USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1129 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 MET CE :methyl 141:sc= -0.558 (180deg=0) USER MOD Set 1.2: A 110 MET CE :methyl -159:sc= -3.24! (180deg=-4.84!) USER MOD Single : A 10 SER OG : rot -18:sc= 0.745 USER MOD Single : A 11 ASN : amide:sc= -1.34 K(o=-1.3,f=-4.3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -1.38 K(o=-1.4,f=-1.9!) USER MOD Single : A 19 THR OG1 : rot 90:sc= 0.0602 USER MOD Single : A 23 LYS NZ :NH3+ -119:sc= 0.0641 (180deg=0) USER MOD Single : A 29 SER OG : rot -60:sc= 1.22 USER MOD Single : A 30 SER OG : rot 75:sc= 0.243 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.302 K(o=-0.3,f=-1.2) USER MOD Single : A 40 TYR OH : rot 30:sc= 0 USER MOD Single : A 43 MET CE :methyl 145:sc= -0.915 (180deg=-4.04!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 64:sc= 1.32 USER MOD Single : A 57 THR OG1 : rot -43:sc= -0.532 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= -0.493 USER MOD Single : A 69 THR OG1 : rot -42:sc= 0.97 USER MOD Single : A 70 HIS : no HD1:sc= -0.393 X(o=-0.39,f=-0.00013) USER MOD Single : A 75 MET CE :methyl 167:sc= -0.0604 (180deg=-0.42) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.097) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl 167:sc= -2.58 (180deg=-3.65) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -1.17 K(o=-1.2,f=-1.8!) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -140:sc= -0.446 (180deg=-2.24!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -2.66! C(o=-2.7!,f=-3.5!) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 112 THR OG1 : rot 180:sc=0.000142 USER MOD Single : A 115 HIS : no HD1:sc= -3.57! C(o=-3.6!,f=-2.7!) USER MOD Single : A 122 LYS NZ :NH3+ 147:sc= 0.00167 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -0.0551 X(o=-0.055,f=-0.31) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 4.972 5.866 -9.635 1.00 25.23 N ATOM 98 CA SER A 10 5.602 7.145 -9.943 1.00 35.31 C ATOM 99 C SER A 10 6.102 7.171 -11.384 1.00 74.21 C ATOM 100 O SER A 10 6.046 8.201 -12.053 1.00 52.53 O ATOM 101 CB SER A 10 6.763 7.410 -8.983 1.00 50.32 C ATOM 102 OG SER A 10 7.169 6.219 -8.332 1.00 12.13 O ATOM 0 HA SER A 10 4.854 7.929 -9.822 1.00 35.31 H new ATOM 0 HB2 SER A 10 7.604 7.832 -9.533 1.00 50.32 H new ATOM 0 HB3 SER A 10 6.463 8.150 -8.241 1.00 50.32 H new ATOM 0 HG SER A 10 6.461 5.546 -8.409 1.00 12.13 H new ATOM 108 N ASN A 11 6.591 6.028 -11.855 1.00 15.02 N ATOM 109 CA ASN A 11 7.102 5.919 -13.216 1.00 74.44 C ATOM 110 C ASN A 11 6.024 6.283 -14.233 1.00 11.01 C ATOM 111 O ASN A 11 6.314 6.859 -15.282 1.00 24.33 O ATOM 112 CB ASN A 11 7.609 4.499 -13.481 1.00 13.45 C ATOM 113 CG ASN A 11 8.692 4.461 -14.541 1.00 22.42 C ATOM 114 OD1 ASN A 11 9.416 5.436 -14.741 1.00 13.41 O ATOM 115 ND2 ASN A 11 8.808 3.329 -15.227 1.00 5.35 N ATOM 0 H ASN A 11 6.644 5.165 -11.314 1.00 15.02 H new ATOM 0 HA ASN A 11 7.930 6.620 -13.323 1.00 74.44 H new ATOM 0 HB2 ASN A 11 7.996 4.075 -12.554 1.00 13.45 H new ATOM 0 HB3 ASN A 11 6.775 3.871 -13.795 1.00 13.45 H new ATOM 0 HD21 ASN A 11 9.519 3.243 -15.953 1.00 5.35 H new ATOM 0 HD22 ASN A 11 8.186 2.546 -15.027 1.00 5.35 H new ATOM 122 N ASP A 12 4.779 5.944 -13.914 1.00 45.35 N ATOM 123 CA ASP A 12 3.657 6.237 -14.799 1.00 3.04 C ATOM 124 C ASP A 12 3.125 7.645 -14.553 1.00 50.40 C ATOM 125 O ASP A 12 2.601 8.290 -15.462 1.00 3.33 O ATOM 126 CB ASP A 12 2.539 5.213 -14.595 1.00 44.20 C ATOM 127 CG ASP A 12 2.297 4.367 -15.830 1.00 3.24 C ATOM 128 OD1 ASP A 12 3.249 3.702 -16.290 1.00 2.05 O ATOM 129 OD2 ASP A 12 1.156 4.370 -16.335 1.00 73.43 O ATOM 0 H ASP A 12 4.522 5.467 -13.050 1.00 45.35 H new ATOM 0 HA ASP A 12 4.011 6.177 -15.828 1.00 3.04 H new ATOM 0 HB2 ASP A 12 2.793 4.564 -13.757 1.00 44.20 H new ATOM 0 HB3 ASP A 12 1.619 5.732 -14.328 1.00 44.20 H new ATOM 134 N LYS A 13 3.261 8.117 -13.318 1.00 65.13 N ATOM 135 CA LYS A 13 2.795 9.449 -12.952 1.00 20.25 C ATOM 136 C LYS A 13 3.487 10.518 -13.791 1.00 23.03 C ATOM 137 O LYS A 13 2.832 11.323 -14.452 1.00 73.15 O ATOM 138 CB LYS A 13 3.048 9.709 -11.465 1.00 24.11 C ATOM 139 CG LYS A 13 2.106 10.733 -10.857 1.00 52.33 C ATOM 140 CD LYS A 13 2.223 10.770 -9.343 1.00 32.42 C ATOM 141 CE LYS A 13 2.575 12.163 -8.844 1.00 71.32 C ATOM 142 NZ LYS A 13 2.069 12.402 -7.464 1.00 44.10 N ATOM 0 H LYS A 13 3.691 7.596 -12.553 1.00 65.13 H new ATOM 0 HA LYS A 13 1.724 9.498 -13.146 1.00 20.25 H new ATOM 0 HB2 LYS A 13 2.952 8.770 -10.919 1.00 24.11 H new ATOM 0 HB3 LYS A 13 4.075 10.050 -11.334 1.00 24.11 H new ATOM 0 HG2 LYS A 13 2.328 11.719 -11.264 1.00 52.33 H new ATOM 0 HG3 LYS A 13 1.080 10.496 -11.138 1.00 52.33 H new ATOM 0 HD2 LYS A 13 1.282 10.450 -8.897 1.00 32.42 H new ATOM 0 HD3 LYS A 13 2.986 10.063 -9.019 1.00 32.42 H new ATOM 0 HE2 LYS A 13 3.657 12.292 -8.862 1.00 71.32 H new ATOM 0 HE3 LYS A 13 2.154 12.908 -9.519 1.00 71.32 H new ATOM 0 HZ1 LYS A 13 2.329 13.362 -7.160 1.00 44.10 H new ATOM 0 HZ2 LYS A 13 1.034 12.304 -7.452 1.00 44.10 H new ATOM 0 HZ3 LYS A 13 2.490 11.707 -6.815 1.00 44.10 H new ATOM 156 N VAL A 14 4.816 10.520 -13.760 1.00 22.40 N ATOM 157 CA VAL A 14 5.597 11.488 -14.520 1.00 3.21 C ATOM 158 C VAL A 14 5.350 11.340 -16.017 1.00 11.51 C ATOM 159 O VAL A 14 5.162 12.329 -16.726 1.00 41.23 O ATOM 160 CB VAL A 14 7.105 11.335 -14.242 1.00 54.33 C ATOM 161 CG1 VAL A 14 7.882 12.484 -14.867 1.00 60.43 C ATOM 162 CG2 VAL A 14 7.365 11.256 -12.746 1.00 0.54 C ATOM 0 H VAL A 14 5.374 9.862 -13.216 1.00 22.40 H new ATOM 0 HA VAL A 14 5.274 12.478 -14.198 1.00 3.21 H new ATOM 0 HB VAL A 14 7.449 10.406 -14.697 1.00 54.33 H new ATOM 0 HG11 VAL A 14 8.945 12.359 -14.660 1.00 60.43 H new ATOM 0 HG12 VAL A 14 7.720 12.489 -15.945 1.00 60.43 H new ATOM 0 HG13 VAL A 14 7.539 13.428 -14.444 1.00 60.43 H new ATOM 0 HG21 VAL A 14 8.435 11.148 -12.568 1.00 0.54 H new ATOM 0 HG22 VAL A 14 7.007 12.167 -12.266 1.00 0.54 H new ATOM 0 HG23 VAL A 14 6.839 10.396 -12.330 1.00 0.54 H new ATOM 172 N TYR A 15 5.350 10.100 -16.491 1.00 65.33 N ATOM 173 CA TYR A 15 5.128 9.822 -17.905 1.00 71.12 C ATOM 174 C TYR A 15 3.730 10.258 -18.333 1.00 13.04 C ATOM 175 O TYR A 15 3.457 10.427 -19.520 1.00 71.35 O ATOM 176 CB TYR A 15 5.318 8.331 -18.190 1.00 5.22 C ATOM 177 CG TYR A 15 4.913 7.925 -19.589 1.00 1.13 C ATOM 178 CD1 TYR A 15 5.388 8.614 -20.698 1.00 64.31 C ATOM 179 CD2 TYR A 15 4.054 6.854 -19.801 1.00 63.12 C ATOM 180 CE1 TYR A 15 5.020 8.247 -21.978 1.00 64.22 C ATOM 181 CE2 TYR A 15 3.682 6.479 -21.078 1.00 1.14 C ATOM 182 CZ TYR A 15 4.167 7.179 -22.163 1.00 25.33 C ATOM 183 OH TYR A 15 3.798 6.809 -23.436 1.00 11.32 O ATOM 0 H TYR A 15 5.501 9.271 -15.917 1.00 65.33 H new ATOM 0 HA TYR A 15 5.859 10.391 -18.480 1.00 71.12 H new ATOM 0 HB2 TYR A 15 6.365 8.070 -18.034 1.00 5.22 H new ATOM 0 HB3 TYR A 15 4.736 7.755 -17.471 1.00 5.22 H new ATOM 0 HD1 TYR A 15 6.056 9.451 -20.557 1.00 64.31 H new ATOM 0 HD2 TYR A 15 3.670 6.305 -18.954 1.00 63.12 H new ATOM 0 HE1 TYR A 15 5.398 8.793 -22.829 1.00 64.22 H new ATOM 0 HE2 TYR A 15 3.015 5.642 -21.226 1.00 1.14 H new ATOM 0 HH TYR A 15 3.195 6.038 -23.391 1.00 11.32 H new ATOM 193 N GLU A 16 2.848 10.439 -17.354 1.00 4.11 N ATOM 194 CA GLU A 16 1.478 10.855 -17.628 1.00 41.52 C ATOM 195 C GLU A 16 1.371 12.377 -17.678 1.00 24.04 C ATOM 196 O GLU A 16 0.876 12.944 -18.651 1.00 20.53 O ATOM 197 CB GLU A 16 0.530 10.301 -16.563 1.00 1.13 C ATOM 198 CG GLU A 16 -0.257 9.085 -17.022 1.00 13.42 C ATOM 199 CD GLU A 16 -1.650 9.441 -17.506 1.00 64.11 C ATOM 200 OE1 GLU A 16 -1.760 10.147 -18.530 1.00 1.43 O ATOM 201 OE2 GLU A 16 -2.629 9.012 -16.861 1.00 30.22 O ATOM 0 H GLU A 16 3.058 10.304 -16.365 1.00 4.11 H new ATOM 0 HA GLU A 16 1.192 10.456 -18.601 1.00 41.52 H new ATOM 0 HB2 GLU A 16 1.107 10.037 -15.677 1.00 1.13 H new ATOM 0 HB3 GLU A 16 -0.168 11.084 -16.267 1.00 1.13 H new ATOM 0 HG2 GLU A 16 0.286 8.587 -17.825 1.00 13.42 H new ATOM 0 HG3 GLU A 16 -0.333 8.374 -16.199 1.00 13.42 H new ATOM 208 N ASN A 17 1.840 13.032 -16.620 1.00 35.31 N ATOM 209 CA ASN A 17 1.796 14.487 -16.541 1.00 50.44 C ATOM 210 C ASN A 17 2.505 15.118 -17.736 1.00 40.10 C ATOM 211 O ASN A 17 2.030 16.100 -18.306 1.00 40.40 O ATOM 212 CB ASN A 17 2.440 14.968 -15.240 1.00 2.24 C ATOM 213 CG ASN A 17 2.361 16.474 -15.077 1.00 64.11 C ATOM 214 OD1 ASN A 17 1.473 16.991 -14.400 1.00 33.42 O ATOM 215 ND2 ASN A 17 3.294 17.186 -15.700 1.00 34.40 N ATOM 0 H ASN A 17 2.255 12.578 -15.806 1.00 35.31 H new ATOM 0 HA ASN A 17 0.751 14.795 -16.556 1.00 50.44 H new ATOM 0 HB2 ASN A 17 1.947 14.488 -14.395 1.00 2.24 H new ATOM 0 HB3 ASN A 17 3.485 14.657 -15.219 1.00 2.24 H new ATOM 0 HD21 ASN A 17 3.292 18.203 -15.627 1.00 34.40 H new ATOM 0 HD22 ASN A 17 4.012 16.715 -16.251 1.00 34.40 H new ATOM 222 N VAL A 18 3.645 14.546 -18.110 1.00 70.14 N ATOM 223 CA VAL A 18 4.419 15.050 -19.238 1.00 43.21 C ATOM 224 C VAL A 18 3.580 15.084 -20.510 1.00 73.42 C ATOM 225 O VAL A 18 3.870 15.836 -21.440 1.00 44.45 O ATOM 226 CB VAL A 18 5.674 14.192 -19.486 1.00 73.45 C ATOM 227 CG1 VAL A 18 6.620 14.272 -18.298 1.00 72.02 C ATOM 228 CG2 VAL A 18 5.284 12.749 -19.771 1.00 54.13 C ATOM 0 H VAL A 18 4.053 13.733 -17.648 1.00 70.14 H new ATOM 0 HA VAL A 18 4.726 16.064 -18.982 1.00 43.21 H new ATOM 0 HB VAL A 18 6.194 14.584 -20.360 1.00 73.45 H new ATOM 0 HG11 VAL A 18 7.500 13.659 -18.492 1.00 72.02 H new ATOM 0 HG12 VAL A 18 6.925 15.307 -18.145 1.00 72.02 H new ATOM 0 HG13 VAL A 18 6.114 13.907 -17.404 1.00 72.02 H new ATOM 0 HG21 VAL A 18 6.182 12.157 -19.944 1.00 54.13 H new ATOM 0 HG22 VAL A 18 4.741 12.344 -18.917 1.00 54.13 H new ATOM 0 HG23 VAL A 18 4.649 12.712 -20.656 1.00 54.13 H new ATOM 238 N THR A 19 2.535 14.262 -20.545 1.00 13.42 N ATOM 239 CA THR A 19 1.652 14.197 -21.703 1.00 22.22 C ATOM 240 C THR A 19 0.490 15.174 -21.565 1.00 4.03 C ATOM 241 O THR A 19 0.200 15.941 -22.481 1.00 54.33 O ATOM 242 CB THR A 19 1.092 12.776 -21.902 1.00 60.15 C ATOM 243 OG1 THR A 19 2.165 11.851 -22.113 1.00 1.34 O ATOM 244 CG2 THR A 19 0.138 12.732 -23.087 1.00 25.41 C ATOM 0 H THR A 19 2.280 13.632 -19.784 1.00 13.42 H new ATOM 0 HA THR A 19 2.250 14.470 -22.572 1.00 22.22 H new ATOM 0 HB THR A 19 0.543 12.496 -21.003 1.00 60.15 H new ATOM 0 HG1 THR A 19 2.464 11.495 -21.250 1.00 1.34 H new ATOM 0 HG21 THR A 19 -0.245 11.719 -23.208 1.00 25.41 H new ATOM 0 HG22 THR A 19 -0.693 13.415 -22.911 1.00 25.41 H new ATOM 0 HG23 THR A 19 0.668 13.030 -23.992 1.00 25.41 H new ATOM 252 N GLY A 20 -0.171 15.141 -20.412 1.00 31.03 N ATOM 253 CA GLY A 20 -1.294 16.029 -20.175 1.00 2.51 C ATOM 254 C GLY A 20 -0.957 17.479 -20.464 1.00 31.14 C ATOM 255 O GLY A 20 -1.656 18.146 -21.228 1.00 3.12 O ATOM 0 H GLY A 20 0.051 14.515 -19.638 1.00 31.03 H new ATOM 0 HA2 GLY A 20 -2.134 15.723 -20.799 1.00 2.51 H new ATOM 0 HA3 GLY A 20 -1.616 15.934 -19.138 1.00 2.51 H new ATOM 259 N LEU A 21 0.115 17.969 -19.851 1.00 32.13 N ATOM 260 CA LEU A 21 0.542 19.350 -20.045 1.00 4.14 C ATOM 261 C LEU A 21 0.664 19.679 -21.529 1.00 4.10 C ATOM 262 O LEU A 21 0.335 20.784 -21.960 1.00 4.52 O ATOM 263 CB LEU A 21 1.881 19.593 -19.345 1.00 12.31 C ATOM 264 CG LEU A 21 3.106 18.951 -19.997 1.00 54.12 C ATOM 265 CD1 LEU A 21 3.711 19.886 -21.033 1.00 11.34 C ATOM 266 CD2 LEU A 21 4.138 18.580 -18.943 1.00 22.21 C ATOM 0 H LEU A 21 0.704 17.431 -19.216 1.00 32.13 H new ATOM 0 HA LEU A 21 -0.214 20.003 -19.608 1.00 4.14 H new ATOM 0 HB2 LEU A 21 2.047 20.669 -19.286 1.00 12.31 H new ATOM 0 HB3 LEU A 21 1.805 19.226 -18.321 1.00 12.31 H new ATOM 0 HG LEU A 21 2.789 18.039 -20.503 1.00 54.12 H new ATOM 0 HD11 LEU A 21 4.582 19.412 -21.486 1.00 11.34 H new ATOM 0 HD12 LEU A 21 2.972 20.101 -21.805 1.00 11.34 H new ATOM 0 HD13 LEU A 21 4.014 20.816 -20.551 1.00 11.34 H new ATOM 0 HD21 LEU A 21 5.003 18.124 -19.425 1.00 22.21 H new ATOM 0 HD22 LEU A 21 4.451 19.477 -18.409 1.00 22.21 H new ATOM 0 HD23 LEU A 21 3.701 17.872 -18.239 1.00 22.21 H new ATOM 278 N VAL A 22 1.138 18.711 -22.307 1.00 52.25 N ATOM 279 CA VAL A 22 1.300 18.896 -23.745 1.00 1.45 C ATOM 280 C VAL A 22 -0.049 19.085 -24.430 1.00 65.01 C ATOM 281 O VAL A 22 -0.175 19.867 -25.373 1.00 24.31 O ATOM 282 CB VAL A 22 2.027 17.700 -24.386 1.00 71.42 C ATOM 283 CG1 VAL A 22 2.145 17.890 -25.891 1.00 11.54 C ATOM 284 CG2 VAL A 22 3.398 17.509 -23.755 1.00 40.14 C ATOM 0 H VAL A 22 1.417 17.791 -21.966 1.00 52.25 H new ATOM 0 HA VAL A 22 1.903 19.794 -23.883 1.00 1.45 H new ATOM 0 HB VAL A 22 1.440 16.800 -24.203 1.00 71.42 H new ATOM 0 HG11 VAL A 22 2.662 17.035 -26.326 1.00 11.54 H new ATOM 0 HG12 VAL A 22 1.149 17.973 -26.326 1.00 11.54 H new ATOM 0 HG13 VAL A 22 2.709 18.799 -26.100 1.00 11.54 H new ATOM 0 HG21 VAL A 22 3.898 16.659 -24.220 1.00 40.14 H new ATOM 0 HG22 VAL A 22 3.996 18.408 -23.905 1.00 40.14 H new ATOM 0 HG23 VAL A 22 3.284 17.323 -22.687 1.00 40.14 H new ATOM 294 N LYS A 23 -1.056 18.364 -23.950 1.00 61.31 N ATOM 295 CA LYS A 23 -2.397 18.452 -24.514 1.00 75.44 C ATOM 296 C LYS A 23 -2.941 19.873 -24.408 1.00 24.13 C ATOM 297 O LYS A 23 -3.595 20.368 -25.325 1.00 32.32 O ATOM 298 CB LYS A 23 -3.339 17.480 -23.799 1.00 64.42 C ATOM 299 CG LYS A 23 -2.955 16.021 -23.976 1.00 21.43 C ATOM 300 CD LYS A 23 -3.745 15.368 -25.098 1.00 2.13 C ATOM 301 CE LYS A 23 -3.417 13.888 -25.222 1.00 74.03 C ATOM 302 NZ LYS A 23 -4.226 13.229 -26.285 1.00 63.40 N ATOM 0 H LYS A 23 -0.969 17.712 -23.171 1.00 61.31 H new ATOM 0 HA LYS A 23 -2.338 18.182 -25.568 1.00 75.44 H new ATOM 0 HB2 LYS A 23 -3.353 17.717 -22.735 1.00 64.42 H new ATOM 0 HB3 LYS A 23 -4.352 17.628 -24.172 1.00 64.42 H new ATOM 0 HG2 LYS A 23 -1.889 15.948 -24.190 1.00 21.43 H new ATOM 0 HG3 LYS A 23 -3.131 15.482 -23.045 1.00 21.43 H new ATOM 0 HD2 LYS A 23 -4.812 15.491 -24.913 1.00 2.13 H new ATOM 0 HD3 LYS A 23 -3.525 15.871 -26.040 1.00 2.13 H new ATOM 0 HE2 LYS A 23 -2.357 13.768 -25.445 1.00 74.03 H new ATOM 0 HE3 LYS A 23 -3.600 13.394 -24.268 1.00 74.03 H new ATOM 0 HZ1 LYS A 23 -4.809 12.478 -25.863 1.00 63.40 H new ATOM 0 HZ2 LYS A 23 -4.843 13.933 -26.738 1.00 63.40 H new ATOM 0 HZ3 LYS A 23 -3.592 12.815 -26.998 1.00 63.40 H new ATOM 316 N ALA A 24 -2.663 20.525 -23.283 1.00 73.32 N ATOM 317 CA ALA A 24 -3.121 21.890 -23.059 1.00 11.21 C ATOM 318 C ALA A 24 -2.310 22.884 -23.884 1.00 30.33 C ATOM 319 O ALA A 24 -2.861 23.817 -24.468 1.00 60.20 O ATOM 320 CB ALA A 24 -3.039 22.238 -21.580 1.00 12.11 C ATOM 0 H ALA A 24 -2.123 20.129 -22.513 1.00 73.32 H new ATOM 0 HA ALA A 24 -4.161 21.955 -23.379 1.00 11.21 H new ATOM 0 HB1 ALA A 24 -3.384 23.261 -21.427 1.00 12.11 H new ATOM 0 HB2 ALA A 24 -3.667 21.554 -21.010 1.00 12.11 H new ATOM 0 HB3 ALA A 24 -2.007 22.149 -21.242 1.00 12.11 H new ATOM 326 N VAL A 25 -0.997 22.678 -23.927 1.00 35.24 N ATOM 327 CA VAL A 25 -0.110 23.555 -24.680 1.00 52.44 C ATOM 328 C VAL A 25 -0.593 23.723 -26.117 1.00 30.12 C ATOM 329 O VAL A 25 -0.577 24.826 -26.663 1.00 1.41 O ATOM 330 CB VAL A 25 1.333 23.017 -24.695 1.00 33.40 C ATOM 331 CG1 VAL A 25 2.234 23.926 -25.516 1.00 2.12 C ATOM 332 CG2 VAL A 25 1.860 22.869 -23.276 1.00 2.22 C ATOM 0 H VAL A 25 -0.525 21.911 -23.449 1.00 35.24 H new ATOM 0 HA VAL A 25 -0.123 24.523 -24.179 1.00 52.44 H new ATOM 0 HB VAL A 25 1.331 22.032 -25.162 1.00 33.40 H new ATOM 0 HG11 VAL A 25 3.249 23.529 -25.515 1.00 2.12 H new ATOM 0 HG12 VAL A 25 1.865 23.975 -26.540 1.00 2.12 H new ATOM 0 HG13 VAL A 25 2.235 24.926 -25.082 1.00 2.12 H new ATOM 0 HG21 VAL A 25 2.881 22.488 -23.305 1.00 2.22 H new ATOM 0 HG22 VAL A 25 1.849 23.840 -22.781 1.00 2.22 H new ATOM 0 HG23 VAL A 25 1.228 22.173 -22.724 1.00 2.22 H new ATOM 342 N ILE A 26 -1.022 22.621 -26.723 1.00 14.21 N ATOM 343 CA ILE A 26 -1.512 22.646 -28.096 1.00 3.53 C ATOM 344 C ILE A 26 -2.933 23.195 -28.163 1.00 30.32 C ATOM 345 O ILE A 26 -3.246 24.032 -29.008 1.00 41.41 O ATOM 346 CB ILE A 26 -1.484 21.243 -28.729 1.00 75.10 C ATOM 347 CG1 ILE A 26 -0.063 20.678 -28.709 1.00 44.14 C ATOM 348 CG2 ILE A 26 -2.021 21.293 -30.152 1.00 4.31 C ATOM 349 CD1 ILE A 26 -0.006 