USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 929 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 113 GLN : amide:sc= 1.38 K(o=3.7,f=-4.7!) USER MOD Set 1.2: A 117 LYS NZ :NH3+ -138:sc= 2.34 (180deg=-0.159) USER MOD Set 2.1: A 8 TYR OH : rot 180:sc= 1.04 USER MOD Set 2.2: A 74 TYR OH : rot 4:sc= 1.23 USER MOD Set 3.1: A 61 SER OG : rot 83:sc= 0.921 USER MOD Set 3.2: A 64 THR OG1 : rot 111:sc= 1.29 USER MOD Set 4.1: A 25 TYR OH : rot -121:sc= -0.16! USER MOD Set 4.2: A 34 CYS SG : rot -160:sc= 0.898 USER MOD Set 4.3: A 37 MET CE :methyl 149:sc= -2.75! (180deg=-4.05) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.0116 K(o=-0.012,f=-1.7) USER MOD Single : A 18 HIS :FLIP no HE2:sc= 0.194 F(o=-1,f=0.19) USER MOD Single : A 21 MET CE :methyl -128:sc= -0.625 (180deg=-3.24!) USER MOD Single : A 23 MET CE :methyl -152:sc= -0.552 (180deg=-1.09) USER MOD Single : A 27 HIS :FLIP no HD1:sc= -0.374 F(o=-1.2,f=-0.37) USER MOD Single : A 28 SER OG : rot 39:sc= 1.25 USER MOD Single : A 30 HIS : no HD1:sc= -0.65 K(o=-0.65,f=-1.9) USER MOD Single : A 31 CYS SG : rot -87:sc= 0.764 USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0.618 K(o=0.62,f=-1.5) USER MOD Single : A 36 GLN : amide:sc= -0.0323 X(o=-0.032,f=-0.43) USER MOD Single : A 38 ASN : amide:sc= -0.0444 X(o=-0.044,f=0.15) USER MOD Single : A 39 THR OG1 : rot 89:sc= 1.22 USER MOD Single : A 43 SER OG : rot -30:sc= 0.351 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 41:sc= 0.322 USER MOD Single : A 68 GLN : amide:sc= -0.191 K(o=-0.19,f=-2.8!) USER MOD Single : A 79 THR OG1 : rot 78:sc= 0 USER MOD Single : A 81 THR OG1 : rot -140:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ -164:sc= 0.608 (180deg=-0.569!) USER MOD Single : A 101 SER OG : rot 180:sc= -0.284 USER MOD Single : A 109 LYS NZ :NH3+ -167:sc= 0.798 (180deg=0.129) USER MOD Single : A 115 CYS SG : rot -22:sc= 1.38 USER MOD ----------------------------------------------------------------- ATOM 31 N LEU A 3 -86.181 13.246 -71.373 1.00 0.00 N ATOM 32 CA LEU A 3 -84.936 13.155 -72.121 1.00 0.00 C ATOM 33 C LEU A 3 -84.109 11.962 -71.657 1.00 0.00 C ATOM 34 O LEU A 3 -83.787 11.827 -70.474 1.00 0.00 O ATOM 35 CB LEU A 3 -84.140 14.456 -71.995 1.00 0.00 C ATOM 36 CG LEU A 3 -83.003 14.615 -73.005 1.00 0.00 C ATOM 37 CD1 LEU A 3 -83.515 14.386 -74.418 1.00 0.00 C ATOM 38 CD2 LEU A 3 -82.380 15.998 -72.893 1.00 0.00 C ATOM 0 HA LEU A 3 -85.178 13.003 -73.173 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -84.825 15.296 -72.106 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -83.724 14.514 -70.989 1.00 0.00 H new ATOM 0 HG LEU A 3 -82.239 13.870 -72.783 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -82.694 14.503 -75.126 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -83.923 13.378 -74.498 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -84.295 15.113 -74.644 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -81.573 16.093 -73.619 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -83.138 16.756 -73.092 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -81.982 16.138 -71.888 1.00 0.00 H new ATOM 50 N ARG A 4 -83.782 11.094 -72.600 1.00 0.00 N ATOM 51 CA ARG A 4 -83.126 9.839 -72.290 1.00 0.00 C ATOM 52 C ARG A 4 -81.606 9.978 -72.322 1.00 0.00 C ATOM 53 O ARG A 4 -80.991 10.038 -73.392 1.00 0.00 O ATOM 54 CB ARG A 4 -83.600 8.770 -73.277 1.00 0.00 C ATOM 55 CG ARG A 4 -83.159 7.356 -72.939 1.00 0.00 C ATOM 56 CD ARG A 4 -83.593 6.941 -71.540 1.00 0.00 C ATOM 57 NE ARG A 4 -82.558 7.214 -70.537 1.00 0.00 N ATOM 58 CZ ARG A 4 -82.670 6.914 -69.242 1.00 0.00 C ATOM 59 NH1 ARG A 4 -83.788 6.368 -68.778 1.00 0.00 N ATOM 60 NH2 ARG A 4 -81.658 7.157 -68.417 1.00 0.00 N ATOM 0 H ARG A 4 -83.963 11.239 -73.593 1.00 0.00 H new ATOM 0 HA ARG A 4 -83.395 9.542 -71.276 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -84.689 8.795 -73.324 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -83.232 9.023 -74.271 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -83.576 6.662 -73.669 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -82.074 7.286 -73.017 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -84.506 7.472 -71.272 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -83.830 5.877 -71.535 1.00 0.00 H new ATOM 0 HE ARG A 4 -81.697 7.662 -70.850 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -84.564 6.177 -69.412 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -83.871 6.140 -67.787 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -80.797 7.572 -68.774 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -81.741 6.928 -67.426 1.00 0.00 H new ATOM 74 N TRP A 5 -81.014 10.028 -71.132 1.00 0.00 N ATOM 75 CA TRP A 5 -79.565 10.100 -70.983 1.00 0.00 C ATOM 76 C TRP A 5 -78.993 8.721 -70.663 1.00 0.00 C ATOM 77 O TRP A 5 -79.494 8.027 -69.776 1.00 0.00 O ATOM 78 CB TRP A 5 -79.180 11.068 -69.854 1.00 0.00 C ATOM 79 CG TRP A 5 -79.655 12.480 -70.050 1.00 0.00 C ATOM 80 CD1 TRP A 5 -80.932 12.945 -69.918 1.00 0.00 C ATOM 81 CD2 TRP A 5 -78.850 13.617 -70.388 1.00 0.00 C ATOM 82 NE1 TRP A 5 -80.973 14.294 -70.164 1.00 0.00 N ATOM 83 CE2 TRP A 5 -79.708 14.730 -70.454 1.00 0.00 C ATOM 84 CE3 TRP A 5 -77.487 13.801 -70.645 1.00 0.00 C ATOM 85 CZ2 TRP A 5 -79.249 16.008 -70.766 1.00 0.00 C ATOM 86 CZ3 TRP A 5 -77.034 15.071 -70.955 1.00 0.00 C ATOM 87 CH2 TRP A 5 -77.913 16.159 -71.011 1.00 0.00 C ATOM 0 H TRP A 5 -81.523 10.020 -70.248 1.00 0.00 H new ATOM 0 HA TRP A 5 -79.153 10.461 -71.925 1.00 0.00 H new ATOM 0 HB2 TRP A 5 -79.585 10.690 -68.915 1.00 0.00 H new ATOM 0 HB3 TRP A 5 -78.095 11.075 -69.753 1.00 0.00 H new ATOM 0 HD1 TRP A 5 -81.787 12.338 -69.657 1.00 0.00 H new ATOM 0 HE1 TRP A 5 -81.809 14.877 -70.136 1.00 0.00 H new ATOM 0 HE3 TRP A 5 -76.802 12.967 -70.602 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 -79.925 16.849 -70.813 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 -75.984 15.226 -71.157 1.00 0.00 H new ATOM 0 HH2 TRP A 5 -77.527 17.138 -71.253 1.00 0.00 H new ATOM 98 N TYR A 6 -77.974 8.322 -71.405 1.00 0.00 N ATOM 99 CA TYR A 6 -77.211 7.113 -71.107 1.00 0.00 C ATOM 100 C TYR A 6 -75.719 7.414 -71.144 1.00 0.00 C ATOM 101 O TYR A 6 -75.318 8.475 -71.615 1.00 0.00 O ATOM 102 CB TYR A 6 -77.523 5.998 -72.106 1.00 0.00 C ATOM 103 CG TYR A 6 -78.798 5.251 -71.820 1.00 0.00 C ATOM 104 CD1 TYR A 6 -78.842 4.276 -70.831 1.00 0.00 C ATOM 105 CD2 TYR A 6 -79.953 5.516 -72.533 1.00 0.00 C ATOM 106 CE1 TYR A 6 -80.005 3.582 -70.565 1.00 0.00 C ATOM 107 CE2 TYR A 6 -81.120 4.824 -72.275 1.00 0.00 C ATOM 108 CZ TYR A 6 -81.141 3.861 -71.290 1.00 0.00 C ATOM 109 OH TYR A 6 -82.306 3.178 -71.029 1.00 0.00 O ATOM 0 H TYR A 6 -77.649 8.824 -72.231 1.00 0.00 H new ATOM 0 HA TYR A 6 -77.498 6.778 -70.110 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -77.584 6.428 -73.106 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -76.694 5.290 -72.113 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -77.951 4.058 -70.261 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -79.942 6.274 -73.302 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -80.023 2.826 -69.794 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -82.013 5.037 -72.844 1.00 0.00 H new ATOM 0 HH TYR A 6 -83.013 3.496 -71.628 1.00 0.00 H new ATOM 119 N PRO A 7 -74.870 6.498 -70.641 1.00 0.00 N ATOM 120 CA PRO A 7 -73.420 6.638 -70.762 1.00 0.00 C ATOM 121 C PRO A 7 -72.977 6.490 -72.212 1.00 0.00 C ATOM 122 O PRO A 7 -73.724 5.966 -73.037 1.00 0.00 O ATOM 123 CB PRO A 7 -72.856 5.491 -69.914 1.00 0.00 C ATOM 124 CG PRO A 7 -74.006 4.971 -69.118 1.00 0.00 C ATOM 125 CD PRO A 7 -75.241 5.273 -69.916 1.00 0.00 C ATOM 0 HA PRO A 7 -73.073 7.617 -70.433 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -72.432 4.710 -70.545 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -72.056 5.843 -69.262 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -73.907 3.899 -68.946 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -74.049 5.449 -68.139 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -75.491 4.460 -70.597 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -76.108 5.430 -69.275 1.00 0.00 H new ATOM 133 N TYR A 8 -71.759 6.933 -72.510 1.00 0.00 N ATOM 134 CA TYR A 8 -71.222 6.891 -73.875 1.00 0.00 C ATOM 135 C TYR A 8 -71.428 5.524 -74.559 1.00 0.00 C ATOM 136 O TYR A 8 -71.984 5.475 -75.656 1.00 0.00 O ATOM 137 CB TYR A 8 -69.735 7.281 -73.869 1.00 0.00 C ATOM 138 CG TYR A 8 -69.051 7.154 -75.213 1.00 0.00 C ATOM 139 CD1 TYR A 8 -69.217 8.117 -76.200 1.00 0.00 C ATOM 140 CD2 TYR A 8 -68.226 6.072 -75.484 1.00 0.00 C ATOM 141 CE1 TYR A 8 -68.580 8.002 -77.421 1.00 0.00 C ATOM 142 CE2 TYR A 8 -67.586 5.949 -76.701 1.00 0.00 C ATOM 143 CZ TYR A 8 -67.766 6.915 -77.667 1.00 0.00 C ATOM 144 OH TYR A 8 -67.129 6.793 -78.880 1.00 0.00 O ATOM 0 H TYR A 8 -71.118 7.329 -71.822 1.00 0.00 H new ATOM 0 HA TYR A 8 -71.784 7.616 -74.464 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -69.643 8.311 -73.524 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -69.210 6.655 -73.147 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -69.854 8.969 -76.010 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -68.082 5.313 -74.730 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -68.718 8.759 -78.179 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -66.947 5.100 -76.895 1.00 0.00 H new ATOM 0 HH TYR A 8 -66.594 5.972 -78.888 1.00 0.00 H new ATOM 154 N PRO A 9 -71.009 4.396 -73.934 1.00 0.00 N ATOM 155 CA PRO A 9 -71.162 3.065 -74.543 1.00 0.00 C ATOM 156 C PRO A 9 -72.614 2.728 -74.881 1.00 0.00 C ATOM 157 O PRO A 9 -72.916 2.321 -76.004 1.00 0.00 O ATOM 158 CB PRO A 9 -70.631 2.111 -73.469 1.00 0.00 C ATOM 159 CG PRO A 9 -69.730 2.949 -72.633 1.00 0.00 C ATOM 160 CD PRO A 9 -70.350 4.313 -72.616 1.00 0.00 C ATOM 0 HA PRO A 9 -70.631 3.000 -75.493 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -71.443 1.690 -72.876 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -70.094 1.273 -73.914 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -69.643 2.545 -71.624 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -68.724 2.981 -73.051 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -71.065 4.421 -71.800 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -69.601 5.095 -72.489 1.00 0.00 H new ATOM 168 N GLU A 10 -73.507 2.916 -73.913 1.00 0.00 N ATOM 169 CA GLU A 10 -74.916 2.581 -74.099 1.00 0.00 C ATOM 170 C GLU A 10 -75.537 3.494 -75.152 1.00 0.00 C ATOM 171 O GLU A 10 -76.265 3.037 -76.021 1.00 0.00 O ATOM 172 CB GLU A 10 -75.671 2.705 -72.769 1.00 0.00 C ATOM 173 CG GLU A 10 -76.804 1.698 -72.594 1.00 0.00 C ATOM 174 CD GLU A 10 -77.856 1.766 -73.689 1.00 0.00 C ATOM 175 OE1 GLU A 10 -78.689 2.693 -73.659 1.00 0.00 O ATOM 176 OE2 GLU A 10 -77.845 0.889 -74.578 1.00 0.00 O ATOM 0 H GLU A 10 -73.281 3.297 -72.994 1.00 0.00 H new ATOM 0 HA GLU A 10 -74.991 1.550 -74.444 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -74.962 2.583 -71.950 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -76.080 3.712 -72.689 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -76.384 0.693 -72.568 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -77.284 1.868 -71.630 1.00 0.00 H new ATOM 183 N ALA A 11 -75.211 4.780 -75.089 1.00 0.00 N ATOM 184 CA ALA A 11 -75.757 5.755 -76.025 1.00 0.00 C ATOM 185 C ALA A 11 -75.493 5.351 -77.471 1.00 0.00 C ATOM 186 O ALA A 11 -76.369 5.471 -78.330 1.00 0.00 O ATOM 187 CB ALA A 11 -75.181 7.131 -75.753 1.00 0.00 C ATOM 0 H ALA A 11 -74.571 5.172 -74.399 1.00 0.00 H new ATOM 0 HA ALA A 11 -76.836 5.786 -75.877 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -75.599 7.847 -76.461 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -75.432 7.436 -74.737 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -74.097 7.100 -75.865 1.00 0.00 H new ATOM 193 N LEU A 12 -74.286 4.867 -77.734 1.00 0.00 N ATOM 194 CA LEU A 12 -73.929 4.407 -79.068 1.00 0.00 C ATOM 195 C LEU A 12 -74.677 3.126 -79.421 1.00 0.00 C ATOM 196 O LEU A 12 -75.117 2.951 -80.554 1.00 0.00 O ATOM 197 CB LEU A 12 -72.417 4.184 -79.189 1.00 0.00 C ATOM 198 CG LEU A 12 -71.609 5.405 -79.641 1.00 0.00 C ATOM 199 CD1 LEU A 12 -71.688 6.531 -78.621 1.00 0.00 C ATOM 200 CD2 LEU A 12 -70.162 5.021 -79.901 1.00 0.00 C ATOM 0 H LEU A 12 -73.540 4.783 -77.043 1.00 0.00 H new ATOM 0 HA LEU A 12 -74.220 5.186 -79.773 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -72.036 3.855 -78.222 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -72.242 3.371 -79.894 1.00 0.00 H new ATOM 0 HG LEU A 12 -72.046 5.767 -80.571 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -71.104 7.382 -78.972 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -72.727 6.833 -78.492 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -71.289 6.186 -77.667 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -69.604 5.901 -80.221 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -69.721 4.624 -78.987 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -70.122 4.262 -80.682 1.00 0.00 H new ATOM 212 N ALA A 13 -74.849 2.249 -78.441 1.00 0.00 N ATOM 213 CA ALA A 13 -75.508 0.972 -78.675 1.00 0.00 C ATOM 214 C ALA A 13 -77.003 1.169 -78.876 1.00 0.00 C ATOM 215 O ALA A 13 -77.596 0.579 -79.778 1.00 0.00 O ATOM 216 CB ALA A 13 -75.241 0.014 -77.525 1.00 0.00 C ATOM 0 H ALA A 13 -74.542 2.398 -77.480 1.00 0.00 H new ATOM 0 HA ALA A 13 -75.097 0.535 -79.585 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -75.742 -0.935 -77.718 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -74.168 -0.154 -77.433 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -75.622 0.443 -76.598 1.00 0.00 H new ATOM 222 N LEU A 14 -77.606 2.008 -78.041 1.00 0.00 N ATOM 223 CA LEU A 14 -79.020 2.313 -78.161 1.00 0.00 C ATOM 224 C LEU A 14 -79.305 2.925 -79.524 1.00 0.00 C ATOM 225 O LEU A 14 -80.257 2.545 -80.201 1.00 0.00 O ATOM 226 CB LEU A 14 -79.477 3.286 -77.073 1.00 0.00 C ATOM 227 CG LEU A 14 -80.959 3.171 -76.711 1.00 0.00 C ATOM 228 CD1 LEU A 14 -81.223 1.871 -75.966 1.00 0.00 C ATOM 229 CD2 LEU A 14 -81.415 4.356 -75.884 1.00 0.00 C ATOM 0 H LEU A 14 -77.134 2.487 -77.274 1.00 0.00 H new ATOM 0 HA LEU A 14 -79.570 1.379 -78.046 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -78.881 3.116 -76.176 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -79.273 4.305 -77.403 1.00 0.00 H new ATOM 0 HG LEU A 14 -81.532 3.168 -77.638 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -82.282 1.804 -75.715 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -80.945 1.027 -76.597 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -80.631 1.850 -75.051 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -82.472 4.246 -75.642 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -80.835 4.401 -74.962 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -81.266 