USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1084 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 79 TYR OH : rot -15:sc= -1.6 USER MOD Set 1.2: A 141 LYS NZ :NH3+ -159:sc= 0 (180deg=0) USER MOD Set 2.1: A 34 ASN : amide:sc= -4.09! C(o=-6.1!,f=-11!) USER MOD Set 2.2: A 57 ASN :FLIP amide:sc= -2.04! C(o=-8.5!,f=-6.1!) USER MOD Set 3.1: A 35 ASN : amide:sc= -0.0614 K(o=1.1,f=-4.5!) USER MOD Set 3.2: A 77 TYR OH : rot 10:sc= 1.12 USER MOD Single : A 14 CYS SG : rot 100:sc= -0.872 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 150:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 146:sc= -3.4! (180deg=-4.68!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= -0.0345 X(o=-0.035,f=0) USER MOD Single : A 48 MET CE :methyl -151:sc= 0 (180deg=-0.175) USER MOD Single : A 56 GLN : amide:sc= -0.718 X(o=-0.72,f=-0.56) USER MOD Single : A 59 SER OG : rot 180:sc= -0.502 USER MOD Single : A 64 LYS NZ :NH3+ 166:sc= 0.191 (180deg=0.167) USER MOD Single : A 71 GLN : amide:sc= -0.0313 X(o=-0.031,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 165:sc= 0 USER MOD Single : A 83 HIS :FLIP no HE2:sc= -0.0209 F(o=-0.74,f=-0.021) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 CYS SG : rot -137:sc= -2.77! USER MOD Single : A 97 SER OG : rot -60:sc= 0.595 USER MOD Single : A 98 SER OG : rot 59:sc= 0.941 USER MOD Single : A 102 CYS SG : rot 76:sc= -0.66 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 107 GLN : amide:sc= -2.26! C(o=-2.3!,f=-2.1!) USER MOD Single : A 108 MET CE :methyl -176:sc= 0 (180deg=-0.019) USER MOD Single : A 109 MET CE :methyl 173:sc= -2.63 (180deg=-3.06) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 86:sc= 1.71 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -1.91! C(o=-1.9!,f=-2.9!) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 THR OG1 : rot 74:sc= 0.811 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot -72:sc= 0.157 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 135 N VAL A 13 17.643 -1.207 -0.417 1.00 4.23 N ATOM 136 CA VAL A 13 16.836 0.007 -0.371 1.00 65.42 C ATOM 137 C VAL A 13 16.777 0.678 -1.739 1.00 71.23 C ATOM 138 O VAL A 13 17.803 1.068 -2.296 1.00 64.22 O ATOM 139 CB VAL A 13 17.390 1.010 0.658 1.00 74.45 C ATOM 140 CG1 VAL A 13 16.548 2.278 0.673 1.00 44.11 C ATOM 141 CG2 VAL A 13 17.442 0.379 2.041 1.00 52.04 C ATOM 0 HA VAL A 13 15.831 -0.291 -0.072 1.00 65.42 H new ATOM 0 HB VAL A 13 18.406 1.279 0.368 1.00 74.45 H new ATOM 0 HG11 VAL A 13 16.954 2.976 1.406 1.00 44.11 H new ATOM 0 HG12 VAL A 13 16.566 2.738 -0.315 1.00 44.11 H new ATOM 0 HG13 VAL A 13 15.521 2.029 0.939 1.00 44.11 H new ATOM 0 HG21 VAL A 13 17.836 1.101 2.756 1.00 52.04 H new ATOM 0 HG22 VAL A 13 16.438 0.080 2.343 1.00 52.04 H new ATOM 0 HG23 VAL A 13 18.089 -0.498 2.017 1.00 52.04 H new ATOM 151 N CYS A 14 15.568 0.811 -2.275 1.00 13.33 N ATOM 152 CA CYS A 14 15.374 1.436 -3.578 1.00 21.24 C ATOM 153 C CYS A 14 14.878 2.870 -3.425 1.00 5.02 C ATOM 154 O CYS A 14 14.506 3.294 -2.331 1.00 45.23 O ATOM 155 CB CYS A 14 14.380 0.627 -4.411 1.00 70.05 C ATOM 156 SG CYS A 14 14.975 -1.014 -4.884 1.00 3.23 S ATOM 0 H CYS A 14 14.708 0.494 -1.827 1.00 13.33 H new ATOM 0 HA CYS A 14 16.336 1.456 -4.091 1.00 21.24 H new ATOM 0 HB2 CYS A 14 13.454 0.517 -3.846 1.00 70.05 H new ATOM 0 HB3 CYS A 14 14.138 1.188 -5.314 1.00 70.05 H new ATOM 0 HG CYS A 14 14.466 -1.906 -4.088 1.00 3.23 H new ATOM 162 N GLU A 15 14.880 3.612 -4.528 1.00 14.41 N ATOM 163 CA GLU A 15 14.432 5.000 -4.514 1.00 3.41 C ATOM 164 C GLU A 15 12.952 5.098 -4.873 1.00 13.02 C ATOM 165 O GLU A 15 12.320 4.103 -5.228 1.00 70.03 O ATOM 166 CB GLU A 15 15.261 5.836 -5.492 1.00 31.23 C ATOM 167 CG GLU A 15 16.356 6.649 -4.822 1.00 13.13 C ATOM 168 CD GLU A 15 16.075 8.139 -4.849 1.00 64.44 C ATOM 169 OE1 GLU A 15 15.590 8.632 -5.889 1.00 51.02 O ATOM 170 OE2 GLU A 15 16.343 8.811 -3.832 1.00 42.21 O ATOM 0 H GLU A 15 15.186 3.276 -5.441 1.00 14.41 H new ATOM 0 HA GLU A 15 14.570 5.389 -3.505 1.00 3.41 H new ATOM 0 HB2 GLU A 15 15.712 5.174 -6.231 1.00 31.23 H new ATOM 0 HB3 GLU A 15 14.598 6.511 -6.032 1.00 31.23 H new ATOM 0 HG2 GLU A 15 16.465 6.322 -3.788 1.00 13.13 H new ATOM 0 HG3 GLU A 15 17.306 6.453 -5.320 1.00 13.13 H new ATOM 177 N VAL A 16 12.404 6.306 -4.775 1.00 20.12 N ATOM 178 CA VAL A 16 10.999 6.536 -5.089 1.00 32.42 C ATOM 179 C VAL A 16 10.843 7.222 -6.441 1.00 32.33 C ATOM 180 O VAL A 16 10.938 8.446 -6.543 1.00 20.33 O ATOM 181 CB VAL A 16 10.316 7.393 -4.007 1.00 53.24 C ATOM 182 CG1 VAL A 16 10.964 8.767 -3.927 1.00 52.53 C ATOM 183 CG2 VAL A 16 8.826 7.514 -4.287 1.00 53.31 C ATOM 0 H VAL A 16 12.912 7.140 -4.481 1.00 20.12 H new ATOM 0 HA VAL A 16 10.518 5.559 -5.125 1.00 32.42 H new ATOM 0 HB VAL A 16 10.443 6.900 -3.043 1.00 53.24 H new ATOM 0 HG11 VAL A 16 10.469 9.359 -3.157 1.00 52.53 H new ATOM 0 HG12 VAL A 16 12.019 8.658 -3.677 1.00 52.53 H new ATOM 0 HG13 VAL A 16 10.869 9.271 -4.889 1.00 52.53 H new ATOM 0 HG21 VAL A 16 8.359 8.123 -3.513 1.00 53.31 H new ATOM 0 HG22 VAL A 16 8.675 7.984 -5.259 1.00 53.31 H new ATOM 0 HG23 VAL A 16 8.375 6.522 -4.290 1.00 53.31 H new ATOM 193 N ASP A 17 10.602 6.427 -7.478 1.00 25.12 N ATOM 194 CA ASP A 17 10.432 6.957 -8.825 1.00 13.42 C ATOM 195 C ASP A 17 9.771 8.333 -8.788 1.00 24.33 C ATOM 196 O ASP A 17 8.856 8.587 -8.006 1.00 15.44 O ATOM 197 CB ASP A 17 9.594 5.999 -9.672 1.00 32.43 C ATOM 198 CG ASP A 17 9.703 6.289 -11.155 1.00 51.24 C ATOM 199 OD1 ASP A 17 10.647 5.777 -11.793 1.00 11.03 O ATOM 200 OD2 ASP A 17 8.844 7.029 -11.679 1.00 73.13 O ATOM 0 H ASP A 17 10.520 5.413 -7.411 1.00 25.12 H new ATOM 0 HA ASP A 17 11.419 7.059 -9.276 1.00 13.42 H new ATOM 0 HB2 ASP A 17 9.915 4.975 -9.481 1.00 32.43 H new ATOM 0 HB3 ASP A 17 8.550 6.068 -9.367 1.00 32.43 H new ATOM 205 N PRO A 18 10.248 9.242 -9.652 1.00 2.24 N ATOM 206 CA PRO A 18 9.719 10.607 -9.735 1.00 62.35 C ATOM 207 C PRO A 18 8.311 10.647 -10.318 1.00 14.00 C ATOM 208 O PRO A 18 7.499 11.494 -9.945 1.00 20.40 O ATOM 209 CB PRO A 18 10.705 11.312 -10.670 1.00 71.04 C ATOM 210 CG PRO A 18 11.288 10.220 -11.500 1.00 75.12 C ATOM 211 CD PRO A 18 11.339 9.008 -10.612 1.00 23.54 C ATOM 0 HA PRO A 18 9.634 11.073 -8.753 1.00 62.35 H new ATOM 0 HB2 PRO A 18 10.201 12.054 -11.289 1.00 71.04 H new ATOM 0 HB3 PRO A 18 11.477 11.837 -10.108 1.00 71.04 H new ATOM 0 HG2 PRO A 18 10.677 10.032 -12.383 1.00 75.12 H new ATOM 0 HG3 PRO A 18 12.284 10.487 -11.853 1.00 75.12 H new ATOM 0 HD2 PRO A 18 11.186 8.089 -11.178 1.00 23.54 H new ATOM 0 HD3 PRO A 18 12.303 8.917 -10.111 1.00 23.54 H new ATOM 219 N GLU A 19 8.027 9.726 -11.235 1.00 21.12 N ATOM 220 CA GLU A 19 6.715 9.658 -11.868 1.00 22.32 C ATOM 221 C GLU A 19 5.656 9.187 -10.876 1.00 75.04 C ATOM 222 O GLU A 19 4.472 9.499 -11.018 1.00 44.43 O ATOM 223 CB GLU A 19 6.756 8.718 -13.074 1.00 74.23 C ATOM 224 CG GLU A 19 6.418 7.276 -12.734 1.00 3.32 C ATOM 225 CD GLU A 19 5.019 6.885 -13.169 1.00 60.22 C ATOM 226 OE1 GLU A 19 4.534 7.442 -14.176 1.00 33.22 O ATOM 227 OE2 GLU A 19 4.411 6.022 -12.502 1.00 75.25 O ATOM 0 H GLU A 19 8.687 9.018 -11.555 1.00 21.12 H new ATOM 0 HA GLU A 19 6.450 10.660 -12.206 1.00 22.32 H new ATOM 0 HB2 GLU A 19 6.057 9.078 -13.828 1.00 74.23 H new ATOM 0 HB3 GLU A 19 7.751 8.754 -13.518 1.00 74.23 H new ATOM 0 HG2 GLU A 19 7.141 6.615 -13.212 1.00 3.32 H new ATOM 0 HG3 GLU A 19 6.514 7.128 -11.658 1.00 3.32 H new ATOM 234 N LEU A 20 6.089 8.432 -9.872 1.00 55.44 N ATOM 235 CA LEU A 20 5.178 7.916 -8.856 1.00 72.31 C ATOM 236 C LEU A 20 5.040 8.899 -7.698 1.00 52.33 C ATOM 237 O LEU A 20 3.934 9.178 -7.234 1.00 72.23 O ATOM 238 CB LEU A 20 5.674 6.565 -8.337 1.00 10.54 C ATOM 239 CG LEU A 20 4.595 5.584 -7.879 1.00 32.32 C ATOM 240 CD1 LEU A 20 5.195 4.211 -7.620 1.00 5.43 C ATOM 241 CD2 LEU A 20 3.894 6.105 -6.633 1.00 13.52 C ATOM 0 H LEU A 20 7.064 8.164 -9.740 1.00 55.44 H new ATOM 0 HA LEU A 20 4.198 7.785 -9.315 1.00 72.31 H new ATOM 0 HB2 LEU A 20 6.259 6.089 -9.124 1.00 10.54 H new ATOM 0 HB3 LEU A 20 6.351 6.746 -7.502 1.00 10.54 H new ATOM 0 HG LEU A 20 3.856 5.490 -8.675 1.00 32.32 H new ATOM 0 HD11 LEU A 20 4.411 3.527 -7.295 1.00 5.43 H new ATOM 0 HD12 LEU A 20 5.649 3.834 -8.536 1.00 5.43 H new ATOM 0 HD13 LEU A 20 5.956 4.287 -6.843 1.00 5.43 H new ATOM 0 HD21 LEU A 20 3.129 5.394 -6.322 1.00 13.52 H new ATOM 0 HD22 LEU A 20 4.622 6.230 -5.831 1.00 13.52 H new ATOM 0 HD23 LEU A 20 3.428 7.066 -6.852 1.00 13.52 H new ATOM 253 N LYS A 21 6.170 9.425 -7.237 1.00 33.31 N ATOM 254 CA LYS A 21 6.177 10.380 -6.136 1.00 3.20 C ATOM 255 C LYS A 21 4.982 11.324 -6.227 1.00 0.40 C ATOM 256 O LYS A 21 4.315 11.592 -5.229 1.00 54.33 O ATOM 257 CB LYS A 21 7.478 11.186 -6.140 1.00 61.34 C ATOM 258 CG LYS A 21 7.724 11.951 -4.853 1.00 10.43 C ATOM 259 CD LYS A 21 8.368 13.302 -5.121 1.00 74.21 C ATOM 260 CE LYS A 21 9.856 13.281 -4.809 1.00 31.13 C ATOM 261 NZ LYS A 21 10.332 14.594 -4.291 1.00 42.25 N ATOM 0 H LYS A 21 7.094 9.205 -7.610 1.00 33.31 H new ATOM 0 HA LYS A 21 6.106 9.821 -5.203 1.00 3.20 H new ATOM 0 HB2 LYS A 21 8.314 10.509 -6.316 1.00 61.34 H new ATOM 0 HB3 LYS A 21 7.457 11.889 -6.972 1.00 61.34 H new ATOM 0 HG2 LYS A 21 6.780 12.095 -4.328 1.00 10.43 H new ATOM 0 HG3 LYS A 21 8.367 11.364 -4.197 1.00 10.43 H new ATOM 0 HD2 LYS A 21 8.218 13.577 -6.165 1.00 74.21 H new ATOM 0 HD3 LYS A 21 7.879 14.066 -4.516 1.00 74.21 H new ATOM 0 HE2 LYS A 21 10.062 12.504 -4.073 1.00 31.13 H new ATOM 0 HE3 LYS A 21 10.413 13.022 -5.710 1.00 31.13 H new ATOM 0 HZ1 LYS A 21 11.351 14.539 -4.090 1.00 42.25 H new ATOM 0 HZ2 LYS A 21 10.159 15.332 -5.003 1.00 42.25 H new ATOM 0 HZ3 LYS A 21 9.819 14.829 -3.417 1.00 42.25 H new ATOM 275 N GLU A 22 4.718 11.823 -7.431 1.00 62.34 N ATOM 276 CA GLU A 22 3.604 12.736 -7.651 1.00 14.34 C ATOM 277 C GLU A 22 2.270 12.029 -7.432 1.00 12.31 C ATOM 278 O GLU A 22 1.365 12.567 -6.791 1.00 3.03 O ATOM 279 CB GLU A 22 3.660 13.314 -9.067 1.00 50.12 C ATOM 280 CG GLU A 22 5.062 13.689 -9.515 1.00 43.42 C ATOM 281 CD GLU A 22 5.062 14.718 -10.630 1.00 25.12 C ATOM 282 OE1 GLU A 22 4.881 15.916 -10.329 1.00 4.41 O ATOM 283 OE2 GLU A 22 5.244 14.325 -11.801 1.00 74.11 O ATOM 0 H GLU A 22 5.261 11.610 -8.268 1.00 62.34 H new ATOM 0 HA GLU A 22 3.688 13.550 -6.931 1.00 14.34 H new ATOM 0 HB2 GLU A 22 3.247 12.585 -9.765 1.00 50.12 H new ATOM 0 HB3 GLU A 22 3.023 14.198 -9.115 1.00 50.12 H new ATOM 0 HG2 GLU A 22 5.619 14.081 -8.664 1.00 43.42 H new ATOM 0 HG3 GLU A 22 5.584 12.793 -9.852 1.00 43.42 H new ATOM 290 N THR A 23 2.153 10.818 -7.968 1.00 55.15 N ATOM 291 CA THR A 23 0.930 10.037 -7.834 1.00 11.10 C ATOM 292 C THR A 23 0.437 10.031 -6.390 1.00 61.24 C ATOM 293 O THR A 23 -0.760 10.153 -6.132 1.00 74.45 O ATOM 294 CB THR A 23 1.138 8.584 -8.300 1.00 32.14 C ATOM 295 OG1 THR A 23 1.223 8.534 -9.728 1.00 11.34 O ATOM 296 CG2 THR A 23 -0.002 7.695 -7.824 1.00 60.51 C ATOM 0 H THR A 23 2.891 10.357 -8.499 1.00 55.15 H new ATOM 0 HA THR A 23 0.181 10.510 -8.469 1.00 11.10 H new ATOM 0 HB THR A 23 2.069 8.218 -7.868 1.00 32.14 H new ATOM 0 HG1 THR A 23 1.799 7.788 -9.995 1.00 11.34 H new ATOM 0 HG21 THR A 23 0.166 6.674 -8.165 1.00 60.51 H new ATOM 0 HG22 THR A 23 -0.046 7.711 -6.735 1.00 60.51 H new ATOM 0 HG23 THR A 23 -0.944 8.063 -8.231 1.00 60.51 H new ATOM 304 N LEU A 24 1.369 9.890 -5.453 1.00 55.23 N ATOM 305 CA LEU A 24 1.029 9.869 -4.035 1.00 34.03 C ATOM 306 C LEU A 24 0.582 11.248 -3.562 1.00 61.00 C ATOM 307 O LEU A 24 -0.462 11.389 -2.924 1.00 61.31 O ATOM 308 CB LEU A 24 2.228 9.398 -3.211 1.00 2.14 C ATOM 309 CG LEU A 24 2.981 8.184 -3.755 1.00 62.20 C ATOM 310 CD1 LEU A 24 4.107 7.788 -2.812 1.00 34.52 C ATOM 311 CD2 LEU A 24 2.029 7.018 -3.971 1.00 34.54 C ATOM 0 H LEU A 24 2.365 9.789 -5.650 1.00 55.23 H new ATOM 0 HA LEU A 24 0.203 9.172 -3.894 1.00 34.03 H new ATOM 0 HB2 LEU A 24 2.931 10.227 -3.123 1.00 2.14 H new ATOM 0 HB3 LEU A 24 1.882 9.165 -2.204 1.00 2.14 H new ATOM 0 HG LEU A 24 3.418 8.453 -4.717 1.00 62.20 H new ATOM 0 HD11 LEU A 24 4.632 6.922 -3.215 1.00 34.52 H new ATOM 0 HD12 LEU A 24 4.804 8.619 -2.709 1.00 34.52 H new ATOM 0 HD13 LEU