19.177 -28.887 1.00 51.15 C ATOM 0 H ILE A 26 -1.040 21.700 -26.285 1.00 14.21 H new ATOM 0 HA ILE A 26 -0.846 23.302 -28.657 1.00 3.53 H new ATOM 0 HB ILE A 26 -2.124 20.584 -28.143 1.00 75.10 H new ATOM 0 HG12 ILE A 26 0.519 21.152 -29.500 1.00 44.14 H new ATOM 0 HG13 ILE A 26 0.411 20.942 -27.763 1.00 44.14 H new ATOM 0 HG21 ILE A 26 -1.995 20.294 -30.586 1.00 4.31 H new ATOM 0 HG22 ILE A 26 -3.048 21.657 -30.141 1.00 4.31 H new ATOM 0 HG23 ILE A 26 -1.405 21.965 -30.750 1.00 4.31 H new ATOM 0 HD11 ILE A 26 1.033 18.847 -28.862 1.00 51.15 H new ATOM 0 HD12 ILE A 26 -0.560 18.694 -28.082 1.00 51.15 H new ATOM 0 HD13 ILE A 26 -0.450 18.907 -29.845 1.00 51.15 H new ATOM 361 N GLU A 27 -3.789 22.717 -27.265 1.00 2.04 N ATOM 362 CA GLU A 27 -5.177 23.161 -27.222 1.00 32.23 C ATOM 363 C GLU A 27 -5.260 24.684 -27.180 1.00 75.11 C ATOM 364 O GLU A 27 -5.893 25.305 -28.034 1.00 20.13 O ATOM 365 CB GLU A 27 -5.888 22.567 -26.004 1.00 74.42 C ATOM 366 CG GLU A 27 -6.873 21.463 -26.353 1.00 10.21 C ATOM 367 CD GLU A 27 -7.516 20.845 -25.126 1.00 45.51 C ATOM 368 OE1 GLU A 27 -7.009 21.082 -24.009 1.00 64.43 O ATOM 369 OE2 GLU A 27 -8.524 20.126 -25.282 1.00 52.34 O ATOM 0 H GLU A 27 -3.546 22.023 -26.558 1.00 2.04 H new ATOM 0 HA GLU A 27 -5.671 22.812 -28.129 1.00 32.23 H new ATOM 0 HB2 GLU A 27 -5.142 22.172 -25.315 1.00 74.42 H new ATOM 0 HB3 GLU A 27 -6.417 23.362 -25.479 1.00 74.42 H new ATOM 0 HG2 GLU A 27 -7.650 21.867 -27.002 1.00 10.21 H new ATOM 0 HG3 GLU A 27 -6.357 20.687 -26.918 1.00 10.21 H new ATOM 376 N MET A 28 -4.618 25.279 -26.180 1.00 63.43 N ATOM 377 CA MET A 28 -4.618 26.729 -26.027 1.00 74.12 C ATOM 378 C MET A 28 -4.077 27.408 -27.281 1.00 51.21 C ATOM 379 O MET A 28 -4.557 28.470 -27.680 1.00 23.53 O ATOM 380 CB MET A 28 -3.783 27.135 -24.812 1.00 1.22 C ATOM 381 CG MET A 28 -2.305 26.810 -24.954 1.00 20.50 C ATOM 382 SD MET A 28 -1.431 26.847 -23.377 1.00 63.14 S ATOM 383 CE MET A 28 -0.511 28.375 -23.537 1.00 4.43 C ATOM 0 H MET A 28 -4.091 24.779 -25.464 1.00 63.43 H new ATOM 0 HA MET A 28 -5.648 27.053 -25.875 1.00 74.12 H new ATOM 0 HB2 MET A 28 -3.897 28.206 -24.645 1.00 1.22 H new ATOM 0 HB3 MET A 28 -4.174 26.631 -23.928 1.00 1.22 H new ATOM 0 HG2 MET A 28 -2.196 25.823 -25.403 1.00 20.50 H new ATOM 0 HG3 MET A 28 -1.844 27.523 -25.637 1.00 20.50 H new ATOM 0 HE1 MET A 28 -0.501 28.896 -22.579 1.00 4.43 H new ATOM 0 HE2 MET A 28 0.512 28.154 -23.840 1.00 4.43 H new ATOM 0 HE3 MET A 28 -0.983 29.007 -24.289 1.00 4.43 H new ATOM 393 N SER A 29 -3.075 26.790 -27.898 1.00 75.34 N ATOM 394 CA SER A 29 -2.466 27.337 -29.105 1.00 14.22 C ATOM 395 C SER A 29 -3.478 27.398 -30.245 1.00 35.12 C ATOM 396 O SER A 29 -3.318 28.168 -31.192 1.00 22.41 O ATOM 397 CB SER A 29 -1.261 26.492 -29.522 1.00 13.01 C ATOM 398 OG SER A 29 -1.627 25.527 -30.493 1.00 42.24 O ATOM 0 H SER A 29 -2.668 25.910 -27.582 1.00 75.34 H new ATOM 0 HA SER A 29 -2.131 28.351 -28.885 1.00 14.22 H new ATOM 0 HB2 SER A 29 -0.481 27.139 -29.923 1.00 13.01 H new ATOM 0 HB3 SER A 29 -0.843 25.993 -28.648 1.00 13.01 H new ATOM 0 HG SER A 29 -2.315 24.935 -30.123 1.00 42.24 H new ATOM 404 N SER A 30 -4.522 26.580 -30.146 1.00 4.02 N ATOM 405 CA SER A 30 -5.559 26.537 -31.170 1.00 21.22 C ATOM 406 C SER A 30 -6.518 27.714 -31.022 1.00 2.22 C ATOM 407 O SER A 30 -6.750 28.465 -31.970 1.00 22.41 O ATOM 408 CB SER A 30 -6.333 25.220 -31.086 1.00 14.11 C ATOM 409 OG SER A 30 -5.451 24.115 -30.994 1.00 34.31 O ATOM 0 H SER A 30 -4.672 25.939 -29.367 1.00 4.02 H new ATOM 0 HA SER A 30 -5.076 26.605 -32.145 1.00 21.22 H new ATOM 0 HB2 SER A 30 -6.992 25.237 -30.218 1.00 14.11 H new ATOM 0 HB3 SER A 30 -6.967 25.111 -31.966 1.00 14.11 H new ATOM 0 HG SER A 30 -5.077 24.069 -30.089 1.00 34.31 H new ATOM 415 N LYS A 31 -7.073 27.870 -29.825 1.00 20.13 N ATOM 416 CA LYS A 31 -8.006 28.956 -29.549 1.00 32.20 C ATOM 417 C LYS A 31 -7.283 30.154 -28.942 1.00 70.12 C ATOM 418 O LYS A 31 -7.899 30.997 -28.289 1.00 20.52 O ATOM 419 CB LYS A 31 -9.110 28.479 -28.602 1.00 4.23 C ATOM 420 CG LYS A 31 -10.507 28.610 -29.181 1.00 54.24 C ATOM 421 CD LYS A 31 -11.166 27.253 -29.362 1.00 22.34 C ATOM 422 CE LYS A 31 -10.705 26.575 -30.643 1.00 40.41 C ATOM 423 NZ LYS A 31 -10.904 25.100 -30.593 1.00 45.43 N ATOM 0 H LYS A 31 -6.893 27.257 -29.030 1.00 20.13 H new ATOM 0 HA LYS A 31 -8.454 29.265 -30.493 1.00 32.20 H new ATOM 0 HB2 LYS A 31 -8.929 27.436 -28.344 1.00 4.23 H new ATOM 0 HB3 LYS A 31 -9.055 29.051 -27.676 1.00 4.23 H new ATOM 0 HG2 LYS A 31 -11.118 29.227 -28.522 1.00 54.24 H new ATOM 0 HG3 LYS A 31 -10.457 29.122 -30.142 1.00 54.24 H new ATOM 0 HD2 LYS A 31 -10.932 26.617 -28.508 1.00 22.34 H new ATOM 0 HD3 LYS A 31 -12.249 27.373 -29.382 1.00 22.34 H new ATOM 0 HE2 LYS A 31 -11.254 26.987 -31.490 1.00 40.41 H new ATOM 0 HE3 LYS A 31 -9.650 26.794 -30.810 1.00 40.41 H new ATOM 0 HZ1 LYS A 31 -10.578 24.675 -31.484 1.00 45.43 H new ATOM 0 HZ2 LYS A 31 -10.360 24.703 -29.801 1.00 45.43 H new ATOM 0 HZ3 LYS A 31 -11.914 24.890 -30.459 1.00 45.43 H new ATOM 437 N ILE A 32 -5.975 30.224 -29.164 1.00 22.25 N ATOM 438 CA ILE A 32 -5.170 31.320 -28.640 1.00 45.34 C ATOM 439 C ILE A 32 -5.645 32.662 -29.189 1.00 22.45 C ATOM 440 O ILE A 32 -5.704 33.653 -28.462 1.00 54.33 O ATOM 441 CB ILE A 32 -3.679 31.138 -28.983 1.00 31.41 C ATOM 442 CG1 ILE A 32 -2.863 32.318 -28.451 1.00 61.54 C ATOM 443 CG2 ILE A 32 -3.495 30.994 -30.486 1.00 60.42 C ATOM 444 CD1 ILE A 32 -2.991 32.517 -26.957 1.00 71.24 C ATOM 0 H ILE A 32 -5.450 29.535 -29.703 1.00 22.25 H new ATOM 0 HA ILE A 32 -5.290 31.309 -27.557 1.00 45.34 H new ATOM 0 HB ILE A 32 -3.320 30.227 -28.504 1.00 31.41 H new ATOM 0 HG12 ILE A 32 -1.813 32.165 -28.700 1.00 61.54 H new ATOM 0 HG13 ILE A 32 -3.182 33.228 -28.959 1.00 61.54 H new ATOM 0 HG21 ILE A 32 -2.436 30.866 -30.712 1.00 60.42 H new ATOM 0 HG22 ILE A 32 -4.049 30.124 -30.839 1.00 60.42 H new ATOM 0 HG23 ILE A 32 -3.867 31.888 -30.985 1.00 60.42 H new ATOM 0 HD11 ILE A 32 -2.386 33.370 -26.650 1.00 71.24 H new ATOM 0 HD12 ILE A 32 -4.035 32.702 -26.703 1.00 71.24 H new ATOM 0 HD13 ILE A 32 -2.645 31.622 -26.440 1.00 71.24 H new ATOM 456 N GLN A 33 -5.984 32.683 -30.474 1.00 25.04 N ATOM 457 CA GLN A 33 -6.455 33.903 -31.119 1.00 30.34 C ATOM 458 C GLN A 33 -7.741 34.401 -30.467 1.00 71.44 C ATOM 459 O GLN A 33 -7.803 35.503 -29.922 1.00 73.13 O ATOM 460 CB GLN A 33 -6.686 33.659 -32.611 1.00 32.11 C ATOM 461 CG GLN A 33 -5.768 34.471 -33.509 1.00 43.25 C ATOM 462 CD GLN A 33 -5.745 35.942 -33.144 1.00 11.31 C ATOM 463 OE1 GLN A 33 -4.719 36.472 -32.717 1.00 22.02 O ATOM 464 NE2 GLN A 33 -6.880 36.611 -33.310 1.00 50.41 N ATOM 0 H GLN A 33 -5.941 31.870 -31.088 1.00 25.04 H new ATOM 0 HA GLN A 33 -5.688 34.668 -30.998 1.00 30.34 H new ATOM 0 HB2 GLN A 33 -6.544 32.599 -32.824 1.00 32.11 H new ATOM 0 HB3 GLN A 33 -7.722 33.897 -32.854 1.00 32.11 H new ATOM 0 HG2 GLN A 33 -4.757 34.069 -33.446 1.00 43.25 H new ATOM 0 HG3 GLN A 33 -6.090 34.363 -34.545 1.00 43.25 H new ATOM 0 HE21 GLN A 33 -7.707 36.132 -33.667 1.00 50.41 H new ATOM 0 HE22 GLN A 33 -6.925 37.604 -33.081 1.00 50.41 H new ATOM 473 N PRO A 34 -8.793 33.571 -30.524 1.00 75.03 N ATOM 474 CA PRO A 34 -10.098 33.906 -29.945 1.00 23.21 C ATOM 475 C PRO A 34 -10.068 33.921 -28.420 1.00 40.34 C ATOM 476 O PRO A 34 -11.040 34.313 -27.775 1.00 70.22 O ATOM 477 CB PRO A 34 -11.009 32.785 -30.451 1.00 21.45 C ATOM 478 CG PRO A 34 -10.092 31.638 -30.707 1.00 54.53 C ATOM 479 CD PRO A 34 -8.791 32.242 -31.158 1.00 70.12 C ATOM 0 HA PRO A 34 -10.428 34.904 -30.233 1.00 23.21 H new ATOM 0 HB2 PRO A 34 -11.768 32.528 -29.712 1.00 21.45 H new ATOM 0 HB3 PRO A 34 -11.535 33.082 -31.358 1.00 21.45 H new ATOM 0 HG2 PRO A 34 -9.953 31.040 -29.806 1.00 54.53 H new ATOM 0 HG3 PRO A 34 -10.500 30.975 -31.470 1.00 54.53 H new ATOM 0 HD2 PRO A 34 -7.938 31.645 -30.836 1.00 70.12 H new ATOM 0 HD3 PRO A 34 -8.737 32.315 -32.244 1.00 70.12 H new ATOM 487 N ALA A 35 -8.946 33.493 -27.851 1.00 12.34 N ATOM 488 CA ALA A 35 -8.789 33.461 -26.402 1.00 35.32 C ATOM 489 C ALA A 35 -9.235 34.776 -25.772 1.00 20.13 C ATOM 490 O ALA A 35 -8.563 35.802 -25.878 1.00 22.13 O ATOM 491 CB ALA A 35 -7.344 33.160 -26.034 1.00 31.20 C ATOM 0 H ALA A 35 -8.133 33.164 -28.371 1.00 12.34 H new ATOM 0 HA ALA A 35 -9.425 32.667 -26.010 1.00 35.32 H new ATOM 0 HB1 ALA A 35 -7.242 33.139 -24.949 1.00 31.20 H new ATOM 0 HB2 ALA A 35 -7.058 32.191 -26.444 1.00 31.20 H new ATOM 0 HB3 ALA A 35 -6.695 33.934 -26.445 1.00 31.20 H new ATOM 497 N PRO A 36 -10.396 34.748 -25.100 1.00 63.02 N ATOM 498 CA PRO A 36 -10.957 35.930 -24.440 1.00 1.41 C ATOM 499 C PRO A 36 -10.147 36.351 -23.218 1.00 33.10 C ATOM 500 O PRO A 36 -9.274 35.625 -22.742 1.00 33.01 O ATOM 501 CB PRO A 36 -12.357 35.473 -24.022 1.00 64.43 C ATOM 502 CG PRO A 36 -12.249 33.992 -23.896 1.00 52.15 C ATOM 503 CD PRO A 36 -11.249 33.560 -24.933 1.00 75.13 C ATOM 0 HA PRO A 36 -10.956 36.801 -25.095 1.00 1.41 H new ATOM 0 HB2 PRO A 36 -12.658 35.930 -23.079 1.00 64.43 H new ATOM 0 HB3 PRO A 36 -13.104 35.754 -24.765 1.00 64.43 H new ATOM 0 HG2 PRO A 36 -11.921 33.708 -22.896 1.00 52.15 H new ATOM 0 HG3 PRO A 36 -13.215 33.515 -24.062 1.00 52.15 H new ATOM 0 HD2 PRO A 36 -10.674 32.696 -24.601 1.00 75.13 H new ATOM 0 HD3 PRO A 36 -11.735 33.280 -25.868 1.00 75.13 H new ATOM 511 N PRO A 37 -10.442 37.551 -22.696 1.00 60.03 N ATOM 512 CA PRO A 37 -9.753 38.094 -21.522 1.00 40.51 C ATOM 513 C PRO A 37 -10.106 37.343 -20.243 1.00 71.23 C ATOM 514 O PRO A 37 -9.383 37.417 -19.250 1.00 75.41 O ATOM 515 CB PRO A 37 -10.258 39.538 -21.451 1.00 31.31 C ATOM 516 CG PRO A 37 -11.583 39.509 -22.132 1.00 3.40 C ATOM 517 CD PRO A 37 -11.471 38.469 -23.212 1.00 42.53 C ATOM 0 HA PRO A 37 -8.670 38.010 -21.610 1.00 40.51 H new ATOM 0 HB2 PRO A 37 -10.351 39.875 -20.418 1.00 31.31 H new ATOM 0 HB3 PRO A 37 -9.572 40.223 -21.949 1.00 31.31 H new ATOM 0 HG2 PRO A 37 -12.377 39.258 -21.429 1.00 3.40 H new ATOM 0 HG3 PRO A 37 -11.827 40.484 -22.553 1.00 3.40 H new ATOM 0 HD2 PRO A 37 -12.419 37.958 -23.377 1.00 42.53 H new ATOM 0 HD3 PRO A 37 -11.176 38.909 -24.165 1.00 42.53 H new ATOM 525 N GLU A 38 -11.221 36.620 -20.276 1.00 33.21 N ATOM 526 CA GLU A 38 -11.669 35.855 -19.118 1.00 11.01 C ATOM 527 C GLU A 38 -11.012 34.478 -19.088 1.00 75.13 C ATOM 528 O GLU A 38 -10.932 33.840 -18.039 1.00 55.11 O ATOM 529 CB GLU A 38 -13.192 35.706 -19.135 1.00 61.24 C ATOM 530 CG GLU A 38 -13.928 37.005 -19.420 1.00 25.53 C ATOM 531 CD GLU A 38 -15.428 36.814 -19.524 1.00 52.11 C ATOM 532 OE1 GLU A 38 -15.870 36.051 -20.408 1.00 40.34 O ATOM 533 OE2 GLU A 38 -16.161 37.428 -18.721 1.00 1.55 O ATOM 0 H GLU A 38 -11.830 36.548 -21.091 1.00 33.21 H new ATOM 0 HA GLU A 38 -11.375 36.398 -18.220 1.00 11.01 H new ATOM 0 HB2 GLU A 38 -13.468 34.969 -19.889 1.00 61.24 H new ATOM 0 HB3 GLU A 38 -13.521 35.316 -18.172 1.00 61.24 H new ATOM 0 HG2 GLU A 38 -13.711 37.723 -18.629 1.00 25.53 H new ATOM 0 HG3 GLU A 38 -13.555 37.433 -20.350 1.00 25.53 H new ATOM 540 N GLU A 39 -10.545 34.027 -20.248 1.00 61.41 N ATOM 541 CA GLU A 39 -9.897 32.725 -20.355 1.00 63.21 C ATOM 542 C GLU A 39 -8.383 32.857 -20.211 1.00 53.11 C ATOM 543 O GLU A 39 -7.679 31.867 -20.013 1.00 63.11 O ATOM 544 CB GLU A 39 -10.237 32.069 -21.695 1.00 53.30 C ATOM 545 CG GLU A 39 -11.619 31.438 -21.730 1.00 51.33 C ATOM 546 CD GLU A 39 -11.690 30.144 -20.943 1.00 64.05 C ATOM 547 OE1 GLU A 39 -11.712 30.209 -19.696 1.00 43.04 O ATOM 548 OE2 GLU A 39 -11.722 29.067 -21.574 1.00 34.30 O ATOM 0 H GLU A 39 -10.603 34.543 -21.126 1.00 61.41 H new ATOM 0 HA GLU A 39 -10.269 32.096 -19.546 1.00 63.21 H new ATOM 0 HB2 GLU A 39 -10.168 32.818 -22.484 1.00 53.30 H new ATOM 0 HB3 GLU A 39 -9.492 31.304 -21.915 1.00 53.30 H new ATOM 0 HG2 GLU A 39 -12.347 32.143 -21.328 1.00 51.33 H new ATOM 0 HG3 GLU A 39 -11.900 31.245 -22.765 1.00 51.33 H new ATOM 555 N TYR A 40 -7.891 34.086 -20.313 1.00 3.52 N ATOM 556 CA TYR A 40 -6.461 34.349 -20.197 1.00 52.12 C ATOM 557 C TYR A 40 -5.992 34.184 -18.755 1.00 2.21 C ATOM 558 O TYR A 40 -4.936 33.606 -18.495 1.00 54.12 O ATOM 559 CB TYR A 40 -6.139 35.760 -20.692 1.00 41.10 C ATOM 560 CG TYR A 40 -5.017 35.805 -21.705 1.00 11.11 C ATOM 561 CD1 TYR A 40 -5.051 35.011 -22.844 1.00 51.04 C ATOM 562 CD2 TYR A 40 -3.924 36.643 -21.523 1.00 24.25 C ATOM 563 CE1 TYR A 40 -4.028 35.048 -23.772 1.00 10.42 C ATOM 564 CE2 TYR A 40 -2.897 36.688 -22.446 1.00 24.15 C ATOM 565 CZ TYR A 40 -2.953 35.889 -23.568 1.00 72.51 C ATOM 566 OH TYR A 40 -1.933 35.930 -24.490 1.00 63.24 O ATOM 0 H TYR A 40 -8.461 34.916 -20.476 1.00 3.52 H new ATOM 0 HA TYR A 40 -5.933 33.624 -20.817 1.00 52.12 H new ATOM 0 HB2 TYR A 40 -7.035 36.194 -21.135 1.00 41.10 H new ATOM 0 HB3 TYR A 40 -5.872 36.383 -19.839 1.00 41.10 H new ATOM 0 HD1 TYR A 40 -5.892 34.353 -23.007 1.00 51.04 H new ATOM 0 HD2 TYR A 40 -3.876 37.270 -20.645 1.00 24.25 H new ATOM 0 HE1 TYR A 40 -4.069 34.423 -24.652 1.00 10.42 H new ATOM 0 HE2 TYR A 40 -2.055 37.346 -22.289 1.00 24.15 H new ATOM 0 HH TYR A 40 -2.288 35.727 -25.380 1.00 63.24 H new ATOM 576 N VAL A 41 -6.785 34.697 -17.819 1.00 61.42 N ATOM 577 CA VAL A 41 -6.453 34.606 -16.402 1.00 73.43 C ATOM 578 C VAL A 41 -6.174 33.163 -15.995 1.00 12.43 C ATOM 579 O VAL A 41 -5.102 32.831 -15.489 1.00 43.43 O ATOM 580 CB VAL A 41 -7.587 35.166 -15.523 1.00 75.44 C ATOM 581 CG1 VAL A 41 -7.632 34.444 -14.185 1.00 73.33 C ATOM 582 CG2 VAL A 41 -7.417 36.664 -15.325 1.00 4.13 C ATOM 0 H VAL A 41 -7.662 35.180 -18.017 1.00 61.42 H new ATOM 0 HA VAL A 41 -5.555 35.204 -16.248 1.00 73.43 H new ATOM 0 HB VAL A 41 -8.536 34.996 -16.032 1.00 75.44 H new ATOM 0 HG11 VAL A 41 -8.439 34.853 -13.578 1.00 73.33 H new ATOM 0 HG12 VAL A 41 -7.806 33.381 -14.351 1.00 73.33 H new ATOM 0 HG13 VAL A 41 -6.683 34.580 -13.666 1.00 73.33 H new ATOM 0 HG21 VAL A 41 -8.227 37.043 -14.702 1.00 4.13 H new ATOM 0 HG22 VAL A 41 -6.462 36.861 -14.838 1.00 4.13 H new ATOM 0 HG23 VAL A 41 -7.440 37.164 -16.293 1.00 4.13 H new ATOM 592 N PRO A 42 -7.161 32.283 -16.219 1.00 54.52 N ATOM 593 CA PRO A 42 -7.046 30.861 -15.884 1.00 5.23 C ATOM 594 C PRO A 42 -6.057 30.131 -16.787 1.00 0.25 C ATOM 595 O PRO A 42 -5.421 29.163 -16.371 1.00 3.30 O ATOM 596 CB PRO A 42 -8.464 30.328 -16.103 1.00 3.54 C ATOM 597 CG PRO A 42 -9.069 31.260 -17.095 1.00 71.34 C ATOM 598 CD PRO A 42 -8.466 32.609 -16.818 1.00 54.24 C ATOM 0 HA PRO A 42 -6.671 30.710 -14.872 1.00 5.23 H new ATOM 0 HB2 PRO A 42 -8.449 29.305 -16.479 1.00 3.54 H new ATOM 0 HB3 PRO A 42 -9.031 30.317 -15.172 1.00 3.54 H new ATOM 0 HG2 PRO A 42 -8.854 30.938 -18.114 1.00 71.34 H new ATOM 0 HG3 PRO A 42 -10.154 31.289 -16.992 1.00 71.34 H new ATOM 0 HD2 PRO A 42 -8.354 33.194 -17.731 1.00 54.24 H new ATOM 0 HD3 PRO A 42 -9.085 33.194 -16.138 1.00 54.24 H new ATOM 606 N MET A 43 -5.933 30.602 -18.023 1.00 71.02 N ATOM 607 CA MET A 43 -5.020 29.994 -18.984 1.00 20.00 C ATOM 608 C MET A 43 -3.620 29.858 -18.393 1.00 13.30 C ATOM 609 O MET A 43 -3.040 28.772 -18.388 1.00 15.34 O ATOM 610 CB MET A 43 -4.966 30.827 -20.266 1.00 73.33 C ATOM 611 CG MET A 43 -5.736 30.211 -21.423 1.00 55.22 C ATOM 612 SD MET A 43 -6.174 31.420 -22.687 1.00 73.04 S ATOM 613 CE MET A 43 -7.560 30.601 -23.474 1.00 24.13 C ATOM 0 H MET A 43 -6.453 31.402 -18.383 1.00 71.02 H new ATOM 0 HA MET A 43 -5.393 28.998 -19.222 1.00 20.00 H new ATOM 0 HB2 MET A 43 -5.366 31.820 -20.062 1.00 73.33 H new ATOM 0 HB3 MET A 43 -3.925 30.957 -20.561 1.00 73.33 H new ATOM 0 HG2 MET A 43 -5.136 29.421 -21.874 1.00 55.22 H new ATOM 0 HG3 MET A 43 -6.644 29.744 -21.042 1.00 55.22 H new ATOM 0 HE1 MET A 43 -8.293 31.345 -23.786 1.00 24.13 H new ATOM 0 HE2 MET A 43 -7.209 30.050 -24.346 1.00 24.13 H new ATOM 0 HE3 MET A 43 -8.022 29.909 -22.769 1.00 24.13 H new ATOM 623 N VAL A 44 -3.082 30.968 -17.896 1.00 73.31 N ATOM 624 CA VAL A 44 -1.751 30.972 -17.302 1.00 42.11 C ATOM 625 C VAL A 44 -1.662 29.984 -16.144 1.00 73.15 C ATOM 626 O VAL A 44 -0.646 29.313 -15.962 1.00 0.40 O ATOM 627 CB VAL A 44 -1.367 32.375 -16.796 