USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 877 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 96 ASN : amide:sc= -0.0785 X(o=1.2,f=0.7) USER MOD Set 1.2: A 97 SER OG : rot 141:sc= 1.24 USER MOD Set 2.1: A 27 THR OG1 : rot -142:sc= 1.14 USER MOD Set 2.2: A 31 THR OG1 : rot -144:sc= 2.02 USER MOD Set 3.1: A 19 SER OG : rot 180:sc= 0.41 USER MOD Set 3.2: A 37 LYS NZ :NH3+ 161:sc= 2.27 (180deg=1.76) USER MOD Set 4.1: A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 66 SER OG : rot 78:sc= 1.21 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= 0.977 (180deg=0.879) USER MOD Single : A 3 LYS NZ :NH3+ 167:sc= 2.43 (180deg=2.23) USER MOD Single : A 7 LYS NZ :NH3+ -139:sc= 2.44 (180deg=0.979) USER MOD Single : A 10 SER OG : rot -55:sc= 1.98 USER MOD Single : A 11 TYR OH : rot -12:sc= 1.25 USER MOD Single : A 12 THR OG1 : rot 39:sc= 1.02 USER MOD Single : A 13 MET CE :methyl -169:sc= -0.0664 (180deg=-0.251) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -173:sc= 2.51 (180deg=2.3) USER MOD Single : A 22 LYS NZ :NH3+ 160:sc= 2.58 (180deg=1.87) USER MOD Single : A 24 MET CE :methyl -152:sc= -0.197 (180deg=-1.62) USER MOD Single : A 28 GLN : amide:sc= -0.545 K(o=-0.54,f=-2.5) USER MOD Single : A 29 HIS : no HE2:sc= 1.24 K(o=1.2,f=-4.2!) USER MOD Single : A 32 THR OG1 : rot 135:sc= 0.337 USER MOD Single : A 35 LYS NZ :NH3+ -132:sc= 2.22 (180deg=0.631) USER MOD Single : A 38 TYR OH : rot 93:sc= -0.0295 USER MOD Single : A 46 LYS NZ :NH3+ 166:sc= 2.06 (180deg=1.5) USER MOD Single : A 55 ASN : amide:sc= 1.19 K(o=1.2,f=-0.55) USER MOD Single : A 56 LYS NZ :NH3+ 134:sc= 3.54 (180deg=0.873) USER MOD Single : A 58 LYS NZ :NH3+ -164:sc= 2.21 (180deg=0.659) USER MOD Single : A 65 SER OG : rot -16:sc= 0.734 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= 1.16 K(o=1.2,f=-0.035) USER MOD Single : A 73 THR OG1 : rot -78:sc= 1.27 USER MOD Single : A 74 ASN : amide:sc= 0.189 K(o=0.19,f=-2.2!) USER MOD Single : A 75 SER OG : rot -80:sc= 0.664 USER MOD Single : A 77 THR OG1 : rot -143:sc= 1.26 USER MOD Single : A 78 ASN : amide:sc= 0.876 K(o=0.88,f=-0.16) USER MOD Single : A 88 SER OG : rot 160:sc= 0 USER MOD Single : A 89 TYR OH : rot -8:sc= 1.03 USER MOD Single : A 100 THR OG1 : rot 64:sc= 0.761 USER MOD Single : A 102 HIS : no HE2:sc= 0.0713 K(o=0.071,f=-7!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 1.24 (180deg=1.24) USER MOD Single : A 108 SER OG : rot -68:sc= 1.1 USER MOD Single : A 109 SER OG : rot -24:sc= 1.1 USER MOD Single : A 112 LYS NZ :NH3+ 157:sc= 2.43 (180deg=1.21) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -78.893 45.447 102.735 1.00 0.00 N ATOM 2 CA MET A 1 -78.396 45.085 101.387 1.00 0.00 C ATOM 3 C MET A 1 -76.994 44.486 101.441 1.00 0.00 C ATOM 4 O MET A 1 -76.816 43.338 101.052 1.00 0.00 O ATOM 5 CB MET A 1 -78.450 46.275 100.414 1.00 0.00 C ATOM 6 CG MET A 1 -79.775 46.300 99.651 1.00 0.00 C ATOM 7 SD MET A 1 -80.033 44.825 98.624 1.00 0.00 S ATOM 8 CE MET A 1 -81.247 45.476 97.447 1.00 0.00 C ATOM 0 H1 MET A 1 -79.907 45.674 102.682 1.00 0.00 H new ATOM 0 H2 MET A 1 -78.751 44.647 103.384 1.00 0.00 H new ATOM 0 H3 MET A 1 -78.371 46.275 103.087 1.00 0.00 H new ATOM 0 HA MET A 1 -79.069 44.318 101.004 1.00 0.00 H new ATOM 0 HB2 MET A 1 -78.327 47.207 100.966 1.00 0.00 H new ATOM 0 HB3 MET A 1 -77.621 46.210 99.709 1.00 0.00 H new ATOM 0 HG2 MET A 1 -80.596 46.388 100.363 1.00 0.00 H new ATOM 0 HG3 MET A 1 -79.806 47.187 99.018 1.00 0.00 H new ATOM 0 HE1 MET A 1 -81.520 44.696 96.737 1.00 0.00 H new ATOM 0 HE2 MET A 1 -82.136 45.803 97.985 1.00 0.00 H new ATOM 0 HE3 MET A 1 -80.816 46.321 96.910 1.00 0.00 H new ATOM 20 N GLU A 2 -76.018 45.258 101.919 1.00 0.00 N ATOM 21 CA GLU A 2 -74.658 44.897 102.338 1.00 0.00 C ATOM 22 C GLU A 2 -74.539 43.528 103.041 1.00 0.00 C ATOM 23 O GLU A 2 -73.784 42.663 102.594 1.00 0.00 O ATOM 24 CB GLU A 2 -74.110 46.060 103.206 1.00 0.00 C ATOM 25 CG GLU A 2 -74.823 46.373 104.552 1.00 0.00 C ATOM 26 CD GLU A 2 -76.359 46.361 104.460 1.00 0.00 C ATOM 27 OE1 GLU A 2 -76.932 47.147 103.669 1.00 0.00 O ATOM 28 OE2 GLU A 2 -76.962 45.362 104.915 1.00 0.00 O ATOM 0 H GLU A 2 -76.175 46.259 102.036 1.00 0.00 H new ATOM 0 HA GLU A 2 -74.050 44.764 101.443 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -73.064 45.847 103.425 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -74.131 46.966 102.600 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -74.508 45.643 105.298 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -74.497 47.351 104.906 1.00 0.00 H new ATOM 35 N LYS A 3 -75.309 43.328 104.117 1.00 0.00 N ATOM 36 CA LYS A 3 -75.421 42.123 104.941 1.00 0.00 C ATOM 37 C LYS A 3 -76.876 41.757 105.210 1.00 0.00 C ATOM 38 O LYS A 3 -77.178 40.564 105.283 1.00 0.00 O ATOM 39 CB LYS A 3 -74.717 42.330 106.290 1.00 0.00 C ATOM 40 CG LYS A 3 -73.195 42.188 106.204 1.00 0.00 C ATOM 41 CD LYS A 3 -72.609 42.160 107.621 1.00 0.00 C ATOM 42 CE LYS A 3 -71.145 41.721 107.573 1.00 0.00 C ATOM 43 NZ LYS A 3 -70.884 40.645 108.551 1.00 0.00 N ATOM 0 H LYS A 3 -75.920 44.069 104.461 1.00 0.00 H new ATOM 0 HA LYS A 3 -74.948 41.313 104.386 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -74.962 43.321 106.672 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -75.103 41.607 107.009 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -72.933 41.274 105.671 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -72.772 43.019 105.639 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -72.686 43.148 108.075 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -73.182 41.476 108.247 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -70.898 41.373 106.570 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -70.499 42.573 107.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -69.958 40.214 108.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -70.883 41.042 109.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -71.626 39.920 108.476 1.00 0.00 H new ATOM 57 N LEU A 4 -77.770 42.746 105.349 1.00 0.00 N ATOM 58 CA LEU A 4 -79.216 42.550 105.412 1.00 0.00 C ATOM 59 C LEU A 4 -79.710 42.153 104.011 1.00 0.00 C ATOM 60 O LEU A 4 -80.140 42.998 103.223 1.00 0.00 O ATOM 61 CB LEU A 4 -79.884 43.818 105.990 1.00 0.00 C ATOM 62 CG LEU A 4 -81.270 43.585 106.629 1.00 0.00 C ATOM 63 CD1 LEU A 4 -81.814 44.919 107.149 1.00 0.00 C ATOM 64 CD2 LEU A 4 -82.310 42.988 105.675 1.00 0.00 C ATOM 0 H LEU A 4 -77.496 43.726 105.422 1.00 0.00 H new ATOM 0 HA LEU A 4 -79.491 41.740 106.087 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -79.222 44.251 106.740 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -79.986 44.554 105.192 1.00 0.00 H new ATOM 0 HG LEU A 4 -81.114 42.860 107.428 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -82.793 44.761 107.602 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -81.131 45.325 107.895 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -81.906 45.622 106.321 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -83.255 42.856 106.203 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -82.457 43.661 104.830 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -81.959 42.022 105.313 1.00 0.00 H new ATOM 76 N ARG A 5 -79.557 40.864 103.696 1.00 0.00 N ATOM 77 CA ARG A 5 -80.005 40.170 102.485 1.00 0.00 C ATOM 78 C ARG A 5 -80.073 38.661 102.773 1.00 0.00 C ATOM 79 O ARG A 5 -79.480 38.182 103.745 1.00 0.00 O ATOM 80 CB ARG A 5 -79.034 40.480 101.318 1.00 0.00 C ATOM 81 CG ARG A 5 -77.687 39.752 101.470 1.00 0.00 C ATOM 82 CD ARG A 5 -76.593 40.118 100.466 1.00 0.00 C ATOM 83 NE ARG A 5 -77.028 40.050 99.059 1.00 0.00 N ATOM 84 CZ ARG A 5 -77.075 41.040 98.175 1.00 0.00 C ATOM 85 NH1 ARG A 5 -76.963 42.300 98.523 1.00 0.00 N ATOM 86 NH2 ARG A 5 -77.227 40.783 96.899 1.00 0.00 N ATOM 0 H ARG A 5 -79.078 40.227 104.333 1.00 0.00 H new ATOM 0 HA ARG A 5 -80.998 40.514 102.194 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -79.498 40.189 100.375 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -78.860 41.555 101.269 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -77.307 39.945 102.473 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -77.869 38.680 101.399 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -76.241 41.127 100.679 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -75.745 39.448 100.607 1.00 0.00 H new ATOM 0 HE ARG A 5 -77.328 39.134 98.725 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -76.834 42.549 99.504 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -77.004 43.031 97.813 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -77.310 39.818 96.580 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -77.262 41.548 96.225 1.00 0.00 H new ATOM 100 N ILE A 6 -80.696 37.889 101.879 1.00 0.00 N ATOM 101 CA ILE A 6 -80.617 36.423 101.879 1.00 0.00 C ATOM 102 C ILE A 6 -79.257 35.974 101.295 1.00 0.00 C ATOM 103 O ILE A 6 -79.127 35.671 100.107 1.00 0.00 O ATOM 104 CB ILE A 6 -81.887 35.817 101.225 1.00 0.00 C ATOM 105 CG1 ILE A 6 -81.922 34.277 101.322 1.00 0.00 C ATOM 106 CG2 ILE A 6 -82.144 36.272 99.775 1.00 0.00 C ATOM 107 CD1 ILE A 6 -82.106 33.762 102.755 1.00 0.00 C ATOM 0 H ILE A 6 -81.275 38.265 101.128 1.00 0.00 H new ATOM 0 HA ILE A 6 -80.626 36.020 102.892 1.00 0.00 H new ATOM 0 HB ILE A 6 -82.706 36.223 101.819 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -82.734 33.899 100.701 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -80.995 33.873 100.915 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -83.051 35.798 99.400 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -82.263 37.355 99.749 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -81.300 35.985 99.148 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -82.122 32.672 102.751 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -81.281 34.110 103.376 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -83.047 34.137 103.158 1.00 0.00 H new ATOM 119 N LYS A 7 -78.204 36.038 102.125 1.00 0.00 N ATOM 120 CA LYS A 7 -76.776 36.050 101.737 1.00 0.00 C ATOM 121 C LYS A 7 -76.383 34.993 100.698 1.00 0.00 C ATOM 122 O LYS A 7 -76.062 35.344 99.562 1.00 0.00 O ATOM 123 CB LYS A 7 -75.869 35.982 102.980 1.00 0.00 C ATOM 124 CG LYS A 7 -76.142 37.066 104.041 1.00 0.00 C ATOM 125 CD LYS A 7 -76.828 36.463 105.280 1.00 0.00 C ATOM 126 CE LYS A 7 -77.305 37.500 106.304 1.00 0.00 C ATOM 127 NZ LYS A 7 -76.220 38.413 106.721 1.00 0.00 N ATOM 0 H LYS A 7 -78.327 36.085 103.136 1.00 0.00 H new ATOM 0 HA LYS A 7 -76.622 37.004 101.233 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -75.985 35.002 103.444 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -74.830 36.061 102.659 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -75.204 37.538 104.334 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -76.773 37.846 103.615 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -77.683 35.870 104.955 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -76.134 35.780 105.769 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -78.122 38.081 105.876 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -77.703 36.987 107.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -76.281 38.580 107.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -75.300 37.985 106.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -76.315 39.318 106.217 1.00 0.00 H new ATOM 141 N GLY A 8 -76.417 33.707 101.066 1.00 0.00 N ATOM 142 CA GLY A 8 -76.015 32.600 100.188 1.00 0.00 C ATOM 143 C GLY A 8 -76.774 32.588 98.857 1.00 0.00 C ATOM 144 O GLY A 8 -76.186 32.347 97.804 1.00 0.00 O ATOM 0 H GLY A 8 -76.727 33.402 101.989 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -74.945 32.670 99.990 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -76.182 31.655 100.704 1.00 0.00 H new ATOM 148 N MET A 9 -78.064 32.931 98.877 1.00 0.00 N ATOM 149 CA MET A 9 -78.907 32.968 97.680 1.00 0.00 C ATOM 150 C MET A 9 -78.704 34.233 96.822 1.00 0.00 C ATOM 151 O MET A 9 -79.297 34.318 95.751 1.00 0.00 O ATOM 152 CB MET A 9 -80.388 32.822 98.081 1.00 0.00 C ATOM 153 CG MET A 9 -80.669 31.625 99.006 1.00 0.00 C ATOM 154 SD MET A 9 -80.121 30.011 98.385 1.00 0.00 S ATOM 155 CE MET A 9 -80.524 28.984 99.824 1.00 0.00 C ATOM 0 H MET A 9 -78.557 33.193 99.731 1.00 0.00 H new ATOM 0 HA MET A 9 -78.603 32.128 97.055 1.00 0.00 H new ATOM 0 HB2 MET A 9 -80.711 33.736 98.578 1.00 0.00 H new ATOM 0 HB3 MET A 9 -80.990 32.720 97.178 1.00 0.00 H new ATOM 0 HG2 MET A 9 -80.186 31.809 99.966 1.00 0.00 H new ATOM 0 HG3 MET A 9 -81.742 31.577 99.194 1.00 0.00 H new ATOM 0 HE1 MET A 9 -80.252 27.948 99.620 1.00 0.00 H new ATOM 0 HE2 MET A 9 -79.969 29.340 100.692 1.00 0.00 H new ATOM 0 HE3 MET A 9 -81.593 29.045 100.027 1.00 0.00 H new ATOM 165 N SER A 10 -77.901 35.219 97.264 1.00 0.00 N ATOM 166 CA SER A 10 -77.870 36.554 96.639 1.00 0.00 C ATOM 167 C SER A 10 -76.512 37.278 96.582 1.00 0.00 C ATOM 168 O SER A 10 -76.449 38.334 95.953 1.00 0.00 O ATOM 169 CB SER A 10 -78.900 37.452 97.330 1.00 0.00 C ATOM 170 OG SER A 10 -78.515 37.678 98.671 1.00 0.00 O ATOM 0 H SER A 10 -77.264 35.115 98.054 1.00 0.00 H new ATOM 0 HA SER A 10 -78.105 36.365 95.592 1.00 0.00 H new ATOM 0 HB2 SER A 10 -78.982 38.401 96.801 1.00 0.00 H new ATOM 0 HB3 SER A 10 -79.884 36.984 97.298 1.00 0.00 H new ATOM 0 HG SER A 10 -78.392 36.818 99.125 1.00 0.00 H new ATOM 176 N TYR A 11 -75.439 36.782 97.211 1.00 0.00 N ATOM 177 CA TYR A 11 -74.067 37.270 96.983 1.00 0.00 C ATOM 178 C TYR A 11 -73.413 36.633 95.733 1.00 0.00 C ATOM 179 O TYR A 11 -73.854 35.594 95.238 1.00 0.00 O ATOM 180 CB TYR A 11 -73.186 36.959 98.213 1.00 0.00 C ATOM 181 CG TYR A 11 -73.243 37.862 99.436 1.00 0.00 C ATOM 182 CD1 TYR A 11 -73.374 39.264 99.322 1.00 0.00 C ATOM 183 CD2 TYR A 11 -72.991 37.293 100.702 1.00 0.00 C ATOM 184 CE1 TYR A 11 -73.288 40.082 100.468 1.00 0.00 