A 24 3.693 7.538 -1.835 1.00 34.52 H new ATOM 0 HD21 LEU A 24 2.583 6.163 -4.358 1.00 34.54 H new ATOM 0 HD22 LEU A 24 1.562 6.749 -3.023 1.00 34.54 H new ATOM 0 HD23 LEU A 24 1.258 7.305 -4.686 1.00 34.54 H new ATOM 323 N ARG A 25 1.377 12.264 -3.880 1.00 63.13 N ATOM 324 CA ARG A 25 1.064 13.633 -3.488 1.00 32.40 C ATOM 325 C ARG A 25 -0.279 14.070 -4.067 1.00 31.43 C ATOM 326 O ARG A 25 -0.923 14.982 -3.550 1.00 2.30 O ATOM 327 CB ARG A 25 2.166 14.586 -3.955 1.00 31.33 C ATOM 328 CG ARG A 25 2.178 15.913 -3.214 1.00 73.12 C ATOM 329 CD ARG A 25 3.595 16.362 -2.897 1.00 25.42 C ATOM 330 NE ARG A 25 3.902 17.663 -3.484 1.00 41.14 N ATOM 331 CZ ARG A 25 5.034 18.321 -3.264 1.00 0.13 C ATOM 332 NH1 ARG A 25 5.963 17.801 -2.473 1.00 23.41 N ATOM 333 NH2 ARG A 25 5.240 19.501 -3.834 1.00 44.31 N ATOM 0 H ARG A 25 2.244 12.165 -4.409 1.00 63.13 H new ATOM 0 HA ARG A 25 1.001 13.667 -2.400 1.00 32.40 H new ATOM 0 HB2 ARG A 25 3.133 14.100 -3.828 1.00 31.33 H new ATOM 0 HB3 ARG A 25 2.043 14.776 -5.021 1.00 31.33 H new ATOM 0 HG2 ARG A 25 1.681 16.672 -3.818 1.00 73.12 H new ATOM 0 HG3 ARG A 25 1.609 15.819 -2.289 1.00 73.12 H new ATOM 0 HD2 ARG A 25 3.726 16.412 -1.816 1.00 25.42 H new ATOM 0 HD3 ARG A 25 4.302 15.621 -3.269 1.00 25.42 H new ATOM 0 HE ARG A 25 3.208 18.090 -4.097 1.00 41.14 H new ATOM 0 HH11 ARG A 25 5.808 16.894 -2.033 1.00 23.41 H new ATOM 0 HH12 ARG A 25 6.832 18.308 -2.305 1.00 23.41 H new ATOM 0 HH21 ARG A 25 4.528 19.905 -4.443 1.00 44.31 H new ATOM 0 HH22 ARG A 25 6.110 20.005 -3.664 1.00 44.31 H new ATOM 347 N LYS A 26 -0.695 13.412 -5.144 1.00 20.43 N ATOM 348 CA LYS A 26 -1.961 13.730 -5.793 1.00 73.23 C ATOM 349 C LYS A 26 -3.101 12.915 -5.192 1.00 13.54 C ATOM 350 O LYS A 26 -4.203 13.426 -4.990 1.00 55.11 O ATOM 351 CB LYS A 26 -1.867 13.462 -7.297 1.00 61.41 C ATOM 352 CG LYS A 26 -0.558 13.922 -7.917 1.00 33.55 C ATOM 353 CD LYS A 26 -0.786 14.992 -8.971 1.00 44.12 C ATOM 354 CE LYS A 26 0.185 14.844 -10.133 1.00 34.43 C ATOM 355 NZ LYS A 26 -0.505 14.951 -11.448 1.00 44.11 N ATOM 0 H LYS A 26 -0.173 12.655 -5.586 1.00 20.43 H new ATOM 0 HA LYS A 26 -2.169 14.787 -5.630 1.00 73.23 H new ATOM 0 HB2 LYS A 26 -1.988 12.394 -7.475 1.00 61.41 H new ATOM 0 HB3 LYS A 26 -2.694 13.965 -7.799 1.00 61.41 H new ATOM 0 HG2 LYS A 26 0.098 14.311 -7.138 1.00 33.55 H new ATOM 0 HG3 LYS A 26 -0.048 13.070 -8.367 1.00 33.55 H new ATOM 0 HD2 LYS A 26 -1.810 14.929 -9.340 1.00 44.12 H new ATOM 0 HD3 LYS A 26 -0.670 15.978 -8.521 1.00 44.12 H new ATOM 0 HE2 LYS A 26 0.955 15.612 -10.063 1.00 34.43 H new ATOM 0 HE3 LYS A 26 0.689 13.880 -10.065 1.00 34.43 H new ATOM 0 HZ1 LYS A 26 0.190 14.845 -12.214 1.00 44.11 H new ATOM 0 HZ2 LYS A 26 -1.223 14.202 -11.525 1.00 44.11 H new ATOM 0 HZ3 LYS A 26 -0.965 15.881 -11.524 1.00 44.11 H new ATOM 369 N PHE A 27 -2.830 11.646 -4.906 1.00 50.40 N ATOM 370 CA PHE A 27 -3.834 10.762 -4.327 1.00 34.40 C ATOM 371 C PHE A 27 -4.350 11.317 -3.003 1.00 11.50 C ATOM 372 O PHE A 27 -5.521 11.153 -2.662 1.00 74.04 O ATOM 373 CB PHE A 27 -3.250 9.363 -4.112 1.00 43.33 C ATOM 374 CG PHE A 27 -4.293 8.292 -3.977 1.00 53.12 C ATOM 375 CD1 PHE A 27 -5.366 8.237 -4.852 1.00 51.22 C ATOM 376 CD2 PHE A 27 -4.201 7.339 -2.976 1.00 31.21 C ATOM 377 CE1 PHE A 27 -6.329 7.253 -4.729 1.00 3.00 C ATOM 378 CE2 PHE A 27 -5.160 6.352 -2.848 1.00 65.31 C ATOM 379 CZ PHE A 27 -6.225 6.308 -3.727 1.00 23.24 C ATOM 0 H PHE A 27 -1.923 11.207 -5.066 1.00 50.40 H new ATOM 0 HA PHE A 27 -4.669 10.697 -5.024 1.00 34.40 H new ATOM 0 HB2 PHE A 27 -2.596 9.119 -4.949 1.00 43.33 H new ATOM 0 HB3 PHE A 27 -2.630 9.371 -3.215 1.00 43.33 H new ATOM 0 HD1 PHE A 27 -5.451 8.971 -5.639 1.00 51.22 H new ATOM 0 HD2 PHE A 27 -3.370 7.368 -2.287 1.00 31.21 H new ATOM 0 HE1 PHE A 27 -7.162 7.223 -5.416 1.00 3.00 H new ATOM 0 HE2 PHE A 27 -5.077 5.616 -2.062 1.00 65.31 H new ATOM 0 HZ PHE A 27 -6.975 5.536 -3.631 1.00 23.24 H new ATOM 389 N ARG A 28 -3.466 11.977 -2.260 1.00 71.34 N ATOM 390 CA ARG A 28 -3.831 12.556 -0.973 1.00 73.20 C ATOM 391 C ARG A 28 -4.697 13.798 -1.162 1.00 2.43 C ATOM 392 O ARG A 28 -5.642 14.030 -0.406 1.00 4.42 O ATOM 393 CB ARG A 28 -2.575 12.913 -0.175 1.00 71.44 C ATOM 394 CG ARG A 28 -1.465 11.881 -0.295 1.00 71.23 C ATOM 395 CD ARG A 28 -0.889 11.523 1.066 1.00 63.11 C ATOM 396 NE ARG A 28 -0.352 12.691 1.757 1.00 3.55 N ATOM 397 CZ ARG A 28 -0.214 12.766 3.077 1.00 24.24 C ATOM 398 NH1 ARG A 28 -0.572 11.744 3.843 1.00 22.21 N ATOM 399 NH2 ARG A 28 0.283 13.863 3.633 1.00 3.10 N ATOM 0 H ARG A 28 -2.493 12.124 -2.528 1.00 71.34 H new ATOM 0 HA ARG A 28 -4.406 11.814 -0.419 1.00 73.20 H new ATOM 0 HB2 ARG A 28 -2.201 13.879 -0.515 1.00 71.44 H new ATOM 0 HB3 ARG A 28 -2.842 13.027 0.876 1.00 71.44 H new ATOM 0 HG2 ARG A 28 -1.852 10.982 -0.775 1.00 71.23 H new ATOM 0 HG3 ARG A 28 -0.673 12.269 -0.936 1.00 71.23 H new ATOM 0 HD2 ARG A 28 -1.665 11.064 1.679 1.00 63.11 H new ATOM 0 HD3 ARG A 28 -0.100 10.781 0.942 1.00 63.11 H new ATOM 0 HE ARG A 28 -0.067 13.494 1.196 1.00 3.55 H new ATOM 0 HH11 ARG A 28 -0.954 10.898 3.419 1.00 22.21 H new ATOM 0 HH12 ARG A 28 -0.465 11.804 4.856 1.00 22.21 H new ATOM 0 HH21 ARG A 28 0.560 14.651 3.047 1.00 3.10 H new ATOM 0 HH22 ARG A 28 0.388 13.919 4.646 1.00 3.10 H new ATOM 413 N PHE A 29 -4.367 14.594 -2.173 1.00 51.41 N ATOM 414 CA PHE A 29 -5.114 15.814 -2.460 1.00 41.25 C ATOM 415 C PHE A 29 -5.737 15.756 -3.852 1.00 34.52 C ATOM 416 O PHE A 29 -5.790 16.759 -4.562 1.00 43.13 O ATOM 417 CB PHE A 29 -4.197 17.035 -2.350 1.00 73.11 C ATOM 418 CG PHE A 29 -3.000 16.808 -1.473 1.00 3.22 C ATOM 419 CD1 PHE A 29 -3.148 16.296 -0.195 1.00 5.33 C ATOM 420 CD2 PHE A 29 -1.725 17.107 -1.928 1.00 62.11 C ATOM 421 CE1 PHE A 29 -2.046 16.088 0.615 1.00 61.40 C ATOM 422 CE2 PHE A 29 -0.620 16.900 -1.124 1.00 13.01 C ATOM 423 CZ PHE A 29 -0.781 16.389 0.149 1.00 52.11 C ATOM 0 H PHE A 29 -3.588 14.417 -2.807 1.00 51.41 H new ATOM 0 HA PHE A 29 -5.915 15.901 -1.726 1.00 41.25 H new ATOM 0 HB2 PHE A 29 -3.859 17.316 -3.347 1.00 73.11 H new ATOM 0 HB3 PHE A 29 -4.770 17.876 -1.959 1.00 73.11 H new ATOM 0 HD1 PHE A 29 -4.135 16.056 0.173 1.00 5.33 H new ATOM 0 HD2 PHE A 29 -1.594 17.507 -2.923 1.00 62.11 H new ATOM 0 HE1 PHE A 29 -2.175 15.691 1.611 1.00 61.40 H new ATOM 0 HE2 PHE A 29 0.368 17.137 -1.491 1.00 13.01 H new ATOM 0 HZ PHE A 29 0.081 16.225 0.779 1.00 52.11 H new ATOM 433 N ARG A 30 -6.208 14.573 -4.234 1.00 23.33 N ATOM 434 CA ARG A 30 -6.826 14.382 -5.539 1.00 63.54 C ATOM 435 C ARG A 30 -8.125 15.174 -5.648 1.00 14.32 C ATOM 436 O ARG A 30 -8.599 15.747 -4.666 1.00 2.33 O ATOM 437 CB ARG A 30 -7.099 12.898 -5.786 1.00 33.32 C ATOM 438 CG ARG A 30 -7.943 12.246 -4.703 1.00 34.21 C ATOM 439 CD ARG A 30 -7.733 10.740 -4.663 1.00 34.11 C ATOM 440 NE ARG A 30 -8.782 10.022 -5.381 1.00 72.03 N ATOM 441 CZ ARG A 30 -9.291 8.864 -4.974 1.00 60.41 C ATOM 442 NH1 ARG A 30 -8.849 8.297 -3.860 1.00 54.20 N ATOM 443 NH2 ARG A 30 -10.243 8.271 -5.682 1.00 21.32 N ATOM 0 H ARG A 30 -6.173 13.733 -3.657 1.00 23.33 H new ATOM 0 HA ARG A 30 -6.133 14.748 -6.297 1.00 63.54 H new ATOM 0 HB2 ARG A 30 -7.604 12.785 -6.746 1.00 33.32 H new ATOM 0 HB3 ARG A 30 -6.148 12.370 -5.861 1.00 33.32 H new ATOM 0 HG2 ARG A 30 -7.689 12.676 -3.734 1.00 34.21 H new ATOM 0 HG3 ARG A 30 -8.996 12.463 -4.881 1.00 34.21 H new ATOM 0 HD2 ARG A 30 -6.764 10.497 -5.099 1.00 34.11 H new ATOM 0 HD3 ARG A 30 -7.709 10.405 -3.626 1.00 34.11 H new ATOM 0 HE ARG A 30 -9.144 10.432 -6.242 1.00 72.03 H new ATOM 0 HH11 ARG A 30 -8.117 8.750 -3.313 1.00 54.20 H new ATOM 0 HH12 ARG A 30 -9.241 7.408 -3.550 1.00 54.20 H new ATOM 0 HH21 ARG A 30 -10.585 8.704 -6.540 1.00 21.32 H new ATOM 0 HH22 ARG A 30 -10.633 7.382 -5.369 1.00 21.32 H new ATOM 508 N ASN A 34 -13.940 9.502 -3.502 1.00 12.21 N ATOM 509 CA ASN A 34 -14.308 8.095 -3.402 1.00 22.11 C ATOM 510 C ASN A 34 -13.095 7.240 -3.045 1.00 13.35 C ATOM 511 O ASN A 34 -11.972 7.737 -2.974 1.00 13.40 O ATOM 512 CB ASN A 34 -14.917 7.611 -4.720 1.00 65.31 C ATOM 513 CG ASN A 34 -14.183 6.411 -5.289 1.00 33.51 C ATOM 514 OD1 ASN A 34 -14.446 5.270 -4.906 1.00 3.12 O ATOM 515 ND2 ASN A 34 -13.259 6.663 -6.208 1.00 1.33 N ATOM 0 HA ASN A 34 -15.048 7.994 -2.608 1.00 22.11 H new ATOM 0 HB2 ASN A 34 -15.963 7.351 -4.560 1.00 65.31 H new ATOM 0 HB3 ASN A 34 -14.898 8.424 -5.446 1.00 65.31 H new ATOM 0 HD21 ASN A 34 -12.734 5.896 -6.627 1.00 1.33 H new ATOM 0 HD22 ASN A 34 -13.074 7.624 -6.495 1.00 1.33 H new ATOM 522 N ASN A 35 -13.332 5.952 -2.821 1.00 60.51 N ATOM 523 CA ASN A 35 -12.260 5.027 -2.471 1.00 64.02 C ATOM 524 C ASN A 35 -11.459 4.629 -3.707 1.00 3.52 C ATOM 525 O ASN A 35 -11.995 4.564 -4.813 1.00 15.40 O ATOM 526 CB ASN A 35 -12.833 3.778 -1.798 1.00 51.31 C ATOM 527 CG ASN A 35 -13.515 4.093 -0.481 1.00 22.54 C ATOM 528 OD1 ASN A 35 -13.575 5.249 -0.061 1.00 24.51 O ATOM 529 ND2 ASN A 35 -14.031 3.062 0.179 1.00 3.13 N ATOM 0 H ASN A 35 -14.257 5.525 -2.876 1.00 60.51 H new ATOM 0 HA ASN A 35 -11.592 5.533 -1.774 1.00 64.02 H new ATOM 0 HB2 ASN A 35 -13.548 3.302 -2.470 1.00 51.31 H new ATOM 0 HB3 ASN A 35 -12.031 3.061 -1.626 1.00 51.31 H new ATOM 0 HD21 ASN A 35 -14.500 3.212 1.072 1.00 3.13 H new ATOM 0 HD22 ASN A 35 -13.958 2.121 -0.207 1.00 3.13 H new ATOM 536 N ALA A 36 -10.171 4.365 -3.512 1.00 1.01 N ATOM 537 CA ALA A 36 -9.297 3.972 -4.610 1.00 22.53 C ATOM 538 C ALA A 36 -8.055 3.252 -4.092 1.00 35.12 C ATOM 539 O ALA A 36 -7.709 3.359 -2.915 1.00 55.35 O ATOM 540 CB ALA A 36 -8.899 5.189 -5.430 1.00 43.03 C ATOM 0 H ALA A 36 -9.710 4.416 -2.604 1.00 1.01 H new ATOM 0 HA ALA A 36 -9.847 3.281 -5.249 1.00 22.53 H new ATOM 0 HB1 ALA A 36 -8.246 4.880 -6.246 1.00 43.03 H new ATOM 0 HB2 ALA A 36 -9.793 5.661 -5.839 1.00 43.03 H new ATOM 0 HB3 ALA A 36 -8.372 5.900 -4.794 1.00 43.03 H new ATOM 546 N ALA A 37 -7.390 2.517 -4.978 1.00 3.41 N ATOM 547 CA ALA A 37 -6.187 1.782 -4.611 1.00 3.15 C ATOM 548 C ALA A 37 -5.071 2.012 -5.624 1.00 10.12 C ATOM 549 O ALA A 37 -5.329 2.183 -6.816 1.00 11.01 O ATOM 550 CB ALA A 37 -6.493 0.297 -4.488 1.00 60.50 C ATOM 0 H ALA A 37 -7.665 2.415 -5.955 1.00 3.41 H new ATOM 0 HA ALA A 37 -5.846 2.153 -3.645 1.00 3.15 H new ATOM 0 HB1 ALA A 37 -5.585 -0.240 -4.213 1.00 60.50 H new ATOM 0 HB2 ALA A 37 -7.251 0.144 -3.720 1.00 60.50 H new ATOM 0 HB3 ALA A 37 -6.862 -0.079 -5.442 1.00 60.50 H new ATOM 556 N ILE A 38 -3.833 2.016 -5.143 1.00 60.22 N ATOM 557 CA ILE A 38 -2.678 2.226 -6.008 1.00 72.24 C ATOM 558 C ILE A 38 -1.610 1.164 -5.766 1.00 13.44 C ATOM 559 O ILE A 38 -0.935 1.173 -4.736 1.00 50.31 O ATOM 560 CB ILE A 38 -2.060 3.619 -5.793 1.00 41.11 C ATOM 561 CG1 ILE A 38 -3.142 4.698 -5.859 1.00 33.31 C ATOM 562 CG2 ILE A 38 -0.978 3.884 -6.830 1.00 63.44 C ATOM 563 CD1 ILE A 38 -2.593 6.098 -6.019 1.00 24.13 C ATOM 0 H ILE A 38 -3.603 1.876 -4.159 1.00 60.22 H new ATOM 0 HA ILE A 38 -3.035 2.151 -7.035 1.00 72.24 H new ATOM 0 HB ILE A 38 -1.604 3.648 -4.803 1.00 41.11 H new ATOM 0 HG12 ILE A 38 -3.809 4.481 -6.693 1.00 33.31 H new ATOM 0 HG13 ILE A 38 -3.743 4.654 -4.951 1.00 33.31 H new ATOM 0 HG21 ILE A 38 -0.550 4.873 -6.665 1.00 63.44 H new ATOM 0 HG22 ILE A 38 -0.195 3.131 -6.740 1.00 63.44 H new ATOM 0 HG23 ILE A 38 -1.412 3.839 -7.829 1.00 63.44 H new ATOM 0 HD11 ILE A 38 -3.418 6.810 -6.058 1.00 24.13 H new ATOM 0 HD12 ILE A 38 -1.949 6.335 -5.172 1.00 24.13 H new ATOM 0 HD13 ILE A 38 -2.016 6.159 -6.942 1.00 24.13 H new ATOM 575 N ILE A 39 -1.462 0.253 -6.721 1.00 61.23 N ATOM 576 CA ILE A 39 -0.473 -0.813 -6.613 1.00 14.32 C ATOM 577 C ILE A 39 0.842 -0.412 -7.272 1.00 34.22 C ATOM 578 O ILE A 39 0.898 -0.184 -8.479 1.00 45.05 O ATOM 579 CB ILE A 39 -0.981 -2.118 -7.255 1.00 45.24 C ATOM 580 CG1 ILE A 39 -2.275 -2.575 -6.579 1.00 64.11 C ATOM 581 CG2 ILE A 39 0.084 -3.201 -7.163 1.00 13.24 C ATOM 582 CD1 ILE A 39 -3.350 -2.997 -7.556 1.00 63.44 C ATOM 0 H ILE A 39 -2.014 0.231 -7.578 1.00 61.23 H new ATOM 0 HA ILE A 39 -0.305 -0.982 -5.549 1.00 14.32 H new ATOM 0 HB ILE A 39 -1.192 -1.931 -8.308 1.00 45.24 H new ATOM 0 HG12 ILE A 39 -2.053 -3.409 -5.913 1.00 64.11 H new ATOM 0 HG13 ILE A 