5.275 -76.452 1.00 0.00 H new ATOM 241 N ALA A 15 -78.471 3.871 -79.927 1.00 0.00 N ATOM 242 CA ALA A 15 -78.628 4.514 -81.219 1.00 0.00 C ATOM 243 C ALA A 15 -78.458 3.505 -82.346 1.00 0.00 C ATOM 244 O ALA A 15 -79.279 3.433 -83.253 1.00 0.00 O ATOM 245 CB ALA A 15 -77.634 5.649 -81.374 1.00 0.00 C ATOM 0 H ALA A 15 -77.680 4.209 -79.378 1.00 0.00 H new ATOM 0 HA ALA A 15 -79.636 4.926 -81.274 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -77.767 6.119 -82.349 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -77.800 6.387 -80.590 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -76.620 5.258 -81.295 1.00 0.00 H new ATOM 251 N GLN A 16 -77.403 2.714 -82.255 1.00 0.00 N ATOM 252 CA GLN A 16 -77.082 1.724 -83.274 1.00 0.00 C ATOM 253 C GLN A 16 -78.164 0.649 -83.392 1.00 0.00 C ATOM 254 O GLN A 16 -78.560 0.276 -84.494 1.00 0.00 O ATOM 255 CB GLN A 16 -75.720 1.099 -82.950 1.00 0.00 C ATOM 256 CG GLN A 16 -75.389 -0.149 -83.748 1.00 0.00 C ATOM 257 CD GLN A 16 -73.952 -0.597 -83.563 1.00 0.00 C ATOM 258 OE1 GLN A 16 -73.057 0.215 -83.341 1.00 0.00 O ATOM 259 NE2 GLN A 16 -73.723 -1.896 -83.654 1.00 0.00 N ATOM 0 H GLN A 16 -76.745 2.738 -81.476 1.00 0.00 H new ATOM 0 HA GLN A 16 -77.036 2.224 -84.242 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -74.943 1.843 -83.126 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -75.692 0.853 -81.888 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -76.058 -0.955 -83.448 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -75.573 0.041 -84.805 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -74.494 -2.538 -83.840 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -72.776 -2.256 -83.539 1.00 0.00 H new ATOM 268 N ALA A 17 -78.655 0.174 -82.259 1.00 0.00 N ATOM 269 CA ALA A 17 -79.629 -0.910 -82.243 1.00 0.00 C ATOM 270 C ALA A 17 -81.049 -0.410 -82.492 1.00 0.00 C ATOM 271 O ALA A 17 -81.951 -1.201 -82.753 1.00 0.00 O ATOM 272 CB ALA A 17 -79.559 -1.670 -80.926 1.00 0.00 C ATOM 0 H ALA A 17 -78.396 0.521 -81.336 1.00 0.00 H new ATOM 0 HA ALA A 17 -79.374 -1.586 -83.059 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -80.293 -2.476 -80.931 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -78.561 -2.089 -80.801 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -79.773 -0.990 -80.102 1.00 0.00 H new ATOM 278 N HIS A 18 -81.260 0.896 -82.388 1.00 0.00 N ATOM 279 CA HIS A 18 -82.606 1.449 -82.549 1.00 0.00 C ATOM 280 C HIS A 18 -82.679 2.412 -83.730 1.00 0.00 C ATOM 281 O HIS A 18 -83.699 3.071 -83.935 1.00 0.00 O ATOM 282 CB HIS A 18 -83.072 2.158 -81.270 1.00 0.00 C ATOM 283 CG HIS A 18 -83.247 1.255 -80.083 1.00 0.00 C ATOM 284 ND1 HIS A 18 -82.372 0.878 -79.120 1.00 0.00 N flip ATOM 285 CD2 HIS A 18 -84.443 0.645 -79.765 1.00 0.00 C flip ATOM 286 CE1 HIS A 18 -83.048 0.063 -78.249 1.00 0.00 C flip ATOM 287 NE2 HIS A 18 -84.295 -0.061 -78.658 1.00 0.00 N flip ATOM 0 H HIS A 18 -80.533 1.585 -82.196 1.00 0.00 H new ATOM 0 HA HIS A 18 -83.272 0.610 -82.747 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -82.349 2.934 -81.016 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -84.019 2.658 -81.472 1.00 0.00 H new ATOM 0 HD1 HIS A 18 -81.391 1.150 -79.055 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -85.358 0.731 -80.333 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -82.627 -0.402 -77.370 1.00 0.00 H new ATOM 296 N GLY A 19 -81.596 2.499 -84.495 1.00 0.00 N ATOM 297 CA GLY A 19 -81.569 3.371 -85.660 1.00 0.00 C ATOM 298 C GLY A 19 -81.720 4.839 -85.299 1.00 0.00 C ATOM 299 O GLY A 19 -82.431 5.585 -85.974 1.00 0.00 O ATOM 0 H GLY A 19 -80.733 1.981 -84.330 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -80.630 3.227 -86.194 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -82.370 3.085 -86.341 1.00 0.00 H new ATOM 303 N ARG A 20 -81.086 5.244 -84.208 1.00 0.00 N ATOM 304 CA ARG A 20 -81.110 6.630 -83.764 1.00 0.00 C ATOM 305 C ARG A 20 -79.734 7.266 -83.941 1.00 0.00 C ATOM 306 O ARG A 20 -78.798 6.612 -84.396 1.00 0.00 O ATOM 307 CB ARG A 20 -81.507 6.682 -82.292 1.00 0.00 C ATOM 308 CG ARG A 20 -82.730 5.845 -81.960 1.00 0.00 C ATOM 309 CD ARG A 20 -84.024 6.490 -82.441 1.00 0.00 C ATOM 310 NE ARG A 20 -84.207 6.355 -83.887 1.00 0.00 N ATOM 311 CZ ARG A 20 -85.322 6.688 -84.534 1.00 0.00 C ATOM 312 NH1 ARG A 20 -86.340 7.237 -83.881 1.00 0.00 N ATOM 313 NH2 ARG A 20 -85.408 6.484 -85.844 1.00 0.00 N ATOM 0 H ARG A 20 -80.542 4.624 -83.608 1.00 0.00 H new ATOM 0 HA ARG A 20 -81.834 7.182 -84.363 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -80.668 6.340 -81.686 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -81.700 7.718 -82.013 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -82.627 4.860 -82.415 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -82.782 5.694 -80.882 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -84.869 6.033 -81.926 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -84.022 7.547 -82.174 1.00 0.00 H new ATOM 0 HE ARG A 20 -83.431 5.982 -84.434 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -86.271 7.406 -82.877 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -87.191 7.490 -84.383 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -84.622 6.074 -86.349 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -86.260 6.737 -86.345 1.00 0.00 H new ATOM 327 N MET A 21 -79.612 8.534 -83.574 1.00 0.00 N ATOM 328 CA MET A 21 -78.325 9.214 -83.599 1.00 0.00 C ATOM 329 C MET A 21 -77.849 9.493 -82.181 1.00 0.00 C ATOM 330 O MET A 21 -78.646 9.497 -81.242 1.00 0.00 O ATOM 331 CB MET A 21 -78.402 10.512 -84.406 1.00 0.00 C ATOM 332 CG MET A 21 -78.621 10.277 -85.893 1.00 0.00 C ATOM 333 SD MET A 21 -78.182 11.697 -86.918 1.00 0.00 S ATOM 334 CE MET A 21 -79.243 12.973 -86.255 1.00 0.00 C ATOM 0 H MET A 21 -80.389 9.113 -83.255 1.00 0.00 H new ATOM 0 HA MET A 21 -77.604 8.559 -84.088 1.00 0.00 H new ATOM 0 HB2 MET A 21 -79.214 11.127 -84.018 1.00 0.00 H new ATOM 0 HB3 MET A 21 -77.480 11.076 -84.265 1.00 0.00 H new ATOM 0 HG2 MET A 21 -78.032 9.416 -86.207 1.00 0.00 H new ATOM 0 HG3 MET A 21 -79.668 10.026 -86.063 1.00 0.00 H new ATOM 0 HE1 MET A 21 -79.800 13.442 -87.067 1.00 0.00 H new ATOM 0 HE2 MET A 21 -79.941 12.532 -85.543 1.00 0.00 H new ATOM 0 HE3 MET A 21 -78.636 13.725 -85.750 1.00 0.00 H new ATOM 344 N VAL A 22 -76.555 9.727 -82.024 1.00 0.00 N ATOM 345 CA VAL A 22 -75.970 9.894 -80.702 1.00 0.00 C ATOM 346 C VAL A 22 -75.627 11.351 -80.423 1.00 0.00 C ATOM 347 O VAL A 22 -74.946 11.999 -81.218 1.00 0.00 O ATOM 348 CB VAL A 22 -74.683 9.053 -80.544 1.00 0.00 C ATOM 349 CG1 VAL A 22 -74.063 9.259 -79.172 1.00 0.00 C ATOM 350 CG2 VAL A 22 -74.966 7.582 -80.777 1.00 0.00 C ATOM 0 H VAL A 22 -75.891 9.805 -82.794 1.00 0.00 H new ATOM 0 HA VAL A 22 -76.721 9.553 -79.989 1.00 0.00 H new ATOM 0 HB VAL A 22 -73.971 9.391 -81.297 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -73.159 8.656 -79.087 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -73.811 10.311 -79.041 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -74.774 8.958 -78.403 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -74.045 7.011 -80.660 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -75.703 7.234 -80.053 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -75.354 7.442 -81.786 1.00 0.00 H new ATOM 360 N MET A 23 -76.099 11.857 -79.294 1.00 0.00 N ATOM 361 CA MET A 23 -75.697 13.172 -78.826 1.00 0.00 C ATOM 362 C MET A 23 -74.736 13.015 -77.660 1.00 0.00 C ATOM 363 O MET A 23 -75.151 12.709 -76.547 1.00 0.00 O ATOM 364 CB MET A 23 -76.913 13.995 -78.384 1.00 0.00 C ATOM 365 CG MET A 23 -76.544 15.330 -77.749 1.00 0.00 C ATOM 366 SD MET A 23 -77.973 16.211 -77.092 1.00 0.00 S ATOM 367 CE MET A 23 -77.177 17.617 -76.321 1.00 0.00 C ATOM 0 H MET A 23 -76.761 11.376 -78.685 1.00 0.00 H new ATOM 0 HA MET A 23 -75.209 13.699 -79.646 1.00 0.00 H new ATOM 0 HB2 MET A 23 -77.552 14.177 -79.248 1.00 0.00 H new ATOM 0 HB3 MET A 23 -77.497 13.412 -77.672 1.00 0.00 H new ATOM 0 HG2 MET A 23 -75.828 15.159 -76.945 1.00 0.00 H new ATOM 0 HG3 MET A 23 -76.047 15.955 -78.491 1.00 0.00 H new ATOM 0 HE1 MET A 23 -77.788 17.970 -75.490 1.00 0.00 H new ATOM 0 HE2 MET A 23 -76.196 17.321 -75.950 1.00 0.00 H new ATOM 0 HE3 MET A 23 -77.063 18.417 -77.053 1.00 0.00 H new ATOM 377 N VAL A 24 -73.455 13.210 -77.915 1.00 0.00 N ATOM 378 CA VAL A 24 -72.456 13.105 -76.867 1.00 0.00 C ATOM 379 C VAL A 24 -72.315 14.443 -76.156 1.00 0.00 C ATOM 380 O VAL A 24 -71.788 15.405 -76.721 1.00 0.00 O ATOM 381 CB VAL A 24 -71.084 12.660 -77.424 1.00 0.00 C ATOM 382 CG1 VAL A 24 -70.089 12.449 -76.298 1.00 0.00 C ATOM 383 CG2 VAL A 24 -71.220 11.391 -78.253 1.00 0.00 C ATOM 0 H VAL A 24 -73.083 13.441 -78.836 1.00 0.00 H new ATOM 0 HA VAL A 24 -72.791 12.344 -76.162 1.00 0.00 H new ATOM 0 HB VAL A 24 -70.712 13.455 -78.071 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -69.131 12.136 -76.713 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -69.959 13.381 -75.748 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -70.461 11.678 -75.623 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -70.241 11.098 -78.634 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -71.621 10.591 -77.631 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -71.895 11.573 -79.089 1.00 0.00 H new ATOM 393 N TYR A 25 -72.817 14.508 -74.931 1.00 0.00 N ATOM 394 CA TYR A 25 -72.784 15.737 -74.157 1.00 0.00 C ATOM 395 C TYR A 25 -71.623 15.712 -73.174 1.00 0.00 C ATOM 396 O TYR A 25 -71.679 15.034 -72.144 1.00 0.00 O ATOM 397 CB TYR A 25 -74.108 15.926 -73.411 1.00 0.00 C ATOM 398 CG TYR A 25 -74.239 17.267 -72.719 1.00 0.00 C ATOM 399 CD1 TYR A 25 -74.612 18.395 -73.433 1.00 0.00 C ATOM 400 CD2 TYR A 25 -73.996 17.404 -71.356 1.00 0.00 C ATOM 401 CE1 TYR A 25 -74.742 19.621 -72.813 1.00 0.00 C ATOM 402 CE2 TYR A 25 -74.124 18.631 -70.730 1.00 0.00 C ATOM 403 CZ TYR A 25 -74.498 19.735 -71.466 1.00 0.00 C ATOM 404 OH TYR A 25 -74.630 20.961 -70.854 1.00 0.00 O ATOM 0 H TYR A 25 -73.253 13.720 -74.452 1.00 0.00 H new ATOM 0 HA TYR A 25 -72.643 16.576 -74.839 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -74.931 15.811 -74.117 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -74.212 15.134 -72.669 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -74.804 18.313 -74.493 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -73.703 16.540 -70.778 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -75.035 20.489 -73.385 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -73.932 18.723 -69.671 1.00 0.00 H new ATOM 0 HH TYR A 25 -73.779 21.213 -70.438 1.00 0.00 H new ATOM 414 N PHE A 26 -70.570 16.439 -73.502 1.00 0.00 N ATOM 415 CA PHE A 26 -69.419 16.550 -72.626 1.00 0.00 C ATOM 416 C PHE A 26 -69.668 17.609 -71.565 1.00 0.00 C ATOM 417 O PHE A 26 -69.824 18.792 -71.889 1.00 0.00 O ATOM 418 CB PHE A 26 -68.158 16.923 -73.412 1.00 0.00 C ATOM 419 CG PHE A 26 -67.638 15.840 -74.315 1.00 0.00 C ATOM 420 CD1 PHE A 26 -68.071 15.741 -75.627 1.00 0.00 C ATOM 421 CD2 PHE A 26 -66.702 14.930 -73.854 1.00 0.00 C ATOM 422 CE1 PHE A 26 -67.580 14.756 -76.461 1.00 0.00 C ATOM 423 CE2 PHE A 26 -66.210 13.940 -74.682 1.00 0.00 C ATOM 424 CZ PHE A 26 -66.650 13.853 -75.988 1.00 0.00 C ATOM 0 H PHE A 26 -70.489 16.963 -74.373 1.00 0.00 H new ATOM 0 HA PHE A 26 -69.268 15.579 -72.155 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -68.369 17.808 -74.013 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -67.374 17.196 -72.706 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -68.801 16.443 -76.002 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -66.352 14.995 -72.834 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -67.924 14.692 -77.483 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -65.482 13.235 -74.309 1.00 0.00 H new ATOM 0 HZ PHE A 26 -66.267 13.080 -76.638 1.00 0.00 H new ATOM 434 N HIS A 27 -69.730 17.181 -70.307 1.00 0.00 N ATOM 435 CA HIS A 27 -69.797 18.117 -69.195 1.00 0.00 C ATOM 436 C HIS A 27 -68.645 17.859 -68.236 1.00 0.00 C ATOM 437 O HIS A 27 -68.313 16.711 -67.946 1.00 0.00 O ATOM 438 CB HIS A 27 -71.150 18.059 -68.458 1.00 0.00 C ATOM 439 CG HIS A 27 -71.432 16.780 -67.722 1.00 0.00 C ATOM 440 ND1 HIS A 27 -72.137 15.686 -68.091 1.00 0.00 N flip ATOM 441 CD2 HIS A 27 -71.006 16.538 -66.430 1.00 0.00 C flip ATOM 442 CE1 HIS A 27 -72.127 14.814 -67.028 1.00 0.00 C flip ATOM 443 NE2 HIS A 27 -71.438 15.356 -66.041 1.00 0.00 N flip ATOM 0 H HIS A 27 -69.735 16.198 -70.036 1.00 0.00 H new ATOM 0 HA HIS A 27 -69.709 19.124 -69.603 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -71.192 18.884 -67.747 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -71.946 18.223 -69.184 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -70.411 17.213 -65.832 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -72.604 13.845 -67.004 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -71.268 14.931 -65.130 1.00 0.00 H new ATOM 452 N SER A 28 -68.053 18.931 -67.750 1.00 0.00 N ATOM 453 CA SER A 28 -66.884 18.854 -66.893 1.00 0.00 C ATOM 454 C SER A 28 -67.200 19.448 -65.530 1.00 0.00 C ATOM 455 O SER A 28 -68.181 20.174 -65.374 1.00 0.00 O ATOM 456 CB SER A 28 -65.721 19.613 -67.558 1.00 0.00 C ATOM 457 OG SER A 28 -64.608 19.774 -66.687 1.00 0.00 O ATOM 0 H SER A 28 -68.368 19.883 -67.938 1.00 0.00 H new ATOM 0 HA SER A 28 -66.597 17.812 -66.753 1.00 0.00 H new ATOM 0 HB2 SER A 28 -65.404 19.075 -68.452 1.00 0.00 H new ATOM 0 HB3 SER A 28 -66.069 20.594 -67.882 1.00 0.00 H new ATOM 0 HG SER A 28 -64.485 18.958 -66.159 1.00 0.00 H new ATOM 463 N GLU A 29 -66.358 19.149 -64.555 1.00 0.00 N ATOM 464 CA GLU A 29 -66.470 19.720 -63.229 1.00 0.00 C ATOM 465 C GLU A 29 -65.948 21.160 -63.246 1.00 0.00 C ATOM 466 O GLU A 29 -65.974 21.867 -62.239 1.00 0.00 O ATOM 467 CB GLU A 29 -65.683 18.870 -62.214 1.00 0.00 C ATOM 468 CG GLU A 29 -64.167 19.089 -62.218 1.00 0.00 C ATOM 469 CD GLU A 29 -63.417 18.432 -63.374 1.00 0.00 C ATOM 470 OE1 GLU A 29 -63.944 18.393 -64.507 1.00 0.00 O ATOM 471 OE2 GLU A 29 -62.257 18.022 -63.159 1.00 0.00 O ATOM 0 H GLU A 29 -65.577 18.502 -64.664 1.00 0.00 H new ATOM 0 HA GLU A 29 -67.517 19.727 -62.927 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -66.062 19.083 -61.214 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -65.883 17.817 -62.413 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -63.971 20.161 -62.242 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -63.759 18.711 -61.280 1.00 0.00 H new ATOM 478 N HIS A 30 -65.463 21.580 -64.410 1.00 0.00 N ATOM 479 CA HIS A 30 -64.933 22.926 -64.590 1.00 0.00 C ATOM 480 C HIS A 30 -65.832 23.733 -65.518 1.00 0.00 C ATOM 481 O HIS A 30 -65.438 24.788 -66.008 1.00 0.00 O ATOM 482 CB HIS A 30 -63.522 22.872 -65.186 1.00 0.00 C ATOM 483 CG HIS A 30 -62.562 22.031 -64.412 1.00 0.00 C ATOM 484 ND1 HIS A 30 -62.262 22.242 -63.086 1.00 0.00 N ATOM 485 CD2 HIS A 30 -61.854 20.951 -64.789 1.00 0.00 C ATOM 486 CE1 HIS A 30 -61.406 21.321 -62.684 1.00 0.00 C ATOM 487 NE2 HIS A 30 -61.140 20.515 -63.698 1.00 0.00 N ATOM 0 H HIS A 30 -65.426 21.001 -65.249 1.00 0.00 H new ATOM 0 HA HIS A 30 -64.896 23.406 -63.612 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -63.584 22.488 -66.204 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -63.128 23.886 -65.251 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -61.848 20.506 -65.773 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -60.991 21.239 -61.690 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -60.514 19.710 -63.675 1.00 0.00 H new ATOM 496 N CYS A 31 -67.036 23.235 -65.755 1.00 0.00 N ATOM 497 CA CYS A 31 -67.938 23.858 -66.706 1.00 0.00 C ATOM 498 C CYS A 31 -68.588 25.114 -66.121 1.00 0.00 C ATOM 499 O CYS A 31 -69.115 25.092 -65.009 1.00 0.00 O ATOM 500 CB CYS A 31 -69.006 22.857 -67.139 1.00 0.00 C ATOM 501 SG CYS A 31 -70.095 22.289 -65.813 1.00 0.00 S ATOM 0 H CYS A 31 -67.409 22.401 -65.301 1.00 0.00 H new ATOM 0 HA CYS A 31 -67.357 24.163 -67.577 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -69.615 23.312 -67.920 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -68.514 21.991 -67.582 1.00 0.00 H new ATOM 0 HG CYS A 31 -69.555 21.268 -65.216 1.00 0.00 H new ATOM 507 N PRO A 32 -68.543 26.232 -66.863 1.00 0.00 N ATOM 508 CA PRO A 32 -69.118 27.502 -66.414 1.00 0.00 C ATOM 509 C PRO A 32 -70.640 27.591 -66.592 1.00 0.00 C ATOM 510 O PRO A 32 -71.397 27.424 -65.638 1.00 0.00 O ATOM 511 CB PRO A 32 -68.402 28.535 -67.287 1.00 0.00 C ATOM 512 CG PRO A 32 -68.023 27.807 -68.536 1.00 0.00 C ATOM 513 CD PRO A 32 -67.892 26.348 -68.180 1.00 0.00 C ATOM 0 HA PRO A 32 -68.977 27.647 -65.343 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -69.053 29.381 -67.508 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -67.522 28.933 -66.782 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -68.779 27.948 -69.308 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -67.084 28.191 -68.935 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -68.378 25.713 -68.921 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -66.847 26.042 -68.135 1.00 0.00 H new ATOM 521 N TYR A 33 -71.085 27.851 -67.815 1.00 0.00 N ATOM 522 CA TYR A 33 -72.503 28.073 -68.093 1.00 0.00 C ATOM 523 C TYR A 33 -73.238 26.756 -68.338 1.00 0.00 C ATOM 524 O TYR A 33 -74.467 26.698 -68.264 1.00 0.00 O ATOM 525 CB TYR A 33 -72.652 29.021 -69.293 1.00 0.00 C ATOM 526 CG TYR A 33 -74.081 29.251 -69.743 1.00 0.00 C ATOM 527 CD1 TYR A 33 -74.910 30.133 -69.065 1.00 0.00 C ATOM 528 CD2 TYR A 33 -74.594 28.588 -70.850 1.00 0.00 C ATOM 529 CE1 TYR A 33 -76.213 30.345 -69.476 1.00 0.00 C ATOM 530 CE2 TYR A 33 -75.895 28.797 -71.267 1.00 0.00 C ATOM 531 CZ TYR A 33 -76.700 29.674 -70.577 1.00 0.00 C ATOM 532 OH TYR A 33 -77.996 29.880 -70.987 1.00 0.00 O ATOM 0 H TYR A 33 -70.483 27.914 -68.636 1.00 0.00 H new ATOM 0 HA TYR A 33 -72.960 28.535 -67.218 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -72.207 29.982 -69.037 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -72.082 28.618 -70.130 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -74.532 30.662 -68.203 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -73.966 27.898 -71.394 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -76.847 31.034 -68.937 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -76.278 28.274 -72.131 1.00 0.00 H new ATOM 0 HH TYR A 33 -78.180 29.332 -71.778 1.00 0.00 H new ATOM 542 N CYS A 34 -72.473 25.708 -68.620 1.00 0.00 N ATOM 543 CA CYS A 34 -73.025 24.393 -68.945 1.00 0.00 C ATOM 544 C CYS A 34 -74.106 23.960 -67.952 1.00 0.00 C ATOM 545 O CYS A 34 -75.168 23.489 -68.352 1.00 0.00 O ATOM 546 CB CYS A 34 -71.893 23.364 -68.974 1.00 0.00 C ATOM 547 SG CYS A 34 -72.427 21.639 -69.057 1.00 0.00 S ATOM 0 H CYS A 34 -71.454 25.743 -68.631 1.00 0.00 H new ATOM 0 HA CYS A 34 -73.498 24.458 -69.925 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -71.255 23.572 -69.833 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -71.280 23.496 -68.082 1.00 0.00 H new ATOM 0 HG CYS A 34 -71.460 20.866 -68.660 1.00 0.00 H new ATOM 553 N GLN A 35 -73.838 24.161 -66.665 1.00 0.00 N ATOM 554 CA GLN A 35 -74.742 23.727 -65.598 1.00 0.00 C ATOM 555 C GLN A 35 -76.152 24.319 -65.731 1.00 0.00 C ATOM 556 O GLN A 35 -77.139 23.663 -65.399 1.00 0.00 O ATOM 557 CB GLN A 35 -74.139 24.042 -64.223 1.00 0.00 C ATOM 558 CG GLN A 35 -73.448 25.398 -64.114 1.00 0.00 C ATOM 559 CD GLN A 35 -74.405 26.570 -64.007 1.00 0.00 C ATOM 560 OE1 GLN A 35 -75.509 26.449 -63.482 1.00 0.00 O ATOM 561 NE2 GLN A 35 -73.977 27.721 -64.500 1.00 0.00 N ATOM 0 H GLN A 35 -72.994 24.626 -66.331 1.00 0.00 H new ATOM 0 HA GLN A 35 -74.854 22.647 -65.697 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -74.932 23.995 -63.476 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -73.418 23.263 -63.973 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -72.796 25.393 -63.240 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -72.811 25.541 -64.987 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -73.053 27.780 -64.928 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -74.571 28.549 -64.452 1.00 0.00 H new ATOM 570 N GLN A 36 -76.250 25.538 -66.240 1.00 0.00 N ATOM 571 CA GLN A 36 -77.540 26.205 -66.351 1.00 0.00 C ATOM 572 C GLN A 36 -78.265 25.758 -67.614 1.00 0.00 C ATOM 573 O GLN A 36 -79.455 25.426 -67.579 1.00 0.00 O ATOM 574 CB GLN A 36 -77.361 27.725 -66.347 1.00 0.00 C ATOM 575 CG GLN A 36 -78.674 28.491 -66.329 1.00 0.00 C ATOM 576 CD GLN A 36 -78.474 29.989 -66.204 1.00 0.00 C ATOM 577 OE1 GLN A 36 -78.368 30.699 -67.198 1.00 0.00 O ATOM 578 NE2 GLN A 36 -78.423 30.477 -64.973 1.00 0.00 N ATOM 0 H GLN A 36 -75.458 26.083 -66.581 1.00 0.00 H new ATOM 0 HA GLN A 36 -78.146 25.927 -65.488 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -76.771 28.011 -65.476 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -76.791 28.018 -67.229 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -79.228 28.277 -67.243 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -79.284 28.139 -65.497 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -78.516 29.852 -64.172 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -78.291 31.478 -64.826 1.00 0.00 H new ATOM 587 N MET A 37 -77.538 25.730 -68.723 1.00 0.00 N ATOM 588 CA MET A 37 -78.115 25.351 -70.006 1.00 0.00 C ATOM 589 C MET A 37 -78.549 23.890 -69.981 1.00 0.00 C ATOM 590 O MET A 37 -79.619 23.548 -70.470 1.00 0.00 O ATOM 591 CB MET A 37 -77.110 25.594 -71.137 1.00 0.00 C ATOM 592 CG MET A 37 -77.710 25.506 -72.530 1.00 0.00 C ATOM 593 SD MET A 37 -77.475 23.888 -73.282 1.00 0.00 S ATOM 594 CE MET A 37 -75.689 23.848 -73.389 1.00 0.00 C ATOM 0 H MET A 37 -76.546 25.966 -68.760 1.00 0.00 H new ATOM 0 HA MET A 37 -78.994 25.969 -70.188 1.00 0.00 H new ATOM 0 HB2 MET A 37 -76.664 26.580 -71.007 1.00 0.00 H new ATOM 0 HB3 MET A 37 -76.303 24.866 -71.054 1.00 0.00 H new ATOM 0 HG2 MET A 37 -78.776 25.727 -72.477 1.00 0.00 H new ATOM 0 HG3 MET A 37 -77.258 26.267 -73.165 1.00 0.00 H new ATOM 0 HE1 MET A 37 -75.342 22.819 -73.294 1.00 0.00 H new ATOM 0 HE2 MET A 37 -75.373 24.251 -74.351 1.00 0.00 H new ATOM 0 HE3 MET A 37 -75.263 24.450 -72.586 1.00 0.00 H new ATOM 604 N ASN A 38 -77.721 23.048 -69.374 1.00 0.00 N ATOM 605 CA ASN A 38 -78.003 21.618 -69.262 1.00 0.00 C ATOM 606 C ASN A 38 -79.310 21.367 -68.515 1.00 0.00 C ATOM 607 O ASN A 38 -80.103 20.513 -68.902 1.00 0.00 O ATOM 608 CB ASN A 38 -76.844 20.912 -68.545 1.00 0.00 C ATOM 609 CG ASN A 38 -77.132 19.454 -68.230 1.00 0.00 C ATOM 610 OD1 ASN A 38 -76.903 18.572 -69.053 1.00 0.00 O ATOM 611 ND2 ASN A 38 -77.604 19.191 -67.020 1.00 0.00 N ATOM 0 H ASN A 38 -76.840 23.333 -68.947 1.00 0.00 H new ATOM 0 HA ASN A 38 -78.108 21.213 -70.269 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -75.950 20.973 -69.166 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -76.624 21.440 -67.617 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -77.790 18.227 -66.744 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -77.781 19.953 -66.365 1.00 0.00 H new ATOM 618 N THR A 39 -79.530 22.129 -67.454 1.00 0.00 N ATOM 619 CA THR A 39 -80.689 21.925 -66.601 1.00 0.00 C ATOM 620 C THR A 39 -81.967 22.484 -67.232 1.00 0.00 C ATOM 621 O THR A 39 -82.943 21.762 -67.413 1.00 0.00 O ATOM 622 CB THR A 39 -80.469 22.569 -65.217 1.00 0.00 C ATOM 623 OG1 THR A 39 -79.238 22.094 -64.656 1.00 0.00 O ATOM 624 CG2 THR A 39 -81.618 22.241 -64.273 1.00 0.00 C ATOM 0 H THR A 39 -78.921 22.894 -67.164 1.00 0.00 H new ATOM 0 HA THR A 39 -80.812 20.848 -66.482 1.00 0.00 H new ATOM 0 HB THR A 39 -80.426 23.651 -65.345 1.00 0.00 H new ATOM 0 HG1 THR A 39 -78.503 22.676 -64.941 1.00 0.00 H new ATOM 0 HG21 THR A 39 -81.438 22.707 -63.304 1.00 0.00 H new ATOM 0 HG22 THR A 39 -82.551 22.620 -64.690 1.00 0.00 H new ATOM 0 HG23 THR A 39 -81.689 21.161 -64.148 1.00 0.00 H new ATOM 632 N PHE A 40 -81.962 23.768 -67.567 1.00 0.00 N ATOM 633 CA PHE A 40 -83.169 24.421 -68.064 1.00 0.00 C ATOM 634 C PHE A 40 -83.278 24.330 -69.584 1.00 0.00 C ATOM 635 O PHE A 40 -84.182 23.683 -70.122 1.00 0.00 O ATOM 636 CB PHE A 40 -83.194 25.888 -67.626 1.00 0.00 C ATOM 637 CG PHE A 40 -83.182 26.075 -66.135 1.00 0.00 C ATOM 638 CD1 PHE A 40 -84.354 25.974 -65.403 1.00 0.00 C ATOM 639 CD2 PHE A 40 -81.999 26.349 -65.465 1.00 0.00 C ATOM 640 CE1 PHE A 40 -84.347 26.146 -64.031 1.00 0.00 C ATOM 641 CE2 PHE A 40 -81.987 26.521 -64.093 1.00 0.00 C ATOM 642 CZ PHE A 40 -83.162 26.419 -63.376 1.00 0.00 C ATOM 0 H PHE A 40 -81.144 24.374 -67.505 1.00 0.00 H new ATOM 0 HA PHE A 40 -84.025 23.899 -67.637 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -82.332 26.400 -68.054 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -84.084 26.365 -68.036 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -85.283 25.759 -65.910 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -81.077 26.429 -66.021 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -85.268 26.067 -63.472 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -81.059 26.735 -63.583 1.00 0.00 H new ATOM 0 HZ PHE A 40 -83.155 26.552 -62.304 1.00 0.00 H new ATOM 652 N VAL A 41 -82.334 24.968 -70.265 1.00 0.00 N ATOM 653 CA VAL A 41 -82.373 25.111 -71.717 1.00 0.00 C ATOM 654 C VAL A 41 -82.481 23.767 -72.431 1.00 0.00 C ATOM 655 O VAL A 41 -83.274 23.612 -73.356 1.00 0.00 O ATOM 656 CB VAL A 41 -81.119 25.861 -72.223 1.00 0.00 C ATOM 657 CG1 VAL A 41 -81.049 25.855 -73.743 1.00 0.00 C ATOM 658 CG2 VAL A 41 -81.103 27.286 -71.691 1.00 0.00 C ATOM 0 H VAL A 41 -81.520 25.401 -69.828 1.00 0.00 H new ATOM 0 HA VAL A 41 -83.268 25.687 -71.950 1.00 0.00 H new ATOM 0 HB VAL A 41 -80.239 25.339 -71.847 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -80.157 26.390 -74.068 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -81.006 24.826 -74.101 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -81.934 26.344 -74.150 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -80.214 27.801 -72.056 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -81.994 27.812 -72.034 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -81.090 27.267 -70.601 1.00 0.00 H new ATOM 668 N LEU A 42 -81.700 22.800 -71.985 1.00 0.00 N ATOM 669 CA LEU A 42 -81.598 21.527 -72.675 1.00 0.00 C ATOM 670 C LEU A 42 -82.766 20.607 -72.314 1.00 0.00 C ATOM 671 O LEU A 42 -83.011 19.605 -72.985 1.00 0.00 O ATOM 672 CB LEU A 42 -80.259 20.870 -72.327 1.00 0.00 C ATOM 673 CG LEU A 42 -79.868 19.679 -73.196 1.00 0.00 C ATOM 674 CD1 LEU A 42 -79.809 20.101 -74.651 1.00 0.00 C ATOM 675 CD2 LEU A 42 -78.521 19.127 -72.765 1.00 0.00 C ATOM 0 H LEU A 42 -81.125 22.872 -71.145 1.00 0.00 H new ATOM 0 HA LEU A 42 -81.645 21.703 -73.750 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -79.475 21.623 -72.399 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -80.293 20.544 -71.288 1.00 0.00 H new ATOM 0 HG LEU A 42 -80.620 18.899 -73.077 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -79.529 19.246 -75.267 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -80.787 20.469 -74.963 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -79.069 20.892 -74.771 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -78.257 18.278 -73.395 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -77.761 19.902 -72.864 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -78.576 18.804 -71.725 1.00 0.00 H new ATOM 687 N SER A 43 -83.497 20.958 -71.262 1.00 0.00 N ATOM 688 CA SER A 43 -84.630 20.153 -70.823 1.00 0.00 C ATOM 689 C SER A 43 -85.945 20.762 -71.308 1.00 0.00 C ATOM 690 O SER A 43 -87.015 20.174 -71.127 1.00 0.00 O ATOM 691 CB SER A 43 -84.634 20.017 -69.297 1.00 0.00 C ATOM 692 OG SER A 43 -85.666 19.148 -68.856 1.00 0.00 O ATOM 0 H SER A 43 -83.326 21.791 -70.699 1.00 0.00 H new ATOM 0 HA SER A 43 -84.531 19.159 -71.258 1.00 0.00 H new ATOM 0 HB2 SER A 43 -83.669 19.637 -68.962 1.00 0.00 H new ATOM 0 HB3 SER A 43 -84.765 20.999 -68.843 1.00 0.00 H new ATOM 0 HG SER A 43 -86.419 19.191 -69.481 1.00 0.00 H new ATOM 698 N ASP A 44 -85.854 21.952 -71.900 1.00 0.00 N ATOM 699 CA ASP A 44 -87.008 22.613 -72.519 1.00 0.00 C ATOM 700 C ASP A 44 -87.797 21.655 -73.415 1.00 0.00 C ATOM 701 O ASP A 44 -87.208 20.897 -74.184 1.00 0.00 O ATOM 702 CB ASP A 44 -86.547 23.812 -73.350 1.00 0.00 C ATOM 703 CG ASP A 44 -87.665 24.403 -74.182 1.00 0.00 C ATOM 704 OD1 ASP A 44 -88.458 25.201 -73.636 1.00 0.00 O ATOM 705 OD2 ASP A 44 -87.763 24.070 -75.382 1.00 0.00 O ATOM 0 H ASP A 44 -84.986 22.484 -71.965 1.00 0.00 H new ATOM 0 HA ASP A 44 -87.661 22.947 -71.713 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -86.148 24.579 -72.686 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -85.733 23.504 -74.007 1.00 0.00 H new ATOM 710 N PRO A 45 -89.143 21.674 -73.314 1.00 0.00 N ATOM 711 CA PRO A 45 -90.027 20.818 -74.121 1.00 0.00 C ATOM 712 C PRO A 45 -89.717 20.856 -75.619 1.00 0.00 C ATOM 713 O PRO A 45 -89.656 19.811 -76.265 1.00 0.00 O ATOM 714 CB PRO A 45 -91.415 21.398 -73.854 1.00 0.00 C ATOM 715 CG PRO A 45 -91.315 21.993 -72.495 1.00 0.00 C ATOM 716 CD PRO A 45 -89.911 22.521 -72.378 1.00 0.00 C ATOM 0 HA PRO A 45 -89.915 19.768 -73.849 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -91.681 22.149 -74.598 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -92.182 20.625 -73.893 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -92.045 22.792 -72.364 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -91.517 21.247 -71.726 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -89.855 23.575 -72.652 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -89.534 22.436 -71.359 1.00 0.00 H new ATOM 724 N GLY A 46 -89.514 22.053 -76.160 1.00 0.00 N