C ATOM 185 CE2 TYR A 11 -72.903 38.105 101.847 1.00 0.00 C ATOM 186 CZ TYR A 11 -73.061 39.503 101.736 1.00 0.00 C ATOM 187 OH TYR A 11 -72.995 40.274 102.855 1.00 0.00 O ATOM 0 H TYR A 11 -75.495 36.028 97.896 1.00 0.00 H new ATOM 0 HA TYR A 11 -74.138 38.345 96.820 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -73.434 35.950 98.543 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -72.150 36.938 97.873 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -73.541 39.711 98.353 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -72.865 36.224 100.793 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -73.396 41.153 100.376 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -72.714 37.658 102.812 1.00 0.00 H new ATOM 0 HH TYR A 11 -72.932 41.218 102.599 1.00 0.00 H new ATOM 197 N THR A 12 -72.283 37.215 95.305 1.00 0.00 N ATOM 198 CA THR A 12 -71.252 36.669 94.399 1.00 0.00 C ATOM 199 C THR A 12 -69.903 37.258 94.841 1.00 0.00 C ATOM 200 O THR A 12 -69.727 38.466 94.679 1.00 0.00 O ATOM 201 CB THR A 12 -71.503 37.045 92.923 1.00 0.00 C ATOM 202 OG1 THR A 12 -71.601 38.445 92.788 1.00 0.00 O ATOM 203 CG2 THR A 12 -72.759 36.413 92.327 1.00 0.00 C ATOM 0 H THR A 12 -72.043 38.159 95.607 1.00 0.00 H new ATOM 0 HA THR A 12 -71.271 35.581 94.459 1.00 0.00 H new ATOM 0 HB THR A 12 -70.649 36.652 92.372 1.00 0.00 H new ATOM 0 HG1 THR A 12 -70.944 38.877 93.373 1.00 0.00 H new ATOM 0 HG21 THR A 12 -72.866 36.725 91.288 1.00 0.00 H new ATOM 0 HG22 THR A 12 -72.677 35.327 92.373 1.00 0.00 H new ATOM 0 HG23 THR A 12 -73.632 36.735 92.894 1.00 0.00 H new ATOM 211 N MET A 13 -69.013 36.474 95.473 1.00 0.00 N ATOM 212 CA MET A 13 -67.902 37.038 96.264 1.00 0.00 C ATOM 213 C MET A 13 -66.514 36.392 96.051 1.00 0.00 C ATOM 214 O MET A 13 -65.840 36.734 95.084 1.00 0.00 O ATOM 215 CB MET A 13 -68.328 37.117 97.747 1.00 0.00 C ATOM 216 CG MET A 13 -69.125 38.381 98.090 1.00 0.00 C ATOM 217 SD MET A 13 -68.259 39.961 97.832 1.00 0.00 S ATOM 218 CE MET A 13 -66.746 39.728 98.810 1.00 0.00 C ATOM 0 H MET A 13 -69.039 35.455 95.453 1.00 0.00 H new ATOM 0 HA MET A 13 -67.727 38.043 95.880 1.00 0.00 H new ATOM 0 HB2 MET A 13 -68.929 36.241 97.991 1.00 0.00 H new ATOM 0 HB3 MET A 13 -67.438 37.077 98.375 1.00 0.00 H new ATOM 0 HG2 MET A 13 -70.036 38.386 97.492 1.00 0.00 H new ATOM 0 HG3 MET A 13 -69.430 38.322 99.135 1.00 0.00 H new ATOM 0 HE1 MET A 13 -66.222 40.679 98.901 1.00 0.00 H new ATOM 0 HE2 MET A 13 -67.007 39.361 99.803 1.00 0.00 H new ATOM 0 HE3 MET A 13 -66.100 39.004 98.314 1.00 0.00 H new ATOM 228 N CYS A 14 -66.005 35.610 97.013 1.00 0.00 N ATOM 229 CA CYS A 14 -64.605 35.780 97.424 1.00 0.00 C ATOM 230 C CYS A 14 -63.556 35.058 96.570 1.00 0.00 C ATOM 231 O CYS A 14 -63.799 34.002 95.994 1.00 0.00 O ATOM 232 CB CYS A 14 -64.469 35.378 98.897 1.00 0.00 C ATOM 233 SG CYS A 14 -64.979 36.698 100.023 1.00 0.00 S ATOM 0 H CYS A 14 -66.519 34.879 97.505 1.00 0.00 H new ATOM 0 HA CYS A 14 -64.381 36.835 97.270 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -65.073 34.490 99.086 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -63.433 35.109 99.103 1.00 0.00 H new ATOM 238 N SER A 15 -62.336 35.607 96.593 1.00 0.00 N ATOM 239 CA SER A 15 -61.140 35.074 95.932 1.00 0.00 C ATOM 240 C SER A 15 -59.942 34.868 96.874 1.00 0.00 C ATOM 241 O SER A 15 -58.881 34.424 96.430 1.00 0.00 O ATOM 242 CB SER A 15 -60.761 35.990 94.764 1.00 0.00 C ATOM 243 OG SER A 15 -60.506 37.296 95.247 1.00 0.00 O ATOM 0 H SER A 15 -62.147 36.474 97.096 1.00 0.00 H new ATOM 0 HA SER A 15 -61.394 34.078 95.570 1.00 0.00 H new ATOM 0 HB2 SER A 15 -59.879 35.601 94.255 1.00 0.00 H new ATOM 0 HB3 SER A 15 -61.567 36.014 94.031 1.00 0.00 H new ATOM 0 HG SER A 15 -60.262 37.880 94.499 1.00 0.00 H new ATOM 249 N GLY A 16 -60.101 35.152 98.173 1.00 0.00 N ATOM 250 CA GLY A 16 -59.088 34.937 99.208 1.00 0.00 C ATOM 251 C GLY A 16 -59.085 33.509 99.773 1.00 0.00 C ATOM 252 O GLY A 16 -59.935 32.686 99.431 1.00 0.00 O ATOM 0 H GLY A 16 -60.965 35.550 98.541 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -58.104 35.158 98.794 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -59.257 35.641 100.023 1.00 0.00 H new ATOM 256 N LYS A 17 -58.106 33.216 100.641 1.00 0.00 N ATOM 257 CA LYS A 17 -57.895 31.897 101.260 1.00 0.00 C ATOM 258 C LYS A 17 -58.928 31.590 102.361 1.00 0.00 C ATOM 259 O LYS A 17 -59.526 32.482 102.957 1.00 0.00 O ATOM 260 CB LYS A 17 -56.463 31.848 101.833 1.00 0.00 C ATOM 261 CG LYS A 17 -55.876 30.423 101.894 1.00 0.00 C ATOM 262 CD LYS A 17 -54.561 30.354 102.687 1.00 0.00 C ATOM 263 CE LYS A 17 -54.743 30.572 104.200 1.00 0.00 C ATOM 264 NZ LYS A 17 -55.362 29.407 104.876 1.00 0.00 N ATOM 0 H LYS A 17 -57.420 33.908 100.941 1.00 0.00 H new ATOM 0 HA LYS A 17 -58.026 31.132 100.495 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -55.813 32.475 101.222 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -56.466 32.275 102.836 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -56.606 29.754 102.350 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -55.703 30.063 100.880 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -54.097 29.382 102.521 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -53.873 31.106 102.300 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -53.773 30.776 104.653 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -55.363 31.453 104.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -55.570 29.650 105.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -56.245 29.152 104.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -54.706 28.601 104.848 1.00 0.00 H new ATOM 278 N PHE A 18 -59.056 30.310 102.700 1.00 0.00 N ATOM 279 CA PHE A 18 -59.859 29.764 103.798 1.00 0.00 C ATOM 280 C PHE A 18 -58.993 28.803 104.636 1.00 0.00 C ATOM 281 O PHE A 18 -57.853 28.523 104.255 1.00 0.00 O ATOM 282 CB PHE A 18 -61.094 29.075 103.178 1.00 0.00 C ATOM 283 CG PHE A 18 -62.069 30.040 102.527 1.00 0.00 C ATOM 284 CD1 PHE A 18 -61.852 30.490 101.209 1.00 0.00 C ATOM 285 CD2 PHE A 18 -63.162 30.537 103.261 1.00 0.00 C ATOM 286 CE1 PHE A 18 -62.677 31.484 100.656 1.00 0.00 C ATOM 287 CE2 PHE A 18 -63.981 31.537 102.711 1.00 0.00 C ATOM 288 CZ PHE A 18 -63.730 32.023 101.415 1.00 0.00 C ATOM 0 H PHE A 18 -58.571 29.576 102.183 1.00 0.00 H new ATOM 0 HA PHE A 18 -60.205 30.543 104.477 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -60.760 28.352 102.433 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -61.615 28.515 103.955 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -61.049 30.069 100.622 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -63.371 30.150 104.247 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -62.502 31.833 99.649 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -64.806 31.934 103.285 1.00 0.00 H new ATOM 0 HZ PHE A 18 -64.346 32.809 101.004 1.00 0.00 H new ATOM 298 N SER A 19 -59.523 28.240 105.728 1.00 0.00 N ATOM 299 CA SER A 19 -59.036 26.973 106.303 1.00 0.00 C ATOM 300 C SER A 19 -60.023 25.832 106.043 1.00 0.00 C ATOM 301 O SER A 19 -61.238 26.034 105.959 1.00 0.00 O ATOM 302 CB SER A 19 -58.811 27.059 107.817 1.00 0.00 C ATOM 303 OG SER A 19 -60.043 27.367 108.419 1.00 0.00 O ATOM 0 H SER A 19 -60.304 28.648 106.242 1.00 0.00 H new ATOM 0 HA SER A 19 -58.083 26.777 105.811 1.00 0.00 H new ATOM 0 HB2 SER A 19 -58.425 26.114 108.200 1.00 0.00 H new ATOM 0 HB3 SER A 19 -58.070 27.824 108.050 1.00 0.00 H new ATOM 0 HG SER A 19 -59.928 27.422 109.391 1.00 0.00 H new ATOM 309 N ILE A 20 -59.474 24.616 105.968 1.00 0.00 N ATOM 310 CA ILE A 20 -60.188 23.378 106.253 1.00 0.00 C ATOM 311 C ILE A 20 -60.132 23.199 107.774 1.00 0.00 C ATOM 312 O ILE A 20 -59.098 22.863 108.346 1.00 0.00 O ATOM 313 CB ILE A 20 -59.629 22.191 105.429 1.00 0.00 C ATOM 314 CG1 ILE A 20 -60.250 20.847 105.863 1.00 0.00 C ATOM 315 CG2 ILE A 20 -58.094 22.069 105.428 1.00 0.00 C ATOM 316 CD1 ILE A 20 -61.755 20.783 105.591 1.00 0.00 C ATOM 0 H ILE A 20 -58.501 24.467 105.702 1.00 0.00 H new ATOM 0 HA ILE A 20 -61.232 23.417 105.941 1.00 0.00 H new ATOM 0 HB ILE A 20 -59.923 22.423 104.405 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -59.753 20.033 105.335 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -60.069 20.693 106.927 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -57.798 21.210 104.826 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -57.657 22.975 105.008 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -57.739 21.935 106.450 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -62.142 19.817 105.915 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -62.258 21.578 106.141 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -61.937 20.908 104.524 1.00 0.00 H new ATOM 328 N ASP A 21 -61.230 23.555 108.434 1.00 0.00 N ATOM 329 CA ASP A 21 -61.288 23.868 109.863 1.00 0.00 C ATOM 330 C ASP A 21 -61.941 22.735 110.683 1.00 0.00 C ATOM 331 O ASP A 21 -61.804 22.680 111.907 1.00 0.00 O ATOM 332 CB ASP A 21 -62.044 25.199 109.981 1.00 0.00 C ATOM 333 CG ASP A 21 -61.473 26.118 111.056 1.00 0.00 C ATOM 334 OD1 ASP A 21 -60.478 26.820 110.745 1.00 0.00 O ATOM 335 OD2 ASP A 21 -62.078 26.141 112.154 1.00 0.00 O ATOM 0 H ASP A 21 -62.137 23.637 107.975 1.00 0.00 H new ATOM 0 HA ASP A 21 -60.287 23.960 110.284 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -62.016 25.712 109.020 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -63.092 24.996 110.204 1.00 0.00 H new ATOM 340 N LYS A 22 -62.626 21.814 109.992 1.00 0.00 N ATOM 341 CA LYS A 22 -62.847 20.407 110.344 1.00 0.00 C ATOM 342 C LYS A 22 -62.916 19.613 109.035 1.00 0.00 C ATOM 343 O LYS A 22 -63.528 20.084 108.076 1.00 0.00 O ATOM 344 CB LYS A 22 -64.155 20.212 111.139 1.00 0.00 C ATOM 345 CG LYS A 22 -64.315 18.786 111.691 1.00 0.00 C ATOM 346 CD LYS A 22 -65.726 18.464 112.213 1.00 0.00 C ATOM 347 CE LYS A 22 -66.839 18.451 111.147 1.00 0.00 C ATOM 348 NZ LYS A 22 -66.570 17.502 110.040 1.00 0.00 N ATOM 0 H LYS A 22 -63.073 22.052 109.107 1.00 0.00 H new ATOM 0 HA LYS A 22 -62.032 20.061 110.980 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -64.180 20.921 111.967 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -65.003 20.444 110.495 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -64.059 18.074 110.906 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -63.599 18.639 112.500 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -65.701 17.489 112.700 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -65.988 19.195 112.978 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -67.785 18.189 111.621 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -66.954 19.455 110.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -67.460 17.280 109.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -65.903 17.932 109.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -66.159 16.628 110.425 1.00 0.00 H new ATOM 362 N GLU A 23 -62.340 18.408 109.066 1.00 0.00 N ATOM 363 CA GLU A 23 -62.442 17.307 108.097 1.00 0.00 C ATOM 364 C GLU A 23 -63.862 17.029 107.576 1.00 0.00 C ATOM 365 O GLU A 23 -64.847 17.598 108.044 1.00 0.00 O ATOM 366 CB GLU A 23 -61.820 16.046 108.747 1.00 0.00 C ATOM 367 CG GLU A 23 -62.312 15.658 110.162 1.00 0.00 C ATOM 368 CD GLU A 23 -63.690 14.975 110.214 1.00 0.00 C ATOM 369 OE1 GLU A 23 -63.711 13.733 110.069 1.00 0.00 O ATOM 370 OE2 GLU A 23 -64.711 15.674 110.423 1.00 0.00 O ATOM 0 H GLU A 23 -61.732 18.152 109.844 1.00 0.00 H new ATOM 0 HA GLU A 23 -61.895 17.604 107.202 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -62.002 15.201 108.084 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -60.740 16.189 108.793 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -61.577 14.992 110.614 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -62.347 16.558 110.776 1.00 0.00 H new ATOM 377 N MET A 24 -63.984 16.131 106.598 1.00 0.00 N ATOM 378 CA MET A 24 -65.274 15.654 106.104 1.00 0.00 C ATOM 379 C MET A 24 -65.820 14.478 106.924 1.00 0.00 C ATOM 380 O MET A 24 -65.141 13.471 107.134 1.00 0.00 O ATOM 381 CB MET A 24 -65.128 15.301 104.623 1.00 0.00 C ATOM 382 CG MET A 24 -65.518 16.518 103.799 1.00 0.00 C ATOM 383 SD MET A 24 -65.058 16.466 102.059 1.00 0.00 S ATOM 384 CE MET A 24 -63.268 16.642 102.250 1.00 0.00 C ATOM 0 H MET A 24 -63.184 15.712 106.124 1.00 0.00 H new ATOM 0 HA MET A 24 -66.011 16.449 106.217 1.00 0.00 H new ATOM 0 HB2 MET A 24 -64.102 15.007 104.403 1.00 0.00 H new ATOM 0 HB3 MET A 24 -65.764 14.453 104.371 1.00 0.00 H new ATOM 0 HG2 MET A 24 -66.598 16.648 103.866 1.00 0.00 H new ATOM 0 HG3 MET A 24 -65.062 17.400 104.250 1.00 0.00 H new ATOM 0 HE1 MET A 24 -62.852 17.117 101.362 1.00 0.00 H new ATOM 0 HE2 MET A 24 -63.054 17.257 103.124 1.00 0.00 H new ATOM 0 HE3 MET A 24 -62.817 15.658 102.379 1.00 0.00 H new ATOM 394 N ALA A 25 -67.085 14.601 107.340 1.00 0.00 N ATOM 395 CA ALA A 25 -67.844 13.605 108.092 1.00 0.00 C ATOM 396 C ALA A 25 -69.172 13.312 107.376 1.00 0.00 C ATOM 397 O ALA A 25 -69.975 14.225 107.173 1.00 0.00 O ATOM 398 CB ALA A 25 -68.055 14.127 109.518 1.00 0.00 C ATOM 0 H ALA A 25 -67.631 15.441 107.150 1.00 0.00 H new ATOM 0 HA ALA A 25 -67.298 12.663 108.149 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -68.621 13.394 110.094 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -67.087 14.292 109.992 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -68.607 15.066 109.484 1.00 0.00 H new ATOM 404 N GLU A 26 -69.377 12.061 106.944 1.00 0.00 N ATOM 405 CA GLU A 26 -70.533 11.662 106.132 1.00 0.00 C ATOM 406 C GLU A 26 -71.818 11.434 106.950 1.00 0.00 C ATOM 407 O GLU A 26 -71.773 11.127 108.141 1.00 0.00 O ATOM 408 CB GLU A 26 -70.180 10.430 105.273 1.00 0.00 C ATOM 409 CG GLU A 26 -70.557 10.660 103.799 1.00 0.00 C ATOM 410 CD GLU A 26 -69.948 9.619 102.866 1.00 0.00 C ATOM 411 OE1 GLU