USER MOD reduce.3.24.130724 H: found=0, std=0, add=836, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 835 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: C 35 CYS SG : rot 23:sc= 1.05 USER MOD Set 1.2: C 69 SER OG : rot -102:sc= 1.28 USER MOD Set 1.3: C 71 THR OG1 : rot 124:sc= 0.96 USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 169:sc= -0.14 (180deg=-0.41) USER MOD Single : C 5 TYR OH : rot 157:sc= 0.386 USER MOD Single : C 6 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.106) USER MOD Single : C 11 GLN : amide:sc= -1.95 X(o=-1.9,f=-1.4!) USER MOD Single : C 13 THR OG1 : rot 180:sc= -0.722 USER MOD Single : C 16 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.24) USER MOD Single : C 17 LYS NZ :NH3+ -150:sc= -0.101 (180deg=-0.559) USER MOD Single : C 18 ASN : amide:sc= -0.207 K(o=-0.21,f=-1.1) USER MOD Single : C 21 LYS NZ :NH3+ 162:sc= -0.0315 (180deg=-0.24) USER MOD Single : C 37 SER OG : rot 180:sc= 0 USER MOD Single : C 38 THR OG1 : rot 175:sc= -0.649 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl -165:sc= -0.207 (180deg=-0.844) USER MOD Single : C 47 MET CE :methyl 178:sc= -0.0176 (180deg=-0.0277) USER MOD Single : C 50 GLN : amide:sc= -0.0822 X(o=-0.082,f=0) USER MOD Single : C 51 ASN : amide:sc= 0.275 X(o=0.27,f=0) USER MOD Single : C 53 THR OG1 : rot 110:sc= -0.747 USER MOD Single : C 58 GLN : amide:sc= -0.365 X(o=-0.36,f=0) USER MOD Single : C 60 MET CE :methyl -174:sc= 0 (180deg=-0.0472) USER MOD Single : C 80 MET CE :methyl -166:sc= -2.99! (180deg=-4.57!) USER MOD Single : C 81 MET CE :methyl -176:sc= -0.549 (180deg=-0.607) USER MOD Single : C 84 CYS SG : rot 180:sc= 0 USER MOD Single : C 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 86 LYS NZ :NH3+ -119:sc= -0.134 (180deg=-2.19!) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 149 SER OG : rot 180:sc= 0 USER MOD Single : I 153 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : I 154 MET CE :methyl -142:sc= -0.163 (180deg=-1.37) USER MOD Single : I 155 GLN : amide:sc=-0.00546 X(o=-0.0055,f=-0.19) USER MOD Single : I 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 -4.445 -2.084 0.222 1.00 42.22 N ATOM 2 CA MET C 1 -3.848 -0.777 -0.031 1.00 11.44 C ATOM 3 C MET C 1 -2.544 -0.916 -0.810 1.00 33.42 C ATOM 4 O MET C 1 -1.684 -0.037 -0.761 1.00 53.23 O ATOM 5 CB MET C 1 -3.592 -0.046 1.288 1.00 4.14 C ATOM 6 CG MET C 1 -3.289 -0.977 2.450 1.00 62.43 C ATOM 7 SD MET C 1 -1.794 -1.951 2.188 1.00 14.41 S ATOM 8 CE MET C 1 -1.269 -2.227 3.878 1.00 4.50 C ATOM 0 H1 MET C 1 -5.223 -1.984 0.905 1.00 42.22 H new ATOM 0 H2 MET C 1 -4.814 -2.475 -0.668 1.00 42.22 H new ATOM 0 H3 MET C 1 -3.724 -2.726 0.609 1.00 42.22 H new ATOM 0 HA MET C 1 -4.548 -0.196 -0.631 1.00 11.44 H new ATOM 0 HB2 MET C 1 -2.756 0.641 1.157 1.00 4.14 H new ATOM 0 HB3 MET C 1 -4.465 0.557 1.535 1.00 4.14 H new ATOM 0 HG2 MET C 1 -3.180 -0.390 3.362 1.00 62.43 H new ATOM 0 HG3 MET C 1 -4.134 -1.649 2.602 1.00 62.43 H new ATOM 0 HE1 MET C 1 -0.353 -2.818 3.883 1.00 4.50 H new ATOM 0 HE2 MET C 1 -1.085 -1.268 4.363 1.00 4.50 H new ATOM 0 HE3 MET C 1 -2.049 -2.763 4.418 1.00 4.50 H new ATOM 18 N ASP C 2 -2.405 -2.025 -1.529 1.00 4.53 N ATOM 19 CA ASP C 2 -1.206 -2.278 -2.319 1.00 35.52 C ATOM 20 C ASP C 2 -1.192 -1.415 -3.576 1.00 13.04 C ATOM 21 O ASP C 2 -2.215 -0.854 -3.968 1.00 60.22 O ATOM 22 CB ASP C 2 -1.123 -3.757 -2.700 1.00 44.22 C ATOM 23 CG ASP C 2 0.261 -4.157 -3.172 1.00 23.14 C ATOM 24 OD1 ASP C 2 1.218 -3.398 -2.914 1.00 32.32 O ATOM 25 OD2 ASP C 2 0.386 -5.230 -3.798 1.00 73.01 O ATOM 0 H ASP C 2 -3.108 -2.763 -1.581 1.00 4.53 H new ATOM 0 HA ASP C 2 -0.339 -2.018 -1.712 1.00 35.52 H new ATOM 0 HB2 ASP C 2 -1.401 -4.367 -1.840 1.00 44.22 H new ATOM 0 HB3 ASP C 2 -1.847 -3.967 -3.487 1.00 44.22 H new ATOM 30 N ASP C 3 -0.025 -1.312 -4.204 1.00 42.13 N ATOM 31 CA ASP C 3 0.123 -0.517 -5.417 1.00 55.15 C ATOM 32 C ASP C 3 -0.724 -1.091 -6.549 1.00 64.03 C ATOM 33 O ASP C 3 -1.300 -0.347 -7.345 1.00 53.41 O ATOM 34 CB ASP C 3 1.592 -0.462 -5.840 1.00 3.52 C ATOM 35 CG ASP C 3 2.518 -0.159 -4.679 1.00 45.12 C ATOM 36 OD1 ASP C 3 2.153 0.686 -3.835 1.00 22.23 O ATOM 37 OD2 ASP C 3 3.607 -0.766 -4.614 1.00 4.13 O ATOM 0 H ASP C 3 0.832 -1.769 -3.893 1.00 42.13 H new ATOM 0 HA ASP C 3 -0.224 0.494 -5.204 1.00 55.15 H new ATOM 0 HB2 ASP C 3 1.874 -1.415 -6.287 1.00 3.52 H new ATOM 0 HB3 ASP C 3 1.717 0.300 -6.609 1.00 3.52 H new ATOM 42 N ILE C 4 -0.795 -2.416 -6.616 1.00 74.41 N ATOM 43 CA ILE C 4 -1.571 -3.088 -7.651 1.00 42.12 C ATOM 44 C ILE C 4 -2.999 -2.555 -7.700 1.00 41.12 C ATOM 45 O ILE C 4 -3.601 -2.462 -8.769 1.00 75.33 O ATOM 46 CB ILE C 4 -1.611 -4.611 -7.424 1.00 51.33 C ATOM 47 CG1 ILE C 4 -2.000 -4.924 -5.978 1.00 42.31 C ATOM 48 CG2 ILE C 4 -0.264 -5.232 -7.762 1.00 21.13 C ATOM 49 CD1 ILE C 4 -2.147 -6.403 -5.698 1.00 2.33 C ATOM 0 H ILE C 4 -0.325 -3.046 -5.966 1.00 74.41 H new ATOM 0 HA ILE C 4 -1.076 -2.883 -8.600 1.00 42.12 H new ATOM 0 HB ILE C 4 -2.364 -5.042 -8.084 1.00 51.33 H new ATOM 0 HG12 ILE C 4 -1.246 -4.509 -5.310 1.00 42.31 H new ATOM 0 HG13 ILE C 4 -2.940 -4.424 -5.747 1.00 42.31 H new ATOM 0 HG21 ILE C 4 -0.308 -6.308 -7.597 1.00 21.13 H new ATOM 0 HG22 ILE C 4 -0.024 -5.035 -8.807 1.00 21.13 H new ATOM 0 HG23 ILE C 4 0.507 -4.798 -7.125 1.00 21.13 H new ATOM 0 HD11 ILE C 4 -2.424 -6.550 -4.654 1.00 2.33 H new ATOM 0 HD12 ILE C 4 -2.922 -6.820 -6.341 1.00 2.33 H new ATOM 0 HD13 ILE C 4 -1.201 -6.907 -5.897 1.00 2.33 H new ATOM 61 N TYR C 5 -3.534 -2.205 -6.535 1.00 33.33 N ATOM 62 CA TYR C 5 -4.892 -1.681 -6.445 1.00 21.24 C ATOM 63 C TYR C 5 -4.922 -0.188 -6.758 1.00 11.45 C ATOM 64 O TYR C 5 -5.911 0.330 -7.277 1.00 43.05 O ATOM 65 CB TYR C 5 -5.466 -1.933 -5.050 1.00 72.41 C ATOM 66 CG TYR C 5 -6.685 -1.095 -4.736 1.00 72.53 C ATOM 67 CD1 TYR C 5 -7.786 -1.091 -5.584 1.00 25.31 C ATOM 68 CD2 TYR C 5 -6.735 -0.306 -3.593 1.00 62.12 C ATOM 69 CE1 TYR C 5 -8.901 -0.326 -5.302 1.00 1.32 C ATOM 70 CE2 TYR C 5 -7.846 0.460 -3.303 1.00 64.25 C ATOM 71 CZ TYR C 5 -8.927 0.447 -4.160 1.00 23.21 C ATOM 72 OH TYR C 5 -10.036 1.211 -3.874 1.00 71.44 O ATOM 0 H TYR C 5 -3.048 -2.275 -5.641 1.00 33.33 H new ATOM 0 HA TYR C 5 -5.505 -2.200 -7.182 1.00 21.24 H new ATOM 0 HB2 TYR C 5 -5.727 -2.987 -4.959 1.00 72.41 H new ATOM 0 HB3 TYR C 5 -4.695 -1.730 -4.307 1.00 72.41 H new ATOM 0 HD1 TYR C 5 -7.770 -1.696 -6.478 1.00 25.31 H new ATOM 0 HD2 TYR C 5 -5.890 -0.292 -2.920 1.00 62.12 H new ATOM 0 HE1 TYR C 5 -9.748 -0.333 -5.972 1.00 1.32 H new ATOM 0 HE2 TYR C 5 -7.869 1.066 -2.410 1.00 64.25 H new ATOM 0 HH TYR C 5 -10.069 1.392 -2.911 1.00 71.44 H new ATOM 82 N LYS C 6 -3.831 0.499 -6.438 1.00 3.44 N ATOM 83 CA LYS C 6 -3.728 1.932 -6.685 1.00 0.12 C ATOM 84 C LYS C 6 -3.599 2.219 -8.178 1.00 73.31 C ATOM 85 O LYS C 6 -4.216 3.148 -8.697 1.00 71.10 O ATOM 86 CB LYS C 6 -2.527 2.515 -5.937 1.00 50.13 C ATOM 87 CG LYS C 6 -2.866 3.025 -4.547 1.00 22.43 C ATOM 88 CD LYS C 6 -3.094 1.881 -3.573 1.00 53.30 C ATOM 89 CE LYS C 6 -3.779 2.359 -2.302 1.00 43.52 C ATOM 90 NZ LYS C 6 -3.023 3.461 -1.645 1.00 0.41 N ATOM 0 H LYS C 6 -3.004 0.086 -6.006 1.00 3.44 H new ATOM 0 HA LYS C 6 -4.640 2.404 -6.319 1.00 0.12 H new ATOM 0 HB2 LYS C 6 -1.754 1.751 -5.856 1.00 50.13 H new ATOM 0 HB3 LYS C 6 -2.107 3.333 -6.523 1.00 50.13 H new ATOM 0 HG2 LYS C 6 -2.056 3.658 -4.183 1.00 22.43 H new ATOM 0 HG3 LYS C 6 -3.760 3.647 -4.595 1.00 22.43 H new ATOM 0 HD2 LYS C 6 -3.703 1.113 -4.049 1.00 53.30 H new ATOM 0 HD3 LYS C 6 -2.139 1.420 -3.321 1.00 53.30 H new ATOM 0 HE2 LYS C 6 -4.786 2.701 -2.539 1.00 43.52 H new ATOM 0 HE3 LYS C 6 -3.881 1.524 -1.608 1.00 43.52 H new ATOM 0 HZ1 LYS C 6 -3.424 3.644 -0.703 1.00 0.41 H new ATOM 0 HZ2 LYS C 6 -2.024 3.188 -1.549 1.00 0.41 H new ATOM 0 HZ3 LYS C 6 -3.092 4.322 -2.224 1.00 0.41 H new ATOM 104 N ALA C 7 -2.793 1.413 -8.862 1.00 51.21 N ATOM 105 CA ALA C 7 -2.585 1.579 -10.296 1.00 74.34 C ATOM 106 C ALA C 7 -3.773 1.043 -11.088 1.00 43.42 C ATOM 107 O ALA C 7 -4.190 1.641 -12.079 1.00 21.21 O ATOM 108 CB ALA C 7 -1.303 0.883 -10.727 1.00 30.11 C ATOM 0 H ALA C 7 -2.274 0.639 -8.447 1.00 51.21 H new ATOM 0 HA ALA C 7 -2.494 2.645 -10.505 1.00 74.34 H new ATOM 0 HB1 ALA C 7 -1.160 1.015 -11.800 1.00 30.11 H new ATOM 0 HB2 ALA C 7 -0.457 1.315 -10.192 1.00 30.11 H new ATOM 0 HB3 ALA C 7 -1.372 -0.181 -10.498 1.00 30.11 H new ATOM 114 N ALA C 8 -4.313 -0.087 -10.644 1.00 4.14 N ATOM 115 CA ALA C 8 -5.454 -0.702 -11.311 1.00 34.42 C ATOM 116 C ALA C 8 -6.626 0.269 -11.401 1.00 31.33 C ATOM 117 O ALA C 8 -7.350 0.294 -12.397 1.00 21.04 O ATOM 118 CB ALA C 8 -5.871 -1.971 -10.581 1.00 15.14 C ATOM 0 H ALA C 8 -3.979 -0.595 -9.825 1.00 4.14 H new ATOM 0 HA ALA C 8 -5.154 -0.962 -12.326 1.00 34.42 H new ATOM 0 HB1 ALA C 8 -6.724 -2.420 -11.090 1.00 15.14 H new ATOM 0 HB2 ALA C 8 -5.040 -2.677 -10.574 1.00 15.14 H new ATOM 0 HB3 ALA C 8 -6.148 -1.727 -9.555 1.00 15.14 H new ATOM 124 N VAL C 9 -6.810 1.067 -10.354 1.00 62.21 N ATOM 125 CA VAL C 9 -7.894 2.040 -10.315 1.00 71.25 C ATOM 126 C VAL C 9 -7.592 3.236 -11.210 1.00 13.04 C ATOM 127 O VAL C 9 -8.495 3.824 -11.803 1.00 45.34 O ATOM 128 CB VAL C 9 -8.151 2.538 -8.880 1.00 21.25 C ATOM 129 CG1 VAL C 9 -9.241 3.599 -8.869 1.00 43.23 C ATOM 130 CG2 VAL C 9 -8.518 1.375 -7.971 1.00 42.25 C ATOM 0 H VAL C 9 -6.221 1.058 -9.521 1.00 62.21 H new ATOM 0 HA VAL C 9 -8.787 1.533 -10.681 1.00 71.25 H new ATOM 0 HB VAL C 9 -7.234 2.990 -8.501 1.00 21.25 H new ATOM 0 HG11 VAL C 9 -9.408 3.938 -7.847 1.00 43.23 H new ATOM 0 HG12 VAL C 9 -8.933 4.443 -9.486 1.00 43.23 H new ATOM 0 HG13 VAL C 9 -10.164 3.177 -9.267 1.00 43.23 H new ATOM 0 HG21 VAL C 9 -8.696 1.745 -6.961 1.00 42.25 H new ATOM 0 HG22 VAL C 9 -9.421 0.892 -8.345 1.00 42.25 H new ATOM 0 HG23 VAL C 9 -7.701 0.654 -7.954 1.00 42.25 H new ATOM 140 N GLU C 10 -6.314 3.591 -11.302 1.00 20.23 N ATOM 141 CA GLU C 10 -5.892 4.718 -12.125 1.00 5.30 C ATOM 142 C GLU C 10 -6.003 4.380 -13.609 1.00 74.22 C ATOM 143 O GLU C 10 -6.450 5.200 -14.411 1.00 71.24 O ATOM 144 CB GLU C 10 -4.454 5.115 -11.788 1.00 70.30 C ATOM 145 CG GLU C 10 -4.312 5.801 -10.439 1.00 71.21 C ATOM 146 CD GLU C 10 -4.578 7.292 -10.512 1.00 10.44 C ATOM 147 OE1 GLU C 10 -5.763 7.684 -10.533 1.00 11.42 O ATOM 148 OE2 GLU C 10 -3.599 8.067 -10.548 1.00 25.41 O ATOM 0 H GLU C 10 -5.554 3.115 -10.817 1.00 20.23 H new ATOM 0 HA GLU C 10 -6.553 5.558 -11.911 1.00 5.30 H new ATOM 0 HB2 GLU C 10 -3.827 4.223 -11.800 1.00 70.30 H new ATOM 0 HB3 GLU C 10 -4.078 5.780 -12.566 1.00 70.30 H new ATOM 0 HG2 GLU C 10 -5.004 5.347 -9.730 1.00 71.21 H new ATOM 0 HG3 GLU C 10 -3.306 5.634 -10.055 1.00 71.21 H new ATOM 155 N GLN C 11 -5.593 3.168 -13.966 1.00 21.31 N ATOM 156 CA GLN C 11 -5.645 2.722 -15.353 1.00 24.12 C ATOM 157 C GLN C 11 -7.077 2.735 -15.876 1.00 21.33 C ATOM 158 O GLN C 11 -7.308 2.721 -17.086 1.00 43.13 O ATOM 159 CB GLN C 11 -5.055 1.316 -15.482 1.00 20.30 C ATOM 160 CG GLN C 11 -5.967 0.223 -14.948 1.00 73.31 C ATOM 161 CD GLN C 11 -6.378 -0.769 -16.019 1.00 24.44 C ATOM 162 OE1 GLN C 11 -5.658 -0.978 -16.996 1.00 21.34 O ATOM 163 NE2 GLN C 11 -7.540 -1.386 -15.840 1.00 14.24 N ATOM 0 H GLN C 11 -5.221 2.477 -13.314 1.00 21.31 H new ATOM 0 HA GLN C 11 -5.052 3.413 -15.952 1.00 24.12 H new ATOM 0 HB2 GLN C 11 -4.838 1.117 -16.531 1.00 20.30 H new ATOM 0 HB3 GLN C 11 -4.106 1.279 -14.948 1.00 20.30 H new ATOM 0 HG2 GLN C 11 -5.459 -0.307 -14.142 1.00 73.31 H new ATOM 0 HG3 GLN C 11 -6.859 0.678 -14.517 1.00 73.31 H new ATOM 0 HE21 GLN C 11 -8.104 -1.182 -15.015 1.00 14.24 H new ATOM 0 HE22 GLN C 11 -7.868 -2.064 -16.527 1.00 14.24 H new ATOM 172 N LEU C 12 -8.037 2.761 -14.958 1.00 71.14 N ATOM 173 CA LEU C 12 -9.448 2.775 -15.326 1.00 74.35 C ATOM 174 C LEU C 12 -9.782 4.012 -16.154 1.00 12.11 C ATOM 175 O LEU C 12 -8.931 4.875 -16.373 1.00 62.23 O ATOM 176 CB LEU C 12 -10.323 2.736 -14.071 1.00 54.12 C ATOM 177 CG LEU C 12 -10.036 1.601 -13.088 1.00 1.44 C ATOM 178 CD1 LEU C 12 -11.075 1.581 -11.977 1.00 11.51 C ATOM 179 CD2 LEU C 12 -10.002 0.263 -13.813 1.00 15.32 C ATOM 0 H LEU C 12 -7.864 2.773 -13.953 1.00 71.14 H new ATOM 0 HA LEU C 12 -9.650 1.890 -15.930 1.00 74.35 H new ATOM 0 HB2 LEU C 12 -10.210 3.683 -13.544 1.00 54.12 H new ATOM 0 HB3 LEU C 12 -11.366 2.666 -14.381 1.00 54.12 H new ATOM 0 HG LEU C 12 -9.058 1.774 -12.639 1.00 1.44 H new ATOM 0 HD11 LEU C 12 -10.854 0.767 -11.287 1.00 11.51 H new ATOM 0 HD12 LEU C 12 -11.051 2.529 -11.439 1.00 11.51 H