ATOM 725 CA GLY A 46 -89.253 22.194 -77.583 1.00 0.00 C ATOM 726 C GLY A 46 -87.911 21.623 -77.974 1.00 0.00 C ATOM 727 O GLY A 46 -87.800 20.897 -78.965 1.00 0.00 O ATOM 0 H GLY A 46 -89.525 22.930 -75.639 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -90.039 21.691 -78.147 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -89.291 23.249 -77.855 1.00 0.00 H new ATOM 731 N VAL A 47 -86.896 21.947 -77.189 1.00 0.00 N ATOM 732 CA VAL A 47 -85.569 21.376 -77.378 1.00 0.00 C ATOM 733 C VAL A 47 -85.638 19.854 -77.252 1.00 0.00 C ATOM 734 O VAL A 47 -85.133 19.106 -78.105 1.00 0.00 O ATOM 735 CB VAL A 47 -84.576 21.936 -76.336 1.00 0.00 C ATOM 736 CG1 VAL A 47 -83.176 21.421 -76.592 1.00 0.00 C ATOM 737 CG2 VAL A 47 -84.589 23.457 -76.336 1.00 0.00 C ATOM 0 H VAL A 47 -86.965 22.604 -76.412 1.00 0.00 H new ATOM 0 HA VAL A 47 -85.218 21.647 -78.374 1.00 0.00 H new ATOM 0 HB VAL A 47 -84.895 21.590 -75.353 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -82.496 21.830 -75.845 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -83.172 20.333 -76.530 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -82.851 21.729 -77.586 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -83.882 23.827 -75.594 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -84.305 23.823 -77.322 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -85.590 23.812 -76.092 1.00 0.00 H new ATOM 747 N SER A 48 -86.306 19.409 -76.195 1.00 0.00 N ATOM 748 CA SER A 48 -86.514 17.996 -75.934 1.00 0.00 C ATOM 749 C SER A 48 -87.123 17.313 -77.157 1.00 0.00 C ATOM 750 O SER A 48 -86.678 16.245 -77.554 1.00 0.00 O ATOM 751 CB SER A 48 -87.425 17.824 -74.708 1.00 0.00 C ATOM 752 OG SER A 48 -87.548 16.465 -74.319 1.00 0.00 O ATOM 0 H SER A 48 -86.719 20.023 -75.493 1.00 0.00 H new ATOM 0 HA SER A 48 -85.552 17.526 -75.727 1.00 0.00 H new ATOM 0 HB2 SER A 48 -87.025 18.404 -73.876 1.00 0.00 H new ATOM 0 HB3 SER A 48 -88.413 18.227 -74.932 1.00 0.00 H new ATOM 0 HG SER A 48 -88.134 16.401 -73.536 1.00 0.00 H new ATOM 758 N ARG A 49 -88.103 17.963 -77.780 1.00 0.00 N ATOM 759 CA ARG A 49 -88.802 17.389 -78.930 1.00 0.00 C ATOM 760 C ARG A 49 -87.865 17.146 -80.116 1.00 0.00 C ATOM 761 O ARG A 49 -88.167 16.338 -80.999 1.00 0.00 O ATOM 762 CB ARG A 49 -89.975 18.281 -79.344 1.00 0.00 C ATOM 763 CG ARG A 49 -91.154 18.205 -78.387 1.00 0.00 C ATOM 764 CD ARG A 49 -92.300 19.104 -78.820 1.00 0.00 C ATOM 765 NE ARG A 49 -93.491 18.902 -77.991 1.00 0.00 N ATOM 766 CZ ARG A 49 -94.733 19.191 -78.382 1.00 0.00 C ATOM 767 NH1 ARG A 49 -94.950 19.788 -79.545 1.00 0.00 N ATOM 768 NH2 ARG A 49 -95.758 18.909 -77.589 1.00 0.00 N ATOM 0 H ARG A 49 -88.432 18.889 -77.508 1.00 0.00 H new ATOM 0 HA ARG A 49 -89.187 16.417 -78.621 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -89.633 19.314 -79.407 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -90.307 17.994 -80.342 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -91.505 17.175 -78.326 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -90.828 18.490 -77.387 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -91.987 20.146 -78.760 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -92.545 18.904 -79.863 1.00 0.00 H new ATOM 0 HE ARG A 49 -93.362 18.516 -77.056 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -94.164 20.030 -80.149 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -95.903 20.006 -79.837 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -95.596 18.472 -76.682 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -96.709 19.129 -77.886 1.00 0.00 H new ATOM 782 N LEU A 50 -86.732 17.840 -80.150 1.00 0.00 N ATOM 783 CA LEU A 50 -85.732 17.579 -81.169 1.00 0.00 C ATOM 784 C LEU A 50 -84.890 16.360 -80.801 1.00 0.00 C ATOM 785 O LEU A 50 -84.543 15.560 -81.666 1.00 0.00 O ATOM 786 CB LEU A 50 -84.831 18.799 -81.398 1.00 0.00 C ATOM 787 CG LEU A 50 -85.494 19.992 -82.097 1.00 0.00 C ATOM 788 CD1 LEU A 50 -84.451 21.033 -82.480 1.00 0.00 C ATOM 789 CD2 LEU A 50 -86.262 19.537 -83.328 1.00 0.00 C ATOM 0 H LEU A 50 -86.488 18.579 -79.490 1.00 0.00 H new ATOM 0 HA LEU A 50 -86.260 17.372 -82.100 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -84.450 19.133 -80.433 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -83.971 18.487 -81.990 1.00 0.00 H new ATOM 0 HG LEU A 50 -86.199 20.445 -81.400 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -84.939 21.872 -82.975 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -83.943 21.386 -81.583 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -83.723 20.586 -83.157 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -86.724 20.400 -83.808 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -85.577 19.056 -84.027 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -87.036 18.828 -83.033 1.00 0.00 H new ATOM 801 N LEU A 51 -84.578 16.209 -79.520 1.00 0.00 N ATOM 802 CA LEU A 51 -83.774 15.065 -79.073 1.00 0.00 C ATOM 803 C LEU A 51 -84.599 13.775 -78.970 1.00 0.00 C ATOM 804 O LEU A 51 -84.219 12.749 -79.535 1.00 0.00 O ATOM 805 CB LEU A 51 -83.099 15.344 -77.724 1.00 0.00 C ATOM 806 CG LEU A 51 -81.907 16.309 -77.747 1.00 0.00 C ATOM 807 CD1 LEU A 51 -80.990 16.009 -78.922 1.00 0.00 C ATOM 808 CD2 LEU A 51 -82.371 17.756 -77.777 1.00 0.00 C ATOM 0 H LEU A 51 -84.861 16.850 -78.778 1.00 0.00 H new ATOM 0 HA LEU A 51 -83.008 14.922 -79.835 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -83.850 15.744 -77.042 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -82.763 14.395 -77.307 1.00 0.00 H new ATOM 0 HG LEU A 51 -81.340 16.161 -76.828 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -80.152 16.706 -78.917 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -80.614 14.989 -78.839 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -81.546 16.116 -79.854 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -81.504 18.416 -77.793 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -82.973 17.927 -78.669 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -82.970 17.965 -76.890 1.00 0.00 H new ATOM 820 N GLU A 52 -85.739 13.858 -78.281 1.00 0.00 N ATOM 821 CA GLU A 52 -86.552 12.687 -77.898 1.00 0.00 C ATOM 822 C GLU A 52 -86.730 11.671 -79.026 1.00 0.00 C ATOM 823 O GLU A 52 -86.555 10.468 -78.828 1.00 0.00 O ATOM 824 CB GLU A 52 -87.948 13.141 -77.451 1.00 0.00 C ATOM 825 CG GLU A 52 -87.963 14.020 -76.215 1.00 0.00 C ATOM 826 CD GLU A 52 -87.783 13.245 -74.933 1.00 0.00 C ATOM 827 OE1 GLU A 52 -86.645 12.859 -74.626 1.00 0.00 O ATOM 828 OE2 GLU A 52 -88.791 13.056 -74.215 1.00 0.00 O ATOM 0 H GLU A 52 -86.133 14.745 -77.967 1.00 0.00 H new ATOM 0 HA GLU A 52 -86.007 12.201 -77.089 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -88.419 13.683 -78.271 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -88.558 12.258 -77.260 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -87.171 14.764 -76.297 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -88.907 14.563 -76.174 1.00 0.00 H new ATOM 835 N ALA A 53 -87.084 12.159 -80.202 1.00 0.00 N ATOM 836 CA ALA A 53 -87.520 11.289 -81.284 1.00 0.00 C ATOM 837 C ALA A 53 -86.401 10.404 -81.837 1.00 0.00 C ATOM 838 O ALA A 53 -86.583 9.198 -81.986 1.00 0.00 O ATOM 839 CB ALA A 53 -88.144 12.113 -82.398 1.00 0.00 C ATOM 0 H ALA A 53 -87.079 13.152 -80.434 1.00 0.00 H new ATOM 0 HA ALA A 53 -88.265 10.614 -80.862 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -88.467 11.452 -83.202 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -89.004 12.658 -82.009 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -87.409 12.821 -82.782 1.00 0.00 H new ATOM 845 N ARG A 54 -85.244 10.981 -82.132 1.00 0.00 N ATOM 846 CA ARG A 54 -84.236 10.245 -82.890 1.00 0.00 C ATOM 847 C ARG A 54 -82.832 10.371 -82.310 1.00 0.00 C ATOM 848 O ARG A 54 -81.856 10.048 -82.987 1.00 0.00 O ATOM 849 CB ARG A 54 -84.224 10.699 -84.356 1.00 0.00 C ATOM 850 CG ARG A 54 -84.016 12.197 -84.553 1.00 0.00 C ATOM 851 CD ARG A 54 -85.327 12.962 -84.459 1.00 0.00 C ATOM 852 NE ARG A 54 -85.170 14.374 -84.795 1.00 0.00 N ATOM 853 CZ ARG A 54 -85.946 15.348 -84.316 1.00 0.00 C ATOM 854 NH1 ARG A 54 -86.931 15.065 -83.469 1.00 0.00 N ATOM 855 NH2 ARG A 54 -85.733 16.601 -84.688 1.00 0.00 N ATOM 0 H ARG A 54 -84.982 11.931 -81.868 1.00 0.00 H new ATOM 0 HA ARG A 54 -84.520 9.195 -82.824 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -83.434 10.163 -84.883 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -85.168 10.412 -84.820 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -83.322 12.570 -83.800 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -83.558 12.376 -85.526 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -86.058 12.510 -85.130 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -85.725 12.873 -83.448 1.00 0.00 H new ATOM 0 HE ARG A 54 -84.420 14.632 -85.436 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -87.096 14.100 -83.183 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -87.522 15.813 -83.105 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -84.978 16.819 -85.338 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -86.324 17.348 -84.324 1.00 0.00 H new ATOM 869 N PHE A 55 -82.712 10.810 -81.070 1.00 0.00 N ATOM 870 CA PHE A 55 -81.395 10.948 -80.463 1.00 0.00 C ATOM 871 C PHE A 55 -81.298 10.185 -79.152 1.00 0.00 C ATOM 872 O PHE A 55 -82.243 10.139 -78.366 1.00 0.00 O ATOM 873 CB PHE A 55 -81.047 12.415 -80.212 1.00 0.00 C ATOM 874 CG PHE A 55 -80.809 13.234 -81.453 1.00 0.00 C ATOM 875 CD1 PHE A 55 -81.859 13.863 -82.106 1.00 0.00 C ATOM 876 CD2 PHE A 55 -79.523 13.401 -81.947 1.00 0.00 C ATOM 877 CE1 PHE A 55 -81.631 14.643 -83.223 1.00 0.00 C ATOM 878 CE2 PHE A 55 -79.293 14.176 -83.066 1.00 0.00 C ATOM 879 CZ PHE A 55 -80.348 14.799 -83.704 1.00 0.00 C ATOM 0 H PHE A 55 -83.494 11.074 -80.470 1.00 0.00 H new ATOM 0 HA PHE A 55 -80.683 10.526 -81.172 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -81.856 12.872 -79.643 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -80.154 12.459 -79.589 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -82.867 13.741 -81.737 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -78.693 12.920 -81.451 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -82.457 15.130 -83.719 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -78.288 14.295 -83.443 1.00 0.00 H new ATOM 0 HZ PHE A 55 -80.168 15.407 -84.578 1.00 0.00 H new ATOM 889 N VAL A 56 -80.147 9.575 -78.944 1.00 0.00 N ATOM 890 CA VAL A 56 -79.795 8.980 -77.666 1.00 0.00 C ATOM 891 C VAL A 56 -78.753 9.872 -77.006 1.00 0.00 C ATOM 892 O VAL A 56 -77.650 10.032 -77.533 1.00 0.00 O ATOM 893 CB VAL A 56 -79.225 7.557 -77.826 1.00 0.00 C ATOM 894 CG1 VAL A 56 -78.950 6.939 -76.463 1.00 0.00 C ATOM 895 CG2 VAL A 56 -80.176 6.683 -78.630 1.00 0.00 C ATOM 0 H VAL A 56 -79.426 9.477 -79.659 1.00 0.00 H new ATOM 0 HA VAL A 56 -80.695 8.900 -77.057 1.00 0.00 H new ATOM 0 HB VAL A 56 -78.283 7.623 -78.371 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -78.548 5.934 -76.593 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -78.227 7.552 -75.925 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -79.878 6.887 -75.893 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -79.754 5.683 -78.731 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -81.136 6.622 -78.117 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -80.321 7.117 -79.619 1.00 0.00 H new ATOM 905 N VAL A 57 -79.100 10.476 -75.881 1.00 0.00 N ATOM 906 CA VAL A 57 -78.224 11.462 -75.275 1.00 0.00 C ATOM 907 C VAL A 57 -77.211 10.794 -74.359 1.00 0.00 C ATOM 908 O VAL A 57 -77.575 10.100 -73.412 1.00 0.00 O ATOM 909 CB VAL A 57 -79.019 12.524 -74.487 1.00 0.00 C ATOM 910 CG1 VAL A 57 -78.108 13.664 -74.063 1.00 0.00 C ATOM 911 CG2 VAL A 57 -80.181 13.048 -75.315 1.00 0.00 C ATOM 0 H VAL A 57 -79.969 10.304 -75.376 1.00 0.00 H new ATOM 0 HA VAL A 57 -77.696 11.964 -76.086 1.00 0.00 H new ATOM 0 HB VAL A 57 -79.423 12.054 -73.590 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -78.685 14.404 -73.508 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -77.311 13.276 -73.429 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -77.674 14.131 -74.947 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -80.729 13.796 -74.741 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -79.800 13.501 -76.231 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -80.848 12.224 -75.568 1.00 0.00 H new ATOM 921 N ALA A 58 -75.942 10.998 -74.663 1.00 0.00 N ATOM 922 CA ALA A 58 -74.866 10.432 -73.877 1.00 0.00 C ATOM 923 C ALA A 58 -74.384 11.429 -72.838 1.00 0.00 C ATOM 924 O ALA A 58 -73.888 12.505 -73.178 1.00 0.00 O ATOM 925 CB ALA A 58 -73.713 10.014 -74.777 1.00 0.00 C ATOM 0 H ALA A 58 -75.632 11.558 -75.457 1.00 0.00 H new ATOM 0 HA ALA A 58 -75.245 9.549 -73.363 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -72.913 9.591 -74.170 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -74.061 9.267 -75.491 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -73.338 10.884 -75.316 1.00 0.00 H new ATOM 931 N SER A 59 -74.528 11.071 -71.577 1.00 0.00 N ATOM 932 CA SER A 59 -74.044 11.903 -70.500 1.00 0.00 C ATOM 933 C SER A 59 -72.576 11.595 -70.234 1.00 0.00 C ATOM 934 O SER A 59 -72.245 10.583 -69.615 1.00 0.00 O ATOM 935 CB SER A 59 -74.884 11.673 -69.239 1.00 0.00 C ATOM 936 OG SER A 59 -74.993 10.291 -68.943 1.00 0.00 O ATOM 0 H SER A 59 -74.978 10.207 -71.276 1.00 0.00 H new ATOM 0 HA SER A 59 -74.135 12.951 -70.784 1.00 0.00 H new ATOM 0 HB2 SER A 59 -74.430 12.194 -68.396 1.00 0.00 H new ATOM 0 HB3 SER A 59 -75.878 12.098 -69.378 1.00 0.00 H new ATOM 0 HG SER A 59 -74.131 9.853 -69.102 1.00 0.00 H new ATOM 942 N VAL A 60 -71.698 12.454 -70.726 1.00 0.00 N ATOM 943 CA VAL A 60 -70.271 12.274 -70.527 1.00 0.00 C ATOM 944 C VAL A 60 -69.784 13.144 -69.384 1.00 0.00 C ATOM 945 O VAL A 60 -69.746 14.372 -69.493 1.00 0.00 O ATOM 946 CB VAL A 60 -69.473 12.599 -71.803 1.00 0.00 C ATOM 947 CG1 VAL A 60 -67.978 12.489 -71.544 1.00 0.00 C ATOM 948 CG2 VAL A 60 -69.885 11.672 -72.934 1.00 0.00 C ATOM 0 H VAL A 60 -71.949 13.282 -71.266 1.00 0.00 H new ATOM 0 HA VAL A 60 -70.105 11.225 -70.282 1.00 0.00 H new ATOM 0 HB VAL A 60 -69.695 13.625 -72.095 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -67.432 12.723 -72.458 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -67.692 13.191 -70.761 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -67.737 11.474 -71.227 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -69.312 11.914 -73.829 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -69.690 10.639 -72.647 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -70.948 11.798 -73.138 1.00 0.00 H new ATOM 958 N SER A 61 -69.446 12.504 -68.283 1.00 0.00 N ATOM 959 CA SER A 61 -68.970 13.203 -67.110 1.00 0.00 C ATOM 960 C SER A 61 -67.450 13.250 -67.078 1.00 