A 26 -70.271 8.430 103.067 1.00 0.00 O ATOM 412 OE2 GLU A 26 -69.196 9.989 101.932 1.00 0.00 O ATOM 0 H GLU A 26 -68.740 11.292 107.150 1.00 0.00 H new ATOM 0 HA GLU A 26 -70.760 12.502 105.475 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -69.113 10.221 105.351 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -70.705 9.554 105.654 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -71.642 10.641 103.699 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -70.226 11.653 103.494 1.00 0.00 H new ATOM 419 N THR A 27 -72.974 11.559 106.288 1.00 0.00 N ATOM 420 CA THR A 27 -74.313 11.570 106.898 1.00 0.00 C ATOM 421 C THR A 27 -75.148 10.336 106.525 1.00 0.00 C ATOM 422 O THR A 27 -74.814 9.576 105.610 1.00 0.00 O ATOM 423 CB THR A 27 -75.080 12.829 106.448 1.00 0.00 C ATOM 424 OG1 THR A 27 -75.358 12.694 105.075 1.00 0.00 O ATOM 425 CG2 THR A 27 -74.346 14.147 106.693 1.00 0.00 C ATOM 0 H THR A 27 -73.006 11.659 105.273 1.00 0.00 H new ATOM 0 HA THR A 27 -74.164 11.563 107.978 1.00 0.00 H new ATOM 0 HB THR A 27 -75.984 12.887 107.054 1.00 0.00 H new ATOM 0 HG1 THR A 27 -75.267 13.565 104.636 1.00 0.00 H new ATOM 0 HG21 THR A 27 -74.962 14.976 106.345 1.00 0.00 H new ATOM 0 HG22 THR A 27 -74.151 14.262 107.759 1.00 0.00 H new ATOM 0 HG23 THR A 27 -73.401 14.144 106.150 1.00 0.00 H new ATOM 433 N GLN A 28 -76.314 10.187 107.176 1.00 0.00 N ATOM 434 CA GLN A 28 -77.376 9.257 106.764 1.00 0.00 C ATOM 435 C GLN A 28 -77.967 9.581 105.375 1.00 0.00 C ATOM 436 O GLN A 28 -78.484 8.691 104.705 1.00 0.00 O ATOM 437 CB GLN A 28 -78.475 9.164 107.849 1.00 0.00 C ATOM 438 CG GLN A 28 -78.956 10.479 108.495 1.00 0.00 C ATOM 439 CD GLN A 28 -79.356 11.552 107.492 1.00 0.00 C ATOM 440 OE1 GLN A 28 -78.591 12.462 107.213 1.00 0.00 O ATOM 441 NE2 GLN A 28 -80.521 11.456 106.878 1.00 0.00 N ATOM 0 H GLN A 28 -76.547 10.718 108.015 1.00 0.00 H new ATOM 0 HA GLN A 28 -76.911 8.277 106.661 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -79.341 8.670 107.408 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -78.108 8.514 108.644 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -79.808 10.264 109.141 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -78.163 10.870 109.133 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -81.159 10.696 107.112 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -80.782 12.142 106.170 1.00 0.00 H new ATOM 450 N HIS A 29 -77.849 10.833 104.920 1.00 0.00 N ATOM 451 CA HIS A 29 -78.200 11.322 103.586 1.00 0.00 C ATOM 452 C HIS A 29 -77.098 10.997 102.553 1.00 0.00 C ATOM 453 O HIS A 29 -77.282 11.210 101.357 1.00 0.00 O ATOM 454 CB HIS A 29 -78.478 12.833 103.749 1.00 0.00 C ATOM 455 CG HIS A 29 -78.903 13.634 102.543 1.00 0.00 C ATOM 456 ND1 HIS A 29 -78.737 14.996 102.415 1.00 0.00 N ATOM 457 CD2 HIS A 29 -79.583 13.192 101.439 1.00 0.00 C ATOM 458 CE1 HIS A 29 -79.301 15.363 101.251 1.00 0.00 C ATOM 459 NE2 HIS A 29 -79.826 14.301 100.622 1.00 0.00 N ATOM 0 H HIS A 29 -77.482 11.578 105.513 1.00 0.00 H new ATOM 0 HA HIS A 29 -79.085 10.826 103.187 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -79.253 12.945 104.508 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -77.573 13.293 104.147 1.00 0.00 H new ATOM 0 HD1 HIS A 29 -78.272 15.613 103.081 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -79.878 12.173 101.236 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -79.328 16.375 100.874 1.00 0.00 H new ATOM 467 N GLY A 30 -75.944 10.462 102.988 1.00 0.00 N ATOM 468 CA GLY A 30 -74.796 10.166 102.131 1.00 0.00 C ATOM 469 C GLY A 30 -74.063 11.414 101.631 1.00 0.00 C ATOM 470 O GLY A 30 -73.191 11.293 100.770 1.00 0.00 O ATOM 0 H GLY A 30 -75.786 10.220 103.966 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -74.094 9.540 102.682 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -75.135 9.586 101.273 1.00 0.00 H new ATOM 474 N THR A 31 -74.440 12.597 102.119 1.00 0.00 N ATOM 475 CA THR A 31 -73.698 13.857 102.045 1.00 0.00 C ATOM 476 C THR A 31 -72.556 13.854 103.059 1.00 0.00 C ATOM 477 O THR A 31 -72.506 12.997 103.937 1.00 0.00 O ATOM 478 CB THR A 31 -74.636 15.030 102.375 1.00 0.00 C ATOM 479 OG1 THR A 31 -75.341 14.783 103.577 1.00 0.00 O ATOM 480 CG2 THR A 31 -75.642 15.248 101.253 1.00 0.00 C ATOM 0 H THR A 31 -75.328 12.708 102.608 1.00 0.00 H new ATOM 0 HA THR A 31 -73.298 13.965 101.037 1.00 0.00 H new ATOM 0 HB THR A 31 -74.020 15.922 102.490 1.00 0.00 H new ATOM 0 HG1 THR A 31 -76.246 15.153 103.507 1.00 0.00 H new ATOM 0 HG21 THR A 31 -76.296 16.082 101.507 1.00 0.00 H new ATOM 0 HG22 THR A 31 -75.112 15.471 100.327 1.00 0.00 H new ATOM 0 HG23 THR A 31 -76.240 14.346 101.120 1.00 0.00 H new ATOM 488 N THR A 32 -71.656 14.833 102.980 1.00 0.00 N ATOM 489 CA THR A 32 -70.571 15.028 103.941 1.00 0.00 C ATOM 490 C THR A 32 -70.532 16.470 104.443 1.00 0.00 C ATOM 491 O THR A 32 -70.904 17.392 103.716 1.00 0.00 O ATOM 492 CB THR A 32 -69.245 14.543 103.338 1.00 0.00 C ATOM 493 OG1 THR A 32 -68.290 14.439 104.361 1.00 0.00 O ATOM 494 CG2 THR A 32 -68.689 15.417 102.212 1.00 0.00 C ATOM 0 H THR A 32 -71.661 15.526 102.232 1.00 0.00 H new ATOM 0 HA THR A 32 -70.752 14.420 104.827 1.00 0.00 H new ATOM 0 HB THR A 32 -69.459 13.577 102.880 1.00 0.00 H new ATOM 0 HG1 THR A 32 -67.802 13.594 104.268 1.00 0.00 H new ATOM 0 HG21 THR A 32 -67.752 14.993 101.851 1.00 0.00 H new ATOM 0 HG22 THR A 32 -69.408 15.457 101.394 1.00 0.00 H new ATOM 0 HG23 THR A 32 -68.511 16.425 102.588 1.00 0.00 H new ATOM 502 N VAL A 33 -70.118 16.654 105.703 1.00 0.00 N ATOM 503 CA VAL A 33 -70.189 17.931 106.424 1.00 0.00 C ATOM 504 C VAL A 33 -68.783 18.432 106.756 1.00 0.00 C ATOM 505 O VAL A 33 -68.130 17.939 107.685 1.00 0.00 O ATOM 506 CB VAL A 33 -71.097 17.864 107.668 1.00 0.00 C ATOM 507 CG1 VAL A 33 -71.351 19.282 108.204 1.00 0.00 C ATOM 508 CG2 VAL A 33 -72.461 17.230 107.354 1.00 0.00 C ATOM 0 H VAL A 33 -69.715 15.902 106.262 1.00 0.00 H new ATOM 0 HA VAL A 33 -70.659 18.658 105.762 1.00 0.00 H new ATOM 0 HB VAL A 33 -70.581 17.249 108.405 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -71.993 19.229 109.083 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -70.402 19.744 108.475 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -71.838 19.880 107.434 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -73.067 17.204 108.260 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -72.971 17.821 106.593 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -72.314 16.215 106.986 1.00 0.00 H new ATOM 518 N VAL A 34 -68.330 19.407 105.963 1.00 0.00 N ATOM 519 CA VAL A 34 -67.031 20.093 106.074 1.00 0.00 C ATOM 520 C VAL A 34 -67.191 21.335 106.956 1.00 0.00 C ATOM 521 O VAL A 34 -68.213 22.005 106.832 1.00 0.00 O ATOM 522 CB VAL A 34 -66.528 20.559 104.679 1.00 0.00 C ATOM 523 CG1 VAL A 34 -64.997 20.507 104.658 1.00 0.00 C ATOM 524 CG2 VAL A 34 -67.087 19.774 103.481 1.00 0.00 C ATOM 0 H VAL A 34 -68.885 19.761 105.184 1.00 0.00 H new ATOM 0 HA VAL A 34 -66.313 19.394 106.504 1.00 0.00 H new ATOM 0 HB VAL A 34 -66.903 21.575 104.553 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -64.635 20.832 103.683 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -64.600 21.166 105.431 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -64.665 19.486 104.846 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -66.674 20.178 102.557 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -66.811 18.724 103.573 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -68.173 19.863 103.463 1.00 0.00 H new ATOM 534 N LYS A 35 -66.198 21.714 107.777 1.00 0.00 N ATOM 535 CA LYS A 35 -66.202 23.027 108.461 1.00 0.00 C ATOM 536 C LYS A 35 -65.085 23.895 107.889 1.00 0.00 C ATOM 537 O LYS A 35 -63.929 23.474 107.871 1.00 0.00 O ATOM 538 CB LYS A 35 -66.091 22.866 109.987 1.00 0.00 C ATOM 539 CG LYS A 35 -66.593 24.058 110.838 1.00 0.00 C ATOM 540 CD LYS A 35 -65.570 24.686 111.811 1.00 0.00 C ATOM 541 CE LYS A 35 -64.773 23.678 112.654 1.00 0.00 C ATOM 542 NZ LYS A 35 -63.569 24.271 113.288 1.00 0.00 N ATOM 0 H LYS A 35 -65.384 21.136 107.986 1.00 0.00 H new ATOM 0 HA LYS A 35 -67.154 23.526 108.278 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -66.650 21.977 110.279 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -65.046 22.682 110.237 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -66.944 24.837 110.161 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -67.455 23.726 111.416 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -64.869 25.291 111.236 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -66.098 25.362 112.483 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -65.421 23.270 113.430 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -64.469 22.844 112.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -62.749 23.653 113.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -63.385 25.208 112.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -63.728 24.368 114.311 1.00 0.00 H new ATOM 556 N VAL A 36 -65.430 25.094 107.419 1.00 0.00 N ATOM 557 CA VAL A 36 -64.478 26.089 106.897 1.00 0.00 C ATOM 558 C VAL A 36 -64.262 27.208 107.917 1.00 0.00 C ATOM 559 O VAL A 36 -65.049 27.330 108.855 1.00 0.00 O ATOM 560 CB VAL A 36 -64.939 26.664 105.533 1.00 0.00 C ATOM 561 CG1 VAL A 36 -65.572 25.589 104.640 1.00 0.00 C ATOM 562 CG2 VAL A 36 -65.934 27.828 105.651 1.00 0.00 C ATOM 0 H VAL A 36 -66.399 25.412 107.388 1.00 0.00 H new ATOM 0 HA VAL A 36 -63.527 25.583 106.729 1.00 0.00 H new ATOM 0 HB VAL A 36 -64.021 27.041 105.082 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -65.880 26.036 103.695 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -64.844 24.801 104.448 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -66.442 25.165 105.142 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -66.208 28.175 104.655 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -66.827 27.491 106.177 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -65.473 28.646 106.206 1.00 0.00 H new ATOM 572 N LYS A 37 -63.263 28.066 107.677 1.00 0.00 N ATOM 573 CA LYS A 37 -63.129 29.431 108.224 1.00 0.00 C ATOM 574 C LYS A 37 -62.516 30.333 107.141 1.00 0.00 C ATOM 575 O LYS A 37 -61.819 29.809 106.271 1.00 0.00 O ATOM 576 CB LYS A 37 -62.221 29.374 109.461 1.00 0.00 C ATOM 577 CG LYS A 37 -62.293 30.582 110.398 1.00 0.00 C ATOM 578 CD LYS A 37 -60.916 31.229 110.642 1.00 0.00 C ATOM 579 CE LYS A 37 -60.000 30.457 111.612 1.00 0.00 C ATOM 580 NZ LYS A 37 -59.340 29.263 111.025 1.00 0.00 N ATOM 0 H LYS A 37 -62.485 27.819 107.066 1.00 0.00 H new ATOM 0 HA LYS A 37 -64.099 29.835 108.515 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -62.473 28.480 110.032 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -61.190 29.259 109.126 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -62.969 31.325 109.975 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -62.718 30.271 111.352 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -60.404 31.331 109.685 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -61.067 32.236 111.032 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -59.231 31.135 111.982 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -60.589 30.143 112.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -58.522 28.997 111.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -60.015 28.473 110.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -59.020 29.482 110.060 1.00 0.00 H new ATOM 594 N TYR A 38 -62.729 31.658 107.169 1.00 0.00 N ATOM 595 CA TYR A 38 -62.198 32.560 106.131 1.00 0.00 C ATOM 596 C TYR A 38 -60.892 33.246 106.550 1.00 0.00 C ATOM 597 O TYR A 38 -60.800 33.845 107.616 1.00 0.00 O ATOM 598 CB TYR A 38 -63.250 33.591 105.697 1.00 0.00 C ATOM 599 CG TYR A 38 -62.767 34.544 104.608 1.00 0.00 C ATOM 600 CD1 TYR A 38 -62.121 34.035 103.465 1.00 0.00 C ATOM 601 CD2 TYR A 38 -62.969 35.934 104.717 1.00 0.00 C ATOM 602 CE1 TYR A 38 -61.715 34.881 102.424 1.00 0.00 C ATOM 603 CE2 TYR A 38 -62.565 36.795 103.675 1.00 0.00 C ATOM 604 CZ TYR A 38 -61.955 36.263 102.514 1.00 0.00 C ATOM 605 OH TYR A 38 -61.602 37.062 101.473 1.00 0.00 O ATOM 0 H TYR A 38 -63.265 32.130 107.898 1.00 0.00 H new ATOM 0 HA TYR A 38 -61.959 31.933 105.272 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -64.135 33.065 105.339 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -63.555 34.173 106.567 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -61.935 32.974 103.389 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -63.435 36.342 105.602 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -61.219 34.472 101.556 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -62.721 37.860 103.763 1.00 0.00 H new ATOM 0 HH TYR A 38 -62.368 37.173 100.871 1.00 0.00 H new ATOM 615 N GLU A 39 -59.867 33.199 105.694 1.00 0.00 N ATOM 616 CA GLU A 39 -58.495 33.602 106.040 1.00 0.00 C ATOM 617 C GLU A 39 -57.867 34.534 104.988 1.00 0.00 C ATOM 618 O GLU A 39 -56.657 34.747 104.993 1.00 0.00 O ATOM 619 CB GLU A 39 -57.653 32.339 106.311 1.00 0.00 C ATOM 620 CG GLU A 39 -58.237 31.535 107.489 1.00 0.00 C ATOM 621 CD GLU A 39 -57.353 30.390 107.982 1.00 0.00 C ATOM 622 OE1 GLU A 39 -56.465 29.937 107.212 1.00 0.00 O ATOM 623 OE2 GLU A 39 -57.609 29.943 109.121 1.00 0.00 O ATOM 0 H GLU A 39 -59.964 32.877 104.731 1.00 0.00 H new ATOM 0 HA GLU A 39 -58.521 34.200 106.951 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -57.626 31.716 105.417 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -56.624 32.623 106.533 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -58.422 32.216 108.319 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -59.203 31.127 107.190 1.00 0.00 H new ATOM 630 N GLY A 40 -58.684 35.088 104.081 1.00 0.00 N ATOM 631 CA GLY A 40 -58.230 35.887 102.946 1.00 0.00 C ATOM 632 C GLY A 40 -58.180 37.395 103.193 1.00 0.00 