new ATOM 0 HD13 LEU C 12 -12.065 1.433 -12.408 1.00 11.51 H new ATOM 0 HD21 LEU C 12 -9.796 -0.533 -13.098 1.00 15.32 H new ATOM 0 HD22 LEU C 12 -10.966 0.083 -14.290 1.00 15.32 H new ATOM 0 HD23 LEU C 12 -9.220 0.280 -14.572 1.00 15.32 H new ATOM 191 N THR C 13 -11.028 4.093 -16.611 1.00 71.22 N ATOM 192 CA THR C 13 -11.475 5.224 -17.414 1.00 11.12 C ATOM 193 C THR C 13 -12.690 5.898 -16.786 1.00 63.53 C ATOM 194 O THR C 13 -13.355 5.321 -15.926 1.00 23.14 O ATOM 195 CB THR C 13 -11.828 4.789 -18.849 1.00 11.22 C ATOM 196 OG1 THR C 13 -12.096 3.383 -18.883 1.00 5.33 O ATOM 197 CG2 THR C 13 -10.694 5.117 -19.808 1.00 23.43 C ATOM 0 H THR C 13 -11.745 3.389 -16.438 1.00 71.22 H new ATOM 0 HA THR C 13 -10.648 5.933 -17.450 1.00 11.12 H new ATOM 0 HB THR C 13 -12.718 5.336 -19.162 1.00 11.22 H new ATOM 0 HG1 THR C 13 -12.321 3.115 -19.798 1.00 5.33 H new ATOM 0 HG21 THR C 13 -10.966 4.801 -20.815 1.00 23.43 H new ATOM 0 HG22 THR C 13 -10.512 6.192 -19.802 1.00 23.43 H new ATOM 0 HG23 THR C 13 -9.790 4.594 -19.495 1.00 23.43 H new ATOM 205 N GLU C 14 -12.974 7.120 -17.223 1.00 34.22 N ATOM 206 CA GLU C 14 -14.111 7.872 -16.703 1.00 71.12 C ATOM 207 C GLU C 14 -15.395 7.053 -16.799 1.00 14.41 C ATOM 208 O GLU C 14 -16.309 7.217 -15.992 1.00 34.41 O ATOM 209 CB GLU C 14 -14.273 9.188 -17.467 1.00 21.04 C ATOM 210 CG GLU C 14 -14.590 9.000 -18.941 1.00 72.50 C ATOM 211 CD GLU C 14 -14.628 10.312 -19.701 1.00 64.01 C ATOM 212 OE1 GLU C 14 -13.549 10.905 -19.914 1.00 0.51 O ATOM 213 OE2 GLU C 14 -15.735 10.746 -20.081 1.00 50.25 O ATOM 0 H GLU C 14 -12.433 7.611 -17.935 1.00 34.22 H new ATOM 0 HA GLU C 14 -13.919 8.092 -15.653 1.00 71.12 H new ATOM 0 HB2 GLU C 14 -15.069 9.772 -17.004 1.00 21.04 H new ATOM 0 HB3 GLU C 14 -13.356 9.769 -17.372 1.00 21.04 H new ATOM 0 HG2 GLU C 14 -13.842 8.346 -19.389 1.00 72.50 H new ATOM 0 HG3 GLU C 14 -15.553 8.498 -19.041 1.00 72.50 H new ATOM 220 N GLU C 15 -15.455 6.172 -17.793 1.00 72.31 N ATOM 221 CA GLU C 15 -16.627 5.329 -17.995 1.00 63.33 C ATOM 222 C GLU C 15 -16.675 4.207 -16.963 1.00 32.12 C ATOM 223 O GLU C 15 -17.728 3.919 -16.393 1.00 2.12 O ATOM 224 CB GLU C 15 -16.620 4.738 -19.407 1.00 65.41 C ATOM 225 CG GLU C 15 -17.900 4.001 -19.765 1.00 13.23 C ATOM 226 CD GLU C 15 -17.727 3.075 -20.952 1.00 71.11 C ATOM 227 OE1 GLU C 15 -16.949 2.104 -20.839 1.00 60.33 O ATOM 228 OE2 GLU C 15 -18.369 3.320 -21.995 1.00 74.24 O ATOM 0 H GLU C 15 -14.707 6.024 -18.470 1.00 72.31 H new ATOM 0 HA GLU C 15 -17.515 5.950 -17.873 1.00 63.33 H new ATOM 0 HB2 GLU C 15 -16.459 5.541 -20.127 1.00 65.41 H new ATOM 0 HB3 GLU C 15 -15.778 4.053 -19.501 1.00 65.41 H new ATOM 0 HG2 GLU C 15 -18.235 3.423 -18.904 1.00 13.23 H new ATOM 0 HG3 GLU C 15 -18.683 4.726 -19.986 1.00 13.23 H new ATOM 235 N GLN C 16 -15.528 3.577 -16.728 1.00 51.11 N ATOM 236 CA GLN C 16 -15.440 2.486 -15.765 1.00 33.01 C ATOM 237 C GLN C 16 -15.917 2.935 -14.388 1.00 42.34 C ATOM 238 O GLN C 16 -16.795 2.313 -13.789 1.00 64.13 O ATOM 239 CB GLN C 16 -14.003 1.970 -15.677 1.00 12.12 C ATOM 240 CG GLN C 16 -13.544 1.230 -16.924 1.00 13.44 C ATOM 241 CD GLN C 16 -14.493 0.117 -17.324 1.00 14.25 C ATOM 242 OE1 GLN C 16 -14.844 -0.024 -18.495 1.00 24.32 O ATOM 243 NE2 GLN C 16 -14.913 -0.681 -16.349 1.00 4.43 N ATOM 0 H GLN C 16 -14.648 3.803 -17.191 1.00 51.11 H new ATOM 0 HA GLN C 16 -16.088 1.679 -16.108 1.00 33.01 H new ATOM 0 HB2 GLN C 16 -13.334 2.812 -15.497 1.00 12.12 H new ATOM 0 HB3 GLN C 16 -13.917 1.305 -14.818 1.00 12.12 H new ATOM 0 HG2 GLN C 16 -13.451 1.937 -17.748 1.00 13.44 H new ATOM 0 HG3 GLN C 16 -12.553 0.812 -16.750 1.00 13.44 H new ATOM 0 HE21 GLN C 16 -14.596 -0.527 -15.392 1.00 4.43 H new ATOM 0 HE22 GLN C 16 -15.553 -1.448 -16.557 1.00 4.43 H new ATOM 252 N LYS C 17 -15.332 4.019 -13.889 1.00 34.05 N ATOM 253 CA LYS C 17 -15.697 4.553 -12.582 1.00 65.14 C ATOM 254 C LYS C 17 -17.176 4.924 -12.540 1.00 2.02 C ATOM 255 O LYS C 17 -17.820 4.828 -11.496 1.00 40.05 O ATOM 256 CB LYS C 17 -14.843 5.779 -12.253 1.00 65.31 C ATOM 257 CG LYS C 17 -13.505 5.437 -11.620 1.00 23.33 C ATOM 258 CD LYS C 17 -12.405 5.333 -12.663 1.00 70.42 C ATOM 259 CE LYS C 17 -11.162 6.101 -12.240 1.00 11.05 C ATOM 260 NZ LYS C 17 -11.440 7.553 -12.062 1.00 22.43 N ATOM 0 H LYS C 17 -14.603 4.545 -14.370 1.00 34.05 H new ATOM 0 HA LYS C 17 -15.513 3.779 -11.837 1.00 65.14 H new ATOM 0 HB2 LYS C 17 -14.668 6.346 -13.168 1.00 65.31 H new ATOM 0 HB3 LYS C 17 -15.400 6.428 -11.577 1.00 65.31 H new ATOM 0 HG2 LYS C 17 -13.242 6.200 -10.888 1.00 23.33 H new ATOM 0 HG3 LYS C 17 -13.587 4.493 -11.081 1.00 23.33 H new ATOM 0 HD2 LYS C 17 -12.150 4.285 -12.822 1.00 70.42 H new ATOM 0 HD3 LYS C 17 -12.767 5.721 -13.615 1.00 70.42 H new ATOM 0 HE2 LYS C 17 -10.780 5.687 -11.307 1.00 11.05 H new ATOM 0 HE3 LYS C 17 -10.382 5.970 -12.990 1.00 11.05 H new ATOM 0 HZ1 LYS C 17 -10.582 8.100 -12.278 1.00 22.43 H new ATOM 0 HZ2 LYS C 17 -12.205 7.841 -12.705 1.00 22.43 H new ATOM 0 HZ3 LYS C 17 -11.727 7.733 -11.079 1.00 22.43 H new ATOM 274 N ASN C 18 -17.708 5.347 -13.682 1.00 2.13 N ATOM 275 CA ASN C 18 -19.112 5.731 -13.775 1.00 51.43 C ATOM 276 C ASN C 18 -20.018 4.506 -13.703 1.00 12.52 C ATOM 277 O ASN C 18 -21.016 4.502 -12.983 1.00 32.41 O ATOM 278 CB ASN C 18 -19.369 6.493 -15.077 1.00 2.21 C ATOM 279 CG ASN C 18 -20.843 6.557 -15.428 1.00 33.04 C ATOM 280 OD1 ASN C 18 -21.699 6.648 -14.548 1.00 1.20 O ATOM 281 ND2 ASN C 18 -21.145 6.511 -16.720 1.00 65.25 N ATOM 0 H ASN C 18 -17.188 5.433 -14.556 1.00 2.13 H new ATOM 0 HA ASN C 18 -19.341 6.380 -12.930 1.00 51.43 H new ATOM 0 HB2 ASN C 18 -18.976 7.505 -14.986 1.00 2.21 H new ATOM 0 HB3 ASN C 18 -18.825 6.012 -15.890 1.00 2.21 H new ATOM 0 HD21 ASN C 18 -22.120 6.551 -17.018 1.00 65.25 H new ATOM 0 HD22 ASN C 18 -20.402 6.435 -17.415 1.00 65.25 H new ATOM 288 N GLU C 19 -19.661 3.468 -14.452 1.00 65.21 N ATOM 289 CA GLU C 19 -20.442 2.237 -14.473 1.00 41.01 C ATOM 290 C GLU C 19 -20.215 1.427 -13.199 1.00 32.34 C ATOM 291 O GLU C 19 -20.998 0.536 -12.869 1.00 64.04 O ATOM 292 CB GLU C 19 -20.076 1.395 -15.697 1.00 4.30 C ATOM 293 CG GLU C 19 -18.725 0.709 -15.582 1.00 61.01 C ATOM 294 CD GLU C 19 -18.445 -0.226 -16.743 1.00 15.55 C ATOM 295 OE1 GLU C 19 -17.939 0.251 -17.781 1.00 20.35 O ATOM 296 OE2 GLU C 19 -18.731 -1.434 -16.613 1.00 53.11 O ATOM 0 H GLU C 19 -18.836 3.455 -15.052 1.00 65.21 H new ATOM 0 HA GLU C 19 -21.497 2.507 -14.529 1.00 41.01 H new ATOM 0 HB2 GLU C 19 -20.846 0.639 -15.851 1.00 4.30 H new ATOM 0 HB3 GLU C 19 -20.076 2.034 -16.580 1.00 4.30 H new ATOM 0 HG2 GLU C 19 -17.941 1.465 -15.532 1.00 61.01 H new ATOM 0 HG3 GLU C 19 -18.686 0.146 -14.649 1.00 61.01 H new ATOM 303 N PHE C 20 -19.138 1.744 -12.488 1.00 53.44 N ATOM 304 CA PHE C 20 -18.807 1.046 -11.251 1.00 42.11 C ATOM 305 C PHE C 20 -19.745 1.464 -10.122 1.00 42.10 C ATOM 306 O PHE C 20 -19.999 0.697 -9.194 1.00 71.54 O ATOM 307 CB PHE C 20 -17.356 1.328 -10.855 1.00 75.53 C ATOM 308 CG PHE C 20 -16.393 0.270 -11.312 1.00 54.13 C ATOM 309 CD1 PHE C 20 -16.623 -1.066 -11.023 1.00 31.24 C ATOM 310 CD2 PHE C 20 -15.258 0.611 -12.030 1.00 15.02 C ATOM 311 CE1 PHE C 20 -15.739 -2.042 -11.442 1.00 1.01 C ATOM 312 CE2 PHE C 20 -14.371 -0.361 -12.452 1.00 51.04 C ATOM 313 CZ PHE C 20 -14.611 -1.689 -12.157 1.00 13.11 C ATOM 0 H PHE C 20 -18.480 2.479 -12.747 1.00 53.44 H new ATOM 0 HA PHE C 20 -18.929 -0.023 -11.423 1.00 42.11 H new ATOM 0 HB2 PHE C 20 -17.054 2.288 -11.273 1.00 75.53 H new ATOM 0 HB3 PHE C 20 -17.295 1.419 -9.771 1.00 75.53 H new ATOM 0 HD1 PHE C 20 -17.503 -1.347 -10.464 1.00 31.24 H new ATOM 0 HD2 PHE C 20 -15.064 1.648 -12.262 1.00 15.02 H new ATOM 0 HE1 PHE C 20 -15.930 -3.080 -11.211 1.00 1.01 H new ATOM 0 HE2 PHE C 20 -13.491 -0.083 -13.012 1.00 51.04 H new ATOM 0 HZ PHE C 20 -13.918 -2.450 -12.485 1.00 13.11 H new ATOM 323 N LYS C 21 -20.257 2.687 -10.209 1.00 44.30 N ATOM 324 CA LYS C 21 -21.167 3.210 -9.197 1.00 2.43 C ATOM 325 C LYS C 21 -22.556 2.596 -9.346 1.00 2.44 C ATOM 326 O LYS C 21 -23.321 2.529 -8.385 1.00 2.32 O ATOM 327 CB LYS C 21 -21.257 4.734 -9.301 1.00 1.51 C ATOM 328 CG LYS C 21 -20.187 5.462 -8.506 1.00 41.43 C ATOM 329 CD LYS C 21 -20.512 5.483 -7.022 1.00 62.22 C ATOM 330 CE LYS C 21 -19.643 6.483 -6.275 1.00 52.25 C ATOM 331 NZ LYS C 21 -19.985 7.888 -6.630 1.00 52.42 N ATOM 0 H LYS C 21 -20.057 3.335 -10.971 1.00 44.30 H new ATOM 0 HA LYS C 21 -20.774 2.942 -8.216 1.00 2.43 H new ATOM 0 HB2 LYS C 21 -21.179 5.024 -10.349 1.00 1.51 H new ATOM 0 HB3 LYS C 21 -22.239 5.056 -8.953 1.00 1.51 H new ATOM 0 HG2 LYS C 21 -19.224 4.977 -8.661 1.00 41.43 H new ATOM 0 HG3 LYS C 21 -20.092 6.484 -8.873 1.00 41.43 H new ATOM 0 HD2 LYS C 21 -21.563 5.737 -6.882 1.00 62.22 H new ATOM 0 HD3 LYS C 21 -20.366 4.488 -6.602 1.00 62.22 H new ATOM 0 HE2 LYS C 21 -19.765 6.340 -5.201 1.00 52.25 H new ATOM 0 HE3 LYS C 21 -18.594 6.295 -6.504 1.00 52.25 H new ATOM 0 HZ1 LYS C 21 -19.607 8.531 -5.905 1.00 52.42 H new ATOM 0 HZ2 LYS C 21 -19.568 8.124 -7.553 1.00 52.42 H new ATOM 0 HZ3 LYS C 21 -21.019 7.992 -6.680 1.00 52.42 H new ATOM 345 N ALA C 22 -22.873 2.148 -10.556 1.00 73.43 N ATOM 346 CA ALA C 22 -24.168 1.537 -10.829 1.00 65.55 C ATOM 347 C ALA C 22 -24.230 0.115 -10.283 1.00 71.31 C ATOM 348 O ALA C 22 -25.170 -0.248 -9.575 1.00 52.51 O ATOM 349 CB ALA C 22 -24.449 1.542 -12.325 1.00 31.33 C ATOM 0 H ALA C 22 -22.251 2.197 -11.363 1.00 73.43 H new ATOM 0 HA ALA C 22 -24.934 2.126 -10.324 1.00 65.55 H new ATOM 0 HB1 ALA C 22 -25.419 1.083 -12.515 1.00 31.33 H new ATOM 0 HB2 ALA C 22 -24.456 2.569 -12.690 1.00 31.33 H new ATOM 0 HB3 ALA C 22 -23.673 0.978 -12.843 1.00 31.33 H new ATOM 355 N ALA C 23 -23.223 -0.687 -10.615 1.00 32.52 N ATOM 356 CA ALA C 23 -23.163 -2.069 -10.156 1.00 21.41 C ATOM 357 C ALA C 23 -23.299 -2.150 -8.640 1.00 13.12 C ATOM 358 O ALA C 23 -23.879 -3.097 -8.108 1.00 12.23 O ATOM 359 CB ALA C 23 -21.864 -2.719 -10.608 1.00 32.20 C ATOM 0 H ALA C 23 -22.438 -0.403 -11.200 1.00 32.52 H new ATOM 0 HA ALA C 23 -24.000 -2.610 -10.598 1.00 21.41 H new ATOM 0 HB1 ALA C 23 -21.833 -3.751 -10.258 1.00 32.20 H new ATOM 0 HB2 ALA C 23 -21.809 -2.703 -11.696 1.00 32.20 H new ATOM 0 HB3 ALA C 23 -21.019 -2.170 -10.194 1.00 32.20 H new ATOM 365 N PHE C 24 -22.759 -1.152 -7.948 1.00 72.23 N ATOM 366 CA PHE C 24 -22.818 -1.112 -6.491 1.00 33.02 C ATOM 367 C PHE C 24 -24.208 -0.701 -6.014 1.00 25.44 C ATOM 368 O PHE C 24 -24.687 -1.174 -4.983 1.00 3.43 O ATOM 369 CB PHE C 24 -21.770 -0.139 -5.944 1.00 51.20 C ATOM 370 CG PHE C 24 -21.523 -0.291 -4.471 1.00 4.51 C ATOM 371 CD1 PHE C 24 -20.670 -1.274 -3.995 1.00 64.41 C ATOM 372 CD2 PHE C 24 -22.145 0.548 -3.560 1.00 42.15 C ATOM 373 CE1 PHE C 24 -20.440 -1.417 -2.640 1.00 21.13 C ATOM 374 CE2 PHE C 24 -21.918 0.411 -2.204 1.00 65.53 C ATOM 375 CZ PHE C 24 -21.066 -0.573 -1.743 1.00 2.44 C ATOM 0 H PHE C 24 -22.276 -0.360 -8.372 1.00 72.23 H new ATOM 0 HA PHE C 24 -22.606 -2.113 -6.116 1.00 33.02 H new ATOM 0 HB2 PHE C 24 -20.832 -0.289 -6.479 1.00 51.20 H new ATOM 0 HB3 PHE C 24 -22.093 0.882 -6.147 1.00 51.20 H new ATOM 0 HD1 PHE C 24 -20.179 -1.937 -4.692 1.00 64.41 H new ATOM 0 HD2 PHE C 24 -22.815 1.318 -3.914 1.00 42.15 H new ATOM 0 HE1 PHE C 24 -19.772 -2.187 -2.283 1.00 21.13 H new ATOM 0 HE2 PHE C 24 -22.407 1.073 -1.505 1.00 65.53 H new ATOM 0 HZ PHE C 24 -20.889 -0.683 -0.683 1.00 2.44 H new ATOM 385 N ASP C 25 -24.849 0.182 -6.772 1.00 30.24 N ATOM 386 CA ASP C 25 -26.185 0.657 -6.428 1.00 2.24 C ATOM 387 C ASP C 25 -27.209 -0.466 -6.552 1.00 41.00 C ATOM 388 O ASP C 25 -28.075 -0.628 -5.691 1.00 35.44 O ATOM 389 CB ASP C 25 -26.581 1.827 -7.329 1.00 73.01 C ATOM 390 CG ASP C 25 -26.749 3.121 -6.557 1.00 54.25 C ATOM 391 OD1 ASP C 25 -25.983 3.343 -5.596 1.00 1.31 O ATOM 392 OD2 ASP C 25 -27.645 3.913 -6.915 1.00 30.00 O ATOM 0 H ASP C 25 -24.466 0.583 -7.628 1.00 30.24 H new ATOM 0 HA ASP C 25 -26.168 0.996 -5.392 1.00 2.24 H new ATOM 0 HB2 ASP C 25 -25.821 1.963 -8.099 1.00 73.01 H new ATOM 0 HB3 ASP C 25 -27.514 1.589 -7.840 1.00 73.01 H new ATOM 397 N ILE C 26 -27.106 -1.239 -7.628 1.00 63.13 N ATOM 398 CA ILE C 26 -28.024 -2.346 -7.864 1.00 71.33 C ATOM 399 C ILE C 26 -27.905 -3.401 -6.770 1.00 33.10 C ATOM 400 O ILE C 26 -28.909 -3.926 -6.287 1.00 31.24 O ATOM 401 CB ILE C 26 -27.767 -3.009 -9.231 1.00 54.13 C ATOM 402 CG1 ILE C 26 -27.918 -1.983 -10.356 1.00 2.21 C ATOM 403 CG2 ILE C 26 -28.718 -4.177 -9.440 1.00 11.43 C ATOM 404 CD1 ILE C 26 -27.518 -2.513 -11.715 1.00 62.54 C ATOM 0 H ILE C 26 -26.396 -1.119 -8.350 1.00 63.13 H new ATOM 0 HA ILE C 26 -29.031 -1.929 -7.855 1.00 71.33 H new ATOM 0 HB ILE C 26 -26.746 -3.390 -9.248 1.00 54.13 H new ATOM 0 HG12 ILE C 26 -28.955 -1.650 -10.396 1.00 2.21 H new ATOM 0 HG13 ILE C 26 -27.311 -1.108 -10.123 1.00 2.21 H new ATOM 0 HG21 ILE C 26 -28.524 -4.635 -10.410 1.00 11.43 H new ATOM 0 HG22 ILE C 26 -28.566 -4.916 -8.653 1.00 11.43 H new ATOM 0 HG23 ILE C 26 -29.747 -3.819 -9.407 1.00 11.43 H new ATOM 0 HD11 ILE C 26 -27.651 -1.732 -12.464 1.00 62.54 H new ATOM 0 HD12 ILE C 26 -26.472 -2.820 -11.692 1.00 62.54 H new ATOM 0 HD13 ILE C 26 -28.142 -3.370 -11.970 1.00 62.54 H new ATOM 416 N PHE C 27 -26.672 -3.707 -6.381 1.00 75.32 N ATOM 417 CA PHE C 27 -26.421 -4.699 -5.342 1.00 31.24 C ATOM 418 C PHE C 27 -27.025 -4.258 -4.012 1.00 61.04 C ATOM 419 O PHE C 27 -27.363 -5.086 -3.166 1.00 3.54 O ATOM 420 CB PHE C 27 -24.917 -4.931 -5.181 1.00 32.03 C ATOM 421 CG PHE C 27 -24.387 -6.043 -6.040 1.00 60.11 C ATOM 422 CD1 PHE C 27 -24.556 -6.015 -7.415 1.00 15.13 C ATOM 423 CD2 PHE C 27 -23.718 -7.115 -5.472 1.00 1.43 C ATOM 424 CE1 PHE C 27 -24.070 -7.038 -8.207 1.00 73.23 C ATOM 425 CE2 PHE C 27 -23.229 -8.141 -6.259 1.00 4.43 C ATOM 426 CZ PHE C 27 -23.404 -8.101 -7.629 1.00 61.44 C ATOM 0 H PHE C 27 -25.830 -3.282 -6.770 1.00 75.32 H new ATOM 0 HA PHE C 27 -26.895 -5.633 -5.644 1.00 31.24 H new ATOM 0 HB2 PHE C 27 -24.387 -4.010 -5.425 1.00 32.03 H new ATOM 0 HB3 PHE C 27 -24.702 -5.155 -4.136 1.00 32.03 H new ATOM 0 HD1 PHE C 27 -25.073 -5.185 -7.873 1.00 15.13 H new ATOM 0 HD2 PHE C 27 -23.577 -7.150 -4.402 1.00 1.43 H new ATOM 0 HE1 PHE C 27 -24.211 -7.006 -9.277 1.00 73.23 H new ATOM 0 HE2 PHE C 27 -22.711 -8.972 -5.804 1.00 4.43 H new ATOM 0 HZ PHE C 27 -23.021 -8.900 -8.247 1.00 61.44 H new ATOM 436 N VAL C 28 -27.156 -2.947 -3.834 1.00 33.52 N ATOM 437 CA VAL C 28 -27.719 -2.394 -2.608 1.00 1.30 C ATOM 438 C VAL C 28 -29.011 -1.636 -2.889 1.00 34.42 C ATOM 439 O VAL C 28 -29.382 -0.724 -2.150 1.00 32.22 O ATOM 440 CB VAL C 28 -26.723 -1.449 -1.910 1.00 1.30 C ATOM 441 CG1 VAL C 28 -25.467 -2.202 -1.501 1.00 4.11 C ATOM 442 CG2 VAL C 28 -26.380 -0.275 -2.815 1.00 61.34 C ATOM 0 H VAL C 28 -26.880 -2.248 -4.524 1.00 33.52 H new ATOM 0 HA VAL C 28 -27.932 -3.236 -1.950 1.00 1.30 H new ATOM 0 HB VAL C 28 -27.192 -1.058 -1.007 1.00 1.30 H new ATOM 0 HG11 VAL C 28 -24.776 -1.517 -1.010 1.00 4.11 H new ATOM 0 HG12 VAL C 28 -25.732 -3.005 -0.814 1.00 4.11 H new ATOM 0 HG13 VAL C 28 -24.991 -2.624 -2.386 1.00 4.11 H new ATOM 0 HG21 VAL C 28 -25.675 0.383 -2.306 1.00 61.34 H new ATOM 0 HG22 VAL C 28 -25.931 -0.645 -3.737 1.00 61.34 H new ATOM 0 HG23 VAL C 28 -27.288 0.280 -3.051 1.00 61.34 H new ATOM 452 N LEU C 29 -29.694 -2.021 -3.962 1.00 34.34 N ATOM 453 CA LEU C 29 -30.947 -1.378 -4.342 1.00 34.34 C ATOM 454 C LEU C 29 -31.917 -1.338 -3.165 1.00 20.44 C ATOM 455 O LEU C 29 -32.740 -0.430 -3.056 1.00 24.11 O ATOM 456 CB LEU C 29 -31.586 -2.117 -5.519 1.00 1.11 C ATOM 457 CG LEU C 29 -32.319 -1.246 -6.540 1.00 64.03 C ATOM 458 CD1 LEU C 29 -31.407 -0.914 -7.711 1.00 22.34 C ATOM 459 CD2 LEU C 29 -33.582 -1.942 -7.026 1.00 33.51 C ATOM 0 H LEU C 29 -29.401 -2.775 -4.584 1.00 34.34 H new ATOM 0 HA LEU C 29 -30.725 -0.354 -4.641 1.00 34.34 H new ATOM 0 HB2 LEU C 29 -30.806 -2.674 -6.039 1.00 1.11 H new ATOM 0 HB3 LEU C 29 -32.290 -2.849 -5.123 1.00 1.11 H new ATOM 0 HG LEU C 29 -32.606 -0.314 -6.054 1.00 64.03 H new ATOM 0 HD11 LEU C 29 -31.946 -0.294 -8.427 1.00 22.34 H new ATOM 0 HD12 LEU C 29 -30.532 -0.374 -7.349 1.00 22.34 H new ATOM 0 HD13 LEU C 29 -31.089 -1.836 -8.197 1.00 22.34 H new ATOM 0 HD21 LEU C 29 -34.091 -1.308 -7.752 1.00 33.51 H new ATOM 0 HD22 LEU C 29 -33.318 -2.890 -7.495 1.00 33.51 H new ATOM 0 HD23 LEU C 29 -34.244 -2.128 -6.180 1.00 33.51 H new ATOM 471 N GLY C 30 -31.813 -2.329 -2.285 1.00 53.22 N ATOM 472 CA GLY C 30 -32.685 -2.387 -1.127 1.00 62.13 C ATOM 473 C GLY C 30 -31.926 -2.654 0.158 1.00 3.25 C ATOM 474 O GLY C 30 -32.510 -3.078 1.155 1.00 15.33 O ATOM 0 H GLY C 30 -31.140 -3.093 -2.354 1.00 53.22 H new ATOM 0 HA2 GLY C 30 -33.227 -1.445 -1.036 1.00 62.13 H new ATOM 0 HA3 GLY C 30 -33.429 -3.170 -1.275 1.00 62.13 H new ATOM 478 N ALA C 31 -30.621 -2.407 0.135 1.00 53.32 N ATOM 479 CA ALA C 31 -29.781 -2.622 1.306 1.00 0.35 C ATOM 480 C ALA C 31 -30.154 -1.665 2.433 1.00 14.42 C ATOM 481 O ALA C 31 -30.605 -0.547 2.185 1.00 35.13 O ATOM 482 CB ALA C 31 -28.313 -2.463 0.940 1.00 0.42 C ATOM 0 H ALA C 31 -30.122 -2.057 -0.683 1.00 53.32 H new ATOM 0 HA ALA C 31 -29.947 -3.640 1.659 1.00 0.35 H new ATOM 0 HB1 ALA C 31 -27.698 -2.626 1.825 1.00 0.42 H new ATOM 0 HB2 ALA C 31 -28.048 -3.192 0.174 1.00 0.42 H new ATOM 0 HB3 ALA C 31 -28.140 -1.457 0.559 1.00 0.42 H new ATOM 488 N GLU C 32 -29.964 -2.112 3.671 1.00 43.41 N ATOM 489 CA GLU C 32 -30.283 -1.294 4.835 1.00 44.24 C ATOM 490 C GLU C 32 -29.159 -0.304 5.129 1.00 72.42 C ATOM 491 O GLU C 32 -29.389 0.762 5.700 1.00 73.13 O ATOM 492 CB GLU C 32 -30.529 -2.181 6.057 1.00 12.43 C ATOM 493 CG GLU C 32 -31.825 -2.970 5.985 1.00 53.13 C ATOM 494 CD GLU C 32 -33.041 -2.081 5.814 1.00 74.31 C ATOM 495 OE1 GLU C 32 -33.201 -1.134 6.612 1.00 34.12 O ATOM 496 OE2 GLU C 32 -33.833 -2.333 4.882 1.00 70.52 O ATOM 0 H GLU C 32 -29.591 -3.035 3.893 1.00 43.41 H new ATOM 0 HA GLU C 32 -31.190 -0.732 4.615 1.00 44.24 H new ATOM 0 HB2 GLU C 32 -29.696 -2.876 6.165 1.00 12.43 H new ATOM 0 HB3 GLU C 32 -30.542 -1.558 6.951 1.00 12.43 H new ATOM 0 HG2 GLU C 32 -31.773 -3.672 5.153 1.00 53.13 H new ATOM 0 HG3 GLU C 32 -31.937 -3.561 6.894 1.00 53.13 H new ATOM 503 N ASP C 33 -27.943 -0.665 4.734 1.00 2.31 N ATOM 504 CA ASP C 33 -26.782 0.190 4.955 1.00 12.02 C ATOM 505 C ASP C 33 -26.113 0.549 3.632 1.00 64.24 C ATOM 506 O ASP C 33 -25.590 1.650 3.467 1.00 62.44 O ATOM 507 CB ASP C 33 -25.779 -0.504 5.877 1.00 22.14 C ATOM 508 CG ASP C 33 -26.103 -0.300 7.344 1.00 4.14 C ATOM 509 OD1 ASP C 33 -27.304 -0.251 7.685 1.00 11.31 O ATOM 510 OD2 ASP C 33 -25.157 -0.190 8.151 1.00 64.44 O ATOM 0 H ASP C 33 -27.735 -1.544 4.259 1.00 2.31 H new ATOM 0 HA ASP C 33 -27.123 1.110 5.430 1.00 12.02 H new ATOM 0 HB2 ASP C 33 -25.765 -1.571 5.656 1.00 22.14 H new ATOM 0 HB3 ASP C 33 -24.778 -0.123 5.673 1.00 22.14 H new ATOM 515 N GLY C 34 -26.132 -0.390 2.690 1.00 3.35 N ATOM 516 CA GLY C 34 -25.522 -0.155 1.395 1.00 52.42 C ATOM 517 C GLY C 34 -24.178 -0.839 1.253 1.00 34.12 C ATOM 518 O GLY C 34 -23.145 -0.177 1.138 1.00 2.15 O ATOM 0 H GLY C 34 -26.559 -1.309 2.801 1.00 3.35 H new ATOM 0 HA2 GLY C 34 -26.191 -0.511 0.612 1.00 52.42 H new ATOM 0 HA3 GLY C 34 -25.398 0.917 1.245 1.00 52.42 H new ATOM 522 N CYS C 35 -24.188 -2.168 1.264 1.00 41.14 N ATOM 523 CA CYS C 35 -22.959 -2.943 1.138 1.00 3.30 C ATOM 524 C CYS C 35 -23.227 -4.281 0.458 1.00 24.05 C ATOM 525 O CYS C 35 -24.365 -4.591 0.104 1.00 5.22 O ATOM 526 CB CYS C 35 -22.334 -3.173 2.515 1.00 31.21 C ATOM 527 SG CYS C 35 -21.384 -1.767 3.139 1.00 53.54 S ATOM 0 H CYS C 35 -25.033 -2.731 1.359 1.00 41.14 H new ATOM 0 HA CYS C 35 -22.262 -2.376 0.521 1.00 3.30 H new ATOM 0 HB2 CYS C 35 -23.126 -3.407 3.227 1.00 31.21 H new ATOM 0 HB3 CYS C 35 -21.682 -4.045 2.465 1.00 31.21 H new ATOM 0 HG CYS C 35 -21.791 -0.677 2.559 1.00 53.54 H new ATOM 533 N ILE C 36 -22.172 -5.069 0.277 1.00 3.43 N ATOM 534 CA ILE C 36 -22.294 -6.373 -0.362 1.00 41.20 C ATOM 535 C ILE C 36 -22.176 -7.499 0.660 1.00 4.22 C ATOM 536 O ILE C 36 -21.203 -7.570 1.410 1.00 72.03 O ATOM 537 CB ILE C 36 -21.223 -6.569 -1.451 1.00 24.31 C ATOM 538 CG1 ILE C 36 -21.110 -5.313 -2.317 1.00 13.34 C ATOM 539 CG2 ILE C 36 -21.555 -7.782 -2.308 1.00 2.02 C ATOM 540 CD1 ILE C 36 -22.418 -4.896 -2.952 1.00 45.41 C ATOM 0 H ILE C 36 -21.224 -4.827 0.564 1.00 3.43 H new ATOM 0 HA ILE C 36 -23.281 -6.407 -0.824 1.00 41.20 H new ATOM 0 HB ILE C 36 -20.261 -6.742 -0.968 1.00 24.31 H new ATOM 0 HG12 ILE C 36 -20.735 -4.493 -1.705 1.00 13.34 H new ATOM 0 HG13 ILE C 36 -20.374 -5.488 -3.102 1.00 13.34 H new ATOM 0 HG21 ILE C 36 -20.789 -7.908 -3.073 1.00 2.02 H new ATOM 0 HG22 ILE C 36 -21.590 -8.672 -1.680 1.00 2.02 H new ATOM 0 HG23 ILE C 36 -22.524 -7.636 -2.785 1.00 2.02 H new ATOM 0 HD11 ILE C 36 -22.262 -3.999 -3.551 1.00 45.41 H new ATOM 0 HD12 ILE C 36 -22.785 -5.700 -3.591 1.00 45.41 H new ATOM 0 HD13 ILE C 36 -23.151 -4.689 -2.172 1.00 45.41 H new ATOM 552 N SER C 37 -23.173 -8.378 0.682 1.00 22.14 N ATOM 553 CA SER C 37 -23.182 -9.500 1.613 1.00 11.32 C ATOM 554 C SER C 37 -22.674 -10.770 0.938 1.00 3.21 C ATOM 555 O SER C 37 -22.865 -10.970 -0.262 1.00 1.30 O ATOM 556 CB SER C 37 -24.594 -9.728 2.156 1.00 13.51 C ATOM 557 OG SER C 37 -24.822 -8.955 3.322 1.00 54.25 O ATOM 0 H SER C 37 -23.985 -8.335 0.066 1.00 22.14 H new ATOM 0 HA SER C 37 -22.516 -9.258 2.441 1.00 11.32 H new ATOM 0 HB2 SER C 37 -25.327 -9.466 1.393 1.00 13.51 H new ATOM 0 HB3 SER C 37 -24.734 -10.785 2.383 1.00 13.51 H new ATOM 0 HG SER C 37 -25.732 -9.117 3.649 1.00 54.25 H new ATOM 563 N THR C 38 -22.024 -11.629 1.718 1.00 72.15 N ATOM 564 CA THR C 38 -21.486 -12.879 1.197 1.00 74.40 C ATOM 565 C THR C 38 -22.550 -13.659 0.434 1.00 73.11 C ATOM 566 O THR C 38 -22.258 -14.307 -0.572 1.00 65.22 O ATOM 567 CB THR C 38 -20.929 -13.765 2.327 1.00 61.51 C ATOM 568 OG1 THR C 38 -20.663 -15.082 1.832 1.00 40.32 O ATOM 569 CG2 THR C 38 -21.909 -13.842 3.488 1.00 35.34 C ATOM 0 H THR C 38 -21.858 -11.481 2.713 1.00 72.15 H new ATOM 0 HA THR C 38 -20.675 -12.616 0.518 1.00 74.40 H new ATOM 0 HB THR C 38 -20.001 -13.318 2.685 1.00 61.51 H new ATOM 0 HG1 THR C 38 -20.227 -15.612 2.531 1.00 40.32 H new ATOM 0 HG21 THR C 38 -21.494 -14.473 4.274 1.00 35.34 H new ATOM 0 HG22 THR C 38 -22.086 -12.841 3.882 1.00 35.34 H new ATOM 0 HG23 THR C 38 -22.851 -14.267 3.141 1.00 35.34 H new ATOM 577 N LYS C 39 -23.786 -13.593 0.917 1.00 21.04 N ATOM 578 CA LYS C 39 -24.896 -14.292 0.279 1.00 33.25 C ATOM 579 C LYS C 39 -25.310 -13.592 -1.012 1.00 42.31 C ATOM 580 O LYS C 39 -25.672 -14.242 -1.992 1.00 22.24 O ATOM 581 CB LYS C 39 -26.090 -14.374 1.233 1.00 43.23 C ATOM 582 CG LYS C 39 -26.643 -13.017 1.633 1.00 63.35 C ATOM 583 CD LYS C 39 -27.421 -13.094 2.936 1.00 61.22 C ATOM 584 CE LYS C 39 -26.497 -13.313 4.124 1.00 51.34 C ATOM 585 NZ LYS C 39 -27.226 -13.214 5.419 1.00 61.34 N ATOM 0 H LYS C 39 -24.045 -13.062 1.749 1.00 21.04 H new ATOM 0 HA LYS C 39 -24.565 -15.301 0.034 1.00 33.25 H new ATOM 0 HB2 LYS C 39 -26.882 -14.955 0.761 1.00 43.23 H new ATOM 0 HB3 LYS C 39 -25.790 -14.914 2.131 1.00 43.23 H new ATOM 0 HG2 LYS C 39 -25.824 -12.306 1.739 1.00 63.35 H new ATOM 0 HG3 LYS C 39 -27.292 -12.640 0.842 1.00 63.35 H new ATOM 0 HD2 LYS C 39 -27.987 -12.173 3.078 1.00 61.22 H new ATOM 0 HD3 LYS C 39 -28.145 -13.907 2.882 1.00 61.22 H new ATOM 0 HE2 LYS C 39 -26.030 -14.294 4.044 1.00 51.34 H new ATOM 0 HE3 LYS C 39 -25.695 -12.575 4.101 1.00 51.34 H new ATOM 0 HZ1 LYS C 39 -26.562 -13.369 6.204 1.00 61.34 H new ATOM 0 HZ2 LYS C 39 -27.651 -12.269 5.507 1.00 61.34 H new ATOM 0 HZ3 LYS C 39 -27.975 -13.935 5.452 1.00 61.34 H new ATOM 599 N GLU C 40 -25.251 -12.264 -1.004 1.00 31.44 N ATOM 600 CA GLU C 40 -25.620 -11.477 -2.176 1.00 51.13 C ATOM 601 C GLU C 40 -24.764 -11.860 -3.379 1.00 34.33 C ATOM 602 O GLU C 40 -25.277 -12.325 -4.398 1.00 51.35 O ATOM 603 CB GLU C 40 -25.467 -9.983 -1.883 1.00 4.41 C ATOM 604 CG GLU C 40 -26.503 -9.445 -0.910 1.00 21.14 C ATOM 605 CD GLU C 40 -27.823 -9.121 -1.582 1.00 21.20 C ATOM 606 OE1 GLU C 40 -27.810 -8.792 -2.787 1.00 14.30 O ATOM 607 OE2 GLU C 40 -28.868 -9.198 -0.903 1.00 23.03 O ATOM 0 H GLU C 40 -24.952 -11.711 -0.201 1.00 31.44 H new ATOM 0 HA GLU C 40 -26.663 -11.689 -2.411 1.00 51.13 H new ATOM 0 HB2 GLU C 40 -24.471 -9.801 -1.478 1.00 4.41 H new ATOM 0 HB3 GLU C 40 -25.537 -9.429 -2.819 1.00 4.41 H new ATOM 0 HG2 GLU C 40 -26.671 -10.179 -0.122 1.00 21.14 H new ATOM 0 HG3 GLU C 40 -26.114 -8.547 -0.431 1.00 21.14 H new ATOM 614 N LEU C 41 -23.456 -11.662 -3.255 1.00 51.23 N ATOM 615 CA LEU C 41 -22.527 -11.986 -4.332 1.00 43.33 C ATOM 616 C LEU C 41 -22.672 -13.445 -4.755 1.00 43.45 C ATOM 617 O LEU C 41 -22.728 -13.754 -5.945 1.00 54.45 O ATOM 618 CB LEU C 41 -21.089 -11.711 -3.892 1.00 23.11 C ATOM 619 CG LEU C 41 -20.074 -11.489 -5.014 1.00 54.44 C ATOM 620 CD1 LEU C 41 -20.488 -10.312 -5.883 1.00 54.40 C ATOM 621 CD2 LEU C 41 -18.683 -11.266 -4.439 1.00 31.11 C ATOM 0 H LEU C 41 -23.015 -11.279 -2.419 1.00 