0.00 C ATOM 961 O SER A 61 -66.797 12.250 -66.811 1.00 0.00 O ATOM 962 CB SER A 61 -69.513 12.495 -65.870 1.00 0.00 C ATOM 963 OG SER A 61 -69.779 11.130 -66.156 1.00 0.00 O ATOM 0 H SER A 61 -69.494 11.491 -68.178 1.00 0.00 H new ATOM 0 HA SER A 61 -69.324 14.234 -67.134 1.00 0.00 H new ATOM 0 HB2 SER A 61 -68.792 12.569 -65.056 1.00 0.00 H new ATOM 0 HB3 SER A 61 -70.425 12.987 -65.533 1.00 0.00 H new ATOM 0 HG SER A 61 -68.949 10.613 -66.087 1.00 0.00 H new ATOM 969 N VAL A 62 -66.891 14.428 -67.325 1.00 0.00 N ATOM 970 CA VAL A 62 -65.449 14.622 -67.239 1.00 0.00 C ATOM 971 C VAL A 62 -65.053 14.671 -65.767 1.00 0.00 C ATOM 972 O VAL A 62 -63.879 14.662 -65.402 1.00 0.00 O ATOM 973 CB VAL A 62 -65.015 15.921 -67.962 1.00 0.00 C ATOM 974 CG1 VAL A 62 -63.502 16.063 -67.993 1.00 0.00 C ATOM 975 CG2 VAL A 62 -65.575 15.956 -69.378 1.00 0.00 C ATOM 0 H VAL A 62 -67.414 15.264 -67.587 1.00 0.00 H new ATOM 0 HA VAL A 62 -64.944 13.792 -67.733 1.00 0.00 H new ATOM 0 HB VAL A 62 -65.420 16.762 -67.399 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -63.234 16.986 -68.508 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -63.118 16.092 -66.973 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -63.068 15.214 -68.520 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -65.260 16.876 -69.871 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -65.203 15.098 -69.938 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -66.664 15.919 -69.340 1.00 0.00 H new ATOM 985 N ASP A 63 -66.081 14.706 -64.935 1.00 0.00 N ATOM 986 CA ASP A 63 -65.946 14.675 -63.493 1.00 0.00 C ATOM 987 C ASP A 63 -65.360 13.333 -63.050 1.00 0.00 C ATOM 988 O ASP A 63 -64.639 13.246 -62.055 1.00 0.00 O ATOM 989 CB ASP A 63 -67.331 14.855 -62.853 1.00 0.00 C ATOM 990 CG ASP A 63 -68.217 15.842 -63.606 1.00 0.00 C ATOM 991 OD1 ASP A 63 -68.725 15.477 -64.698 1.00 0.00 O ATOM 992 OD2 ASP A 63 -68.415 16.970 -63.120 1.00 0.00 O ATOM 0 H ASP A 63 -67.049 14.758 -65.252 1.00 0.00 H new ATOM 0 HA ASP A 63 -65.280 15.479 -63.178 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -67.832 13.888 -62.808 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -67.208 15.198 -61.826 1.00 0.00 H new ATOM 997 N THR A 64 -65.679 12.289 -63.806 1.00 0.00 N ATOM 998 CA THR A 64 -65.289 10.928 -63.457 1.00 0.00 C ATOM 999 C THR A 64 -64.515 10.241 -64.591 1.00 0.00 C ATOM 1000 O THR A 64 -64.556 10.689 -65.736 1.00 0.00 O ATOM 1001 CB THR A 64 -66.540 10.110 -63.068 1.00 0.00 C ATOM 1002 OG1 THR A 64 -67.665 10.549 -63.835 1.00 0.00 O ATOM 1003 CG2 THR A 64 -66.846 10.250 -61.584 1.00 0.00 C ATOM 0 H THR A 64 -66.212 12.361 -64.673 1.00 0.00 H new ATOM 0 HA THR A 64 -64.614 10.979 -62.602 1.00 0.00 H new ATOM 0 HB THR A 64 -66.339 9.060 -63.280 1.00 0.00 H new ATOM 0 HG1 THR A 64 -67.919 9.850 -64.473 1.00 0.00 H new ATOM 0 HG21 THR A 64 -67.731 9.664 -61.338 1.00 0.00 H new ATOM 0 HG22 THR A 64 -65.998 9.888 -61.002 1.00 0.00 H new ATOM 0 HG23 THR A 64 -67.028 11.298 -61.347 1.00 0.00 H new ATOM 1011 N PRO A 65 -63.810 9.126 -64.277 1.00 0.00 N ATOM 1012 CA PRO A 65 -62.830 8.475 -65.179 1.00 0.00 C ATOM 1013 C PRO A 65 -63.343 8.194 -66.586 1.00 0.00 C ATOM 1014 O PRO A 65 -62.655 8.479 -67.558 1.00 0.00 O ATOM 1015 CB PRO A 65 -62.535 7.142 -64.475 1.00 0.00 C ATOM 1016 CG PRO A 65 -63.661 6.980 -63.520 1.00 0.00 C ATOM 1017 CD PRO A 65 -63.924 8.364 -63.028 1.00 0.00 C ATOM 0 HA PRO A 65 -61.971 9.129 -65.332 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -62.493 6.317 -65.186 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -61.575 7.167 -63.959 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -64.539 6.557 -64.008 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -63.397 6.310 -62.702 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -64.910 8.461 -62.573 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -63.196 8.683 -62.282 1.00 0.00 H new ATOM 1025 N GLU A 66 -64.530 7.614 -66.692 1.00 0.00 N ATOM 1026 CA GLU A 66 -65.082 7.235 -67.994 1.00 0.00 C ATOM 1027 C GLU A 66 -65.285 8.465 -68.886 1.00 0.00 C ATOM 1028 O GLU A 66 -65.066 8.405 -70.096 1.00 0.00 O ATOM 1029 CB GLU A 66 -66.395 6.450 -67.818 1.00 0.00 C ATOM 1030 CG GLU A 66 -67.587 7.277 -67.347 1.00 0.00 C ATOM 1031 CD GLU A 66 -67.333 8.036 -66.062 1.00 0.00 C ATOM 1032 OE1 GLU A 66 -66.789 7.441 -65.108 1.00 0.00 O ATOM 1033 OE2 GLU A 66 -67.641 9.244 -66.023 1.00 0.00 O ATOM 0 H GLU A 66 -65.131 7.394 -65.898 1.00 0.00 H new ATOM 0 HA GLU A 66 -64.364 6.584 -68.492 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -66.650 5.982 -68.769 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -66.226 5.645 -67.102 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -67.858 7.986 -68.130 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -68.443 6.617 -67.205 1.00 0.00 H new ATOM 1040 N GLY A 67 -65.679 9.580 -68.288 1.00 0.00 N ATOM 1041 CA GLY A 67 -65.811 10.810 -69.040 1.00 0.00 C ATOM 1042 C GLY A 67 -64.480 11.511 -69.197 1.00 0.00 C ATOM 1043 O GLY A 67 -64.242 12.185 -70.197 1.00 0.00 O ATOM 0 H GLY A 67 -65.909 9.655 -67.297 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -66.227 10.593 -70.024 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -66.515 11.472 -68.535 1.00 0.00 H new ATOM 1047 N GLN A 68 -63.615 11.358 -68.200 1.00 0.00 N ATOM 1048 CA GLN A 68 -62.236 11.822 -68.284 1.00 0.00 C ATOM 1049 C GLN A 68 -61.539 11.138 -69.459 1.00 0.00 C ATOM 1050 O GLN A 68 -60.740 11.745 -70.177 1.00 0.00 O ATOM 1051 CB GLN A 68 -61.508 11.512 -66.969 1.00 0.00 C ATOM 1052 CG GLN A 68 -62.021 12.313 -65.787 1.00 0.00 C ATOM 1053 CD GLN A 68 -61.261 12.032 -64.507 1.00 0.00 C ATOM 1054 OE1 GLN A 68 -60.730 10.939 -64.306 1.00 0.00 O ATOM 1055 NE2 GLN A 68 -61.220 13.016 -63.624 1.00 0.00 N ATOM 0 H GLN A 68 -63.850 10.910 -67.314 1.00 0.00 H new ATOM 0 HA GLN A 68 -62.219 12.900 -68.446 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -61.610 10.449 -66.749 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -60.444 11.710 -67.097 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -61.952 13.376 -66.018 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -63.076 12.088 -65.633 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -61.673 13.906 -63.831 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -60.735 12.885 -62.736 1.00 0.00 H new ATOM 1064 N GLU A 69 -61.872 9.867 -69.639 1.00 0.00 N ATOM 1065 CA GLU A 69 -61.438 9.088 -70.784 1.00 0.00 C ATOM 1066 C GLU A 69 -61.972 9.711 -72.071 1.00 0.00 C ATOM 1067 O GLU A 69 -61.214 9.972 -72.996 1.00 0.00 O ATOM 1068 CB GLU A 69 -61.922 7.639 -70.602 1.00 0.00 C ATOM 1069 CG GLU A 69 -62.232 6.880 -71.884 1.00 0.00 C ATOM 1070 CD GLU A 69 -61.024 6.676 -72.781 1.00 0.00 C ATOM 1071 OE1 GLU A 69 -59.899 6.540 -72.252 1.00 0.00 O ATOM 1072 OE2 GLU A 69 -61.202 6.647 -74.019 1.00 0.00 O ATOM 0 H GLU A 69 -62.457 9.345 -68.986 1.00 0.00 H new ATOM 0 HA GLU A 69 -60.350 9.084 -70.856 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -61.160 7.088 -70.050 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -62.819 7.650 -69.982 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -62.651 5.907 -71.627 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -62.998 7.421 -72.439 1.00 0.00 H new ATOM 1079 N LEU A 70 -63.268 9.979 -72.105 1.00 0.00 N ATOM 1080 CA LEU A 70 -63.896 10.609 -73.262 1.00 0.00 C ATOM 1081 C LEU A 70 -63.271 11.971 -73.573 1.00 0.00 C ATOM 1082 O LEU A 70 -63.058 12.315 -74.738 1.00 0.00 O ATOM 1083 CB LEU A 70 -65.397 10.764 -73.022 1.00 0.00 C ATOM 1084 CG LEU A 70 -66.277 9.667 -73.627 1.00 0.00 C ATOM 1085 CD1 LEU A 70 -66.204 9.710 -75.142 1.00 0.00 C ATOM 1086 CD2 LEU A 70 -65.866 8.294 -73.119 1.00 0.00 C ATOM 0 H LEU A 70 -63.911 9.770 -71.341 1.00 0.00 H new ATOM 0 HA LEU A 70 -63.730 9.963 -74.124 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -65.574 10.796 -71.947 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -65.715 11.725 -73.426 1.00 0.00 H new ATOM 0 HG LEU A 70 -67.306 9.849 -73.317 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -66.834 8.925 -75.559 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -66.552 10.681 -75.496 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -65.173 9.556 -75.461 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -66.508 7.534 -73.565 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -64.829 8.100 -73.393 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -65.966 8.262 -72.034 1.00 0.00 H new ATOM 1098 N ALA A 71 -62.975 12.732 -72.526 1.00 0.00 N ATOM 1099 CA ALA A 71 -62.381 14.057 -72.673 1.00 0.00 C ATOM 1100 C ALA A 71 -61.019 13.986 -73.354 1.00 0.00 C ATOM 1101 O ALA A 71 -60.758 14.707 -74.315 1.00 0.00 O ATOM 1102 CB ALA A 71 -62.257 14.734 -71.318 1.00 0.00 C ATOM 0 H ALA A 71 -63.138 12.452 -71.559 1.00 0.00 H new ATOM 0 HA ALA A 71 -63.041 14.649 -73.307 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -61.812 15.721 -71.444 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -63.246 14.836 -70.870 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -61.624 14.131 -70.667 1.00 0.00 H new ATOM 1108 N ARG A 72 -60.154 13.113 -72.854 1.00 0.00 N ATOM 1109 CA ARG A 72 -58.830 12.937 -73.443 1.00 0.00 C ATOM 1110 C ARG A 72 -58.944 12.262 -74.810 1.00 0.00 C ATOM 1111 O ARG A 72 -58.137 12.508 -75.704 1.00 0.00 O ATOM 1112 CB ARG A 72 -57.930 12.111 -72.518 1.00 0.00 C ATOM 1113 CG ARG A 72 -58.403 10.684 -72.358 1.00 0.00 C ATOM 1114 CD ARG A 72 -57.494 9.858 -71.467 1.00 0.00 C ATOM 1115 NE ARG A 72 -57.992 8.490 -71.319 1.00 0.00 N ATOM 1116 CZ ARG A 72 -57.618 7.649 -70.359 1.00 0.00 C ATOM 1117 NH1 ARG A 72 -56.730 8.023 -69.441 1.00 0.00 N ATOM 1118 NH2 ARG A 72 -58.145 6.434 -70.319 1.00 0.00 N ATOM 0 H ARG A 72 -60.342 12.518 -72.047 1.00 0.00 H new ATOM 0 HA ARG A 72 -58.379 13.921 -73.572 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -56.914 12.110 -72.914 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -57.890 12.587 -71.538 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -59.410 10.685 -71.941 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -58.465 10.215 -73.340 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -56.489 9.837 -71.889 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -57.419 10.328 -70.486 1.00 0.00 H new ATOM 0 HE ARG A 72 -58.674 8.158 -72.000 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -56.331 8.961 -69.470 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -56.449 7.372 -68.708 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -58.830 6.152 -71.020 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -57.866 5.781 -69.587 1.00 0.00 H new ATOM 1132 N ARG A 73 -59.970 11.435 -74.960 1.00 0.00 N ATOM 1133 CA ARG A 73 -60.194 10.662 -76.177 1.00 0.00 C ATOM 1134 C ARG A 73 -60.494 11.573 -77.362 1.00 0.00 C ATOM 1135 O ARG A 73 -59.805 11.532 -78.381 1.00 0.00 O ATOM 1136 CB ARG A 73 -61.359 9.699 -75.946 1.00 0.00 C ATOM 1137 CG ARG A 73 -61.543 8.647 -77.021 1.00 0.00 C ATOM 1138 CD ARG A 73 -62.665 7.695 -76.638 1.00 0.00 C ATOM 1139 NE ARG A 73 -62.768 6.556 -77.544 1.00 0.00 N ATOM 1140 CZ ARG A 73 -62.453 5.306 -77.196 1.00 0.00 C ATOM 1141 NH1 ARG A 73 -61.928 5.053 -75.999 1.00 0.00 N ATOM 1142 NH2 ARG A 73 -62.645 4.311 -78.055 1.00 0.00 N ATOM 0 H ARG A 73 -60.674 11.280 -74.238 1.00 0.00 H new ATOM 0 HA ARG A 73 -59.288 10.102 -76.411 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -61.212 9.198 -74.989 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -62.279 10.278 -75.864 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -61.772 9.126 -77.973 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -60.616 8.091 -77.158 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -62.499 7.333 -75.623 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -63.611 8.237 -76.633 1.00 0.00 H new ATOM 0 HE ARG A 73 -63.098 6.724 -78.494 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -61.764 5.816 -75.342 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -61.689 4.096 -75.739 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -63.033 4.502 -78.979 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -62.405 3.356 -77.791 1.00 0.00 H new ATOM 1156 N TYR A 74 -61.514 12.407 -77.214 1.00 0.00 N ATOM 1157 CA TYR A 74 -61.947 13.290 -78.293 1.00 0.00 C ATOM 1158 C TYR A 74 -61.254 14.645 -78.220 1.00 0.00 C ATOM 1159 O TYR A 74 -61.538 15.531 -79.026 1.00 0.00 O ATOM 1160 CB TYR A 74 -63.464 13.482 -78.247 1.00 0.00 C ATOM 1161 CG TYR A 74 -64.247 12.292 -78.751 1.00 0.00 C ATOM 1162 CD1 TYR A 74 -64.454 11.179 -77.947 1.00 0.00 C ATOM 1163 CD2 TYR A 74 -64.784 12.287 -80.033 1.00 0.00 C ATOM 1164 CE1 TYR A 74 -65.173 10.093 -78.407 1.00 0.00 C ATOM 1165 CE2 TYR A 74 -65.505 11.205 -80.498 1.00 0.00 C ATOM 1166 CZ TYR A 74 -65.694 10.112 -79.682 1.00 0.00 C ATOM 1167 OH TYR A 74 -66.410 9.034 -80.144 1.00 0.00 O ATOM 0 H TYR A 74 -62.059 12.492 -76.356 1.00 0.00 H new ATOM 0 HA TYR A 74 -61.670 12.817 -79.235 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -63.763 13.693 -77.220 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -63.728 14.357 -78.842 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -64.047 11.162 -76.947 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -64.635 13.142 -80.675 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -65.326 9.234 -77.771 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -65.918 11.216 -81.496 1.00 0.00 H new ATOM 0 HH TYR A 74 -66.503 8.372 -79.428 1.00 0.00 H new ATOM 1177 N ARG A 75 -60.341 14.786 -77.260 1.00 0.00 N ATOM 1178 CA ARG A 75 -59.617 16.040 -77.035 1.00 0.00 C ATOM 1179 C ARG A 75 -60.613 17.167 -76.747 1.00 0.00 C ATOM 1180 O ARG A 75 -60.746 18.104 -77.534 1.00 0.00 O ATOM 1181 CB ARG A 75 -58.753 16.429 -78.249 1.00 0.00 C ATOM 1182 CG ARG A 75 -57.998 15.281 -78.914 1.00 0.00 C ATOM 1183 CD ARG A 75 -56.987 14.619 -77.991 1.00 0.00 C ATOM 1184 NE ARG A 75 -56.026 13.809 -78.750 1.00 0.00 N ATOM 1185 CZ ARG A 75 -55.876 12.488 -78.622 1.00 0.00 C ATOM 1186 NH1 ARG A 75 -56.609 11.808 -77.753 1.00 0.00 N ATOM 1187 NH2 ARG A 75 -54.983 11.846 -79.370 1.00 0.00 N ATOM 0 H ARG A 75 -60.082 14.038 -76.617 1.00 0.00 H new ATOM 0 HA ARG A 75 -58.956 15.890 -76.181 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -59.395 16.898 -78.994 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -58.030 17.181 -77.932 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -58.713 14.533 -79.256 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -57.483 15.657 -79.798 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -56.455 15.382 -77.423 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -57.507 13.989 -77.269 1.00 0.00 H new ATOM 0 HE ARG A 75 -55.430 14.290 -79.424 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -57.295 12.293 -77.175 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -56.487 10.799 -77.662 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -54.414 12.362 -80.040 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -54.868 10.837 -79.273 1.00 0.00 H new ATOM 1201 N VAL A 76 -61.329 17.059 -75.635 1.00 0.00 N ATOM 1202 CA VAL A 76 -62.395 18.008 -75.326 1.00 0.00 C ATOM 1203 C VAL A 76 -62.168 18.727 -73.993 1.00 0.00 C ATOM 1204 O VAL A 76 -62.519 18.212 -72.929 1.00 0.00 O ATOM 1205 CB VAL A 76 -63.774 17.311 -75.295 1.00 0.00 C ATOM 1206 CG1 VAL A 76 -64.870 18.299 -74.930 1.00 0.00 C ATOM 1207 CG2 VAL A 76 -64.078 16.658 -76.634 1.00 0.00 C ATOM 0 H VAL A 76 -61.194 16.329 -74.935 1.00 0.00 H new ATOM 0 HA VAL A 76 -62.378 18.750 -76.124 1.00 0.00 H new ATOM 0 HB VAL A 76 -63.741 16.534 -74.531 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -65.832 17.786 -74.914 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -64.667 18.720 -73.945 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -64.898 19.100 -75.668 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -65.053 16.173 -76.589 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -64.086 17.417 -77.416 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -63.313 15.914 -76.858 1.00 0.00 H new ATOM 1217 N PRO A 77 -61.528 19.905 -74.033 1.00 0.00 N ATOM 1218 CA PRO A 77 -61.436 20.811 -72.902 1.00 0.00 C ATOM 1219 C PRO A 77 -62.412 21.988 -73.026 1.00 0.00 C ATOM 1220 O PRO A 77 -62.457 22.658 -74.058 1.00 0.00 O ATOM 1221 CB PRO A 77 -59.992 21.302 -73.018 1.00 0.00 C ATOM 1222 CG PRO A 77 -59.637 21.182 -74.479 1.00 0.00 C ATOM 1223 CD PRO A 77 -60.762 20.433 -75.162 1.00 0.00 C ATOM 0 HA PRO A 77 -61.684 20.339 -71.951 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -59.900 22.333 -72.676 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -59.323 20.701 -72.402 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -59.508 22.169 -74.924 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -58.693 20.651 -74.602 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -61.365 21.091 -75.788 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -60.387 19.637 -75.805 1.00 0.00 H new ATOM 1231 N GLY A 78 -63.199 22.242 -71.988 1.00 0.00 N ATOM 1232 CA GLY A 78 -64.091 23.385 -72.021 1.00 0.00 C ATOM 1233 C GLY A 78 -65.444 23.091 -71.414 1.00 0.00 C ATOM 1234 O GLY A 78 -65.659 23.353 -70.230 1.00 0.00 O ATOM 0 H GLY A 78 -63.236 21.685 -71.134 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -63.630 24.215 -71.485 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -64.224 23.707 -73.054 1.00 0.00 H new ATOM 1238 N THR A 79 -66.349 22.533 -72.226 1.00 0.00 N ATOM 1239 CA THR A 79 -67.717 22.234 -71.793 1.00 0.00 C ATOM 1240 C THR A 79 -68.569 23.514 -71.705 1.00 0.00 C ATOM 1241 O THR A 79 -68.107 24.542 -71.213 1.00 0.00 O ATOM 1242 CB THR A 79 -67.716 21.500 -70.436 1.00 0.00 C ATOM 1243 OG1 THR A 79 -66.965 20.285 -70.542 1.00 0.00 O ATOM 1244 CG2 THR A 79 -69.123 21.184 -69.973 1.00 0.00 C ATOM 0 H THR A 79 -66.155 22.278 -73.194 1.00 0.00 H new ATOM 0 HA THR A 79 -68.162 21.580 -72.543 1.00 0.00 H new ATOM 0 HB THR A 79 -67.256 22.160 -69.700 1.00 0.00 H new ATOM 0 HG1 THR A 79 -66.007 20.489 -70.511 1.00 0.00 H new ATOM 0 HG21 THR A 79 -69.083 20.667 -69.014 1.00 0.00 H new ATOM 0 HG22 THR A 79 -69.686 22.111 -69.863 1.00 0.00 H new ATOM 0 HG23 THR A 79 -69.614 20.547 -70.709 1.00 0.00 H new ATOM 1252 N PRO A 80 -69.831 23.474 -72.182 1.00 0.00 N ATOM 1253 CA PRO A 80 -70.442 22.277 -72.769 1.00 0.00 C ATOM 1254 C PRO A 80 -69.959 22.000 -74.184 1.00 0.00 C ATOM 1255 O PRO A 80 -69.833 22.914 -75.005 1.00 0.00 O ATOM 1256 CB PRO A 80 -71.932 22.612 -72.781 1.00 0.00 C ATOM 1257 CG PRO A 80 -71.985 24.097 -72.884 1.00 0.00 C ATOM 1258 CD PRO A 80 -70.762 24.617 -72.175 1.00 0.00 C ATOM 0 HA PRO A 80 -70.188 21.380 -72.204 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -72.438 22.138 -73.623 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -72.424 22.260 -71.874 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -71.993 24.414 -73.927 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -72.894 24.486 -72.426 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -70.339 25.479 -72.690 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -70.995 24.935 -71.159 1.00 0.00 H new ATOM 1266 N THR A 81 -69.691 20.739 -74.465 1.00 0.00 N ATOM 1267 CA THR A 81 -69.282 20.333 -75.794 1.00 0.00 C ATOM 1268 C THR A 81 -70.208 19.240 -76.313 1.00 0.00 C ATOM 1269 O THR A 81 -70.466 18.254 -75.623 1.00 0.00 O ATOM 1270 CB THR A 81 -67.823 19.849 -75.797 1.00 0.00 C ATOM 1271 OG1 THR A 81 -66.987 20.857 -75.210 1.00 0.00 O ATOM 1272 CG2 THR A 81 -67.346 19.558 -77.216 1.00 0.00 C ATOM 0 H THR A 81 -69.750 19.978 -73.789 1.00 0.00 H new ATOM 0 HA THR A 81 -69.350 21.197 -76.455 1.00 0.00 H new ATOM 0 HB THR A 81 -67.763 18.928 -75.218 1.00 0.00 H new ATOM 0 HG1 THR A 81 -66.148 20.920 -75.713 1.00 0.00 H new ATOM 0 HG21 THR A 81 -66.311 19.217 -77.189 1.00 0.00 H new ATOM 0 HG22 THR A 81 -67.972 18.783 -77.658 1.00 0.00 H new ATOM 0 HG23 THR A 81 -67.414 20.465 -77.816 1.00 0.00 H new ATOM 1280 N PHE A 82 -70.723 19.438 -77.516 1.00 0.00 N ATOM 1281 CA PHE A 82 -71.706 18.530 -78.088 1.00 0.00 C ATOM 1282 C PHE A 82 -71.133 17.850 -79.314 1.00 0.00 C ATOM 1283 O PHE A 82 -70.709 18.513 -80.259 1.00 0.00 O ATOM 1284 CB PHE A 82 -72.975 19.293 -78.476 1.00 0.00 C ATOM 1285 CG PHE A 82 -73.298 20.416 -77.538 1.00 0.00 C ATOM 1286 CD1 PHE A 82 -72.758 21.669 -77.750 1.00 0.00 C ATOM 1287 CD2 PHE A 82 -74.118 20.220 -76.441 1.00 0.00 C ATOM 1288 CE1 PHE A 82 -73.026 22.706 -76.894 1.00 0.00 C ATOM 1289 CE2 PHE A 82 -74.392 21.261 -75.577 1.00 0.00 C ATOM 1290 CZ PHE A 82 -73.843 22.506 -75.806 1.00 0.00 C ATOM 0 H PHE A 82 -70.475 20.223 -78.118 1.00 0.00 H new ATOM 0 HA PHE A 82 -71.957 17.778 -77.340 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -72.858 19.692 -79.484 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -73.815 18.599 -78.504 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -72.115 21.835 -78.602 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -74.547 19.246 -76.259 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -72.595 23.680 -77.074 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -75.035 21.101 -74.724 1.00 0.00 H new ATOM 0 HZ PHE A 82 -74.055 23.323 -75.132 1.00 0.00 H new ATOM 1300 N VAL A 83 -71.101 16.534 -79.286 1.00 0.00 N ATOM 1301 CA VAL A 83 -70.621 15.760 -80.414 1.00 0.00 C ATOM 1302 C VAL A 83 -71.714 14.814 -80.896 1.00 0.00 C ATOM 1303 O VAL A 83 -72.057 13.850 -80.215 1.00 0.00 O ATOM 1304 CB VAL A 83 -69.350 14.962 -80.044 1.00 0.00 C ATOM 1305 CG1 VAL A 83 -68.886 14.101 -81.206 1.00 0.00 C ATOM 1306 CG2 VAL A 83 -68.238 15.903 -79.608 1.00 0.00 C ATOM 0 H VAL A 83 -71.404 15.974 -78.489 1.00 0.00 H new ATOM 0 HA VAL A 83 -70.362 16.451 -81.217 1.00 0.00 H new ATOM 0 HB VAL A 83 -69.599 14.303 -79.212 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -67.990 13.551 -80.917 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -69.673 13.397 -81.474 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -68.661 14.736 -82.062 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -67.351 15.324 -79.351 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -68.001 16.588 -80.422 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -68.564 16.473 -78.738 1.00 0.00 H new ATOM 1316 N PHE A 84 -72.286 15.112 -82.052 1.00 0.00 N ATOM 1317 CA PHE A 84 -73.349 14.284 -82.599 1.00 0.00 C ATOM 1318 C PHE A 84 -72.770 13.263 -83.562 1.00 0.00 C ATOM 1319 O PHE A 84 -72.140 13.620 -84.562 1.00 0.00 O ATOM 1320 CB PHE A 84 -74.404 15.135 -83.312 1.00 0.00 C ATOM 1321 CG PHE A 84 -74.973 16.237 -82.463 1.00 0.00 C ATOM 1322 CD1 PHE A 84 -74.380 17.488 -82.444 1.00 0.00 C ATOM 1323 CD2 PHE A 84 -76.101 16.024 -81.688 1.00 0.00 C ATOM 1324 CE1 PHE A 84 -74.899 18.504 -81.669 1.00 0.00 C ATOM 1325 CE2 PHE A 84 -76.627 17.039 -80.910 1.00 0.00 C ATOM 1326 CZ PHE A 84 -76.023 18.281 -80.901 1.00 0.00 C ATOM 0 H PHE A 84 -72.034 15.916 -82.627 1.00 0.00 H new ATOM 0 HA PHE A 84 -73.833 13.766 -81.771 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -73.960 15.571 -84.207 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -75.216 14.488 -83.642 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -73.500 17.670 -83.043 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -76.575 15.054 -81.691 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -74.425 19.475 -81.663 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -77.508 16.861 -80.311 1.00 0.00 H new ATOM 0 HZ PHE A 84 -76.430 19.076 -80.294 1.00 0.00 H new ATOM 1336 N LEU A 85 -72.975 11.993 -83.257 1.00 0.00 N ATOM 1337 CA LEU A 85 -72.451 10.924 -84.085 1.00 0.00 C ATOM 1338 C LEU A 85 -73.576 10.220 -84.828 1.00 0.00 C ATOM 1339 O LEU A 85 -74.589 9.843 -84.236 1.00 0.00 O ATOM 1340 CB LEU A 85 -71.655 9.919 -83.246 1.00 0.00 C ATOM 1341 CG LEU A 85 -70.437 10.498 -82.515 1.00 0.00 C ATOM 1342 CD1 LEU A 85 -69.582 9.391 -81.931 1.00 0.00 C ATOM 1343 CD2 LEU A 85 -69.604 11.352 -83.448 1.00 0.00 C ATOM 0 H LEU A 85 -73.501 11.678 -82.442 1.00 0.00 H new ATOM 0 HA LEU A 85 -71.776 11.367 -84.817 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -72.324 9.475 -82.509 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -71.318 9.112 -83.897 1.00 0.00 H new ATOM 0 HG LEU A 85 -70.805 11.123 -81.702 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -68.724 9.826 -81.418 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -70.173 8.810 -81.223 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -69.233 8.740 -82.732 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -68.746 11.751 -82.907 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -69.256 10.745 -84.283 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -70.210 12.175 -83.826 1.00 0.00 H new ATOM 1355 N VAL A 86 -73.391 10.057 -86.127 1.00 0.00 N ATOM 1356 CA VAL A 86 -74.372 9.391 -86.970 1.00 0.00 C ATOM 1357 C VAL A 86 -73.858 8.025 -87.404 1.00 0.00 C ATOM 1358 O VAL A 86 -72.767 7.923 -87.968 1.00 0.00 O ATOM 1359 CB VAL A 86 -74.667 10.214 -88.242 1.00 0.00 C ATOM 1360 CG1 VAL A 86 -75.820 9.607 -89.027 1.00 0.00 C ATOM 1361 CG2 VAL A 86 -74.950 11.663 -87.902 1.00 0.00 C ATOM 0 H VAL A 86 -72.562 10.380 -86.626 1.00 0.00 H new ATOM 0 HA VAL A 86 -75.284 9.287 -86.382 1.00 0.00 H new ATOM 0 HB VAL A 86 -73.777 10.185 -88.871 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -76.008 10.205 -89.918 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -75.564 8.589 -89.321 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -76.715 9.591 -88.405 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -75.154 12.218 -88.817 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -75.816 11.720 -87.242 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -74.084 12.095 -87.401 1.00 0.00 H new ATOM 1371 N PRO A 87 -74.614 6.954 -87.124 1.00 0.00 N ATOM 1372 CA PRO A 87 -74.291 5.628 -87.636 1.00 0.00 C ATOM 1373 C PRO A 87 -74.697 5.506 -89.100 1.00 0.00 C ATOM 1374 O PRO A 87 -75.874 5.623 -89.441 1.00 0.00 O ATOM 1375 CB PRO A 87 -75.124 4.695 -86.756 1.00 0.00 C ATOM 1376 CG PRO A 87 -76.292 5.516 -86.320 1.00 0.00 C ATOM 1377 CD PRO A 87 -75.829 6.952 -86.286 1.00 0.00 C ATOM 0 HA PRO A 87 -73.225 5.401 -87.601 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -75.446 3.813 -87.310 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -74.549 4.341 -85.900 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -77.128 5.396 -87.009 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -76.641 5.199 -85.337 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -76.589 7.626 -86.682 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -75.613 7.278 -85.269 1.00 0.00 H new ATOM 1385 N LYS A 88 -73.724 5.284 -89.967 1.00 0.00 N ATOM 1386 CA LYS A 88 -73.987 5.254 -91.397 1.00 0.00 C ATOM 1387 C LYS A 88 -72.904 4.468 -92.129 1.00 0.00 C ATOM 1388 O LYS A 88 -71.731 4.518 -91.749 1.00 0.00 O ATOM 1389 CB LYS A 88 -74.087 6.689 -91.936 1.00 0.00 C ATOM 1390 CG LYS A 88 -72.850 7.531 -91.671 1.00 0.00 C ATOM 1391 CD LYS A 88 -73.144 9.021 -91.766 1.00 0.00 C ATOM 1392 CE LYS A 88 -73.544 9.451 -93.169 1.00 0.00 C ATOM 1393 NZ LYS A 88 -73.644 10.933 -93.275 1.00 0.00 N ATOM 0 H LYS A 88 -72.750 5.123 -89.709 1.00 0.00 H new ATOM 0 HA LYS A 88 -74.937 4.749 -91.572 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -74.267 6.652 -93.010 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -74.951 7.177 -91.485 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -72.460 7.301 -90.679 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -72.072 7.268 -92.388 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -73.944 9.275 -91.071 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -72.262 9.582 -91.456 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -72.812 9.082 -93.887 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -74.502 9.001 -93.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -74.169 11.185 -94.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -74.143 11.308 -92.