C ATOM 633 O GLY A 40 -57.181 38.021 102.855 1.00 0.00 O ATOM 0 H GLY A 40 -59.698 34.988 104.121 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -57.235 35.548 102.658 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -58.889 35.695 102.099 1.00 0.00 H new ATOM 637 N ALA A 41 -59.264 37.990 103.716 1.00 0.00 N ATOM 638 CA ALA A 41 -59.436 39.451 103.714 1.00 0.00 C ATOM 639 C ALA A 41 -60.190 40.038 104.923 1.00 0.00 C ATOM 640 O ALA A 41 -60.575 41.206 104.881 1.00 0.00 O ATOM 641 CB ALA A 41 -60.125 39.854 102.401 1.00 0.00 C ATOM 0 H ALA A 41 -60.036 37.480 104.146 1.00 0.00 H new ATOM 0 HA ALA A 41 -58.436 39.877 103.798 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -60.262 40.935 102.379 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -59.506 39.550 101.557 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -61.096 39.364 102.334 1.00 0.00 H new ATOM 647 N GLY A 42 -60.468 39.265 105.982 1.00 0.00 N ATOM 648 CA GLY A 42 -61.158 39.762 107.180 1.00 0.00 C ATOM 649 C GLY A 42 -62.678 39.927 107.026 1.00 0.00 C ATOM 650 O GLY A 42 -63.426 39.597 107.940 1.00 0.00 O ATOM 0 H GLY A 42 -60.220 38.277 106.032 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -60.963 39.077 108.005 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -60.728 40.725 107.457 1.00 0.00 H new ATOM 654 N ALA A 43 -63.120 40.454 105.882 1.00 0.00 N ATOM 655 CA ALA A 43 -64.493 40.825 105.539 1.00 0.00 C ATOM 656 C ALA A 43 -65.402 39.619 105.146 1.00 0.00 C ATOM 657 O ALA A 43 -64.932 38.480 105.144 1.00 0.00 O ATOM 658 CB ALA A 43 -64.347 41.877 104.425 1.00 0.00 C ATOM 0 H ALA A 43 -62.478 40.647 105.113 1.00 0.00 H new ATOM 0 HA ALA A 43 -65.020 41.226 106.405 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -65.335 42.211 104.108 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -63.780 42.729 104.801 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -63.823 41.438 103.576 1.00 0.00 H new ATOM 664 N PRO A 44 -66.710 39.827 104.858 1.00 0.00 N ATOM 665 CA PRO A 44 -67.653 38.764 104.478 1.00 0.00 C ATOM 666 C PRO A 44 -67.381 38.105 103.115 1.00 0.00 C ATOM 667 O PRO A 44 -66.694 38.668 102.262 1.00 0.00 O ATOM 668 CB PRO A 44 -69.043 39.418 104.426 1.00 0.00 C ATOM 669 CG PRO A 44 -68.878 40.743 105.157 1.00 0.00 C ATOM 670 CD PRO A 44 -67.417 41.096 104.934 1.00 0.00 C ATOM 0 HA PRO A 44 -67.557 37.965 105.213 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -69.369 39.572 103.397 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -69.793 38.791 104.908 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -69.541 41.508 104.754 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -69.110 40.647 106.218 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -67.289 41.670 104.017 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -67.034 41.709 105.750 1.00 0.00 H new ATOM 678 N CYS A 45 -68.038 36.961 102.880 1.00 0.00 N ATOM 679 CA CYS A 45 -68.088 36.223 101.616 1.00 0.00 C ATOM 680 C CYS A 45 -69.431 35.479 101.469 1.00 0.00 C ATOM 681 O CYS A 45 -69.966 35.007 102.470 1.00 0.00 O ATOM 682 CB CYS A 45 -66.973 35.160 101.630 1.00 0.00 C ATOM 683 SG CYS A 45 -65.272 35.740 101.785 1.00 0.00 S ATOM 0 H CYS A 45 -68.580 36.501 103.612 1.00 0.00 H new ATOM 0 HA CYS A 45 -67.969 36.930 100.795 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -67.171 34.475 102.454 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -67.049 34.581 100.710 1.00 0.00 H new ATOM 688 N LYS A 46 -69.875 35.181 100.234 1.00 0.00 N ATOM 689 CA LYS A 46 -70.257 33.791 99.934 1.00 0.00 C ATOM 690 C LYS A 46 -68.989 33.022 99.579 1.00 0.00 C ATOM 691 O LYS A 46 -68.142 33.561 98.858 1.00 0.00 O ATOM 692 CB LYS A 46 -71.362 33.616 98.883 1.00 0.00 C ATOM 693 CG LYS A 46 -71.058 33.973 97.416 1.00 0.00 C ATOM 694 CD LYS A 46 -71.991 33.230 96.441 1.00 0.00 C ATOM 695 CE LYS A 46 -73.444 33.184 96.934 1.00 0.00 C ATOM 696 NZ LYS A 46 -74.416 32.980 95.841 1.00 0.00 N ATOM 0 H LYS A 46 -69.975 35.844 99.465 1.00 0.00 H new ATOM 0 HA LYS A 46 -70.723 33.382 100.830 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -71.680 32.574 98.909 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -72.215 34.217 99.198 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -71.166 35.048 97.274 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -70.022 33.724 97.189 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -71.957 33.719 95.467 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -71.627 32.212 96.300 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -73.550 32.380 97.662 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -73.677 34.115 97.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -75.340 32.722 96.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -74.510 33.858 95.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -74.083 32.216 95.219 1.00 0.00 H new ATOM 710 N VAL A 47 -68.823 31.822 100.143 1.00 0.00 N ATOM 711 CA VAL A 47 -67.552 31.093 100.058 1.00 0.00 C ATOM 712 C VAL A 47 -67.573 30.127 98.869 1.00 0.00 C ATOM 713 O VAL A 47 -68.563 29.418 98.684 1.00 0.00 O ATOM 714 CB VAL A 47 -67.044 30.494 101.393 1.00 0.00 C ATOM 715 CG1 VAL A 47 -67.840 30.881 102.642 1.00 0.00 C ATOM 716 CG2 VAL A 47 -66.761 28.992 101.422 1.00 0.00 C ATOM 0 H VAL A 47 -69.552 31.334 100.663 1.00 0.00 H new ATOM 0 HA VAL A 47 -66.773 31.828 99.855 1.00 0.00 H new ATOM 0 HB VAL A 47 -66.077 30.995 101.432 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -67.397 30.406 103.517 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -67.818 31.964 102.766 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -68.872 30.549 102.533 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -66.412 28.707 102.415 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -67.674 28.445 101.187 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -65.994 28.752 100.685 1.00 0.00 H new ATOM 726 N PRO A 48 -66.529 30.129 98.017 1.00 0.00 N ATOM 727 CA PRO A 48 -66.548 29.426 96.740 1.00 0.00 C ATOM 728 C PRO A 48 -66.298 27.938 96.991 1.00 0.00 C ATOM 729 O PRO A 48 -65.174 27.560 97.316 1.00 0.00 O ATOM 730 CB PRO A 48 -65.452 30.079 95.877 1.00 0.00 C ATOM 731 CG PRO A 48 -64.892 31.204 96.747 1.00 0.00 C ATOM 732 CD PRO A 48 -65.233 30.774 98.161 1.00 0.00 C ATOM 0 HA PRO A 48 -67.505 29.498 96.223 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -64.677 29.360 95.611 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -65.861 30.466 94.944 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -63.816 31.316 96.612 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -65.346 32.164 96.501 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -64.486 30.089 98.563 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -65.282 31.626 98.839 1.00 0.00 H new ATOM 740 N ILE A 49 -67.346 27.111 96.898 1.00 0.00 N ATOM 741 CA ILE A 49 -67.276 25.668 97.157 1.00 0.00 C ATOM 742 C ILE A 49 -67.794 24.872 95.967 1.00 0.00 C ATOM 743 O ILE A 49 -68.939 25.029 95.544 1.00 0.00 O ATOM 744 CB ILE A 49 -67.977 25.284 98.481 1.00 0.00 C ATOM 745 CG1 ILE A 49 -67.166 25.915 99.635 1.00 0.00 C ATOM 746 CG2 ILE A 49 -68.122 23.758 98.646 1.00 0.00 C ATOM 747 CD1 ILE A 49 -67.371 25.356 101.050 1.00 0.00 C ATOM 0 H ILE A 49 -68.279 27.430 96.637 1.00 0.00 H new ATOM 0 HA ILE A 49 -66.226 25.403 97.284 1.00 0.00 H new ATOM 0 HB ILE A 49 -68.997 25.668 98.484 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -66.108 25.822 99.389 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -67.395 26.980 99.660 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -68.620 23.540 99.591 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -68.714 23.358 97.823 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -67.135 23.296 98.641 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -66.736 25.898 101.751 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -68.415 25.474 101.340 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -67.108 24.298 101.065 1.00 0.00 H new ATOM 759 N GLU A 50 -66.942 23.966 95.488 1.00 0.00 N ATOM 760 CA GLU A 50 -67.276 22.928 94.517 1.00 0.00 C ATOM 761 C GLU A 50 -66.652 21.594 94.948 1.00 0.00 C ATOM 762 O GLU A 50 -65.758 21.556 95.797 1.00 0.00 O ATOM 763 CB GLU A 50 -66.726 23.292 93.127 1.00 0.00 C ATOM 764 CG GLU A 50 -67.204 24.630 92.545 1.00 0.00 C ATOM 765 CD GLU A 50 -66.518 24.893 91.202 1.00 0.00 C ATOM 766 OE1 GLU A 50 -65.291 24.693 91.090 1.00 0.00 O ATOM 767 OE2 GLU A 50 -67.194 25.234 90.208 1.00 0.00 O ATOM 0 H GLU A 50 -65.964 23.935 95.777 1.00 0.00 H new ATOM 0 HA GLU A 50 -68.362 22.843 94.471 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -65.638 23.310 93.182 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -66.997 22.498 92.431 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -68.286 24.612 92.413 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -66.981 25.439 93.241 1.00 0.00 H new ATOM 774 N ILE A 51 -67.051 20.510 94.277 1.00 0.00 N ATOM 775 CA ILE A 51 -66.253 19.287 94.187 1.00 0.00 C ATOM 776 C ILE A 51 -65.966 19.047 92.716 1.00 0.00 C ATOM 777 O ILE A 51 -66.913 18.952 91.931 1.00 0.00 O ATOM 778 CB ILE A 51 -66.946 18.051 94.798 1.00 0.00 C ATOM 779 CG1 ILE A 51 -67.559 18.385 96.169 1.00 0.00 C ATOM 780 CG2 ILE A 51 -65.919 16.909 94.860 1.00 0.00 C ATOM 781 CD1 ILE A 51 -67.921 17.190 97.065 1.00 0.00 C ATOM 0 H ILE A 51 -67.940 20.457 93.780 1.00 0.00 H new ATOM 0 HA ILE A 51 -65.341 19.427 94.767 1.00 0.00 H new ATOM 0 HB ILE A 51 -67.782 17.731 94.175 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -66.858 19.019 96.712 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -68.461 18.975 96.005 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -66.386 16.023 95.289 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -65.566 16.682 93.854 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -65.076 17.211 95.481 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -68.344 17.553 98.002 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -68.652 16.562 96.556 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -67.024 16.607 97.273 1.00 0.00 H new ATOM 793 N ARG A 52 -64.686 18.923 92.360 1.00 0.00 N ATOM 794 CA ARG A 52 -64.249 18.511 91.027 1.00 0.00 C ATOM 795 C ARG A 52 -63.682 17.084 91.049 1.00 0.00 C ATOM 796 O ARG A 52 -63.419 16.505 92.106 1.00 0.00 O ATOM 797 CB ARG A 52 -63.319 19.578 90.407 1.00 0.00 C ATOM 798 CG ARG A 52 -64.096 20.887 90.157 1.00 0.00 C ATOM 799 CD ARG A 52 -63.314 21.963 89.394 1.00 0.00 C ATOM 800 NE ARG A 52 -64.155 23.164 89.211 1.00 0.00 N ATOM 801 CZ ARG A 52 -64.619 23.743 88.111 1.00 0.00 C ATOM 802 NH1 ARG A 52 -64.314 23.362 86.893 1.00 0.00 N ATOM 803 NH2 ARG A 52 -65.455 24.746 88.210 1.00 0.00 N ATOM 0 H ARG A 52 -63.914 19.109 93.000 1.00 0.00 H new ATOM 0 HA ARG A 52 -65.107 18.456 90.357 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -62.478 19.768 91.074 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -62.905 19.208 89.469 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -65.003 20.654 89.600 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -64.408 21.297 91.118 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -62.408 22.223 89.942 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -63.000 21.577 88.424 1.00 0.00 H new ATOM 0 HE ARG A 52 -64.425 23.627 90.079 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -63.683 22.574 86.748 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -64.708 23.854 86.091 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -65.746 25.078 89.129 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -65.815 25.195 87.368 1.00 0.00 H new ATOM 817 N ASP A 53 -63.608 16.496 89.858 1.00 0.00 N ATOM 818 CA ASP A 53 -63.160 15.133 89.577 1.00 0.00 C ATOM 819 C ASP A 53 -61.711 14.846 90.020 1.00 0.00 C ATOM 820 O ASP A 53 -60.996 15.725 90.497 1.00 0.00 O ATOM 821 CB ASP A 53 -63.397 14.824 88.080 1.00 0.00 C ATOM 822 CG ASP A 53 -62.741 15.771 87.061 1.00 0.00 C ATOM 823 OD1 ASP A 53 -62.108 16.776 87.443 1.00 0.00 O ATOM 824 OD2 ASP A 53 -62.914 15.493 85.847 1.00 0.00 O ATOM 0 H ASP A 53 -63.877 16.990 89.007 1.00 0.00 H new ATOM 0 HA ASP A 53 -63.757 14.453 90.185 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -63.041 13.813 87.882 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -64.472 14.824 87.900 1.00 0.00 H new ATOM 829 N VAL A 54 -61.253 13.595 89.867 1.00 0.00 N ATOM 830 CA VAL A 54 -59.885 13.180 90.238 1.00 0.00 C ATOM 831 C VAL A 54 -58.801 14.003 89.527 1.00 0.00 C ATOM 832 O VAL A 54 -57.772 14.326 90.128 1.00 0.00 O ATOM 833 CB VAL A 54 -59.666 11.664 90.053 1.00 0.00 C ATOM 834 CG1 VAL A 54 -60.625 10.864 90.943 1.00 0.00 C ATOM 835 CG2 VAL A 54 -59.827 11.189 88.602 1.00 0.00 C ATOM 0 H VAL A 54 -61.819 12.839 89.482 1.00 0.00 H new ATOM 0 HA VAL A 54 -59.785 13.391 91.303 1.00 0.00 H new ATOM 0 HB VAL A 54 -58.631 11.484 90.344 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -60.453 9.798 90.797 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -60.450 11.120 91.988 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -61.654 11.105 90.678 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -59.658 10.113 88.550 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -60.835 11.415 88.255 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -59.102 11.701 87.969 1.00 0.00 H new ATOM 845 N ASN A 55 -59.079 14.417 88.287 1.00 0.00 N ATOM 846 CA ASN A 55 -58.273 15.330 87.479 1.00 0.00 C ATOM 847 C ASN A 55 -58.368 16.806 87.934 1.00 0.00 C ATOM 848 O ASN A 55 -57.564 17.622 87.486 1.00 0.00 O ATOM 849 CB ASN A 55 -58.755 15.223 86.024 1.00 0.00 C ATOM 850 CG ASN A 55 -58.477 13.925 85.288 1.00 0.00 C ATOM 851 OD1 ASN A 55 -58.060 12.917 85.838 1.00 0.00 O ATOM 852 ND2 ASN A 55 -58.736 13.941 83.998 1.00 0.00 N ATOM 0 H ASN A 55 -59.917 14.106 87.796 1.00 0.00 H new ATOM 0 HA ASN A 55 -57.229 15.038 87.592 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -59.832 15.392 86.013 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -58.299 16.035 85.458 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -58.589 13.101 83.438 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -59.084 14.793 83.558 1.00 0.00 H new ATOM 859 N LYS A 56 -59.315 17.148 88.825 1.00 0.00 N ATOM 860 CA LYS A 56 -59.575 18.474 89.418 1.00 0.00 C ATOM 861 C LYS A 56 -59.998 19.538 88.388 1.00 0.00 C ATOM 862 O LYS A 56 -59.789 20.729 88.596 1.00 0.00 O ATOM 863 CB LYS A 56 -58.389 18.892 90.314 1.00 0.00 C ATOM 864 CG LYS A 56 -58.133 17.902 91.471 1.00 0.00 C ATOM 865 CD LYS A 56 -56.630 17.700 91.714 1.00 0.00 C ATOM 866 CE LYS A 56 -56.309 16.660 92.797 1.00 0.00 C ATOM 867 NZ LYS A 56 -56.899 15.329 92.513 1.00 0.00 N ATOM 0 H LYS A 56 -59.970 16.451 89.178 1.00 0.00 H new ATOM 0 HA LYS A 56 -60.452 18.392 90.060 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -57.489 18.971 89.704 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -58.583 19.882 90.726 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -58.603 18.274 92.381 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -58.598 16.943 91.241 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -56.159 17.395 90.780 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -56.186 18.654 91.998 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -55.227 16.560 92.888 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -56.678 17.018 93.