39 -2.657 -1.765 -5.958 1.00 64.11 H new ATOM 0 HG21 ILE A 39 -0.289 -4.117 -7.620 1.00 13.24 H new ATOM 0 HG22 ILE A 39 0.982 -2.873 -7.686 1.00 13.24 H new ATOM 0 HG23 ILE A 39 0.322 -3.389 -6.116 1.00 13.24 H new ATOM 0 HD11 ILE A 39 -4.239 -3.309 -7.007 1.00 63.44 H new ATOM 0 HD12 ILE A 39 -3.600 -2.159 -8.206 1.00 63.44 H new ATOM 0 HD13 ILE A 39 -2.987 -3.828 -8.160 1.00 63.44 H new ATOM 594 N MET A 40 1.898 -0.330 -6.470 1.00 0.11 N ATOM 595 CA MET A 40 3.215 0.040 -6.976 1.00 14.30 C ATOM 596 C MET A 40 4.197 -1.118 -6.836 1.00 43.12 C ATOM 597 O MET A 40 4.058 -1.960 -5.948 1.00 51.21 O ATOM 598 CB MET A 40 3.745 1.267 -6.230 1.00 50.15 C ATOM 599 CG MET A 40 2.679 2.311 -5.941 1.00 32.42 C ATOM 600 SD MET A 40 2.989 3.216 -4.414 1.00 31.04 S ATOM 601 CE MET A 40 1.618 2.659 -3.405 1.00 11.05 C ATOM 0 H MET A 40 1.868 -0.515 -5.467 1.00 0.11 H new ATOM 0 HA MET A 40 3.115 0.282 -8.034 1.00 14.30 H new ATOM 0 HB2 MET A 40 4.191 0.945 -5.289 1.00 50.15 H new ATOM 0 HB3 MET A 40 4.540 1.725 -6.819 1.00 50.15 H new ATOM 0 HG2 MET A 40 2.630 3.015 -6.772 1.00 32.42 H new ATOM 0 HG3 MET A 40 1.706 1.824 -5.879 1.00 32.42 H new ATOM 0 HE1 MET A 40 1.934 2.596 -2.364 1.00 11.05 H new ATOM 0 HE2 MET A 40 0.792 3.365 -3.492 1.00 11.05 H new ATOM 0 HE3 MET A 40 1.292 1.676 -3.745 1.00 11.05 H new ATOM 611 N LYS A 41 5.190 -1.156 -7.718 1.00 74.22 N ATOM 612 CA LYS A 41 6.196 -2.212 -7.694 1.00 5.44 C ATOM 613 C LYS A 41 7.603 -1.621 -7.702 1.00 14.23 C ATOM 614 O LYS A 41 7.776 -0.405 -7.775 1.00 45.54 O ATOM 615 CB LYS A 41 6.016 -3.145 -8.892 1.00 62.03 C ATOM 616 CG LYS A 41 6.387 -2.507 -10.220 1.00 22.43 C ATOM 617 CD LYS A 41 6.559 -3.551 -11.311 1.00 32.43 C ATOM 618 CE LYS A 41 5.889 -3.120 -12.606 1.00 22.53 C ATOM 619 NZ LYS A 41 5.762 -4.250 -13.568 1.00 53.13 N ATOM 0 H LYS A 41 5.320 -0.467 -8.459 1.00 74.22 H new ATOM 0 HA LYS A 41 6.065 -2.784 -6.775 1.00 5.44 H new ATOM 0 HB2 LYS A 41 6.626 -4.036 -8.743 1.00 62.03 H new ATOM 0 HB3 LYS A 41 4.977 -3.473 -8.934 1.00 62.03 H new ATOM 0 HG2 LYS A 41 5.613 -1.797 -10.513 1.00 22.43 H new ATOM 0 HG3 LYS A 41 7.312 -1.941 -10.107 1.00 22.43 H new ATOM 0 HD2 LYS A 41 7.621 -3.721 -11.489 1.00 32.43 H new ATOM 0 HD3 LYS A 41 6.135 -4.499 -10.979 1.00 32.43 H new ATOM 0 HE2 LYS A 41 4.900 -2.717 -12.387 1.00 22.53 H new ATOM 0 HE3 LYS A 41 6.466 -2.317 -13.064 1.00 22.53 H new ATOM 0 HZ1 LYS A 41 5.300 -3.915 -14.438 1.00 53.13 H new ATOM 0 HZ2 LYS A 41 6.707 -4.619 -13.797 1.00 53.13 H new ATOM 0 HZ3 LYS A 41 5.190 -5.006 -13.141 1.00 53.13 H new ATOM 633 N VAL A 42 8.605 -2.491 -7.627 1.00 11.23 N ATOM 634 CA VAL A 42 9.996 -2.056 -7.628 1.00 64.11 C ATOM 635 C VAL A 42 10.810 -2.820 -8.667 1.00 15.23 C ATOM 636 O VAL A 42 11.032 -4.023 -8.534 1.00 23.32 O ATOM 637 CB VAL A 42 10.645 -2.246 -6.243 1.00 70.33 C ATOM 638 CG1 VAL A 42 10.125 -3.511 -5.579 1.00 21.42 C ATOM 639 CG2 VAL A 42 12.161 -2.283 -6.367 1.00 31.22 C ATOM 0 H VAL A 42 8.479 -3.501 -7.565 1.00 11.23 H new ATOM 0 HA VAL A 42 9.996 -0.995 -7.879 1.00 64.11 H new ATOM 0 HB VAL A 42 10.375 -1.398 -5.614 1.00 70.33 H new ATOM 0 HG11 VAL A 42 10.594 -3.629 -4.602 1.00 21.42 H new ATOM 0 HG12 VAL A 42 9.044 -3.440 -5.456 1.00 21.42 H new ATOM 0 HG13 VAL A 42 10.363 -4.373 -6.202 1.00 21.42 H new ATOM 0 HG21 VAL A 42 12.604 -2.418 -5.380 1.00 31.22 H new ATOM 0 HG22 VAL A 42 12.453 -3.112 -7.012 1.00 31.22 H new ATOM 0 HG23 VAL A 42 12.514 -1.346 -6.798 1.00 31.22 H new ATOM 649 N ASP A 43 11.252 -2.112 -9.701 1.00 74.30 N ATOM 650 CA ASP A 43 12.043 -2.723 -10.763 1.00 61.31 C ATOM 651 C ASP A 43 13.464 -3.006 -10.288 1.00 44.33 C ATOM 652 O ASP A 43 14.195 -2.092 -9.900 1.00 75.22 O ATOM 653 CB ASP A 43 12.073 -1.813 -11.992 1.00 24.21 C ATOM 654 CG ASP A 43 10.941 -2.105 -12.957 1.00 13.10 C ATOM 655 OD1 ASP A 43 10.002 -2.833 -12.569 1.00 3.22 O ATOM 656 OD2 ASP A 43 10.993 -1.606 -14.100 1.00 13.20 O ATOM 0 H ASP A 43 11.076 -1.115 -9.826 1.00 74.30 H new ATOM 0 HA ASP A 43 11.575 -3.670 -11.033 1.00 61.31 H new ATOM 0 HB2 ASP A 43 12.014 -0.773 -11.672 1.00 24.21 H new ATOM 0 HB3 ASP A 43 13.026 -1.934 -12.507 1.00 24.21 H new ATOM 661 N LYS A 44 13.853 -4.276 -10.321 1.00 12.45 N ATOM 662 CA LYS A 44 15.187 -4.680 -9.894 1.00 61.34 C ATOM 663 C LYS A 44 16.250 -4.127 -10.837 1.00 70.10 C ATOM 664 O LYS A 44 17.411 -3.973 -10.457 1.00 24.42 O ATOM 665 CB LYS A 44 15.285 -6.206 -9.836 1.00 2.25 C ATOM 666 CG LYS A 44 16.661 -6.711 -9.438 1.00 25.42 C ATOM 667 CD LYS A 44 17.475 -7.131 -10.651 1.00 14.01 C ATOM 668 CE LYS A 44 18.461 -8.236 -10.307 1.00 34.54 C ATOM 669 NZ LYS A 44 19.736 -7.694 -9.763 1.00 52.51 N ATOM 0 H LYS A 44 13.262 -5.044 -10.640 1.00 12.45 H new ATOM 0 HA LYS A 44 15.362 -4.273 -8.898 1.00 61.34 H new ATOM 0 HB2 LYS A 44 14.549 -6.582 -9.125 1.00 2.25 H new ATOM 0 HB3 LYS A 44 15.025 -6.616 -10.812 1.00 2.25 H new ATOM 0 HG2 LYS A 44 17.193 -5.930 -8.895 1.00 25.42 H new ATOM 0 HG3 LYS A 44 16.556 -7.557 -8.759 1.00 25.42 H new ATOM 0 HD2 LYS A 44 16.804 -7.473 -11.439 1.00 14.01 H new ATOM 0 HD3 LYS A 44 18.015 -6.270 -11.044 1.00 14.01 H new ATOM 0 HE2 LYS A 44 18.012 -8.909 -9.576 1.00 34.54 H new ATOM 0 HE3 LYS A 44 18.669 -8.827 -11.199 1.00 34.54 H new ATOM 0 HZ1 LYS A 44 20.381 -8.479 -9.541 1.00 52.51 H new ATOM 0 HZ2 LYS A 44 20.178 -7.072 -10.469 1.00 52.51 H new ATOM 0 HZ3 LYS A 44 19.541 -7.151 -8.898 1.00 52.51 H new ATOM 683 N ASP A 45 15.846 -3.827 -12.067 1.00 30.41 N ATOM 684 CA ASP A 45 16.764 -3.288 -13.063 1.00 24.51 C ATOM 685 C ASP A 45 17.162 -1.857 -12.717 1.00 43.21 C ATOM 686 O ASP A 45 18.327 -1.478 -12.843 1.00 20.31 O ATOM 687 CB ASP A 45 16.126 -3.333 -14.453 1.00 0.54 C ATOM 688 CG ASP A 45 17.155 -3.459 -15.559 1.00 33.23 C ATOM 689 OD1 ASP A 45 18.267 -3.953 -15.280 1.00 23.20 O ATOM 690 OD2 ASP A 45 16.848 -3.065 -16.703 1.00 12.51 O ATOM 0 H ASP A 45 14.889 -3.948 -12.398 1.00 30.41 H new ATOM 0 HA ASP A 45 17.663 -3.905 -13.065 1.00 24.51 H new ATOM 0 HB2 ASP A 45 15.436 -4.175 -14.506 1.00 0.54 H new ATOM 0 HB3 ASP A 45 15.538 -2.428 -14.609 1.00 0.54 H new ATOM 695 N ARG A 46 16.187 -1.066 -12.282 1.00 42.44 N ATOM 696 CA ARG A 46 16.435 0.324 -11.921 1.00 41.23 C ATOM 697 C ARG A 46 16.474 0.494 -10.405 1.00 72.14 C ATOM 698 O ARG A 46 16.753 1.581 -9.900 1.00 74.50 O ATOM 699 CB ARG A 46 15.356 1.230 -12.519 1.00 33.50 C ATOM 700 CG ARG A 46 15.177 1.056 -14.018 1.00 30.22 C ATOM 701 CD ARG A 46 13.853 1.633 -14.492 1.00 1.43 C ATOM 702 NE ARG A 46 13.989 3.013 -14.949 1.00 41.00 N ATOM 703 CZ ARG A 46 13.023 3.681 -15.571 1.00 13.00 C ATOM 704 NH1 ARG A 46 11.856 3.098 -15.807 1.00 12.11 N ATOM 705 NH2 ARG A 46 13.224 4.934 -15.957 1.00 15.02 N ATOM 0 H ARG A 46 15.218 -1.364 -12.171 1.00 42.44 H new ATOM 0 HA ARG A 46 17.405 0.610 -12.327 1.00 41.23 H new ATOM 0 HB2 ARG A 46 14.407 1.027 -12.022 1.00 33.50 H new ATOM 0 HB3 ARG A 46 15.609 2.269 -12.310 1.00 33.50 H new ATOM 0 HG2 ARG A 46 15.997 1.546 -14.543 1.00 30.22 H new ATOM 0 HG3 ARG A 46 15.225 -0.003 -14.271 1.00 30.22 H new ATOM 0 HD2 ARG A 46 13.460 1.020 -15.303 1.00 1.43 H new ATOM 0 HD3 ARG A 46 13.127 1.590 -13.680 1.00 1.43 H new ATOM 0 HE ARG A 46 14.874 3.491 -14.782 1.00 41.00 H new ATOM 0 HH11 ARG A 46 11.698 2.135 -15.511 1.00 12.11 H new ATOM 0 HH12 ARG A 46 11.116 3.613 -16.285 1.00 12.11 H new ATOM 0 HH21 ARG A 46 14.121 5.386 -15.777 1.00 15.02 H new ATOM 0 HH22 ARG A 46 12.482 5.446 -16.434 1.00 15.02 H new ATOM 719 N GLN A 47 16.192 -0.589 -9.686 1.00 52.34 N ATOM 720 CA GLN A 47 16.193 -0.559 -8.229 1.00 51.33 C ATOM 721 C GLN A 47 15.409 0.641 -7.709 1.00 35.42 C ATOM 722 O GLN A 47 15.853 1.338 -6.798 1.00 4.04 O ATOM 723 CB GLN A 47 17.628 -0.513 -7.700 1.00 41.43 C ATOM 724 CG GLN A 47 18.550 -1.528 -8.355 1.00 44.44 C ATOM 725 CD GLN A 47 18.832 -2.722 -7.465 1.00 2.51 C ATOM 726 OE1 GLN A 47 19.780 -2.714 -6.679 1.00 74.11 O ATOM 727 NE2 GLN A 47 18.008 -3.756 -7.582 1.00 61.21 N ATOM 0 H GLN A 47 15.960 -1.497 -10.089 1.00 52.34 H new ATOM 0 HA GLN A 47 15.710 -1.468 -7.872 1.00 51.33 H new ATOM 0 HB2 GLN A 47 18.032 0.487 -7.857 1.00 41.43 H new ATOM 0 HB3 GLN A 47 17.616 -0.687 -6.624 1.00 41.43 H new ATOM 0 HG2 GLN A 47 18.101 -1.872 -9.287 1.00 44.44 H new ATOM 0 HG3 GLN A 47 19.491 -1.043 -8.615 1.00 44.44 H new ATOM 0 HE21 GLN A 47 17.235 -3.720 -8.247 1.00 61.21 H new ATOM 0 HE22 GLN A 47 18.148 -4.587 -7.007 1.00 61.21 H new ATOM 736 N MET A 48 14.238 0.874 -8.293 1.00 11.24 N ATOM 737 CA MET A 48 13.390 1.990 -7.887 1.00 21.42 C ATOM 738 C MET A 48 11.924 1.572 -7.847 1.00 53.54 C ATOM 739 O MET A 48 11.513 0.646 -8.546 1.00 31.12 O ATOM 740 CB MET A 48 13.571 3.170 -8.842 1.00 71.04 C ATOM 741 CG MET A 48 12.514 3.237 -9.932 1.00 61.34 C ATOM 742 SD MET A 48 13.165 3.857 -11.495 1.00 51.01 S ATOM 743 CE MET A 48 13.795 5.456 -10.989 1.00 72.41 C ATOM 0 H MET A 48 13.855 0.306 -9.048 1.00 11.24 H new ATOM 0 HA MET A 48 13.689 2.295 -6.884 1.00 21.42 H new ATOM 0 HB2 MET A 48 13.550 4.097 -8.269 1.00 71.04 H new ATOM 0 HB3 MET A 48 14.555 3.104 -9.305 1.00 71.04 H new ATOM 0 HG2 MET A 48 12.094 2.243 -10.087 1.00 61.34 H new ATOM 0 HG3 MET A 48 11.698 3.880 -9.602 1.00 61.34 H new ATOM 0 HE1 MET A 48 13.751 6.147 -11.830 1.00 72.41 H new ATOM 0 HE2 MET A 48 13.190 5.843 -10.169 1.00 72.41 H new ATOM 0 HE3 MET A 48 14.829 5.352 -10.659 1.00 72.41 H new ATOM 753 N VAL A 49 11.139 2.261 -7.025 1.00 71.15 N ATOM 754 CA VAL A 49 9.717 1.962 -6.896 1.00 22.23 C ATOM 755 C VAL A 49 8.900 2.713 -7.941 1.00 65.14 C ATOM 756 O VAL A 49 8.817 3.940 -7.915 1.00 43.22 O ATOM 757 CB VAL A 49 9.193 2.324 -5.493 1.00 62.13 C ATOM 758 CG1 VAL A 49 7.744 1.889 -5.336 1.00 21.20 C ATOM 759 CG2 VAL A 49 10.068 1.695 -4.419 1.00 14.12 C ATOM 0 H VAL A 49 11.463 3.030 -6.438 1.00 71.15 H new ATOM 0 HA VAL A 49 9.603 0.889 -7.053 1.00 22.23 H new ATOM 0 HB VAL A 49 9.236 3.407 -5.375 1.00 62.13 H new ATOM 0 HG11 VAL A 49 7.391 2.153 -4.339 1.00 21.20 H new ATOM 0 HG12 VAL A 49 7.130 2.392 -6.083 1.00 21.20 H new ATOM 0 HG13 VAL A 49 7.671 0.810 -5.473 1.00 21.20 H new ATOM 0 HG21 VAL A 49 9.683 1.961 -3.434 1.00 14.12 H new ATOM 0 HG22 VAL A 49 10.059 0.611 -4.531 1.00 14.12 H new ATOM 0 HG23 VAL A 49 11.089 2.062 -4.521 1.00 14.12 H new ATOM 769 N VAL A 50 8.297 1.966 -8.861 1.00 3.25 N ATOM 770 CA VAL A 50 7.484 2.560 -9.915 1.00 43.22 C ATOM 771 C VAL A 50 6.055 2.031 -9.871 1.00 44.53 C ATOM 772 O VAL A 50 5.821 0.870 -9.535 1.00 20.10 O ATOM 773 CB VAL A 50 8.080 2.280 -11.308 1.00 1.34 C ATOM 774 CG1 VAL A 50 9.419 2.985 -11.467 1.00 62.24 C ATOM 775 CG2 VAL A 50 8.226 0.784 -11.534 1.00 23.42 C ATOM 0 H VAL A 50 8.357 0.948 -8.897 1.00 3.25 H new ATOM 0 HA VAL A 50 7.476 3.636 -9.740 1.00 43.22 H new ATOM 0 HB VAL A 50 7.398 2.673 -12.062 1.00 1.34 H new ATOM 0 HG11 VAL A 50 9.825 2.776 -12.457 1.00 62.24 H new ATOM 0 HG12 VAL A 50 9.280 4.060 -11.351 1.00 62.24 H new ATOM 0 HG13 VAL A 50 10.112 2.625 -10.707 1.00 62.24 H new ATOM 0 HG21 VAL A 50 8.648 0.605 -12.523 1.00 23.42 H new ATOM 0 HG22 VAL A 50 8.887 0.364 -10.776 1.00 23.42 H new ATOM 0 HG23 VAL A 50 7.248 0.309 -11.466 1.00 23.42 H new ATOM 785 N LEU A 51 5.102 2.892 -10.213 1.00 60.22 N ATOM 786 CA LEU A 51 3.694 2.513 -10.213 1.00 32.51 C ATOM 787 C LEU A 51 3.467 1.260 -11.054 1.00 25.12 C ATOM 788 O LEU A 51 4.154 1.037 -12.050 1.00 4.23 O ATOM 789 CB LEU A 51 2.835 3.661 -10.746 1.00 24.11 C ATOM 790 CG LEU A 51 1.349 3.611 -10.389 1.00 63.40 C ATOM 791 CD1 LEU A 51 0.758 5.012 -10.370 1.00 44.03 C ATOM 792 CD2 LEU A 51 0.595 2.724 -11.367 1.00 73.44 C ATOM 0 H LEU A 51 5.279 3.857 -10.494 1.00 60.22 H new ATOM 0 HA LEU A 51 3.402 2.297 -9.185 1.00 32.51 H new ATOM 0 HB2 LEU A 51 3.246 4.599 -10.373 1.00 24.11 H new ATOM 0 HB3 LEU A 51 2.926 3.682 -11.832 1.00 24.11 H new ATOM 0 HG LEU A 51 1.248 3.183 -9.392 1.00 63.40 H new ATOM 0 HD11 LEU A 51 -0.300 4.957 -10.114 1.00 44.03 H new ATOM 0 HD12 LEU A 51 1.280 5.617 -9.628 1.00 44.03 H new ATOM 0 HD13 LEU A 51 0.870 5.468 -11.354 1.00 44.03 H new ATOM 0 HD21 LEU A 51 -0.461 2.700 -11.097 1.00 73.44 H new ATOM 0 HD22 LEU A 51 0.703 3.121 -12.376 1.00 73.44 H new ATOM 0 HD23 LEU A 51 1.002 1.713 -11.330 1.00 73.44 H new ATOM 804 N GLU A 52 2.497 0.448 -10.647 1.00 75.42 N ATOM 805 CA GLU A 52 2.179 -0.782 -11.365 1.00 11.45 C ATOM 806 C GLU A 52 0.752 -0.744 -11.904 1.00 14.22 C ATOM 807 O GLU A 52 0.485 -1.198 -13.016 1.00 62.02 O ATOM 808 CB GLU A 52 2.358 -1.994 -10.449 1.00 35.53 C ATOM 809 CG GLU A 52 2.100 -3.322 -11.140 1.00 4.10 C ATOM 810 CD GLU A 52 2.664 -4.500 -10.368 1.00 74.23 C ATOM 811 OE1 GLU A 52 2.031 -4.919 -9.377 1.00 53.25 O ATOM 812 OE2 GLU A 52 3.739 -5.003 -10.758 1.00 35.13 O ATOM 0 H GLU A 52 1.918 0.619 -9.825 1.00 75.42 H new ATOM 0 HA GLU A 52 2.865 -0.868 -12.208 1.00 11.45 H new ATOM 0 HB2 GLU A 52 3.373 -1.992 -10.052 1.00 35.53 H new ATOM 0 HB3 GLU A 52 1.683 -1.899 -9.599 1.00 35.53 H new ATOM 0 HG2 GLU A 52 1.026 -3.458 -11.269 1.00 4.10 H new ATOM 0 HG3 GLU A 52 2.541 -3.301 -12.137 1.00 4.10 H new ATOM 819 N ASP A 53 -0.160 -0.198 -11.107 1.00 71.41 N ATOM 820 CA ASP A 53 -1.561 -0.100 -11.503 1.00 5.12 C ATOM 821 C ASP A 53 -2.317 0.860 -10.591 1.00 2.52 C ATOM 822 O ASP A 53 -1.802 1.284 -9.557 1.00 31.20 O ATOM 823 CB ASP A 53 -2.220 -1.480 -11.470 1.00 61.14 C ATOM 824 CG ASP A 53 -1.968 -2.272 -12.739 1.00 22.00 C ATOM 825 OD1 ASP A 53 -1.961 -1.661 -13.827 1.00 61.23 O ATOM 826 OD2 ASP A 53 -1.777 -3.503 -12.642 1.00 14.43 O ATOM 0 H ASP A 53 0.045 0.183 -10.183 1.00 71.41 H new ATOM 0 HA ASP A 53 -1.599 0.288 -12.521 1.00 5.12 H new ATOM 0 HB2 ASP A 53 -1.842 -2.040 -10.615 1.00 61.14 H new ATOM 0 HB3 ASP A 53 -3.294 -1.363 -11.325 1.00 61.14 H new ATOM 831 N GLU A 54 -3.541 1.199 -10.982 1.00 54.03 N ATOM 832 CA GLU A 54 -4.368 2.112 -10.200 1.00 21.23 C ATOM 833 C GLU A 54 -5.850 1.836 -10.431 1.00 34.45 C ATOM 834 O GLU A 54 -6.356 1.986 -11.543 1.00 63.01 O ATOM 835 CB GLU A 54 -4.045 3.564 -10.560 1.00 72.35 C ATOM 836 CG GLU A 54 -3.072 4.227 -9.601 1.00 22.42 C ATOM 837 CD GLU A 54 -3.047 5.736 -9.746 1.00 64.11 C ATOM 838 OE1 GLU A 54 -2.262 6.238 -10.578 1.00 43.32 O ATOM 839 OE2 GLU A 54 -3.809 6.415 -9.029 1.00 35.45 O ATOM 0 H GLU A 54 -3.982 0.856 -11.835 1.00 54.03 H new ATOM 0 HA GLU A 54 -4.146 1.950 -9.145 1.00 21.23 H new ATOM 0 HB2 GLU A 54 -3.628 3.596 -11.567 1.00 72.35 H new ATOM 0 HB3 GLU A 54 -4.971 4.139 -10.580 1.00 72.35 H new ATOM 0 HG2 GLU A 54 -3.343 3.969 -8.577 1.00 22.42 H new ATOM 0 HG3 GLU A 54 -2.071 3.832 -9.775 1.00 22.42 H new ATOM 846 N LEU A 55 -6.542 1.432 -9.371 1.00 34.32 N ATOM 847 CA LEU A 55 -7.968 1.135 -9.457 1.00 30.41 C ATOM 848 C LEU A 55 -8.786 2.156 -8.673 1.00 44.14 C ATOM 849 O LEU A 55 -8.354 2.639 -7.627 1.00 45.24 O ATOM 850 CB LEU A 55 -8.249 -0.274 -8.927 1.00 44.32 C ATOM 851 CG LEU A 55 -7.332 -1.381 -9.449 1.00 5.23 C ATOM 852 CD1 LEU A 55 -7.132 -2.452 -8.387 1.00 52.03 C ATOM 853 CD2 LEU A 55 -7.902 -1.989 -10.723 1.00 30.24 C ATOM 0 H LEU A 55 -6.139 1.303 -8.443 1.00 34.32 H new ATOM 0 HA LEU A 55 -8.262 1.189 -10.505 1.00 30.41 H new ATOM 0 HB2 LEU A 55 -8.178 -0.253 -7.840 1.00 44.32 H new ATOM 0 HB3 LEU A 55 -9.278 -0.535 -9.174 1.00 44.32 H new ATOM 0 HG LEU A 55 -6.361 -0.944 -9.682 1.00 5.23 H new ATOM 0 HD11 LEU A 55 -6.477 -3.232 -8.776 1.00 52.03 H new ATOM 0 HD12 LEU A 55 -6.680 -2.006 -7.501 1.00 52.03 H new ATOM 0 HD13 LEU A 55 -8.096 -2.886 -8.122 1.00 52.03 H new ATOM 0 HD21 LEU A 55 -7.237 -2.775 -11.080 1.00 30.24 H new ATOM 0 HD22 LEU A 55 -8.885 -2.412 -10.516 1.00 30.24 H new ATOM 0 HD23 LEU A 55 -7.993 -1.216 -11.486 1.00 30.24 H new ATOM 865 N GLN A 56 -9.969 2.478 -9.185 1.00 61.12 N ATOM 866 CA GLN A 56 -10.847 3.441 -8.533 1.00 11.44 C ATOM 867 C GLN A 56 -12.228 2.842 -8.290 1.00 74.31 C ATOM 868 O GLN A 56 -12.641 1.911 -8.980 1.00 12.24 O ATOM 869 CB GLN A 56 -10.970 4.709 -9.381 1.00 71.44 C ATOM 870 CG GLN A 56 -9.662 5.466 -9.537 1.00 2.44 C ATOM 871 CD GLN A 56 -8.790 4.905 -10.643 1.00 73.41 C ATOM 872 OE1 GLN A 56 -9.247 4.708 -11.769 1.00 53.15 O ATOM 873 NE2 GLN A 56 -7.527 4.644 -10.327 1.00 52.42 N ATOM 0 H GLN A 56 -10.341 2.086 -10.050 1.00 61.12 H new ATOM 0 HA GLN A 56 -10.408 3.699 -7.569 1.00 11.44 H new ATOM 0 HB2 GLN A 56 -11.345 4.440 -10.369 1.00 71.44 H new ATOM 0 HB3 GLN A 56 -11.710 5.369 -8.928 1.00 71.44 H new ATOM 0 HG2 GLN A 56 -9.876 6.514 -9.745 1.00 2.44 H new ATOM 0 HG3 GLN A 56 -9.114 5.434 -8.596 1.00 2.44 H new ATOM 0 HE21 GLN A 56 -7.191 4.823 -9.381 1.00 52.42 H new ATOM 0 HE22 GLN A 56 -6.893 4.265 -11.030 1.00 52.42 H new ATOM 882 N ASN A 57 -12.937 3.382 -7.304 1.00 73.21 N ATOM 883 CA ASN A 57 -14.272 2.898 -6.970 1.00 13.43 C ATOM 884 C ASN A 57 -14.250 1.404 -6.666 1.00 51.12 C ATOM 885 O ASN A 57 -15.049 0.638 -7.206 1.00 12.43 O ATOM 886 CB ASN A 57 -15.243 3.183 -8.117 1.00 70.11 C ATOM 887 CG ASN A 57 -14.620 4.041 -9.202 1.00 13.13 C ATOM 888 OD1 ASN A 57 -14.198 5.246 -8.834 1.00 2.40 O flip ATOM 889 ND2 ASN A 57 -14.520 3.625 -10.356 1.00 75.14 N flip ATOM 0 H ASN A 57 -12.610 4.154 -6.723 1.00 73.21 H new ATOM 0 HA ASN A 57 -14.609 3.426 -6.078 1.00 13.43 H new ATOM 0 HB2 ASN A 57 -15.577 2.240 -8.550 1.00 70.11 H new ATOM 0 HB3 ASN A 57 -16.128 3.684 -7.724 1.00 70.11 H new ATOM 0 HD21 ASN A 57 -14.858 2.692 -10.593 1.00 75.14 H new ATOM 0 HD22 ASN A 57 -14.099 4.213 -11.075 1.00 75.14 H new ATOM 896 N ILE A 58 -13.330 0.995 -5.799 1.00 13.01 N ATOM 897 CA ILE A 58 -13.204 -0.407 -5.423 1.00 32.22 C ATOM 898 C ILE A 58 -13.223 -0.574 -3.907 1.00 14.41 C ATOM 899 O ILE A 58 -12.669 0.246 -3.175 1.00 44.21 O ATOM 900 CB ILE A 58 -11.909 -1.026 -5.979 1.00 65.45 C ATOM 901 CG1 ILE A 58 -11.189 -1.823 -4.890 1.00 54.31 C ATOM 902 CG2 ILE A 58 -11.001 0.060 -6.538 1.00 2.14 C ATOM 903 CD1 ILE A 58 -10.482 -0.954 -3.873 1.00 71.05 C ATOM 0 H ILE A 58 -12.661 1.615 -5.344 1.00 13.01 H new ATOM 0 HA ILE A 58 -14.060 -0.926 -5.855 1.00 32.22 H new ATOM 0 HB ILE A 58 -12.168 -1.708 -6.789 1.00 65.45 H new ATOM 0 HG12 ILE A 58 -11.912 -2.455 -4.375 1.00 54.31 H new ATOM 0 HG13 ILE A 58 -10.461 -2.486 -5.358 1.00 54.31 H new ATOM 0 HG21 ILE A 58 -10.089 -0.393 -6.928 1.00 2.14 H new ATOM 0 HG22 ILE A 58 -11.516 0.587 -7.341 1.00 2.14 H new ATOM 0 HG23 ILE A 58 -10.746 0.765 -5.746 1.00 2.14 H new ATOM 0 HD11 ILE A 58 -9.994 -1.586 -3.131 1.00 71.05 H new ATOM 0 HD12 ILE A 58 -9.734 -0.340 -4.376 1.00 71.05 H new ATOM 0 HD13 ILE A 58 -11.208 -0.309 -3.378 1.00 71.05 H new ATOM 915 N SER A 59 -13.864 -1.642 -3.442 1.00 63.31 N ATOM 916 CA SER A 59 -13.957 -1.916 -2.013 1.00 51.55 C ATOM 917 C SER A 59 -12.693 -2.606 -1.509 1.00 41.22 C ATOM 918 O SER A 59 -11.834 -3.026 -2.284 1.00 23.34 O ATOM 919 CB SER A 59 -15.180 -2.786 -1.718 1.00 4.15 C ATOM 920 OG SER A 59 -16.155 -2.064 -0.987 1.00 15.23 O ATOM 0 H SER A 59 -14.327 -2.332 -4.034 1.00 63.31 H new ATOM 0 HA SER A 59 -14.063 -0.965 -1.491 1.00 51.55 H new ATOM 0 HB2 SER A 59 -15.612 -3.141 -2.654 1.00 4.15 H new ATOM 0 HB3 SER A 59 -14.876 -3.667 -1.153 1.00 4.15 H new ATOM 0 HG SER A 59 -16.927 -2.642 -0.813 1.00 15.23 H new ATOM 926 N PRO A 60 -12.576 -2.726 -0.178 1.00 61.15 N ATOM 927 CA PRO A 60 -11.422 -3.365 0.461 1.00 53.04 C ATOM 928 C PRO A 60 -11.388 -4.872 0.223 1.00 0.53 C ATOM 929 O PRO A 60 -10.445 -5.551 0.626 1.00 1.03 O ATOM 930 CB PRO A 60 -11.626 -3.063 1.948 1.00 75.24 C ATOM 931 CG PRO A 60 -13.096 -2.865 2.095 1.00 73.44 C ATOM 932 CD PRO A 60 -13.562 -2.248 0.805 1.00 51.32 C ATOM 0 HA PRO A 60 -10.478 -2.993 0.062 1.00 53.04 H new ATOM 0 HB2 PRO A 60 -11.273 -3.885 2.571 1.00 75.24 H new ATOM 0 HB3 PRO A 60 -11.074 -2.173 2.251 1.00 75.24 H new ATOM 0 HG2 PRO A 60 -13.601 -3.813 2.279 1.00 73.44 H new ATOM 0 HG3 PRO A 60 -13.320 -2.216 2.941 1.00 73.44 H new ATOM 0 HD2 PRO A 60 -14.572 -2.567 0.549 1.00 51.32 H new ATOM 0 HD3 PRO A 60 -13.577 -1.160 0.863 1.00 51.32 H new ATOM 940 N GLU A 61 -12.423 -5.386 -0.434 1.00 2.22 N ATOM 941 CA GLU A 61 -12.510 -6.812 -0.724 1.00 51.01 C ATOM 942 C GLU A 61 -12.056 -7.106 -2.152 1.00 5.44 C ATOM 943 O GLU A 61 -11.545 -8.187 -2.440 1.00 43.22 O ATOM 944 CB GLU A 61 -13.942 -7.310 -0.521 1.00 12.34 C ATOM 945 CG GLU A 61 -14.212 -7.829 0.881 1.00 14.33 C ATOM 946 CD GLU A 61 -15.665 -7.674 1.290 1.00 61.21 C ATOM 947 OE1 GLU A 61 -16.539 -7.695 0.398 1.00 30.34 O ATOM 948 OE2 GLU A 61 -15.927 -7.532 2.503 1.00 20.52 O ATOM 0 H GLU A 61 -13.212 -4.837 -0.775 1.00 2.22 H new ATOM 0 HA GLU A 61 -11.849 -7.337 -0.035 1.00 51.01 H new ATOM 0 HB2 GLU A 61 -14.635 -6.497 -0.738 1.00 12.34 H new ATOM 0 HB3 GLU A 61 -14.147 -8.104 -1.239 1.00 12.34 H new ATOM 0 HG2 GLU A 61 -13.933 -8.881 0.935 1.00 14.33 H new ATOM 0 HG3 GLU A 61 -13.580 -7.295 1.590 1.00 14.33 H new ATOM 955 N GLU A 62 -12.246 -6.134 -3.039 1.00 32.33 N ATOM 956 CA GLU A 62 -11.857 -6.289 -4.436 1.00 3.22 C ATOM 957 C GLU A 62 -10.348 -6.131 -4.601 1.00 22.53 C ATOM 958 O GLU A 62 -9.706 -6.903 -5.315 1.00 0.21 O ATOM 959 CB GLU A 62 -12.586 -5.265 -5.307 1.00 72.32 C ATOM 960 CG GLU A 62 -13.452 -5.892 -6.388 1.00 25.45 C ATOM 961 CD GLU A 62 -12.975 -5.554 -7.787 1.00 40.51 C ATOM 962 OE1 GLU A 62 -11.893 -6.039 -8.179 1.00 50.33 O ATOM 963 OE2 GLU A 62 -13.684 -4.804 -8.490 1.00 34.03 O ATOM 0 H GLU A 62 -12.666 -5.232 -2.815 1.00 32.33 H new ATOM 0 HA GLU A 62 -12.137 -7.293 -4.756 1.00 3.22 H new ATOM 0 HB2 GLU A 62 -13.211 -4.638 -4.671 1.00 72.32 H new ATOM 0 HB3 GLU A 62 -11.851 -4.611 -5.776 1.00 72.32 H new ATOM 0 HG2 GLU A 62 -13.457 -6.975 -6.262 1.00 25.45 H new ATOM 0 HG3 GLU A 62 -14.481 -5.552 -6.267 1.00 25.45 H new ATOM 970 N LEU A 63 -9.789 -5.126 -3.937 1.00 4.21 N ATOM 971 CA LEU A 63 -8.355 -4.866 -4.010 1.00 2.51 C ATOM 972 C LEU A 63 -7.557 -6.147 -3.794 1.00 43.32 C ATOM 973 O LEU A 63 -6.640 -6.457 -4.556 1.00 35.00 O ATOM 974 CB LEU A 63 -7.953 -3.820 -2.968 1.00 41.13 C ATOM 975 CG LEU A 63 -7.029 -2.705 -3.459 1.00 2.42 C ATOM 976 CD1 LEU A 63 -6.386 -1.987 -2.281 1.00 74.32 C ATOM 977 CD2 LEU A 63 -5.965 -3.265 -4.390 1.00 63.02 C ATOM 0 H LEU A 63 -10.306 -4.478 -3.342 1.00 4.21 H new ATOM 0 HA LEU A 63 -8.131 -4.484 -5.006 1.00 2.51 H new ATOM 0 HB2 LEU A 63 -8.860 -3.364 -2.571 1.00 41.13 H new ATOM 0 HB3 LEU A 63 -7.464 -4.331 -2.139 1.00 41.13 H new ATOM 0 HG LEU A 63 -7.626 -1.983 -4.016 1.00 2.42 H new ATOM 0 HD11 LEU A 63 -5.732 -1.197 -2.650 1.00 74.32 H new ATOM 0 HD12 LEU A 63 -7.163 -1.551 -1.652 1.00 74.32 H new ATOM 0 HD13 LEU A 63 -5.802 -2.698 -1.696 1.00 74.32 H new ATOM 0 HD21 LEU A 63 -5.317 -2.457 -4.729 1.00 63.02 H new ATOM 0 HD22 LEU A 63 -5.371 -4.008 -3.858 1.00 63.02 H new ATOM 0 HD23 LEU A 63 -6.444 -3.732 -5.251 1.00 63.02 H new ATOM 989 N LYS A 64 -7.911 -6.891 -2.751 1.00 11.31 N ATOM 990 CA LYS A 64 -7.231 -8.141 -2.436 1.00 54.12 C ATOM 991 C LYS A 64 -7.333 -9.125 -3.598 1.00 11.40 C ATOM 992 O LYS A 64 -6.432 -9.932 -3.822 1.00 70.41 O ATOM 993 CB LYS A 64 -7.828 -8.765 -1.173 1.00 35.14 C ATOM 994 CG LYS A 64 -8.195 -10.231 -1.333 1.00 33.11 C ATOM 995 CD LYS A 64 -8.327 -10.924 0.013 1.00 45.21 C ATOM 996 CE LYS A 64 -9.759 -11.360 0.278 1.00 23.32 C ATOM 997 NZ LYS A 64 -9.927 -12.832 0.125 1.00 44.13 N ATOM 0 H LYS A 64 -8.666 -6.649 -2.109 1.00 11.31 H new ATOM 0 HA LYS A 64 -6.178 -7.919 -2.263 1.00 54.12 H new ATOM 0 HB2 LYS A 64 -7.113 -8.665 -0.356 1.00 35.14 H new ATOM 0 HB3 LYS A 64 -8.719 -8.205 -0.888 1.00 35.14 H new ATOM 0 HG2 LYS A 64 -9.134 -10.314 -1.879 1.00 33.11 H new ATOM 0 HG3 LYS A 64 -7.434 -10.734 -1.929 1.00 33.11 H new ATOM 0 HD2 LYS A 64 -7.670 -11.793 0.042 1.00 45.21 H new ATOM 0 HD3 LYS A 64 -7.999 -10.250 0.804 1.00 45.21 H new ATOM 0 HE2 LYS A 64 -10.048 -11.064 1.286 1.00 23.32 H new ATOM 0 HE3 LYS A 64 -10.429 -10.844 -0.410 1.00 23.32 H new ATOM 0 HZ1 LYS A 64 -10.837 -13.122 0.537 1.00 44.13 H new ATOM 0 HZ2 LYS A 64 -9.909 -13.080 -0.885 1.00 44.13 H new ATOM 0 HZ3 LYS A 64 -9.153 -13.323 0.616 1.00 44.13 H new ATOM 1011 N LEU A 65 -8.436 -9.048 -4.336 1.00 25.41 N ATOM 1012 CA LEU A 65 -8.655 -9.931 -5.477 1.00 42.34 C ATOM 1013 C LEU A 65 -7.817 -9.491 -6.674 1.00 50.23 C ATOM 1014 O LEU A 65 -7.625 -10.252 -7.621 1.00 40.41 O ATOM 1015 CB LEU A 65 -10.137 -9.949 -5.856 1.00 4.40 C ATOM 1016 CG