1.00 2.04 C ATOM 628 CG1 VAL A 44 0.011 32.352 -16.151 1.00 34.43 C ATOM 629 CG2 VAL A 44 -1.415 33.383 -17.934 1.00 3.45 C ATOM 0 H VAL A 44 -3.548 31.875 -17.893 1.00 73.31 H new ATOM 0 HA VAL A 44 -1.054 30.673 -18.085 1.00 42.11 H new ATOM 0 HB VAL A 44 -2.090 32.680 -16.040 1.00 2.04 H new ATOM 0 HG11 VAL A 44 0.265 33.352 -15.800 1.00 34.43 H new ATOM 0 HG12 VAL A 44 0.007 31.661 -15.308 1.00 34.43 H new ATOM 0 HG13 VAL A 44 0.750 32.026 -16.883 1.00 34.43 H new ATOM 0 HG21 VAL A 44 -1.141 34.369 -17.559 1.00 3.45 H new ATOM 0 HG22 VAL A 44 -0.715 33.084 -18.714 1.00 3.45 H new ATOM 0 HG23 VAL A 44 -2.424 33.419 -18.346 1.00 3.45 H new ATOM 639 N LYS A 45 -2.734 29.898 -15.364 1.00 12.10 N ATOM 640 CA LYS A 45 -2.780 28.990 -14.224 1.00 12.53 C ATOM 641 C LYS A 45 -2.562 27.548 -14.668 1.00 32.43 C ATOM 642 O LYS A 45 -1.940 26.758 -13.958 1.00 42.20 O ATOM 643 CB LYS A 45 -4.123 29.115 -13.500 1.00 41.32 C ATOM 644 CG LYS A 45 -4.005 29.666 -12.090 1.00 2.24 C ATOM 645 CD LYS A 45 -4.247 31.166 -12.054 1.00 72.25 C ATOM 646 CE LYS A 45 -3.039 31.913 -11.512 1.00 44.22 C ATOM 647 NZ LYS A 45 -2.824 31.644 -10.063 1.00 71.14 N ATOM 0 H LYS A 45 -3.583 30.446 -15.501 1.00 12.10 H new ATOM 0 HA LYS A 45 -1.978 29.266 -13.539 1.00 12.53 H new ATOM 0 HB2 LYS A 45 -4.780 29.763 -14.080 1.00 41.32 H new ATOM 0 HB3 LYS A 45 -4.597 28.134 -13.459 1.00 41.32 H new ATOM 0 HG2 LYS A 45 -4.724 29.165 -11.442 1.00 2.24 H new ATOM 0 HG3 LYS A 45 -3.013 29.447 -11.695 1.00 2.24 H new ATOM 0 HD2 LYS A 45 -4.476 31.523 -13.058 1.00 72.25 H new ATOM 0 HD3 LYS A 45 -5.117 31.380 -11.433 1.00 72.25 H new ATOM 0 HE2 LYS A 45 -2.150 31.621 -12.071 1.00 44.22 H new ATOM 0 HE3 LYS A 45 -3.175 32.983 -11.666 1.00 44.22 H new ATOM 0 HZ1 LYS A 45 -1.991 32.172 -9.732 1.00 71.14 H new ATOM 0 HZ2 LYS A 45 -3.662 31.946 -9.526 1.00 71.14 H new ATOM 0 HZ3 LYS A 45 -2.669 30.626 -9.918 1.00 71.14 H new ATOM 661 N GLU A 46 -3.078 27.211 -15.846 1.00 45.31 N ATOM 662 CA GLU A 46 -2.938 25.863 -16.384 1.00 4.14 C ATOM 663 C GLU A 46 -1.476 25.547 -16.685 1.00 24.50 C ATOM 664 O GLU A 46 -0.910 24.597 -16.144 1.00 20.55 O ATOM 665 CB GLU A 46 -3.777 25.707 -17.653 1.00 60.33 C ATOM 666 CG GLU A 46 -5.071 24.940 -17.437 1.00 63.32 C ATOM 667 CD GLU A 46 -4.909 23.448 -17.659 1.00 42.43 C ATOM 668 OE1 GLU A 46 -3.764 23.002 -17.882 1.00 73.11 O ATOM 669 OE2 GLU A 46 -5.928 22.728 -17.610 1.00 22.11 O ATOM 0 H GLU A 46 -3.597 27.853 -16.446 1.00 45.31 H new ATOM 0 HA GLU A 46 -3.296 25.160 -15.632 1.00 4.14 H new ATOM 0 HB2 GLU A 46 -4.012 26.696 -18.047 1.00 60.33 H new ATOM 0 HB3 GLU A 46 -3.183 25.195 -18.410 1.00 60.33 H new ATOM 0 HG2 GLU A 46 -5.428 25.116 -16.422 1.00 63.32 H new ATOM 0 HG3 GLU A 46 -5.834 25.324 -18.114 1.00 63.32 H new ATOM 676 N VAL A 47 -0.869 26.349 -17.554 1.00 12.43 N ATOM 677 CA VAL A 47 0.527 26.156 -17.928 1.00 13.33 C ATOM 678 C VAL A 47 1.439 26.240 -16.709 1.00 33.41 C ATOM 679 O VAL A 47 2.405 25.487 -16.591 1.00 12.22 O ATOM 680 CB VAL A 47 0.979 27.200 -18.966 1.00 41.20 C ATOM 681 CG1 VAL A 47 0.730 28.609 -18.450 1.00 52.34 C ATOM 682 CG2 VAL A 47 2.447 27.003 -19.314 1.00 73.04 C ATOM 0 H VAL A 47 -1.323 27.139 -18.013 1.00 12.43 H new ATOM 0 HA VAL A 47 0.603 25.161 -18.367 1.00 13.33 H new ATOM 0 HB VAL A 47 0.392 27.062 -19.874 1.00 41.20 H new ATOM 0 HG11 VAL A 47 1.056 29.333 -19.197 1.00 52.34 H new ATOM 0 HG12 VAL A 47 -0.334 28.742 -18.255 1.00 52.34 H new ATOM 0 HG13 VAL A 47 1.290 28.763 -17.527 1.00 52.34 H new ATOM 0 HG21 VAL A 47 2.750 27.749 -20.049 1.00 73.04 H new ATOM 0 HG22 VAL A 47 3.052 27.113 -18.414 1.00 73.04 H new ATOM 0 HG23 VAL A 47 2.592 26.005 -19.729 1.00 73.04 H new ATOM 692 N GLY A 48 1.124 27.161 -15.803 1.00 23.42 N ATOM 693 CA GLY A 48 1.925 27.325 -14.604 1.00 0.42 C ATOM 694 C GLY A 48 1.948 26.076 -13.746 1.00 10.13 C ATOM 695 O GLY A 48 2.931 25.807 -13.054 1.00 31.01 O ATOM 0 H GLY A 48 0.329 27.796 -15.878 1.00 23.42 H new ATOM 0 HA2 GLY A 48 2.945 27.587 -14.885 1.00 0.42 H new ATOM 0 HA3 GLY A 48 1.532 28.156 -14.019 1.00 0.42 H new ATOM 699 N LEU A 49 0.863 25.311 -13.788 1.00 53.31 N ATOM 700 CA LEU A 49 0.761 24.084 -13.007 1.00 31.42 C ATOM 701 C LEU A 49 1.637 22.986 -13.601 1.00 71.44 C ATOM 702 O LEU A 49 2.271 22.221 -12.874 1.00 54.41 O ATOM 703 CB LEU A 49 -0.694 23.614 -12.945 1.00 63.03 C ATOM 704 CG LEU A 49 -1.149 23.012 -11.615 1.00 60.05 C ATOM 705 CD1 LEU A 49 -1.122 24.063 -10.517 1.00 22.04 C ATOM 706 CD2 LEU A 49 -2.542 22.414 -11.750 1.00 1.12 C ATOM 0 H LEU A 49 0.041 25.519 -14.355 1.00 53.31 H new ATOM 0 HA LEU A 49 1.111 24.296 -11.997 1.00 31.42 H new ATOM 0 HB2 LEU A 49 -1.339 24.462 -13.177 1.00 63.03 H new ATOM 0 HB3 LEU A 49 -0.849 22.872 -13.729 1.00 63.03 H new ATOM 0 HG LEU A 49 -0.458 22.214 -11.343 1.00 60.05 H new ATOM 0 HD11 LEU A 49 -1.449 23.617 -9.578 1.00 22.04 H new ATOM 0 HD12 LEU A 49 -0.107 24.445 -10.404 1.00 22.04 H new ATOM 0 HD13 LEU A 49 -1.790 24.882 -10.781 1.00 22.04 H new ATOM 0 HD21 LEU A 49 -2.850 21.990 -10.794 1.00 1.12 H new ATOM 0 HD22 LEU A 49 -3.245 23.193 -12.045 1.00 1.12 H new ATOM 0 HD23 LEU A 49 -2.530 21.630 -12.507 1.00 1.12 H new ATOM 718 N ALA A 50 1.669 22.915 -14.928 1.00 61.21 N ATOM 719 CA ALA A 50 2.471 21.914 -15.621 1.00 33.55 C ATOM 720 C ALA A 50 3.943 22.032 -15.243 1.00 3.22 C ATOM 721 O ALA A 50 4.549 21.077 -14.754 1.00 55.21 O ATOM 722 CB ALA A 50 2.297 22.048 -17.126 1.00 65.32 C ATOM 0 H ALA A 50 1.149 23.539 -15.545 1.00 61.21 H new ATOM 0 HA ALA A 50 2.123 20.928 -15.313 1.00 33.55 H new ATOM 0 HB1 ALA A 50 2.902 21.294 -17.631 1.00 65.32 H new ATOM 0 HB2 ALA A 50 1.248 21.905 -17.385 1.00 65.32 H new ATOM 0 HB3 ALA A 50 2.617 23.041 -17.442 1.00 65.32 H new ATOM 728 N LEU A 51 4.515 23.209 -15.473 1.00 1.02 N ATOM 729 CA LEU A 51 5.918 23.453 -15.157 1.00 64.40 C ATOM 730 C LEU A 51 6.208 23.146 -13.691 1.00 52.40 C ATOM 731 O LEU A 51 7.130 22.395 -13.374 1.00 34.50 O ATOM 732 CB LEU A 51 6.287 24.904 -15.469 1.00 63.12 C ATOM 733 CG LEU A 51 6.582 25.221 -16.936 1.00 13.12 C ATOM 734 CD1 LEU A 51 7.725 24.359 -17.449 1.00 54.23 C ATOM 735 CD2 LEU A 51 5.336 25.019 -17.786 1.00 15.24 C ATOM 0 H LEU A 51 4.029 24.009 -15.877 1.00 1.02 H new ATOM 0 HA LEU A 51 6.524 22.790 -15.774 1.00 64.40 H new ATOM 0 HB2 LEU A 51 5.471 25.545 -15.137 1.00 63.12 H new ATOM 0 HB3 LEU A 51 7.163 25.171 -14.877 1.00 63.12 H new ATOM 0 HG LEU A 51 6.882 26.266 -17.009 1.00 13.12 H new ATOM 0 HD11 LEU A 51 7.921 24.598 -18.494 1.00 54.23 H new ATOM 0 HD12 LEU A 51 8.620 24.553 -16.859 1.00 54.23 H new ATOM 0 HD13 LEU A 51 7.454 23.307 -17.362 1.00 54.23 H new ATOM 0 HD21 LEU A 51 5.564 25.249 -18.827 1.00 15.24 H new ATOM 0 HD22 LEU A 51 5.006 23.983 -17.707 1.00 15.24 H new ATOM 0 HD23 LEU A 51 4.544 25.680 -17.434 1.00 15.24 H new ATOM 747 N ARG A 52 5.413 23.732 -12.801 1.00 40.35 N ATOM 748 CA ARG A 52 5.583 23.521 -11.369 1.00 42.30 C ATOM 749 C ARG A 52 5.517 22.036 -11.027 1.00 21.24 C ATOM 750 O ARG A 52 6.327 21.530 -10.249 1.00 32.41 O ATOM 751 CB ARG A 52 4.511 24.284 -10.589 1.00 31.34 C ATOM 752 CG ARG A 52 4.686 25.793 -10.628 1.00 25.02 C ATOM 753 CD ARG A 52 5.516 26.288 -9.454 1.00 24.14 C ATOM 754 NE ARG A 52 5.997 27.652 -9.659 1.00 70.42 N ATOM 755 CZ ARG A 52 6.648 28.349 -8.735 1.00 30.43 C ATOM 756 NH1 ARG A 52 6.895 27.813 -7.548 1.00 23.45 N ATOM 757 NH2 ARG A 52 7.054 29.584 -8.997 1.00 54.50 N ATOM 0 H ARG A 52 4.645 24.357 -13.047 1.00 40.35 H new ATOM 0 HA ARG A 52 6.566 23.898 -11.085 1.00 42.30 H new ATOM 0 HB2 ARG A 52 3.531 24.030 -10.992 1.00 31.34 H new ATOM 0 HB3 ARG A 52 4.524 23.952 -9.551 1.00 31.34 H new ATOM 0 HG2 ARG A 52 5.168 26.080 -11.563 1.00 25.02 H new ATOM 0 HG3 ARG A 52 3.708 26.274 -10.612 1.00 25.02 H new ATOM 0 HD2 ARG A 52 4.917 26.248 -8.544 1.00 24.14 H new ATOM 0 HD3 ARG A 52 6.366 25.622 -9.305 1.00 24.14 H new ATOM 0 HE ARG A 52 5.823 28.094 -10.562 1.00 70.42 H new ATOM 0 HH11 ARG A 52 6.585 26.863 -7.343 1.00 23.45 H new ATOM 0 HH12 ARG A 52 7.395 28.350 -6.840 1.00 23.45 H new ATOM 0 HH21 ARG A 52 6.866 30.000 -9.909 1.00 54.50 H new ATOM 0 HH22 ARG A 52 7.554 30.118 -8.286 1.00 54.50 H new ATOM 771 N THR A 53 4.546 21.341 -11.612 1.00 44.33 N ATOM 772 CA THR A 53 4.373 19.915 -11.369 1.00 20.15 C ATOM 773 C THR A 53 5.561 19.119 -11.896 1.00 72.54 C ATOM 774 O THR A 53 6.030 18.182 -11.249 1.00 63.40 O ATOM 775 CB THR A 53 3.083 19.386 -12.023 1.00 70.12 C ATOM 776 OG1 THR A 53 1.944 20.059 -11.475 1.00 30.51 O ATOM 777 CG2 THR A 53 2.944 17.886 -11.810 1.00 52.10 C ATOM 0 H THR A 53 3.867 21.744 -12.258 1.00 44.33 H new ATOM 0 HA THR A 53 4.303 19.785 -10.289 1.00 20.15 H new ATOM 0 HB THR A 53 3.139 19.581 -13.094 1.00 70.12 H new ATOM 0 HG1 THR A 53 1.987 21.012 -11.701 1.00 30.51 H new ATOM 0 HG21 THR A 53 2.026 17.535 -12.281 1.00 52.10 H new ATOM 0 HG22 THR A 53 3.798 17.375 -12.255 1.00 52.10 H new ATOM 0 HG23 THR A 53 2.909 17.672 -10.742 1.00 52.10 H new ATOM 785 N LEU A 54 6.044 19.496 -13.075 1.00 15.41 N ATOM 786 CA LEU A 54 7.179 18.817 -13.690 1.00 54.21 C ATOM 787 C LEU A 54 8.349 18.721 -12.716 1.00 75.42 C ATOM 788 O LEU A 54 9.033 17.699 -12.651 1.00 63.20 O ATOM 789 CB LEU A 54 7.614 19.556 -14.957 1.00 24.41 C ATOM 790 CG LEU A 54 6.742 19.339 -16.194 1.00 13.32 C ATOM 791 CD1 LEU A 54 7.072 20.365 -17.266 1.00 45.35 C ATOM 792 CD2 LEU A 54 6.919 17.927 -16.731 1.00 62.23 C ATOM 0 H LEU A 54 5.667 20.268 -13.624 1.00 15.41 H new ATOM 0 HA LEU A 54 6.867 17.807 -13.955 1.00 54.21 H new ATOM 0 HB2 LEU A 54 7.641 20.624 -14.739 1.00 24.41 H new ATOM 0 HB3 LEU A 54 8.633 19.254 -15.198 1.00 24.41 H new ATOM 0 HG LEU A 54 5.699 19.468 -15.906 1.00 13.32 H new ATOM 0 HD11 LEU A 54 6.442 20.195 -18.139 1.00 45.35 H new ATOM 0 HD12 LEU A 54 6.892 21.368 -16.878 1.00 45.35 H new ATOM 0 HD13 LEU A 54 8.120 20.269 -17.551 1.00 45.35 H new ATOM 0 HD21 LEU A 54 6.291 17.791 -17.611 1.00 62.23 H new ATOM 0 HD22 LEU A 54 7.963 17.769 -17.002 1.00 62.23 H new ATOM 0 HD23 LEU A 54 6.631 17.207 -15.965 1.00 62.23 H new ATOM 804 N LEU A 55 8.571 19.789 -11.959 1.00 41.33 N ATOM 805 CA LEU A 55 9.657 19.825 -10.986 1.00 21.21 C ATOM 806 C LEU A 55 9.526 18.684 -9.982 1.00 10.01 C ATOM 807 O LEU A 55 10.503 18.005 -9.668 1.00 71.33 O ATOM 808 CB LEU A 55 9.667 21.167 -10.252 1.00 32.21 C ATOM 809 CG LEU A 55 10.883 21.438 -9.365 1.00 74.00 C ATOM 810 CD1 LEU A 55 12.103 21.754 -10.215 1.00 45.00 C ATOM 811 CD2 LEU A 55 10.594 22.577 -8.398 1.00 41.23 C ATOM 0 H LEU A 55 8.013 20.642 -12.000 1.00 41.33 H new ATOM 0 HA LEU A 55 10.598 19.705 -11.524 1.00 21.21 H new ATOM 0 HB2 LEU A 55 9.598 21.964 -10.992 1.00 32.21 H new ATOM 0 HB3 LEU A 55 8.771 21.227 -9.634 1.00 32.21 H new ATOM 0 HG LEU A 55 11.093 20.540 -8.784 1.00 74.00 H new ATOM 0 HD11 LEU A 55 12.959 21.944 -9.567 1.00 45.00 H new ATOM 0 HD12 LEU A 55 12.322 20.908 -10.866 1.00 45.00 H new ATOM 0 HD13 LEU A 55 11.905 22.637 -10.822 1.00 45.00 H new ATOM 0 HD21 LEU A 55 11.470 22.756 -7.775 1.00 41.23 H new ATOM 0 HD22 LEU A 55 10.358 23.480 -8.960 1.00 41.23 H new ATOM 0 HD23 LEU A 55 9.747 22.311 -7.766 1.00 41.23 H new ATOM 823 N ALA A 56 8.311 18.478 -9.483 1.00 5.51 N ATOM 824 CA ALA A 56 8.052 17.417 -8.518 1.00 15.40 C ATOM 825 C ALA A 56 8.063 16.049 -9.191 1.00 34.14 C ATOM 826 O ALA A 56 8.642 15.094 -8.671 1.00 52.21 O ATOM 827 CB ALA A 56 6.721 17.654 -7.820 1.00 34.55 C ATOM 0 H ALA A 56 7.491 19.032 -9.731 1.00 5.51 H new ATOM 0 HA ALA A 56 8.848 17.433 -7.774 1.00 15.40 H new ATOM 0 HB1 ALA A 56 6.539 16.854 -7.102 1.00 34.55 H new ATOM 0 HB2 ALA A 56 6.749 18.611 -7.299 1.00 34.55 H new ATOM 0 HB3 ALA A 56 5.920 17.667 -8.559 1.00 34.55 H new ATOM 833 N THR A 57 7.418 15.959 -10.350 1.00 0.01 N ATOM 834 CA THR A 57 7.352 14.707 -11.093 1.00 22.12 C ATOM 835 C THR A 57 8.743 14.120 -11.306 1.00 11.04 C ATOM 836 O THR A 57 8.980 12.943 -11.032 1.00 12.43 O ATOM 837 CB THR A 57 6.674 14.901 -12.462 1.00 42.12 C ATOM 838 OG1 THR A 57 7.502 15.707 -13.309 1.00 13.04 O ATOM 839 CG2 THR A 57 5.311 15.558 -12.303 1.00 62.40 C ATOM 0 H THR A 57 6.934 16.739 -10.794 1.00 0.01 H new ATOM 0 HA THR A 57 6.757 14.016 -10.496 1.00 22.12 H new ATOM 0 HB THR A 57 6.536 13.920 -12.916 1.00 42.12 H new ATOM 0 HG1 THR A 57 7.861 16.460 -12.795 1.00 13.04 H new ATOM 0 HG21 THR A 57 4.852 15.685 -13.283 1.00 62.40 H new ATOM 0 HG22 THR A 57 4.674 14.928 -11.682 1.00 62.40 H new ATOM 0 HG23 THR A 57 5.430 16.533 -11.829 1.00 62.40 H new ATOM 847 N VAL A 58 9.661 14.947 -11.795 1.00 52.53 N ATOM 848 CA VAL A 58 11.030 14.511 -12.043 1.00 75.42 C ATOM 849 C VAL A 58 11.735 14.147 -10.741 1.00 53.33 C ATOM 850 O VAL A 58 12.528 13.207 -10.694 1.00 72.24 O ATOM 851 CB VAL A 58 11.843 15.599 -12.769 1.00 23.43 C ATOM 852 CG1 VAL A 58 13.276 15.138 -12.987 1.00 24.44 C ATOM 853 CG2 VAL A 58 11.185 15.963 -14.091 1.00 31.02 C ATOM 0 H VAL A 58 9.481 15.924 -12.028 1.00 52.53 H new ATOM 0 HA VAL A 58 10.971 13.628 -12.679 1.00 75.42 H new ATOM 0 HB VAL A 58 11.864 16.491 -12.143 1.00 23.43 H new ATOM 0 HG11 VAL A 58 13.835 15.920 -13.501 1.00 24.44 H new ATOM 0 HG12 VAL A 58 13.742 14.932 -12.024 1.00 24.44 H new ATOM 0 HG13 VAL A 58 13.279 14.232 -13.593 1.00 24.44 H new ATOM 0 HG21 VAL A 58 11.773 16.733 -14.590 1.00 31.02 H new ATOM 0 HG22 VAL A 58 11.131 15.079 -14.726 1.00 31.02 H new ATOM 0 HG23 VAL A 58 10.179 16.338 -13.905 1.00 31.02 H new ATOM 863 N ASP A 59 11.440 14.898 -9.686 1.00 2.50 N ATOM 864 CA ASP A 59 12.045 14.655 -8.381 1.00 72.14 C ATOM 865 C ASP A 59 11.888 13.193 -7.974 1.00 42.13 C ATOM 866 O ASP A 59 12.836 12.565 -7.504 1.00 44.43 O ATOM 867 CB ASP A 59 11.412 15.562 -7.325 1.00 41.10 C ATOM 868 CG ASP A 59 12.446 16.347 -6.542 1.00 31.03 C ATOM 869 OD1 ASP A 59 13.320 16.975 -7.176 1.00 13.45 O ATOM 870 OD2 ASP A 59 12.381 16.334 -5.295 1.00 33.41 O ATOM 0 H ASP A 59 10.786 15.680 -9.708 1.00 2.50 H new ATOM 0 HA ASP A 59 13.109 14.882 -8.453 1.00 72.14 H new ATOM 0 HB2 ASP A 59 10.725 16.255 -7.810 1.00 41.10 H new ATOM 0 HB3 ASP A 59 10.822 14.957 -6.637 1.00 41.10 H new ATOM 875 N GLU A 60 10.685 12.659 -8.157 1.00 72.44 N ATOM 876 CA GLU A 60 10.405 11.271 -7.807 1.00 14.21 C ATOM 877 C GLU A 60 10.906 10.324 -8.893 1.00 21.20 C ATOM 878 O GLU A 60 11.017 9.117 -8.676 1.00 44.21 O ATOM 879 CB GLU A 60 8.903 11.069 -7.592 1.00 42.42 C ATOM 880 CG GLU A 60 8.076 11.266 -8.852 1.00 4.12 C ATOM 881 CD GLU A 60 6.681 10.685 -8.731 1.00 22.45 C ATOM 882 OE1 GLU A 60 6.229 10.458 -7.589 1.00 2.53 O ATOM 883 OE2 GLU A 60 6.041 10.456 -9.778 1.00 43.15 O ATOM 0 H GLU A 60 9.889 13.165 -8.545 1.00 72.44 H new ATOM 0 HA GLU A 60 10.932 11.044 -6.880 1.00 14.21 H new ATOM 0 HB2 GLU A 60 8.731 10.063 -7.208 1.00 42.42 H new ATOM 0 HB3 GLU A 60 8.557 11.765 -6.828 1.00 42.42 H new ATOM 0 HG2 GLU A 60 8.004 12.331 -9.072 1.00 4.12 H new ATOM 0 HG3 GLU A 60 8.588 10.800 -9.694 1.00 4.12 H new ATOM 890 N SER A 61 11.207 10.880 -10.062 1.00 74.44 N ATOM 891 CA SER A 61 11.692 10.085 -11.184 1.00 70.34 C ATOM 892 C SER A 61 13.136 9.647 -10.956 1.00 35.12 C ATOM 893 O SER A 61 13.590 8.649 -11.516 1.00 61.41 O ATOM 894 CB SER A 61 11.589 10.884 -12.485 1.00 63.40 C ATOM 895 OG SER A 61 11.361 10.029 -13.592 1.00 64.20 O ATOM 0 H SER A 61 11.124 11.878 -10.257 1.00 74.44 H new ATOM 0 HA SER A 61 11.069 9.194 -11.262 1.00 70.34 H new ATOM 0 HB2 SER A 61 10.778 11.608 -12.408 1.00 63.40 H new ATOM 0 HB3 SER A 61 12.507 11.450 -12.642 1.00 63.40 H new ATOM 0 HG SER A 61 11.298 10.564 -14.411 1.00 64.20 H new ATOM 901 N LEU A 62 13.852 10.401 -10.129 1.00 34.30 N ATOM 902 CA LEU A 62 15.245 10.092 -9.825 1.00 34.03 C ATOM 903 C LEU A 62 15.400 8.634 -9.403 1.00 13.41 C ATOM 904 O LEU A 62 16.108 7.851 -10.036 1.00 1.30 O ATOM 905 CB LEU A 62 15.762 11.013 -8.718 1.00 74.21 C ATOM 906 CG LEU A 62 16.625 12.190 -9.173 1.00 55.22 C ATOM 907 CD1 LEU A 62 17.888 11.693 -9.858 1.00 22.24 C ATOM 908 CD2 LEU A 62 15.836 13.102 -10.102 1.00 60.54 C ATOM 0 H LEU A 62 13.491 11.230 -9.657 1.00 34.30 H new ATOM 0 HA LEU A 62 15.833 10.254 -10.728 1.00 34.03 H new ATOM 0 HB2 LEU A 62 14.905 11.407 -8.171 1.00 74.21 H new ATOM 0 HB3 LEU A 62 16.341 10.414 -8.015 1.00 74.21 H new ATOM 0 HG LEU A 62 16.916 12.764 -8.293 1.00 55.22 H new ATOM 0 HD11 LEU A 62 18.489 12.545 -10.175 1.00 22.24 H new ATOM 0 HD12 LEU A 62 18.463 11.082 -9.162 1.00 22.24 H new ATOM 0 HD13 LEU A 62 17.619 11.095 -10.729 1.00 22.24 H new ATOM 0 HD21 LEU A 62 16.466 13.934 -10.416 1.00 60.54 H new ATOM 0 HD22 LEU A 62 15.515 12.539 -10.978 1.00 60.54 H new ATOM 0 HD23 LEU A 62 14.961 13.487 -9.578 1.00 60.54 H new ATOM 920 N PRO A 63 14.720 8.259 -8.309 1.00 3.11 N ATOM 921 CA PRO A 63 14.764 6.893 -7.780 1.00 24.24 C ATOM 922 C PRO A 63 14.048 5.897 -8.685 1.00 64.15 C ATOM 923 O PRO A 63 14.533 4.788 -8.911 1.00 60.11 O ATOM 924 CB PRO A 63 14.041 7.010 -6.436 1.00 32.52 C ATOM 925 CG PRO A 63 13.138 8.184 -6.592 1.00 41.34 C ATOM 926 CD PRO A 63 13.856 9.140 -7.505 1.00 24.33 C ATOM 0 HA PRO A 63 15.785 6.520 -7.700 1.00 24.24 H new ATOM 0 HB2 PRO A 63 13.478 6.105 -6.210 1.00 32.52 H new ATOM 0 HB3 PRO A 63 14.747 7.159 -5.619 1.00 32.52 H new ATOM 0 HG2 PRO A 63 12.179 7.885 -7.016 1.00 41.34 H new ATOM 0 HG3 PRO A 63 12.930 8.647 -5.628 1.00 41.34 H new ATOM 0 HD2 PRO A 63 13.159 9.699 -8.130 1.00 24.33 H new ATOM 0 HD3 PRO A 63 14.438 9.871 -6.944 1.00 24.33 H new ATOM 934 N VAL A 64 12.892 6.300 -9.203 1.00 21.41 N ATOM 935 CA VAL A 64 12.110 5.443 -10.086 1.00 30.30 C ATOM 936 C VAL A 64 12.965 4.904 -11.228 1.00 33.14 C ATOM 937 O VAL A 64 12.711 3.817 -11.749 1.00 14.13 O ATOM 938 CB VAL A 64 10.903 6.196 -10.675 1.00 14.53 C ATOM 939 CG1 VAL A 64 10.184 5.335 -11.701 1.00 71.35 C ATOM 940 CG2 VAL A 64 9.952 6.626 -9.568 1.00 12.04 C ATOM 0 H VAL A 64 12.476 7.215 -9.026 1.00 21.41 H new ATOM 0 HA VAL A 64 11.750 4.611 -9.481 1.00 30.30 H new ATOM 0 HB VAL A 64 11.267 7.091 -11.179 1.00 14.53 H new ATOM 0 HG11 VAL A 64 9.334 5.885 -12.106 1.00 71.35 H new ATOM 0 HG12 VAL A 64 10.871 5.082 -12.509 1.00 71.35 H new ATOM 0 HG13 VAL A 64 9.831 4.420 -11.225 1.00 71.35 H new ATOM 0 HG21 VAL A 64 9.105 7.157 -10.002 1.00 12.04 H new ATOM 0 HG22 VAL A 64 9.594 5.746 -9.034 1.00 12.04 H new ATOM 0 HG23 VAL A 64 10.475 7.284 -8.874 1.00 12.04 H new ATOM 950 N LEU A 65 13.979 5.670 -11.612 1.00 5.10 N ATOM 951 CA LEU A 65 14.874 5.270 -12.693 1.00 31.23 C ATOM 952 C LEU A 65 16.286 5.026 -12.169 1.00 14.00 C ATOM 953 O LEU A 65 16.689 5.553 -11.132 1.00 42.11 O ATOM 954 CB LEU A 65 14.900 6.342 -13.783 1.00 43.40 C ATOM 955 CG LEU A 65 13.795 6.256 -14.836 1.00 41.22 C ATOM 956 CD1 LEU A 65 14.251 5.420 -16.022 1.00 24.24 C ATOM 957 CD2 LEU A 65 12.525 5.677 -14.230 1.00 51.42 C ATOM 0 H LEU A 65 14.203 6.572 -11.191 1.00 5.10 H new ATOM 0 HA LEU A 65 14.498 4.339 -13.117 1.00 31.23 H new ATOM 0 HB2 LEU A 65 14.843 7.320 -13.304 1.00 43.40 H new ATOM 0 HB3 LEU A 65 15.863 6.292 -14.291 1.00 43.40 H new ATOM 0 HG LEU A 65 13.578 7.264 -15.190 1.00 41.22 H new ATOM 0 HD11 LEU A 65 13.451 5.370 -16.761 1.00 24.24 H new ATOM 0 HD12 LEU A 65 15.133 5.877 -16.472 1.00 24.24 H new ATOM 0 HD13 LEU A 65 14.496 4.413 -15.684 1.00 24.24 H new ATOM 0 HD21 LEU A 65 11.749 5.623 -14.994 1.00 51.42 H new ATOM 0 HD22 LEU A 65 12.728 4.677 -13.847 1.00 51.42 H new ATOM 0 HD23 LEU A 65 12.187 6.316 -13.414 1.00 51.42 H new ATOM 969 N PRO A 66 17.056 4.210 -12.903 1.00 25.32 N ATOM 970 CA PRO A 66 18.436 3.880 -12.533 1.00 61.33 C ATOM 971 C PRO A 66 19.378 5.069 -12.688 1.00 60.22 C ATOM 972 O PRO A 66 19.346 5.770 -13.699 1.00 65.11 O ATOM 973 CB PRO A 66 18.811 2.769 -13.518 1.00 31.25 C ATOM 974 CG PRO A 66 17.928 2.993 -14.696 1.00 50.42 C ATOM 975 CD PRO A 66 16.641 3.546 -14.150 1.00 52.51 C ATOM 0 HA PRO A 66 18.518 3.587 -11.486 1.00 61.33 H new ATOM 0 HB2 PRO A 66 19.863 2.825 -13.796 1.00 31.25 H new ATOM 0 HB3 PRO A 66 18.648 1.783 -13.083 1.00 31.25 H new ATOM 0 HG2 PRO A 66 18.385 3.689 -15.399 1.00 50.42 H new ATOM 0 HG3 PRO A 66 17.755 2.062 -15.236 1.00 50.42 H new ATOM 0 HD2 PRO A 66 16.179 4.248 -14.844 1.00 52.51 H new ATOM 0 HD3 PRO A 66 15.913 2.757 -13.962 1.00 52.51 H new ATOM 983 N ALA A 67 20.215 5.290 -11.680 1.00 65.32 N ATOM 984 CA ALA A 67 21.168 6.393 -11.706 1.00 61.43 C ATOM 985 C ALA A 67 22.053 6.324 -12.946 1.00 43.41 C ATOM 986 O ALA A 67 22.841 5.392 -13.108 1.00 0.45 O ATOM 987 CB ALA A 67 22.020 6.384 -10.446 1.00 23.22 C ATOM 0 H ALA A 67 20.253 4.720 -10.835 1.00 65.32 H new ATOM 0 HA ALA A 67 20.606 7.326 -11.744 1.00 61.43 H new ATOM 0 HB1 ALA A 67 22.727 7.213 -10.479 1.00 23.22 H new ATOM 0 HB2 ALA A 67 21.378 6.489 -9.572 1.00 23.22 H new ATOM 0 HB3 ALA A 67 22.567 5.443 -10.383 1.00 23.22 H new ATOM 993 N SER A 68 21.918 7.317 -13.820 1.00 32.13 N ATOM 994 CA SER A 68 22.702 7.367 -15.048 1.00 24.21 C ATOM 995 C SER A 68 22.316 8.579 -15.890 1.00 64.23 C ATOM 996 O SER A 68 23.150 9.156 -16.589 1.00 23.01 O ATOM 997 CB SER A 68 22.503 6.084 -15.858 1.00 1.23 C ATOM 998 OG SER A 68 21.278 5.456 -15.524 1.00 75.33 O ATOM 0 H SER A 68 21.273 8.098 -13.700 1.00 32.13 H new ATOM 0 HA SER A 68 23.754 7.456 -14.775 1.00 24.21 H new ATOM 0 HB2 SER A 68 22.518 6.316 -16.923 1.00 1.23 H new ATOM 0 HB3 SER A 68 23.330 5.399 -15.670 1.00 1.23 H new ATOM 0 HG SER A 68 21.173 4.639 -16.056 1.00 75.33 H new ATOM 1004 N THR A 69 21.045 8.960 -15.819 1.00 53.24 N ATOM 1005 CA THR A 69 20.546 10.102 -16.575 1.00 40.13 C ATOM 1006 C THR A 69 20.180 11.257 -15.650 1.00 25.12 C ATOM 1007 O THR A 69 19.321 12.078 -15.974 1.00 25.41 O ATOM 1008 CB THR A 69 19.313 9.723 -17.417 1.00 13.42 C ATOM 1009 OG1 THR A 69 18.900 10.841 -18.211 1.00 53.01 O ATOM 1010 CG2 THR A 69 18.165 9.277 -16.524 1.00 54.40 C ATOM 0 H THR A 69 20.342 8.494 -15.245 1.00 53.24 H new ATOM 0 HA THR A 69 21.350 10.415 -17.241 1.00 40.13 H new ATOM 0 HB THR A 69 19.587 8.895 -18.071 1.00 13.42 H new ATOM 0 HG1 THR A 69 18.946 11.659 -17.673 1.00 53.01 H new ATOM 0 HG21 THR A 69 17.305 9.014 -17.141 1.00 54.40 H new ATOM 0 HG22 THR A 69 18.473 8.408 -15.942 1.00 54.40 H new ATOM 0 HG23 THR A 69 17.893 10.088 -15.849 1.00 54.40 H new ATOM 1018 N HIS A 70 20.838 11.316 -14.496 1.00 62.40 N ATOM 1019 CA HIS A 70 20.583 12.372 -13.523 1.00 53.03 C ATOM 1020 C HIS A 70 21.201 13.691 -13.979 1.00 34.45 C ATOM 1021 O HIS A 70 20.803 14.763 -13.524 1.00 11.34 O ATOM 1022 CB HIS A 70 21.140 11.980 -12.155 1.00 21.23 C ATOM 1023 CG HIS A 70 22.637 11.957 -12.102 1.00 33.43 C ATOM 1024 ND1 HIS A 70 23.373 12.767 -11.263 1.00 73.03 N ATOM 1025 CD2 HIS A 70 23.535 11.213 -12.789 1.00 5.35 C ATOM 1026 CE1 HIS A 70 24.660 12.524 -11.438 1.00 15.41 C ATOM 1027 NE2 HIS A 70 24.785 11.585 -12.358 1.00 3.10 N ATOM 0 H HIS A 70 21.552 10.645 -14.212 1.00 62.40 H new ATOM 0 HA HIS A 70 19.504 12.505 -13.442 1.00 53.03 H new ATOM 0 HB2 HIS A 70 20.769 12.680 -11.407 1.00 21.23 H new ATOM 0 HB3 HIS A 70 20.760 10.995 -11.886 1.00 21.23 H new ATOM 0 HD2 HIS A 70 23.311 10.466 -13.536 1.00 5.35 H new ATOM 0 HE1 HIS A 70 25.471 13.011 -10.917 1.00 15.41 H new ATOM 0 HE2 HIS A 70 25.667 11.198 -12.694 1.00 3.10 H new ATOM 1035 N ARG A 71 22.175 13.603 -14.878 1.00 30.30 N ATOM 1036 CA ARG A 71 22.849 14.789 -15.393 1.00 31.42 C ATOM 1037 C ARG A 71 21.837 15.816 -15.891 1.00 74.34 C ATOM 1038 O ARG A 71 21.706 16.899 -15.322 1.00 71.31 O ATOM 1039 CB ARG A 71 23.804 14.407 -16.525 1.00 4.20 C ATOM 1040 CG ARG A 71 24.613 15.578 -17.060 1.00 74.11 C ATOM 1041 CD ARG A 71 24.609 15.608 -18.581 1.00 2.45 C ATOM 1042 NE ARG A 71 25.912 15.983 -19.123 1.00 42.23 N ATOM 1043 CZ ARG A 71 26.291 15.723 -20.370 1.00 5.34 C ATOM 1044 NH1 ARG A 71 25.471 15.091 -21.198 1.00 2.25 N ATOM 1045 NH2 ARG A 71 27.493 16.096 -20.790 1.00 44.40 N ATOM 0 H ARG A 71 22.515 12.723 -15.265 1.00 30.30 H new ATOM 0 HA ARG A 71 23.421 15.234 -14.579 1.00 31.42 H new ATOM 0 HB2 ARG A 71 24.488 13.637 -16.168 1.00 4.20 H new ATOM 0 HB3 ARG A 71 23.230 13.970 -17.342 1.00 4.20 H new ATOM 0 HG2 ARG A 71 24.202 16.512 -16.675 1.00 74.11 H new ATOM 0 HG3 ARG A 71 25.639 15.508 -16.699 1.00 74.11 H new ATOM 0 HD2 ARG A 71 24.326 14.627 -18.962 1.00 2.45 H new ATOM 0 HD3 ARG A 71 23.855 16.314 -18.928 1.00 2.45 H new ATOM 0 HE ARG A 71 26.567 16.471 -18.512 1.00 42.23 H new ATOM 0 HH11 ARG A 71 24.546 14.803 -20.879 1.00 2.25 H new ATOM 0 HH12 ARG A 71 25.765 14.893 -22.154 1.00 2.25 H new ATOM 0 HH21 ARG A 71 28.127 16.582 -20.156 1.00 44.40 H new ATOM 0 HH22 ARG A 71 27.783 15.896 -21.747 1.00 44.40 H new ATOM 1059 N GLU A 72 21.124 15.467 -16.958 1.00 51.21 N ATOM 1060 CA GLU A 72 20.125 16.360 -17.533 1.00 72.15 C ATOM 1061 C GLU A 72 19.007 16.642 -16.534 1.00 33.42 C ATOM 1062 O GLU A 72 18.518 17.768 -16.434 1.00 64.50 O ATOM 1063 CB GLU A 72 19.541 15.752 -18.811 1.00 11.53 C ATOM 1064 CG GLU A 72 20.595 15.284 -19.799 1.00 44.12 C ATOM 1065 CD GLU A 72 20.005 14.888 -21.139 1.00 13.44 C ATOM 1066 OE1 GLU A 72 18.983 15.487 -21.536 1.00 44.40 O ATOM 1067 OE2 GLU A 72 20.563 13.980 -21.789 1.00 11.22 O ATOM 0 H GLU A 72 21.220 14.574 -17.441 1.00 51.21 H new ATOM 0 HA GLU A 72 20.615 17.302 -17.778 1.00 72.15 H new ATOM 0 HB2 GLU A 72 18.905 14.908 -18.544 1.00 11.53 H new ATOM 0 HB3 GLU A 72 18.903 16.491 -19.296 1.00 11.53 H new ATOM 0 HG2 GLU A 72 21.325 16.079 -19.949 1.00 44.12 H new ATOM 0 HG3 GLU A 72 21.131 14.434 -19.377 1.00 44.12 H new ATOM 1074 N ILE A 73 18.607 15.611 -15.797 1.00 34.10 N ATOM 1075 CA ILE A 73 17.547 15.747 -14.805 1.00 41.12 C ATOM 1076 C ILE A 73 17.854 16.873 -13.824 1.00 40.41 C ATOM 1077 O ILE A 73 17.000 17.714 -13.543 1.00 25.12 O ATOM 1078 CB ILE A 73 17.340 14.439 -14.019 1.00 62.12 C ATOM 1079 CG1 ILE A 73 16.750 13.360 -14.929 1.00 32.30 C ATOM 1080 CG2 ILE A 73 16.437 14.680 -12.819 1.00 21.43 C ATOM 1081 CD1 ILE A 73 15.343 13.665 -15.394 1.00 61.31 C ATOM 0 H ILE A 73 19.001 14.673 -15.868 1.00 34.10 H new ATOM 0 HA ILE A 73 16.633 15.982 -15.350 1.00 41.12 H new ATOM 0 HB ILE A 73 18.308 14.092 -13.657 1.00 62.12 H new ATOM 0 HG12 ILE A 73 17.394 13.239 -15.800 1.00 32.30 H new ATOM 0 HG13 ILE A 73 16.750 12.408 -14.398 1.00 32.30 H new ATOM 0 HG21 ILE A 73 16.300 13.746 -12.273 1.00 21.43 H new ATOM 0 HG22 ILE A 73 16.894 15.420 -12.162 1.00 21.43 H new ATOM 0 HG23 ILE A 73 15.469 15.046 -13.160 1.00 21.43 H new ATOM 0 HD11 ILE A 73 14.989 12.858 -16.035 1.00 61.31 H new ATOM 0 HD12 ILE A 73 14.686 13.757 -14.529 1.00 61.31 H new ATOM 0 HD13 ILE A 73 15.339 14.601 -15.953 1.00 61.31 H new ATOM 1093 N GLU A 74 19.079 16.884 -13.308 1.00 42.12 N ATOM 1094 CA GLU A 74 19.499 17.908 -12.359 1.00 53.50 C ATOM 1095 C GLU A 74 19.404 19.299 -12.981 1.00 72.55 C ATOM 1096 O GLU A 74 18.769 20.196 -12.428 1.00 23.12 O ATOM 1097 CB GLU A 74 20.931 17.645 -11.890 1.00 31.54 C ATOM 1098 CG GLU A 74 21.154 17.945 -10.417 1.00 32.41 C ATOM 1099 CD GLU A 74 21.624 16.731 -9.639 1.00 20.11 C ATOM 1100 OE1 GLU A 74 22.812 16.367 -9.769 1.00 11.52 O ATOM 1101 OE2 GLU A 74 20.805 16.145 -8.901 1.00 21.31 O ATOM 0 H GLU A 74 19.798 16.195 -13.531 1.00 42.12 H new ATOM 0 HA GLU A 74 18.829 17.866 -11.500 1.00 53.50 H new ATOM 0 HB2 GLU A 74 21.181 16.602 -12.082 1.00 31.54 H new ATOM 0 HB3 GLU A 74 21.616 18.251 -12.483 1.00 31.54 H new ATOM 0 HG2 GLU A 74 21.891 18.742 -10.320 1.00 32.41 H new ATOM 0 HG3 GLU A 74 20.226 18.315 -9.981 1.00 32.41 H new ATOM 1108 N MET A 75 20.040 19.468 -14.136 1.00 1.11 N ATOM 1109 CA MET A 75 20.027 20.748 -14.834 1.00 41.23 C ATOM 1110 C MET A 75 18.604 21.148 -15.210 1.00 11.33 C ATOM 1111 O MET A 75 18.306 22.330 -15.381 1.00 43.03 O ATOM 1112 CB MET A 75 20.897 20.677 -16.091 1.00 25.15 C ATOM 1113 CG MET A 75 20.817 21.923 -16.957 1.00 51.12 C ATOM 1114 SD MET A 75 22.014 21.910 -18.305 1.00 40.05 S ATOM 1115 CE MET A 75 21.503 20.444 -19.198 1.00 74.11 C ATOM 0 H MET A 75 20.570 18.735 -14.608 1.00 1.11 H new ATOM 0 HA MET A 75 20.433 21.504 -14.161 1.00 41.23 H new ATOM 0 HB2 MET A 75 21.934 20.515 -15.796 1.00 25.15 H new ATOM 0 HB3 MET A 75 20.595 19.813 -16.683 1.00 25.15 H new ATOM 0 HG2 MET A 75 19.812 22.010 -17.370 1.00 51.12 H new ATOM 0 HG3 MET A 75 20.984 22.803 -16.336 1.00 51.12 H new ATOM 0 HE1 MET A 75 21.988 20.425 -20.174 1.00 74.11 H new ATOM 0 HE2 MET A 75 21.788 19.556 -18.634 1.00 74.11 H new ATOM 0 HE3 MET A 75 20.421 20.457 -19.331 1.00 74.11 H new ATOM 1125 N ALA A 76 17.729 20.156 -15.336 1.00 13.11 N ATOM 1126 CA ALA A 76 16.337 20.406 -15.689 1.00 72.53 C ATOM 1127 C ALA A 76 15.585 21.056 -14.533 1.00 41.52 C ATOM 1128 O ALA A 76 14.666 21.846 -14.746 1.00 12.40 O ATOM 1129 CB ALA A 76 15.656 19.108 -16.100 1.00 40.32 C ATOM 0 H ALA A 76 17.959 19.172 -15.199 1.00 13.11 H new ATOM 0 HA ALA A 76 16.320 21.096 -16.532 1.00 72.53 H new ATOM 0 HB1 ALA A 76 14.617 19.309 -16.361 1.00 40.32 H new ATOM 0 HB2 ALA A 76 16.171 18.684 -16.962 1.00 40.32 H new ATOM 0 HB3 ALA A 76 15.692 18.400 -15.272 1.00 40.32 H new ATOM 1135 N GLN A 77 15.982 20.719 -13.310 1.00 71.35 N ATOM 1136 CA GLN A 77 15.344 21.270 -12.121 1.00 53.21 C ATOM 1137 C GLN A 77 15.441 22.792 -12.107 1.00 43.10 C ATOM 1138 O GLN A 77 14.453 23.491 -12.331 1.00 74.43 O ATOM 1139 CB GLN A 77 15.986 20.694 -10.858 1.00 44.32 C ATOM 1140 CG GLN A 77 15.603 19.249 -10.586 1.00 23.35 C ATOM 1141 CD GLN A 77 16.004 18.791 -9.197 1.00 64.52 C ATOM 1142 OE1 GLN A 77 17.062 18.188 -9.011 1.00 70.22 O ATOM 1143 NE2 GLN A 77 15.160 19.075 -8.213 1.00 31.33 N ATOM 0 H GLN A 77 16.742 20.067 -13.117 1.00 71.35 H new ATOM 0 HA GLN A 77 14.290 20.992 -12.143 1.00 53.21 H new ATOM 0 HB2 GLN A 77 17.070 20.763 -10.948 1.00 44.32 H new ATOM 0 HB3 GLN A 77 15.697 21.305 -10.003 1.00 44.32 H new ATOM 0 HG2 GLN A 77 14.526 19.134 -10.706 1.00 23.35 H new ATOM 0 HG3 GLN A 77 16.077 18.606 -11.328 1.00 23.35 H new ATOM 0 HE21 GLN A 77 14.294 19.577 -8.412 1.00 31.33 H new ATOM 0 HE22 GLN A 77 15.377 18.792 -7.257 1.00 31.33 H new ATOM 1152 N LYS A 78 16.640 23.301 -11.842 1.00 32.45 N ATOM 1153 CA LYS A 78 16.868 24.740 -11.799 1.00 3.04 C ATOM 1154 C LYS A 78 16.373 25.408 -13.077 1.00 62.15 C ATOM 1155 O LYS A 78 15.768 26.480 -13.036 1.00 32.20 O ATOM 1156 CB LYS A 78 18.357 25.035 -11.600 1.00 13.22 C ATOM 1157 CG LYS A 78 18.646 26.478 -11.222 1.00 74.24 C ATOM 1158 CD LYS A 78 19.810 27.040 -12.020 1.00 41.40 C ATOM 1159 CE LYS A 78 19.636 28.528 -12.287 1.00 30.40 C ATOM 1160 NZ LYS A 78 20.942 29.242 -12.318 1.00 41.22 N ATOM 0 H LYS A 78 17.469 22.737 -11.654 1.00 32.45 H new ATOM 0 HA LYS A 78 16.307 25.147 -10.957 1.00 3.04 H new ATOM 0 HB2 LYS A 78 18.748 24.379 -10.822 1.00 13.22 H new ATOM 0 HB3 LYS A 78 18.892 24.795 -12.518 1.00 13.22 H new ATOM 0 HG2 LYS A 78 17.758 27.085 -11.395 1.00 74.24 H new ATOM 0 HG3 LYS A 78 18.871 26.538 -10.157 1.00 74.24 H new ATOM 0 HD2 LYS A 78 20.740 26.873 -11.476 1.00 41.40 H new ATOM 0 HD3 LYS A 78 19.895 26.507 -12.967 1.00 41.40 H new ATOM 0 HE2 LYS A 78 19.122 28.669 -13.238 1.00 30.40 H new ATOM 0 HE3 LYS A 78 19.002 28.964 -11.515 1.00 30.40 H new ATOM 0 HZ1 LYS A 78 20.781 30.253 -12.502 1.00 41.22 H new ATOM 0 HZ2 LYS A 78 21.421 29.129 -11.402 1.00 41.22 H new ATOM 0 HZ3 LYS A 78 21.538 28.843 -13.072 1.00 41.22 H new ATOM 1174 N LEU A 79 16.633 24.768 -14.212 1.00 72.13 N ATOM 1175 CA LEU A 79 16.212 25.299 -15.504 1.00 11.40 C ATOM 1176 C LEU A 79 14.697 25.473 -15.554 1.00 4.31 C ATOM 1177 O LEU A 79 14.193 26.476 -16.061 1.00 41.12 O ATOM 1178 CB LEU A 79 16.668 24.372 -16.632 1.00 52.41 C ATOM 1179 CG LEU A 79 16.015 24.603 -17.996 1.00 3.24 C ATOM 1180 CD1 LEU A 79 17.033 24.423 -19.112 1.00 13.45 C ATOM 1181 CD2 LEU A 79 14.836 23.661 -18.189 1.00 64.41 C ATOM 0 H LEU A 79 17.133 23.881 -14.264 1.00 72.13 H new ATOM 0 HA LEU A 79 16.676 26.277 -15.636 1.00 11.40 H new ATOM 0 HB2 LEU A 79 17.747 24.475 -16.746 1.00 52.41 H new ATOM 0 HB3 LEU A 79 16.476 23.343 -16.329 1.00 52.41 H new ATOM 0 HG LEU A 79 15.645 25.628 -18.032 1.00 3.24 H new ATOM 0 HD11 LEU A 79 16.551 24.591 -20.075 1.00 13.45 H new ATOM 0 HD12 LEU A 79 17.845 25.139 -18.983 1.00 13.45 H new ATOM 0 HD13 LEU A 79 17.434 23.410 -19.079 1.00 