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -72.689 11.343 -93.319 1.00 0.00 H new ATOM 1407 N ALA A 89 -73.323 3.734 -93.162 1.00 0.00 N ATOM 1408 CA ALA A 89 -72.430 2.901 -93.974 1.00 0.00 C ATOM 1409 C ALA A 89 -71.874 1.729 -93.168 1.00 0.00 C ATOM 1410 O ALA A 89 -72.337 0.599 -93.304 1.00 0.00 O ATOM 1411 CB ALA A 89 -71.303 3.731 -94.583 1.00 0.00 C ATOM 0 H ALA A 89 -74.297 3.700 -93.461 1.00 0.00 H new ATOM 0 HA ALA A 89 -73.021 2.488 -94.792 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -70.658 3.086 -95.179 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -71.726 4.509 -95.219 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -70.719 4.192 -93.786 1.00 0.00 H new ATOM 1417 N GLY A 90 -70.892 2.009 -92.327 1.00 0.00 N ATOM 1418 CA GLY A 90 -70.299 0.979 -91.500 1.00 0.00 C ATOM 1419 C GLY A 90 -69.429 1.565 -90.411 1.00 0.00 C ATOM 1420 O GLY A 90 -68.517 0.908 -89.913 1.00 0.00 O ATOM 0 H GLY A 90 -70.492 2.939 -92.201 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -71.087 0.375 -91.050 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -69.703 0.312 -92.122 1.00 0.00 H new ATOM 1424 N ALA A 91 -69.710 2.809 -90.044 1.00 0.00 N ATOM 1425 CA ALA A 91 -68.930 3.500 -89.031 1.00 0.00 C ATOM 1426 C ALA A 91 -69.734 4.641 -88.428 1.00 0.00 C ATOM 1427 O ALA A 91 -70.901 4.842 -88.776 1.00 0.00 O ATOM 1428 CB ALA A 91 -67.628 4.026 -89.624 1.00 0.00 C ATOM 0 H ALA A 91 -70.475 3.359 -90.435 1.00 0.00 H new ATOM 0 HA ALA A 91 -68.688 2.789 -88.241 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -67.058 4.540 -88.851 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -67.043 3.193 -90.013 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -67.851 4.721 -90.433 1.00 0.00 H new ATOM 1434 N TRP A 92 -69.108 5.381 -87.525 1.00 0.00 N ATOM 1435 CA TRP A 92 -69.747 6.526 -86.903 1.00 0.00 C ATOM 1436 C TRP A 92 -69.193 7.818 -87.476 1.00 0.00 C ATOM 1437 O TRP A 92 -67.980 7.992 -87.597 1.00 0.00 O ATOM 1438 CB TRP A 92 -69.549 6.506 -85.389 1.00 0.00 C ATOM 1439 CG TRP A 92 -70.213 5.344 -84.715 1.00 0.00 C ATOM 1440 CD1 TRP A 92 -69.673 4.113 -84.469 1.00 0.00 C ATOM 1441 CD2 TRP A 92 -71.545 5.311 -84.196 1.00 0.00 C ATOM 1442 NE1 TRP A 92 -70.596 3.315 -83.835 1.00 0.00 N ATOM 1443 CE2 TRP A 92 -71.751 4.028 -83.655 1.00 0.00 C ATOM 1444 CE3 TRP A 92 -72.584 6.242 -84.136 1.00 0.00 C ATOM 1445 CZ2 TRP A 92 -72.952 3.654 -83.064 1.00 0.00 C ATOM 1446 CZ3 TRP A 92 -73.776 5.868 -83.549 1.00 0.00 C ATOM 1447 CH2 TRP A 92 -73.952 4.585 -83.020 1.00 0.00 C ATOM 0 H TRP A 92 -68.155 5.206 -87.207 1.00 0.00 H new ATOM 0 HA TRP A 92 -70.815 6.470 -87.115 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -68.481 6.481 -85.170 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -69.939 7.432 -84.967 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -68.670 3.812 -84.733 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -70.445 2.349 -83.546 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -72.457 7.235 -84.541 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -73.090 2.664 -82.655 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -74.587 6.579 -83.497 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -74.897 4.325 -82.567 1.00 0.00 H new ATOM 1458 N GLU A 93 -70.094 8.709 -87.825 1.00 0.00 N ATOM 1459 CA GLU A 93 -69.737 9.990 -88.406 1.00 0.00 C ATOM 1460 C GLU A 93 -69.954 11.105 -87.396 1.00 0.00 C ATOM 1461 O GLU A 93 -71.070 11.288 -86.906 1.00 0.00 O ATOM 1462 CB GLU A 93 -70.596 10.246 -89.650 1.00 0.00 C ATOM 1463 CG GLU A 93 -70.454 11.642 -90.244 1.00 0.00 C ATOM 1464 CD GLU A 93 -71.425 11.888 -91.383 1.00 0.00 C ATOM 1465 OE1 GLU A 93 -71.099 11.551 -92.541 1.00 0.00 O ATOM 1466 OE2 GLU A 93 -72.535 12.394 -91.128 1.00 0.00 O ATOM 0 H GLU A 93 -71.098 8.568 -87.715 1.00 0.00 H new ATOM 0 HA GLU A 93 -68.684 9.970 -88.687 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -70.334 9.513 -90.413 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -71.642 10.080 -89.393 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -70.619 12.384 -89.463 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -69.434 11.779 -90.604 1.00 0.00 H new ATOM 1473 N GLU A 94 -68.893 11.824 -87.053 1.00 0.00 N ATOM 1474 CA GLU A 94 -69.046 13.021 -86.248 1.00 0.00 C ATOM 1475 C GLU A 94 -69.560 14.136 -87.144 1.00 0.00 C ATOM 1476 O GLU A 94 -68.800 14.800 -87.848 1.00 0.00 O ATOM 1477 CB GLU A 94 -67.730 13.412 -85.564 1.00 0.00 C ATOM 1478 CG GLU A 94 -67.876 14.586 -84.606 1.00 0.00 C ATOM 1479 CD GLU A 94 -66.569 14.984 -83.946 1.00 0.00 C ATOM 1480 OE1 GLU A 94 -65.942 14.133 -83.283 1.00 0.00 O ATOM 1481 OE2 GLU A 94 -66.179 16.163 -84.060 1.00 0.00 O ATOM 0 H GLU A 94 -67.933 11.601 -87.316 1.00 0.00 H new ATOM 0 HA GLU A 94 -69.762 12.834 -85.448 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -67.343 12.552 -85.018 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -66.993 13.663 -86.326 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -68.277 15.442 -85.149 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -68.602 14.329 -83.834 1.00 0.00 H new ATOM 1488 N VAL A 95 -70.870 14.311 -87.124 1.00 0.00 N ATOM 1489 CA VAL A 95 -71.547 15.169 -88.079 1.00 0.00 C ATOM 1490 C VAL A 95 -71.593 16.614 -87.584 1.00 0.00 C ATOM 1491 O VAL A 95 -71.994 17.530 -88.314 1.00 0.00 O ATOM 1492 CB VAL A 95 -72.972 14.639 -88.347 1.00 0.00 C ATOM 1493 CG1 VAL A 95 -73.880 14.867 -87.150 1.00 0.00 C ATOM 1494 CG2 VAL A 95 -73.564 15.248 -89.605 1.00 0.00 C ATOM 0 H VAL A 95 -71.491 13.865 -86.449 1.00 0.00 H new ATOM 0 HA VAL A 95 -70.985 15.156 -89.013 1.00 0.00 H new ATOM 0 HB VAL A 95 -72.894 13.563 -88.506 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -74.876 14.483 -87.370 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -73.475 14.348 -86.282 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -73.942 15.934 -86.938 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -74.567 14.853 -89.763 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -73.614 16.331 -89.496 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -72.936 14.998 -90.460 1.00 0.00 H new ATOM 1504 N GLY A 96 -71.170 16.819 -86.348 1.00 0.00 N ATOM 1505 CA GLY A 96 -71.161 18.149 -85.790 1.00 0.00 C ATOM 1506 C GLY A 96 -70.617 18.189 -84.380 1.00 0.00 C ATOM 1507 O GLY A 96 -71.169 17.559 -83.476 1.00 0.00 O ATOM 0 H GLY A 96 -70.833 16.087 -85.723 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -70.560 18.800 -86.425 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -72.176 18.547 -85.794 1.00 0.00 H new ATOM 1511 N ARG A 97 -69.525 18.914 -84.203 1.00 0.00 N ATOM 1512 CA ARG A 97 -68.978 19.164 -82.883 1.00 0.00 C ATOM 1513 C ARG A 97 -69.211 20.621 -82.524 1.00 0.00 C ATOM 1514 O ARG A 97 -68.849 21.522 -83.279 1.00 0.00 O ATOM 1515 CB ARG A 97 -67.485 18.849 -82.848 1.00 0.00 C ATOM 1516 CG ARG A 97 -66.865 18.968 -81.465 1.00 0.00 C ATOM 1517 CD ARG A 97 -65.378 18.648 -81.486 1.00 0.00 C ATOM 1518 NE ARG A 97 -65.118 17.268 -81.893 1.00 0.00 N ATOM 1519 CZ ARG A 97 -64.175 16.497 -81.361 1.00 0.00 C ATOM 1520 NH1 ARG A 97 -63.359 16.983 -80.429 1.00 0.00 N ATOM 1521 NH2 ARG A 97 -64.045 15.242 -81.766 1.00 0.00 N ATOM 0 H ARG A 97 -68.998 19.342 -84.964 1.00 0.00 H new ATOM 0 HA ARG A 97 -69.476 18.518 -82.160 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -67.328 17.837 -83.220 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -66.965 19.523 -83.528 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -67.014 19.979 -81.085 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -67.373 18.291 -80.779 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -64.871 19.329 -82.170 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -64.957 18.819 -80.495 1.00 0.00 H new ATOM 0 HE ARG A 97 -65.698 16.871 -82.633 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -63.456 17.950 -80.120 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -62.637 16.388 -80.023 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -64.667 14.871 -82.484 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -63.322 14.647 -81.360 1.00 0.00 H new ATOM 1535 N LEU A 98 -69.815 20.844 -81.377 1.00 0.00 N ATOM 1536 CA LEU A 98 -70.218 22.182 -80.977 1.00 0.00 C ATOM 1537 C LEU A 98 -69.639 22.572 -79.629 1.00 0.00 C ATOM 1538 O LEU A 98 -69.584 21.761 -78.703 1.00 0.00 O ATOM 1539 CB LEU A 98 -71.743 22.270 -80.892 1.00 0.00 C ATOM 1540 CG LEU A 98 -72.493 22.197 -82.218 1.00 0.00 C ATOM 1541 CD1 LEU A 98 -73.983 22.042 -81.965 1.00 0.00 C ATOM 1542 CD2 LEU A 98 -72.230 23.449 -83.038 1.00 0.00 C ATOM 0 H LEU A 98 -70.040 20.115 -80.700 1.00 0.00 H new ATOM 0 HA LEU A 98 -69.835 22.868 -81.733 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -72.098 21.463 -80.252 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -72.006 23.206 -80.400 1.00 0.00 H new ATOM 0 HG LEU A 98 -72.138 21.331 -82.776 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -74.510 21.991 -82.918 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -74.163 21.127 -81.401 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -74.346 22.897 -81.395 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -72.771 23.386 -83.982 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -72.569 24.325 -82.484 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -71.162 23.536 -83.237 1.00 0.00 H new ATOM 1554 N PHE A 99 -69.200 23.815 -79.535 1.00 0.00 N ATOM 1555 CA PHE A 99 -68.926 24.429 -78.253 1.00 0.00 C ATOM 1556 C PHE A 99 -70.089 25.357 -77.932 1.00 0.00 C ATOM 1557 O PHE A 99 -70.361 26.305 -78.670 1.00 0.00 O ATOM 1558 CB PHE A 99 -67.591 25.180 -78.270 1.00 0.00 C ATOM 1559 CG PHE A 99 -67.207 25.749 -76.935 1.00 0.00 C ATOM 1560 CD1 PHE A 99 -66.692 24.930 -75.945 1.00 0.00 C ATOM 1561 CD2 PHE A 99 -67.340 27.102 -76.680 1.00 0.00 C ATOM 1562 CE1 PHE A 99 -66.316 25.452 -74.721 1.00 0.00 C ATOM 1563 CE2 PHE A 99 -66.970 27.631 -75.458 1.00 0.00 C ATOM 1564 CZ PHE A 99 -66.459 26.804 -74.476 1.00 0.00 C ATOM 0 H PHE A 99 -69.026 24.420 -80.338 1.00 0.00 H new ATOM 0 HA PHE A 99 -68.834 23.667 -77.479 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -66.806 24.502 -78.607 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -67.648 25.989 -78.998 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -66.583 23.872 -76.131 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -67.738 27.753 -77.445 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -65.911 24.804 -73.958 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -67.080 28.689 -75.271 1.00 0.00 H new ATOM 0 HZ PHE A 99 -66.172 27.214 -73.519 1.00 0.00 H new ATOM 1574 N GLY A 100 -70.795 25.053 -76.854 1.00 0.00 N ATOM 1575 CA GLY A 100 -72.072 25.687 -76.610 1.00 0.00 C ATOM 1576 C GLY A 100 -71.995 26.952 -75.794 1.00 0.00 C ATOM 1577 O GLY A 100 -71.170 27.823 -76.062 1.00 0.00 O ATOM 0 H GLY A 100 -70.506 24.379 -76.145 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -72.539 25.915 -77.568 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -72.723 24.979 -76.098 1.00 0.00 H new ATOM 1581 N SER A 101 -72.897 27.046 -74.813 1.00 0.00 N ATOM 1582 CA SER A 101 -73.085 28.244 -73.991 1.00 0.00 C ATOM 1583 C SER A 101 -73.834 29.324 -74.777 1.00 0.00 C ATOM 1584 O SER A 101 -74.289 30.322 -74.220 1.00 0.00 O ATOM 1585 CB SER A 101 -71.751 28.775 -73.472 1.00 0.00 C ATOM 1586 OG SER A 101 -71.035 27.768 -72.770 1.00 0.00 O ATOM 0 H SER A 101 -73.525 26.282 -74.564 1.00 0.00 H new ATOM 0 HA SER A 101 -73.689 27.967 -73.127 1.00 0.00 H new ATOM 0 HB2 SER A 101 -71.151 29.136 -74.307 1.00 0.00 H new ATOM 0 HB3 SER A 101 -71.927 29.626 -72.814 1.00 0.00 H new ATOM 0 HG SER A 101 -70.184 28.134 -72.450 1.00 0.00 H new ATOM 1592 N ARG A 102 -73.946 29.100 -76.078 1.00 0.00 N ATOM 1593 CA ARG A 102 -74.744 29.944 -76.966 1.00 0.00 C ATOM 1594 C ARG A 102 -76.225 29.843 -76.602 1.00 0.00 C ATOM 1595 O ARG A 102 -76.648 28.848 -76.008 1.00 0.00 O ATOM 1596 CB ARG A 102 -74.548 29.496 -78.422 1.00 0.00 C ATOM 1597 CG ARG A 102 -73.097 29.530 -78.884 1.00 0.00 C ATOM 1598 CD ARG A 102 -72.850 28.619 -80.083 1.00 0.00 C ATOM 1599 NE ARG A 102 -73.568 29.040 -81.292 1.00 0.00 N ATOM 1600 CZ ARG A 102 -73.543 28.355 -82.442 1.00 0.00 C ATOM 1601 NH1 ARG A 102 -72.845 27.232 -82.537 1.00 0.00 N ATOM 1602 NH2 ARG A 102 -74.205 28.787 -83.506 1.00 0.00 N ATOM 0 H ARG A 102 -73.485 28.324 -76.553 1.00 0.00 H new ATOM 0 HA ARG A 102 -74.417 30.978 -76.853 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -74.932 28.482 -78.536 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -75.142 30.137 -79.073 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -72.825 30.553 -79.145 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -72.449 29.228 -78.061 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -71.781 28.592 -80.295 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -73.150 27.603 -79.826 1.00 0.00 H new ATOM 0 HE ARG A 102 -74.115 29.900 -81.254 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -72.324 26.886 -81.732 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -72.829 26.714 -83.416 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -74.743 29.652 -83.455 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -74.177 28.254 -84.375 1.00 0.00 H new ATOM 1616 N PRO A 103 -77.030 30.865 -76.950 1.00 0.00 N ATOM 1617 CA PRO A 103 -78.482 30.838 -76.737 1.00 0.00 C ATOM 1618 C PRO A 103 -79.125 29.631 -77.413 1.00 0.00 C ATOM 1619 O PRO A 103 -78.588 29.097 -78.386 1.00 0.00 O ATOM 1620 CB PRO A 103 -78.976 32.143 -77.382 1.00 0.00 C ATOM 1621 CG PRO A 103 -77.846 32.617 -78.234 1.00 0.00 C ATOM 1622 CD PRO A 103 -76.595 32.127 -77.566 1.00 0.00 C ATOM 0 HA PRO A 103 -78.740 30.758 -75.681 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -79.872 31.972 -77.978 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -79.234 32.883 -76.624 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -77.928 32.223 -79.247 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -77.846 33.704 -78.314 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -75.788 31.971 -78.282 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -76.229 32.835 -76.823 1.00 0.00 H new ATOM 1630 N ARG A 104 -80.283 29.209 -76.911 1.00 0.00 N ATOM 1631 CA ARG A 104 -80.916 27.995 -77.408 1.00 0.00 C ATOM 1632 C ARG A 104 -81.393 28.174 -78.842 1.00 0.00 C ATOM 1633 O ARG A 104 -81.531 27.201 -79.572 1.00 0.00 O ATOM 1634 CB ARG A 104 -82.064 27.533 -76.507 1.00 0.00 C ATOM 1635 CG ARG A 104 -83.356 28.314 -76.649 1.00 0.00 C ATOM 1636 CD ARG A 104 -84.464 27.652 -75.849 1.00 0.00 C ATOM 1637 NE ARG A 104 -85.763 28.287 -76.052 1.00 0.00 N ATOM 1638 CZ ARG A 104 -86.829 28.042 -75.292 1.00 0.00 C ATOM 1639 NH1 ARG A 104 -86.713 27.250 -74.233 1.00 0.00 N ATOM 1640 NH2 ARG A 104 -88.002 28.592 -75.581 1.00 0.00 N ATOM 0 H ARG A 104 -80.796 29.685 -76.169 1.00 0.00 H new ATOM 0 HA ARG A 104 -80.158 27.212 -77.393 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -82.269 26.483 -76.717 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -81.736 27.592 -75.469 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -83.210 29.337 -76.303 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -83.641 28.371 -77.700 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -84.530 26.601 -76.129 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -84.210 27.684 -74.789 1.00 0.00 H new ATOM 0 HE ARG A 104 -85.859 28.954 -76.817 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -85.811 26.833 -74.005 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -87.526 27.059 -73.648 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -88.091 29.207 -76.390 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -88.814 28.400 -74.994 1.00 0.00 H new ATOM 1654 N ALA A 105 -81.656 29.416 -79.236 1.00 0.00 N ATOM 1655 CA ALA A 105 -81.973 29.718 -80.628 1.00 0.00 C ATOM 1656 C ALA A 105 -80.857 29.212 -81.538 1.00 0.00 C ATOM 1657 O ALA A 105 -81.111 28.604 -82.579 1.00 0.00 O ATOM 1658 CB ALA A 105 -82.182 31.213 -80.816 1.00 0.00 C ATOM 0 H ALA A 105 -81.656 30.226 -78.615 1.00 0.00 H new ATOM 0 HA ALA A 105 -82.900 29.210 -80.896 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -82.417 31.419 -81.860 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -83.006 31.547 -80.185 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -81.273 31.745 -80.537 1.00 0.00 H new ATOM 1664 N GLU A 106 -79.618 