51.23 H new ATOM 0 HA LEU C 41 -22.765 -11.353 -5.187 1.00 43.33 H new ATOM 0 HB2 LEU C 41 -21.089 -10.830 -3.250 1.00 23.11 H new ATOM 0 HB3 LEU C 41 -20.750 -12.549 -3.283 1.00 23.11 H new ATOM 0 HG LEU C 41 -20.049 -12.383 -5.637 1.00 54.44 H new ATOM 0 HD11 LEU C 41 -19.754 -10.169 -6.676 1.00 54.40 H new ATOM 0 HD12 LEU C 41 -21.465 -10.511 -6.324 1.00 54.40 H new ATOM 0 HD13 LEU C 41 -20.543 -9.411 -5.273 1.00 54.40 H new ATOM 0 HD21 LEU C 41 -17.974 -11.110 -5.252 1.00 31.11 H new ATOM 0 HD22 LEU C 41 -18.693 -10.388 -3.793 1.00 31.11 H new ATOM 0 HD23 LEU C 41 -18.384 -12.140 -3.860 1.00 31.11 H new ATOM 633 N GLY C 42 -22.733 -14.338 -3.772 1.00 45.03 N ATOM 634 CA GLY C 42 -22.873 -15.753 -4.063 1.00 55.32 C ATOM 635 C GLY C 42 -24.115 -16.058 -4.876 1.00 33.24 C ATOM 636 O GLY C 42 -24.073 -16.855 -5.813 1.00 10.12 O ATOM 0 H GLY C 42 -22.688 -14.107 -2.780 1.00 45.03 H new ATOM 0 HA2 GLY C 42 -21.993 -16.098 -4.606 1.00 55.32 H new ATOM 0 HA3 GLY C 42 -22.909 -16.311 -3.128 1.00 55.32 H new ATOM 640 N LYS C 43 -25.226 -15.423 -4.517 1.00 43.04 N ATOM 641 CA LYS C 43 -26.487 -15.630 -5.219 1.00 13.34 C ATOM 642 C LYS C 43 -26.315 -15.420 -6.720 1.00 54.10 C ATOM 643 O LYS C 43 -26.997 -16.051 -7.528 1.00 45.32 O ATOM 644 CB LYS C 43 -27.557 -14.679 -4.679 1.00 62.12 C ATOM 645 CG LYS C 43 -28.105 -15.086 -3.322 1.00 14.43 C ATOM 646 CD LYS C 43 -29.388 -15.888 -3.456 1.00 71.54 C ATOM 647 CE LYS C 43 -30.572 -14.993 -3.791 1.00 63.45 C ATOM 648 NZ LYS C 43 -31.862 -15.735 -3.734 1.00 61.40 N ATOM 0 H LYS C 43 -25.278 -14.760 -3.743 1.00 43.04 H new ATOM 0 HA LYS C 43 -26.805 -16.659 -5.048 1.00 13.34 H new ATOM 0 HB2 LYS C 43 -27.136 -13.676 -4.605 1.00 62.12 H new ATOM 0 HB3 LYS C 43 -28.379 -14.628 -5.393 1.00 62.12 H new ATOM 0 HG2 LYS C 43 -27.359 -15.677 -2.790 1.00 14.43 H new ATOM 0 HG3 LYS C 43 -28.293 -14.195 -2.722 1.00 14.43 H new ATOM 0 HD2 LYS C 43 -29.268 -16.641 -4.235 1.00 71.54 H new ATOM 0 HD3 LYS C 43 -29.585 -16.420 -2.525 1.00 71.54 H new ATOM 0 HE2 LYS C 43 -30.603 -14.156 -3.093 1.00 63.45 H new ATOM 0 HE3 LYS C 43 -30.439 -14.572 -4.788 1.00 63.45 H new ATOM 0 HZ1 LYS C 43 -32.644 -15.090 -3.968 1.00 61.40 H new ATOM 0 HZ2 LYS C 43 -31.842 -16.518 -4.418 1.00 61.40 H new ATOM 0 HZ3 LYS C 43 -32.002 -16.115 -2.776 1.00 61.40 H new ATOM 662 N VAL C 44 -25.399 -14.529 -7.087 1.00 51.54 N ATOM 663 CA VAL C 44 -25.136 -14.238 -8.491 1.00 1.04 C ATOM 664 C VAL C 44 -24.328 -15.354 -9.142 1.00 22.04 C ATOM 665 O VAL C 44 -24.483 -15.635 -10.330 1.00 13.31 O ATOM 666 CB VAL C 44 -24.378 -12.907 -8.656 1.00 23.34 C ATOM 667 CG1 VAL C 44 -24.293 -12.518 -10.124 1.00 13.03 C ATOM 668 CG2 VAL C 44 -25.047 -11.809 -7.843 1.00 33.02 C ATOM 0 H VAL C 44 -24.827 -13.997 -6.431 1.00 51.54 H new ATOM 0 HA VAL C 44 -26.105 -14.160 -8.984 1.00 1.04 H new ATOM 0 HB VAL C 44 -23.363 -13.039 -8.281 1.00 23.34 H new ATOM 0 HG11 VAL C 44 -23.754 -11.575 -10.220 1.00 13.03 H new ATOM 0 HG12 VAL C 44 -23.765 -13.295 -10.676 1.00 13.03 H new ATOM 0 HG13 VAL C 44 -25.299 -12.404 -10.529 1.00 13.03 H new ATOM 0 HG21 VAL C 44 -24.498 -10.876 -7.971 1.00 33.02 H new ATOM 0 HG22 VAL C 44 -26.073 -11.677 -8.185 1.00 33.02 H new ATOM 0 HG23 VAL C 44 -25.049 -12.087 -6.789 1.00 33.02 H new ATOM 678 N MET C 45 -23.464 -15.988 -8.355 1.00 13.13 N ATOM 679 CA MET C 45 -22.632 -17.076 -8.855 1.00 43.22 C ATOM 680 C MET C 45 -23.475 -18.311 -9.159 1.00 54.05 C ATOM 681 O MET C 45 -23.134 -19.107 -10.033 1.00 33.40 O ATOM 682 CB MET C 45 -21.545 -17.425 -7.836 1.00 64.41 C ATOM 683 CG MET C 45 -20.757 -16.219 -7.352 1.00 55.45 C ATOM 684 SD MET C 45 -19.968 -15.318 -8.700 1.00 15.50 S ATOM 685 CE MET C 45 -19.104 -16.646 -9.536 1.00 33.03 C ATOM 0 H MET C 45 -23.322 -15.767 -7.369 1.00 13.13 H new ATOM 0 HA MET C 45 -22.161 -16.743 -9.780 1.00 43.22 H new ATOM 0 HB2 MET C 45 -22.006 -17.916 -6.979 1.00 64.41 H new ATOM 0 HB3 MET C 45 -20.857 -18.143 -8.282 1.00 64.41 H new ATOM 0 HG2 MET C 45 -21.424 -15.547 -6.812 1.00 55.45 H new ATOM 0 HG3 MET C 45 -19.995 -16.548 -6.645 1.00 55.45 H new ATOM 0 HE1 MET C 45 -18.365 -16.226 -10.219 1.00 33.03 H new ATOM 0 HE2 MET C 45 -18.602 -17.274 -8.800 1.00 33.03 H new ATOM 0 HE3 MET C 45 -19.818 -17.247 -10.099 1.00 33.03 H new ATOM 695 N ARG C 46 -24.577 -18.462 -8.431 1.00 43.23 N ATOM 696 CA ARG C 46 -25.468 -19.601 -8.622 1.00 74.10 C ATOM 697 C ARG C 46 -26.169 -19.522 -9.975 1.00 21.01 C ATOM 698 O ARG C 46 -26.336 -20.531 -10.659 1.00 34.35 O ATOM 699 CB ARG C 46 -26.507 -19.657 -7.500 1.00 13.00 C ATOM 700 CG ARG C 46 -25.898 -19.678 -6.108 1.00 22.43 C ATOM 701 CD ARG C 46 -24.944 -20.850 -5.935 1.00 61.00 C ATOM 702 NE ARG C 46 -25.532 -22.106 -6.393 1.00 71.34 N ATOM 703 CZ ARG C 46 -26.418 -22.803 -5.690 1.00 3.22 C ATOM 704 NH1 ARG C 46 -26.818 -22.367 -4.503 1.00 0.23 N ATOM 705 NH2 ARG C 46 -26.907 -23.937 -6.175 1.00 51.22 N ATOM 0 H ARG C 46 -24.874 -17.811 -7.704 1.00 43.23 H new ATOM 0 HA ARG C 46 -24.866 -20.509 -8.596 1.00 74.10 H new ATOM 0 HB2 ARG C 46 -27.168 -18.795 -7.585 1.00 13.00 H new ATOM 0 HB3 ARG C 46 -27.124 -20.546 -7.631 1.00 13.00 H new ATOM 0 HG2 ARG C 46 -25.365 -18.744 -5.929 1.00 22.43 H new ATOM 0 HG3 ARG C 46 -26.692 -19.740 -5.363 1.00 22.43 H new ATOM 0 HD2 ARG C 46 -24.026 -20.656 -6.490 1.00 61.00 H new ATOM 0 HD3 ARG C 46 -24.668 -20.941 -4.884 1.00 61.00 H new ATOM 0 HE ARG C 46 -25.247 -22.468 -7.303 1.00 71.34 H new ATOM 0 HH11 ARG C 46 -26.445 -21.495 -4.128 1.00 0.23 H new ATOM 0 HH12 ARG C 46 -27.498 -22.904 -3.965 1.00 0.23 H new ATOM 0 HH21 ARG C 46 -26.603 -24.274 -7.088 1.00 51.22 H new ATOM 0 HH22 ARG C 46 -27.587 -24.472 -5.635 1.00 51.22 H new ATOM 719 N MET C 47 -26.577 -18.315 -10.355 1.00 42.40 N ATOM 720 CA MET C 47 -27.259 -18.105 -11.626 1.00 43.31 C ATOM 721 C MET C 47 -26.259 -18.042 -12.776 1.00 51.51 C ATOM 722 O MET C 47 -26.599 -18.331 -13.924 1.00 73.34 O ATOM 723 CB MET C 47 -28.082 -16.816 -11.581 1.00 61.01 C ATOM 724 CG MET C 47 -27.255 -15.577 -11.280 1.00 11.51 C ATOM 725 SD MET C 47 -28.035 -14.061 -11.867 1.00 63.45 S ATOM 726 CE MET C 47 -27.015 -13.685 -13.291 1.00 14.40 C ATOM 0 H MET C 47 -26.447 -17.469 -9.801 1.00 42.40 H new ATOM 0 HA MET C 47 -27.927 -18.949 -11.794 1.00 43.31 H new ATOM 0 HB2 MET C 47 -28.586 -16.683 -12.538 1.00 61.01 H new ATOM 0 HB3 MET C 47 -28.859 -16.917 -10.823 1.00 61.01 H new ATOM 0 HG2 MET C 47 -27.094 -15.505 -10.204 1.00 11.51 H new ATOM 0 HG3 MET C 47 -26.274 -15.679 -11.743 1.00 11.51 H new ATOM 0 HE1 MET C 47 -27.395 -12.790 -13.784 1.00 14.40 H new ATOM 0 HE2 MET C 47 -25.988 -13.513 -12.968 1.00 14.40 H new ATOM 0 HE3 MET C 47 -27.041 -14.522 -13.988 1.00 14.40 H new ATOM 736 N LEU C 48 -25.025 -17.663 -12.461 1.00 4.02 N ATOM 737 CA LEU C 48 -23.975 -17.563 -13.469 1.00 2.21 C ATOM 738 C LEU C 48 -23.629 -18.937 -14.034 1.00 41.40 C ATOM 739 O LEU C 48 -23.293 -19.069 -15.210 1.00 30.30 O ATOM 740 CB LEU C 48 -22.726 -16.916 -12.869 1.00 31.13 C ATOM 741 CG LEU C 48 -22.421 -15.490 -13.329 1.00 33.53 C ATOM 742 CD1 LEU C 48 -22.536 -14.517 -12.166 1.00 74.20 C ATOM 743 CD2 LEU C 48 -21.034 -15.416 -13.953 1.00 10.50 C ATOM 0 H LEU C 48 -24.727 -17.420 -11.516 1.00 4.02 H new ATOM 0 HA LEU C 48 -24.345 -16.939 -14.283 1.00 2.21 H new ATOM 0 HB2 LEU C 48 -22.829 -16.912 -11.784 1.00 31.13 H new ATOM 0 HB3 LEU C 48 -21.867 -17.544 -13.105 1.00 31.13 H new ATOM 0 HG LEU C 48 -23.154 -15.209 -14.085 1.00 33.53 H new ATOM 0 HD11 LEU C 48 -22.315 -13.508 -12.513 1.00 74.20 H new ATOM 0 HD12 LEU C 48 -23.548 -14.549 -11.763 1.00 74.20 H new ATOM 0 HD13 LEU C 48 -21.827 -14.796 -11.387 1.00 74.20 H new ATOM 0 HD21 LEU C 48 -20.834 -14.394 -14.275 1.00 10.50 H new ATOM 0 HD22 LEU C 48 -20.288 -15.718 -13.218 1.00 10.50 H new ATOM 0 HD23 LEU C 48 -20.986 -16.083 -14.814 1.00 10.50 H new ATOM 755 N GLY C 49 -23.716 -19.958 -13.187 1.00 40.00 N ATOM 756 CA GLY C 49 -23.411 -21.309 -13.620 1.00 4.45 C ATOM 757 C GLY C 49 -22.631 -22.089 -12.581 1.00 21.21 C ATOM 758 O GLY C 49 -22.711 -23.316 -12.528 1.00 32.02 O ATOM 0 H GLY C 49 -23.992 -19.874 -12.209 1.00 40.00 H new ATOM 0 HA2 GLY C 49 -24.340 -21.834 -13.842 1.00 4.45 H new ATOM 0 HA3 GLY C 49 -22.838 -21.270 -14.546 1.00 4.45 H new ATOM 762 N GLN C 50 -21.872 -21.377 -11.754 1.00 42.14 N ATOM 763 CA GLN C 50 -21.073 -22.011 -10.713 1.00 70.20 C ATOM 764 C GLN C 50 -21.828 -22.043 -9.389 1.00 21.54 C ATOM 765 O GLN C 50 -22.987 -21.635 -9.315 1.00 23.15 O ATOM 766 CB GLN C 50 -19.745 -21.272 -10.539 1.00 74.15 C ATOM 767 CG GLN C 50 -18.965 -21.108 -11.834 1.00 74.41 C ATOM 768 CD GLN C 50 -18.335 -22.404 -12.303 1.00 23.21 C ATOM 769 OE1 GLN C 50 -18.600 -22.871 -13.412 1.00 73.52 O ATOM 770 NE2 GLN C 50 -17.495 -22.994 -11.461 1.00 45.14 N ATOM 0 H GLN C 50 -21.794 -20.360 -11.785 1.00 42.14 H new ATOM 0 HA GLN C 50 -20.872 -23.038 -11.020 1.00 70.20 H new ATOM 0 HB2 GLN C 50 -19.940 -20.287 -10.115 1.00 74.15 H new ATOM 0 HB3 GLN C 50 -19.130 -21.813 -9.820 1.00 74.15 H new ATOM 0 HG2 GLN C 50 -19.631 -20.731 -12.610 1.00 74.41 H new ATOM 0 HG3 GLN C 50 -18.185 -20.360 -11.692 1.00 74.41 H new ATOM 0 HE21 GLN C 50 -17.304 -22.572 -10.552 1.00 45.14 H new ATOM 0 HE22 GLN C 50 -17.041 -23.869 -11.723 1.00 45.14 H new ATOM 779 N ASN C 51 -21.165 -22.530 -8.346 1.00 21.41 N ATOM 780 CA ASN C 51 -21.775 -22.615 -7.024 1.00 22.53 C ATOM 781 C ASN C 51 -20.713 -22.555 -5.930 1.00 61.25 C ATOM 782 O ASN C 51 -20.455 -23.532 -5.226 1.00 50.12 O ATOM 783 CB ASN C 51 -22.583 -23.908 -6.895 1.00 33.14 C ATOM 784 CG ASN C 51 -21.908 -25.082 -7.577 1.00 4.41 C ATOM 785 OD1 ASN C 51 -22.192 -25.388 -8.735 1.00 53.41 O ATOM 786 ND2 ASN C 51 -21.010 -25.747 -6.859 1.00 43.42 N ATOM 0 H ASN C 51 -20.205 -22.872 -8.390 1.00 21.41 H new ATOM 0 HA ASN C 51 -22.444 -21.763 -6.904 1.00 22.53 H new ATOM 0 HB2 ASN C 51 -22.728 -24.139 -5.840 1.00 33.14 H new ATOM 0 HB3 ASN C 51 -23.572 -23.760 -7.328 1.00 33.14 H new ATOM 0 HD21 ASN C 51 -20.524 -26.547 -7.264 1.00 43.42 H new ATOM 0 HD22 ASN C 51 -20.806 -25.458 -5.902 1.00 43.42 H new ATOM 793 N PRO C 52 -20.081 -21.381 -5.783 1.00 72.33 N ATOM 794 CA PRO C 52 -19.038 -21.165 -4.776 1.00 61.25 C ATOM 795 C PRO C 52 -19.595 -21.154 -3.356 1.00 71.54 C ATOM 796 O PRO C 52 -20.542 -20.427 -3.054 1.00 52.25 O ATOM 797 CB PRO C 52 -18.475 -19.788 -5.139 1.00 12.40 C ATOM 798 CG PRO C 52 -19.588 -19.099 -5.850 1.00 24.01 C ATOM 799 CD PRO C 52 -20.337 -20.175 -6.587 1.00 63.12 C ATOM 0 HA PRO C 52 -18.294 -21.962 -4.783 1.00 61.25 H new ATOM 0 HB2 PRO C 52 -18.173 -19.237 -4.249 1.00 12.40 H new ATOM 0 HB3 PRO C 52 -17.594 -19.876 -5.774 1.00 12.40 H new ATOM 0 HG2 PRO C 52 -20.240 -18.582 -5.146 1.00 24.01 H new ATOM 0 HG3 PRO C 52 -19.204 -18.348 -6.540 1.00 24.01 H new ATOM 0 HD2 PRO C 52 -21.402 -19.952 -6.649 1.00 63.12 H new ATOM 0 HD3 PRO C 52 -19.975 -20.289 -7.609 1.00 63.12 H new ATOM 807 N THR C 53 -19.002 -21.967 -2.487 1.00 41.11 N ATOM 808 CA THR C 53 -19.440 -22.052 -1.099 1.00 65.11 C ATOM 809 C THR C 53 -19.586 -20.665 -0.483 1.00 54.33 C ATOM 810 O THR C 53 -18.863 -19.729 -0.823 1.00 22.44 O ATOM 811 CB THR C 53 -18.456 -22.877 -0.249 1.00 10.43 C ATOM 812 OG1 THR C 53 -18.674 -22.619 1.142 1.00 12.13 O ATOM 813 CG2 THR C 53 -17.016 -22.545 -0.613 1.00 52.42 C ATOM 0 H THR C 53 -18.217 -22.576 -2.720 1.00 41.11 H new ATOM 0 HA THR C 53 -20.410 -22.549 -1.104 1.00 65.11 H new ATOM 0 HB THR C 53 -18.631 -23.933 -0.453 1.00 10.43 H new ATOM 0 HG1 THR C 53 -19.066 -23.412 1.564 1.00 12.13 H new ATOM 0 HG21 THR C 53 -16.339 -23.140 0.000 1.00 52.42 H new ATOM 0 HG22 THR C 53 -16.845 -22.771 -1.666 1.00 52.42 H new ATOM 0 HG23 THR C 53 -16.831 -21.486 -0.435 1.00 52.42 H new ATOM 821 N PRO C 54 -20.544 -20.528 0.446 1.00 35.23 N ATOM 822 CA PRO C 54 -20.807 -19.258 1.130 1.00 4.44 C ATOM 823 C PRO C 54 -19.685 -18.874 2.089 1.00 62.11 C ATOM 824 O PRO C 54 -19.586 -17.723 2.513 1.00 72.03 O ATOM 825 CB PRO C 54 -22.099 -19.532 1.903 1.00 64.21 C ATOM 826 CG PRO C 54 -22.111 -21.007 2.110 1.00 2.14 C ATOM 827 CD PRO C 54 -21.444 -21.601 0.900 1.00 52.44 C ATOM 0 HA PRO C 54 -20.881 -18.426 0.430 1.00 4.44 H new ATOM 0 HB2 PRO C 54 -22.112 -18.999 2.854 1.00 64.21 H new ATOM 0 HB3 PRO C 54 -22.974 -19.204 1.341 1.00 64.21 H new ATOM 0 HG2 PRO C 54 -21.578 -21.277 3.021 1.00 2.14 H new ATOM 0 HG3 PRO C 54 -23.131 -21.378 2.215 1.00 2.14 H new ATOM 0 HD2 PRO C 54 -20.894 -22.508 1.149 1.00 52.44 H new ATOM 0 HD3 PRO C 54 -22.170 -21.869 0.132 1.00 52.44 H new ATOM 835 N GLU C 55 -18.841 -19.844 2.426 1.00 42.21 N ATOM 836 CA GLU C 55 -17.727 -19.606 3.335 1.00 71.50 C ATOM 837 C GLU C 55 -16.606 -18.845 2.633 1.00 15.45 C ATOM 838 O GLU C 55 -15.932 -18.014 3.241 1.00 62.42 O ATOM 839 CB GLU C 55 -17.193 -20.931 3.883 1.00 14.22 C ATOM 840 CG GLU C 55 -18.097 -21.566 4.926 1.00 1.13 C ATOM 841 CD GLU C 55 -18.481 -20.601 6.030 1.00 5.32 C ATOM 842 OE1 GLU C 55 -17.706 -20.471 7.001 1.00 55.24 O ATOM 843 OE2 GLU C 55 -19.557 -19.975 5.924 1.00 43.53 O ATOM 0 H GLU C 55 -18.908 -20.802 2.083 1.00 42.21 H new ATOM 0 HA GLU C 55 -18.092 -19.000 4.164 1.00 71.50 H new ATOM 0 HB2 GLU C 55 -17.060 -21.629 3.057 1.00 14.22 H new ATOM 0 HB3 GLU C 55 -16.209 -20.763 4.321 1.00 14.22 H new ATOM 0 HG2 GLU C 55 -19.001 -21.936 4.441 1.00 1.13 H new ATOM 0 HG3 GLU C 55 -17.593 -22.429 5.362 1.00 1.13 H new ATOM 850 N GLU C 56 -16.413 -19.136 1.351 1.00 34.52 N ATOM 851 CA GLU C 56 -15.373 -18.481 0.567 1.00 4.23 C ATOM 852 C GLU C 56 -15.617 -16.976 0.489 1.00 24.22 C ATOM 853 O GLU C 56 -14.746 -16.176 0.832 1.00 75.33 O ATOM 854 CB GLU C 56 -15.315 -19.073 -0.842 1.00 34.42 C ATOM 855 CG GLU C 56 -14.131 -19.998 -1.066 1.00 12.14 C ATOM 856 CD GLU C 56 -13.851 -20.887 0.130 1.00 43.01 C ATOM 857 OE1 GLU C 56 -14.820 -21.308 0.797 1.00 53.05 O ATOM 858 OE2 GLU C 56 -12.663 -21.162 0.399 1.00 63.53 O ATOM 0 H GLU C 56 -16.963 -19.821 0.833 1.00 34.52 H new ATOM 0 HA GLU C 56 -14.418 -18.652 1.064 1.00 4.23 H new ATOM 0 HB2 GLU C 56 -16.236 -19.623 -1.034 1.00 34.42 H new ATOM 0 HB3 GLU C 56 -15.272 -18.260 -1.567 1.00 34.42 H new ATOM 0 HG2 GLU C 56 -14.321 -20.621 -1.940 1.00 12.14 H new ATOM 0 HG3 GLU C 56 -13.245 -19.402 -1.286 1.00 12.14 H new ATOM 865 N LEU C 57 -16.807 -16.599 0.036 1.00 34.11 N ATOM 866 CA LEU C 57 -17.168 -15.191 -0.089 1.00 13.12 C ATOM 867 C LEU C 57 -16.955 -14.456 1.231 1.00 45.52 C ATOM 868 O LEU C 57 -16.322 -13.402 1.269 1.00 11.24 O ATOM 869 CB LEU C 57 -18.625 -15.055 -0.532 1.00 61.35 C ATOM 870 CG LEU C 57 -18.934 -15.489 -1.965 1.00 54.42 C ATOM 871 CD1 LEU C 57 -20.301 -16.153 -2.039 1.00 45.11 C ATOM 872 CD2 LEU C 57 -18.866 -14.299 -2.910 1.00 44.33 C ATOM 0 H LEU C 57 -17.539 -17.249 -0.251 1.00 34.11 H new ATOM 0 HA LEU C 57 -16.522 -14.741 -0.843 1.00 13.12 H new ATOM 0 HB2 LEU C 57 -19.246 -15.641 0.146 1.00 61.35 H new ATOM 0 HB3 LEU C 57 -18.923 -14.013 -0.417 1.00 61.35 H new ATOM 0 HG LEU C 57 -18.182 -16.216 -2.273 1.00 54.42 H new ATOM 0 HD11 LEU C 57 -20.504 -16.455 -3.067 1.00 45.11 H new ATOM 0 HD12 LEU C 57 -20.314 -17.031 -1.393 1.00 45.11 H new ATOM 0 HD13 LEU C 57 -21.066 -15.449 -1.710 1.00 45.11 H new ATOM 0 HD21 LEU C 57 -19.089 -14.627 -3.925 1.00 44.33 H new ATOM 0 HD22 LEU C 57 -19.595 -13.549 -2.603 1.00 44.33 H new ATOM 0 HD23 LEU C 57 -17.866 -13.867 -2.880 1.00 44.33 H new ATOM 884 N GLN C 58 -17.487 -15.022 2.310 1.00 10.43 N ATOM 885 CA GLN C 58 -17.353 -14.420 3.631 1.00 72.31 C ATOM 886 C GLN C 58 -15.892 -14.117 3.946 1.00 62.02 C ATOM 887 O GLN C 58 -15.586 -13.154 4.649 1.00 71.31 O ATOM 888 CB GLN C 58 -17.935 -15.349 4.699 1.00 32.41 C ATOM 889 CG GLN C 58 -17.915 -14.756 6.098 1.00 32.43 C ATOM 890 CD GLN C 58 -19.119 -13.878 6.378 1.00 32.13 C ATOM 891 OE1 GLN C 58 -20.124 -14.338 6.920 1.00 51.35 O ATOM 892 NE2 GLN C 58 -19.023 -12.607 6.008 1.00 52.20 N ATOM 0 H GLN C 58 -18.014 -15.895 2.295 1.00 10.43 H new ATOM 0 HA GLN C 58 -17.908 -13.482 3.633 1.00 72.31 H new ATOM 0 HB2 GLN C 58 -18.963 -15.596 4.433 1.00 32.41 H new ATOM 0 HB3 GLN C 58 -17.373 -16.283 4.701 1.00 32.41 H new ATOM 0 HG2 GLN C 58 -17.881 -15.563 6.830 1.00 32.43 H new ATOM 0 HG3 GLN C 58 -17.005 -14.170 6.227 1.00 32.43 H new ATOM 0 HE21 GLN C 58 -18.170 -12.269 5.562 1.00 52.20 H new ATOM 0 HE22 GLN C 58 -19.802 -11.968 6.170 1.00 52.20 H new ATOM 901 N GLU C 59 -14.994 -14.945 3.422 1.00 64.24 N ATOM 902 CA GLU C 59 -13.565 -14.765 3.649 1.00 31.44 C ATOM 903 C GLU C 59 -13.006 -13.665 2.750 1.00 33.43 C ATOM 904 O GLU C 59 -12.066 -12.964 3.122 1.00 73.41 O ATOM 905 CB GLU C 59 -12.817 -16.075 3.396 1.00 13.40 C ATOM 906 CG GLU C 59 -11.498 -16.177 4.143 1.00 2.21 C ATOM 907 CD GLU C 59 -11.674 -16.639 5.577 1.00 31.30 C ATOM 908 OE1 GLU C 59 -12.020 -17.822 5.780 1.00 44.33 O ATOM 909 OE2 GLU C 59 -11.466 -15.819 6.495 1.00 30.12 O ATOM 0 H GLU C 59 -15.231 -15.747 2.838 1.00 64.24 H new ATOM 0 HA GLU C 59 -13.422 -14.469 4.688 1.00 31.44 H new ATOM 0 HB2 GLU C 59 -13.455 -16.910 3.687 1.00 13.40 H new ATOM 0 HB3 GLU C 59 -12.628 -16.175 2.327 1.00 13.40 H new ATOM 0 HG2 GLU C 59 -10.841 -16.872 3.619 1.00 2.21 H new ATOM 0 HG3 GLU C 59 -11.005 -15.205 4.136 1.00 2.21 H new ATOM 916 N MET C 60 -13.591 -13.522 1.566 1.00 31.22 N ATOM 917 CA MET C 60 -13.152 -12.508 0.614 1.00 51.52 C ATOM 918 C MET C 60 -13.500 -11.109 1.112 1.00 52.25 C ATOM 919 O MET C 60 -12.786 -10.146 0.832 1.00 51.13 O ATOM 920 CB MET C 60 -13.794 -12.750 -0.753 1.00 1.15 C ATOM 921 CG MET C 60 -13.215 -11.881 -1.858 1.00 3.44 C ATOM 922 SD MET C 60 -14.316 -11.738 -3.279 1.00 25.50 S ATOM 923 CE MET C 60 -14.394 -13.444 -3.820 1.00 70.44 C ATOM 0 H MET C 60 -14.370 -14.095 1.242 1.00 31.22 H new ATOM 0 HA MET C 60 -12.069 -12.581 0.516 1.00 51.52 H new ATOM 0 HB2 MET C 60 -13.669 -13.799 -1.023 1.00 1.15 H new ATOM 0 HB3 MET C 60 -14.866 -12.565 -0.680 1.00 1.15 H new ATOM 0 HG2 MET C 60 -13.008 -10.887 -1.462 1.00 3.44 H new ATOM 0 HG3 MET C 60 -12.262 -12.299 -2.182 1.00 3.44 H new ATOM 0 HE1 MET C 60 -14.952 -13.504 -4.755 1.00 70.44 H new ATOM 0 HE2 MET C 60 -13.384 -13.823 -3.975 1.00 70.44 H new ATOM 0 HE3 MET C 60 -14.894 -14.044 -3.060 1.00 70.44 H new ATOM 933 N ILE C 61 -14.599 -11.005 1.851 1.00 23.11 N ATOM 934 CA ILE C 61 -15.040 -9.723 2.387 1.00 51.35 C ATOM 935 C ILE C 61 -13.989 -9.126 3.318 1.00 31.44 C ATOM 936 O ILE C 61 -13.706 -7.929 3.265 1.00 10.23 O ATOM 937 CB ILE C 61 -16.369 -9.860 3.153 1.00 42.01 C ATOM 938 CG1 ILE C 61 -17.456 -10.423 2.236 1.00 34.01 C ATOM 939 CG2 ILE C 61 -16.793 -8.515 3.723 1.00 21.32 C ATOM 940 CD1 ILE C 61 -18.680 -10.913 2.978 1.00 70.13 C ATOM 0 H ILE C 61 -15.200 -11.793 2.092 1.00 23.11 H new ATOM 0 HA ILE C 61 -15.188 -9.059 1.535 1.00 51.35 H new ATOM 0 HB ILE C 61 -16.224 -10.554 3.981 1.00 42.01 H new ATOM 0 HG12 ILE C 61 -17.756 -9.652 1.526 1.00 34.01 H new ATOM 0 HG13 ILE C 61 -17.040 -11.246 1.655 1.00 34.01 H new ATOM 0 HG21 ILE C 61 -17.734 -8.628 4.261 1.00 21.32 H new ATOM 0 HG22 ILE C 61 -16.026 -8.151 4.406 1.00 21.32 H new ATOM 0 HG23 ILE C 61 -16.924 -7.800 2.910 1.00 21.32 H new ATOM 0 HD11 ILE C 61 -19.408 -11.298 2.264 1.00 70.13 H new ATOM 0 HD12 ILE C 61 -18.394 -11.707 3.668 1.00 70.13 H new ATOM 0 HD13 ILE C 61 -19.121 -10.088 3.537 1.00 70.13 H new ATOM 952 N ASP C 62 -13.413 -9.969 4.168 1.00 61.23 N ATOM 953 CA ASP C 62 -12.390 -9.526 5.108 1.00 71.22 C ATOM 954 C ASP C 62 -11.109 -9.140 4.376 1.00 72.43 C ATOM 955 O ASP C 62 -10.353 -8.286 4.837 1.00 72.40 O ATOM 956 CB ASP C 62 -12.097 -10.625 6.131 1.00 34.01 C ATOM 957 CG ASP C 62 -11.453 -10.085 7.392 1.00 24.22 C ATOM 958 OD1 ASP C 62 -11.619 -8.880 7.675 1.00 61.55 O ATOM 959 OD2 ASP C 62 -10.783 -10.868 8.098 1.00 22.45 O ATOM 0 H ASP C 62 -13.637 -10.962 4.225 1.00 61.23 H new ATOM 0 HA ASP C 62 -12.767 -8.646 5.629 1.00 71.22 H new ATOM 0 HB2 ASP C 62 -13.026 -11.133 6.390 1.00 34.01 H new ATOM 0 HB3 ASP C 62 -11.440 -11.370 5.682 1.00 34.01 H new ATOM 964 N GLU C 63 -10.871 -9.777 3.233 1.00 34.03 N ATOM 965 CA GLU C 63 -9.680 -9.501 2.439 1.00 54.41 C ATOM 966 C GLU C 63 -9.697 -8.069 1.912 1.00 32.42 C ATOM 967 O GLU C 63 -8.648 -7.480 1.649 1.00 12.13 O ATOM 968 CB GLU C 63 -9.579 -10.485 1.271 1.00 74.32 C ATOM 969 CG GLU C 63 -8.792 -11.742 1.600 1.00 51.24 C ATOM 970 CD GLU C 63 -9.117 -12.894 0.670 1.00 1.15 C ATOM 971 OE1 GLU C 63 -8.810 -12.788 -0.536 1.00 40.13 O ATOM 972 OE2 GLU C 63 -9.678 -13.902 1.148 1.00 24.31 O ATOM 0 H GLU C 63 -11.487 -10.487 2.837 1.00 34.03 H new ATOM 0 HA GLU C 63 -8.809 -9.622 3.083 1.00 54.41 H new ATOM 0 HB2 GLU C 63 -10.584 -10.767 0.957 1.00 74.32 H new ATOM 0 HB3 GLU C 63 -9.110 -9.984 0.424 1.00 74.32 H new ATOM 0 HG2 GLU C 63 -7.726 -11.524 1.543 1.00 51.24 H new ATOM 0 HG3 GLU C 63 -9.002 -12.039 2.627 1.00 51.24 H new ATOM 979 N VAL C 64 -10.895 -7.515 1.760 1.00 10.23 N ATOM 980 CA VAL C 64 -11.050 -6.152 1.265 1.00 63.34 C ATOM 981 C VAL C 64 -11.500 -5.211 2.378 1.00 63.23 C ATOM 982 O VAL C 64 -11.559 -3.996 2.191 1.00 65.43 O ATOM 983 CB VAL C 64 -12.067 -6.087 0.110 1.00 31.21 C ATOM 984 CG1 VAL C 64 -11.469 -6.669 -1.161 1.00 13.43 C ATOM 985 CG2 VAL C 64 -13.349 -6.813 0.488 1.00 64.34 C ATOM 0 H VAL C 64 -11.773 -7.989 1.972 1.00 10.23 H new ATOM 0 HA VAL C 64 -10.074 -5.835 0.898 1.00 63.34 H new ATOM 0 HB VAL C 64 -12.311 -5.042 -0.078 1.00 31.21 H new ATOM 0 HG11 VAL C 64 -12.202 -6.615 -1.966 1.00 13.43 H new ATOM 0 HG12 VAL C 64 -10.582 -6.100 -1.439 1.00 13.43 H new ATOM 0 HG13 VAL C 64 -11.194 -7.710 -0.990 1.00 13.43 H new ATOM 0 HG21 VAL C 64 -14.056 -6.757 -0.339 1.00 64.34 H new ATOM 0 HG22 VAL C 64 -13.125 -7.858 0.704 1.00 64.34 H new ATOM 0 HG23 VAL C 64 -13.785 -6.345 1.371 1.00 64.34 H new ATOM 995 N ASP C 65 -11.815 -5.781 3.535 1.00 63.42 N ATOM 996 CA ASP C 65 -12.258 -4.993 4.680 1.00 71.03 C ATOM 997 C ASP C 65 -11.280 -3.859 4.970 1.00 33.42 C ATOM 998 O ASP C 65 -10.170 -4.092 5.447 1.00 2.53 O ATOM 999 CB ASP C 65 -12.405 -5.885 5.914 1.00 21.00 C ATOM 1000 CG ASP C 65 -13.836 -6.333 6.137 1.00 13.21 C ATOM 1001 OD1 ASP C 65 -14.657 -6.185 5.208 1.00 32.44 O ATOM 1002 OD2 ASP C 65 -14.135 -6.832 7.242 1.00 14.33 O ATOM 0 H ASP C 65 -11.772 -6.786 3.706 1.00 63.42 H new ATOM 0 HA ASP C 65 -13.228 -4.559 4.438 1.00 71.03 H new ATOM 0 HB2 ASP C 65 -11.766 -6.761 5.804 1.00 21.00 H new ATOM 0 HB3 ASP C 65 -12.055 -5.344 6.793 1.00 21.00 H new ATOM 1007 N GLU C 66 -11.701 -2.632 4.677 1.00 74.41 N ATOM 1008 CA GLU C 66 -10.860 -1.463 4.905 1.00 12.01 C ATOM 1009 C GLU C 66 -10.904 -1.039 6.371 1.00 30.31 C ATOM 1010 O GLU C 66 -9.911 -0.562 6.920 1.00 44.54 O ATOM 1011 CB GLU C 66 -11.309 -0.303 4.014 1.00 63.23 C ATOM 1012 CG GLU C 66 -10.166 0.580 3.542 1.00 53.54 C ATOM 1013 CD GLU C 66 -10.583 2.026 3.357 1.00 34.52 C ATOM 1014 OE1 GLU C 66 -10.674 2.752 4.369 1.00 12.34 O ATOM 1015 OE2 GLU C 66 -10.819 2.431 2.200 1.00 35.11 O ATOM 0 H GLU C 66 -12.618 -2.422 4.282 1.00 74.41 H new ATOM 0 HA GLU C 66 -9.834 -1.730 4.652 1.00 12.01 H new ATOM 0 HB2 GLU C 66 -11.830 -0.704 3.145 1.00 63.23 H new ATOM 0 HB3 GLU C 66 -12.027 0.308 4.562 1.00 63.23 H new ATOM 0 HG2 GLU C 66 -9.351 0.530 4.265 1.00 53.54 H new ATOM 0 HG3 GLU C 66 -9.779 0.194 2.599 1.00 53.54 H new ATOM 1022 N ASP C 67 -12.062 -1.216 6.997 1.00 51.43 N ATOM 1023 CA ASP C 67 -12.236 -0.853 8.399 1.00 62.55 C ATOM 1024 C ASP C 67 -12.516 -2.088 9.250 1.00 3.51 C ATOM 1025 O ASP C 67 -12.527 -2.018 10.478 1.00 55.22 O ATOM 1026 CB ASP C 67 -13.378 0.154 8.548 1.00 11.22 C ATOM 1027 CG ASP C 67 -14.570 -0.188 7.677 1.00 75.01 C ATOM 1028 OD1 ASP C 67 -14.772 -1.388 7.392 1.00 52.34 O ATOM 1029 OD2 ASP C 67 -15.302 0.742 7.281 1.00 14.54 O ATOM 0 H ASP C 67 -12.894 -1.608 6.556 1.00 51.43 H new ATOM 0 HA ASP C 67 -11.310 -0.396 8.748 1.00 62.55 H new ATOM 0 HB2 ASP C 67 -13.693 0.190 9.591 1.00 11.22 H new ATOM 0 HB3 ASP C 67 -13.017 1.149 8.289 1.00 11.22 H new ATOM 1034 N GLY C 68 -12.743 -3.218 8.587 1.00 71.12 N ATOM 1035 CA GLY C 68 -13.021 -4.452 9.298 1.00 31.43 C ATOM 1036 C GLY C 68 -14.479 -4.579 9.690 1.00 71.42 C ATOM 1037 O GLY C 68 -14.819 -5.321 10.612 1.00 61.23 O ATOM 0 H GLY C 68 -12.739 -3.301 7.570 1.00 71.12 H new ATOM 0 HA2 GLY C 68 -12.741 -5.299 8.672 1.00 31.43 H new ATOM 0 HA3 GLY C 68 -12.402 -4.499 10.194 1.00 31.43 H new ATOM 1041 N SER C 69 -15.344 -3.853 8.990 1.00 63.15 N ATOM 1042 CA SER C 69 -16.774 -3.883 9.273 1.00 13.10 C ATOM 1043 C SER C 69 -17.408 -5.163 8.736 1.00 52.41 C ATOM 1044 O SER C 69 -18.578 -5.444 8.990 1.00 51.23 O ATOM 1045 CB SER C 69 -17.464 -2.663 8.659 1.00 31.14 C ATOM 1046 OG SER C 69 -17.112 -2.511 7.295 1.00 60.01 O ATOM 0 H SER C 69 -15.079 -3.236 8.222 1.00 63.15 H new ATOM 0 HA SER C 69 -16.905 -3.859 10.355 1.00 13.10 H new ATOM 0 HB2 SER C 69 -18.545 -2.769 8.749 1.00 31.14 H new ATOM 0 HB3 SER C 69 -17.184 -1.766 9.212 1.00 31.14 H new ATOM 0 HG SER C 69 -16.439 -1.804 7.208 1.00 60.01 H new ATOM 1052 N GLY C 70 -16.624 -5.936 7.990 1.00 60.51 N ATOM 1053 CA GLY C 70 -17.124 -7.177 7.428 1.00 4.43 C ATOM 1054 C GLY C 70 -18.071 -6.947 6.267 1.00 15.13 C ATOM 1055 O GLY C 70 -18.805 -7.851 5.865 1.00 23.54 O ATOM 0 H GLY C 70 -15.652 -5.725 7.765 1.00 60.51 H new ATOM 0 HA2 GLY C 70 -16.284 -7.785 7.093 1.00 4.43 H new ATOM 0 HA3 GLY C 70 -17.637 -7.743 8.205 1.00 4.43 H new ATOM 1059 N THR C 71 -18.058 -5.733 5.726 1.00 74.51 N ATOM 1060 CA THR C 71 -18.924 -5.385 4.607 1.00 13.11 C ATOM 1061 C THR C 71 -18.121 -4.804 3.449 1.00 25.53 C ATOM 1062 O THR C 71 -16.954 -4.444 3.609 1.00 60.14 O ATOM 1063 CB THR C 71 -20.006 -4.372 5.026 1.00 73.13 C ATOM 1064 OG1 THR C 71 -19.410 -3.092 5.267 1.00 62.11 O ATOM 1065 CG2 THR C 71 -20.732 -4.842 6.278 1.00 22.15 C ATOM 0 H THR C 71 -17.456 -4.974 6.045 1.00 74.51 H new ATOM 0 HA THR C 71 -19.407 -6.307 4.284 1.00 13.11 H new ATOM 0 HB THR C 71 -20.730 -4.290 4.215 1.00 73.13 H new ATOM 0 HG1 THR C 71 -19.845 -2.418 4.705 1.00 62.11 H new ATOM 0 HG21 THR C 71 -21.491 -4.110 6.555 1.00 22.15 H new ATOM 0 HG22 THR C 71 -21.208 -5.803 6.083 1.00 22.15 H new ATOM 0 HG23 THR C 71 -20.018 -4.950 7.094 1.00 22.15 H new ATOM 1073 N VAL C 72 -18.752 -4.714 2.283 1.00 75.04 N ATOM 1074 CA VAL C 72 -18.095 -4.174 1.098 1.00 54.22 C ATOM 1075 C VAL C 72 -18.553 -2.746 0.819 1.00 23.14 C ATOM 1076 O VAL C 72 -19.697 -2.516 0.427 1.00 52.43 O ATOM 1077 CB VAL C 72 -18.374 -5.042 -0.143 1.00 64.14 C ATOM 1078 CG1 VAL C 72 -17.689 -4.458 -1.369 1.00 52.14 C ATOM 1079 CG2 VAL C 72 -17.923 -6.475 0.098 1.00 21.21 C ATOM 0 H VAL C 72 -19.717 -5.008 2.133 1.00 75.04 H new ATOM 0 HA VAL C 72 -17.024 -4.177 1.301 1.00 54.22 H new ATOM 0 HB VAL C 72 -19.448 -5.049 -0.326 1.00 64.14 H new ATOM 0 HG11 VAL C 72 -17.898 -5.085 -2.236 1.00 52.14 H new ATOM 0 HG12 VAL C 72 -18.065 -3.451 -1.551 1.00 52.14 H new ATOM 0 HG13 VAL C 72 -16.613 -4.419 -1.200 1.00 52.14 H new ATOM 0 HG21 VAL C 72 -18.127 -7.075 -0.789 1.00 21.21 H new ATOM 0 HG22 VAL C 72 -16.853 -6.489 0.307 1.00 21.21 H new ATOM 0 HG23 VAL C 72 -18.465 -6.889 0.949 1.00 21.21 H new ATOM 1089 N ASP C 73 -17.652 -1.792 1.023 1.00 22.25 N ATOM 1090 CA ASP C 73 -17.962 -0.386 0.791 1.00 54.30 C ATOM 1091 C ASP C 73 -17.733 -0.012 -0.670 1.00 32.14 C ATOM 1092 O ASP C 73 -17.197 -0.802 -1.447 1.00 73.33 O ATOM 1093 CB ASP C 73 -17.108 0.503 1.698 1.00 34.45 C ATOM 1094 CG ASP C 73 -17.775 1.829 2.003 1.00 35.20 C ATOM 1095 OD1 ASP C 73 -18.989 1.957 1.738 1.00 11.44 O ATOM 1096 OD2 ASP C 73 -17.084 2.740 2.506 1.00 42.12 O ATOM 0 H ASP C 73 -16.701 -1.966 1.348 1.00 22.25 H new ATOM 0 HA ASP C 73 -19.014 -0.228 1.027 1.00 54.30 H new ATOM 0 HB2 ASP C 73 -16.907 -0.022 2.632 1.00 34.45 H new ATOM 0 HB3 ASP C 73 -16.145 0.685 1.221 1.00 34.45 H new ATOM 1101 N PHE C 74 -18.144 1.197 -1.038 1.00 63.21 N ATOM 1102 CA PHE C 74 -17.986 1.675 -2.406 1.00 13.25 C ATOM 1103 C PHE C 74 -16.532 1.562 -2.857 1.00 52.45 C ATOM 1104 O PHE C 74 -16.249 1.413 -4.046 1.00 65.14 O ATOM 1105 CB PHE C 74 -18.455 3.127 -2.519 1.00 24.44 C ATOM 1106 CG PHE C 74 -17.960 4.006 -1.407 1.00 14.40 C ATOM 1107 CD1 PHE C 74 -16.676 4.525 -1.437 1.00 24.40 C ATOM 1108 CD2 PHE C 74 -18.778 4.312 -0.331 1.00 32.30 C ATOM 1109 CE1 PHE C 74 -16.216 5.335 -0.415 1.00 74.20 C ATOM 1110 CE2 PHE C 74 -18.324 5.121 0.693 1.00 41.42 C ATOM 1111 CZ PHE C 74 -17.041 5.632 0.652 1.00 65.45 C ATOM 0 H PHE C 74 -18.589 1.864 -0.407 1.00 63.21 H new ATOM 0 HA PHE C 74 -18.600 1.051 -3.056 1.00 13.25 H new ATOM 0 HB2 PHE C 74 -18.118 3.536 -3.472 1.00 24.44 H new ATOM 0 HB3 PHE C 74 -19.545 3.148 -2.530 1.00 24.44 H new ATOM 0 HD1 PHE C 74 -16.026 4.294 -2.268 1.00 24.40 H new ATOM 0 HD2 PHE C 74 -19.781 3.914 -0.292 1.00 32.30 H new ATOM 0 HE1 PHE C 74 -15.213 5.735 -0.451 1.00 74.20 H new ATOM 0 HE2 PHE C 74 -18.972 5.354 1.525 1.00 41.42 H new ATOM 0 HZ PHE C 74 -16.684 6.263 1.453 1.00 65.45 H new ATOM 1121 N ASP C 75 -15.615 1.634 -1.899 1.00 12.54 N ATOM 1122 CA ASP C 75 -14.190 1.540 -2.196 1.00 20.24 C ATOM 1123 C ASP C 75 -13.727 0.087 -2.181 1.00 65.51 C ATOM 1124 O ASP C 75 -12.962 -0.339 -3.045 1.00 34.13 O ATOM 1125 CB ASP C 75 -13.382 2.356 -1.186 1.00 54.21 C ATOM 1126 CG ASP C 75 -12.034 2.782 -1.732 1.00 60.43 C ATOM 1127 OD1 ASP C 75 -12.002 3.674 -2.607 1.00 44.32 O ATOM 1128 OD2 ASP C 75 -11.010 2.225 -1.285 1.00 51.45 O ATOM 0 H ASP C 75 -15.832 1.757 -0.910 1.00 12.54 H new ATOM 0 HA ASP C 75 -14.024 1.945 -3.194 1.00 20.24 H new ATOM 0 HB2 ASP C 75 -13.951 3.241 -0.900 1.00 54.21 H new ATOM 0 HB3 ASP C 75 -13.234 1.766 -0.282 1.00 54.21 H new ATOM 1133 N GLU C 76 -14.195 -0.668 -1.192 1.00 2.11 N ATOM 1134 CA GLU C 76 -13.827 -2.073 -1.064 1.00 54.35 C ATOM 1135 C GLU C 76 -14.287 -2.869 -2.282 1.00 73.43 C ATOM 1136 O GLU C 76 -13.771 -3.952 -2.560 1.00 72.12 O ATOM 1137 CB GLU C 76 -14.434 -2.669 0.208 1.00 61.51 C ATOM 1138 CG GLU C 76 -14.218 -1.813 1.444 1.00 61.32 C ATOM 1139 CD GLU C 76 -14.686 -2.496 2.715 1.00 42.14 C ATOM 1140 OE1 GLU C 76 -14.589 -3.738 2.792 1.00 41.32 O ATOM 1141 OE2 GLU C 76 -15.150 -1.786 3.633 1.00 15.04 O ATOM 0 H GLU C 76 -14.829 -0.330 -0.468 1.00 2.11 H new ATOM 0 HA GLU C 76 -12.740 -2.133 -1.001 1.00 54.35 H new ATOM 0 HB2 GLU C 76 -15.504 -2.812 0.058 1.00 61.51 H new ATOM 0 HB3 GLU C 76 -14.002 -3.655 0.379 1.00 61.51 H new ATOM 0 HG2 GLU C 76 -13.159 -1.572 1.534 1.00 61.32 H new ATOM 0 HG3 GLU C 76 -14.751 -0.869 1.326 1.00 61.32 H new ATOM 1148 N TRP C 77 -15.260 -2.325 -3.003 1.00 53.33 N ATOM 1149 CA TRP C 77 -15.790 -2.984 -4.192 1.00 41.02 C ATOM 1150 C TRP C 77 -14.849 -2.808 -5.378 1.00 4.14 C ATOM 1151 O TRP C 77 -14.682 -3.717 -6.192 1.00 50.24 O ATOM 1152 CB TRP C 77 -17.173 -2.427 -4.534 1.00 45.54 C ATOM 1153 CG TRP C 77 -17.818 -3.115 -5.699 1.00 3.01 C ATOM 1154 CD1 TRP C 77 -18.032 -2.594 -6.943 1.00 24.34 C ATOM 1155 CD2 TRP C 77 -18.334 -4.450 -5.728 1.00 23.04 C ATOM 1156 NE1 TRP C 77 -18.650 -3.524 -7.743 1.00 11.20 N ATOM 1157 CE2 TRP C 77 -18.846 -4.672 -7.021 1.00 14.05 C ATOM 1158 CE3 TRP C 77 -18.413 -5.481 -4.787 1.00 51.51 C ATOM 1159 CZ2 TRP C 77 -19.428 -5.880 -7.395 1.00 73.54 C ATOM 1160 CZ3 TRP C 77 -18.990 -6.680 -5.159 1.00 34.22 C ATOM 1161 CH2 TRP C 77 -19.491 -6.872 -6.454 1.00 33.14 C ATOM 0 H TRP C 77 -15.698 -1.430 -2.786 1.00 53.33 H new ATOM 0 HA TRP C 77 -15.878 -4.049 -3.978 1.00 41.02 H new ATOM 0 HB2 TRP C 77 -17.820 -2.520 -3.662 1.00 45.54 H new ATOM 0 HB3 TRP C 77 -17.084 -1.363 -4.753 1.00 45.54 H new ATOM 0 HD1 TRP C 77 -17.756 -1.597 -7.253 1.00 24.34 H new ATOM 0 HE1 TRP C 77 -18.919 -3.383 -8.717 1.00 11.20 H new ATOM 0 HE3 TRP C 77 -18.030 -5.343 -3.787 1.00 51.51 H new ATOM 0 HZ2 TRP C 77 -19.816 -6.029 -8.392 1.00 73.54 H new ATOM 0 HZ3 TRP C 77 -19.056 -7.483 -4.440 1.00 34.22 H new ATOM 0 HH2 TRP C 77 -19.935 -7.821 -6.714 1.00 33.14 H new ATOM 1172 N LEU C 78 -14.235 -1.633 -5.471 1.00 71.42 N ATOM 1173 CA LEU C 78 -13.309 -1.338 -6.559 1.00 34.31 C ATOM 1174 C LEU C 78 -12.039 -2.173 -6.435 1.00 72.12 C ATOM 1175 O LEU C 78 -11.452 -2.583 -7.437 1.00 2.43 O ATOM 1176 CB LEU C 78 -12.956 0.151 -6.565 1.00 65.13 C ATOM 1177 CG LEU C 78 -13.785 1.033 -7.499 1.00 65.20 C ATOM 1178 CD1 LEU C 78 -13.396 2.495 -7.336 1.00 31.23 C ATOM 1179 CD2 LEU C 78 -13.610 0.591 -8.945 1.00 42.01 C ATOM 0 H LEU C 78 -14.362 -0.870 -4.806 1.00 71.42 H new ATOM 0 HA LEU C 78 -13.799 -1.593 -7.499 1.00 34.31 H new ATOM 0 HB2 LEU C 78 -13.060 0.533 -5.549 1.00 65.13 H new ATOM 0 HB3 LEU C 78 -11.906 0.254 -6.838 1.00 65.13 H new ATOM 0 HG LEU C 78 -14.836 0.925 -7.232 1.00 65.20 H new ATOM 0 HD11 LEU C 78 -13.996 3.108 -8.008 1.00 31.23 H new ATOM 0 HD12 LEU C 78 -13.573 2.806 -6.306 1.00 31.23 H new ATOM 0 HD13 LEU C 78 -12.340 2.620 -7.576 1.00 31.23 H new ATOM 0 HD21 LEU C 78 -14.207 1.230 -9.596 1.00 42.01 H new ATOM 0 HD22 LEU C 78 -12.559 0.669 -9.225 1.00 42.01 H new ATOM 0 HD23 LEU C 78 -13.938 -0.443 -9.052 1.00 42.01 H new ATOM 1191 N VAL C 79 -11.620 -2.424 -5.198 1.00 25.40 N ATOM 1192 CA VAL C 79 -10.421 -3.213 -4.943 1.00 53.42 C ATOM 1193 C VAL C 79 -10.692 -4.701 -5.132 1.00 21.21 C ATOM 1194 O VAL C 79 -9.782 -5.476 -5.424 1.00 50.52 O ATOM 1195 CB VAL C 79 -9.888 -2.977 -3.517 1.00 24.14 C ATOM 1196 CG1 VAL C 79 -10.941 -3.349 -2.484 1.00 32.45 C ATOM 1197 CG2 VAL C 79 -8.606 -3.765 -3.291 1.00 2.44 C ATOM 0 H VAL C 79 -12.093 -2.092 -4.358 1.00 25.40 H new ATOM 0 HA VAL C 79 -9.669 -2.889 -5.663 1.00 53.42 H new ATOM 0 HB VAL C 79 -9.661 -1.917 -3.403 1.00 24.14 H new ATOM 0 HG11 VAL C 79 -10.546 -3.175 -1.483 1.00 32.45 H new ATOM 0 HG12 VAL C 79 -11.830 -2.737 -2.634 1.00 32.45 H new ATOM 0 HG13 VAL C 79 -11.202 -4.402 -2.594 1.00 32.45 H new ATOM 0 HG21 VAL C 79 -8.243 -3.587 -2.279 1.00 2.44 H new ATOM 0 HG22 VAL C 79 -8.805 -4.829 -3.423 1.00 2.44 H new ATOM 0 HG23 VAL C 79 -7.851 -3.445 -4.009 1.00 2.44 H new ATOM 1207 N MET C 80 -11.951 -5.094 -4.965 1.00 22.22 N ATOM 1208 CA MET C 80 -12.342 -6.490 -5.120 1.00 71.44 C ATOM 1209 C MET C 80 -11.938 -7.019 -6.492 1.00 32.52 C ATOM 1210 O MET C 80 -11.647 -8.204 -6.649 1.00 5.50 O ATOM 1211 CB MET C 80 -13.852 -6.643 -4.925 1.00 45.32 C ATOM 1212 CG MET C 80 -14.375 -8.023 -5.290 1.00 54.41 C ATOM 1213 SD MET C 80 -16.002 -8.357 -4.590 1.00 21.42 S ATOM 1214 CE MET C 80 -16.809 -9.158 -5.974 1.00 52.34 C ATOM 0 H MET C 80 -12.717 -4.466 -4.723 1.00 22.22 H new ATOM 0 HA MET C 80 -11.824 -7.073 -4.359 1.00 71.44 H new ATOM 0 HB2 MET C 80 -14.099 -6.433 -3.884 1.00 45.32 H new ATOM 0 HB3 MET C 80 -14.366 -5.897 -5.531 1.00 45.32 H new ATOM 0 HG2 MET C 80 -14.425 -8.113 -6.375 1.00 54.41 H new ATOM 0 HG3 MET C 80 -13.671 -8.778 -4.940 1.00 54.41 H new ATOM 0 HE1 MET C 80 -17.883 -9.202 -5.793 1.00 52.34 H new ATOM 0 HE2 MET C 80 -16.617 -8.591 -6.885 1.00 52.34 H new ATOM 0 HE3 MET C 80 -16.419 -10.169 -6.087 1.00 52.34 H new ATOM 1224 N MET C 81 -11.924 -6.133 -7.482 1.00 52.31 N ATOM 1225 CA MET C 81 -11.554 -6.512 -8.841 1.00 53.33 C ATOM 1226 C MET C 81 -10.078 -6.887 -8.919 1.00 51.12 C ATOM 1227 O MET C 81 -9.728 -7.982 -9.360 1.00 75.44 O ATOM 1228 CB MET C 81 -11.853 -5.367 -9.812 1.00 71.21 C ATOM 1229 CG MET C 81 -13.310 -5.298 -10.239 1.00 11.22 C ATOM 1230 SD MET C 81 -14.277 -4.162 -9.226 1.00 50.35 S ATOM 1231 CE MET C 81 -15.479 -5.283 -8.514 1.00 72.13 C ATOM 0 H MET C 81 -12.164 -5.148 -7.369 1.00 52.31 H new ATOM 0 HA MET C 81 -12.147 -7.382 -9.122 1.00 53.33 H new ATOM 0 HB2 MET C 81 -11.575 -4.423 -9.344 1.00 71.21 H new ATOM 0 HB3 MET C 81 -11.228 -5.480 -10.698 1.00 71.21 H new ATOM 0 HG2 MET C 81 -13.365 -4.985 -11.282 1.00 11.22 H new ATOM 0 HG3 MET C 81 -13.749 -6.294 -10.181 1.00 11.22 H new ATOM 0 HE1 MET C 81 -16.195 -4.718 -7.917 1.00 72.13 H new ATOM 0 HE2 MET C 81 -16.006 -5.806 -9.312 1.00 72.13 H new ATOM 0 HE3 MET C 81 -14.969 -6.008 -7.879 1.00 72.13 H new ATOM 1241 N VAL C 82 -9.216 -5.972 -8.487 1.00 72.43 N ATOM 1242 CA VAL C 82 -7.777 -6.208 -8.507 1.00 72.52 C ATOM 1243 C VAL C 82 -7.389 -7.324 -7.542 1.00 70.32 C ATOM 1244 O VAL C 82 -6.475 -8.102 -7.813 1.00 1.43 O ATOM 1245 CB VAL C 82 -6.994 -4.933 -8.141 1.00 50.44 C ATOM 1246 CG1 VAL C 82 -7.442 -4.401 -6.788 1.00 44.34 C ATOM 1247 CG2 VAL C 82 -5.498 -5.207 -8.146 1.00 22.13 C ATOM 0 H VAL C 82 -9.489 -5.061 -8.119 1.00 72.43 H new ATOM 0 HA VAL C 82 -7.519 -6.505 -9.524 1.00 72.52 H new ATOM 0 HB VAL C 82 -7.203 -4.171 -8.892 1.00 50.44 H new ATOM 0 HG11 VAL C 82 -6.878 -3.500 -6.546 1.00 44.34 H new ATOM 0 HG12 VAL C 82 -8.505 -4.164 -6.824 1.00 44.34 H new ATOM 0 HG13 VAL C 82 -7.264 -5.157 -6.023 1.00 44.34 H new ATOM 0 HG21 VAL C 82 -4.960 -4.295 -7.885 1.00 22.13 H new ATOM 0 HG22 VAL C 82 -5.268 -5.985 -7.418 1.00 22.13 H new ATOM 0 HG23 VAL C 82 -5.192 -5.537 -9.139 1.00 22.13 H new ATOM 1257 N ARG C 83 -8.092 -7.395 -6.416 1.00 52.35 N ATOM 1258 CA ARG C 83 -7.821 -8.415 -5.410 1.00 1.30 C ATOM 1259 C ARG C 83 -7.878 -9.811 -6.023 1.00 24.53 C ATOM 1260 O ARG C 83 -7.110 -10.697 -5.647 1.00 24.11 O ATOM 1261 CB ARG C 83 -8.826 -8.309 -4.262 1.00 52.41 C ATOM 1262 CG ARG C 83 -8.507 -7.199 -3.274 1.00 33.24 C ATOM 1263 CD ARG C 83 -7.292 -7.541 -2.426 1.00 62.24 C ATOM 1264 NE ARG C 83 -7.439 -8.828 -1.752 1.00 12.34 N ATOM 1265 CZ ARG C 83 -6.428 -9.486 -1.195 1.00 11.02 C ATOM 1266 NH1 ARG C 83 -5.204 -8.979 -1.230 1.00 42.14 N ATOM 1267 NH2 ARG C 83 -6.642 -10.653 -0.600 1.00 73.24 N ATOM 0 H ARG C 83 -8.853 -6.759 -6.178 1.00 52.35 H new ATOM 0 HA ARG C 83 -6.817 -8.248 -5.021 