13.45 H new ATOM 0 HD21 LEU A 79 14.384 23.839 -19.165 1.00 64.41 H new ATOM 0 HD22 LEU A 79 15.182 22.629 -18.133 1.00 64.41 H new ATOM 0 HD23 LEU A 79 14.097 23.839 -17.408 1.00 64.41 H new ATOM 1193 N LEU A 80 13.977 24.492 -15.023 1.00 33.22 N ATOM 1194 CA LEU A 80 12.519 24.537 -15.004 1.00 73.24 C ATOM 1195 C LEU A 80 12.022 25.821 -14.349 1.00 53.42 C ATOM 1196 O LEU A 80 11.172 26.521 -14.898 1.00 40.33 O ATOM 1197 CB LEU A 80 11.961 23.322 -14.260 1.00 53.43 C ATOM 1198 CG LEU A 80 11.173 22.321 -15.106 1.00 24.42 C ATOM 1199 CD1 LEU A 80 12.097 21.596 -16.073 1.00 11.31 C ATOM 1200 CD2 LEU A 80 10.446 21.325 -14.214 1.00 12.43 C ATOM 0 H LEU A 80 14.379 23.655 -14.600 1.00 33.22 H new ATOM 0 HA LEU A 80 12.166 24.517 -16.035 1.00 73.24 H new ATOM 0 HB2 LEU A 80 12.792 22.796 -13.790 1.00 53.43 H new ATOM 0 HB3 LEU A 80 11.314 23.678 -13.458 1.00 53.43 H new ATOM 0 HG LEU A 80 10.431 22.869 -15.686 1.00 24.42 H new ATOM 0 HD11 LEU A 80 11.519 20.888 -16.667 1.00 11.31 H new ATOM 0 HD12 LEU A 80 12.573 22.320 -16.734 1.00 11.31 H new ATOM 0 HD13 LEU A 80 12.862 21.060 -15.512 1.00 11.31 H new ATOM 0 HD21 LEU A 80 9.890 20.620 -14.833 1.00 12.43 H new ATOM 0 HD22 LEU A 80 11.171 20.782 -13.608 1.00 12.43 H new ATOM 0 HD23 LEU A 80 9.755 21.858 -13.561 1.00 12.43 H new ATOM 1212 N ASN A 81 12.560 26.126 -13.172 1.00 74.25 N ATOM 1213 CA ASN A 81 12.172 27.328 -12.443 1.00 31.41 C ATOM 1214 C ASN A 81 12.277 28.562 -13.333 1.00 51.12 C ATOM 1215 O ASN A 81 11.317 29.319 -13.479 1.00 31.34 O ATOM 1216 CB ASN A 81 13.051 27.503 -11.203 1.00 64.22 C ATOM 1217 CG ASN A 81 12.257 27.943 -9.989 1.00 4.05 C ATOM 1218 OD1 ASN A 81 12.353 29.091 -9.553 1.00 73.34 O ATOM 1219 ND2 ASN A 81 11.469 27.030 -9.435 1.00 35.43 N ATOM 0 H ASN A 81 13.265 25.558 -12.703 1.00 74.25 H new ATOM 0 HA ASN A 81 11.134 27.215 -12.131 1.00 31.41 H new ATOM 0 HB2 ASN A 81 13.555 26.562 -10.983 1.00 64.22 H new ATOM 0 HB3 ASN A 81 13.827 28.239 -11.412 1.00 64.22 H new ATOM 0 HD21 ASN A 81 10.912 27.268 -8.614 1.00 35.43 H new ATOM 0 HD22 ASN A 81 11.421 26.091 -9.830 1.00 35.43 H new ATOM 1226 N SER A 82 13.450 28.759 -13.927 1.00 74.42 N ATOM 1227 CA SER A 82 13.682 29.903 -14.801 1.00 33.20 C ATOM 1228 C SER A 82 12.609 29.987 -15.883 1.00 31.34 C ATOM 1229 O SER A 82 11.988 31.032 -16.077 1.00 31.14 O ATOM 1230 CB SER A 82 15.066 29.806 -15.446 1.00 13.41 C ATOM 1231 OG SER A 82 15.878 30.907 -15.076 1.00 63.12 O ATOM 0 H SER A 82 14.254 28.141 -13.819 1.00 74.42 H new ATOM 0 HA SER A 82 13.634 30.808 -14.195 1.00 33.20 H new ATOM 0 HB2 SER A 82 15.548 28.876 -15.143 1.00 13.41 H new ATOM 0 HB3 SER A 82 14.964 29.773 -16.531 1.00 13.41 H new ATOM 0 HG SER A 82 16.758 30.821 -15.499 1.00 63.12 H new ATOM 1237 N ASP A 83 12.397 28.879 -16.584 1.00 21.41 N ATOM 1238 CA ASP A 83 11.399 28.825 -17.646 1.00 20.12 C ATOM 1239 C ASP A 83 10.046 29.320 -17.145 1.00 52.32 C ATOM 1240 O ASP A 83 9.287 29.943 -17.889 1.00 75.42 O ATOM 1241 CB ASP A 83 11.268 27.398 -18.180 1.00 31.32 C ATOM 1242 CG ASP A 83 12.542 26.906 -18.837 1.00 44.12 C ATOM 1243 OD1 ASP A 83 13.559 27.629 -18.775 1.00 55.11 O ATOM 1244 OD2 ASP A 83 12.524 25.799 -19.415 1.00 33.33 O ATOM 0 H ASP A 83 12.903 28.006 -16.436 1.00 21.41 H new ATOM 0 HA ASP A 83 11.728 29.478 -18.454 1.00 20.12 H new ATOM 0 HB2 ASP A 83 11.004 26.730 -17.361 1.00 31.32 H new ATOM 0 HB3 ASP A 83 10.452 27.357 -18.901 1.00 31.32 H new ATOM 1249 N LEU A 84 9.750 29.040 -15.881 1.00 74.51 N ATOM 1250 CA LEU A 84 8.487 29.456 -15.281 1.00 31.45 C ATOM 1251 C LEU A 84 8.345 30.974 -15.308 1.00 2.12 C ATOM 1252 O LEU A 84 7.480 31.514 -15.996 1.00 43.45 O ATOM 1253 CB LEU A 84 8.393 28.949 -13.840 1.00 41.02 C ATOM 1254 CG LEU A 84 6.981 28.779 -13.279 1.00 72.12 C ATOM 1255 CD1 LEU A 84 6.276 30.124 -13.190 1.00 61.44 C ATOM 1256 CD2 LEU A 84 6.179 27.810 -14.137 1.00 4.32 C ATOM 0 H LEU A 84 10.367 28.527 -15.252 1.00 74.51 H new ATOM 0 HA LEU A 84 7.675 29.023 -15.866 1.00 31.45 H new ATOM 0 HB2 LEU A 84 8.904 27.988 -13.780 1.00 41.02 H new ATOM 0 HB3 LEU A 84 8.937 29.640 -13.197 1.00 41.02 H new ATOM 0 HG LEU A 84 7.058 28.365 -12.274 1.00 72.12 H new ATOM 0 HD11 LEU A 84 5.272 29.983 -12.789 1.00 61.44 H new ATOM 0 HD12 LEU A 84 6.839 30.787 -12.534 1.00 61.44 H new ATOM 0 HD13 LEU A 84 6.210 30.567 -14.184 1.00 61.44 H new ATOM 0 HD21 LEU A 84 5.177 27.701 -13.723 1.00 4.32 H new ATOM 0 HD22 LEU A 84 6.111 28.195 -15.154 1.00 4.32 H new ATOM 0 HD23 LEU A 84 6.674 26.839 -14.149 1.00 4.32 H new ATOM 1268 N ALA A 85 9.202 31.657 -14.555 1.00 61.25 N ATOM 1269 CA ALA A 85 9.175 33.113 -14.497 1.00 22.03 C ATOM 1270 C ALA A 85 9.272 33.721 -15.892 1.00 74.51 C ATOM 1271 O ALA A 85 8.635 34.732 -16.183 1.00 53.31 O ATOM 1272 CB ALA A 85 10.305 33.627 -13.616 1.00 72.42 C ATOM 0 H ALA A 85 9.923 31.225 -13.977 1.00 61.25 H new ATOM 0 HA ALA A 85 8.222 33.416 -14.063 1.00 22.03 H new ATOM 0 HB1 ALA A 85 10.273 34.716 -13.582 1.00 72.42 H new ATOM 0 HB2 ALA A 85 10.190 33.229 -12.608 1.00 72.42 H new ATOM 0 HB3 ALA A 85 11.262 33.305 -14.027 1.00 72.42 H new ATOM 1278 N GLU A 86 10.072 33.097 -16.750 1.00 64.53 N ATOM 1279 CA GLU A 86 10.252 33.578 -18.115 1.00 3.22 C ATOM 1280 C GLU A 86 8.949 33.481 -18.902 1.00 51.14 C ATOM 1281 O GLU A 86 8.556 34.422 -19.594 1.00 2.05 O ATOM 1282 CB GLU A 86 11.349 32.778 -18.821 1.00 53.13 C ATOM 1283 CG GLU A 86 12.203 33.614 -19.760 1.00 71.51 C ATOM 1284 CD GLU A 86 13.286 34.386 -19.032 1.00 34.12 C ATOM 1285 OE1 GLU A 86 12.960 35.070 -18.039 1.00 32.23 O ATOM 1286 OE2 GLU A 86 14.458 34.307 -19.454 1.00 51.14 O ATOM 0 H GLU A 86 10.606 32.258 -16.525 1.00 64.53 H new ATOM 0 HA GLU A 86 10.550 34.625 -18.068 1.00 3.22 H new ATOM 0 HB2 GLU A 86 11.992 32.319 -18.070 1.00 53.13 H new ATOM 0 HB3 GLU A 86 10.889 31.967 -19.386 1.00 53.13 H new ATOM 0 HG2 GLU A 86 12.663 32.963 -20.503 1.00 71.51 H new ATOM 0 HG3 GLU A 86 11.565 34.313 -20.300 1.00 71.51 H new ATOM 1293 N LEU A 87 8.283 32.337 -18.794 1.00 31.14 N ATOM 1294 CA LEU A 87 7.023 32.115 -19.495 1.00 44.04 C ATOM 1295 C LEU A 87 5.938 33.054 -18.977 1.00 65.31 C ATOM 1296 O LEU A 87 5.357 33.826 -19.739 1.00 55.23 O ATOM 1297 CB LEU A 87 6.576 30.661 -19.334 1.00 11.24 C ATOM 1298 CG LEU A 87 5.686 30.105 -20.446 1.00 14.34 C ATOM 1299 CD1 LEU A 87 4.367 30.861 -20.502 1.00 43.42 C ATOM 1300 CD2 LEU A 87 6.401 30.176 -21.787 1.00 31.31 C ATOM 0 H LEU A 87 8.595 31.548 -18.227 1.00 31.14 H new ATOM 0 HA LEU A 87 7.183 32.324 -20.553 1.00 44.04 H new ATOM 0 HB2 LEU A 87 7.465 30.035 -19.260 1.00 11.24 H new ATOM 0 HB3 LEU A 87 6.042 30.569 -18.388 1.00 11.24 H new ATOM 0 HG LEU A 87 5.473 29.059 -20.226 1.00 14.34 H new ATOM 0 HD11 LEU A 87 3.747 30.452 -21.299 1.00 43.42 H new ATOM 0 HD12 LEU A 87 3.848 30.758 -19.549 1.00 43.42 H new ATOM 0 HD13 LEU A 87 4.560 31.916 -20.698 1.00 43.42 H new ATOM 0 HD21 LEU A 87 5.753 29.776 -22.567 1.00 31.31 H new ATOM 0 HD22 LEU A 87 6.645 31.214 -22.015 1.00 31.31 H new ATOM 0 HD23 LEU A 87 7.318 29.589 -21.742 1.00 31.31 H new ATOM 1312 N ILE A 88 5.673 32.982 -17.677 1.00 45.51 N ATOM 1313 CA ILE A 88 4.661 33.828 -17.057 1.00 2.21 C ATOM 1314 C ILE A 88 4.941 35.304 -17.321 1.00 32.12 C ATOM 1315 O ILE A 88 4.021 36.117 -17.393 1.00 75.04 O ATOM 1316 CB ILE A 88 4.587 33.595 -15.536 1.00 45.23 C ATOM 1317 CG1 ILE A 88 4.378 32.110 -15.236 1.00 34.25 C ATOM 1318 CG2 ILE A 88 3.470 34.428 -14.926 1.00 73.25 C ATOM 1319 CD1 ILE A 88 3.114 31.543 -15.844 1.00 20.22 C ATOM 0 H ILE A 88 6.145 32.347 -17.033 1.00 45.51 H new ATOM 0 HA ILE A 88 3.705 33.556 -17.505 1.00 2.21 H new ATOM 0 HB ILE A 88 5.531 33.907 -15.089 1.00 45.23 H new ATOM 0 HG12 ILE A 88 5.235 31.548 -15.609 1.00 34.25 H new ATOM 0 HG13 ILE A 88 4.348 31.966 -14.156 1.00 34.25 H new ATOM 0 HG21 ILE A 88 3.431 34.252 -13.851 1.00 73.25 H new ATOM 0 HG22 ILE A 88 3.660 35.485 -15.114 1.00 73.25 H new ATOM 0 HG23 ILE A 88 2.518 34.145 -15.375 1.00 73.25 H new ATOM 0 HD11 ILE A 88 3.031 30.486 -15.591 1.00 20.22 H new ATOM 0 HD12 ILE A 88 2.250 32.079 -15.452 1.00 20.22 H new ATOM 0 HD13 ILE A 88 3.150 31.655 -16.928 1.00 20.22 H new ATOM 1331 N ASN A 89 6.218 35.642 -17.465 1.00 61.13 N ATOM 1332 CA ASN A 89 6.620 37.020 -17.723 1.00 15.11 C ATOM 1333 C ASN A 89 6.057 37.511 -19.053 1.00 60.14 C ATOM 1334 O ASN A 89 5.246 38.437 -19.094 1.00 64.30 O ATOM 1335 CB ASN A 89 8.145 37.136 -17.727 1.00 41.43 C ATOM 1336 CG ASN A 89 8.626 38.411 -18.394 1.00 12.14 C ATOM 1337 OD1 ASN A 89 8.390 39.512 -17.896 1.00 13.03 O ATOM 1338 ND2 ASN A 89 9.304 38.267 -19.526 1.00 50.12 N ATOM 0 H ASN A 89 6.992 34.981 -17.407 1.00 61.13 H new ATOM 0 HA ASN A 89 6.217 37.645 -16.926 1.00 15.11 H new ATOM 0 HB2 ASN A 89 8.512 37.105 -16.701 1.00 41.43 H new ATOM 0 HB3 ASN A 89 8.571 36.276 -18.244 1.00 41.43 H new ATOM 0 HD21 ASN A 89 9.653 39.089 -20.020 1.00 50.12 H new ATOM 0 HD22 ASN A 89 9.476 37.335 -19.902 1.00 50.12 H new ATOM 1345 N LYS A 90 6.492 36.884 -20.141 1.00 23.21 N ATOM 1346 CA LYS A 90 6.032 37.254 -21.474 1.00 20.10 C ATOM 1347 C LYS A 90 4.514 37.144 -21.575 1.00 61.35 C ATOM 1348 O LYS A 90 3.845 38.067 -22.039 1.00 63.12 O ATOM 1349 CB LYS A 90 6.690 36.362 -22.529 1.00 44.11 C ATOM 1350 CG LYS A 90 6.335 36.743 -23.956 1.00 15.44 C ATOM 1351 CD LYS A 90 7.569 36.814 -24.839 1.00 22.15 C ATOM 1352 CE LYS A 90 7.951 35.442 -25.374 1.00 13.23 C ATOM 1353 NZ LYS A 90 9.285 35.456 -26.036 1.00 14.44 N ATOM 0 H LYS A 90 7.163 36.116 -20.125 1.00 23.21 H new ATOM 0 HA LYS A 90 6.317 38.290 -21.655 1.00 20.10 H new ATOM 0 HB2 LYS A 90 7.772 36.409 -22.408 1.00 44.11 H new ATOM 0 HB3 LYS A 90 6.394 35.328 -22.354 1.00 44.11 H new ATOM 0 HG2 LYS A 90 5.636 36.014 -24.365 1.00 15.44 H new ATOM 0 HG3 LYS A 90 5.828 37.708 -23.960 1.00 15.44 H new ATOM 0 HD2 LYS A 90 7.383 37.492 -25.672 1.00 22.15 H new ATOM 0 HD3 LYS A 90 8.401 37.229 -24.270 1.00 22.15 H new ATOM 0 HE2 LYS A 90 7.960 34.723 -24.555 1.00 13.23 H new ATOM 0 HE3 LYS A 90 7.196 35.107 -26.085 1.00 13.23 H new ATOM 0 HZ1 LYS A 90 9.508 34.503 -26.387 1.00 14.44 H new ATOM 0 HZ2 LYS A 90 9.270 36.124 -26.833 1.00 14.44 H new ATOM 0 HZ3 LYS A 90 10.009 35.751 -25.351 1.00 14.44 H new ATOM 1367 N MET A 91 3.977 36.010 -21.138 1.00 30.33 N ATOM 1368 CA MET A 91 2.537 35.781 -21.177 1.00 42.23 C ATOM 1369 C MET A 91 1.790 36.890 -20.443 1.00 44.21 C ATOM 1370 O MET A 91 0.734 37.340 -20.886 1.00 54.24 O ATOM 1371 CB MET A 91 2.197 34.424 -20.557 1.00 43.43 C ATOM 1372 CG MET A 91 1.518 33.468 -21.524 1.00 22.32 C ATOM 1373 SD MET A 91 -0.210 33.168 -21.105 1.00 63.31 S ATOM 1374 CE MET A 91 -0.796 34.843 -20.866 1.00 2.25 C ATOM 0 H MET A 91 4.517 35.235 -20.753 1.00 30.33 H new ATOM 0 HA MET A 91 2.222 35.784 -22.221 1.00 42.23 H new ATOM 0 HB2 MET A 91 3.113 33.963 -20.186 1.00 43.43 H new ATOM 0 HB3 MET A 91 1.547 34.580 -19.696 1.00 43.43 H new ATOM 0 HG2 MET A 91 1.578 33.875 -22.533 1.00 22.32 H new ATOM 0 HG3 MET A 91 2.056 32.520 -21.530 1.00 22.32 H new ATOM 0 HE1 MET A 91 -1.885 34.846 -20.830 1.00 2.25 H new ATOM 0 HE2 MET A 91 -0.401 35.236 -19.929 1.00 2.25 H new ATOM 0 HE3 MET A 91 -0.459 35.468 -21.693 1.00 2.25 H new ATOM 1384 N LYS A 92 2.346 37.327 -19.318 1.00 32.01 N ATOM 1385 CA LYS A 92 1.734 38.384 -18.522 1.00 15.11 C ATOM 1386 C LYS A 92 1.633 39.679 -19.322 1.00 62.10 C ATOM 1387 O LYS A 92 0.692 40.455 -19.151 1.00 3.21 O ATOM 1388 CB LYS A 92 2.542 38.623 -17.245 1.00 23.32 C ATOM 1389 CG LYS A 92 2.065 37.801 -16.060 1.00 72.21 C ATOM 1390 CD LYS A 92 2.958 37.999 -14.847 1.00 43.52 C ATOM 1391 CE LYS A 92 2.817 39.401 -14.274 1.00 40.44 C ATOM 1392 NZ LYS A 92 3.980 40.263 -14.623 1.00 44.03 N ATOM 0 H LYS A 92 3.220 36.965 -18.937 1.00 32.01 H new ATOM 0 HA LYS A 92 0.727 38.064 -18.253 1.00 15.11 H new ATOM 0 HB2 LYS A 92 3.589 38.391 -17.439 1.00 23.32 H new ATOM 0 HB3 LYS A 92 2.492 39.681 -16.986 1.00 23.32 H new ATOM 0 HG2 LYS A 92 1.042 38.082 -15.809 1.00 72.21 H new ATOM 0 HG3 LYS A 92 2.048 36.746 -16.332 1.00 72.21 H new ATOM 0 HD2 LYS A 92 2.703 37.265 -14.083 1.00 43.52 H new ATOM 0 HD3 LYS A 92 3.997 37.821 -15.126 1.00 43.52 H new ATOM 0 HE2 LYS A 92 1.901 39.857 -14.651 1.00 40.44 H new ATOM 0 HE3 LYS A 92 2.721 39.342 -13.190 1.00 40.44 H new ATOM 0 HZ1 LYS A 92 3.846 41.210 -14.214 1.00 44.03 H new ATOM 0 HZ2 LYS A 92 4.851 39.842 -14.242 1.00 44.03 H new ATOM 0 HZ3 LYS A 92 4.057 40.340 -15.657 1.00 44.03 H new ATOM 1406 N LEU A 93 2.607 39.905 -20.197 1.00 1.44 N ATOM 1407 CA LEU A 93 2.628 41.106 -21.025 1.00 14.00 C ATOM 1408 C LEU A 93 1.473 41.100 -22.022 1.00 21.42 C ATOM 1409 O LEU A 93 0.740 42.080 -22.144 1.00 41.40 O ATOM 1410 CB LEU A 93 3.959 41.213 -21.770 1.00 63.41 C ATOM 1411 CG LEU A 93 5.209 41.334 -20.897 1.00 70.34 C ATOM 1412 CD1 LEU A 93 6.458 41.411 -21.761 1.00 40.44 C ATOM 1413 CD2 LEU A 93 5.110 42.551 -19.990 1.00 14.13 C ATOM 0 H LEU A 93 3.392 39.273 -20.351 1.00 1.44 H new ATOM 0 HA LEU A 93 2.515 41.970 -20.371 1.00 14.00 H new ATOM 0 HB2 LEU A 93 4.068 40.335 -22.406 1.00 63.41 H new ATOM 0 HB3 LEU A 93 3.915 42.080 -22.429 1.00 63.41 H new ATOM 0 HG LEU A 93 5.279 40.444 -20.271 1.00 70.34 H new ATOM 0 HD11 LEU A 93 7.337 41.497 -21.123 1.00 40.44 H new ATOM 0 HD12 LEU A 93 6.537 40.509 -22.368 1.00 40.44 H new ATOM 0 HD13 LEU A 93 6.396 42.283 -22.413 1.00 40.44 H new ATOM 0 HD21 LEU A 93 6.008 42.621 -19.376 1.00 14.13 H new ATOM 0 HD22 LEU A 93 5.015 43.451 -20.598 1.00 14.13 H new ATOM 0 HD23 LEU A 93 4.236 42.454 -19.345 1.00 14.13 H new ATOM 1425 N ALA A 94 1.317 39.986 -22.731 1.00 15.42 N ATOM 1426 CA ALA A 94 0.249 39.851 -23.714 1.00 33.43 C ATOM 1427 C ALA A 94 -1.108 40.179 -23.100 1.00 3.45 C ATOM 1428 O ALA A 94 -1.950 40.811 -23.737 1.00 32.05 O ATOM 1429 CB ALA A 94 0.241 38.444 -24.293 1.00 72.13 C ATOM 0 H ALA A 94 1.916 39.165 -22.643 1.00 15.42 H new ATOM 0 HA ALA A 94 0.436 40.563 -24.518 1.00 33.43 H new ATOM 0 HB1 ALA A 94 -0.561 38.357 -25.026 1.00 72.13 H new ATOM 0 HB2 ALA A 94 1.197 38.244 -24.776 1.00 72.13 H new ATOM 0 HB3 ALA A 94 0.081 37.722 -23.492 1.00 72.13 H new ATOM 1435 N GLN A 95 -1.311 39.746 -21.860 1.00 14.34 N ATOM 1436 CA GLN A 95 -2.567 39.994 -21.161 1.00 0.11 C ATOM 1437 C GLN A 95 -2.868 41.488 -21.095 1.00 62.14 C ATOM 1438 O GLN A 95 -4.027 41.893 -21.010 1.00 44.33 O ATOM 1439 CB GLN A 95 -2.513 39.410 -19.748 1.00 42.31 C ATOM 1440 CG GLN A 95 -3.811 39.571 -18.973 1.00 63.02 C ATOM 1441 CD GLN A 95 -4.307 38.263 -18.388 1.00 3.41 C ATOM 1442 OE1 GLN A 95 -3.527 37.340 -18.151 1.00 42.43 O ATOM 1443 NE2 GLN A 95 -5.610 38.177 -18.151 1.00 14.53 N ATOM 0 H GLN A 95 -0.623 39.222 -21.319 1.00 14.34 H new ATOM 0 HA GLN A 95 -3.366 39.505 -21.718 1.00 0.11 H new ATOM 0 HB2 GLN A 95 -2.266 38.350 -19.811 1.00 42.31 H new ATOM 0 HB3 GLN A 95 -1.707 39.892 -19.195 1.00 42.31 H new ATOM 0 HG2 GLN A 95 -3.663 40.291 -18.169 1.00 63.02 H new ATOM 0 HG3 GLN A 95 -4.575 39.983 -19.633 1.00 63.02 H new ATOM 0 HE21 GLN A 95 -6.220 38.967 -18.363 1.00 14.53 H new ATOM 0 HE22 GLN A 95 -6.001 37.321 -17.757 1.00 14.53 H new ATOM 1452 N GLN A 96 -1.817 42.300 -21.135 1.00 42.42 N ATOM 1453 CA GLN A 96 -1.970 43.749 -21.079 1.00 44.42 C ATOM 1454 C GLN A 96 -1.850 44.364 -22.470 1.00 25.31 C ATOM 1455 O GLN A 96 -2.382 45.442 -22.731 1.00 55.41 O ATOM 1456 CB GLN A 96 -0.920 44.358 -20.147 1.00 53.44 C ATOM 1457 CG GLN A 96 -1.501 44.913 -18.857 1.00 33.44 C ATOM 1458 CD GLN A 96 -0.489 44.947 -17.728 1.00 72.05 C ATOM 1459 OE1 GLN A 96 -0.638 44.251 -16.724 1.00 32.40 O ATOM 1460 NE2 GLN A 96 0.549 45.760 -17.889 1.00 33.45 N ATOM 0 H GLN A 96 -0.851 41.980 -21.206 1.00 42.42 H new ATOM 0 HA GLN A 96 -2.964 43.969 -20.689 1.00 44.42 H new ATOM 0 HB2 GLN A 96 -0.177 43.598 -19.904 1.00 53.44 H new ATOM 0 HB3 GLN A 96 -0.398 45.157 -20.674 1.00 53.44 H new ATOM 0 HG2 GLN A 96 -1.874 45.921 -19.035 1.00 33.44 H new ATOM 0 HG3 GLN A 96 -2.355 44.305 -18.556 1.00 33.44 H new ATOM 0 HE21 GLN A 96 0.632 46.319 -18.738 1.00 33.45 H new ATOM 0 HE22 GLN A 96 1.263 45.825 -17.163 1.00 