29.433 -81.111 1.00 0.00 N ATOM 1665 CA GLU A 106 -78.462 28.962 -81.851 1.00 0.00 C ATOM 1666 C GLU A 106 -78.291 27.464 -81.668 1.00 0.00 C ATOM 1667 O GLU A 106 -77.939 26.755 -82.606 1.00 0.00 O ATOM 1668 CB GLU A 106 -77.201 29.701 -81.403 1.00 0.00 C ATOM 1669 CG GLU A 106 -77.065 31.077 -82.024 1.00 0.00 C ATOM 1670 CD GLU A 106 -76.979 30.999 -83.532 1.00 0.00 C ATOM 1671 OE1 GLU A 106 -75.871 30.746 -84.053 1.00 0.00 O ATOM 1672 OE2 GLU A 106 -78.017 31.146 -84.205 1.00 0.00 O ATOM 0 H GLU A 106 -79.393 29.937 -80.253 1.00 0.00 H new ATOM 0 HA GLU A 106 -78.623 29.166 -82.909 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -77.211 29.798 -80.317 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -76.326 29.104 -81.662 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -77.918 31.692 -81.739 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -76.174 31.567 -81.633 1.00 0.00 H new ATOM 1679 N PHE A 107 -78.562 26.988 -80.459 1.00 0.00 N ATOM 1680 CA PHE A 107 -78.464 25.567 -80.157 1.00 0.00 C ATOM 1681 C PHE A 107 -79.423 24.763 -81.033 1.00 0.00 C ATOM 1682 O PHE A 107 -79.037 23.764 -81.638 1.00 0.00 O ATOM 1683 CB PHE A 107 -78.763 25.318 -78.675 1.00 0.00 C ATOM 1684 CG PHE A 107 -78.584 23.885 -78.259 1.00 0.00 C ATOM 1685 CD1 PHE A 107 -77.338 23.413 -77.885 1.00 0.00 C ATOM 1686 CD2 PHE A 107 -79.658 23.008 -78.253 1.00 0.00 C ATOM 1687 CE1 PHE A 107 -77.164 22.096 -77.511 1.00 0.00 C ATOM 1688 CE2 PHE A 107 -79.491 21.690 -77.879 1.00 0.00 C ATOM 1689 CZ PHE A 107 -78.241 21.233 -77.509 1.00 0.00 C ATOM 0 H PHE A 107 -78.852 27.567 -79.671 1.00 0.00 H new ATOM 0 HA PHE A 107 -77.447 25.239 -80.370 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -78.110 25.948 -78.070 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -79.787 25.624 -78.463 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -76.491 24.084 -77.886 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -80.636 23.360 -78.544 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -76.186 21.741 -77.220 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -80.336 21.017 -77.876 1.00 0.00 H new ATOM 0 HZ PHE A 107 -78.107 20.202 -77.218 1.00 0.00 H new ATOM 1699 N LEU A 108 -80.670 25.215 -81.106 1.00 0.00 N ATOM 1700 CA LEU A 108 -81.686 24.547 -81.909 1.00 0.00 C ATOM 1701 C LEU A 108 -81.375 24.682 -83.392 1.00 0.00 C ATOM 1702 O LEU A 108 -81.698 23.796 -84.182 1.00 0.00 O ATOM 1703 CB LEU A 108 -83.073 25.117 -81.607 1.00 0.00 C ATOM 1704 CG LEU A 108 -83.561 24.902 -80.173 1.00 0.00 C ATOM 1705 CD1 LEU A 108 -84.944 25.507 -79.980 1.00 0.00 C ATOM 1706 CD2 LEU A 108 -83.576 23.420 -79.838 1.00 0.00 C ATOM 0 H LEU A 108 -81.002 26.046 -80.616 1.00 0.00 H new ATOM 0 HA LEU A 108 -81.680 23.489 -81.649 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -83.063 26.187 -81.815 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -83.792 24.666 -82.291 1.00 0.00 H new ATOM 0 HG LEU A 108 -82.872 25.405 -79.495 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -85.273 25.343 -78.954 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -84.904 26.577 -80.182 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -85.647 25.034 -80.666 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -83.925 23.282 -78.815 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -84.245 22.899 -80.523 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -82.569 23.015 -79.935 1.00 0.00 H new ATOM 1718 N LYS A 109 -80.748 25.792 -83.763 1.00 0.00 N ATOM 1719 CA LYS A 109 -80.320 26.011 -85.138 1.00 0.00 C ATOM 1720 C LYS A 109 -79.279 24.960 -85.535 1.00 0.00 C ATOM 1721 O LYS A 109 -79.390 24.326 -86.588 1.00 0.00 O ATOM 1722 CB LYS A 109 -79.760 27.433 -85.279 1.00 0.00 C ATOM 1723 CG LYS A 109 -79.454 27.861 -86.709 1.00 0.00 C ATOM 1724 CD LYS A 109 -78.031 27.515 -87.128 1.00 0.00 C ATOM 1725 CE LYS A 109 -76.996 28.172 -86.222 1.00 0.00 C ATOM 1726 NZ LYS A 109 -77.099 29.657 -86.221 1.00 0.00 N ATOM 0 H LYS A 109 -80.524 26.557 -83.127 1.00 0.00 H new ATOM 0 HA LYS A 109 -81.172 25.909 -85.811 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -80.476 28.134 -84.850 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -78.847 27.509 -84.689 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -80.157 27.378 -87.388 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -79.606 28.936 -86.804 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -77.899 26.433 -87.105 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -77.868 27.835 -88.157 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -77.121 27.802 -85.205 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -75.997 27.881 -86.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -76.252 30.063 -85.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -77.174 30.000 -87.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -77.943 29.946 -85.687 1.00 0.00 H new ATOM 1740 N GLU A 110 -78.288 24.764 -84.673 1.00 0.00 N ATOM 1741 CA GLU A 110 -77.229 23.791 -84.923 1.00 0.00 C ATOM 1742 C GLU A 110 -77.770 22.369 -84.826 1.00 0.00 C ATOM 1743 O GLU A 110 -77.426 21.503 -85.628 1.00 0.00 O ATOM 1744 CB GLU A 110 -76.088 23.979 -83.923 1.00 0.00 C ATOM 1745 CG GLU A 110 -75.527 25.392 -83.884 1.00 0.00 C ATOM 1746 CD GLU A 110 -74.777 25.789 -85.141 1.00 0.00 C ATOM 1747 OE1 GLU A 110 -75.275 25.518 -86.256 1.00 0.00 O ATOM 1748 OE2 GLU A 110 -73.702 26.414 -85.009 1.00 0.00 O ATOM 0 H GLU A 110 -78.195 25.268 -83.791 1.00 0.00 H new ATOM 0 HA GLU A 110 -76.850 23.954 -85.932 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -76.443 23.712 -82.928 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -75.284 23.286 -84.171 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -76.346 26.093 -83.724 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -74.857 25.483 -83.029 1.00 0.00 H new ATOM 1755 N LEU A 111 -78.624 22.130 -83.840 1.00 0.00 N ATOM 1756 CA LEU A 111 -79.250 20.827 -83.673 1.00 0.00 C ATOM 1757 C LEU A 111 -80.080 20.508 -84.914 1.00 0.00 C ATOM 1758 O LEU A 111 -80.136 19.364 -85.368 1.00 0.00 O ATOM 1759 CB LEU A 111 -80.125 20.827 -82.409 1.00 0.00 C ATOM 1760 CG LEU A 111 -80.386 19.459 -81.764 1.00 0.00 C ATOM 1761 CD1 LEU A 111 -81.013 19.646 -80.396 1.00 0.00 C ATOM 1762 CD2 LEU A 111 -81.290 18.595 -82.631 1.00 0.00 C ATOM 0 H LEU A 111 -78.899 22.823 -83.143 1.00 0.00 H new ATOM 0 HA LEU A 111 -78.486 20.059 -83.555 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -79.654 21.471 -81.667 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -81.086 21.277 -82.658 1.00 0.00 H new ATOM 0 HG LEU A 111 -79.428 18.948 -81.663 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -81.196 18.671 -79.943 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -80.338 20.220 -79.762 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -81.957 20.181 -80.499 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -81.453 17.634 -82.143 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -82.247 19.097 -82.772 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -80.819 18.434 -83.600 1.00 0.00 H new ATOM 1774 N ARG A 112 -80.700 21.539 -85.474 1.00 0.00 N ATOM 1775 CA ARG A 112 -81.509 21.389 -86.670 1.00 0.00 C ATOM 1776 C ARG A 112 -80.663 20.934 -87.856 1.00 0.00 C ATOM 1777 O ARG A 112 -81.067 20.026 -88.584 1.00 0.00 O ATOM 1778 CB ARG A 112 -82.232 22.699 -87.004 1.00 0.00 C ATOM 1779 CG ARG A 112 -83.064 22.634 -88.276 1.00 0.00 C ATOM 1780 CD ARG A 112 -84.172 21.594 -88.183 1.00 0.00 C ATOM 1781 NE ARG A 112 -85.166 21.928 -87.161 1.00 0.00 N ATOM 1782 CZ ARG A 112 -86.389 21.395 -87.112 1.00 0.00 C ATOM 1783 NH1 ARG A 112 -86.764 20.502 -88.025 1.00 0.00 N ATOM 1784 NH2 ARG A 112 -87.236 21.756 -86.153 1.00 0.00 N ATOM 0 H ARG A 112 -80.655 22.492 -85.114 1.00 0.00 H new ATOM 0 HA ARG A 112 -82.255 20.620 -86.471 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -82.880 22.968 -86.170 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -81.494 23.495 -87.104 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -83.502 23.613 -88.473 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -82.416 22.399 -89.121 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -84.666 21.505 -89.151 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -83.735 20.621 -87.957 1.00 0.00 H new ATOM 0 HE ARG A 112 -84.909 22.607 -86.445 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -86.117 20.224 -88.763 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -87.699 20.095 -87.987 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -86.952 22.441 -85.453 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -88.170 21.348 -86.117 1.00 0.00 H new ATOM 1798 N GLN A 113 -79.491 21.545 -88.052 1.00 0.00 N ATOM 1799 CA GLN A 113 -78.629 21.157 -89.160 1.00 0.00 C ATOM 1800 C GLN A 113 -78.186 19.706 -88.991 1.00 0.00 C ATOM 1801 O GLN A 113 -78.122 18.955 -89.959 1.00 0.00 O ATOM 1802 CB GLN A 113 -77.404 22.082 -89.295 1.00 0.00 C ATOM 1803 CG GLN A 113 -76.281 21.804 -88.303 1.00 0.00 C ATOM 1804 CD GLN A 113 -74.946 22.388 -88.730 1.00 0.00 C ATOM 1805 OE1 GLN A 113 -74.169 21.733 -89.437 1.00 0.00 O ATOM 1806 NE2 GLN A 113 -74.653 23.603 -88.292 1.00 0.00 N ATOM 0 H GLN A 113 -79.126 22.297 -87.467 1.00 0.00 H new ATOM 0 HA GLN A 113 -79.207 21.255 -90.079 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -77.007 21.991 -90.306 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -77.731 23.115 -89.172 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -76.555 22.213 -87.331 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -76.175 20.727 -88.177 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -75.321 24.111 -87.711 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -73.760 24.031 -88.535 1.00 0.00 H new ATOM 1815 N VAL A 114 -77.911 19.312 -87.752 1.00 0.00 N ATOM 1816 CA VAL A 114 -77.505 17.943 -87.455 1.00 0.00 C ATOM 1817 C VAL A 114 -78.651 16.972 -87.719 1.00 0.00 C ATOM 1818 O VAL A 114 -78.451 15.904 -88.297 1.00 0.00 O ATOM 1819 CB VAL A 114 -77.037 17.801 -85.990 1.00 0.00 C ATOM 1820 CG1 VAL A 114 -76.770 16.345 -85.642 1.00 0.00 C ATOM 1821 CG2 VAL A 114 -75.794 18.644 -85.745 1.00 0.00 C ATOM 0 H VAL A 114 -77.962 19.922 -86.936 1.00 0.00 H new ATOM 0 HA VAL A 114 -76.670 17.702 -88.112 1.00 0.00 H new ATOM 0 HB VAL A 114 -77.836 18.162 -85.342 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -76.442 16.273 -84.605 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -77.684 15.766 -85.774 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -75.993 15.951 -86.297 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -75.477 18.533 -84.708 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -74.993 18.313 -86.406 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -76.020 19.691 -85.945 1.00 0.00 H new ATOM 1831 N CYS A 115 -79.851 17.363 -87.304 1.00 0.00 N ATOM 1832 CA CYS A 115 -81.049 16.560 -87.517 1.00 0.00 C ATOM 1833 C CYS A 115 -81.255 16.274 -89.003 1.00 0.00 C ATOM 1834 O CYS A 115 -81.811 15.242 -89.375 1.00 0.00 O ATOM 1835 CB CYS A 115 -82.272 17.284 -86.944 1.00 0.00 C ATOM 1836 SG CYS A 115 -83.829 16.387 -87.144 1.00 0.00 S ATOM 0 H CYS A 115 -80.020 18.241 -86.813 1.00 0.00 H new ATOM 0 HA CYS A 115 -80.922 15.608 -87.001 1.00 0.00 H new ATOM 0 HB2 CYS A 115 -82.106 17.468 -85.883 1.00 0.00 H new ATOM 0 HB3 CYS A 115 -82.362 18.257 -87.426 1.00 0.00 H new ATOM 0 HG CYS A 115 -83.717 15.536 -88.121 1.00 0.00 H new ATOM 1842 N VAL A 116 -80.812 17.202 -89.842 1.00 0.00 N ATOM 1843 CA VAL A 116 -80.898 17.035 -91.285 1.00 0.00 C ATOM 1844 C VAL A 116 -79.713 16.227 -91.811 1.00 0.00 C ATOM 1845 O VAL A 116 -79.896 15.212 -92.482 1.00 0.00 O ATOM 1846 CB VAL A 116 -80.946 18.400 -92.006 1.00 0.00 C ATOM 1847 CG1 VAL A 116 -80.970 18.217 -93.517 1.00 0.00 C ATOM 1848 CG2 VAL A 116 -82.152 19.204 -91.546 1.00 0.00 C ATOM 0 H VAL A 116 -80.388 18.081 -89.545 1.00 0.00 H new ATOM 0 HA VAL A 116 -81.822 16.495 -91.492 1.00 0.00 H new ATOM 0 HB VAL A 116 -80.043 18.952 -91.747 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -81.004 19.193 -94.001 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -80.072 17.686 -93.833 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -81.851 17.641 -93.800 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -82.169 20.163 -92.065 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -83.065 18.653 -91.772 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -82.088 19.374 -90.471 1.00 0.00 H new ATOM 1858 N LYS A 117 -78.507 16.673 -91.466 1.00 0.00 N ATOM 1859 CA LYS A 117 -77.267 16.094 -91.992 1.00 0.00 C ATOM 1860 C LYS A 117 -77.123 14.609 -91.674 1.00 0.00 C ATOM 1861 O LYS A 117 -76.466 13.877 -92.412 1.00 0.00 O ATOM 1862 CB LYS A 117 -76.067 16.852 -91.444 1.00 0.00 C ATOM 1863 CG LYS A 117 -75.957 18.261 -91.988 1.00 0.00 C ATOM 1864 CD LYS A 117 -75.052 19.109 -91.125 1.00 0.00 C ATOM 1865 CE LYS A 117 -73.597 18.685 -91.232 1.00 0.00 C ATOM 1866 NZ LYS A 117 -72.750 19.369 -90.218 1.00 0.00 N ATOM 0 H LYS A 117 -78.359 17.444 -90.815 1.00 0.00 H new ATOM 0 HA LYS A 117 -77.311 16.188 -93.077 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -76.136 16.893 -90.357 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -75.157 16.303 -91.686 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -75.570 18.232 -93.007 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -76.947 18.714 -92.036 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -75.147 20.154 -91.419 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -75.374 19.040 -90.086 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -73.522 17.606 -91.101 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -73.224 18.912 -92.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -71.855 19.666 -90.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -73.251 20.204 -89.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -72.551 18.715 -89.434 1.00 0.00 H new ATOM 1880 N GLY A 118 -77.724 14.174 -90.572 1.00 0.00 N ATOM 1881 CA GLY A 118 -77.648 12.776 -90.192 1.00 0.00 C ATOM 1882 C GLY A 118 -78.287 11.860 -91.218 1.00 0.00 C ATOM 1883 O GLY A 118 -77.749 10.799 -91.537 1.00 0.00 O ATOM 0 H GLY A 118 -78.261 14.763 -89.936 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -76.603 12.495 -90.060 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -78.140 12.637 -89.229 1.00 0.00 H new ATOM 1887 N GLY A 119 -79.430 12.279 -91.743 1.00 0.00 N ATOM 1888 CA GLY A 119 -80.122 11.484 -92.737 1.00 0.00 C ATOM 1889 C GLY A 119 -79.793 11.934 -94.143 1.00 0.00 C ATOM 1890 O GLY A 119 -79.679 11.119 -95.057 1.00 0.00 O ATOM 0 H GLY A 119 -79.890 13.156 -91.498 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -79.850 10.435 -92.618 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -81.198 11.555 -92.575 1.00 0.00 H new