LEU A 65 -11.007 -10.963 -5.114 1.00 44.11 C ATOM 1017 CD1 LEU A 65 -10.339 -12.329 -5.099 1.00 60.12 C ATOM 1018 CD2 LEU A 65 -11.286 -10.490 -3.695 1.00 14.44 C ATOM 0 H LEU A 65 -9.191 -8.384 -4.165 1.00 25.41 H new ATOM 0 HA LEU A 65 -8.347 -10.937 -5.191 1.00 42.34 H new ATOM 0 HB2 LEU A 65 -10.547 -8.954 -5.684 1.00 4.40 H new ATOM 0 HB3 LEU A 65 -10.216 -10.146 -6.925 1.00 4.40 H new ATOM 0 HG LEU A 65 -11.957 -11.051 -5.640 1.00 44.11 H new ATOM 0 HD11 LEU A 65 -10.973 -13.038 -4.566 1.00 60.12 H new ATOM 0 HD12 LEU A 65 -10.191 -12.673 -6.123 1.00 60.12 H new ATOM 0 HD13 LEU A 65 -9.374 -12.257 -4.597 1.00 60.12 H new ATOM 0 HD21 LEU A 65 -11.907 -11.225 -3.182 1.00 14.44 H new ATOM 0 HD22 LEU A 65 -10.344 -10.373 -3.159 1.00 14.44 H new ATOM 0 HD23 LEU A 65 -11.807 -9.533 -3.726 1.00 14.44 H new ATOM 1030 N GLU A 66 -7.320 -8.259 -6.622 1.00 12.44 N ATOM 1031 CA GLU A 66 -6.503 -7.720 -7.701 1.00 44.31 C ATOM 1032 C GLU A 66 -5.028 -8.048 -7.483 1.00 54.11 C ATOM 1033 O GLU A 66 -4.245 -8.095 -8.432 1.00 64.34 O ATOM 1034 CB GLU A 66 -6.689 -6.205 -7.804 1.00 53.44 C ATOM 1035 CG GLU A 66 -8.105 -5.789 -8.168 1.00 2.33 C ATOM 1036 CD GLU A 66 -8.518 -6.269 -9.546 1.00 51.41 C ATOM 1037 OE1 GLU A 66 -7.700 -6.156 -10.483 1.00 1.43 O ATOM 1038 OE2 GLU A 66 -9.658 -6.757 -9.687 1.00 32.31 O ATOM 0 H GLU A 66 -7.469 -7.616 -5.844 1.00 12.44 H new ATOM 0 HA GLU A 66 -6.827 -8.183 -8.633 1.00 44.31 H new ATOM 0 HB2 GLU A 66 -6.419 -5.749 -6.852 1.00 53.44 H new ATOM 0 HB3 GLU A 66 -6.000 -5.813 -8.552 1.00 53.44 H new ATOM 0 HG2 GLU A 66 -8.798 -6.186 -7.426 1.00 2.33 H new ATOM 0 HG3 GLU A 66 -8.182 -4.702 -8.128 1.00 2.33 H new ATOM 1045 N LEU A 67 -4.658 -8.273 -6.227 1.00 41.23 N ATOM 1046 CA LEU A 67 -3.278 -8.596 -5.883 1.00 52.10 C ATOM 1047 C LEU A 67 -2.973 -10.062 -6.175 1.00 63.11 C ATOM 1048 O LEU A 67 -3.855 -10.921 -6.154 1.00 51.43 O ATOM 1049 CB LEU A 67 -3.015 -8.293 -4.407 1.00 31.42 C ATOM 1050 CG LEU A 67 -3.309 -6.863 -3.953 1.00 4.33 C ATOM 1051 CD1 LEU A 67 -3.032 -6.708 -2.465 1.00 62.21 C ATOM 1052 CD2 LEU A 67 -2.484 -5.869 -4.757 1.00 54.23 C ATOM 0 H LEU A 67 -5.294 -8.238 -5.430 1.00 41.23 H new ATOM 0 HA LEU A 67 -2.622 -7.978 -6.497 1.00 52.10 H new ATOM 0 HB2 LEU A 67 -3.615 -8.975 -3.804 1.00 31.42 H new ATOM 0 HB3 LEU A 67 -1.969 -8.513 -4.192 1.00 31.42 H new ATOM 0 HG LEU A 67 -4.365 -6.656 -4.129 1.00 4.33 H new ATOM 0 HD11 LEU A 67 -3.247 -5.684 -2.160 1.00 62.21 H new ATOM 0 HD12 LEU A 67 -3.666 -7.395 -1.904 1.00 62.21 H new ATOM 0 HD13 LEU A 67 -1.985 -6.934 -2.264 1.00 62.21 H new ATOM 0 HD21 LEU A 67 -2.706 -4.856 -4.421 1.00 54.23 H new ATOM 0 HD22 LEU A 67 -1.424 -6.075 -4.612 1.00 54.23 H new ATOM 0 HD23 LEU A 67 -2.731 -5.962 -5.815 1.00 54.23 H new ATOM 1064 N PRO A 68 -1.694 -10.356 -6.453 1.00 34.51 N ATOM 1065 CA PRO A 68 -1.243 -11.719 -6.752 1.00 2.35 C ATOM 1066 C PRO A 68 -1.289 -12.627 -5.526 1.00 44.35 C ATOM 1067 O PRO A 68 -1.881 -12.277 -4.506 1.00 75.34 O ATOM 1068 CB PRO A 68 0.202 -11.520 -7.215 1.00 65.41 C ATOM 1069 CG PRO A 68 0.636 -10.250 -6.569 1.00 13.30 C ATOM 1070 CD PRO A 68 -0.590 -9.383 -6.495 1.00 13.33 C ATOM 0 HA PRO A 68 -1.879 -12.206 -7.491 1.00 2.35 H new ATOM 0 HB2 PRO A 68 0.834 -12.355 -6.911 1.00 65.41 H new ATOM 0 HB3 PRO A 68 0.264 -11.453 -8.301 1.00 65.41 H new ATOM 0 HG2 PRO A 68 1.042 -10.437 -5.575 1.00 13.30 H new ATOM 0 HG3 PRO A 68 1.422 -9.766 -7.149 1.00 13.30 H new ATOM 0 HD2 PRO A 68 -0.580 -8.748 -5.609 1.00 13.33 H new ATOM 0 HD3 PRO A 68 -0.668 -8.723 -7.359 1.00 13.33 H new ATOM 1078 N GLU A 69 -0.660 -13.792 -5.636 1.00 72.32 N ATOM 1079 CA GLU A 69 -0.630 -14.750 -4.537 1.00 32.10 C ATOM 1080 C GLU A 69 0.803 -15.030 -4.097 1.00 45.12 C ATOM 1081 O GLU A 69 1.042 -15.516 -2.991 1.00 52.14 O ATOM 1082 CB GLU A 69 -1.313 -16.056 -4.950 1.00 22.23 C ATOM 1083 CG GLU A 69 -1.072 -16.435 -6.400 1.00 73.55 C ATOM 1084 CD GLU A 69 -1.900 -17.629 -6.837 1.00 13.35 C ATOM 1085 OE1 GLU A 69 -1.664 -18.738 -6.316 1.00 23.13 O ATOM 1086 OE2 GLU A 69 -2.786 -17.452 -7.699 1.00 65.51 O ATOM 0 H GLU A 69 -0.164 -14.096 -6.474 1.00 72.32 H new ATOM 0 HA GLU A 69 -1.171 -14.315 -3.696 1.00 32.10 H new ATOM 0 HB2 GLU A 69 -0.956 -16.862 -4.308 1.00 22.23 H new ATOM 0 HB3 GLU A 69 -2.386 -15.965 -4.780 1.00 22.23 H new ATOM 0 HG2 GLU A 69 -1.306 -15.583 -7.038 1.00 73.55 H new ATOM 0 HG3 GLU A 69 -0.015 -16.659 -6.542 1.00 73.55 H new ATOM 1093 N ARG A 70 1.755 -14.719 -4.970 1.00 42.14 N ATOM 1094 CA ARG A 70 3.166 -14.939 -4.674 1.00 51.44 C ATOM 1095 C ARG A 70 4.026 -13.827 -5.270 1.00 22.40 C ATOM 1096 O ARG A 70 5.083 -14.088 -5.843 1.00 75.25 O ATOM 1097 CB ARG A 70 3.618 -16.295 -5.218 1.00 3.31 C ATOM 1098 CG ARG A 70 2.649 -17.426 -4.916 1.00 65.15 C ATOM 1099 CD ARG A 70 2.893 -18.014 -3.535 1.00 61.11 C ATOM 1100 NE ARG A 70 2.284 -19.334 -3.387 1.00 50.11 N ATOM 1101 CZ ARG A 70 0.983 -19.526 -3.199 1.00 12.20 C ATOM 1102 NH1 ARG A 70 0.159 -18.488 -3.135 1.00 70.43 N ATOM 1103 NH2 ARG A 70 0.504 -20.757 -3.073 1.00 2.53 N ATOM 0 H ARG A 70 1.575 -14.314 -5.889 1.00 42.14 H new ATOM 0 HA ARG A 70 3.290 -14.930 -3.591 1.00 51.44 H new ATOM 0 HB2 ARG A 70 3.749 -16.219 -6.297 1.00 3.31 H new ATOM 0 HB3 ARG A 70 4.592 -16.540 -4.795 1.00 3.31 H new ATOM 0 HG2 ARG A 70 1.625 -17.057 -4.980 1.00 65.15 H new ATOM 0 HG3 ARG A 70 2.754 -18.207 -5.669 1.00 65.15 H new ATOM 0 HD2 ARG A 70 3.966 -18.088 -3.357 1.00 61.11 H new ATOM 0 HD3 ARG A 70 2.489 -17.342 -2.778 1.00 61.11 H new ATOM 0 HE ARG A 70 2.891 -20.153 -3.430 1.00 50.11 H new ATOM 0 HH11 ARG A 70 0.524 -17.540 -3.230 1.00 70.43 H new ATOM 0 HH12 ARG A 70 -0.840 -18.638 -2.991 1.00 70.43 H new ATOM 0 HH21 ARG A 70 1.135 -21.557 -3.120 1.00 2.53 H new ATOM 0 HH22 ARG A 70 -0.495 -20.903 -2.929 1.00 2.53 H new ATOM 1117 N GLN A 71 3.564 -12.589 -5.129 1.00 24.02 N ATOM 1118 CA GLN A 71 4.290 -11.438 -5.654 1.00 24.35 C ATOM 1119 C GLN A 71 4.141 -10.233 -4.731 1.00 74.51 C ATOM 1120 O GLN A 71 3.110 -9.559 -4.713 1.00 20.11 O ATOM 1121 CB GLN A 71 3.789 -11.089 -7.056 1.00 62.31 C ATOM 1122 CG GLN A 71 4.666 -11.638 -8.170 1.00 2.23 C ATOM 1123 CD GLN A 71 3.904 -11.849 -9.463 1.00 53.50 C ATOM 1124 OE1 GLN A 71 4.143 -11.163 -10.457 1.00 64.11 O ATOM 1125 NE2 GLN A 71 2.978 -12.801 -9.456 1.00 44.13 N ATOM 0 H GLN A 71 2.691 -12.357 -4.656 1.00 24.02 H new ATOM 0 HA GLN A 71 5.347 -11.700 -5.709 1.00 24.35 H new ATOM 0 HB2 GLN A 71 2.777 -11.475 -7.178 1.00 62.31 H new ATOM 0 HB3 GLN A 71 3.730 -10.005 -7.152 1.00 62.31 H new ATOM 0 HG2 GLN A 71 5.493 -10.951 -8.348 1.00 2.23 H new ATOM 0 HG3 GLN A 71 5.102 -12.585 -7.851 1.00 2.23 H new ATOM 0 HE21 GLN A 71 2.813 -13.346 -8.610 1.00 44.13 H new ATOM 0 HE22 GLN A 71 2.432 -12.987 -10.297 1.00 44.13 H new ATOM 1134 N PRO A 72 5.192 -9.953 -3.947 1.00 15.34 N ATOM 1135 CA PRO A 72 5.201 -8.827 -3.008 1.00 13.13 C ATOM 1136 C PRO A 72 5.248 -7.479 -3.720 1.00 11.21 C ATOM 1137 O PRO A 72 6.044 -7.279 -4.637 1.00 4.21 O ATOM 1138 CB PRO A 72 6.482 -9.050 -2.199 1.00 54.21 C ATOM 1139 CG PRO A 72 7.366 -9.840 -3.100 1.00 55.05 C ATOM 1140 CD PRO A 72 6.453 -10.713 -3.916 1.00 51.04 C ATOM 0 HA PRO A 72 4.297 -8.796 -2.400 1.00 13.13 H new ATOM 0 HB2 PRO A 72 6.945 -8.103 -1.921 1.00 54.21 H new ATOM 0 HB3 PRO A 72 6.277 -9.588 -1.274 1.00 54.21 H new ATOM 0 HG2 PRO A 72 7.955 -9.185 -3.741 1.00 55.05 H new ATOM 0 HG3 PRO A 72 8.071 -10.442 -2.526 1.00 55.05 H new ATOM 0 HD2 PRO A 72 6.847 -10.880 -4.919 1.00 51.04 H new ATOM 0 HD3 PRO A 72 6.320 -11.694 -3.459 1.00 51.04 H new ATOM 1148 N ARG A 73 4.392 -6.558 -3.290 1.00 70.20 N ATOM 1149 CA ARG A 73 4.336 -5.230 -3.888 1.00 14.54 C ATOM 1150 C ARG A 73 3.687 -4.231 -2.933 1.00 60.01 C ATOM 1151 O ARG A 73 3.228 -4.599 -1.852 1.00 13.03 O ATOM 1152 CB ARG A 73 3.558 -5.271 -5.205 1.00 3.45 C ATOM 1153 CG ARG A 73 2.055 -5.131 -5.029 1.00 60.33 C ATOM 1154 CD ARG A 73 1.302 -6.203 -5.802 1.00 43.01 C ATOM 1155 NE ARG A 73 1.140 -7.428 -5.022 1.00 51.23 N ATOM 1156 CZ ARG A 73 0.461 -7.488 -3.882 1.00 62.11 C ATOM 1157 NH1 ARG A 73 -0.115 -6.400 -3.392 1.00 14.01 N ATOM 1158 NH2 ARG A 73 0.358 -8.640 -3.231 1.00 73.00 N ATOM 0 H ARG A 73 3.728 -6.707 -2.530 1.00 70.20 H new ATOM 0 HA ARG A 73 5.357 -4.906 -4.088 1.00 14.54 H new ATOM 0 HB2 ARG A 73 3.915 -4.471 -5.853 1.00 3.45 H new ATOM 0 HB3 ARG A 73 3.770 -6.212 -5.713 1.00 3.45 H new ATOM 0 HG2 ARG A 73 1.803 -5.199 -3.971 1.00 60.33 H new ATOM 0 HG3 ARG A 73 1.738 -4.145 -5.369 1.00 60.33 H new ATOM 0 HD2 ARG A 73 0.321 -5.823 -6.088 1.00 43.01 H new ATOM 0 HD3 ARG A 73 1.837 -6.429 -6.724 1.00 43.01 H new ATOM 0 HE ARG A 73 1.572 -8.283 -5.372 1.00 51.23 H new ATOM 0 HH11 ARG A 73 -0.038 -5.513 -3.890 1.00 14.01 H new ATOM 0 HH12 ARG A 73 -0.636 -6.449 -2.516 1.00 14.01 H new ATOM 0 HH21 ARG A 73 0.800 -9.479 -3.606 1.00 73.00 H new ATOM 0 HH22 ARG A 73 -0.163 -8.686 -2.356 1.00 73.00 H new ATOM 1172 N PHE A 74 3.653 -2.967 -3.341 1.00 3.55 N ATOM 1173 CA PHE A 74 3.062 -1.915 -2.521 1.00 23.22 C ATOM 1174 C PHE A 74 1.632 -1.622 -2.961 1.00 52.43 C ATOM 1175 O PHE A 74 1.314 -1.666 -4.151 1.00 4.32 O ATOM 1176 CB PHE A 74 3.905 -0.641 -2.604 1.00 14.30 C ATOM 1177 CG PHE A 74 5.347 -0.851 -2.242 1.00 70.52 C ATOM 1178 CD1 PHE A 74 5.697 -1.373 -1.007 1.00 0.35 C ATOM 1179 CD2 PHE A 74 6.354 -0.527 -3.137 1.00 0.15 C ATOM 1180 CE1 PHE A 74 7.023 -1.568 -0.670 1.00 74.15 C ATOM 1181 CE2 PHE A 74 7.682 -0.720 -2.806 1.00 61.42 C ATOM 1182 CZ PHE A 74 8.017 -1.240 -1.571 1.00 11.03 C ATOM 0 H PHE A 74 4.027 -2.646 -4.234 1.00 3.55 H new ATOM 0 HA PHE A 74 3.041 -2.262 -1.488 1.00 23.22 H new ATOM 0 HB2 PHE A 74 3.847 -0.242 -3.617 1.00 14.30 H new ATOM 0 HB3 PHE A 74 3.478 0.111 -1.941 1.00 14.30 H new ATOM 0 HD1 PHE A 74 4.924 -1.631 -0.299 1.00 0.35 H new ATOM 0 HD2 PHE A 74 6.098 -0.119 -4.104 1.00 0.15 H new ATOM 0 HE1 PHE A 74 7.281 -1.976 0.296 1.00 74.15 H new ATOM 0 HE2 PHE A 74 8.458 -0.464 -3.513 1.00 61.42 H new ATOM 0 HZ PHE A 74 9.054 -1.390 -1.310 1.00 11.03 H new ATOM 1192 N VAL A 75 0.770 -1.322 -1.994 1.00 51.13 N ATOM 1193 CA VAL A 75 -0.627 -1.021 -2.282 1.00 33.33 C ATOM 1194 C VAL A 75 -1.163 0.053 -1.341 1.00 25.32 C ATOM 1195 O VAL A 75 -1.147 -0.111 -0.120 1.00 61.43 O ATOM 1196 CB VAL A 75 -1.508 -2.279 -2.161 1.00 54.41 C ATOM 1197 CG1 VAL A 75 -2.898 -2.013 -2.721 1.00 45.43 C ATOM 1198 CG2 VAL A 75 -0.855 -3.455 -2.870 1.00 33.51 C ATOM 0 H VAL A 75 1.015 -1.281 -1.005 1.00 51.13 H new ATOM 0 HA VAL A 75 -0.667 -0.655 -3.308 1.00 33.33 H new ATOM 0 HB VAL A 75 -1.610 -2.531 -1.105 1.00 54.41 H new ATOM 0 HG11 VAL A 75 -3.506 -2.913 -2.627 1.00 45.43 H new ATOM 0 HG12 VAL A 75 -3.365 -1.200 -2.165 1.00 45.43 H new ATOM 0 HG13 VAL A 75 -2.820 -1.736 -3.772 1.00 45.43 H new ATOM 0 HG21 VAL A 75 -1.490 -4.336 -2.775 1.00 33.51 H new ATOM 0 HG22 VAL A 75 -0.722 -3.216 -3.925 1.00 33.51 H new ATOM 0 HG23 VAL A 75 0.116 -3.658 -2.419 1.00 33.51 H new ATOM 1208 N VAL A 76 -1.635 1.154 -1.916 1.00 35.32 N ATOM 1209 CA VAL A 76 -2.177 2.255 -1.129 1.00 51.41 C ATOM 1210 C VAL A 76 -3.686 2.376 -1.318 1.00 41.14 C ATOM 1211 O VAL A 76 -4.156 2.881 -2.339 1.00 23.44 O ATOM 1212 CB VAL A 76 -1.515 3.594 -1.507 1.00 30.11 C ATOM 1213 CG1 VAL A 76 -2.362 4.762 -1.027 1.00 2.15 C ATOM 1214 CG2 VAL A 76 -0.109 3.672 -0.933 1.00 63.34 C ATOM 0 H VAL A 76 -1.653 1.307 -2.924 1.00 35.32 H new ATOM 0 HA VAL A 76 -1.961 2.033 -0.084 1.00 51.41 H new ATOM 0 HB VAL A 76 -1.443 3.651 -2.593 1.00 30.11 H new ATOM 0 HG11 VAL A 76 -1.879 5.699 -1.303 1.00 2.15 H new ATOM 0 HG12 VAL A 76 -3.347 4.712 -1.490 1.00 2.15 H new ATOM 0 HG13 VAL A 76 -2.468 4.714 0.057 1.00 2.15 H new ATOM 0 HG21 VAL A 76 0.344 4.624 -1.209 1.00 63.34 H new ATOM 0 HG22 VAL A 76 -0.155 3.593 0.153 1.00 63.34 H new ATOM 0 HG23 VAL A 76 0.492 2.855 -1.331 1.00 63.34 H new ATOM 1224 N TYR A 77 -4.440 1.909 -0.329 1.00 45.23 N ATOM 1225 CA TYR A 77 -5.895 1.962 -0.387 1.00 11.51 C ATOM 1226 C TYR A 77 -6.428 3.161 0.393 1.00 43.41 C ATOM 1227 O TYR A 77 -5.940 3.476 1.479 1.00 75.44 O ATOM 1228 CB TYR A 77 -6.496 0.671 0.170 1.00 74.42 C ATOM 1229 