33.45 H new ATOM 1469 N TYR A 97 -1.146 43.671 -23.358 1.00 73.45 N ATOM 1470 CA TYR A 97 -0.954 44.149 -24.722 1.00 42.42 C ATOM 1471 C TYR A 97 -1.982 43.533 -25.666 1.00 43.02 C ATOM 1472 O TYR A 97 -1.742 43.407 -26.867 1.00 71.11 O ATOM 1473 CB TYR A 97 0.460 43.822 -25.205 1.00 70.43 C ATOM 1474 CG TYR A 97 1.494 44.842 -24.788 1.00 5.22 C ATOM 1475 CD1 TYR A 97 1.636 46.040 -25.478 1.00 33.23 C ATOM 1476 CD2 TYR A 97 2.330 44.609 -23.702 1.00 41.04 C ATOM 1477 CE1 TYR A 97 2.580 46.975 -25.100 1.00 60.41 C ATOM 1478 CE2 TYR A 97 3.276 45.539 -23.317 1.00 23.23 C ATOM 1479 CZ TYR A 97 3.398 46.720 -24.019 1.00 32.31 C ATOM 1480 OH TYR A 97 4.339 47.649 -23.639 1.00 13.03 O ATOM 0 H TYR A 97 -0.699 42.776 -23.158 1.00 73.45 H new ATOM 0 HA TYR A 97 -1.090 45.230 -24.723 1.00 42.42 H new ATOM 0 HB2 TYR A 97 0.750 42.845 -24.819 1.00 70.43 H new ATOM 0 HB3 TYR A 97 0.455 43.746 -26.292 1.00 70.43 H new ATOM 0 HD1 TYR A 97 0.997 46.244 -26.325 1.00 33.23 H new ATOM 0 HD2 TYR A 97 2.238 43.685 -23.150 1.00 41.04 H new ATOM 0 HE1 TYR A 97 2.677 47.901 -25.648 1.00 60.41 H new ATOM 0 HE2 TYR A 97 3.917 45.342 -22.470 1.00 23.23 H new ATOM 0 HH TYR A 97 4.831 47.316 -22.860 1.00 13.03 H new ATOM 1490 N VAL A 98 -3.129 43.151 -25.114 1.00 23.24 N ATOM 1491 CA VAL A 98 -4.195 42.549 -25.905 1.00 13.13 C ATOM 1492 C VAL A 98 -5.396 43.482 -26.008 1.00 54.30 C ATOM 1493 O VAL A 98 -6.102 43.493 -27.016 1.00 44.35 O ATOM 1494 CB VAL A 98 -4.652 41.207 -25.302 1.00 52.14 C ATOM 1495 CG1 VAL A 98 -5.076 41.389 -23.853 1.00 21.12 C ATOM 1496 CG2 VAL A 98 -5.784 40.611 -26.126 1.00 44.45 C ATOM 0 H VAL A 98 -3.344 43.248 -24.122 1.00 23.24 H new ATOM 0 HA VAL A 98 -3.789 42.372 -26.901 1.00 13.13 H new ATOM 0 HB VAL A 98 -3.811 40.513 -25.325 1.00 52.14 H new ATOM 0 HG11 VAL A 98 -5.395 40.430 -23.444 1.00 21.12 H new ATOM 0 HG12 VAL A 98 -4.235 41.769 -23.273 1.00 21.12 H new ATOM 0 HG13 VAL A 98 -5.902 42.099 -23.802 1.00 21.12 H new ATOM 0 HG21 VAL A 98 -6.095 39.663 -25.686 1.00 44.45 H new ATOM 0 HG22 VAL A 98 -6.628 41.300 -26.136 1.00 44.45 H new ATOM 0 HG23 VAL A 98 -5.441 40.442 -27.147 1.00 44.45 H new ATOM 1506 N MET A 99 -5.623 44.265 -24.958 1.00 63.10 N ATOM 1507 CA MET A 99 -6.738 45.204 -24.932 1.00 32.25 C ATOM 1508 C MET A 99 -6.478 46.384 -25.863 1.00 31.33 C ATOM 1509 O MET A 99 -7.408 47.072 -26.285 1.00 1.12 O ATOM 1510 CB MET A 99 -6.976 45.707 -23.506 1.00 63.33 C ATOM 1511 CG MET A 99 -5.933 46.706 -23.033 1.00 0.31 C ATOM 1512 SD MET A 99 -5.292 46.317 -21.393 1.00 42.22 S ATOM 1513 CE MET A 99 -3.906 47.448 -21.294 1.00 54.13 C ATOM 0 H MET A 99 -5.050 44.268 -24.114 1.00 63.10 H new ATOM 0 HA MET A 99 -7.629 44.681 -25.279 1.00 32.25 H new ATOM 0 HB2 MET A 99 -7.961 46.170 -23.452 1.00 63.33 H new ATOM 0 HB3 MET A 99 -6.986 44.855 -22.826 1.00 63.33 H new ATOM 0 HG2 MET A 99 -5.108 46.729 -23.745 1.00 0.31 H new ATOM 0 HG3 MET A 99 -6.371 47.704 -23.020 1.00 0.31 H new ATOM 0 HE1 MET A 99 -3.063 46.949 -20.817 1.00 54.13 H new ATOM 0 HE2 MET A 99 -3.621 47.763 -22.298 1.00 54.13 H new ATOM 0 HE3 MET A 99 -4.190 48.321 -20.707 1.00 54.13 H new ATOM 1523 N THR A 100 -5.207 46.613 -26.180 1.00 34.22 N ATOM 1524 CA THR A 100 -4.825 47.710 -27.060 1.00 12.04 C ATOM 1525 C THR A 100 -5.095 47.364 -28.519 1.00 70.14 C ATOM 1526 O THR A 100 -6.039 47.873 -29.124 1.00 32.44 O ATOM 1527 CB THR A 100 -3.336 48.069 -26.896 1.00 32.23 C ATOM 1528 OG1 THR A 100 -3.076 48.476 -25.548 1.00 0.51 O ATOM 1529 CG2 THR A 100 -2.939 49.182 -27.853 1.00 53.32 C ATOM 0 H THR A 100 -4.425 46.053 -25.840 1.00 34.22 H new ATOM 0 HA THR A 100 -5.432 48.570 -26.775 1.00 12.04 H new ATOM 0 HB THR A 100 -2.744 47.184 -27.128 1.00 32.23 H new ATOM 0 HG1 THR A 100 -2.127 48.701 -25.451 1.00 0.51 H new ATOM 0 HG21 THR A 100 -1.883 49.418 -27.719 1.00 53.32 H new ATOM 0 HG22 THR A 100 -3.110 48.858 -28.879 1.00 53.32 H new ATOM 0 HG23 THR A 100 -3.538 50.069 -27.648 1.00 53.32 H new ATOM 1537 N SER A 101 -4.260 46.495 -29.081 1.00 34.12 N ATOM 1538 CA SER A 101 -4.408 46.083 -30.472 1.00 4.01 C ATOM 1539 C SER A 101 -3.329 45.075 -30.857 1.00 34.42 C ATOM 1540 O SER A 101 -3.572 44.159 -31.645 1.00 5.41 O ATOM 1541 CB SER A 101 -4.337 47.300 -31.396 1.00 72.14 C ATOM 1542 OG SER A 101 -3.758 46.960 -32.644 1.00 61.31 O ATOM 0 H SER A 101 -3.474 46.063 -28.594 1.00 34.12 H new ATOM 0 HA SER A 101 -5.382 45.607 -30.583 1.00 4.01 H new ATOM 0 HB2 SER A 101 -5.339 47.700 -31.553 1.00 72.14 H new ATOM 0 HB3 SER A 101 -3.750 48.087 -30.922 1.00 72.14 H new ATOM 0 HG SER A 101 -3.726 47.754 -33.217 1.00 61.31 H new ATOM 1548 N LEU A 102 -2.138 45.249 -30.295 1.00 71.23 N ATOM 1549 CA LEU A 102 -1.021 44.355 -30.579 1.00 23.34 C ATOM 1550 C LEU A 102 -1.173 43.037 -29.825 1.00 1.30 C ATOM 1551 O LEU A 102 -0.363 42.711 -28.958 1.00 13.15 O ATOM 1552 CB LEU A 102 0.302 45.023 -30.199 1.00 33.14 C ATOM 1553 CG LEU A 102 0.404 46.521 -30.488 1.00 22.15 C ATOM 1554 CD1 LEU A 102 1.803 47.030 -30.176 1.00 12.31 C ATOM 1555 CD2 LEU A 102 0.039 46.811 -31.936 1.00 65.22 C ATOM 0 H LEU A 102 -1.921 46.001 -29.640 1.00 71.23 H new ATOM 0 HA LEU A 102 -1.020 44.143 -31.648 1.00 23.34 H new ATOM 0 HB2 LEU A 102 0.472 44.866 -29.134 1.00 33.14 H new ATOM 0 HB3 LEU A 102 1.108 44.515 -30.729 1.00 33.14 H new ATOM 0 HG LEU A 102 -0.303 47.045 -29.845 1.00 22.15 H new ATOM 0 HD11 LEU A 102 1.857 48.098 -30.388 1.00 12.31 H new ATOM 0 HD12 LEU A 102 2.027 46.857 -29.123 1.00 12.31 H new ATOM 0 HD13 LEU A 102 2.529 46.501 -30.793 1.00 12.31 H new ATOM 0 HD21 LEU A 102 0.117 47.882 -32.123 1.00 65.22 H new ATOM 0 HD22 LEU A 102 0.721 46.276 -32.597 1.00 65.22 H new ATOM 0 HD23 LEU A 102 -0.983 46.483 -32.126 1.00 65.22 H new ATOM 1567 N GLN A 103 -2.214 42.284 -30.164 1.00 53.33 N ATOM 1568 CA GLN A 103 -2.471 41.002 -29.520 1.00 60.52 C ATOM 1569 C GLN A 103 -1.861 39.857 -30.324 1.00 13.55 C ATOM 1570 O GLN A 103 -1.090 39.058 -29.794 1.00 71.22 O ATOM 1571 CB GLN A 103 -3.976 40.781 -29.357 1.00 62.23 C ATOM 1572 CG GLN A 103 -4.330 39.440 -28.735 1.00 72.34 C ATOM 1573 CD GLN A 103 -5.808 39.119 -28.843 1.00 61.32 C ATOM 1574 OE1 GLN A 103 -6.618 39.978 -29.192 1.00 2.11 O ATOM 1575 NE2 GLN A 103 -6.167 37.876 -28.544 1.00 33.12 N ATOM 0 H GLN A 103 -2.893 42.540 -30.881 1.00 53.33 H new ATOM 0 HA GLN A 103 -2.005 41.019 -28.535 1.00 60.52 H new ATOM 0 HB2 GLN A 103 -4.387 41.579 -28.738 1.00 62.23 H new ATOM 0 HB3 GLN A 103 -4.454 40.857 -30.334 1.00 62.23 H new ATOM 0 HG2 GLN A 103 -3.755 38.654 -29.224 1.00 72.34 H new ATOM 0 HG3 GLN A 103 -4.038 39.442 -27.685 1.00 72.34 H new ATOM 0 HE21 GLN A 103 -5.462 37.196 -28.259 1.00 33.12 H new ATOM 0 HE22 GLN A 103 -7.148 37.601 -28.599 1.00 33.12 H new ATOM 1584 N GLN A 104 -2.213 39.786 -31.603 1.00 40.43 N ATOM 1585 CA GLN A 104 -1.701 38.739 -32.479 1.00 24.13 C ATOM 1586 C GLN A 104 -0.178 38.671 -32.413 1.00 34.31 C ATOM 1587 O GLN A 104 0.409 37.595 -32.524 1.00 51.13 O ATOM 1588 CB GLN A 104 -2.150 38.984 -33.920 1.00 50.51 C ATOM 1589 CG GLN A 104 -1.979 40.425 -34.374 1.00 1.34 C ATOM 1590 CD GLN A 104 -2.116 40.585 -35.875 1.00 21.21 C ATOM 1591 OE1 GLN A 104 -1.123 40.721 -36.590 1.00 25.04 O ATOM 1592 NE2 GLN A 104 -3.351 40.568 -36.362 1.00 12.40 N ATOM 0 H GLN A 104 -2.851 40.441 -32.056 1.00 40.43 H new ATOM 0 HA GLN A 104 -2.105 37.786 -32.138 1.00 24.13 H new ATOM 0 HB2 GLN A 104 -1.582 38.333 -34.584 1.00 50.51 H new ATOM 0 HB3 GLN A 104 -3.199 38.703 -34.018 1.00 50.51 H new ATOM 0 HG2 GLN A 104 -2.722 41.049 -33.877 1.00 1.34 H new ATOM 0 HG3 GLN A 104 -0.999 40.786 -34.062 1.00 1.34 H new ATOM 0 HE21 GLN A 104 -4.146 40.453 -35.733 1.00 12.40 H new ATOM 0 HE22 GLN A 104 -3.505 40.670 -37.365 1.00 12.40 H new ATOM 1601 N GLU A 105 0.454 39.826 -32.232 1.00 14.04 N ATOM 1602 CA GLU A 105 1.908 39.896 -32.152 1.00 50.14 C ATOM 1603 C GLU A 105 2.431 39.052 -30.994 1.00 21.31 C ATOM 1604 O GLU A 105 3.126 38.056 -31.201 1.00 53.51 O ATOM 1605 CB GLU A 105 2.362 41.348 -31.986 1.00 25.33 C ATOM 1606 CG GLU A 105 3.865 41.499 -31.814 1.00 15.23 C ATOM 1607 CD GLU A 105 4.389 42.801 -32.387 1.00 11.52 C ATOM 1608 OE1 GLU A 105 4.403 43.811 -31.652 1.00 21.22 O ATOM 1609 OE2 GLU A 105 4.785 42.811 -33.571 1.00 65.41 O ATOM 0 H GLU A 105 -0.018 40.725 -32.138 1.00 14.04 H new ATOM 0 HA GLU A 105 2.317 39.499 -33.081 1.00 50.14 H new ATOM 0 HB2 GLU A 105 2.045 41.921 -32.857 1.00 25.33 H new ATOM 0 HB3 GLU A 105 1.860 41.780 -31.120 1.00 25.33 H new ATOM 0 HG2 GLU A 105 4.113 41.447 -30.754 1.00 15.23 H new ATOM 0 HG3 GLU A 105 4.368 40.663 -32.300 1.00 15.23 H new ATOM 1616 N TYR A 106 2.093 39.456 -29.775 1.00 11.51 N ATOM 1617 CA TYR A 106 2.530 38.740 -28.583 1.00 23.22 C ATOM 1618 C TYR A 106 2.073 37.285 -28.623 1.00 60.13 C ATOM 1619 O TYR A 106 2.711 36.404 -28.046 1.00 1.30 O ATOM 1620 CB TYR A 106 1.989 39.421 -27.325 1.00 52.30 C ATOM 1621 CG TYR A 106 2.947 40.421 -26.718 1.00 12.21 C ATOM 1622 CD1 TYR A 106 4.114 40.003 -26.092 1.00 22.14 C ATOM 1623 CD2 TYR A 106 2.685 41.785 -26.772 1.00 33.23 C ATOM 1624 CE1 TYR A 106 4.992 40.913 -25.535 1.00 32.00 C ATOM 1625 CE2 TYR A 106 3.557 42.702 -26.219 1.00 44.21 C ATOM 1626 CZ TYR A 106 4.709 42.261 -25.601 1.00 42.45 C ATOM 1627 OH TYR A 106 5.582 43.171 -25.049 1.00 54.35 O ATOM 0 H TYR A 106 1.517 40.276 -29.586 1.00 11.51 H new ATOM 0 HA TYR A 106 3.620 38.760 -28.558 1.00 23.22 H new ATOM 0 HB2 TYR A 106 1.055 39.927 -27.569 1.00 52.30 H new ATOM 0 HB3 TYR A 106 1.754 38.659 -26.582 1.00 52.30 H new ATOM 0 HD1 TYR A 106 4.339 38.948 -26.040 1.00 22.14 H new ATOM 0 HD2 TYR A 106 1.784 42.134 -27.255 1.00 33.23 H new ATOM 0 HE1 TYR A 106 5.895 40.571 -25.051 1.00 32.00 H new ATOM 0 HE2 TYR A 106 3.338 43.758 -26.270 1.00 44.21 H new ATOM 0 HH TYR A 106 5.236 44.078 -25.182 1.00 54.35 H new ATOM 1637 N LYS A 107 0.963 37.040 -29.311 1.00 32.43 N ATOM 1638 CA LYS A 107 0.418 35.692 -29.430 1.00 43.24 C ATOM 1639 C LYS A 107 1.389 34.777 -30.171 1.00 14.23 C ATOM 1640 O LYS A 107 1.682 33.670 -29.719 1.00 14.01 O ATOM 1641 CB LYS A 107 -0.926 35.726 -30.161 1.00 42.23 C ATOM 1642 CG LYS A 107 -1.461 34.349 -30.514 1.00 50.35 C ATOM 1643 CD LYS A 107 -1.045 33.932 -31.915 1.00 73.21 C ATOM 1644 CE LYS A 107 -2.247 33.808 -32.839 1.00 62.34 C ATOM 1645 NZ LYS A 107 -1.953 32.948 -34.019 1.00 64.12 N ATOM 0 H LYS A 107 0.423 37.757 -29.795 1.00 32.43 H new ATOM 0 HA LYS A 107 0.268 35.297 -28.425 1.00 43.24 H new ATOM 0 HB2 LYS A 107 -1.656 36.242 -29.537 1.00 42.23 H new ATOM 0 HB3 LYS A 107 -0.818 36.310 -31.075 1.00 42.23 H new ATOM 0 HG2 LYS A 107 -1.095 33.619 -29.792 1.00 50.35 H new ATOM 0 HG3 LYS A 107 -2.549 34.351 -30.442 1.00 50.35 H new ATOM 0 HD2 LYS A 107 -0.346 34.663 -32.321 1.00 73.21 H new ATOM 0 HD3 LYS A 107 -0.519 32.979 -31.871 1.00 73.21 H new ATOM 0 HE2 LYS A 107 -3.089 33.391 -32.286 1.00 62.34 H new ATOM 0 HE3 LYS A 107 -2.548 34.799 -33.178 1.00 62.34 H new ATOM 0 HZ1 LYS A 107 -2.797 32.889 -34.624 1.00 64.12 H new ATOM 0 HZ2 LYS A 107 -1.167 33.359 -34.561 1.00 64.12 H new ATOM 0 HZ3 LYS A 107 -1.690 31.995 -33.697 1.00 64.12 H new ATOM 1659 N LYS A 108 1.885 35.247 -31.310 1.00 24.00 N ATOM 1660 CA LYS A 108 2.825 34.473 -32.112 1.00 61.13 C ATOM 1661 C LYS A 108 4.022 34.033 -31.275 1.00 32.01 C ATOM 1662 O LYS A 108 4.283 32.839 -31.129 1.00 54.21 O ATOM 1663 CB LYS A 108 3.303 35.296 -33.311 1.00 32.21 C ATOM 1664 CG LYS A 108 3.766 34.449 -34.484 1.00 53.41 C ATOM 1665 CD LYS A 108 3.581 35.178 -35.805 1.00 3.24 C ATOM 1666 CE LYS A 108 4.857 35.888 -36.232 1.00 54.41 C ATOM 1667 NZ LYS A 108 5.444 35.282 -37.459 1.00 4.43 N ATOM 0 H LYS A 108 1.652 36.161 -31.699 1.00 24.00 H new ATOM 0 HA LYS A 108 2.309 33.583 -32.472 1.00 61.13 H new ATOM 0 HB2 LYS A 108 2.493 35.947 -33.641 1.00 32.21 H new ATOM 0 HB3 LYS A 108 4.122 35.942 -32.994 1.00 32.21 H new ATOM 0 HG2 LYS A 108 4.817 34.190 -34.354 1.00 53.41 H new ATOM 0 HG3 LYS A 108 3.207 33.514 -34.502 1.00 53.41 H new ATOM 0 HD2 LYS A 108 3.283 34.467 -36.576 1.00 3.24 H new ATOM 0 HD3 LYS A 108 2.773 35.904 -35.712 1.00 3.24 H new ATOM 0 HE2 LYS A 108 4.643 36.941 -36.414 1.00 54.41 H new ATOM 0 HE3 LYS A 108 5.585 35.845 -35.422 1.00 54.41 H new ATOM 0 HZ1 LYS A 108 6.312 35.793 -37.718 1.00 4.43 H new ATOM 0 HZ2 LYS A 108 5.672 34.283 -37.278 1.00 4.43 H new ATOM 0 HZ3 LYS A 108 4.759 35.345 -38.239 1.00 4.43 H new ATOM 1681 N GLN A 109 4.744 35.005 -30.727 1.00 31.34 N ATOM 1682 CA GLN A 109 5.912 34.716 -29.903 1.00 42.12 C ATOM 1683 C GLN A 109 5.529 33.876 -28.690 1.00 13.05 C ATOM 1684 O GLN A 109 6.261 32.970 -28.294 1.00 32.52 O ATOM 1685 CB GLN A 109 6.576 36.017 -29.449 1.00 0.13 C ATOM 1686 CG GLN A 109 6.985 36.925 -30.597 1.00 52.13 C ATOM 1687 CD GLN A 109 7.290 38.339 -30.143 1.00 63.13 C ATOM 1688 OE1 GLN A 109 6.408 39.055 -29.668 1.00 43.05 O ATOM 1689 NE2 GLN A 109 8.545 38.749 -30.287 1.00 21.02 N ATOM 0 H GLN A 109 4.541 35.998 -30.838 1.00 31.34 H new ATOM 0 HA GLN A 109 6.619 34.147 -30.506 1.00 42.12 H new ATOM 0 HB2 GLN A 109 5.890 36.557 -28.797 1.00 0.13 H new ATOM 0 HB3 GLN A 109 7.458 35.777 -28.855 1.00 0.13 H new ATOM 0 HG2 GLN A 109 7.864 36.508 -31.089 1.00 52.13 H new ATOM 0 HG3 GLN A 109 6.186 36.950 -31.338 1.00 52.13 H new ATOM 0 HE21 GLN A 109 9.244 38.122 -30.686 1.00 21.02 H new ATOM 0 HE22 GLN A 109 8.810 39.691 -29.999 1.00 21.02 H new ATOM 1698 N MET A 110 4.377 34.184 -28.103 1.00 14.10 N ATOM 1699 CA MET A 110 3.896 33.456 -26.934 1.00 52.33 C ATOM 1700 C MET A 110 3.890 31.953 -27.195 1.00 12.25 C ATOM 1701 O MET A 110 4.466 31.178 -26.430 1.00 43.31 O ATOM 1702 CB MET A 110 2.490 33.926 -26.557 1.00 55.03 C ATOM 1703 CG MET A 110 1.829 33.070 -25.489 1.00 74.55 C ATOM 1704 SD MET A 110 0.446 32.106 -26.130 1.00 34.13 S ATOM 1705 CE MET A 110 1.071 30.440 -25.926 1.00 33.23 C ATOM 0 H MET A 110 3.759 34.932 -28.417 1.00 14.10 H new ATOM 0 HA MET A 110 4.574 33.660 -26.105 1.00 52.33 H new ATOM 0 HB2 MET A 110 2.543 34.956 -26.204 1.00 55.03 H new ATOM 0 HB3 MET A 110 1.864 33.926 -27.450 1.00 55.03 H new ATOM 0 HG2 MET A 110 2.570 32.395 -25.060 1.00 74.55 H new ATOM 0 HG3 MET A 110 1.476 33.711 -24.681 1.00 74.55 H new ATOM 0 HE1 MET A 110 0.531 29.765 -26.590 1.00 33.23 H new ATOM 0 HE2 MET A 110 2.133 30.417 -26.170 1.00 33.23 H new ATOM 0 HE3 MET A 110 0.930 30.122 -24.893 1.00 33.23 H new ATOM 1715 N LEU A 111 3.235 31.547 -28.277 1.00 11.43 N ATOM 1716 CA LEU A 111 3.154 30.136 -28.638 1.00 13.34 C ATOM 1717 C LEU A 111 4.545 29.522 -28.751 1.00 4.24 C ATOM 1718 O LEU A 111 4.782 28.404 -28.291 1.00 44.43 O ATOM 1719 CB LEU A 111 2.402 29.970 -29.959 1.00 55.01 C ATOM 1720 CG LEU A 111 1.600 28.677 -30.117 1.00 43.33 C ATOM 1721 CD1 LEU A 111 1.066 28.551 -31.535 1.00 71.35 C ATOM 1722 CD2 LEU A 111 2.457 27.472 -29.758 1.00 73.35 C ATOM 0 H LEU A 111 2.752 32.175 -28.920 1.00 11.43 H new ATOM 0 HA LEU A 111 2.610 29.615 -27.850 1.00 13.34 H new ATOM 0 HB2 LEU A 111 1.721 30.813 -30.075 1.00 55.01 H new ATOM 0 HB3 LEU A 111 3.123 30.029 -30.774 1.00 55.01 H new ATOM 0 HG LEU A 111 0.752 28.711 -29.433 1.00 43.33 H new ATOM 0 HD11 LEU A 111 0.498 27.625 -31.629 1.00 71.35 H new ATOM 0 HD12 LEU A 111 0.417 29.399 -31.756 1.00 71.35 H new ATOM 0 HD13 LEU A 111 1.899 28.538 -32.238 1.00 71.35 H new ATOM 0 HD21 LEU A 111 1.871 26.561 -29.876 1.00 73.35 H new ATOM 0 HD22 LEU A 111 3.325 27.433 -30.417 1.00 73.35 H new ATOM 0 HD23 LEU A 111 2.790 27.558 -28.724 1.00 73.35 H new ATOM 1734 N THR A 112 5.465 30.261 -29.364 1.00 11.33 N ATOM 1735 CA THR A 112 6.833 29.791 -29.536 1.00 63.42 C ATOM 1736 C THR A 112 7.421 29.313 -28.213 1.00 45.34 C ATOM 1737 O THR A 112 8.004 28.232 -28.136 1.00 73.14 O ATOM 1738 CB THR A 112 7.737 30.893 -30.119 1.00 4.21 C ATOM 1739 OG1 THR A 112 7.116 31.479 -31.268 1.00 44.52 O ATOM 1740 CG2 THR A 112 9.098 30.331 -30.503 1.00 32.13 C ATOM 0 H THR A 112 5.286 31.188 -29.750 1.00 11.33 H new ATOM 0 HA THR A 112 6.794 28.956 -30.236 1.00 63.42 H new ATOM 0 HB THR A 112 7.880 31.657 -29.354 1.00 4.21 H new ATOM 0 HG1 THR