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -56.184 14.591 92.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -57.711 15.167 93.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -57.217 15.294 91.523 1.00 0.00 H new ATOM 881 N GLU A 57 -60.640 19.113 87.297 1.00 0.00 N ATOM 882 CA GLU A 57 -61.053 19.949 86.159 1.00 0.00 C ATOM 883 C GLU A 57 -62.573 20.144 86.093 1.00 0.00 C ATOM 884 O GLU A 57 -63.009 21.263 85.825 1.00 0.00 O ATOM 885 CB GLU A 57 -60.511 19.393 84.819 1.00 0.00 C ATOM 886 CG GLU A 57 -60.687 17.875 84.712 1.00 0.00 C ATOM 887 CD GLU A 57 -60.473 17.258 83.327 1.00 0.00 C ATOM 888 OE1 GLU A 57 -61.347 17.509 82.460 1.00 0.00 O ATOM 889 OE2 GLU A 57 -59.597 16.377 83.188 1.00 0.00 O ATOM 0 H GLU A 57 -60.899 18.134 87.174 1.00 0.00 H new ATOM 0 HA GLU A 57 -60.611 20.931 86.324 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -61.028 19.877 83.990 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -59.454 19.643 84.724 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -59.994 17.401 85.407 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -61.694 17.624 85.045 1.00 0.00 H new ATOM 896 N LYS A 58 -63.392 19.115 86.366 1.00 0.00 N ATOM 897 CA LYS A 58 -64.845 19.135 86.098 1.00 0.00 C ATOM 898 C LYS A 58 -65.654 18.837 87.356 1.00 0.00 C ATOM 899 O LYS A 58 -65.292 17.953 88.127 1.00 0.00 O ATOM 900 CB LYS A 58 -65.201 18.131 84.989 1.00 0.00 C ATOM 901 CG LYS A 58 -64.513 18.469 83.656 1.00 0.00 C ATOM 902 CD LYS A 58 -64.874 17.506 82.514 1.00 0.00 C ATOM 903 CE LYS A 58 -64.607 16.017 82.787 1.00 0.00 C ATOM 904 NZ LYS A 58 -63.214 15.755 83.214 1.00 0.00 N ATOM 0 H LYS A 58 -63.067 18.242 86.780 1.00 0.00 H new ATOM 0 HA LYS A 58 -65.103 20.140 85.765 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -64.910 17.128 85.302 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -66.281 18.119 84.845 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -64.785 19.483 83.364 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -63.433 18.458 83.801 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -65.931 17.629 82.280 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -64.315 17.799 81.626 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -65.291 15.665 83.559 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -64.820 15.443 81.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -63.008 14.740 83.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -62.559 16.296 82.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -63.094 16.046 84.205 1.00 0.00 H new ATOM 918 N VAL A 59 -66.746 19.585 87.555 1.00 0.00 N ATOM 919 CA VAL A 59 -67.609 19.511 88.745 1.00 0.00 C ATOM 920 C VAL A 59 -68.356 18.175 88.811 1.00 0.00 C ATOM 921 O VAL A 59 -68.947 17.733 87.829 1.00 0.00 O ATOM 922 CB VAL A 59 -68.588 20.704 88.802 1.00 0.00 C ATOM 923 CG1 VAL A 59 -69.508 20.643 90.033 1.00 0.00 C ATOM 924 CG2 VAL A 59 -67.819 22.033 88.870 1.00 0.00 C ATOM 0 H VAL A 59 -67.064 20.277 86.877 1.00 0.00 H new ATOM 0 HA VAL A 59 -66.965 19.570 89.622 1.00 0.00 H new ATOM 0 HB VAL A 59 -69.190 20.645 87.895 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -70.178 21.503 90.029 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -70.095 19.725 90.003 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -68.904 20.658 90.940 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -68.527 22.861 88.909 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -67.194 22.047 89.763 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -67.190 22.135 87.986 1.00 0.00 H new ATOM 934 N VAL A 60 -68.346 17.556 89.997 1.00 0.00 N ATOM 935 CA VAL A 60 -68.943 16.245 90.295 1.00 0.00 C ATOM 936 C VAL A 60 -69.823 16.229 91.553 1.00 0.00 C ATOM 937 O VAL A 60 -70.570 15.265 91.744 1.00 0.00 O ATOM 938 CB VAL A 60 -67.856 15.154 90.402 1.00 0.00 C ATOM 939 CG1 VAL A 60 -67.184 14.885 89.052 1.00 0.00 C ATOM 940 CG2 VAL A 60 -66.777 15.498 91.439 1.00 0.00 C ATOM 0 H VAL A 60 -67.901 17.973 90.815 1.00 0.00 H new ATOM 0 HA VAL A 60 -69.602 16.031 89.453 1.00 0.00 H new ATOM 0 HB VAL A 60 -68.377 14.254 90.730 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -66.426 14.111 89.171 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -67.932 14.552 88.333 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -66.715 15.800 88.690 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -66.038 14.698 91.474 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -66.288 16.432 91.160 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -67.238 15.609 92.420 1.00 0.00 H new ATOM 950 N GLY A 61 -69.798 17.283 92.384 1.00 0.00 N ATOM 951 CA GLY A 61 -70.571 17.380 93.631 1.00 0.00 C ATOM 952 C GLY A 61 -71.514 18.587 93.707 1.00 0.00 C ATOM 953 O GLY A 61 -71.428 19.502 92.889 1.00 0.00 O ATOM 0 H GLY A 61 -69.227 18.109 92.203 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -71.158 16.469 93.751 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -69.877 17.425 94.470 1.00 0.00 H new ATOM 957 N ARG A 62 -72.412 18.583 94.704 1.00 0.00 N ATOM 958 CA ARG A 62 -73.504 19.559 94.898 1.00 0.00 C ATOM 959 C ARG A 62 -73.567 20.042 96.353 1.00 0.00 C ATOM 960 O ARG A 62 -73.728 19.221 97.254 1.00 0.00 O ATOM 961 CB ARG A 62 -74.852 18.902 94.538 1.00 0.00 C ATOM 962 CG ARG A 62 -75.015 18.525 93.055 1.00 0.00 C ATOM 963 CD ARG A 62 -75.660 17.139 92.869 1.00 0.00 C ATOM 964 NE ARG A 62 -74.777 16.036 93.299 1.00 0.00 N ATOM 965 CZ ARG A 62 -73.663 15.605 92.732 1.00 0.00 C ATOM 966 NH1 ARG A 62 -73.177 16.107 91.626 1.00 0.00 N ATOM 967 NH2 ARG A 62 -72.982 14.649 93.300 1.00 0.00 N ATOM 0 H ARG A 62 -72.399 17.868 95.432 1.00 0.00 H new ATOM 0 HA ARG A 62 -73.309 20.414 94.251 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -74.974 18.003 95.142 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -75.657 19.583 94.815 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -75.627 19.277 92.557 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -74.039 18.536 92.571 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -76.590 17.097 93.436 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -75.920 17.002 91.819 1.00 0.00 H new ATOM 0 HE ARG A 62 -75.064 15.542 94.144 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -73.663 16.871 91.156 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -72.312 15.734 91.234 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -73.310 14.240 94.175 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -72.122 14.310 92.869 1.00 0.00 H new ATOM 981 N ILE A 63 -73.449 21.350 96.607 1.00 0.00 N ATOM 982 CA ILE A 63 -73.627 21.906 97.960 1.00 0.00 C ATOM 983 C ILE A 63 -75.107 21.846 98.367 1.00 0.00 C ATOM 984 O ILE A 63 -75.957 22.400 97.673 1.00 0.00 O ATOM 985 CB ILE A 63 -73.077 23.346 98.145 1.00 0.00 C ATOM 986 CG1 ILE A 63 -72.087 23.875 97.081 1.00 0.00 C ATOM 987 CG2 ILE A 63 -72.399 23.384 99.523 1.00 0.00 C ATOM 988 CD1 ILE A 63 -72.809 24.495 95.877 1.00 0.00 C ATOM 0 H ILE A 63 -73.231 22.047 95.895 1.00 0.00 H new ATOM 0 HA ILE A 63 -73.026 21.277 98.617 1.00 0.00 H new ATOM 0 HB ILE A 63 -73.936 24.008 98.039 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -71.433 24.620 97.534 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -71.451 23.058 96.740 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -71.994 24.380 99.702 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -73.131 23.146 100.295 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -71.591 22.653 99.551 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -72.074 24.853 95.156 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -73.443 23.743 95.406 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -73.424 25.330 96.212 1.00 0.00 H new ATOM 1000 N ILE A 64 -75.413 21.169 99.480 1.00 0.00 N ATOM 1001 CA ILE A 64 -76.785 20.934 99.956 1.00 0.00 C ATOM 1002 C ILE A 64 -77.205 21.972 100.997 1.00 0.00 C ATOM 1003 O ILE A 64 -78.347 22.423 100.982 1.00 0.00 O ATOM 1004 CB ILE A 64 -76.898 19.491 100.502 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -76.719 18.447 99.377 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -78.196 19.228 101.283 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -77.755 18.466 98.244 1.00 0.00 C ATOM 0 H ILE A 64 -74.702 20.761 100.087 1.00 0.00 H new ATOM 0 HA ILE A 64 -77.474 21.045 99.119 1.00 0.00 H new ATOM 0 HB ILE A 64 -76.081 19.384 101.216 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -75.732 18.588 98.937 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -76.728 17.455 99.829 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -78.206 18.197 101.635 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -78.250 19.904 102.137 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -79.053 19.397 100.631 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -77.517 17.686 97.520 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -78.748 18.288 98.656 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -77.736 19.437 97.750 1.00 0.00 H new ATOM 1019 N SER A 65 -76.285 22.399 101.872 1.00 0.00 N ATOM 1020 CA SER A 65 -76.577 23.317 102.983 1.00 0.00 C ATOM 1021 C SER A 65 -77.038 24.733 102.582 1.00 0.00 C ATOM 1022 O SER A 65 -77.395 25.504 103.478 1.00 0.00 O ATOM 1023 CB SER A 65 -75.332 23.433 103.864 1.00 0.00 C ATOM 1024 OG SER A 65 -75.618 24.191 105.019 1.00 0.00 O ATOM 0 H SER A 65 -75.306 22.114 101.829 1.00 0.00 H new ATOM 0 HA SER A 65 -77.426 22.877 103.506 1.00 0.00 H new ATOM 0 HB2 SER A 65 -74.986 22.439 104.149 1.00 0.00 H new ATOM 0 HB3 SER A 65 -74.524 23.903 103.303 1.00 0.00 H new ATOM 0 HG SER A 65 -76.456 24.681 104.889 1.00 0.00 H new ATOM 1030 N SER A 66 -76.992 25.072 101.285 1.00 0.00 N ATOM 1031 CA SER A 66 -77.095 26.370 100.576 1.00 0.00 C ATOM 1032 C SER A 66 -75.782 26.635 99.828 1.00 0.00 C ATOM 1033 O SER A 66 -74.797 25.922 100.030 1.00 0.00 O ATOM 1034 CB SER A 66 -77.386 27.586 101.479 1.00 0.00 C ATOM 1035 OG SER A 66 -78.571 27.398 102.214 1.00 0.00 O ATOM 0 H SER A 66 -76.861 24.329 100.599 1.00 0.00 H new ATOM 0 HA SER A 66 -77.950 26.271 99.907 1.00 0.00 H new ATOM 0 HB2 SER A 66 -76.552 27.744 102.162 1.00 0.00 H new ATOM 0 HB3 SER A 66 -77.472 28.485 100.868 1.00 0.00 H new ATOM 0 HG SER A 66 -78.397 26.794 102.966 1.00 0.00 H new ATOM 1041 N THR A 67 -75.716 27.700 99.017 1.00 0.00 N ATOM 1042 CA THR A 67 -74.421 28.277 98.631 1.00 0.00 C ATOM 1043 C THR A 67 -73.742 28.858 99.890 1.00 0.00 C ATOM 1044 O THR A 67 -74.329 29.749 100.510 1.00 0.00 O ATOM 1045 CB THR A 67 -74.551 29.365 97.559 1.00 0.00 C ATOM 1046 OG1 THR A 67 -75.410 28.964 96.517 1.00 0.00 O ATOM 1047 CG2 THR A 67 -73.185 29.651 96.931 1.00 0.00 C ATOM 0 H THR A 67 -76.529 28.173 98.621 1.00 0.00 H new ATOM 0 HA THR A 67 -73.817 27.481 98.196 1.00 0.00 H new ATOM 0 HB THR A 67 -74.954 30.249 98.053 1.00 0.00 H new ATOM 0 HG1 THR A 67 -75.473 29.680 95.851 1.00 0.00 H new ATOM 0 HG21 THR A 67 -73.289 30.425 96.171 1.00 0.00 H new ATOM 0 HG22 THR A 67 -72.494 29.990 97.702 1.00 0.00 H new ATOM 0 HG23 THR A 67 -72.798 28.741 96.472 1.00 0.00 H new ATOM 1055 N PRO A 68 -72.566 28.353 100.311 1.00 0.00 N ATOM 1056 CA PRO A 68 -71.908 28.713 101.575 1.00 0.00 C ATOM 1057 C PRO A 68 -71.635 30.207 101.767 1.00 0.00 C ATOM 1058 O PRO A 68 -71.436 30.932 100.794 1.00 0.00 O ATOM 1059 CB PRO A 68 -70.570 27.973 101.538 1.00 0.00 C ATOM 1060 CG PRO A 68 -70.903 26.734 100.726 1.00 0.00 C ATOM 1061 CD PRO A 68 -71.810 27.300 99.650 1.00 0.00 C ATOM 0 HA PRO A 68 -72.567 28.444 102.401 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -69.789 28.570 101.066 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -70.218 27.720 102.538 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -70.011 26.269 100.306 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -71.405 25.975 101.326 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -71.232 27.694 98.814 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -72.471 26.533 99.247 1.00 0.00 H new ATOM 1069 N LEU A 69 -71.499 30.653 103.024 1.00 0.00 N ATOM 1070 CA LEU A 69 -71.085 32.023 103.339 1.00 0.00 C ATOM 1071 C LEU A 69 -70.210 32.154 104.596 1.00 0.00 C ATOM 1072 O LEU A 69 -70.063 31.209 105.374 1.00 0.00 O ATOM 1073 