CG TYR A 77 -7.994 0.571 -0.015 1.00 3.35 C ATOM 1230 CD1 TYR A 77 -8.585 0.876 -1.235 1.00 71.50 C ATOM 1231 CD2 TYR A 77 -8.817 0.172 1.031 1.00 1.44 C ATOM 1232 CE1 TYR A 77 -9.953 0.786 -1.407 1.00 24.02 C ATOM 1233 CE2 TYR A 77 -10.185 0.079 0.867 1.00 14.42 C ATOM 1234 CZ TYR A 77 -10.748 0.387 -0.354 1.00 14.20 C ATOM 1235 OH TYR A 77 -12.111 0.296 -0.522 1.00 10.35 O ATOM 0 H TYR A 77 -4.067 1.489 0.523 1.00 45.23 H new ATOM 0 HA TYR A 77 -6.188 2.071 -1.431 1.00 11.51 H new ATOM 0 HB2 TYR A 77 -6.021 -0.181 -0.317 1.00 74.42 H new ATOM 0 HB3 TYR A 77 -6.264 0.601 1.233 1.00 74.42 H new ATOM 0 HD1 TYR A 77 -7.965 1.188 -2.062 1.00 71.50 H new ATOM 0 HD2 TYR A 77 -8.379 -0.069 1.988 1.00 1.44 H new ATOM 0 HE1 TYR A 77 -10.397 1.027 -2.362 1.00 24.02 H new ATOM 0 HE2 TYR A 77 -10.811 -0.233 1.690 1.00 14.42 H new ATOM 0 HH TYR A 77 -12.330 0.390 -1.472 1.00 10.35 H new ATOM 1245 N SER A 78 -7.431 3.826 -0.170 1.00 13.43 N ATOM 1246 CA SER A 78 -8.029 4.992 0.470 1.00 73.20 C ATOM 1247 C SER A 78 -9.482 4.719 0.849 1.00 3.22 C ATOM 1248 O SER A 78 -10.386 4.852 0.024 1.00 32.44 O ATOM 1249 CB SER A 78 -7.953 6.205 -0.460 1.00 1.25 C ATOM 1250 OG SER A 78 -8.512 7.353 0.153 1.00 51.42 O ATOM 0 H SER A 78 -7.847 3.578 -1.068 1.00 13.43 H new ATOM 0 HA SER A 78 -7.468 5.204 1.380 1.00 73.20 H new ATOM 0 HB2 SER A 78 -6.914 6.400 -0.725 1.00 1.25 H new ATOM 0 HB3 SER A 78 -8.483 5.990 -1.388 1.00 1.25 H new ATOM 0 HG SER A 78 -8.450 8.115 -0.461 1.00 51.42 H new ATOM 1256 N TYR A 79 -9.697 4.336 2.103 1.00 12.13 N ATOM 1257 CA TYR A 79 -11.038 4.042 2.593 1.00 72.35 C ATOM 1258 C TYR A 79 -11.770 5.323 2.980 1.00 75.33 C ATOM 1259 O TYR A 79 -11.150 6.357 3.225 1.00 13.14 O ATOM 1260 CB TYR A 79 -10.969 3.097 3.794 1.00 3.30 C ATOM 1261 CG TYR A 79 -12.312 2.835 4.437 1.00 51.22 C ATOM 1262 CD1 TYR A 79 -13.163 1.855 3.939 1.00 43.41 C ATOM 1263 CD2 TYR A 79 -12.731 3.567 5.541 1.00 53.14 C ATOM 1264 CE1 TYR A 79 -14.392 1.614 4.522 1.00 31.32 C ATOM 1265 CE2 TYR A 79 -13.957 3.331 6.131 1.00 33.03 C ATOM 1266 CZ TYR A 79 -14.784 2.353 5.618 1.00 3.24 C ATOM 1267 OH TYR A 79 -16.007 2.115 6.202 1.00 13.12 O ATOM 0 H TYR A 79 -8.960 4.222 2.798 1.00 12.13 H new ATOM 0 HA TYR A 79 -11.593 3.557 1.790 1.00 72.35 H new ATOM 0 HB2 TYR A 79 -10.537 2.148 3.475 1.00 3.30 H new ATOM 0 HB3 TYR A 79 -10.295 3.519 4.539 1.00 3.30 H new ATOM 0 HD1 TYR A 79 -12.858 1.272 3.082 1.00 43.41 H new ATOM 0 HD2 TYR A 79 -12.087 4.334 5.945 1.00 53.14 H new ATOM 0 HE1 TYR A 79 -15.042 0.851 4.121 1.00 31.32 H new ATOM 0 HE2 TYR A 79 -14.267 3.909 6.989 1.00 33.03 H new ATOM 0 HH TYR A 79 -16.561 1.581 5.595 1.00 13.12 H new ATOM 1277 N LYS A 80 -13.096 5.245 3.032 1.00 14.05 N ATOM 1278 CA LYS A 80 -13.917 6.396 3.392 1.00 62.02 C ATOM 1279 C LYS A 80 -14.653 6.151 4.704 1.00 72.34 C ATOM 1280 O LYS A 80 -15.660 5.443 4.738 1.00 33.12 O ATOM 1281 CB LYS A 80 -14.922 6.699 2.279 1.00 64.14 C ATOM 1282 CG LYS A 80 -16.058 7.607 2.715 1.00 41.42 C ATOM 1283 CD LYS A 80 -17.182 7.624 1.694 1.00 53.43 C ATOM 1284 CE LYS A 80 -18.539 7.438 2.355 1.00 21.53 C ATOM 1285 NZ LYS A 80 -19.129 6.106 2.044 1.00 44.04 N ATOM 0 H LYS A 80 -13.625 4.397 2.829 1.00 14.05 H new ATOM 0 HA LYS A 80 -13.258 7.254 3.522 1.00 62.02 H new ATOM 0 HB2 LYS A 80 -14.397 7.163 1.444 1.00 64.14 H new ATOM 0 HB3 LYS A 80 -15.338 5.761 1.912 1.00 64.14 H new ATOM 0 HG2 LYS A 80 -16.445 7.271 3.677 1.00 41.42 H new ATOM 0 HG3 LYS A 80 -15.681 8.619 2.859 1.00 41.42 H new ATOM 0 HD2 LYS A 80 -17.167 8.569 1.151 1.00 53.43 H new ATOM 0 HD3 LYS A 80 -17.021 6.833 0.962 1.00 53.43 H new ATOM 0 HE2 LYS A 80 -18.435 7.546 3.435 1.00 21.53 H new ATOM 0 HE3 LYS A 80 -19.217 8.223 2.020 1.00 21.53 H new ATOM 0 HZ1 LYS A 80 -20.053 6.018 2.513 1.00 44.04 H new ATOM 0 HZ2 LYS A 80 -19.252 6.012 1.016 1.00 44.04 H new ATOM 0 HZ3 LYS A 80 -18.494 5.357 2.386 1.00 44.04 H new ATOM 1299 N TYR A 81 -14.147 6.740 5.781 1.00 72.34 N ATOM 1300 CA TYR A 81 -14.757 6.585 7.095 1.00 32.55 C ATOM 1301 C TYR A 81 -15.690 7.751 7.405 1.00 12.22 C ATOM 1302 O TYR A 81 -15.328 8.914 7.230 1.00 15.11 O ATOM 1303 CB TYR A 81 -13.677 6.481 8.174 1.00 65.34 C ATOM 1304 CG TYR A 81 -13.983 5.456 9.242 1.00 53.13 C ATOM 1305 CD1 TYR A 81 -15.139 5.545 10.008 1.00 1.23 C ATOM 1306 CD2 TYR A 81 -13.116 4.397 9.484 1.00 73.50 C ATOM 1307 CE1 TYR A 81 -15.422 4.611 10.985 1.00 30.00 C ATOM 1308 CE2 TYR A 81 -13.392 3.457 10.459 1.00 71.24 C ATOM 1309 CZ TYR A 81 -14.546 3.569 11.207 1.00 73.32 C ATOM 1310 OH TYR A 81 -14.825 2.635 12.179 1.00 55.31 O ATOM 0 H TYR A 81 -13.315 7.330 5.770 1.00 72.34 H new ATOM 0 HA TYR A 81 -15.344 5.666 7.088 1.00 32.55 H new ATOM 0 HB2 TYR A 81 -12.727 6.229 7.702 1.00 65.34 H new ATOM 0 HB3 TYR A 81 -13.550 7.456 8.644 1.00 65.34 H new ATOM 0 HD1 TYR A 81 -15.828 6.359 9.836 1.00 1.23 H new ATOM 0 HD2 TYR A 81 -12.212 4.307 8.901 1.00 73.50 H new ATOM 0 HE1 TYR A 81 -16.324 4.696 11.572 1.00 30.00 H new ATOM 0 HE2 TYR A 81 -12.708 2.640 10.634 1.00 71.24 H new ATOM 0 HH TYR A 81 -14.252 1.850 12.053 1.00 55.31 H new ATOM 1320 N VAL A 82 -16.894 7.430 7.868 1.00 53.50 N ATOM 1321 CA VAL A 82 -17.881 8.450 8.204 1.00 70.12 C ATOM 1322 C VAL A 82 -17.982 8.641 9.713 1.00 23.10 C ATOM 1323 O VAL A 82 -17.656 7.740 10.487 1.00 53.23 O ATOM 1324 CB VAL A 82 -19.272 8.091 7.649 1.00 61.53 C ATOM 1325 CG1 VAL A 82 -19.888 6.951 8.447 1.00 44.10 C ATOM 1326 CG2 VAL A 82 -20.180 9.311 7.658 1.00 33.12 C ATOM 0 H VAL A 82 -17.210 6.472 8.019 1.00 53.50 H new ATOM 0 HA VAL A 82 -17.544 9.379 7.744 1.00 70.12 H new ATOM 0 HB VAL A 82 -19.158 7.759 6.617 1.00 61.53 H new ATOM 0 HG11 VAL A 82 -20.870 6.711 8.040 1.00 44.10 H new ATOM 0 HG12 VAL A 82 -19.245 6.073 8.383 1.00 44.10 H new ATOM 0 HG13 VAL A 82 -19.990 7.251 9.490 1.00 44.10 H new ATOM 0 HG21 VAL A 82 -21.159 9.039 7.263 1.00 33.12 H new ATOM 0 HG22 VAL A 82 -20.290 9.675 8.679 1.00 33.12 H new ATOM 0 HG23 VAL A 82 -19.743 10.094 7.038 1.00 33.12 H new ATOM 1336 N HIS A 83 -18.436 9.820 10.126 1.00 2.33 N ATOM 1337 CA HIS A 83 -18.581 10.129 11.544 1.00 11.33 C ATOM 1338 C HIS A 83 -20.003 9.847 12.018 1.00 0.35 C ATOM 1339 O HIS A 83 -20.284 8.782 12.570 1.00 52.43 O ATOM 1340 CB HIS A 83 -18.224 11.593 11.808 1.00 64.32 C ATOM 1341 CG HIS A 83 -16.770 11.898 11.616 1.00 72.04 C ATOM 1342 ND1 HIS A 83 -15.981 11.795 10.521 1.00 73.42 N flip ATOM 1343 CD2 HIS A 83 -15.960 12.370 12.627 1.00 53.43 C flip ATOM 1344 CE1 HIS A 83 -14.722 12.204 10.886 1.00 72.20 C flip ATOM 1345 NE2 HIS A 83 -14.736 12.546 12.162 1.00 4.11 N flip ATOM 0 H HIS A 83 -18.710 10.577 9.499 1.00 2.33 H new ATOM 0 HA HIS A 83 -17.897 9.490 12.102 1.00 11.33 H new ATOM 0 HB2 HIS A 83 -18.811 12.227 11.144 1.00 64.32 H new ATOM 0 HB3 HIS A 83 -18.509 11.850 12.828 1.00 64.32 H new ATOM 0 HD1 HIS A 83 -16.268 11.473 9.597 1.00 73.42 H new ATOM 0 HD2 HIS A 83 -16.277 12.565 13.641 1.00 53.43 H new ATOM 0 HE1 HIS A 83 -13.860 12.240 10.236 1.00 72.20 H new ATOM 1354 N ASP A 84 -20.895 10.807 11.802 1.00 15.34 N ATOM 1355 CA ASP A 84 -22.289 10.662 12.208 1.00 64.31 C ATOM 1356 C ASP A 84 -23.011 12.004 12.161 1.00 12.32 C ATOM 1357 O ASP A 84 -24.119 12.107 11.633 1.00 63.31 O ATOM 1358 CB ASP A 84 -22.373 10.071 13.616 1.00 51.53 C ATOM 1359 CG ASP A 84 -22.963 8.675 13.624 1.00 72.12 C ATOM 1360 OD1 ASP A 84 -22.506 7.833 12.823 1.00 23.34 O ATOM 1361 OD2 ASP A 84 -23.884 8.424 14.430 1.00 70.41 O ATOM 0 H ASP A 84 -20.678 11.694 11.348 1.00 15.34 H new ATOM 0 HA ASP A 84 -22.777 9.984 11.508 1.00 64.31 H new ATOM 0 HB2 ASP A 84 -21.376 10.043 14.055 1.00 51.53 H new ATOM 0 HB3 ASP A 84 -22.980 10.722 14.245 1.00 51.53 H new ATOM 1366 N ASP A 85 -22.377 13.031 12.717 1.00 22.42 N ATOM 1367 CA ASP A 85 -22.959 14.368 12.739 1.00 12.14 C ATOM 1368 C ASP A 85 -23.117 14.915 11.325 1.00 30.02 C ATOM 1369 O ASP A 85 -23.790 15.922 11.109 1.00 32.02 O ATOM 1370 CB ASP A 85 -22.090 15.312 13.571 1.00 14.24 C ATOM 1371 CG ASP A 85 -22.912 16.218 14.467 1.00 34.41 C ATOM 1372 OD1 ASP A 85 -23.770 15.697 15.210 1.00 13.45 O ATOM 1373 OD2 ASP A 85 -22.696 17.446 14.426 1.00 15.51 O ATOM 0 H ASP A 85 -21.460 12.963 13.158 1.00 22.42 H new ATOM 0 HA ASP A 85 -23.947 14.300 13.195 1.00 12.14 H new ATOM 0 HB2 ASP A 85 -21.405 14.725 14.183 1.00 14.24 H new ATOM 0 HB3 ASP A 85 -21.480 15.922 12.904 1.00 14.24 H new ATOM 1378 N GLY A 86 -22.490 14.245 10.362 1.00 2.44 N ATOM 1379 CA GLY A 86 -22.572 14.681 8.981 1.00 63.34 C ATOM 1380 C GLY A 86 -21.207 14.918 8.366 1.00 1.40 C ATOM 1381 O GLY A 86 -21.088 15.602 7.349 1.00 65.30 O ATOM 0 H GLY A 86 -21.927 13.408 10.514 1.00 2.44 H new ATOM 0 HA2 GLY A 86 -23.105 13.930 8.397 1.00 63.34 H new ATOM 0 HA3 GLY A 86 -23.156 15.600 8.927 1.00 63.34 H new ATOM 1385 N ARG A 87 -20.174 14.355 8.985 1.00 42.15 N ATOM 1386 CA ARG A 87 -18.811 14.513 8.493 1.00 20.25 C ATOM 1387 C ARG A 87 -18.204 13.160 8.132 1.00 5.21 C ATOM 1388 O ARG A 87 -18.309 12.197 8.893 1.00 42.42 O ATOM 1389 CB ARG A 87 -17.944 15.208 9.545 1.00 62.22 C ATOM 1390 CG ARG A 87 -18.368 16.639 9.834 1.00 60.11 C ATOM 1391 CD ARG A 87 -17.967 17.577 8.706 1.00 73.13 C ATOM 1392 NE ARG A 87 -18.690 18.844 8.765 1.00 71.44 N ATOM 1393 CZ ARG A 87 -18.742 19.708 7.757 1.00 53.00 C ATOM 1394 NH1 ARG A 87 -18.117 19.442 6.618 1.00 42.21 N ATOM 1395 NH2 ARG A 87 -19.422 20.841 7.887 1.00 43.04 N ATOM 0 H ARG A 87 -20.255 13.786 9.828 1.00 42.15 H new ATOM 0 HA ARG A 87 -18.844 15.129 7.594 1.00 20.25 H new ATOM 0 HB2 ARG A 87 -17.980 14.633 10.471 1.00 62.22 H new ATOM 0 HB3 ARG A 87 -16.907 15.206 9.208 1.00 62.22 H new ATOM 0 HG2 ARG A 87 -19.448 16.678 9.975 1.00 60.11 H new ATOM 0 HG3 ARG A 87 -17.913 16.973 10.766 1.00 60.11 H new ATOM 0 HD2 ARG A 87 -16.895 17.769 8.758 1.00 73.13 H new ATOM 0 HD3 ARG A 87 -18.159 17.094 7.748 1.00 73.13 H new ATOM 0 HE ARG A 87 -19.182 19.079 9.627 1.00 71.44 H new ATOM 0 HH11 ARG A 87 -17.595 18.572 6.514 1.00 42.21 H new ATOM 0 HH12 ARG A 87 -18.159 20.107 5.846 1.00 42.21 H new ATOM 0 HH21 ARG A 87 -19.905 21.049 8.761 1.00 43.04 H new ATOM 0 HH22 ARG A 87 -19.461 21.504 7.113 1.00 43.04 H new ATOM 1409 N VAL A 88 -17.568 13.094 6.967 1.00 55.24 N ATOM 1410 CA VAL A 88 -16.944 11.861 6.504 1.00 21.23 C ATOM 1411 C VAL A 88 -15.572 12.133 5.898 1.00 2.22 C ATOM 1412 O VAL A 88 -15.425 12.995 5.032 1.00 50.25 O ATOM 1413 CB VAL A 88 -17.822 11.145 5.460 1.00 31.22 C ATOM 1414 CG1 VAL A 88 -18.093 12.057 4.274 1.00 4.03 C ATOM 1415 CG2 VAL A 88 -17.162 9.851 5.009 1.00 64.41 C ATOM 0 H VAL A 88 -17.471 13.881 6.326 1.00 55.24 H new ATOM 0 HA VAL A 88 -16.831 11.217 7.376 1.00 21.23 H new ATOM 0 HB VAL A 88 -18.778 10.897 5.922 1.00 31.22 H new ATOM 0 HG11 VAL A 88 -18.715 11.534 3.547 1.00 4.03 H new ATOM 0 HG12 VAL A 88 -18.610 12.954 4.615 1.00 4.03 H new ATOM 0 HG13 VAL A 88 -17.149 12.338 3.808 1.00 4.03 H new ATOM 0 HG21 VAL A 88 -17.795 9.357 4.272 1.00 64.41 H new ATOM 0 HG22 VAL A 88 -16.192 10.073 4.564 1.00 64.41 H new ATOM 0 HG23 VAL A 88 -17.025 9.194 5.868 1.00 64.41 H new ATOM 1425 N SER A 89 -14.570 11.391 6.359 1.00 32.23 N ATOM 1426 CA SER A 89 -13.208 11.555 5.864 1.00 21.41 C ATOM 1427 C SER A 89 -12.662 10.234 5.330 1.00 72.42 C ATOM 1428 O SER A 89 -13.128 9.159 5.706 1.00 54.12 O ATOM 1429 CB SER A 89 -12.299 12.082 6.977 1.00 52.14 C ATOM 1430 OG SER A 89 -12.720 13.362 7.415 1.00 13.42 O ATOM 0 H SER A 89 -14.676 10.671 7.074 1.00 32.23 H new ATOM 0 HA SER A 89 -13.228 12.277 5.048 1.00 21.41 H new ATOM 0 HB2 SER A 89 -12.306 11.387 7.816 1.00 52.14 H new ATOM 0 HB3 SER A 89 -11.272 12.137 6.617 1.00 52.14 H new ATOM 0 HG SER A 89 -12.125 13.676 8.127 1.00 13.42 H new ATOM 1436 N TYR A 90 -11.671 10.324 4.449 1.00 14.41 N ATOM 1437 CA TYR A 90 -11.063 9.137 3.860 1.00 41.53 C ATOM 1438 C TYR A 90 -9.638 8.944 4.372 1.00 34.13 C ATOM 1439 O TYR A 90 -8.679 9.509 3.846 1.00 35.23 O ATOM 1440 CB TYR A 90 -11.057 9.246 2.334 1.00 12.42 C ATOM 1441 CG TYR A 90 -12.101 10.196 1.791 1.00 74.52 C ATOM 1442 CD1 TYR A 90 -13.456 9.930 1.945 1.00 54.35 C ATOM 1443 CD2 TYR A 90 -11.733 11.357 1.123 1.00 61.21 