1.00 1.30 H new ATOM 0 HB2 ARG C 83 -9.821 -8.141 -4.675 1.00 52.41 H new ATOM 0 HB3 ARG C 83 -8.858 -9.260 -3.730 1.00 52.41 H new ATOM 0 HG2 ARG C 83 -8.325 -6.270 -3.815 1.00 33.24 H new ATOM 0 HG3 ARG C 83 -9.367 -7.028 -2.627 1.00 33.24 H new ATOM 0 HD2 ARG C 83 -6.404 -7.562 -3.057 1.00 62.24 H new ATOM 0 HD3 ARG C 83 -7.137 -6.759 -1.683 1.00 62.24 H new ATOM 0 HE ARG C 83 -8.369 -9.245 -1.706 1.00 12.34 H new ATOM 0 HH11 ARG C 83 -5.036 -8.082 -1.685 1.00 42.14 H new ATOM 0 HH12 ARG C 83 -4.430 -9.486 -0.802 1.00 42.14 H new ATOM 0 HH21 ARG C 83 -7.583 -11.045 -0.570 1.00 73.24 H new ATOM 0 HH22 ARG C 83 -5.865 -11.158 -0.173 1.00 73.24 H new ATOM 1281 N CYS C 84 -8.792 -10.000 -6.968 1.00 15.42 N ATOM 1282 CA CYS C 84 -8.951 -11.289 -7.632 1.00 52.43 C ATOM 1283 C CYS C 84 -7.845 -11.511 -8.659 1.00 1.51 C ATOM 1284 O CYS C 84 -7.381 -12.634 -8.853 1.00 62.25 O ATOM 1285 CB CYS C 84 -10.319 -11.372 -8.311 1.00 24.32 C ATOM 1286 SG CYS C 84 -10.850 -13.056 -8.700 1.00 63.50 S ATOM 0 H CYS C 84 -9.434 -9.277 -7.292 1.00 15.42 H new ATOM 0 HA CYS C 84 -8.882 -12.071 -6.875 1.00 52.43 H new ATOM 0 HB2 CYS C 84 -11.063 -10.909 -7.663 1.00 24.32 H new ATOM 0 HB3 CYS C 84 -10.291 -10.789 -9.232 1.00 24.32 H new ATOM 0 HG CYS C 84 -12.018 -13.022 -9.270 1.00 63.50 H new ATOM 1292 N MET C 85 -7.430 -10.433 -9.316 1.00 33.34 N ATOM 1293 CA MET C 85 -6.379 -10.510 -10.324 1.00 73.12 C ATOM 1294 C MET C 85 -5.016 -10.722 -9.673 1.00 32.30 C ATOM 1295 O MET C 85 -4.100 -11.268 -10.289 1.00 62.35 O ATOM 1296 CB MET C 85 -6.361 -9.236 -11.171 1.00 22.01 C ATOM 1297 CG MET C 85 -7.747 -8.715 -11.515 1.00 74.32 C ATOM 1298 SD MET C 85 -7.866 -8.129 -13.216 1.00 74.21 S ATOM 1299 CE MET C 85 -7.528 -6.384 -12.997 1.00 23.40 C ATOM 0 H MET C 85 -7.805 -9.496 -9.169 1.00 33.34 H new ATOM 0 HA MET C 85 -6.590 -11.363 -10.969 1.00 73.12 H new ATOM 0 HB2 MET C 85 -5.813 -8.461 -10.635 1.00 22.01 H new ATOM 0 HB3 MET C 85 -5.816 -9.431 -12.094 1.00 22.01 H new ATOM 0 HG2 MET C 85 -8.479 -9.507 -11.356 1.00 74.32 H new ATOM 0 HG3 MET C 85 -8.004 -7.902 -10.836 1.00 74.32 H new ATOM 0 HE1 MET C 85 -7.566 -5.882 -13.964 1.00 23.40 H new ATOM 0 HE2 MET C 85 -8.275 -5.949 -12.333 1.00 23.40 H new ATOM 0 HE3 MET C 85 -6.537 -6.257 -12.561 1.00 23.40 H new ATOM 1309 N LYS C 86 -4.887 -10.285 -8.425 1.00 53.11 N ATOM 1310 CA LYS C 86 -3.636 -10.427 -7.689 1.00 51.42 C ATOM 1311 C LYS C 86 -3.861 -11.159 -6.370 1.00 75.41 C ATOM 1312 O LYS C 86 -3.280 -10.803 -5.345 1.00 11.15 O ATOM 1313 CB LYS C 86 -3.018 -9.053 -7.423 1.00 4.40 C ATOM 1314 CG LYS C 86 -3.083 -8.116 -8.617 1.00 12.34 C ATOM 1315 CD LYS C 86 -2.205 -8.603 -9.757 1.00 72.52 C ATOM 1316 CE LYS C 86 -2.066 -7.548 -10.844 1.00 22.31 C ATOM 1317 NZ LYS C 86 -0.862 -6.696 -10.639 1.00 21.32 N ATOM 0 H LYS C 86 -5.634 -9.829 -7.901 1.00 53.11 H new ATOM 0 HA LYS C 86 -2.950 -11.015 -8.298 1.00 51.42 H new ATOM 0 HB2 LYS C 86 -3.531 -8.590 -6.580 1.00 4.40 H new ATOM 0 HB3 LYS C 86 -1.976 -9.183 -7.130 1.00 4.40 H new ATOM 0 HG2 LYS C 86 -4.114 -8.034 -8.960 1.00 12.34 H new ATOM 0 HG3 LYS C 86 -2.767 -7.118 -8.315 1.00 12.34 H new ATOM 0 HD2 LYS C 86 -1.219 -8.863 -9.373 1.00 72.52 H new ATOM 0 HD3 LYS C 86 -2.631 -9.512 -10.183 1.00 72.52 H new ATOM 0 HE2 LYS C 86 -2.005 -8.035 -11.817 1.00 22.31 H new ATOM 0 HE3 LYS C 86 -2.957 -6.920 -10.857 1.00 22.31 H new ATOM 0 HZ1 LYS C 86 -1.155 -5.706 -10.514 1.00 21.32 H new ATOM 0 HZ2 LYS C 86 -0.351 -7.016 -9.792 1.00 21.32 H new ATOM 0 HZ3 LYS C 86 -0.239 -6.770 -11.468 1.00 21.32 H new ATOM 1331 N ASP C 87 -4.705 -12.184 -6.404 1.00 35.33 N ATOM 1332 CA ASP C 87 -5.005 -12.968 -5.211 1.00 31.25 C ATOM 1333 C ASP C 87 -3.721 -13.440 -4.535 1.00 51.33 C ATOM 1334 O ASP C 87 -2.637 -13.354 -5.111 1.00 54.12 O ATOM 1335 CB ASP C 87 -5.879 -14.170 -5.571 1.00 34.44 C ATOM 1336 CG ASP C 87 -7.358 -13.838 -5.552 1.00 62.14 C ATOM 1337 OD1 ASP C 87 -7.811 -13.210 -4.572 1.00 74.33 O ATOM 1338 OD2 ASP C 87 -8.062 -14.206 -6.516 1.00 52.42 O ATOM 0 H ASP C 87 -5.194 -12.492 -7.245 1.00 35.33 H new ATOM 0 HA ASP C 87 -5.548 -12.330 -4.514 1.00 31.25 H new ATOM 0 HB2 ASP C 87 -5.604 -14.532 -6.562 1.00 34.44 H new ATOM 0 HB3 ASP C 87 -5.683 -14.981 -4.870 1.00 34.44 H new ATOM 1343 N ASP C 88 -3.853 -13.939 -3.311 1.00 11.13 N ATOM 1344 CA ASP C 88 -2.703 -14.425 -2.556 1.00 72.42 C ATOM 1345 C ASP C 88 -1.499 -13.509 -2.750 1.00 72.12 C ATOM 1346 O ASP C 88 -0.505 -13.896 -3.365 1.00 10.03 O ATOM 1347 CB ASP C 88 -2.351 -15.850 -2.985 1.00 2.43 C ATOM 1348 CG ASP C 88 -2.123 -15.966 -4.479 1.00 44.43 C ATOM 1349 OD1 ASP C 88 -3.119 -16.079 -5.223 1.00 50.42 O ATOM 1350 OD2 ASP C 88 -0.949 -15.944 -4.904 1.00 31.14 O ATOM 0 H ASP C 88 -4.744 -14.018 -2.820 1.00 11.13 H new ATOM 0 HA ASP C 88 -2.967 -14.427 -1.499 1.00 72.42 H new ATOM 0 HB2 ASP C 88 -1.454 -16.174 -2.457 1.00 2.43 H new ATOM 0 HB3 ASP C 88 -3.155 -16.524 -2.690 1.00 2.43 H new ATOM 1355 N SER C 89 -1.595 -12.293 -2.223 1.00 14.12 N ATOM 1356 CA SER C 89 -0.515 -11.321 -2.342 1.00 32.23 C ATOM 1357 C SER C 89 0.266 -11.213 -1.036 1.00 71.13 C ATOM 1358 O SER C 89 -0.346 -11.141 0.029 1.00 0.24 O ATOM 1359 CB SER C 89 -1.075 -9.951 -2.730 1.00 1.32 C ATOM 1360 OG SER C 89 -0.225 -8.908 -2.284 1.00 31.14 O ATOM 0 H SER C 89 -2.410 -11.957 -1.709 1.00 14.12 H new ATOM 0 HA SER C 89 0.164 -11.663 -3.123 1.00 32.23 H new ATOM 0 HB2 SER C 89 -1.188 -9.894 -3.813 1.00 1.32 H new ATOM 0 HB3 SER C 89 -2.068 -9.825 -2.298 1.00 1.32 H new ATOM 0 HG SER C 89 -0.604 -8.043 -2.545 1.00 31.14 H new TER 1366 SER C 89 ATOM 1367 N ARG I 144 -3.754 -6.605 -15.796 1.00 0.24 N ATOM 1368 CA ARG I 144 -3.594 -5.157 -15.850 1.00 51.14 C ATOM 1369 C ARG I 144 -4.462 -4.555 -16.952 1.00 32.44 C ATOM 1370 O ARG I 144 -5.430 -3.846 -16.675 1.00 40.13 O ATOM 1371 CB ARG I 144 -2.127 -4.792 -16.085 1.00 41.11 C ATOM 1372 CG ARG I 144 -1.813 -3.329 -15.818 1.00 12.50 C ATOM 1373 CD ARG I 144 -1.676 -3.051 -14.329 1.00 1.20 C ATOM 1374 NE ARG I 144 -0.346 -3.387 -13.830 1.00 34.12 N ATOM 1375 CZ ARG I 144 0.741 -2.670 -14.094 1.00 61.44 C ATOM 1376 NH1 ARG I 144 0.655 -1.583 -14.848 1.00 32.33 N ATOM 1377 NH2 ARG I 144 1.917 -3.040 -13.603 1.00 53.25 N ATOM 0 HA ARG I 144 -3.914 -4.746 -14.893 1.00 51.14 H new ATOM 0 HB2 ARG I 144 -1.500 -5.412 -15.444 1.00 41.11 H new ATOM 0 HB3 ARG I 144 -1.863 -5.029 -17.116 1.00 41.11 H new ATOM 0 HG2 ARG I 144 -0.889 -3.055 -16.327 1.00 12.50 H new ATOM 0 HG3 ARG I 144 -2.603 -2.704 -16.235 1.00 12.50 H new ATOM 0 HD2 ARG I 144 -1.880 -1.998 -14.137 1.00 1.20 H new ATOM 0 HD3 ARG I 144 -2.424 -3.625 -13.783 1.00 1.20 H new ATOM 0 HE ARG I 144 -0.246 -4.218 -13.247 1.00 34.12 H new ATOM 0 HH11 ARG I 144 -0.247 -1.295 -15.227 1.00 32.33 H new ATOM 0 HH12 ARG I 144 1.491 -1.034 -15.049 1.00 32.33 H new ATOM 0 HH21 ARG I 144 1.987 -3.876 -13.022 1.00 53.25 H new ATOM 0 HH22 ARG I 144 2.751 -2.489 -13.806 1.00 53.25 H new ATOM 1391 N ARG I 145 -4.108 -4.842 -18.200 1.00 52.33 N ATOM 1392 CA ARG I 145 -4.852 -4.328 -19.343 1.00 14.21 C ATOM 1393 C ARG I 145 -6.092 -5.176 -19.610 1.00 0.54 C ATOM 1394 O ARG I 145 -7.154 -4.654 -19.949 1.00 72.42 O ATOM 1395 CB ARG I 145 -3.963 -4.299 -20.587 1.00 60.41 C ATOM 1396 CG ARG I 145 -4.605 -3.608 -21.779 1.00 75.30 C ATOM 1397 CD ARG I 145 -4.000 -4.083 -23.091 1.00 45.53 C ATOM 1398 NE ARG I 145 -2.850 -3.275 -23.488 1.00 22.32 N ATOM 1399 CZ ARG I 145 -1.928 -3.684 -24.351 1.00 2.14 C ATOM 1400 NH1 ARG I 145 -2.019 -4.885 -24.905 1.00 43.50 N ATOM 1401 NH2 ARG I 145 -0.910 -2.891 -24.662 1.00 52.53 N ATOM 0 H ARG I 145 -3.310 -5.428 -18.445 1.00 52.33 H new ATOM 0 HA ARG I 145 -5.171 -3.312 -19.110 1.00 14.21 H new ATOM 0 HB2 ARG I 145 -3.029 -3.792 -20.344 1.00 60.41 H new ATOM 0 HB3 ARG I 145 -3.708 -5.322 -20.865 1.00 60.41 H new ATOM 0 HG2 ARG I 145 -5.677 -3.803 -21.780 1.00 75.30 H new ATOM 0 HG3 ARG I 145 -4.477 -2.529 -21.688 1.00 75.30 H new ATOM 0 HD2 ARG I 145 -3.695 -5.125 -22.993 1.00 45.53 H new ATOM 0 HD3 ARG I 145 -4.757 -4.045 -23.874 1.00 45.53 H new ATOM 0 HE ARG I 145 -2.750 -2.346 -23.080 1.00 22.32 H new ATOM 0 HH11 ARG I 145 -2.799 -5.498 -24.669 1.00 43.50 H new ATOM 0 HH12 ARG I 145 -1.309 -5.196 -25.568 1.00 43.50 H new ATOM 0 HH21 ARG I 145 -0.836 -1.966 -24.238 1.00 52.53 H new ATOM 0 HH22 ARG I 145 -0.202 -3.206 -25.325 1.00 52.53 H new ATOM 1415 N VAL I 146 -5.949 -6.489 -19.456 1.00 24.35 N ATOM 1416 CA VAL I 146 -7.057 -7.410 -19.680 1.00 31.23 C ATOM 1417 C VAL I 146 -7.725 -7.797 -18.365 1.00 71.22 C ATOM 1418 O VAL I 146 -7.229 -8.654 -17.633 1.00 75.21 O ATOM 1419 CB VAL I 146 -6.587 -8.688 -20.399 1.00 22.15 C ATOM 1420 CG1 VAL I 146 -7.760 -9.624 -20.647 1.00 74.44 C ATOM 1421 CG2 VAL I 146 -5.888 -8.338 -21.705 1.00 74.24 C ATOM 0 H VAL I 146 -5.077 -6.938 -19.177 1.00 24.35 H new ATOM 0 HA VAL I 146 -7.778 -6.890 -20.311 1.00 31.23 H new ATOM 0 HB VAL I 146 -5.872 -9.203 -19.757 1.00 22.15 H new ATOM 0 HG11 VAL I 146 -7.408 -10.521 -21.156 1.00 74.44 H new ATOM 0 HG12 VAL I 146 -8.212 -9.901 -19.695 1.00 74.44 H new ATOM 0 HG13 VAL I 146 -8.501 -9.122 -21.268 1.00 74.44 H new ATOM 0 HG21 VAL I 146 -5.562 -9.253 -22.200 1.00 74.24 H new ATOM 0 HG22 VAL I 146 -6.579 -7.800 -22.354 1.00 74.24 H new ATOM 0 HG23 VAL I 146 -5.022 -7.710 -21.497 1.00 74.24 H new ATOM 1431 N ARG I 147 -8.853 -7.159 -18.071 1.00 45.34 N ATOM 1432 CA ARG I 147 -9.589 -7.435 -16.843 1.00 22.13 C ATOM 1433 C ARG I 147 -10.323 -8.770 -16.938 1.00 53.11 C ATOM 1434 O ARG I 147 -10.822 -9.140 -18.001 1.00 30.32 O ATOM 1435 CB ARG I 147 -10.587 -6.311 -16.558 1.00 63.45 C ATOM 1436 CG ARG I 147 -9.929 -4.973 -16.264 1.00 70.21 C ATOM 1437 CD ARG I 147 -9.661 -4.192 -17.540 1.00 42.11 C ATOM 1438 NE ARG I 147 -9.784 -2.751 -17.337 1.00 42.05 N ATOM 1439 CZ ARG I 147 -9.941 -1.880 -18.327 1.00 44.02 C ATOM 1440 NH1 ARG I 147 -9.995 -2.301 -19.583 1.00 63.54 N ATOM 1441 NH2 ARG I 147 -10.046 -0.584 -18.061 1.00 22.52 N ATOM 0 H ARG I 147 -9.277 -6.448 -18.666 1.00 45.34 H new ATOM 0 HA ARG I 147 -8.872 -7.491 -16.024 1.00 22.13 H new ATOM 0 HB2 ARG I 147 -11.250 -6.199 -17.416 1.00 63.45 H new ATOM 0 HB3 ARG I 147 -11.209 -6.595 -15.709 1.00 63.45 H new ATOM 0 HG2 ARG I 147 -10.571 -4.387 -15.606 1.00 70.21 H new ATOM 0 HG3 ARG I 147 -8.992 -5.136 -15.732 1.00 70.21 H new ATOM 0 HD2 ARG I 147 -8.659 -4.423 -17.902 1.00 42.11 H new ATOM 0 HD3 ARG I 147 -10.361 -4.510 -18.313 1.00 42.11 H new ATOM 0 HE ARG I 147 -9.747 -2.394 -16.382 1.00 42.05 H new ATOM 0 HH11 ARG I 147 -9.916 -3.296 -19.791 1.00 63.54 H new ATOM 0 HH12 ARG I 147 -10.116 -1.629 -20.341 1.00 63.54 H new ATOM 0 HH21 ARG I 147 -10.006 -0.257 -17.096 1.00 22.52 H new ATOM 0 HH22 ARG I 147 -10.167 0.085 -18.822 1.00 22.52 H new ATOM 1455 N ILE I 148 -10.384 -9.486 -15.821 1.00 40.31 N ATOM 1456 CA ILE I 148 -11.057 -10.779 -15.779 1.00 4.12 C ATOM 1457 C ILE I 148 -12.474 -10.679 -16.334 1.00 74.13 C ATOM 1458 O ILE I 148 -13.027 -9.587 -16.459 1.00 0.32 O ATOM 1459 CB ILE I 148 -11.118 -11.335 -14.344 1.00 25.13 C ATOM 1460 CG1 ILE I 148 -11.847 -10.354 -13.424 1.00 65.23 C ATOM 1461 CG2 ILE I 148 -9.715 -11.614 -13.824 1.00 15.24 C ATOM 1462 CD1 ILE I 148 -12.403 -10.998 -12.173 1.00 54.11 C ATOM 0 H ILE I 148 -9.976 -9.193 -14.933 1.00 40.31 H new ATOM 0 HA ILE I 148 -10.473 -11.459 -16.399 1.00 4.12 H new ATOM 0 HB ILE I 148 -11.673 -12.273 -14.357 1.00 25.13 H new ATOM 0 HG12 ILE I 148 -11.160 -9.557 -13.138 1.00 65.23 H new ATOM 0 HG13 ILE I 148 -12.663 -9.888 -13.977 1.00 65.23 H new ATOM 0 HG21 ILE I 148 -9.775 -12.006 -12.809 1.00 15.24 H new ATOM 0 HG22 ILE I 148 -9.227 -12.346 -14.468 1.00 15.24 H new ATOM 0 HG23 ILE I 148 -9.137 -10.690 -13.822 1.00 15.24 H new ATOM 0 HD11 ILE I 148 -12.906 -10.244 -11.568 1.00 54.11 H new ATOM 0 HD12 ILE I 148 -13.115 -11.776 -12.450 1.00 54.11 H new ATOM 0 HD13 ILE I 148 -11.589 -11.440 -11.598 1.00 54.11 H new ATOM 1474 N SER I 149 -13.056 -11.827 -16.664 1.00 43.00 N ATOM 1475 CA SER I 149 -14.409 -11.870 -17.207 1.00 34.24 C ATOM 1476 C SER I 149 -15.393 -11.178 -16.269 1.00 62.13 C ATOM 1477 O SER I 149 -15.788 -11.735 -15.246 1.00 14.23 O ATOM 1478 CB SER I 149 -14.842 -13.318 -17.441 1.00 33.35 C ATOM 1479 OG SER I 149 -14.170 -13.877 -18.557 1.00 23.43 O ATOM 0 H SER I 149 -12.612 -12.740 -16.565 1.00 43.00 H new ATOM 0 HA SER I 149 -14.408 -11.340 -18.160 1.00 34.24 H new ATOM 0 HB2 SER I 149 -14.632 -13.912 -16.551 1.00 33.35 H new ATOM 0 HB3 SER I 149 -15.919 -13.357 -17.604 1.00 33.35 H new ATOM 0 HG SER I 149 -14.463 -14.804 -18.685 1.00 23.43 H new ATOM 1485 N ALA I 150 -15.785 -9.960 -16.627 1.00 55.23 N ATOM 1486 CA ALA I 150 -16.725 -9.192 -15.820 1.00 52.33 C ATOM 1487 C ALA I 150 -18.003 -8.896 -16.597 1.00 14.35 C ATOM 1488 O ALA I 150 -19.078 -8.756 -16.013 1.00 11.22 O ATOM 1489 CB ALA I 150 -16.080 -7.896 -15.349 1.00 43.40 C ATOM 0 H ALA I 150 -15.466 -9.484 -17.471 1.00 55.23 H new ATOM 0 HA ALA I 150 -16.991 -9.791 -14.949 1.00 52.33 H new ATOM 0 HB1 ALA I 150 -16.793 -7.332 -14.747 1.00 43.40 H new ATOM 0 HB2 ALA I 150 -15.200 -8.125 -14.748 1.00 43.40 H new ATOM 0 HB3 ALA I 150 -15.785 -7.301 -16.213 1.00 43.40 H new ATOM 1495 N ASP I 151 -17.879 -8.803 -17.917 1.00 2.00 N ATOM 1496 CA ASP I 151 -19.025 -8.525 -18.774 1.00 30.22 C ATOM 1497 C ASP I 151 -20.153 -9.519 -18.515 1.00 11.20 C ATOM 1498 O ASP I 151 -21.321 -9.141 -18.439 1.00 72.22 O ATOM 1499 CB ASP I 151 -18.612 -8.576 -20.246 1.00 33.30 C ATOM 1500 CG ASP I 151 -17.908 -7.310 -20.694 1.00 23.15 C ATOM 1501 OD1 ASP I 151 -17.996 -6.295 -19.973 1.00 70.31 O ATOM 1502 OD2 ASP I 151 -17.267 -7.336 -21.766 1.00 12.23 O ATOM 0 H ASP I 151 -16.997 -8.916 -18.416 1.00 2.00 H new ATOM 0 HA ASP I 151 -19.387 -7.524 -18.540 1.00 30.22 H new ATOM 0 HB2 ASP I 151 -17.954 -9.430 -20.406 1.00 33.30 H new ATOM 0 HB3 ASP I 151 -19.496 -8.734 -20.863 1.00 33.30 H new ATOM 1507 N ALA I 152 -19.793 -10.792 -18.381 1.00 51.14 N ATOM 1508 CA ALA I 152 -20.774 -11.840 -18.129 1.00 71.23 C ATOM 1509 C ALA I 152 -21.622 -11.516 -16.904 1.00 71.43 C ATOM 1510 O ALA I 152 -22.776 -11.932 -16.809 1.00 60.31 O ATOM 1511 CB ALA I 152 -20.079 -13.182 -17.953 1.00 3.22 C ATOM 0 H ALA I 152 -18.830 -11.122 -18.443 1.00 51.14 H new ATOM 0 HA ALA I 152 -21.437 -11.897 -18.992 1.00 71.23 H new ATOM 0 HB1 ALA I 152 -20.824 -13.956 -17.765 1.00 3.22 H new ATOM 0 HB2 ALA I 152 -19.523 -13.425 -18.858 1.00 3.22 H new ATOM 0 HB3 ALA I 152 -19.392 -13.128 -17.109 1.00 3.22 H new ATOM 1517 N MET I 153 -21.042 -10.771 -15.969 1.00 62.25 N ATOM 1518 CA MET I 153 -21.745 -10.391 -14.749 1.00 11.42 C ATOM 1519 C MET I 153 -22.599 -9.148 -14.979 1.00 71.54 C ATOM 1520 O MET I 153 -23.599 -8.936 -14.295 1.00 35.34 O ATOM 1521 CB MET I 153 -20.748 -10.138 -13.617 1.00 65.44 C ATOM 1522 CG MET I 153 -20.157 -11.410 -13.032 1.00 60.12 C ATOM 1523 SD MET I 153 -18.525 -11.788 -13.698 1.00 65.03 S ATOM 1524 CE MET I 153 -17.474 -11.222 -12.362 1.00 1.52 C ATOM 0 H MET I 153 -20.087 -10.418 -16.033 1.00 62.25 H new ATOM 0 HA MET I 153 -22.401 -11.214 -14.466 1.00 11.42 H new ATOM 0 HB2 MET I 153 -19.939 -9.510 -13.990 1.00 65.44 H new ATOM 0 HB3 MET I 153 -21.245 -9.580 -12.824 1.00 65.44 H new ATOM 0 HG2 MET I 153 -20.089 -11.309 -11.949 1.00 60.12 H new ATOM 0 HG3 MET I 153 -20.829 -12.244 -13.233 1.00 60.12 H new ATOM 0 HE1 MET I 153 -16.429 -11.389 -12.625 1.00 1.52 H new ATOM 0 HE2 MET I 153 -17.640 -10.158 -12.194 1.00 1.52 H new ATOM 0 HE3 MET I 153 -17.712 -11.774 -11.453 1.00 1.52 H new ATOM 1534 N MET I 154 -22.196 -8.330 -15.946 1.00 73.51 N ATOM 1535 CA MET I 154 -22.925 -7.108 -16.266 1.00 34.42 C ATOM 1536 C MET I 154 -24.398 -7.407 -16.530 1.00 40.01 C ATOM 1537 O MET I 154 -25.270 -6.599 -16.215 1.00 52.13 O ATOM 1538 CB MET I 154 -22.305 -6.423 -17.485 1.00 45.31 C ATOM 1539 CG MET I 154 -22.614 -4.937 -17.570 1.00 24.43 C ATOM 1540 SD MET I 154 -21.285 -3.913 -16.911 1.00 71.02 S ATOM 1541 CE MET I 154 -20.687 -3.130 -18.407 1.00 74.53 C ATOM 0 H MET I 154 -21.369 -8.491 -16.521 1.00 73.51 H new ATOM 0 HA MET I 154 -22.856 -6.439 -15.409 1.00 34.42 H new ATOM 0 HB2 MET I 154 -21.224 -6.560 -17.458 1.00 45.31 H new ATOM 0 HB3 MET I 154 -22.666 -6.913 -18.389 1.00 45.31 H new ATOM 0 HG2 MET I 154 -22.794 -4.666 -18.610 1.00 24.43 H new ATOM 0 HG3 MET I 154 -23.533 -4.729 -17.023 1.00 24.43 H new ATOM 0 HE1 MET I 154 -19.601 -3.046 -18.365 1.00 74.53 H new ATOM 0 HE2 MET I 154 -20.971 -3.731 -19.271 1.00 74.53 H new ATOM 0 HE3 MET I 154 -21.124 -2.136 -18.497 1.00 74.53 H new ATOM 1551 N GLN I 155 -24.665 -8.572 -17.111 1.00 44.52 N ATOM 1552 CA GLN I 155 -26.032 -8.976 -17.418 1.00 51.21 C ATOM 1553 C GLN I 155 -26.888 -9.006 -16.156 1.00 33.15 C ATOM 1554 O GLN I 155 -28.108 -8.857 -16.218 1.00 63.24 O ATOM 1555 CB GLN I 155 -26.042 -10.352 -18.088 1.00 64.10 C ATOM 1556 CG GLN I 155 -25.195 -10.421 -19.348 1.00 44.03 C ATOM 1557 CD GLN I 155 -24.907 -11.845 -19.780 1.00 3.31 C ATOM 1558 OE1 GLN I 155 -25.722 -12.745 -19.576 1.00 24.04 O ATOM 1559 NE2 GLN I 155 -23.741 -12.057 -20.381 1.00 62.45 N ATOM 0 H GLN I 155 -23.954 -9.252 -17.378 1.00 44.52 H new ATOM 0 HA GLN I 155 -26.455 -8.242 -18.104 1.00 51.21 H new ATOM 0 HB2 GLN I 155 -25.682 -11.096 -17.377 1.00 64.10 H new ATOM 0 HB3 GLN I 155 -27.069 -10.619 -18.336 1.00 64.10 H new ATOM 0 HG2 GLN I 155 -25.707 -9.897 -20.155 1.00 44.03 H new ATOM 0 HG3 GLN I 155 -24.253 -9.900 -19.177 1.00 44.03 H new ATOM 0 HE21 GLN I 155 -23.095 -11.281 -20.530 1.00 62.45 H new ATOM 0 HE22 GLN I 155 -23.492 -12.995 -20.694 1.00 62.45 H new ATOM 1568 N ALA I 156 -26.239 -9.199 -15.012 1.00 43.53 N ATOM 1569 CA ALA I 156 -26.940 -9.247 -13.735 1.00 4.34 C ATOM 1570 C ALA I 156 -27.221 -7.843 -13.210 1.00 12.33 C ATOM 1571 O ALA I 156 -28.019 -7.661 -12.290 1.00 1.13 O ATOM 1572 CB ALA I 156 -26.133 -10.040 -12.719 1.00 24.24 C ATOM 0 H ALA I 156 -25.229 -9.325 -14.944 1.00 43.53 H new ATOM 0 HA ALA I 156 -27.896 -9.746 -13.892 1.00 4.34 H new ATOM 0 HB1 ALA I 156 -26.669 -10.067 -11.770 1.00 24.24 H new ATOM 0 HB2 ALA I 156 -25.988 -11.057 -13.083 1.00 24.24 H new ATOM 0 HB3 ALA I 156 -25.163 -9.565 -12.574 1.00 24.24 H new ATOM 1578 N LEU I 157 -26.560 -6.853 -13.800 1.00 20.34 N ATOM 1579 CA LEU I 157 -26.738 -5.464 -13.392 1.00 3.34 C ATOM 1580 C LEU I 157 -27.805 -4.779 -14.240 1.00 23.03 C ATOM 1581 O LEU I 157 -28.891 -4.461 -13.753 1.00 73.34 O ATOM 1582 CB LEU I 157 -25.415 -4.704 -13.505 1.00 33.22 C ATOM 1583 CG LEU I 157 -24.348 -5.057 -12.468 1.00 23.42 C ATOM 1584 CD1 LEU I 157 -24.924 -4.982 -11.063 1.00 11.43 C ATOM 1585 CD2 LEU I 157 -23.777 -6.441 -12.740 1.00 62.34 C ATOM 0 H LEU I 157 -25.896 -6.987 -14.563 1.00 20.34 H new ATOM 0 HA LEU I 157 -27.066 -5.457 -12.353 1.00 3.34 H new ATOM 0 HB2 LEU I 157 -25.001 -4.881 -14.498 1.00 33.22 H new ATOM 0 HB3 LEU I 157 -25.625 -3.637 -13.433 1.00 33.22 H new ATOM 0 HG LEU I 157 -23.539 -4.331 -12.546 1.00 23.42 H new ATOM 0 HD11 LEU I 157 -24.150 -5.236 -10.339 1.00 11.43 H new ATOM 0 HD12 LEU I 157 -25.283 -3.971 -10.870 1.00 11.43 H new ATOM 0 HD13 LEU I 157 -25.752 -5.685 -10.971 1.00 11.43 H new ATOM 0 HD21 LEU I 157 -23.019 -6.675 -11.992 1.00 62.34 H new ATOM 0 HD22 LEU I 157 -24.576 -7.180 -12.691 1.00 62.34 H new ATOM 0 HD23 LEU I 157 -23.326 -6.460 -13.732 1.00 62.34 H new ATOM 1597 N LEU I 158 -27.490 -4.557 -15.511 1.00 43.22 N ATOM 1598 CA LEU I 158 -28.422 -3.911 -16.429 1.00 1.14 C ATOM 1599 C LEU I 158 -28.637 -4.764 -17.675 1.00 43.30 C ATOM 1600 O LEU I 158 -28.912 -4.244 -18.756 1.00 11.44 O ATOM 1601 CB LEU I 158 -27.903 -2.529 -16.827 1.00 43.20 C ATOM 1602 CG LEU I 158 -26.494 -2.486 -17.419 1.00 70.34 C ATOM 1603 CD1 LEU I 158 -26.372 -1.352 -18.425 1.00 24.01 C ATOM 1604 CD2 LEU I 158 -25.456 -2.336 -16.316 1.00 41.41 C ATOM 0 H LEU I 158 -26.596 -4.815 -15.930 1.00 43.22 H new ATOM 0 HA LEU I 158 -29.378 -3.799 -15.917 1.00 1.14 H new ATOM 0 HB2 LEU I 158 -28.593 -2.099 -17.552 1.00 43.20 H new ATOM 0 HB3 LEU I 158 -27.925 -1.887 -15.946 1.00 43.20 H new ATOM 0 HG LEU I 158 -26.310 -3.427 -17.938 1.00 70.34 H new ATOM 0 HD11 LEU I 158 -25.362 -1.337 -18.836 1.00 24.01 H new ATOM 0 HD12 LEU I 158 -27.090 -1.502 -19.231 1.00 24.01 H new ATOM 0 HD13 LEU I 158 -26.576 -0.403 -17.930 1.00 24.01 H new ATOM 0 HD21 LEU I 158 -24.459 -2.307 -16.756 1.00 41.41 H new ATOM 0 HD22 LEU I 158 -25.638 -1.411 -15.769 1.00 41.41 H new ATOM 0 HD23 LEU I 158 -25.527 -3.182 -15.632 1.00 41.41 H new ATOM 1616 N GLY I 159 -28.512 -6.078 -17.516 1.00 40.24 N ATOM 1617 CA GLY I 159 -28.698 -6.982 -18.636 1.00 1.34 C ATOM 1618 C GLY I 159 -27.857 -6.598 -19.837 1.00 2.24 C ATOM 1619 O GLY I 159 -28.223 -6.884 -20.977 1.00 43.33 O ATOM 0 H GLY I 159 -28.285 -6.533 -16.632 1.00 40.24 H new ATOM 0 HA2 GLY I 159 -28.443 -7.996 -18.327 1.00 1.34 H new ATOM 0 HA3 GLY I 159 -29.750 -6.991 -18.921 1.00 1.34 H new ATOM 1623 N ALA I 160 -26.727 -5.946 -19.582 1.00 3.33 N ATOM 1624 CA ALA I 160 -25.832 -5.522 -20.652 1.00 65.51 C ATOM 1625 C ALA I 160 -25.057 -6.705 -21.221 1.00 2.31 C ATOM 1626 O ALA I 160 -24.656 -7.608 -20.486 1.00 72.13 O ATOM 1627 CB ALA I 160 -24.873 -4.455 -20.145 1.00 65.20 C ATOM 0 H ALA I 160 -26.410 -5.700 -18.644 1.00 3.33 H new ATOM 0 HA ALA I 160 -26.438 -5.100 -21.453 1.00 65.51 H new ATOM 0 HB1 ALA I 160 -24.210 -4.147 -20.954 1.00 65.20 H new ATOM 0 HB2 ALA I 160 -25.440 -3.593 -19.793 1.00 65.20 H new ATOM 0 HB3 ALA I 160 -24.280 -4.859 -19.324 1.00 65.20 H new ATOM 1633 N ARG I 161 -24.852 -6.696 -22.534 1.00 24.42 N ATOM 1634 CA ARG I 161 -24.126 -7.770 -23.201 1.00 64.05 C ATOM 1635 C ARG I 161 -24.797 -9.117 -22.949 1.00 20.34 C ATOM 1636 O ARG I 161 -24.127 -10.114 -22.678 1.00 4.10 O ATOM 1637 CB ARG I 161 -22.675 -7.812 -22.718 1.00 4.44 C ATOM 1638 CG ARG I 161 -22.015 -6.444 -22.654 1.00 75.15 C ATOM 1639 CD ARG I 161 -20.590 -6.537 -22.133 1.00 40.22 C ATOM 1640 NE ARG I 161 -19.719 -7.269 -23.049 1.00 32.20 N ATOM 1641 CZ ARG I 161 -19.284 -6.775 -24.202 1.00 44.43 C ATOM 1642 NH1 ARG I 161 -19.636 -5.553 -24.579 1.00 12.14 N ATOM 1643 NH2 ARG I 161 -18.494 -7.503 -24.982 1.00 51.24 N ATOM 0 H ARG I 161 -25.178 -5.957 -23.157 1.00 24.42 H new ATOM 0 HA ARG I 161 -24.138 -7.572 -24.273 1.00 64.05 H new ATOM 0 HB2 ARG I 161 -22.643 -8.268 -21.729 1.00 4.44 H new ATOM 0 HB3 ARG I 161 -22.098 -8.454 -23.383 1.00 4.44 H new ATOM 0 HG2 ARG I 161 -22.012 -5.994 -23.647 1.00 75.15 H new ATOM 0 HG3 ARG I 161 -22.598 -5.788 -22.008 1.00 75.15 H new ATOM 0 HD2 ARG I 161 -20.194 -5.533 -21.980 1.00 40.22 H new ATOM 0 HD3 ARG I 161 -20.591 -7.031 -21.161 1.00 40.22 H new ATOM 0 HE ARG I 161 -19.429 -8.212 -22.789 1.00 32.20 H new ATOM 0 HH11 ARG I 161 -20.242 -4.990 -23.983 1.00 12.14 H new ATOM 0 HH12 ARG I 161 -19.300 -5.176 -25.465 1.00 12.14 H new ATOM 0 HH21 ARG I 161 -18.221 -8.443 -24.696 1.00 51.24 H new ATOM 0 HH22 ARG I 161 -18.161 -7.122 -25.868 1.00 51.24 H new ATOM 1657 N ALA I 162 -26.122 -9.139 -23.039 1.00 32.14 N ATOM 1658 CA ALA I 162 -26.883 -10.363 -22.822 1.00 33.22 C ATOM 1659 C ALA I 162 -26.508 -11.431 -23.844 1.00 64.40 C ATOM 1660 O ALA I 162 -26.144 -12.551 -23.483 1.00 14.21 O ATOM 1661 CB ALA I 162 -28.376 -10.075 -22.881 1.00 30.22 C ATOM 0 H ALA I 162 -26.691 -8.322 -23.261 1.00 32.14 H new ATOM 0 HA ALA I 162 -26.637 -10.743 -21.831 1.00 33.22 H new ATOM 0 HB1 ALA I 162 -28.931 -10.998 -22.717 1.00 30.22 H new ATOM 0 HB2 ALA I 162 -28.638 -9.352 -22.108 1.00 30.22 H new ATOM 0 HB3 ALA I 162 -28.630 -9.668 -23.860 1.00 30.22 H new ATOM 1667 N LYS I 163 -26.600 -11.079 -25.122 1.00 24.11 N ATOM 1668 CA LYS I 163 -26.270 -12.006 -26.198 1.00 24.03 C ATOM 1669 C LYS I 163 -24.804 -11.874 -26.599 1.00 45.54 C ATOM 1670 O LYS I 163 -24.131 -10.960 -26.127 1.00 35.22 O ATOM 1671 CB LYS I 163 -27.167 -11.751 -27.411 1.00 31.30 C ATOM 1672 CG LYS I 163 -26.749 -12.525 -28.649 1.00 21.23 C ATOM 1673 CD LYS I 163 -27.667 -12.235 -29.825 1.00 24.12 C ATOM 1674 CE LYS I 163 -27.430 -10.841 -30.386 1.00 24.42 C ATOM 1675 NZ LYS I 163 -26.213 -10.787 -31.243 1.00 55.10 N ATOM 0 H LYS I 163 -26.901 -10.157 -25.438 1.00 24.11 H new ATOM 0 HA LYS I 163 -26.439 -13.020 -25.836 1.00 24.03 H new ATOM 0 HB2 LYS I 163 -28.193 -12.016 -27.156 1.00 31.30 H new ATOM 0 HB3 LYS I 163 -27.161 -10.685 -27.640 1.00 31.30 H new ATOM 0 HG2 LYS I 163 -25.724 -12.264 -28.913 1.00 21.23 H new ATOM 0 HG3 LYS I 163 -26.760 -13.593 -28.432 1.00 21.23 H new ATOM 0 HD2 LYS I 163 -27.503 -12.976 -30.607 1.00 24.12 H new ATOM 0 HD3 LYS I 163 -28.706 -12.330 -29.509 1.00 24.12 H new ATOM 0 HE2 LYS I 163 -28.298 -10.531 -30.968 1.00 24.42 H new ATOM 0 HE3 LYS I 163 -27.328 -10.132 -29.565 1.00 24.42 H new ATOM 0 HZ1 LYS I 163 -26.086 -9.821 -31.606 1.00 55.10 H new ATOM 0 HZ2 LYS I 163 -25.381 -11.058 -30.681 1.00 55.10 H new ATOM 0 HZ3 LYS I 163 -26.321 -11.445 -32.041 1.00 55.10 H new TER 1689 LYS I 163 HETATM 1690 CA CA C 90 -15.174 -3.442 5.519 1.00 13.22 CA