A 112 7.696 32.180 -31.632 1.00 44.52 H new ATOM 0 HG21 THR A 112 9.719 31.128 -30.912 1.00 32.13 H new ATOM 0 HG22 THR A 112 9.581 29.912 -29.620 1.00 32.13 H new ATOM 0 HG23 THR A 112 8.971 29.549 -31.252 1.00 32.13 H new ATOM 1748 N ALA A 113 7.265 30.126 -27.174 1.00 11.32 N ATOM 1749 CA ALA A 113 7.778 29.785 -25.853 1.00 44.10 C ATOM 1750 C ALA A 113 7.145 28.499 -25.333 1.00 62.13 C ATOM 1751 O ALA A 113 7.845 27.554 -24.972 1.00 21.53 O ATOM 1752 CB ALA A 113 7.532 30.928 -24.879 1.00 54.04 C ATOM 0 H ALA A 113 6.787 31.026 -27.221 1.00 11.32 H new ATOM 0 HA ALA A 113 8.852 29.621 -25.940 1.00 44.10 H new ATOM 0 HB1 ALA A 113 7.920 30.659 -23.897 1.00 54.04 H new ATOM 0 HB2 ALA A 113 8.038 31.825 -25.236 1.00 54.04 H new ATOM 0 HB3 ALA A 113 6.461 31.120 -24.806 1.00 54.04 H new ATOM 1758 N ALA A 114 5.817 28.471 -25.298 1.00 70.12 N ATOM 1759 CA ALA A 114 5.090 27.300 -24.824 1.00 12.12 C ATOM 1760 C ALA A 114 5.429 26.068 -25.656 1.00 45.42 C ATOM 1761 O ALA A 114 5.331 24.938 -25.179 1.00 22.52 O ATOM 1762 CB ALA A 114 3.591 27.562 -24.852 1.00 43.14 C ATOM 0 H ALA A 114 5.223 29.246 -25.592 1.00 70.12 H new ATOM 0 HA ALA A 114 5.395 27.106 -23.796 1.00 12.12 H new ATOM 0 HB1 ALA A 114 3.061 26.679 -24.495 1.00 43.14 H new ATOM 0 HB2 ALA A 114 3.358 28.410 -24.208 1.00 43.14 H new ATOM 0 HB3 ALA A 114 3.280 27.785 -25.873 1.00 43.14 H new ATOM 1768 N HIS A 115 5.829 26.295 -26.904 1.00 32.33 N ATOM 1769 CA HIS A 115 6.183 25.202 -27.803 1.00 40.31 C ATOM 1770 C HIS A 115 7.395 24.438 -27.279 1.00 10.13 C ATOM 1771 O HIS A 115 7.381 23.210 -27.204 1.00 24.13 O ATOM 1772 CB HIS A 115 6.472 25.741 -29.205 1.00 24.25 C ATOM 1773 CG HIS A 115 6.566 24.672 -30.249 1.00 60.14 C ATOM 1774 ND1 HIS A 115 6.814 24.939 -31.579 1.00 43.12 N ATOM 1775 CD2 HIS A 115 6.445 23.327 -30.154 1.00 12.24 C ATOM 1776 CE1 HIS A 115 6.840 23.805 -32.256 1.00 40.14 C ATOM 1777 NE2 HIS A 115 6.619 22.812 -31.414 1.00 70.24 N ATOM 0 H HIS A 115 5.916 27.225 -27.315 1.00 32.33 H new ATOM 0 HA HIS A 115 5.337 24.516 -27.852 1.00 40.31 H new ATOM 0 HB2 HIS A 115 5.686 26.443 -29.485 1.00 24.25 H new ATOM 0 HB3 HIS A 115 7.407 26.301 -29.185 1.00 24.25 H new ATOM 0 HD2 HIS A 115 6.248 22.764 -29.254 1.00 12.24 H new ATOM 0 HE1 HIS A 115 7.013 23.707 -33.318 1.00 40.14 H new ATOM 0 HE2 HIS A 115 6.583 21.823 -31.660 1.00 70.24 H new ATOM 1785 N ALA A 116 8.442 25.174 -26.918 1.00 35.41 N ATOM 1786 CA ALA A 116 9.660 24.565 -26.400 1.00 5.23 C ATOM 1787 C ALA A 116 9.410 23.894 -25.053 1.00 52.35 C ATOM 1788 O ALA A 116 10.018 22.871 -24.735 1.00 53.32 O ATOM 1789 CB ALA A 116 10.760 25.610 -26.274 1.00 74.24 C ATOM 0 H ALA A 116 8.470 26.192 -26.975 1.00 35.41 H new ATOM 0 HA ALA A 116 9.980 23.798 -27.105 1.00 5.23 H new ATOM 0 HB1 ALA A 116 11.664 25.141 -25.886 1.00 74.24 H new ATOM 0 HB2 ALA A 116 10.966 26.041 -27.254 1.00 74.24 H new ATOM 0 HB3 ALA A 116 10.438 26.397 -25.592 1.00 74.24 H new ATOM 1795 N LEU A 117 8.512 24.476 -24.266 1.00 10.10 N ATOM 1796 CA LEU A 117 8.181 23.934 -22.952 1.00 41.55 C ATOM 1797 C LEU A 117 7.490 22.580 -23.080 1.00 4.40 C ATOM 1798 O LEU A 117 7.895 21.604 -22.449 1.00 40.41 O ATOM 1799 CB LEU A 117 7.282 24.909 -22.189 1.00 71.51 C ATOM 1800 CG LEU A 117 7.989 26.079 -21.505 1.00 52.34 C ATOM 1801 CD1 LEU A 117 6.978 26.989 -20.824 1.00 61.12 C ATOM 1802 CD2 LEU A 117 9.013 25.571 -20.501 1.00 62.05 C ATOM 0 H LEU A 117 8.000 25.323 -24.514 1.00 10.10 H new ATOM 0 HA LEU A 117 9.109 23.796 -22.398 1.00 41.55 H new ATOM 0 HB2 LEU A 117 6.545 25.312 -22.884 1.00 71.51 H new ATOM 0 HB3 LEU A 117 6.733 24.349 -21.432 1.00 71.51 H new ATOM 0 HG LEU A 117 8.513 26.657 -22.266 1.00 52.34 H new ATOM 0 HD11 LEU A 117 7.499 27.816 -20.342 1.00 61.12 H new ATOM 0 HD12 LEU A 117 6.283 27.381 -21.567 1.00 61.12 H new ATOM 0 HD13 LEU A 117 6.426 26.423 -20.074 1.00 61.12 H new ATOM 0 HD21 LEU A 117 9.506 26.418 -20.024 1.00 62.05 H new ATOM 0 HD22 LEU A 117 8.512 24.969 -19.743 1.00 62.05 H new ATOM 0 HD23 LEU A 117 9.756 24.961 -21.016 1.00 62.05 H new ATOM 1814 N ALA A 118 6.447 22.529 -23.902 1.00 44.10 N ATOM 1815 CA ALA A 118 5.703 21.294 -24.116 1.00 4.02 C ATOM 1816 C ALA A 118 6.635 20.154 -24.513 1.00 73.22 C ATOM 1817 O ALA A 118 6.634 19.092 -23.890 1.00 74.02 O ATOM 1818 CB ALA A 118 4.634 21.499 -25.178 1.00 40.35 C ATOM 0 H ALA A 118 6.098 23.329 -24.431 1.00 44.10 H new ATOM 0 HA ALA A 118 5.219 21.023 -23.178 1.00 4.02 H new ATOM 0 HB1 ALA A 118 4.086 20.568 -25.327 1.00 40.35 H new ATOM 0 HB2 ALA A 118 3.944 22.278 -24.854 1.00 40.35 H new ATOM 0 HB3 ALA A 118 5.104 21.798 -26.115 1.00 40.35 H new ATOM 1824 N VAL A 119 7.429 20.380 -25.555 1.00 11.11 N ATOM 1825 CA VAL A 119 8.366 19.372 -26.035 1.00 72.43 C ATOM 1826 C VAL A 119 9.418 19.051 -24.979 1.00 54.22 C ATOM 1827 O VAL A 119 9.830 17.901 -24.828 1.00 41.20 O ATOM 1828 CB VAL A 119 9.072 19.831 -27.325 1.00 21.42 C ATOM 1829 CG1 VAL A 119 9.898 18.697 -27.914 1.00 52.20 C ATOM 1830 CG2 VAL A 119 8.056 20.342 -28.335 1.00 3.31 C ATOM 0 H VAL A 119 7.442 21.253 -26.083 1.00 11.11 H new ATOM 0 HA VAL A 119 7.784 18.475 -26.247 1.00 72.43 H new ATOM 0 HB VAL A 119 9.747 20.650 -27.078 1.00 21.42 H new ATOM 0 HG11 VAL A 119 10.389 19.040 -28.825 1.00 52.20 H new ATOM 0 HG12 VAL A 119 10.651 18.382 -27.192 1.00 52.20 H new ATOM 0 HG13 VAL A 119 9.246 17.856 -28.148 1.00 52.20 H new ATOM 0 HG21 VAL A 119 8.572 20.662 -29.240 1.00 3.31 H new ATOM 0 HG22 VAL A 119 7.354 19.545 -28.580 1.00 3.31 H new ATOM 0 HG23 VAL A 119 7.513 21.186 -27.910 1.00 3.31 H new ATOM 1840 N ASP A 120 9.847 20.075 -24.251 1.00 3.54 N ATOM 1841 CA ASP A 120 10.851 19.903 -23.206 1.00 54.43 C ATOM 1842 C ASP A 120 10.339 18.976 -22.108 1.00 53.14 C ATOM 1843 O ASP A 120 10.987 17.988 -21.765 1.00 33.02 O ATOM 1844 CB ASP A 120 11.234 21.258 -22.609 1.00 53.32 C ATOM 1845 CG ASP A 120 12.311 21.961 -23.411 1.00 64.35 C ATOM 1846 OD1 ASP A 120 13.086 21.265 -24.101 1.00 31.25 O ATOM 1847 OD2 ASP A 120 12.381 23.206 -23.350 1.00 12.34 O ATOM 0 H ASP A 120 9.516 21.033 -24.364 1.00 3.54 H new ATOM 0 HA ASP A 120 11.734 19.450 -23.656 1.00 54.43 H new ATOM 0 HB2 ASP A 120 10.349 21.893 -22.560 1.00 53.32 H new ATOM 0 HB3 ASP A 120 11.582 21.116 -21.586 1.00 53.32 H new ATOM 1852 N ALA A 121 9.172 19.303 -21.561 1.00 65.22 N ATOM 1853 CA ALA A 121 8.573 18.499 -20.503 1.00 63.01 C ATOM 1854 C ALA A 121 8.506 17.029 -20.902 1.00 75.20 C ATOM 1855 O ALA A 121 8.722 16.140 -20.078 1.00 1.22 O ATOM 1856 CB ALA A 121 7.184 19.021 -20.166 1.00 25.01 C ATOM 0 H ALA A 121 8.623 20.119 -21.833 1.00 65.22 H new ATOM 0 HA ALA A 121 9.204 18.579 -19.618 1.00 63.01 H new ATOM 0 HB1 ALA A 121 6.748 18.411 -19.374 1.00 25.01 H new ATOM 0 HB2 ALA A 121 7.256 20.055 -19.830 1.00 25.01 H new ATOM 0 HB3 ALA A 121 6.552 18.971 -21.052 1.00 25.01 H new ATOM 1862 N LYS A 122 8.203 16.778 -22.171 1.00 52.43 N ATOM 1863 CA LYS A 122 8.107 15.416 -22.681 1.00 74.40 C ATOM 1864 C LYS A 122 9.492 14.808 -22.875 1.00 3.30 C ATOM 1865 O LYS A 122 9.726 13.651 -22.531 1.00 63.52 O ATOM 1866 CB LYS A 122 7.340 15.397 -24.005 1.00 42.55 C ATOM 1867 CG LYS A 122 7.146 14.004 -24.577 1.00 65.40 C ATOM 1868 CD LYS A 122 8.307 13.602 -25.472 1.00 75.15 C ATOM 1869 CE LYS A 122 7.940 12.426 -26.365 1.00 25.00 C ATOM 1870 NZ LYS A 122 7.250 12.867 -27.608 1.00 51.23 N ATOM 0 H LYS A 122 8.019 17.502 -22.866 1.00 52.43 H new ATOM 0 HA LYS A 122 7.567 14.818 -21.947 1.00 74.40 H new ATOM 0 HB2 LYS A 122 6.364 15.858 -23.856 1.00 42.55 H new ATOM 0 HB3 LYS A 122 7.874 16.008 -24.733 1.00 42.55 H new ATOM 0 HG2 LYS A 122 7.047 13.286 -23.763 1.00 65.40 H new ATOM 0 HG3 LYS A 122 6.217 13.970 -25.147 1.00 65.40 H new ATOM 0 HD2 LYS A 122 8.603 14.450 -26.089 1.00 75.15 H new ATOM 0 HD3 LYS A 122 9.168 13.339 -24.857 1.00 75.15 H new ATOM 0 HE2 LYS A 122 8.842 11.874 -26.627 1.00 25.00 H new ATOM 0 HE3 LYS A 122 7.295 11.740 -25.816 1.00 25.00 H new ATOM 0 HZ1 LYS A 122 7.500 12.228 -28.389 1.00 51.23 H new ATOM 0 HZ2 LYS A 122 6.221 12.847 -27.460 1.00 51.23 H new ATOM 0 HZ3 LYS A 122 7.546 13.835 -27.845 1.00 51.23 H new ATOM 1884 N ASN A 123 10.408 15.598 -23.427 1.00 12.23 N ATOM 1885 CA ASN A 123 11.771 15.138 -23.665 1.00 71.22 C ATOM 1886 C ASN A 123 12.422 14.670 -22.367 1.00 71.53 C ATOM 1887 O ASN A 123 13.277 13.783 -22.373 1.00 71.23 O ATOM 1888 CB ASN A 123 12.606 16.255 -24.294 1.00 2.24 C ATOM 1889 CG ASN A 123 14.027 15.817 -24.592 1.00 0.02 C ATOM 1890 OD1 ASN A 123 14.250 14.810 -25.264 1.00 33.34 O ATOM 1891 ND2 ASN A 123 14.997 16.574 -24.092 1.00 13.11 N ATOM 0 H ASN A 123 10.231 16.559 -23.718 1.00 12.23 H new ATOM 0 HA ASN A 123 11.728 14.294 -24.354 1.00 71.22 H new ATOM 0 HB2 ASN A 123 12.129 16.585 -25.217 1.00 2.24 H new ATOM 0 HB3 ASN A 123 12.627 17.112 -23.621 1.00 2.24 H new ATOM 0 HD21 ASN A 123 15.973 16.329 -24.260 1.00 13.11 H new ATOM 0 HD22 ASN A 123 14.766 17.400 -23.540 1.00 13.11 H new ATOM 1898 N LEU A 124 12.011 15.270 -21.256 1.00 4.31 N ATOM 1899 CA LEU A 124 12.554 14.915 -19.949 1.00 74.20 C ATOM 1900 C LEU A 124 12.480 13.409 -19.720 1.00 63.55 C ATOM 1901 O LEU A 124 13.496 12.757 -19.474 1.00 21.12 O ATOM 1902 CB LEU A 124 11.793 15.648 -18.843 1.00 33.32 C ATOM 1903 CG LEU A 124 12.517 16.831 -18.200 1.00 63.02 C ATOM 1904 CD1 LEU A 124 12.990 17.809 -19.264 1.00 64.04 C ATOM 1905 CD2 LEU A 124 11.612 17.529 -17.196 1.00 52.31 C ATOM 0 H LEU A 124 11.304 16.005 -21.233 1.00 4.31 H new ATOM 0 HA LEU A 124 13.601 15.217 -19.923 1.00 74.20 H new ATOM 0 HB2 LEU A 124 10.849 16.006 -19.255 1.00 33.32 H new ATOM 0 HB3 LEU A 124 11.548 14.930 -18.061 1.00 33.32 H new ATOM 0 HG LEU A 124 13.391 16.453 -17.669 1.00 63.02 H new ATOM 0 HD11 LEU A 124 13.503 18.645 -18.788 1.00 64.04 H new ATOM 0 HD12 LEU A 124 13.675 17.303 -19.945 1.00 64.04 H new ATOM 0 HD13 LEU A 124 12.132 18.181 -19.823 1.00 64.04 H new ATOM 0 HD21 LEU A 124 12.144 18.368 -16.748 1.00 52.31 H new ATOM 0 HD22 LEU A 124 10.719 17.894 -17.703 1.00 52.31 H new ATOM 0 HD23 LEU A 124 11.323 16.825 -16.416 1.00 52.31 H new ATOM 1917 N LEU A 125 11.273 12.861 -19.806 1.00 62.40 N ATOM 1918 CA LEU A 125 11.067 11.430 -19.611 1.00 31.32 C ATOM 1919 C LEU A 125 11.615 10.634 -20.791 1.00 41.54 C ATOM 1920 O LEU A 125 12.146 9.537 -20.620 1.00 74.35 O ATOM 1921 CB LEU A 125 9.578 11.130 -19.426 1.00 63.53 C ATOM 1922 CG LEU A 125 9.239 9.953 -18.510 1.00 44.21 C ATOM 1923 CD1 LEU A 125 8.242 10.377 -17.443 1.00 50.54 C ATOM 1924 CD2 LEU A 125 8.693 8.787 -19.320 1.00 72.41 C ATOM 0 H LEU A 125 10.422 13.386 -20.009 1.00 62.40 H new ATOM 0 HA LEU A 125 11.607 11.130 -18.713 1.00 31.32 H new ATOM 0 HB2 LEU A 125 9.094 12.023 -19.031 1.00 63.53 H new ATOM 0 HB3 LEU A 125 9.142 10.939 -20.406 1.00 63.53 H new ATOM 0 HG LEU A 125 10.154 9.628 -18.014 1.00 44.21 H new ATOM 0 HD11 LEU A 125 8.013 9.527 -16.801 1.00 50.54 H new ATOM 0 HD12 LEU A 125 8.671 11.180 -16.843 1.00 50.54 H new ATOM 0 HD13 LEU A 125 7.327 10.729 -17.919 1.00 50.54 H new ATOM 0 HD21 LEU A 125 8.457 7.959 -18.652 1.00 72.41 H new ATOM 0 HD22 LEU A 125 7.789 9.099 -19.844 1.00 72.41 H new ATOM 0 HD23 LEU A 125 9.440 8.466 -20.046 1.00 72.41 H new ATOM 1936 N ASP A 126 11.485 11.197 -21.988 1.00 21.40 N ATOM 1937 CA ASP A 126 11.970 10.542 -23.197 1.00 64.22 C ATOM 1938 C ASP A 126 13.464 10.247 -23.094 1.00 14.04 C ATOM 1939 O ASP A 126 13.920 9.163 -23.458 1.00 11.22 O ATOM 1940 CB ASP A 126 11.694 11.415 -24.422 1.00 1.31 C ATOM 1941 CG ASP A 126 10.689 10.786 -25.367 1.00 3.21 C ATOM 1942 OD1 ASP A 126 9.625 10.340 -24.890 1.00 1.53 O ATOM 1943 OD2 ASP A 126 10.968 10.739 -26.584 1.00 35.14 O ATOM 0 H ASP A 126 11.048 12.105 -22.146 1.00 21.40 H new ATOM 0 HA ASP A 126 11.438 9.597 -23.306 1.00 64.22 H new ATOM 0 HB2 ASP A 126 11.323 12.387 -24.096 1.00 1.31 H new ATOM 0 HB3 ASP A 126 12.628 11.593 -24.955 1.00 1.31 H new ATOM 1948 N VAL A 127 14.221 11.220 -22.595 1.00 75.34 N ATOM 1949 CA VAL A 127 15.662 11.065 -22.444 1.00 23.11 C ATOM 1950 C VAL A 127 15.995 9.968 -21.439 1.00 34.14 C ATOM 1951 O VAL A 127 16.640 8.976 -21.778 1.00 64.01 O ATOM 1952 CB VAL A 127 16.323 12.380 -21.990 1.00 23.25 C ATOM 1953 CG1 VAL A 127 17.813 12.177 -21.757 1.00 72.45 C ATOM 1954 CG2 VAL A 127 16.080 13.479 -23.012 1.00 52.23 C ATOM 0 H VAL A 127 13.859 12.123 -22.289 1.00 75.34 H new ATOM 0 HA VAL A 127 16.055 10.788 -23.422 1.00 23.11 H new ATOM 0 HB VAL A 127 15.871 12.686 -21.047 1.00 23.25 H new ATOM 0 HG11 VAL A 127 18.263 13.117 -21.437 1.00 72.45 H new ATOM 0 HG12 VAL A 127 17.961 11.422 -20.985 1.00 72.45 H new ATOM 0 HG13 VAL A 127 18.284 11.846 -22.682 1.00 72.45 H new ATOM 0 HG21 VAL A 127 16.554 14.401 -22.675 1.00 52.23 H new ATOM 0 HG22 VAL A 127 16.503 13.183 -23.972 1.00 52.23 H new ATOM 0 HG23 VAL A 127 15.008 13.642 -23.123 1.00 52.23 H new ATOM 1964 N ILE A 128 15.549 10.153 -20.201 1.00 32.23 N ATOM 1965 CA ILE A 128 15.798 9.178 -19.146 1.00 74.21 C ATOM 1966 C ILE A 128 15.310 7.791 -19.553 1.00 43.42 C ATOM 1967 O ILE A 128 15.793 6.779 -19.046 1.00 21.20 O ATOM 1968 CB ILE A 128 15.110 9.585 -17.829 1.00 43.04 C ATOM 1969 CG1 ILE A 128 13.589 9.568 -17.996 1.00 24.41 C ATOM 1970 CG2 ILE A 128 15.585 10.962 -17.388 1.00 75.41 C ATOM 1971 CD1 ILE A 128 12.840 9.988 -16.751 1.00 4.03 C ATOM 0 H ILE A 128 15.014 10.969 -19.904 1.00 32.23 H new ATOM 0 HA ILE A 128 16.876 9.151 -18.990 1.00 74.21 H new ATOM 0 HB ILE A 128 15.379 8.864 -17.057 1.00 43.04 H new ATOM 0 HG12 ILE A 128 13.314 10.231 -18.817 1.00 24.41 H new ATOM 0 HG13 ILE A 128 13.274 8.564 -18.278 1.00 24.41 H new ATOM 0 HG21 ILE A 128 15.090 11.236 -16.456 1.00 75.41 H new ATOM 0 HG22 ILE A 128 16.664 10.943 -17.234 1.00 75.41 H new ATOM 0 HG23 ILE A 128 15.341 11.695 -18.157 1.00 75.41 H new ATOM 0 HD11 ILE A 128 11.767 9.952 -16.942 1.00 4.03 H new ATOM 0 HD12 ILE A 128 13.085 9.311 -15.933 1.00 4.03 H new ATOM 0 HD13 ILE A 128 13.127 11.004 -16.479 1.00 4.03 H new ATOM 1983 N ASP A 129 14.353 7.754 -20.473 1.00 35.51 N ATOM 1984 CA ASP A 129 13.801 6.491 -20.951 1.00 63.02 C ATOM 1985 C ASP A 129 14.908 5.573 -21.462 1.00 0.54 C ATOM 1986 O ASP A 129 14.877 4.364 -21.236 1.00 1.11 O ATOM 1987 CB ASP A 129 12.779 6.744 -22.061 1.00 23.14 C ATOM 1988 CG ASP A 129 11.915 5.530 -22.340 1.00 21.25 C ATOM 1989 OD1 ASP A 129 12.309 4.416 -21.934 1.00 53.33 O ATOM 1990 OD2 ASP A 129 10.846 5.693 -22.964 1.00 14.13 O ATOM 0 H ASP A 129 13.943 8.583 -20.903 1.00 35.51 H new ATOM 0 HA ASP A 129 13.304 6.000 -20.114 1.00 63.02 H new ATOM 0 HB2 ASP A 129 12.142 7.583 -21.780 1.00 23.14 H new ATOM 0 HB3 ASP A 129 13.301 7.032 -22.973 1.00 23.14 H new ATOM 1995 N GLN A 130 15.883 6.157 -22.151 1.00 11.42 N ATOM 1996 CA GLN A 130 16.998 5.391 -22.695 1.00 1.35 C ATOM 1997 C GLN A 130 17.739 4.648 -21.588 1.00 11.12 C ATOM 1998 O GLN A 130 18.296 3.574 -21.813 1.00 50.23 O ATOM 1999 CB GLN A 130 17.963 6.315 -23.440 1.00 25.33 C ATOM 2000 CG GLN A 130 18.021 6.055 -24.936 1.00 71.23 C ATOM 2001 CD GLN A 130 19.335 6.490 -25.554 1.00 61.32 C ATOM 2002 OE1 GLN A 130 19.823 7.590 -25.293 1.00 63.41 O ATOM 2003 NE2 GLN A 130 19.916 5.626 -26.379 1.00 42.41 N ATOM 0 H GLN A 130 15.923 7.157 -22.346 1.00 11.42 H new ATOM 0 HA GLN A 130 16.596 4.657 -23.394 1.00 1.35 H new ATOM 0 HB2 GLN A 130 17.666 7.350 -23.271 1.00 25.33 H new ATOM 0 HB3 GLN A 130 18.962 6.198 -23.020 1.00 25.33 H new ATOM 0 HG2 GLN A 130 17.871 4.992 -25.122 1.00 71.23 H new ATOM 0 HG3 GLN A 130 17.202 6.583 -25.425 1.00 71.23 H new ATOM 0 HE21 GLN A 130 19.476 4.725 -26.567 1.00 42.41 H new ATOM 0 HE22 GLN A 130 20.802 5.863 -26.825 1.00 42.41 H new ATOM 2012 N ALA A 131 17.741 5.227 -20.392 1.00 1.33 N ATOM 2013 CA ALA A 131 18.412 4.619 -19.250 1.00 20.14 C ATOM 2014 C ALA A 131 17.638 3.408 -18.740 1.00 25.42 C ATOM 2015 O ALA A 131 18.227 2.379 -18.405 1.00 0.51 O ATOM 2016 CB ALA A 131 18.590 5.641 -18.136 1.00 61.44 C ATOM 0 H ALA A 131 17.285 6.117 -20.189 1.00 1.33 H new ATOM 0 HA ALA A 131 19.395 4.279 -19.576 1.00 20.14 H new ATOM 0 HB1 ALA A 131 19.092 