C ATOM 1444 CE1 TYR A 90 -14.414 10.794 1.449 1.00 23.43 C ATOM 1445 CE2 TYR A 90 -12.683 12.227 0.626 1.00 51.51 C ATOM 1446 CZ TYR A 90 -14.022 11.941 0.791 1.00 51.42 C ATOM 1447 OH TYR A 90 -14.972 12.805 0.296 1.00 62.52 O ATOM 0 H TYR A 90 -11.272 11.206 4.128 1.00 14.41 H new ATOM 0 HA TYR A 90 -11.657 8.271 4.154 1.00 41.53 H new ATOM 0 HB2 TYR A 90 -10.071 9.576 2.006 1.00 12.42 H new ATOM 0 HB3 TYR A 90 -11.221 8.257 1.907 1.00 12.42 H new ATOM 0 HD1 TYR A 90 -13.766 9.033 2.461 1.00 54.35 H new ATOM 0 HD2 TYR A 90 -10.685 11.583 0.990 1.00 61.21 H new ATOM 0 HE1 TYR A 90 -15.463 10.572 1.576 1.00 23.43 H new ATOM 0 HE2 TYR A 90 -12.379 13.126 0.111 1.00 51.51 H new ATOM 0 HH TYR A 90 -14.529 13.564 -0.138 1.00 62.52 H new ATOM 1457 N PRO A 91 -9.497 8.125 5.425 1.00 24.22 N ATOM 1458 CA PRO A 91 -8.194 7.836 6.032 1.00 72.31 C ATOM 1459 C PRO A 91 -7.308 6.987 5.127 1.00 32.21 C ATOM 1460 O PRO A 91 -7.448 5.763 5.074 1.00 4.45 O ATOM 1461 CB PRO A 91 -8.558 7.062 7.301 1.00 0.05 C ATOM 1462 CG PRO A 91 -9.883 6.447 7.004 1.00 2.25 C ATOM 1463 CD PRO A 91 -10.596 7.417 6.103 1.00 50.41 C ATOM 0 HA PRO A 91 -7.621 8.744 6.219 1.00 72.31 H new ATOM 0 HB2 PRO A 91 -7.811 6.302 7.529 1.00 0.05 H new ATOM 0 HB3 PRO A 91 -8.614 7.723 8.166 1.00 0.05 H new ATOM 0 HG2 PRO A 91 -9.764 5.478 6.518 1.00 2.25 H new ATOM 0 HG3 PRO A 91 -10.449 6.277 7.920 1.00 2.25 H new ATOM 0 HD2 PRO A 91 -11.242 6.903 5.391 1.00 50.41 H new ATOM 0 HD3 PRO A 91 -11.226 8.102 6.669 1.00 50.41 H new ATOM 1471 N LEU A 92 -6.397 7.641 4.416 1.00 50.34 N ATOM 1472 CA LEU A 92 -5.486 6.946 3.512 1.00 32.05 C ATOM 1473 C LEU A 92 -4.440 6.158 4.294 1.00 51.42 C ATOM 1474 O LEU A 92 -3.752 6.707 5.156 1.00 63.45 O ATOM 1475 CB LEU A 92 -4.798 7.946 2.580 1.00 34.43 C ATOM 1476 CG LEU A 92 -5.297 7.968 1.135 1.00 32.14 C ATOM 1477 CD1 LEU A 92 -5.962 9.300 0.820 1.00 21.54 C ATOM 1478 CD2 LEU A 92 -4.150 7.701 0.172 1.00 54.54 C ATOM 0 H LEU A 92 -6.269 8.652 4.448 1.00 50.34 H new ATOM 0 HA LEU A 92 -6.070 6.246 2.915 1.00 32.05 H new ATOM 0 HB2 LEU A 92 -4.917 8.945 3.000 1.00 34.43 H new ATOM 0 HB3 LEU A 92 -3.730 7.729 2.571 1.00 34.43 H new ATOM 0 HG LEU A 92 -6.038 7.178 1.014 1.00 32.14 H new ATOM 0 HD11 LEU A 92 -6.311 9.297 -0.213 1.00 21.54 H new ATOM 0 HD12 LEU A 92 -6.809 9.451 1.489 1.00 21.54 H new ATOM 0 HD13 LEU A 92 -5.243 10.107 0.958 1.00 21.54 H new ATOM 0 HD21 LEU A 92 -4.523 7.720 -0.852 1.00 54.54 H new ATOM 0 HD22 LEU A 92 -3.386 8.469 0.294 1.00 54.54 H new ATOM 0 HD23 LEU A 92 -3.718 6.723 0.383 1.00 54.54 H new ATOM 1490 N CYS A 93 -4.323 4.871 3.985 1.00 12.41 N ATOM 1491 CA CYS A 93 -3.358 4.008 4.657 1.00 14.34 C ATOM 1492 C CYS A 93 -2.438 3.331 3.647 1.00 4.02 C ATOM 1493 O CYS A 93 -2.691 3.362 2.443 1.00 34.41 O ATOM 1494 CB CYS A 93 -4.084 2.951 5.493 1.00 45.54 C ATOM 1495 SG CYS A 93 -5.007 3.625 6.894 1.00 41.11 S ATOM 0 H CYS A 93 -4.884 4.402 3.274 1.00 12.41 H new ATOM 0 HA CYS A 93 -2.750 4.628 5.316 1.00 14.34 H new ATOM 0 HB2 CYS A 93 -4.771 2.403 4.849 1.00 45.54 H new ATOM 0 HB3 CYS A 93 -3.354 2.232 5.865 1.00 45.54 H new ATOM 0 HG CYS A 93 -4.817 2.876 7.940 1.00 41.11 H new ATOM 1501 N PHE A 94 -1.367 2.722 4.145 1.00 1.03 N ATOM 1502 CA PHE A 94 -0.407 2.040 3.286 1.00 4.40 C ATOM 1503 C PHE A 94 -0.406 0.538 3.557 1.00 5.40 C ATOM 1504 O PHE A 94 0.096 0.083 4.586 1.00 15.23 O ATOM 1505 CB PHE A 94 0.997 2.609 3.502 1.00 52.51 C ATOM 1506 CG PHE A 94 2.024 2.045 2.563 1.00 62.41 C ATOM 1507 CD1 PHE A 94 2.267 2.645 1.339 1.00 42.32 C ATOM 1508 CD2 PHE A 94 2.746 0.912 2.904 1.00 5.33 C ATOM 1509 CE1 PHE A 94 3.211 2.127 0.473 1.00 65.44 C ATOM 1510 CE2 PHE A 94 3.691 0.390 2.042 1.00 4.12 C ATOM 1511 CZ PHE A 94 3.925 0.998 0.825 1.00 4.32 C ATOM 0 H PHE A 94 -1.142 2.687 5.139 1.00 1.03 H new ATOM 0 HA PHE A 94 -0.703 2.205 2.250 1.00 4.40 H new ATOM 0 HB2 PHE A 94 0.964 3.692 3.383 1.00 52.51 H new ATOM 0 HB3 PHE A 94 1.307 2.411 4.528 1.00 52.51 H new ATOM 0 HD1 PHE A 94 1.712 3.528 1.058 1.00 42.32 H new ATOM 0 HD2 PHE A 94 2.568 0.432 3.855 1.00 5.33 H new ATOM 0 HE1 PHE A 94 3.391 2.605 -0.479 1.00 65.44 H new ATOM 0 HE2 PHE A 94 4.246 -0.493 2.320 1.00 4.12 H new ATOM 0 HZ PHE A 94 4.664 0.592 0.150 1.00 4.32 H new ATOM 1521 N ILE A 95 -0.970 -0.225 2.628 1.00 44.31 N ATOM 1522 CA ILE A 95 -1.034 -1.674 2.766 1.00 61.11 C ATOM 1523 C ILE A 95 0.155 -2.345 2.085 1.00 50.43 C ATOM 1524 O ILE A 95 0.445 -2.081 0.917 1.00 14.14 O ATOM 1525 CB ILE A 95 -2.337 -2.240 2.171 1.00 1.44 C ATOM 1526 CG1 ILE A 95 -3.551 -1.561 2.809 1.00 23.44 C ATOM 1527 CG2 ILE A 95 -2.400 -3.747 2.370 1.00 2.20 C ATOM 1528 CD1 ILE A 95 -4.832 -1.756 2.029 1.00 31.33 C ATOM 0 H ILE A 95 -1.389 0.136 1.771 1.00 44.31 H new ATOM 0 HA ILE A 95 -1.008 -1.890 3.834 1.00 61.11 H new ATOM 0 HB ILE A 95 -2.350 -2.034 1.101 1.00 1.44 H new ATOM 0 HG12 ILE A 95 -3.687 -1.951 3.818 1.00 23.44 H new ATOM 0 HG13 ILE A 95 -3.352 -0.494 2.904 1.00 23.44 H new ATOM 0 HG21 ILE A 95 -3.327 -4.132 1.944 1.00 2.20 H new ATOM 0 HG22 ILE A 95 -1.550 -4.215 1.873 1.00 2.20 H new ATOM 0 HG23 ILE A 95 -2.368 -3.975 3.435 1.00 2.20 H new ATOM 0 HD11 ILE A 95 -5.650 -1.248 2.540 1.00 31.33 H new ATOM 0 HD12 ILE A 95 -4.715 -1.341 1.028 1.00 31.33 H new ATOM 0 HD13 ILE A 95 -5.055 -2.820 1.956 1.00 31.33 H new ATOM 1540 N PHE A 96 0.839 -3.213 2.821 1.00 62.11 N ATOM 1541 CA PHE A 96 1.996 -3.923 2.288 1.00 42.43 C ATOM 1542 C PHE A 96 1.706 -5.415 2.156 1.00 3.21 C ATOM 1543 O PHE A 96 1.843 -6.173 3.117 1.00 45.41 O ATOM 1544 CB PHE A 96 3.213 -3.706 3.189 1.00 25.11 C ATOM 1545 CG PHE A 96 4.443 -4.432 2.722 1.00 31.00 C ATOM 1546 CD1 PHE A 96 4.536 -4.897 1.420 1.00 11.52 C ATOM 1547 CD2 PHE A 96 5.506 -4.649 3.585 1.00 14.20 C ATOM 1548 CE1 PHE A 96 5.666 -5.564 0.986 1.00 22.12 C ATOM 1549 CE2 PHE A 96 6.637 -5.315 3.157 1.00 65.53 C ATOM 1550 CZ PHE A 96 6.717 -5.775 1.857 1.00 64.24 C ATOM 0 H PHE A 96 0.613 -3.442 3.789 1.00 62.11 H new ATOM 0 HA PHE A 96 2.211 -3.524 1.297 1.00 42.43 H new ATOM 0 HB2 PHE A 96 3.429 -2.639 3.243 1.00 25.11 H new ATOM 0 HB3 PHE A 96 2.970 -4.033 4.200 1.00 25.11 H new ATOM 0 HD1 PHE A 96 3.716 -4.736 0.736 1.00 11.52 H new ATOM 0 HD2 PHE A 96 5.449 -4.293 4.603 1.00 14.20 H new ATOM 0 HE1 PHE A 96 5.727 -5.919 -0.032 1.00 22.12 H new ATOM 0 HE2 PHE A 96 7.459 -5.476 3.839 1.00 65.53 H new ATOM 0 HZ PHE A 96 7.600 -6.299 1.522 1.00 64.24 H new ATOM 1560 N SER A 97 1.305 -5.830 0.959 1.00 52.34 N ATOM 1561 CA SER A 97 0.992 -7.230 0.700 1.00 12.24 C ATOM 1562 C SER A 97 2.264 -8.040 0.474 1.00 43.42 C ATOM 1563 O SER A 97 2.810 -8.062 -0.630 1.00 70.41 O ATOM 1564 CB SER A 97 0.071 -7.353 -0.517 1.00 4.15 C ATOM 1565 OG SER A 97 -0.595 -8.603 -0.527 1.00 33.33 O ATOM 0 H SER A 97 1.189 -5.216 0.153 1.00 52.34 H new ATOM 0 HA SER A 97 0.480 -7.629 1.576 1.00 12.24 H new ATOM 0 HB2 SER A 97 -0.662 -6.547 -0.505 1.00 4.15 H new ATOM 0 HB3 SER A 97 0.654 -7.240 -1.431 1.00 4.15 H new ATOM 0 HG SER A 97 0.066 -9.326 -0.562 1.00 33.33 H new ATOM 1571 N SER A 98 2.733 -8.703 1.526 1.00 44.41 N ATOM 1572 CA SER A 98 3.944 -9.510 1.444 1.00 24.42 C ATOM 1573 C SER A 98 3.667 -10.949 1.870 1.00 62.15 C ATOM 1574 O SER A 98 3.708 -11.293 3.051 1.00 12.31 O ATOM 1575 CB SER A 98 5.044 -8.910 2.322 1.00 12.50 C ATOM 1576 OG SER A 98 4.841 -9.233 3.686 1.00 15.24 O ATOM 0 H SER A 98 2.292 -8.697 2.446 1.00 44.41 H new ATOM 0 HA SER A 98 4.279 -9.513 0.407 1.00 24.42 H new ATOM 0 HB2 SER A 98 6.016 -9.282 1.998 1.00 12.50 H new ATOM 0 HB3 SER A 98 5.061 -7.827 2.200 1.00 12.50 H new ATOM 0 HG SER A 98 4.825 -10.207 3.793 1.00 15.24 H new ATOM 1582 N PRO A 99 3.379 -11.811 0.883 1.00 32.35 N ATOM 1583 CA PRO A 99 3.090 -13.228 1.130 1.00 1.33 C ATOM 1584 C PRO A 99 4.324 -14.001 1.579 1.00 63.23 C ATOM 1585 O PRO A 99 5.448 -13.505 1.487 1.00 13.04 O ATOM 1586 CB PRO A 99 2.607 -13.733 -0.231 1.00 44.22 C ATOM 1587 CG PRO A 99 3.234 -12.813 -1.222 1.00 3.24 C ATOM 1588 CD PRO A 99 3.313 -11.471 -0.547 1.00 14.32 C ATOM 0 HA PRO A 99 2.364 -13.363 1.932 1.00 1.33 H new ATOM 0 HB2 PRO A 99 2.912 -14.765 -0.401 1.00 44.22 H new ATOM 0 HB3 PRO A 99 1.519 -13.707 -0.300 1.00 44.22 H new ATOM 0 HG2 PRO A 99 4.225 -13.165 -1.509 1.00 3.24 H new ATOM 0 HG3 PRO A 99 2.639 -12.757 -2.134 1.00 3.24 H new ATOM 0 HD2 PRO A 99 4.192 -10.911 -0.868 1.00 14.32 H new ATOM 0 HD3 PRO A 99 2.443 -10.855 -0.774 1.00 14.32 H new ATOM 1596 N VAL A 100 4.110 -15.220 2.063 1.00 74.12 N ATOM 1597 CA VAL A 100 5.206 -16.064 2.525 1.00 54.21 C ATOM 1598 C VAL A 100 5.496 -17.181 1.530 1.00 75.54 C ATOM 1599 O VAL A 100 6.193 -18.145 1.846 1.00 12.34 O ATOM 1600 CB VAL A 100 4.897 -16.684 3.901 1.00 43.24 C ATOM 1601 CG1 VAL A 100 3.614 -17.499 3.842 1.00 2.34 C ATOM 1602 CG2 VAL A 100 6.062 -17.540 4.372 1.00 22.14 C ATOM 0 H VAL A 100 3.187 -15.646 2.146 1.00 74.12 H new ATOM 0 HA VAL A 100 6.083 -15.423 2.613 1.00 54.21 H new ATOM 0 HB VAL A 100 4.754 -15.878 4.621 1.00 43.24 H new ATOM 0 HG11 VAL A 100 3.411 -17.930 4.823 1.00 2.34 H new ATOM 0 HG12 VAL A 100 2.786 -16.853 3.551 1.00 2.34 H new ATOM 0 HG13 VAL A 100 3.725 -18.299 3.110 1.00 2.34 H new ATOM 0 HG21 VAL A 100 5.827 -17.970 5.346 1.00 22.14 H new ATOM 0 HG22 VAL A 100 6.238 -18.341 3.654 1.00 22.14 H new ATOM 0 HG23 VAL A 100 6.957 -16.923 4.454 1.00 22.14 H new ATOM 1612 N GLY A 101 4.955 -17.047 0.322 1.00 40.25 N ATOM 1613 CA GLY A 101 5.167 -18.052 -0.702 1.00 71.43 C ATOM 1614 C GLY A 101 6.124 -17.588 -1.781 1.00 62.24 C ATOM 1615 O GLY A 101 6.475 -18.353 -2.681 1.00 54.51 O ATOM 0 H GLY A 101 4.374 -16.260 0.035 1.00 40.25 H new ATOM 0 HA2 GLY A 101 5.557 -18.959 -0.241 1.00 71.43 H new ATOM 0 HA3 GLY A 101 4.210 -18.311 -1.156 1.00 71.43 H new ATOM 1619 N CYS A 102 6.548 -16.333 -1.693 1.00 42.14 N ATOM 1620 CA CYS A 102 7.470 -15.766 -2.671 1.00 64.24 C ATOM 1621 C CYS A 102 8.917 -15.954 -2.228 1.00 2.45 C ATOM 1622 O CYS A 102 9.187 -16.577 -1.200 1.00 5.21 O ATOM 1623 CB CYS A 102 7.176 -14.280 -2.880 1.00 2.10 C ATOM 1624 SG CYS A 102 7.533 -13.683 -4.549 1.00 34.24 S ATOM 0 H CYS A 102 6.268 -15.688 -0.954 1.00 42.14 H new ATOM 0 HA CYS A 102 7.327 -16.292 -3.615 1.00 64.24 H new ATOM 0 HB2 CYS A 102 6.126 -14.094 -2.656 1.00 2.10 H new ATOM 0 HB3 CYS A 102 7.762 -13.701 -2.166 1.00 2.10 H new ATOM 0 HG CYS A 102 6.594 -14.072 -5.359 1.00 34.24 H new ATOM 1630 N LYS A 103 9.845 -15.411 -3.008 1.00 10.43 N ATOM 1631 CA LYS A 103 11.266 -15.517 -2.697 1.00 30.22 C ATOM 1632 C LYS A 103 11.715 -14.365 -1.803 1.00 61.22 C ATOM 1633 O LYS A 103 11.166 -13.264 -1.846 1.00 52.10 O ATOM 1634 CB LYS A 103 12.092 -15.529 -3.984 1.00 70.44 C ATOM 1635 CG LYS A 103 11.474 -16.361 -5.096 1.00 25.44 C ATOM 1636 CD LYS A 103 11.510 -15.629 -6.426 1.00 54.43 C ATOM 1637 CE LYS A 103 12.930 -15.249 -6.817 1.00 13.33 C ATOM 1638 NZ LYS A 103 13.421 -16.053 -7.970 1.00 2.32 N ATOM 0 H LYS A 103 9.638 -14.892 -3.862 1.00 10.43 H new ATOM 0 HA LYS A 103 11.426 -16.453 -2.162 1.00 30.22 H new ATOM 0 HB2 LYS A 103 12.217 -14.505 -4.335 1.00 70.44 H new ATOM 0 HB3 LYS A 103 13.087 -15.915 -3.763 1.00 70.44 H new ATOM 0 HG2 LYS A 103 12.010 -17.306 -5.185 1.00 25.44 H new ATOM 0 HG3 LYS A 103 10.442 -16.602 -4.840 1.00 25.44 H new ATOM 0 HD2 LYS A 103 11.075 -16.260 -7.201 1.00 54.43 H new ATOM 0 HD3 LYS A 103 10.896 -14.730 -6.364 1.00 54.43 H new ATOM 0 HE2 LYS A 103 12.966 -14.190 -7.071 1.00 13.33 H new ATOM 0 HE3 LYS A 103 13.593 -15.394 -5.964 1.00 13.33 H new ATOM 0 HZ1 LYS A 103 14.392 -15.764 -8.206 1.00 2.32 H new ATOM 0 HZ2 LYS A 103 13.411 -17.062 -7.719 1.00 2.32 H new ATOM 0 HZ3 LYS A 103 12.803 -15.895 -8.792 1.00 2.32 H new ATOM 1652 N PRO A 104 12.737 -14.622 -0.974 1.00 64.22 N ATOM 1653 CA PRO A 104 13.284 -13.618 -0.057 1.00 22.02 C ATOM 1654 C PRO A 104 14.029 -12.507 -0.789 1.00 34.11 C ATOM 1655 O PRO A 104 14.272 -11.439 -0.231 1.00 15.43 O ATOM 1656 CB PRO A 104 14.250 -14.423 0.816 1.00 31.42 C ATOM 1657 CG PRO A 104 14.642 -15.587 -0.028 1.00 2.25 C ATOM 1658 CD PRO A 104 13.440 -15.912 -0.870 1.00 71.43 C ATOM 0 HA PRO A 104 12.500 -13.111 0.506 1.00 22.02 H new