CB LEU A 69 -72.325 32.938 103.371 1.00 0.00 C ATOM 1074 CG LEU A 69 -73.251 32.719 104.586 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -73.470 34.043 105.324 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -74.598 32.143 104.145 1.00 0.00 C ATOM 0 H LEU A 69 -71.673 30.075 103.846 1.00 0.00 H new ATOM 0 HA LEU A 69 -70.421 32.351 102.539 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -71.995 33.977 103.365 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -72.900 32.781 102.459 1.00 0.00 H new ATOM 0 HG LEU A 69 -72.772 32.006 105.258 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -74.125 33.879 106.180 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -72.511 34.430 105.670 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -73.930 34.764 104.649 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -75.234 31.997 105.018 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -75.081 32.835 103.455 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -74.439 31.186 103.647 1.00 0.00 H new ATOM 1088 N ALA A 70 -69.642 33.350 104.764 1.00 0.00 N ATOM 1089 CA ALA A 70 -68.867 33.811 105.911 1.00 0.00 C ATOM 1090 C ALA A 70 -69.198 35.293 106.163 1.00 0.00 C ATOM 1091 O ALA A 70 -69.323 36.068 105.215 1.00 0.00 O ATOM 1092 CB ALA A 70 -67.372 33.617 105.609 1.00 0.00 C ATOM 0 H ALA A 70 -69.719 34.072 104.048 1.00 0.00 H new ATOM 0 HA ALA A 70 -69.114 33.241 106.807 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -66.782 33.958 106.459 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -67.171 32.561 105.428 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -67.102 34.194 104.725 1.00 0.00 H new ATOM 1098 N GLU A 71 -69.339 35.704 107.425 1.00 0.00 N ATOM 1099 CA GLU A 71 -69.715 37.074 107.807 1.00 0.00 C ATOM 1100 C GLU A 71 -68.498 37.942 108.185 1.00 0.00 C ATOM 1101 O GLU A 71 -68.602 39.170 108.196 1.00 0.00 O ATOM 1102 CB GLU A 71 -70.720 36.998 108.973 1.00 0.00 C ATOM 1103 CG GLU A 71 -72.120 36.511 108.545 1.00 0.00 C ATOM 1104 CD GLU A 71 -72.921 37.543 107.735 1.00 0.00 C ATOM 1105 OE1 GLU A 71 -72.586 38.749 107.807 1.00 0.00 O ATOM 1106 OE2 GLU A 71 -73.909 37.150 107.075 1.00 0.00 O ATOM 0 H GLU A 71 -69.194 35.088 108.225 1.00 0.00 H new ATOM 0 HA GLU A 71 -70.172 37.559 106.944 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -70.328 36.327 109.737 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -70.810 37.984 109.430 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -72.012 35.603 107.951 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -72.688 36.243 109.436 1.00 0.00 H new ATOM 1113 N ASN A 72 -67.353 37.317 108.477 1.00 0.00 N ATOM 1114 CA ASN A 72 -66.021 37.875 108.731 1.00 0.00 C ATOM 1115 C ASN A 72 -65.005 36.715 108.713 1.00 0.00 C ATOM 1116 O ASN A 72 -65.409 35.553 108.675 1.00 0.00 O ATOM 1117 CB ASN A 72 -66.007 38.601 110.101 1.00 0.00 C ATOM 1118 CG ASN A 72 -65.818 40.108 109.990 1.00 0.00 C ATOM 1119 OD1 ASN A 72 -64.987 40.702 110.654 1.00 0.00 O ATOM 1120 ND2 ASN A 72 -66.611 40.775 109.178 1.00 0.00 N ATOM 0 H ASN A 72 -67.335 36.300 108.549 1.00 0.00 H new ATOM 0 HA ASN A 72 -65.757 38.604 107.965 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -66.944 38.398 110.620 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -65.207 38.187 110.714 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -66.530 41.789 109.105 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -67.307 40.278 108.622 1.00 0.00 H new ATOM 1127 N THR A 73 -63.699 36.995 108.821 1.00 0.00 N ATOM 1128 CA THR A 73 -62.659 35.958 108.949 1.00 0.00 C ATOM 1129 C THR A 73 -62.966 34.962 110.064 1.00 0.00 C ATOM 1130 O THR A 73 -62.887 33.758 109.852 1.00 0.00 O ATOM 1131 CB THR A 73 -61.248 36.573 109.071 1.00 0.00 C ATOM 1132 OG1 THR A 73 -60.626 36.428 107.816 1.00 0.00 O ATOM 1133 CG2 THR A 73 -60.292 35.948 110.095 1.00 0.00 C ATOM 0 H THR A 73 -63.331 37.946 108.822 1.00 0.00 H new ATOM 0 HA THR A 73 -62.668 35.383 108.023 1.00 0.00 H new ATOM 0 HB THR A 73 -61.418 37.595 109.411 1.00 0.00 H new ATOM 0 HG1 THR A 73 -60.314 35.505 107.710 1.00 0.00 H new ATOM 0 HG21 THR A 73 -59.339 36.478 110.074 1.00 0.00 H new ATOM 0 HG22 THR A 73 -60.727 36.023 111.092 1.00 0.00 H new ATOM 0 HG23 THR A 73 -60.129 34.899 109.848 1.00 0.00 H new ATOM 1141 N ASN A 74 -63.391 35.455 111.230 1.00 0.00 N ATOM 1142 CA ASN A 74 -63.758 34.655 112.398 1.00 0.00 C ATOM 1143 C ASN A 74 -65.007 33.770 112.184 1.00 0.00 C ATOM 1144 O ASN A 74 -65.317 32.953 113.048 1.00 0.00 O ATOM 1145 CB ASN A 74 -63.953 35.607 113.594 1.00 0.00 C ATOM 1146 CG ASN A 74 -62.790 36.574 113.784 1.00 0.00 C ATOM 1147 OD1 ASN A 74 -62.610 37.500 113.008 1.00 0.00 O ATOM 1148 ND2 ASN A 74 -61.967 36.390 114.796 1.00 0.00 N ATOM 0 H ASN A 74 -63.492 36.457 111.391 1.00 0.00 H new ATOM 0 HA ASN A 74 -62.947 33.952 112.589 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -64.872 36.176 113.452 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -64.080 35.018 114.502 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -61.178 37.021 114.933 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -62.119 35.616 115.443 1.00 0.00 H new ATOM 1155 N SER A 75 -65.725 33.907 111.057 1.00 0.00 N ATOM 1156 CA SER A 75 -66.829 33.016 110.695 1.00 0.00 C ATOM 1157 C SER A 75 -66.307 31.644 110.289 1.00 0.00 C ATOM 1158 O SER A 75 -65.783 31.472 109.187 1.00 0.00 O ATOM 1159 CB SER A 75 -67.658 33.573 109.541 1.00 0.00 C ATOM 1160 OG SER A 75 -68.190 34.820 109.915 1.00 0.00 O ATOM 0 H SER A 75 -65.552 34.643 110.372 1.00 0.00 H new ATOM 0 HA SER A 75 -67.460 32.933 111.580 1.00 0.00 H new ATOM 0 HB2 SER A 75 -67.038 33.681 108.651 1.00 0.00 H new ATOM 0 HB3 SER A 75 -68.462 32.882 109.288 1.00 0.00 H new ATOM 0 HG SER A 75 -68.983 34.683 110.475 1.00 0.00 H new ATOM 1166 N VAL A 76 -66.499 30.663 111.170 1.00 0.00 N ATOM 1167 CA VAL A 76 -66.563 29.268 110.745 1.00 0.00 C ATOM 1168 C VAL A 76 -67.915 28.965 110.088 1.00 0.00 C ATOM 1169 O VAL A 76 -68.937 29.525 110.487 1.00 0.00 O ATOM 1170 CB VAL A 76 -66.308 28.288 111.901 1.00 0.00 C ATOM 1171 CG1 VAL A 76 -64.832 28.299 112.309 1.00 0.00 C ATOM 1172 CG2 VAL A 76 -67.177 28.537 113.143 1.00 0.00 C ATOM 0 H VAL A 76 -66.612 30.807 112.173 1.00 0.00 H new ATOM 0 HA VAL A 76 -65.766 29.125 110.015 1.00 0.00 H new ATOM 0 HB VAL A 76 -66.589 27.310 111.510 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -64.676 27.598 113.129 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -64.217 28.005 111.458 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -64.551 29.302 112.631 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -66.934 27.802 113.910 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -66.985 29.539 113.526 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -68.230 28.447 112.875 1.00 0.00 H new ATOM 1182 N THR A 77 -67.931 28.031 109.130 1.00 0.00 N ATOM 1183 CA THR A 77 -69.164 27.604 108.444 1.00 0.00 C ATOM 1184 C THR A 77 -69.135 26.093 108.200 1.00 0.00 C ATOM 1185 O THR A 77 -68.250 25.605 107.498 1.00 0.00 O ATOM 1186 CB THR A 77 -69.404 28.361 107.114 1.00 0.00 C ATOM 1187 OG1 THR A 77 -69.027 29.719 107.197 1.00 0.00 O ATOM 1188 CG2 THR A 77 -70.887 28.330 106.745 1.00 0.00 C ATOM 0 H THR A 77 -67.093 27.548 108.806 1.00 0.00 H new ATOM 0 HA THR A 77 -69.997 27.852 109.101 1.00 0.00 H new ATOM 0 HB THR A 77 -68.795 27.858 106.363 1.00 0.00 H new ATOM 0 HG1 THR A 77 -69.655 30.265 106.680 1.00 0.00 H new ATOM 0 HG21 THR A 77 -71.040 28.866 105.808 1.00 0.00 H new ATOM 0 HG22 THR A 77 -71.211 27.296 106.629 1.00 0.00 H new ATOM 0 HG23 THR A 77 -71.468 28.806 107.535 1.00 0.00 H new ATOM 1196 N ASN A 78 -70.083 25.348 108.791 1.00 0.00 N ATOM 1197 CA ASN A 78 -70.264 23.913 108.544 1.00 0.00 C ATOM 1198 C ASN A 78 -71.222 23.655 107.365 1.00 0.00 C ATOM 1199 O ASN A 78 -72.382 24.064 107.398 1.00 0.00 O ATOM 1200 CB ASN A 78 -70.646 23.163 109.837 1.00 0.00 C ATOM 1201 CG ASN A 78 -71.823 23.714 110.636 1.00 0.00 C ATOM 1202 OD1 ASN A 78 -71.709 23.966 111.823 1.00 0.00 O ATOM 1203 ND2 ASN A 78 -72.978 23.903 110.035 1.00 0.00 N ATOM 0 H ASN A 78 -70.751 25.731 109.460 1.00 0.00 H new ATOM 0 HA ASN A 78 -69.306 23.496 108.234 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -70.869 22.129 109.575 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -69.773 23.146 110.489 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -73.775 24.260 110.562 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -73.076 23.693 109.042 1.00 0.00 H new ATOM 1210 N ILE A 79 -70.729 22.985 106.322 1.00 0.00 N ATOM 1211 CA ILE A 79 -71.362 22.855 105.010 1.00 0.00 C ATOM 1212 C ILE A 79 -71.610 21.383 104.673 1.00 0.00 C ATOM 1213 O ILE A 79 -70.669 20.629 104.420 1.00 0.00 O ATOM 1214 CB ILE A 79 -70.487 23.564 103.948 1.00 0.00 C ATOM 1215 CG1 ILE A 79 -70.374 25.087 104.193 1.00 0.00 C ATOM 1216 CG2 ILE A 79 -70.988 23.299 102.519 1.00 0.00 C ATOM 1217 CD1 ILE A 79 -71.714 25.839 104.270 1.00 0.00 C ATOM 0 H ILE A 79 -69.836 22.496 106.372 1.00 0.00 H new ATOM 0 HA ILE A 79 -72.338 23.340 105.021 1.00 0.00 H new ATOM 0 HB ILE A 79 -69.491 23.133 104.052 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -69.830 25.250 105.124 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -69.776 25.524 103.394 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -70.345 23.815 101.806 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -70.965 22.228 102.318 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -72.010 23.666 102.418 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -71.527 26.899 104.444 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -72.255 25.715 103.332 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -72.310 25.437 105.089 1.00 0.00 H new ATOM 1229 N GLU A 80 -72.892 20.996 104.652 1.00 0.00 N ATOM 1230 CA GLU A 80 -73.378 19.766 104.022 1.00 0.00 C ATOM 1231 C GLU A 80 -73.263 19.844 102.487 1.00 0.00 C ATOM 1232 O GLU A 80 -73.808 20.751 101.843 1.00 0.00 O ATOM 1233 CB GLU A 80 -74.833 19.474 104.438 1.00 0.00 C ATOM 1234 CG GLU A 80 -75.230 18.062 103.978 1.00 0.00 C ATOM 1235 CD GLU A 80 -76.695 17.675 104.211 1.00 0.00 C ATOM 1236 OE1 GLU A 80 -77.492 18.529 104.647 1.00 0.00 O ATOM 1237 OE2 GLU A 80 -77.003 16.495 103.895 1.00 0.00 O ATOM 0 H GLU A 80 -73.636 21.544 105.084 1.00 0.00 H new ATOM 0 HA GLU A 80 -72.749 18.946 104.368 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -74.936 19.557 105.520 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -75.503 20.212 103.997 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -75.015 17.973 102.913 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -74.596 17.340 104.493 1.00 0.00 H new ATOM 1244 N LEU A 81 -72.557 18.868 101.914 1.00 0.00 N ATOM 1245 CA LEU A 81 -72.117 18.808 100.523 1.00 0.00 C ATOM 1246 C LEU A 81 -72.210 17.356 100.003 1.00 0.00 C ATOM 1247 O LEU A 81 -71.937 16.414 100.741 1.00 0.00 O ATOM 1248 CB LEU A 81 -70.691 19.391 100.564 1.00 0.00 C ATOM 1249 CG LEU A 81 -69.838 19.315 99.296 1.00 0.00 C ATOM 1250 CD1 LEU A 81 -70.462 20.025 98.098 1.00 0.00 C ATOM 1251 CD2 LEU A 81 -68.476 19.957 99.587 1.00 0.00 C ATOM 0 H LEU A 81 -72.260 18.048 102.443 1.00 0.00 H new ATOM 0 HA LEU A 81 -72.731 19.375 99.823 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -70.769 20.440 100.849 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -70.147 18.884 101.361 1.00 0.00 H new ATOM 0 HG LEU A 81 -69.750 18.261 99.033 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -69.803 19.930 97.235 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -71.427 19.573 97.869 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -70.603 21.080 98.333 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -67.854 19.912 98.693 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -68.619 20.998 99.877 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -67.986 19.418 100.398 1.00 0.00 H new ATOM 1263 N GLU A 82 -72.617 17.159 98.744 1.00 0.00 N ATOM 1264 CA GLU A 82 -72.971 15.861 98.145 1.00 0.00 C ATOM 1265 C GLU A 82 -71.960 15.480 97.036 1.00 0.00 C ATOM 1266 O GLU A 82 -72.023 16.058 95.951 1.00 0.00 O ATOM 1267 CB GLU A 82 -74.434 15.937 97.652 1.00 0.00 C ATOM 1268 CG GLU A 82 -75.215 14.609 97.656 1.00 0.00 C ATOM 1269 CD GLU A 82 -75.141 13.778 96.371 1.00 0.00 C ATOM 1270 OE1 GLU A 82 -74.600 14.263 95.353 1.00 0.00 O ATOM 1271 OE2 GLU A 82 -75.595 12.610 96.420 1.00 0.00 O ATOM 0 H GLU A 82 -72.714 17.931 98.084 1.00 0.00 H new ATOM 0 HA GLU A 82 -72.909 15.059 98.881 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -74.970 16.653 98.275 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -74.435 16.334 96.637 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -74.848 13.998 98.481 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -76.263 14.828 97.863 1.00 0.00 H new ATOM 1278 N PRO A 83 -70.973 14.591 97.301 1.00 0.00 N ATOM 1279 CA PRO A 83 -69.968 14.149 96.322 1.00 0.00 C ATOM 1280 C PRO A 83 -70.495 13.097 95.320 1.00 0.00 C ATOM 1281 O PRO A 83 -71.589 12.565 95.500 1.00 0.00 O ATOM 1282 CB PRO A 83 -68.813 13.563 97.154 1.00 0.00 C ATOM 1283 CG PRO A 83 -69.290 13.504 98.605 1.00 0.00 C ATOM 1284 CD PRO A 83 -70.748 13.940 98.583 1.00 0.00 C ATOM 0 HA PRO A 83 -69.664 14.993 95.703 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -68.546 12.569 96.796 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -67.921 14.184 97.066 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -69.190 12.496 99.008 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -68.695 14.162 99.239 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -71.410 13.082 98.702 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -70.960 14.623 99.406 1.00 0.00 H new ATOM 1292 N PRO A 84 -69.718 12.708 94.289 1.00 0.00 N ATOM 1293 CA PRO A 84 -69.975 