5.173 -17.290 1.00 61.44 H new ATOM 0 HB2 ALA A 131 19.191 6.474 -18.499 1.00 61.44 H new ATOM 0 HB3 ALA A 131 17.614 6.009 -17.820 1.00 61.44 H new ATOM 2022 N ARG A 132 16.317 3.536 -18.683 1.00 10.41 N ATOM 2023 CA ARG A 132 15.463 2.453 -18.212 1.00 23.52 C ATOM 2024 C ARG A 132 15.732 1.170 -18.993 1.00 62.23 C ATOM 2025 O ARG A 132 15.844 0.089 -18.414 1.00 31.34 O ATOM 2026 CB ARG A 132 13.990 2.842 -18.342 1.00 13.12 C ATOM 2027 CG ARG A 132 13.122 2.330 -17.204 1.00 74.43 C ATOM 2028 CD ARG A 132 11.677 2.779 -17.360 1.00 21.31 C ATOM 2029 NE ARG A 132 10.756 1.647 -17.426 1.00 2.21 N ATOM 2030 CZ ARG A 132 9.534 1.724 -17.940 1.00 33.31 C ATOM 2031 NH1 ARG A 132 9.088 2.872 -18.430 1.00 72.04 N ATOM 2032 NH2 ARG A 132 8.755 0.650 -17.964 1.00 75.14 N ATOM 0 H ARG A 132 15.814 4.380 -18.957 1.00 10.41 H new ATOM 0 HA ARG A 132 15.693 2.274 -17.162 1.00 23.52 H new ATOM 0 HB2 ARG A 132 13.912 3.928 -18.386 1.00 13.12 H new ATOM 0 HB3 ARG A 132 13.603 2.456 -19.285 1.00 13.12 H new ATOM 0 HG2 ARG A 132 13.165 1.241 -17.174 1.00 74.43 H new ATOM 0 HG3 ARG A 132 13.516 2.691 -16.254 1.00 74.43 H new ATOM 0 HD2 ARG A 132 11.404 3.420 -16.522 1.00 21.31 H new ATOM 0 HD3 ARG A 132 11.579 3.379 -18.265 1.00 21.31 H new ATOM 0 HE ARG A 132 11.068 0.749 -17.057 1.00 2.21 H new ATOM 0 HH11 ARG A 132 9.684 3.700 -18.413 1.00 72.04 H new ATOM 0 HH12 ARG A 132 8.149 2.928 -18.824 1.00 72.04 H new ATOM 0 HH21 ARG A 132 9.095 -0.235 -17.588 1.00 75.14 H new ATOM 0 HH22 ARG A 132 7.816 0.709 -18.359 1.00 75.14 H new ATOM 2046 N LEU A 133 15.835 1.297 -20.312 1.00 35.04 N ATOM 2047 CA LEU A 133 16.090 0.148 -21.174 1.00 11.04 C ATOM 2048 C LEU A 133 17.538 -0.315 -21.049 1.00 50.23 C ATOM 2049 O LEU A 133 17.842 -1.495 -21.225 1.00 55.15 O ATOM 2050 CB LEU A 133 15.778 0.498 -22.629 1.00 53.45 C ATOM 2051 CG LEU A 133 14.309 0.398 -23.044 1.00 43.00 C ATOM 2052 CD1 LEU A 133 13.893 1.627 -23.837 1.00 42.20 C ATOM 2053 CD2 LEU A 133 14.069 -0.868 -23.854 1.00 1.23 C ATOM 0 H LEU A 133 15.746 2.184 -20.807 1.00 35.04 H new ATOM 0 HA LEU A 133 15.439 -0.666 -20.856 1.00 11.04 H new ATOM 0 HB2 LEU A 133 16.120 1.516 -22.818 1.00 53.45 H new ATOM 0 HB3 LEU A 133 16.362 -0.159 -23.273 1.00 53.45 H new ATOM 0 HG LEU A 133 13.699 0.350 -22.142 1.00 43.00 H new ATOM 0 HD11 LEU A 133 12.845 1.538 -24.123 1.00 42.20 H new ATOM 0 HD12 LEU A 133 14.027 2.518 -23.224 1.00 42.20 H new ATOM 0 HD13 LEU A 133 14.508 1.707 -24.733 1.00 42.20 H new ATOM 0 HD21 LEU A 133 13.019 -0.923 -24.141 1.00 1.23 H new ATOM 0 HD22 LEU A 133 14.689 -0.850 -24.750 1.00 1.23 H new ATOM 0 HD23 LEU A 133 14.327 -1.739 -23.252 1.00 1.23 H new ATOM 2065 N LYS A 134 18.429 0.622 -20.743 1.00 12.15 N ATOM 2066 CA LYS A 134 19.845 0.311 -20.590 1.00 42.35 C ATOM 2067 C LYS A 134 20.053 -0.782 -19.547 1.00 45.40 C ATOM 2068 O LYS A 134 20.878 -1.677 -19.729 1.00 34.20 O ATOM 2069 CB LYS A 134 20.624 1.567 -20.192 1.00 21.12 C ATOM 2070 CG LYS A 134 21.675 1.979 -21.208 1.00 22.21 C ATOM 2071 CD LYS A 134 21.795 3.491 -21.305 1.00 20.54 C ATOM 2072 CE LYS A 134 23.174 3.969 -20.876 1.00 33.11 C ATOM 2073 NZ LYS A 134 23.192 5.432 -20.601 1.00 3.31 N ATOM 0 H LYS A 134 18.195 1.604 -20.596 1.00 12.15 H new ATOM 0 HA LYS A 134 20.217 -0.051 -21.548 1.00 42.35 H new ATOM 0 HB2 LYS A 134 19.923 2.390 -20.053 1.00 21.12 H new ATOM 0 HB3 LYS A 134 21.108 1.395 -19.231 1.00 21.12 H new ATOM 0 HG2 LYS A 134 22.639 1.554 -20.928 1.00 22.21 H new ATOM 0 HG3 LYS A 134 21.418 1.570 -22.185 1.00 22.21 H new ATOM 0 HD2 LYS A 134 21.602 3.807 -22.330 1.00 20.54 H new ATOM 0 HD3 LYS A 134 21.035 3.958 -20.678 1.00 20.54 H new ATOM 0 HE2 LYS A 134 23.485 3.427 -19.982 1.00 33.11 H new ATOM 0 HE3 LYS A 134 23.898 3.737 -21.657 1.00 33.11 H new ATOM 0 HZ1 LYS A 134 24.149 5.719 -20.312 1.00 3.31 H new ATOM 0 HZ2 LYS A 134 22.920 5.950 -21.461 1.00 3.31 H new ATOM 0 HZ3 LYS A 134 22.520 5.650 -19.838 1.00 3.31 H new ATOM 2087 N MET A 135 19.300 -0.702 -18.455 1.00 23.11 N ATOM 2088 CA MET A 135 19.401 -1.687 -17.384 1.00 43.30 C ATOM 2089 C MET A 135 18.669 -2.972 -17.757 1.00 24.24 C ATOM 2090 O MET A 135 19.220 -4.067 -17.639 1.00 64.12 O ATOM 2091 CB MET A 135 18.829 -1.119 -16.084 1.00 52.51 C ATOM 2092 CG MET A 135 19.071 -2.006 -14.874 1.00 63.11 C ATOM 2093 SD MET A 135 19.441 -1.062 -13.383 1.00 51.11 S ATOM 2094 CE MET A 135 17.841 -1.061 -12.578 1.00 0.13 C ATOM 0 H MET A 135 18.614 0.034 -18.288 1.00 23.11 H new ATOM 0 HA MET A 135 20.456 -1.920 -17.237 1.00 43.30 H new ATOM 0 HB2 MET A 135 19.270 -0.139 -15.900 1.00 52.51 H new ATOM 0 HB3 MET A 135 17.756 -0.968 -16.204 1.00 52.51 H new ATOM 0 HG2 MET A 135 18.190 -2.623 -14.699 1.00 63.11 H new ATOM 0 HG3 MET A 135 19.898 -2.684 -15.085 1.00 63.11 H new ATOM 0 HE1 MET A 135 17.907 -0.513 -11.638 1.00 0.13 H new ATOM 0 HE2 MET A 135 17.108 -0.582 -13.227 1.00 0.13 H new ATOM 0 HE3 MET A 135 17.533 -2.088 -12.379 1.00 0.13 H new ATOM 2104 N ILE A 136 17.427 -2.831 -18.205 1.00 73.42 N ATOM 2105 CA ILE A 136 16.621 -3.982 -18.595 1.00 50.32 C ATOM 2106 C ILE A 136 17.337 -4.824 -19.646 1.00 1.42 C ATOM 2107 O ILE A 136 17.671 -5.984 -19.405 1.00 15.24 O ATOM 2108 CB ILE A 136 15.251 -3.548 -19.148 1.00 54.33 C ATOM 2109 CG1 ILE A 136 14.492 -2.725 -18.104 1.00 63.15 C ATOM 2110 CG2 ILE A 136 14.438 -4.765 -19.564 1.00 52.42 C ATOM 2111 CD1 ILE A 136 13.325 -1.951 -18.677 1.00 24.04 C ATOM 0 H ILE A 136 16.956 -1.932 -18.307 1.00 73.42 H new ATOM 0 HA ILE A 136 16.469 -4.580 -17.696 1.00 50.32 H new ATOM 0 HB ILE A 136 15.412 -2.925 -20.028 1.00 54.33 H new ATOM 0 HG12 ILE A 136 14.127 -3.392 -17.323 1.00 63.15 H new ATOM 0 HG13 ILE A 136 15.183 -2.027 -17.631 1.00 63.15 H new ATOM 0 HG21 ILE A 136 13.472 -4.442 -19.953 1.00 52.42 H new ATOM 0 HG22 ILE A 136 14.975 -5.314 -20.337 1.00 52.42 H new ATOM 0 HG23 ILE A 136 14.283 -5.412 -18.700 1.00 52.42 H new ATOM 0 HD11 ILE A 136 12.834 -1.391 -17.881 1.00 24.04 H new ATOM 0 HD12 ILE A 136 13.686 -1.259 -19.438 1.00 24.04 H new ATOM 0 HD13 ILE A 136 12.613 -2.644 -19.125 1.00 24.04 H new ATOM 2123 N SER A 137 17.572 -4.231 -20.812 1.00 1.41 N ATOM 2124 CA SER A 137 18.247 -4.927 -21.901 1.00 4.50 C ATOM 2125 C SER A 137 19.748 -5.013 -21.642 1.00 65.12 C ATOM 2126 O SER A 137 20.545 -4.381 -22.335 1.00 63.22 O ATOM 2127 CB SER A 137 17.988 -4.213 -23.229 1.00 54.01 C ATOM 2128 OG SER A 137 16.601 -4.010 -23.436 1.00 75.13 O ATOM 0 H SER A 137 17.305 -3.270 -21.027 1.00 1.41 H new ATOM 0 HA SER A 137 17.846 -5.939 -21.956 1.00 4.50 H new ATOM 0 HB2 SER A 137 18.504 -3.253 -23.236 1.00 54.01 H new ATOM 0 HB3 SER A 137 18.399 -4.802 -24.049 1.00 54.01 H new ATOM 0 HG SER A 137 16.462 -3.551 -24.290 1.00 75.13 H new ATOM 2272 N GLU A 162 2.162 9.538 -31.145 1.00 51.25 N ATOM 2273 CA GLU A 162 0.946 10.334 -31.018 1.00 24.50 C ATOM 2274 C GLU A 162 1.277 11.778 -30.653 1.00 20.22 C ATOM 2275 O GLU A 162 0.736 12.717 -31.237 1.00 40.52 O ATOM 2276 CB GLU A 162 0.022 9.727 -29.960 1.00 3.11 C ATOM 2277 CG GLU A 162 -1.417 10.202 -30.065 1.00 33.11 C ATOM 2278 CD GLU A 162 -1.979 10.661 -28.733 1.00 43.44 C ATOM 2279 OE1 GLU A 162 -2.053 9.833 -27.803 1.00 35.45 O ATOM 2280 OE2 GLU A 162 -2.343 11.851 -28.623 1.00 31.13 O ATOM 0 HA GLU A 162 0.436 10.329 -31.981 1.00 24.50 H new ATOM 0 HB2 GLU A 162 0.045 8.641 -30.050 1.00 3.11 H new ATOM 0 HB3 GLU A 162 0.406 9.973 -28.970 1.00 3.11 H new ATOM 0 HG2 GLU A 162 -1.474 11.022 -30.781 1.00 33.11 H new ATOM 0 HG3 GLU A 162 -2.035 9.394 -30.457 1.00 33.11 H new ATOM 2287 N LEU A 163 2.168 11.947 -29.682 1.00 42.13 N ATOM 2288 CA LEU A 163 2.572 13.277 -29.237 1.00 72.55 C ATOM 2289 C LEU A 163 3.394 13.983 -30.310 1.00 45.21 C ATOM 2290 O LEU A 163 3.317 15.202 -30.463 1.00 50.32 O ATOM 2291 CB LEU A 163 3.378 13.179 -27.941 1.00 45.25 C ATOM 2292 CG LEU A 163 2.570 13.208 -26.644 1.00 30.31 C ATOM 2293 CD1 LEU A 163 2.940 12.028 -25.758 1.00 43.13 C ATOM 2294 CD2 LEU A 163 2.791 14.520 -25.907 1.00 12.53 C ATOM 0 H LEU A 163 2.624 11.180 -29.188 1.00 42.13 H new ATOM 0 HA LEU A 163 1.671 13.862 -29.053 1.00 72.55 H new ATOM 0 HB2 LEU A 163 3.956 12.255 -27.965 1.00 45.25 H new ATOM 0 HB3 LEU A 163 4.093 14.001 -27.918 1.00 45.25 H new ATOM 0 HG LEU A 163 1.512 13.130 -26.896 1.00 30.31 H new ATOM 0 HD11 LEU A 163 2.355 12.065 -24.839 1.00 43.13 H new ATOM 0 HD12 LEU A 163 2.729 11.097 -26.285 1.00 43.13 H new ATOM 0 HD13 LEU A 163 4.001 12.075 -25.514 1.00 43.13 H new ATOM 0 HD21 LEU A 163 2.208 14.523 -24.986 1.00 12.53 H new ATOM 0 HD22 LEU A 163 3.849 14.629 -25.667 1.00 12.53 H new ATOM 0 HD23 LEU A 163 2.475 15.350 -26.539 1.00 12.53 H new ATOM 2306 N ASP A 164 4.180 13.210 -31.051 1.00 70.41 N ATOM 2307 CA ASP A 164 5.015 13.761 -32.112 1.00 72.32 C ATOM 2308 C ASP A 164 4.168 14.509 -33.137 1.00 33.21 C ATOM 2309 O ASP A 164 4.382 15.695 -33.387 1.00 0.13 O ATOM 2310 CB ASP A 164 5.804 12.646 -32.801 1.00 31.14 C ATOM 2311 CG ASP A 164 6.770 11.954 -31.859 1.00 72.10 C ATOM 2312 OD1 ASP A 164 6.837 12.355 -30.678 1.00 25.30 O ATOM 2313 OD2 ASP A 164 7.457 11.011 -32.303 1.00 5.01 O ATOM 0 H ASP A 164 4.256 12.199 -30.936 1.00 70.41 H new ATOM 0 HA ASP A 164 5.714 14.465 -31.661 1.00 72.32 H new ATOM 0 HB2 ASP A 164 5.109 11.912 -33.209 1.00 31.14 H new ATOM 0 HB3 ASP A 164 6.357 13.063 -33.643 1.00 31.14 H new ATOM 2318 N ARG A 165 3.206 13.807 -33.728 1.00 21.13 N ATOM 2319 CA ARG A 165 2.328 14.404 -34.727 1.00 64.10 C ATOM 2320 C ARG A 165 1.630 15.640 -34.168 1.00 43.43 C ATOM 2321 O ARG A 165 1.524 16.665 -34.844 1.00 35.20 O ATOM 2322 CB ARG A 165 1.288 13.386 -35.196 1.00 74.31 C ATOM 2323 CG ARG A 165 1.114 13.344 -36.706 1.00 31.55 C ATOM 2324 CD ARG A 165 -0.355 13.309 -37.096 1.00 73.45 C ATOM 2325 NE ARG A 165 -0.555 13.645 -38.504 1.00 34.25 N ATOM 2326 CZ ARG A 165 -0.546 14.888 -38.971 1.00 10.35 C ATOM 2327 NH1 ARG A 165 -0.347 15.908 -38.147 1.00 20.13 N ATOM 2328 NH2 ARG A 165 -0.736 15.114 -40.264 1.00 64.13 N ATOM 0 H ARG A 165 3.015 12.824 -33.532 1.00 21.13 H new ATOM 0 HA ARG A 165 2.939 14.707 -35.577 1.00 64.10 H new ATOM 0 HB2 ARG A 165 1.577 12.396 -34.844 1.00 74.31 H new ATOM 0 HB3 ARG A 165 0.329 13.620 -34.735 1.00 74.31 H new ATOM 0 HG2 ARG A 165 1.590 14.217 -37.153 1.00 31.55 H new ATOM 0 HG3 ARG A 165 1.619 12.466 -37.107 1.00 31.55 H new ATOM 0 HD2 ARG A 165 -0.759 12.316 -36.899 1.00 73.45 H new ATOM 0 HD3 ARG A 165 -0.912 14.009 -36.473 1.00 73.45 H new ATOM 0 HE ARG A 165 -0.710 12.883 -39.164 1.00 34.25 H new ATOM 0 HH11 ARG A 165 -0.200 15.739 -37.152 1.00 20.13 H new ATOM 0 HH12 ARG A 165 -0.341 16.862 -38.508 1.00 20.13 H new ATOM 0 HH21 ARG A 165 -0.889 14.332 -40.901 1.00 64.13 H new ATOM 0 HH22 ARG A 165 -0.729 16.069 -40.621 1.00 64.13 H new ATOM 2342 N LEU A 166 1.156 15.537 -32.932 1.00 2.53 N ATOM 2343 CA LEU A 166 0.468 16.647 -32.282 1.00 15.15 C ATOM 2344 C LEU A 166 1.369 17.874 -32.199 1.00 5.42 C ATOM 2345 O LEU A 166 0.927 19.000 -32.430 1.00 53.30 O ATOM 2346 CB LEU A 166 0.012 16.239 -30.879 1.00 42.23 C ATOM 2347 CG LEU A 166 -1.499 16.162 -30.660 1.00 51.22 C ATOM 2348 CD1 LEU A 166 -1.812 15.820 -29.212 1.00 22.31 C ATOM 2349 CD2 LEU A 166 -2.163 17.473 -31.055 1.00 43.44 C ATOM 0 H LEU A 166 1.235 14.697 -32.359 1.00 2.53 H new ATOM 0 HA LEU A 166 -0.406 16.901 -32.882 1.00 15.15 H new ATOM 0 HB2 LEU A 166 0.442 15.265 -30.648 1.00 42.23 H new ATOM 0 HB3 LEU A 166 0.427 16.949 -30.163 1.00 42.23 H new ATOM 0 HG LEU A 166 -1.898 15.370 -31.294 1.00 51.22 H new ATOM 0 HD11 LEU A 166 -2.892 15.770 -29.075 1.00 22.31 H new ATOM 0 HD12 LEU A 166 -1.369 14.856 -28.962 1.00 22.31 H new ATOM 0 HD13 LEU A 166 -1.399 16.589 -28.559 1.00 22.31 H new ATOM 0 HD21 LEU A 166 -3.238 17.400 -30.892 1.00 43.44 H new ATOM 0 HD22 LEU A 166 -1.759 18.283 -30.448 1.00 43.44 H new ATOM 0 HD23 LEU A 166 -1.968 17.677 -32.108 1.00 43.44 H new ATOM 2361 N LEU A 167 2.637 17.650 -31.870 1.00 33.43 N ATOM 2362 CA LEU A 167 3.603 18.737 -31.759 1.00 32.03 C ATOM 2363 C LEU A 167 3.803 19.427 -33.104 1.00 51.12 C ATOM 2364 O LEU A 167 3.910 20.652 -33.176 1.00 12.11 O ATOM 2365 CB LEU A 167 4.941 18.206 -31.241 1.00 72.11 C ATOM 2366 CG LEU A 167 5.210 18.406 -29.749 1.00 45.03 C ATOM 2367 CD1 LEU A 167 4.051 17.874 -28.921 1.00 41.12 C ATOM 2368 CD2 LEU A 167 6.512 17.727 -29.347 1.00 15.12 C ATOM 0 H LEU A 167 3.020 16.725 -31.675 1.00 33.43 H new ATOM 0 HA LEU A 167 3.211 19.468 -31.052 1.00 32.03 H new ATOM 0 HB2 LEU A 167 4.995 17.140 -31.460 1.00 72.11 H new ATOM 0 HB3 LEU A 167 5.742 18.688 -31.802 1.00 72.11 H new ATOM 0 HG LEU A 167 5.306 19.475 -29.556 1.00 45.03 H new ATOM 0 HD11 LEU A 167 4.261 18.025 -27.862 1.00 41.12 H new ATOM 0 HD12 LEU A 167 3.138 18.405 -29.190 1.00 41.12 H new ATOM 0 HD13 LEU A 167 3.922 16.810 -29.117 1.00 41.12 H new ATOM 0 HD21 LEU A 167 6.688 17.879 -28.282 1.00 15.12 H new ATOM 0 HD22 LEU A 167 6.445 16.659 -29.555 1.00 15.12 H new ATOM 0 HD23 LEU A 167 7.337 18.156 -29.916 1.00 15.12 H new ATOM 2380 N LEU A 168 3.851 18.634 -34.169 1.00 35.24 N ATOM 2381 CA LEU A 168 4.035 19.168 -35.513 1.00 42.34 C ATOM 2382 C LEU A 168 3.003 20.249 -35.816 1.00 55.24 C ATOM 2383 O LEU A 168 3.354 21.375 -36.168 1.00 72.45 O ATOM 2384 CB LEU A 168 3.934 18.046 -36.548 1.00 21.11 C ATOM 2385 CG LEU A 168 5.176 17.813 -37.409 1.00 21.44 C ATOM 2386 CD1 LEU A 168 5.206 16.383 -37.926 1.00 72.14 C ATOM 2387 CD2 LEU A 168 5.217 18.801 -38.565 1.00 4.44 C ATOM 0 H LEU A 168 3.765 17.618 -34.127 1.00 35.24 H new ATOM 0 HA LEU A 168 5.028 19.615 -35.566 1.00 42.34 H new ATOM 0 HB2 LEU A 168 3.699 17.118 -36.027 1.00 21.11 H new ATOM 0 HB3 LEU A 168 3.094 18.263 -37.208 1.00 21.11 H new ATOM 0 HG LEU A 168 6.059 17.973 -36.790 1.00 21.44 H new ATOM 0 HD11 LEU A 168 6.097 16.236 -38.537 1.00 72.14 H new ATOM 0 HD12 LEU A 168 5.225 15.692 -37.083 1.00 72.14 H new ATOM 0 HD13 LEU A 168 4.318 16.195 -38.529 1.00 72.14 H new ATOM 0 HD21 LEU A 168 6.108 18.620 -39.167 1.00 4.44 H new ATOM 0 HD22 LEU A 168 4.329 18.674 -39.184 1.00 4.44 H new ATOM 0 HD23 LEU A 168 5.244 19.818 -38.174 1.00 4.44 H new ATOM 2399 N GLU A 169 1.728 19.899 -35.675 1.00 11.12 N ATOM 2400 CA GLU A 169 0.645 20.841 -35.932 1.00 73.43 C ATOM 2401 C GLU A 169 0.849 22.133 -35.147 1.00 33.25 C ATOM 2402 O GLU A 169 0.665 23.230 -35.675 1.00 53.02 O ATOM 2403 CB GLU A 169 -0.703 20.215 -35.565 1.00 43.14 C ATOM 2404 CG GLU A 169 -1.864 20.742 -36.392 1.00 3.22 C ATOM 2405 CD GLU A 169 -2.970 19.719 -36.563 1.00 1.21 C ATOM 2406 OE1 GLU A 169 -3.875 19.676 -35.704 1.00 12.14 O ATOM 2407 OE2 GLU A 169 -2.930 18.962 -37.555 1.00 54.10 O ATOM 0 H GLU A 169 1.420 18.971 -35.385 1.00 11.12 H new ATOM 0 HA GLU A 169 0.650 21.079 -36.996 1.00 73.43 H new ATOM 0 HB2 GLU A 169 -0.639 19.134 -35.692 1.00 43.14 H new ATOM 0 HB3 GLU A 169 -0.905 20.401 -34.510 1.00 43.14 H new ATOM 0 HG2 GLU A 169 -2.270 21.634 -35.915 1.00 3.22 H new ATOM 0 HG3 GLU A 169 -1.499 21.044 -37.374 1.00 3.22 H new ATOM 2414 N LEU A 170 1.229 21.995 -33.881 1.00 61.23 N ATOM 2415 CA LEU A 170 1.458 23.150 -33.021 1.00 1.42 C ATOM 2416 C LEU A 170 2.408 24.143 -33.683 1.00 61.13 C ATOM 2417 O LEU A 170 2.192 25.353 -33.632 1.00 70.10 O ATOM 2418 CB LEU A 170 2.028 22.703 -31.674 1.00 31.04 C ATOM 2419 CG LEU A 170 2.138 23.785 -30.599 1.00 31.13 C ATOM 2420 CD1 LEU A 170 2.097 23.165 -29.211 1.00 32.42 C ATOM 2421 CD2 LEU A 170 3.413 24.595 -30.785 1.00 73.45 C ATOM 0 H LEU A 170 1.385 21.095 -33.428 1.00 61.23 H new ATOM 0 HA LEU A 170 0.501 23.645 -32.858 1.00 1.42 H new ATOM 0 HB2 LEU A 170 1.404 21.897 -31.287 1.00 31.04 H new ATOM 0 HB3 LEU A 170 3.020 22.285 -31.843 1.00 31.04 H new ATOM 0 HG LEU A 170 1.286 24.457 -30.700 1.00 31.13 H new ATOM 0 HD11 LEU A 170 2.177 23.950 -28.459 1.00 32.42 H new ATOM 0 HD12 LEU A 170 1.156 22.630 -29.079 1.00 32.42 H new ATOM 0 HD13 LEU A 170 2.929 22.469 -29.098 1.00 32.42 H new ATOM 0 HD21 LEU A 170 3.474 25.360 -30.011 1.00 73.45 H new ATOM 0 HD22 LEU A 170 4.277 23.935 -30.712 1.00 73.45 H new ATOM 0 HD23 LEU A 170 3.402 25.071 -31.766 1.00 73.45 H new