11.482 93.527 1.00 0.00 C ATOM 1294 C PRO A 84 -69.637 10.236 94.363 1.00 0.00 C ATOM 1295 O PRO A 84 -68.873 10.320 95.321 1.00 0.00 O ATOM 1296 CB PRO A 84 -69.042 11.580 92.317 1.00 0.00 C ATOM 1297 CG PRO A 84 -67.824 12.288 92.909 1.00 0.00 C ATOM 1298 CD PRO A 84 -68.458 13.304 93.863 1.00 0.00 C ATOM 0 HA PRO A 84 -71.023 11.388 93.242 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -68.788 10.598 91.917 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -69.489 12.150 91.503 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -67.167 11.594 93.434 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -67.224 12.774 92.140 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -67.808 13.499 94.716 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -68.625 14.259 93.364 1.00 0.00 H new ATOM 1306 N PHE A 85 -70.143 9.058 93.982 1.00 0.00 N ATOM 1307 CA PHE A 85 -69.659 7.779 94.514 1.00 0.00 C ATOM 1308 C PHE A 85 -68.273 7.460 93.934 1.00 0.00 C ATOM 1309 O PHE A 85 -68.160 7.060 92.777 1.00 0.00 O ATOM 1310 CB PHE A 85 -70.663 6.652 94.233 1.00 0.00 C ATOM 1311 CG PHE A 85 -71.817 6.604 95.216 1.00 0.00 C ATOM 1312 CD1 PHE A 85 -72.929 7.452 95.055 1.00 0.00 C ATOM 1313 CD2 PHE A 85 -71.779 5.704 96.300 1.00 0.00 C ATOM 1314 CE1 PHE A 85 -73.999 7.396 95.966 1.00 0.00 C ATOM 1315 CE2 PHE A 85 -72.857 5.636 97.201 1.00 0.00 C ATOM 1316 CZ PHE A 85 -73.966 6.485 97.037 1.00 0.00 C ATOM 0 H PHE A 85 -70.896 8.964 93.300 1.00 0.00 H new ATOM 0 HA PHE A 85 -69.564 7.861 95.597 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -71.060 6.774 93.225 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -70.139 5.697 94.255 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -72.961 8.148 94.229 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -70.920 5.065 96.439 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -74.847 8.053 95.843 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -72.833 4.931 98.019 1.00 0.00 H new ATOM 0 HZ PHE A 85 -74.791 6.438 97.732 1.00 0.00 H new ATOM 1326 N GLY A 86 -67.222 7.672 94.732 1.00 0.00 N ATOM 1327 CA GLY A 86 -65.824 7.521 94.331 1.00 0.00 C ATOM 1328 C GLY A 86 -64.925 8.574 94.982 1.00 0.00 C ATOM 1329 O GLY A 86 -65.354 9.281 95.898 1.00 0.00 O ATOM 0 H GLY A 86 -67.326 7.962 95.704 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -65.474 6.526 94.605 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -65.747 7.599 93.247 1.00 0.00 H new ATOM 1333 N ASP A 87 -63.673 8.647 94.513 1.00 0.00 N ATOM 1334 CA ASP A 87 -62.694 9.666 94.904 1.00 0.00 C ATOM 1335 C ASP A 87 -62.970 11.003 94.194 1.00 0.00 C ATOM 1336 O ASP A 87 -63.320 11.033 93.012 1.00 0.00 O ATOM 1337 CB ASP A 87 -61.274 9.172 94.585 1.00 0.00 C ATOM 1338 CG ASP A 87 -60.225 9.915 95.417 1.00 0.00 C ATOM 1339 OD1 ASP A 87 -60.335 9.824 96.667 1.00 0.00 O ATOM 1340 OD2 ASP A 87 -59.345 10.572 94.827 1.00 0.00 O ATOM 0 H ASP A 87 -63.305 7.981 93.834 1.00 0.00 H new ATOM 0 HA ASP A 87 -62.782 9.835 95.977 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -61.206 8.102 94.782 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -61.067 9.314 93.524 1.00 0.00 H new ATOM 1345 N SER A 88 -62.827 12.119 94.914 1.00 0.00 N ATOM 1346 CA SER A 88 -63.174 13.459 94.431 1.00 0.00 C ATOM 1347 C SER A 88 -62.466 14.566 95.227 1.00 0.00 C ATOM 1348 O SER A 88 -61.932 14.310 96.309 1.00 0.00 O ATOM 1349 CB SER A 88 -64.694 13.615 94.513 1.00 0.00 C ATOM 1350 OG SER A 88 -65.137 13.548 95.856 1.00 0.00 O ATOM 0 H SER A 88 -62.460 12.117 95.866 1.00 0.00 H new ATOM 0 HA SER A 88 -62.836 13.564 93.400 1.00 0.00 H new ATOM 0 HB2 SER A 88 -64.990 14.568 94.075 1.00 0.00 H new ATOM 0 HB3 SER A 88 -65.176 12.832 93.927 1.00 0.00 H new ATOM 0 HG SER A 88 -66.024 13.957 95.929 1.00 0.00 H new ATOM 1356 N TYR A 89 -62.451 15.794 94.684 1.00 0.00 N ATOM 1357 CA TYR A 89 -61.612 16.891 95.176 1.00 0.00 C ATOM 1358 C TYR A 89 -62.428 18.158 95.410 1.00 0.00 C ATOM 1359 O TYR A 89 -62.860 18.841 94.482 1.00 0.00 O ATOM 1360 CB TYR A 89 -60.399 17.098 94.263 1.00 0.00 C ATOM 1361 CG TYR A 89 -59.482 15.899 94.364 1.00 0.00 C ATOM 1362 CD1 TYR A 89 -59.770 14.757 93.597 1.00 0.00 C ATOM 1363 CD2 TYR A 89 -58.490 15.846 95.364 1.00 0.00 C ATOM 1364 CE1 TYR A 89 -59.149 13.535 93.898 1.00 0.00 C ATOM 1365 CE2 TYR A 89 -57.829 14.632 95.632 1.00 0.00 C ATOM 1366 CZ TYR A 89 -58.202 13.459 94.939 1.00 0.00 C ATOM 1367 OH TYR A 89 -57.666 12.258 95.270 1.00 0.00 O ATOM 0 H TYR A 89 -63.028 16.052 93.883 1.00 0.00 H new ATOM 0 HA TYR A 89 -61.215 16.618 96.154 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -60.725 17.234 93.232 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -59.864 18.003 94.550 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -60.469 14.820 92.776 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -58.237 16.735 95.923 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -59.397 12.650 93.330 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -57.038 14.598 96.366 1.00 0.00 H new ATOM 0 HH TYR A 89 -58.133 11.546 94.785 1.00 0.00 H new ATOM 1377 N ILE A 90 -62.667 18.421 96.692 1.00 0.00 N ATOM 1378 CA ILE A 90 -63.426 19.535 97.235 1.00 0.00 C ATOM 1379 C ILE A 90 -62.528 20.764 97.168 1.00 0.00 C ATOM 1380 O ILE A 90 -61.424 20.734 97.714 1.00 0.00 O ATOM 1381 CB ILE A 90 -63.855 19.224 98.687 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -64.809 18.017 98.787 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -64.598 20.434 99.282 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -64.217 16.623 98.571 1.00 0.00 C ATOM 0 H ILE A 90 -62.307 17.815 97.429 1.00 0.00 H new ATOM 0 HA ILE A 90 -64.338 19.711 96.665 1.00 0.00 H new ATOM 0 HB ILE A 90 -62.938 18.997 99.230 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -65.271 18.036 99.774 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -65.607 18.159 98.058 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -64.898 20.209 100.306 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -63.940 21.303 99.279 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -65.483 20.648 98.683 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -65.003 15.874 98.671 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -63.783 16.563 97.573 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -63.442 16.437 99.315 1.00 0.00 H new ATOM 1396 N VAL A 91 -62.994 21.828 96.507 1.00 0.00 N ATOM 1397 CA VAL A 91 -62.251 23.085 96.366 1.00 0.00 C ATOM 1398 C VAL A 91 -62.981 24.177 97.149 1.00 0.00 C ATOM 1399 O VAL A 91 -64.172 24.393 96.926 1.00 0.00 O ATOM 1400 CB VAL A 91 -61.888 23.447 94.901 1.00 0.00 C ATOM 1401 CG1 VAL A 91 -61.740 22.218 93.990 1.00 0.00 C ATOM 1402 CG2 VAL A 91 -62.819 24.455 94.217 1.00 0.00 C ATOM 0 H VAL A 91 -63.906 21.842 96.050 1.00 0.00 H new ATOM 0 HA VAL A 91 -61.262 22.966 96.809 1.00 0.00 H new ATOM 0 HB VAL A 91 -60.921 23.934 95.024 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -61.486 22.542 92.981 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -60.949 21.573 94.374 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -62.680 21.666 93.968 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -62.474 24.636 93.199 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -63.833 24.055 94.191 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -62.813 25.392 94.774 1.00 0.00 H new ATOM 1412 N ILE A 92 -62.287 24.814 98.103 1.00 0.00 N ATOM 1413 CA ILE A 92 -62.832 25.854 98.992 1.00 0.00 C ATOM 1414 C ILE A 92 -61.989 27.129 98.850 1.00 0.00 C ATOM 1415 O ILE A 92 -60.879 27.220 99.379 1.00 0.00 O ATOM 1416 CB ILE A 92 -62.968 25.367 100.454 1.00 0.00 C ATOM 1417 CG1 ILE A 92 -63.710 24.012 100.520 1.00 0.00 C ATOM 1418 CG2 ILE A 92 -63.631 26.459 101.316 1.00 0.00 C ATOM 1419 CD1 ILE A 92 -63.927 23.456 101.930 1.00 0.00 C ATOM 0 H ILE A 92 -61.303 24.615 98.284 1.00 0.00 H new ATOM 0 HA ILE A 92 -63.852 26.088 98.687 1.00 0.00 H new ATOM 0 HB ILE A 92 -61.975 25.189 100.868 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -64.681 24.124 100.037 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -63.148 23.280 99.940 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -63.722 26.106 102.343 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -63.019 27.361 101.295 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -64.622 26.683 100.920 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -64.455 22.504 101.869 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -62.962 23.305 102.414 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -64.519 24.162 102.513 1.00 0.00 H new ATOM 1431 N GLY A 93 -62.509 28.080 98.071 1.00 0.00 N ATOM 1432 CA GLY A 93 -61.792 29.204 97.464 1.00 0.00 C ATOM 1433 C GLY A 93 -61.806 29.078 95.933 1.00 0.00 C ATOM 1434 O GLY A 93 -62.291 28.081 95.399 1.00 0.00 O ATOM 0 H GLY A 93 -63.501 28.087 97.833 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -62.255 30.144 97.763 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -60.764 29.226 97.825 1.00 0.00 H new ATOM 1438 N VAL A 94 -61.258 30.066 95.212 1.00 0.00 N ATOM 1439 CA VAL A 94 -61.114 30.005 93.742 1.00 0.00 C ATOM 1440 C VAL A 94 -59.649 29.790 93.361 1.00 0.00 C ATOM 1441 O VAL A 94 -58.764 30.382 93.976 1.00 0.00 O ATOM 1442 CB VAL A 94 -61.706 31.239 93.022 1.00 0.00 C ATOM 1443 CG1 VAL A 94 -63.158 31.492 93.442 1.00 0.00 C ATOM 1444 CG2 VAL A 94 -60.880 32.517 93.218 1.00 0.00 C ATOM 0 H VAL A 94 -60.902 30.928 95.624 1.00 0.00 H new ATOM 0 HA VAL A 94 -61.698 29.151 93.400 1.00 0.00 H new ATOM 0 HB VAL A 94 -61.674 30.994 91.960 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -63.542 32.366 92.916 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -63.766 30.623 93.192 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -63.201 31.667 94.517 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -61.354 33.342 92.686 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -60.824 32.755 94.280 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -59.874 32.363 92.828 1.00 0.00 H new ATOM 1454 N GLY A 95 -59.411 28.945 92.347 1.00 0.00 N ATOM 1455 CA GLY A 95 -58.110 28.529 91.805 1.00 0.00 C ATOM 1456 C GLY A 95 -56.921 28.661 92.764 1.00 0.00 C ATOM 1457 O GLY A 95 -56.732 27.825 93.645 1.00 0.00 O ATOM 0 H GLY A 95 -60.182 28.501 91.847 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -58.184 27.489 91.488 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -57.902 29.120 90.913 1.00 0.00 H new ATOM 1461 N ASN A 96 -56.134 29.732 92.608 1.00 0.00 N ATOM 1462 CA ASN A 96 -54.918 30.023 93.379 1.00 0.00 C ATOM 1463 C ASN A 96 -55.112 30.146 94.905 1.00 0.00 C ATOM 1464 O ASN A 96 -54.128 30.091 95.638 1.00 0.00 O ATOM 1465 CB ASN A 96 -54.300 31.312 92.811 1.00 0.00 C ATOM 1466 CG ASN A 96 -55.267 32.485 92.876 1.00 0.00 C ATOM 1467 OD1 ASN A 96 -56.010 32.734 91.939 1.00 0.00 O ATOM 1468 ND2 ASN A 96 -55.334 33.192 93.985 1.00 0.00 N ATOM 0 H ASN A 96 -56.335 30.450 91.912 1.00 0.00 H new ATOM 0 HA ASN A 96 -54.258 29.163 93.266 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -53.396 31.556 93.368 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -54.001 31.145 91.776 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -56.009 33.952 94.065 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -54.711 32.979 94.764 1.00 0.00 H new ATOM 1475 N SER A 97 -56.348 30.317 95.384 1.00 0.00 N ATOM 1476 CA SER A 97 -56.713 30.407 96.804 1.00 0.00 C ATOM 1477 C SER A 97 -57.495 29.179 97.296 1.00 0.00 C ATOM 1478 O SER A 97 -57.856 29.125 98.472 1.00 0.00 O ATOM 1479 CB SER A 97 -57.583 31.648 97.033 1.00 0.00 C ATOM 1480 OG SER A 97 -56.930 32.845 96.662 1.00 0.00 O ATOM 0 H SER A 97 -57.157 30.400 94.768 1.00 0.00 H new ATOM 0 HA SER A 97 -55.780 30.464 97.364 1.00 0.00 H new ATOM 0 HB2 SER A 97 -58.506 31.550 96.462 1.00 0.00 H new ATOM 0 HB3 SER A 97 -57.863 31.702 98.085 1.00 0.00 H new ATOM 0 HG SER A 97 -57.572 33.449 96.234 1.00 0.00 H new ATOM 1486 N ALA A 98 -57.805 28.223 96.410 1.00 0.00 N ATOM 1487 CA ALA A 98 -58.714 27.118 96.685 1.00 0.00 C ATOM 1488 C ALA A 98 -58.053 25.982 97.474 1.00 0.00 C ATOM 1489 O ALA A 98 -57.241 25.226 96.928 1.00 0.00 O ATOM 1490 CB ALA A 98 -59.298 26.599 95.368 1.00 0.00 C ATOM 0 H ALA A 98 -57.420 28.202 95.466 1.00 0.00 H new ATOM 0 HA ALA A 98 -59.514 27.500 97.319 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -59.978 25.772 95.572 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -59.842 27.402 94.870 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -58.490 26.253 94.723 1.00 0.00 H new ATOM 1496 N LEU A 99 -58.474 25.804 98.735 1.00 0.00 N ATOM 1497 CA LEU A 99 -58.214 24.585 99.503 1.00 0.00 C ATOM 1498 C LEU A 99 -58.760 23.393 98.716 1.00 0.00 C ATOM 1499 O LEU A 99 -59.969 23.174 98.703 1.00 0.00 O ATOM 1500 CB LEU A 99 -58.919 24.612 100.862 1.00 0.00 C ATOM 1501 CG LEU A 99 -58.576 25.763 101.805 1.00 0.00 C ATOM 1502 CD1 LEU A 99 -59.693 25.796 102.841 1.00 0.00 C ATOM 1503 CD2 LEU A 99 -57.234 25.538 102.501 1.00 0.00 C ATOM 0 H LEU A 99 -59.006 26.506 99.249 1.00 0.00 H new ATOM 0 HA LEU A 99 -57.139 24.509 99.667 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -59.994 24.630 100.684 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -58.697 23.677 101.376 1.00 0.00 H new ATOM 0 HG LEU A 99 -58.491 26.699 101.254 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -59.507 26.602 103.551 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -60.647 25.964 102.342 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -59.724 24.845 103.373 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -57.023 26.377 103.164 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -57.276 24.617 103.083 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -56.445 25.459 101.753 1.00 0.00 H new ATOM 1515 N THR A 100 -57.881 22.677 98.024 1.00 0.00 N ATOM 1516 CA THR A 100 -58.239 21.581 97.124 1.00 0.00 C ATOM 1517 C THR A 100 -57.920 20.268 97.829 1.00 0.00 C ATOM 1518 O THR A 100 -56.777 19.813 97.789 1.00 0.00 O ATOM 1519 CB THR A 100 -57.510 21.745 95.782 1.00 0.00 C ATOM 1520 OG1 THR A 100 -57.862 22.995 95.219 1.00 0.00 O ATOM 1521 CG2 THR A 100 -57.890 20.641 94.788 1.00 0.00 C ATOM 0 H THR A 100 -56.876 22.844 98.073 1.00 0.00 H new ATOM 0 HA THR A 100 -59.304 21.587 96.890 1.00 0.00 H new ATOM 0 HB THR A 100 -56.439 21.683 95.972 1.00 0.00 H new ATOM 0 HG1 THR A 100 -57.543 23.717 95.800 1.00 0.00 H new ATOM 0 HG21 THR A 100 -57.353 20.794 93.852 1.00 0.00 H new ATOM 0 HG22 THR A 100 -57.625 19.669 95.204 1.00 0.00 H new ATOM 0 HG23 THR A 100 -58.963 20.674 94.600 1.00 0.00 H new ATOM 1529 N LEU A 101 -58.910 19.691 98.521 1.00 0.00 N ATOM 1530 CA LEU A 101 -58.723 18.521 99.382 1.00 0.00 C ATOM 1531 C LEU A 101 -59.606 17.327 98.993 1.00 0.00 C ATOM 1532 O LEU A 101 -60.642 17.460 98.346 1.00 0.00 O ATOM 1533 CB LEU A 101 -58.853 18.906 100.869 1.00 0.00 C ATOM 1534 CG LEU A 101 -60.259 19.350 101.330 1.00 0.00 C ATOM 1535 CD1 LEU A 101 -60.572 18.723 102.687 1.00 0.00 C ATOM 1536 CD2 LEU A 101 -60.363 20.872 101.474 1.00 0.00 C ATOM 0 H LEU A 101 -59.872 20.028 98.497 1.00 0.00 H new ATOM 0 HA LEU A 101 -57.703 18.170 99.222 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -58.546 18.053 101.474 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -58.151 19.713 101.078 1.00 0.00 H new ATOM 0 HG LEU A 101 -60.968 19.022 100.570 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -61.564 19.036 103.012 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -60.544 17.637 102.601 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -59.831 19.048 103.418 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -61.368 21.139 101.800 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -59.639 21.218 102.211 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -60.156 21.343 100.513 1.00 0.00 H new ATOM 1548 N HIS A 102 -59.147 16.142 99.386 1.00 0.00 N ATOM 1549 CA HIS A 102 -59.676 14.837 99.003 1.00 0.00 C ATOM 1550 C HIS A 102 -60.944 14.417 99.760 1.00 0.00 C ATOM 1551 O HIS A 102 -61.062 14.637 100.963 1.00 0.00 O ATOM 1552 CB HIS A 102 -58.564 13.804 99.262 1.00 0.00 C ATOM 1553 CG HIS A 102 -57.881 13.863 100.620 1.00 0.00 C ATOM 1554 ND1 HIS A 102 -58.306 14.503 101.772 1.00 0.00 N ATOM 1555 CD2 HIS A 102 -56.673 13.282 100.905 1.00 0.00 C ATOM 1556 CE1 HIS A 102 -57.365 14.321 102.713 1.00 0.00 C ATOM 1557 NE2 HIS A 102 -56.358 13.576 102.234 1.00 0.00 N ATOM 0 H HIS A 102 -58.350 16.063 100.017 1.00 0.00 H new ATOM 0 HA HIS A 102 -59.970 14.894 97.955 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -58.989 12.808 99.138 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -57.802 13.924 98.492 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -59.178 15.020 101.886 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -56.071 12.700 100.223 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -57.413 14.719 103.716 1.00 0.00 H new ATOM 1565 N TRP A 103 -61.826 13.677 99.084 1.00 0.00 N ATOM 1566 CA TRP A 103 -62.815 12.796 99.708 1.00 0.00 C ATOM 1567 C TRP A 103 -63.059 11.565 98.847 1.00 0.00 C ATOM 1568 O TRP A 103 -63.172 11.681 97.625 1.00 0.00 O ATOM 1569 CB TRP A 103 -64.151 13.519 99.877 1.00 0.00 C ATOM 1570 CG TRP A 103 -65.207 12.794 100.661 1.00 0.00 C ATOM 1571 CD1 TRP A 103 -66.400 12.347 100.194 1.00 0.00 C ATOM 1572 CD2 TRP A 103 -65.178 12.438 102.072 1.00 0.00 C ATOM 1573 NE1 TRP A 103 -67.127 11.789 101.235 1.00 0.00 N ATOM 1574 CE2 TRP A 103 -66.430 11.858 102.415 1.00 0.00 C ATOM 1575 CE3 TRP A 103 -64.225 12.551 103.103 1.00 0.00 C ATOM 1576 CZ2 TRP A 103 -66.748 11.464 103.717 1.00 0.00 C ATOM 1577 CZ3 TRP A 103 -64.524 12.125 104.412 1.00 0.00 C ATOM 1578 CH2 TRP A 103 -65.786 11.594 104.726 1.00 0.00 C ATOM 0 H TRP A 103 -61.873 13.674 98.065 1.00 0.00 H new ATOM 0 HA TRP A 103 -62.419 12.503 100.680 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -63.962 14.477 100.362 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -64.550 13.736 98.886 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -66.733 12.415 99.169 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -68.057 11.381 101.136 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -63.253 12.969 102.887 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -67.725 11.063 103.943 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -63.773 12.208 105.184 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -66.012 11.289 105.737 1.00 0.00 H new ATOM 1589 N PHE A 104 -63.280 10.425 99.503 1.00 0.00 N ATOM 1590 CA PHE A 104 -63.874 9.248 98.883 1.00 0.00 C ATOM 1591 C PHE A 104 -65.232 8.986 99.533 1.00 0.00 C ATOM 1592 O PHE A 104 -65.315 8.745 100.743 1.00 0.00 O ATOM 1593 CB PHE A 104 -62.915 8.057 98.945 1.00 0.00 C ATOM 1594 CG PHE A 104 -63.434 6.820 98.233 1.00 0.00 C ATOM 1595 CD1 PHE A 104 -64.462 6.048 98.806 1.00 0.00 C ATOM 1596 CD2 PHE A 104 -62.911 6.450 96.981 1.00 0.00 C ATOM 1597 CE1 PHE A 104 -64.982 4.934 98.127 1.00 0.00 C ATOM 1598 CE2 PHE A 104 -63.426 5.332 96.299 1.00 0.00 C ATOM 1599 CZ PHE A 104 -64.467 4.578 96.870 1.00 0.00 C ATOM 0 H PHE A 104 -63.048 10.295 100.488 1.00 0.00 H new ATOM 0 HA PHE A 104 -64.048 9.417 97.820 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -61.961 8.346 98.504 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -62.722 7.811 99.989 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -64.854 6.315 99.776 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -62.111 7.026 96.541 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -65.776 4.352 98.571 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -63.022 5.053 95.337 1.00 0.00 H new ATOM 0 HZ PHE A 104 -64.870 3.726 96.342 1.00 0.00 H new ATOM 1609 N ARG A 105 -66.307 9.074 98.743 1.00 0.00 N ATOM 1610 CA ARG A 105 -67.678 8.939 99.249 1.00 0.00 C ATOM 1611 C ARG A 105 -67.999 7.507 99.682 1.00 0.00 C ATOM 1612 O ARG A 105 -67.654 6.558 98.980 1.00 0.00 O ATOM 1613 CB ARG A 105 -68.654 9.438 98.182 1.00 0.00 C ATOM 1614 CG ARG A 105 -70.100 9.525 98.689 1.00 0.00 C ATOM 1615 CD ARG A 105 -71.032 10.143 97.648 1.00 0.00 C ATOM 1616 NE ARG A 105 -72.339 10.448 98.243 1.00 0.00 N ATOM 1617 CZ ARG A 105 -73.453 10.787 97.614 1.00 0.00 C ATOM 1618 NH1 ARG A 105 -73.541 10.951 96.324 1.00 0.00 N ATOM 1619 NH2 ARG A 105 -74.522 11.076 98.301 1.00 0.00 N ATOM 0 H ARG A 105 -66.252 9.240 97.738 1.00 0.00 H new ATOM 0 HA ARG A 105 -67.780 9.550 100.146 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -68.335 10.422 97.837 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -68.616 8.771 97.321 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -70.455 8.527 98.947 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -70.130 10.120 99.602 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -70.587 11.054 97.248 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -71.158 9.456 96.811 1.00 0.00 H new ATOM 0 HE ARG A 105 -72.395 10.392 99.260 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -72.719 10.817 95.736 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -74.432 11.213 95.903 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -74.498 11.041 99.320 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -75.382 11.338 97.820 1.00 0.00 H new ATOM 1633 N LYS A 106 -68.703 7.352 100.814 1.00 0.00 N ATOM 1634 CA LYS A 106 -69.242 6.077 101.336 1.00 0.00 C ATOM 1635 C LYS A 106 -68.196 4.973 101.595 1.00 0.00 C ATOM 1636 O LYS A 106 -68.565 3.815 101.774 1.00 0.00 O ATOM 1637 CB LYS A 106 -70.438 5.629 100.463 1.00 0.00 C ATOM 1638 CG LYS A 106 -71.665 6.564 100.571 1.00 0.00 C ATOM 1639 CD LYS A 106 -72.830 5.985 101.394 1.00 0.00 C ATOM 1640 CE LYS A 106 -72.493 5.668 102.858 1.00 0.00 C ATOM 1641 NZ LYS A 106 -72.325 6.888 103.683 1.00 0.00 N ATOM 0 H LYS A 106 -68.924 8.142 101.420 1.00 0.00 H new ATOM 0 HA LYS A 106 -69.605 6.270 102.346 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -70.119 5.580 99.422 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -70.733 4.621 100.754 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -71.351 7.506 101.020 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -72.023 6.793 99.567 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -73.658 6.693 101.372 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -73.179 5.072 100.911 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -73.285 5.053 103.284 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -71.577 5.079 102.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -72.099 6.617 104.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -71.551 7.465 103.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -73.207 7.439 103.671 1.00 0.00 H new ATOM 1655 N GLY A 107 -66.908 5.329 101.683 1.00 0.00 N ATOM 1656 CA GLY A 107 -65.798 4.403 101.945 1.00 0.00 C ATOM 1657 C GLY A 107 -64.464 5.118 102.183 1.00 0.00 C ATOM 1658 O GLY A 107 -63.444 4.721 101.629 1.00 0.00 O ATOM 0 H GLY A 107 -66.601 6.295 101.571 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -66.038 3.794 102.817 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -65.693 3.722 101.100 1.00 0.00 H new ATOM 1662 N SER A 108 -64.490 6.209 102.954 1.00 0.00 N ATOM 1663 CA SER A 108 -63.527 7.323 103.012 1.00 0.00 C ATOM 1664 C SER A 108 -62.126 7.016 103.578 1.00 0.00 C ATOM 1665 O SER A 108 -61.499 7.870 104.198 1.00 0.00 O ATOM 1666 CB SER A 108 -64.199 8.484 103.758 1.00 0.00 C ATOM 1667 OG SER A 108 -65.523 8.633 103.274 1.00 0.00 O ATOM 0 H SER A 108 -65.253 6.352 103.615 1.00 0.00 H new ATOM 0 HA SER A 108 -63.295 7.576 101.977 1.00 0.00 H new ATOM 0 HB2 SER A 108 -64.209 8.288 104.830 1.00 0.00 H new ATOM 0 HB3 SER A 108 -63.636 9.405 103.608 1.00 0.00 H new ATOM 0 HG SER A 108 -65.499 8.951 102.347 1.00 0.00 H new ATOM 1673 N SER A 109 -61.598 5.812 103.340 1.00 0.00 N ATOM 1674 CA SER A 109 -60.266 5.362 103.769 1.00 0.00 C ATOM 1675 C SER A 109 -59.089 5.987 102.993 1.00 0.00 C ATOM 1676 O SER A 109 -57.944 5.648 103.292 1.00 0.00 O ATOM 1677 CB SER A 109 -60.193 3.834 103.657 1.00 0.00 C ATOM 1678 OG SER A 109 -58.965 3.382 104.190 1.00 0.00 O ATOM 0 H SER A 109 -62.105 5.094 102.823 1.00 0.00 H new ATOM 0 HA SER A 109 -60.153 5.700 104.799 1.00 0.00 H new ATOM 0 HB2 SER A 109 -61.025 3.379 104.195 1.00 0.00 H new ATOM 0 HB3 SER A 109 -60.283 3.530 102.614 1.00 0.00 H new ATOM 0 HG SER A 109 -58.305 4.105 104.150 1.00 0.00 H new ATOM 1684 N ILE A 110 -59.350 6.847 101.998 1.00 0.00 N ATOM 1685 CA ILE A 110 -58.337 7.453 101.116 1.00 0.00 C ATOM 1686 C ILE A 110 -58.495 8.983 100.957 1.00 0.00 C ATOM 1687 O ILE A 110 -57.661 9.621 100.318 1.00 0.00 O ATOM 1688 CB ILE A 110 -58.298 6.670 99.776 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -56.989 6.910 98.989 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -59.542 6.951 98.917 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -56.763 5.900 97.855 1.00 0.00 C ATOM 0 H ILE A 110 -60.298 7.150 101.777 1.00 0.00 H new ATOM 0 HA ILE A 110 -57.358 7.358 101.586 1.00 0.00 H new ATOM 0 HB ILE A 110 -58.314 5.611 100.033 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -57.005 7.916 98.571 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -56.146 6.865 99.679 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -59.478 6.385 97.988 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -60.437 6.652 99.463 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -59.595 8.016 98.690 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -55.827 6.128 97.346 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -56.715 4.893 98.269 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -57.587 5.961 97.144 1.00 0.00 H new ATOM 1703 N GLY A 111 -59.512 9.595 101.581 1.00 0.00 N ATOM 1704 CA GLY A 111 -59.695 11.047 101.595 1.00 0.00 C ATOM 1705 C GLY A 111 -60.561 11.511 102.767 1.00 0.00 C ATOM 1706 O GLY A 111 -61.512 10.829 103.141 1.00 0.00 O ATOM 0 H GLY A 111 -60.234 9.089 102.093 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -58.721 11.533 101.651 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -60.155 11.362 100.659 1.00 0.00 H new ATOM 1710 N LYS A 112 -60.220 12.678 103.326 1.00 0.00 N ATOM 1711 CA LYS A 112 -60.728 13.271 104.570 1.00 0.00 C ATOM 1712 C LYS A 112 -60.833 14.797 104.495 1.00 0.00 C ATOM 1713 O LYS A 112 -60.051 15.392 103.719 1.00 0.00 O ATOM 1714 CB LYS A 112 -59.799 12.871 105.733 1.00 0.00 C ATOM 1715 CG LYS A 112 -59.985 11.427 106.239 1.00 0.00 C ATOM 1716 CD LYS A 112 -61.400 11.100 106.746 1.00 0.00 C ATOM 1717 CE LYS A 112 -61.878 12.139 107.770 1.00 0.00 C ATOM 1718 NZ LYS A 112 -63.253 11.891 108.248 1.00 0.00 N ATOM 1719 OXT LYS A 112 -61.679 15.326 105.254 1.00 0.00 O ATOM 0 H LYS A 112 -59.526 13.281 102.885 1.00 0.00 H new ATOM 0 HA LYS A 112 -61.736 12.889 104.732 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -58.765 12.999 105.414 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -59.964 13.557 106.564 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -59.735 10.739 105.432 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -59.274 11.245 107.045 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -62.092 11.070 105.905 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -61.406 10.109 107.200 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -61.198 12.140 108.622 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -61.829 13.131 107.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -63.386 12.345 109.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -63.933 12.287 107.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -63.410 10.867 108.338 1.00 0.00 H new TER 1733 LYS A 112