ATOM 0 HB2 PRO A 104 15.119 -13.828 1.098 1.00 31.42 H new ATOM 0 HB3 PRO A 104 13.772 -14.747 1.740 1.00 31.42 H new ATOM 0 HG2 PRO A 104 15.502 -15.344 -0.653 1.00 2.25 H new ATOM 0 HG3 PRO A 104 14.927 -16.438 0.590 1.00 2.25 H new ATOM 0 HD2 PRO A 104 13.727 -16.293 -1.850 1.00 71.43 H new ATOM 0 HD3 PRO A 104 12.816 -16.673 -0.402 1.00 71.43 H new ATOM 1666 N GLU A 105 14.387 -12.768 -2.042 1.00 52.44 N ATOM 1667 CA GLU A 105 15.104 -11.788 -2.850 1.00 73.33 C ATOM 1668 C GLU A 105 14.185 -10.639 -3.254 1.00 2.23 C ATOM 1669 O GLU A 105 14.635 -9.508 -3.441 1.00 22.25 O ATOM 1670 CB GLU A 105 15.687 -12.453 -4.099 1.00 2.21 C ATOM 1671 CG GLU A 105 16.892 -13.333 -3.815 1.00 31.23 C ATOM 1672 CD GLU A 105 18.115 -12.534 -3.409 1.00 3.31 C ATOM 1673 OE1 GLU A 105 18.452 -11.562 -4.118 1.00 14.02 O ATOM 1674 OE2 GLU A 105 18.737 -12.881 -2.383 1.00 11.14 O ATOM 0 H GLU A 105 14.193 -13.648 -2.519 1.00 52.44 H new ATOM 0 HA GLU A 105 15.918 -11.384 -2.248 1.00 73.33 H new ATOM 0 HB2 GLU A 105 14.913 -13.055 -4.575 1.00 2.21 H new ATOM 0 HB3 GLU A 105 15.973 -11.680 -4.812 1.00 2.21 H new ATOM 0 HG2 GLU A 105 16.643 -14.038 -3.022 1.00 31.23 H new ATOM 0 HG3 GLU A 105 17.125 -13.921 -4.703 1.00 31.23 H new ATOM 1681 N GLN A 106 12.897 -10.937 -3.387 1.00 61.32 N ATOM 1682 CA GLN A 106 11.916 -9.929 -3.770 1.00 50.25 C ATOM 1683 C GLN A 106 11.307 -9.267 -2.539 1.00 5.35 C ATOM 1684 O GLN A 106 11.428 -8.056 -2.351 1.00 33.21 O ATOM 1685 CB GLN A 106 10.813 -10.559 -4.623 1.00 31.22 C ATOM 1686 CG GLN A 106 11.323 -11.602 -5.604 1.00 33.24 C ATOM 1687 CD GLN A 106 12.125 -10.994 -6.737 1.00 21.02 C ATOM 1688 OE1 GLN A 106 13.277 -11.364 -6.968 1.00 34.35 O ATOM 1689 NE2 GLN A 106 11.520 -10.053 -7.454 1.00 22.23 N ATOM 0 H GLN A 106 12.509 -11.868 -3.235 1.00 61.32 H new ATOM 0 HA GLN A 106 12.427 -9.165 -4.356 1.00 50.25 H new ATOM 0 HB2 GLN A 106 10.076 -11.020 -3.966 1.00 31.22 H new ATOM 0 HB3 GLN A 106 10.299 -9.773 -5.176 1.00 31.22 H new ATOM 0 HG2 GLN A 106 11.943 -12.324 -5.072 1.00 33.24 H new ATOM 0 HG3 GLN A 106 10.477 -12.151 -6.017 1.00 33.24 H new ATOM 0 HE21 GLN A 106 10.564 -9.776 -7.229 1.00 22.23 H new ATOM 0 HE22 GLN A 106 12.011 -9.608 -8.229 1.00 22.23 H new ATOM 1698 N GLN A 107 10.654 -10.068 -1.704 1.00 53.01 N ATOM 1699 CA GLN A 107 10.025 -9.558 -0.491 1.00 11.24 C ATOM 1700 C GLN A 107 10.905 -8.507 0.177 1.00 3.45 C ATOM 1701 O GLN A 107 10.411 -7.497 0.679 1.00 32.42 O ATOM 1702 CB GLN A 107 9.747 -10.703 0.485 1.00 1.53 C ATOM 1703 CG GLN A 107 8.277 -10.857 0.839 1.00 1.14 C ATOM 1704 CD GLN A 107 7.996 -10.574 2.302 1.00 44.41 C ATOM 1705 OE1 GLN A 107 7.454 -11.416 3.016 1.00 24.44 O ATOM 1706 NE2 GLN A 107 8.365 -9.381 2.756 1.00 41.12 N ATOM 0 H GLN A 107 10.546 -11.073 -1.845 1.00 53.01 H new ATOM 0 HA GLN A 107 9.081 -9.091 -0.770 1.00 11.24 H new ATOM 0 HB2 GLN A 107 10.107 -11.635 0.050 1.00 1.53 H new ATOM 0 HB3 GLN A 107 10.317 -10.537 1.399 1.00 1.53 H new ATOM 0 HG2 GLN A 107 7.686 -10.180 0.222 1.00 1.14 H new ATOM 0 HG3 GLN A 107 7.954 -11.870 0.600 1.00 1.14 H new ATOM 0 HE21 GLN A 107 8.812 -8.712 2.129 1.00 41.12 H new ATOM 0 HE22 GLN A 107 8.201 -9.134 3.732 1.00 41.12 H new ATOM 1715 N MET A 108 12.212 -8.750 0.180 1.00 73.41 N ATOM 1716 CA MET A 108 13.161 -7.824 0.786 1.00 33.40 C ATOM 1717 C MET A 108 13.166 -6.490 0.046 1.00 32.22 C ATOM 1718 O MET A 108 13.167 -5.427 0.666 1.00 13.32 O ATOM 1719 CB MET A 108 14.566 -8.427 0.784 1.00 2.05 C ATOM 1720 CG MET A 108 14.839 -9.336 1.972 1.00 5.13 C ATOM 1721 SD MET A 108 16.493 -9.111 2.654 1.00 41.42 S ATOM 1722 CE MET A 108 17.504 -9.626 1.269 1.00 61.22 C ATOM 0 H MET A 108 12.638 -9.581 -0.231 1.00 73.41 H new ATOM 0 HA MET A 108 12.851 -7.647 1.816 1.00 33.40 H new ATOM 0 HB2 MET A 108 14.708 -8.993 -0.136 1.00 2.05 H new ATOM 0 HB3 MET A 108 15.299 -7.620 0.778 1.00 2.05 H new ATOM 0 HG2 MET A 108 14.100 -9.142 2.750 1.00 5.13 H new ATOM 0 HG3 MET A 108 14.715 -10.375 1.666 1.00 5.13 H new ATOM 0 HE1 MET A 108 18.554 -9.611 1.560 1.00 61.22 H new ATOM 0 HE2 MET A 108 17.225 -10.636 0.970 1.00 61.22 H new ATOM 0 HE3 MET A 108 17.349 -8.945 0.432 1.00 61.22 H new ATOM 1732 N MET A 109 13.169 -6.554 -1.281 1.00 60.24 N ATOM 1733 CA MET A 109 13.173 -5.351 -2.104 1.00 32.11 C ATOM 1734 C MET A 109 12.045 -4.409 -1.695 1.00 13.31 C ATOM 1735 O MET A 109 12.172 -3.189 -1.805 1.00 70.12 O ATOM 1736 CB MET A 109 13.036 -5.717 -3.583 1.00 33.20 C ATOM 1737 CG MET A 109 14.345 -6.142 -4.227 1.00 44.34 C ATOM 1738 SD MET A 109 14.895 -4.994 -5.504 1.00 11.30 S ATOM 1739 CE MET A 109 13.686 -5.309 -6.787 1.00 43.31 C ATOM 0 H MET A 109 13.169 -7.426 -1.809 1.00 60.24 H new ATOM 0 HA MET A 109 14.124 -4.840 -1.951 1.00 32.11 H new ATOM 0 HB2 MET A 109 12.312 -6.525 -3.683 1.00 33.20 H new ATOM 0 HB3 MET A 109 12.635 -4.861 -4.125 1.00 33.20 H new ATOM 0 HG2 MET A 109 15.114 -6.221 -3.459 1.00 44.34 H new ATOM 0 HG3 MET A 109 14.226 -7.134 -4.662 1.00 44.34 H new ATOM 0 HE1 MET A 109 13.816 -4.588 -7.594 1.00 43.31 H new ATOM 0 HE2 MET A 109 13.823 -6.318 -7.176 1.00 43.31 H new ATOM 0 HE3 MET A 109 12.682 -5.213 -6.373 1.00 43.31 H new ATOM 1749 N TYR A 110 10.943 -4.982 -1.225 1.00 52.22 N ATOM 1750 CA TYR A 110 9.792 -4.193 -0.802 1.00 53.25 C ATOM 1751 C TYR A 110 9.830 -3.936 0.701 1.00 51.10 C ATOM 1752 O TYR A 110 9.428 -2.872 1.170 1.00 63.12 O ATOM 1753 CB TYR A 110 8.492 -4.907 -1.176 1.00 63.43 C ATOM 1754 CG TYR A 110 8.450 -5.375 -2.614 1.00 45.52 C ATOM 1755 CD1 TYR A 110 8.960 -6.614 -2.978 1.00 22.22 C ATOM 1756 CD2 TYR A 110 7.899 -4.575 -3.609 1.00 30.23 C ATOM 1757 CE1 TYR A 110 8.925 -7.045 -4.291 1.00 15.34 C ATOM 1758 CE2 TYR A 110 7.858 -4.997 -4.923 1.00 33.12 C ATOM 1759 CZ TYR A 110 8.372 -6.232 -5.259 1.00 73.53 C ATOM 1760 OH TYR A 110 8.333 -6.657 -6.567 1.00 30.42 O ATOM 0 H TYR A 110 10.822 -5.990 -1.127 1.00 52.22 H new ATOM 0 HA TYR A 110 9.833 -3.233 -1.317 1.00 53.25 H new ATOM 0 HB2 TYR A 110 8.357 -5.766 -0.519 1.00 63.43 H new ATOM 0 HB3 TYR A 110 7.653 -4.234 -0.997 1.00 63.43 H new ATOM 0 HD1 TYR A 110 9.392 -7.253 -2.222 1.00 22.22 H new ATOM 0 HD2 TYR A 110 7.496 -3.607 -3.350 1.00 30.23 H new ATOM 0 HE1 TYR A 110 9.328 -8.011 -4.557 1.00 15.34 H new ATOM 0 HE2 TYR A 110 7.426 -4.364 -5.684 1.00 33.12 H new ATOM 0 HH TYR A 110 7.911 -5.968 -7.122 1.00 30.42 H new ATOM 1770 N ALA A 111 10.316 -4.919 1.450 1.00 31.21 N ATOM 1771 CA ALA A 111 10.409 -4.800 2.901 1.00 65.13 C ATOM 1772 C ALA A 111 11.425 -3.735 3.299 1.00 14.13 C ATOM 1773 O ALA A 111 11.309 -3.119 4.358 1.00 13.21 O ATOM 1774 CB ALA A 111 10.780 -6.142 3.518 1.00 53.53 C ATOM 0 H ALA A 111 10.652 -5.807 1.077 1.00 31.21 H new ATOM 0 HA ALA A 111 9.433 -4.495 3.280 1.00 65.13 H new ATOM 0 HB1 ALA A 111 10.846 -6.039 4.601 1.00 53.53 H new ATOM 0 HB2 ALA A 111 10.017 -6.880 3.270 1.00 53.53 H new ATOM 0 HB3 ALA A 111 11.743 -6.469 3.125 1.00 53.53 H new ATOM 1780 N GLY A 112 12.420 -3.522 2.443 1.00 15.13 N ATOM 1781 CA GLY A 112 13.441 -2.530 2.726 1.00 22.13 C ATOM 1782 C GLY A 112 13.136 -1.187 2.092 1.00 35.33 C ATOM 1783 O GLY A 112 13.516 -0.142 2.622 1.00 75.31 O ATOM 0 H GLY A 112 12.537 -4.018 1.560 1.00 15.13 H new ATOM 0 HA2 GLY A 112 13.534 -2.406 3.805 1.00 22.13 H new ATOM 0 HA3 GLY A 112 14.404 -2.890 2.362 1.00 22.13 H new ATOM 1787 N SER A 113 12.449 -1.213 0.955 1.00 13.15 N ATOM 1788 CA SER A 113 12.098 0.012 0.246 1.00 32.23 C ATOM 1789 C SER A 113 10.745 0.541 0.713 1.00 61.04 C ATOM 1790 O SER A 113 10.381 1.682 0.432 1.00 55.20 O ATOM 1791 CB SER A 113 12.066 -0.238 -1.263 1.00 22.54 C ATOM 1792 OG SER A 113 13.256 -0.871 -1.699 1.00 63.24 O ATOM 0 H SER A 113 12.124 -2.069 0.505 1.00 13.15 H new ATOM 0 HA SER A 113 12.858 0.761 0.467 1.00 32.23 H new ATOM 0 HB2 SER A 113 11.206 -0.860 -1.514 1.00 22.54 H new ATOM 0 HB3 SER A 113 11.940 0.708 -1.789 1.00 22.54 H new ATOM 0 HG SER A 113 13.169 -1.841 -1.591 1.00 63.24 H new ATOM 1798 N LYS A 114 10.003 -0.298 1.429 1.00 61.42 N ATOM 1799 CA LYS A 114 8.691 0.083 1.937 1.00 11.31 C ATOM 1800 C LYS A 114 8.750 1.440 2.632 1.00 61.03 C ATOM 1801 O LYS A 114 8.040 2.371 2.256 1.00 61.43 O ATOM 1802 CB LYS A 114 8.171 -0.978 2.910 1.00 21.22 C ATOM 1803 CG LYS A 114 7.004 -0.504 3.760 1.00 74.14 C ATOM 1804 CD LYS A 114 6.437 -1.632 4.605 1.00 15.12 C ATOM 1805 CE LYS A 114 7.163 -1.750 5.936 1.00 54.01 C ATOM 1806 NZ LYS A 114 6.528 -2.761 6.827 1.00 62.44 N ATOM 0 H LYS A 114 10.289 -1.247 1.670 1.00 61.42 H new ATOM 0 HA LYS A 114 8.008 0.157 1.091 1.00 11.31 H new ATOM 0 HB2 LYS A 114 7.864 -1.858 2.345 1.00 21.22 H new ATOM 0 HB3 LYS A 114 8.985 -1.288 3.566 1.00 21.22 H new ATOM 0 HG2 LYS A 114 7.331 0.309 4.408 1.00 74.14 H new ATOM 0 HG3 LYS A 114 6.222 -0.102 3.115 1.00 74.14 H new ATOM 0 HD2 LYS A 114 5.376 -1.457 4.782 1.00 15.12 H new ATOM 0 HD3 LYS A 114 6.518 -2.573 4.060 1.00 15.12 H new ATOM 0 HE2 LYS A 114 8.203 -2.024 5.759 1.00 54.01 H new ATOM 0 HE3 LYS A 114 7.169 -0.780 6.434 1.00 54.01 H new ATOM 0 HZ1 LYS A 114 7.052 -2.811 7.724 1.00 62.44 H new ATOM 0 HZ2 LYS A 114 5.543 -2.487 7.017 1.00 62.44 H new ATOM 0 HZ3 LYS A 114 6.545 -3.692 6.363 1.00 62.44 H new ATOM 1820 N ASN A 115 9.601 1.544 3.647 1.00 24.32 N ATOM 1821 CA ASN A 115 9.753 2.788 4.393 1.00 61.30 C ATOM 1822 C ASN A 115 10.050 3.953 3.453 1.00 34.23 C ATOM 1823 O ASN A 115 9.461 5.027 3.575 1.00 12.25 O ATOM 1824 CB ASN A 115 10.873 2.653 5.426 1.00 4.52 C ATOM 1825 CG ASN A 115 12.249 2.835 4.816 1.00 52.12 C ATOM 1826 OD1 ASN A 115 12.680 3.958 4.552 1.00 1.43 O ATOM 1827 ND2 ASN A 115 12.946 1.728 4.586 1.00 54.32 N ATOM 0 H ASN A 115 10.196 0.782 3.972 1.00 24.32 H new ATOM 0 HA ASN A 115 8.814 2.991 4.909 1.00 61.30 H new ATOM 0 HB2 ASN A 115 10.728 3.392 6.214 1.00 4.52 H new ATOM 0 HB3 ASN A 115 10.814 1.671 5.895 1.00 4.52 H new ATOM 0 HD21 ASN A 115 13.878 1.788 4.175 1.00 54.32 H new ATOM 0 HD22 ASN A 115 12.550 0.818 4.821 1.00 54.32 H new ATOM 1834 N ARG A 116 10.967 3.732 2.517 1.00 72.41 N ATOM 1835 CA ARG A 116 11.342 4.763 1.558 1.00 54.14 C ATOM 1836 C ARG A 116 10.117 5.284 0.812 1.00 13.33 C ATOM 1837 O ARG A 116 9.836 6.483 0.819 1.00 12.23 O ATOM 1838 CB ARG A 116 12.364 4.214 0.559 1.00 34.33 C ATOM 1839 CG ARG A 116 12.642 5.150 -0.605 1.00 1.32 C ATOM 1840 CD ARG A 116 13.747 6.141 -0.270 1.00 71.04 C ATOM 1841 NE ARG A 116 15.060 5.660 -0.693 1.00 32.24 N ATOM 1842 CZ ARG A 116 16.131 6.438 -0.790 1.00 51.45 C ATOM 1843 NH1 ARG A 116 16.045 7.729 -0.499 1.00 42.43 N ATOM 1844 NH2 ARG A 116 17.291 5.927 -1.182 1.00 30.41 N ATOM 0 H ARG A 116 11.464 2.848 2.403 1.00 72.41 H new ATOM 0 HA ARG A 116 11.790 5.590 2.109 1.00 54.14 H new ATOM 0 HB2 ARG A 116 13.298 4.012 1.082 1.00 34.33 H new ATOM 0 HB3 ARG A 116 12.004 3.262 0.170 1.00 34.33 H new ATOM 0 HG2 ARG A 116 12.927 4.568 -1.482 1.00 1.32 H new ATOM 0 HG3 ARG A 116 11.732 5.691 -0.864 1.00 1.32 H new ATOM 0 HD2 ARG A 116 13.537 7.095 -0.754 1.00 71.04 H new ATOM 0 HD3 ARG A 116 13.757 6.324 0.805 1.00 71.04 H new ATOM 0 HE ARG A 116 15.159 4.672 -0.927 1.00 32.24 H new ATOM 0 HH11 ARG A 116 15.154 8.126 -0.200 1.00 42.43 H new ATOM 0 HH12 ARG A 116 16.869 8.325 -0.574 1.00 42.43 H new ATOM 0 HH21 ARG A 116 17.361 4.935 -1.409 1.00 30.41 H new ATOM 0 HH22 ARG A 116 18.113 6.526 -1.256 1.00 30.41 H new ATOM 1858 N LEU A 117 9.391 4.376 0.169 1.00 23.35 N ATOM 1859 CA LEU A 117 8.196 4.743 -0.581 1.00 53.24 C ATOM 1860 C LEU A 117 7.154 5.382 0.331 1.00 10.14 C ATOM 1861 O LEU A 117 6.717 6.510 0.100 1.00 71.02 O ATOM 1862 CB LEU A 117 7.602 3.512 -1.269 1.00 1.22 C ATOM 1863 CG LEU A 117 6.239 3.707 -1.935 1.00 3.24 C ATOM 1864 CD1 LEU A 117 6.400 4.364 -3.296 1.00 14.31 C ATOM 1865 CD2 LEU A 117 5.515 2.375 -2.065 1.00 54.22 C ATOM 0 H LEU A 117 9.610 3.380 0.152 1.00 23.35 H new ATOM 0 HA LEU A 117 8.484 5.472 -1.339 1.00 53.24 H new ATOM 0 HB2 LEU A 117 8.307 3.167 -2.025 1.00 1.22 H new ATOM 0 HB3 LEU A 117 7.512 2.716 -0.530 1.00 1.22 H new ATOM 0 HG LEU A 117 5.638 4.364 -1.306 1.00 3.24 H new ATOM 0 HD11 LEU A 117 5.420 4.495 -3.755 1.00 14.31 H new ATOM 0 HD12 LEU A 117 6.877 5.337 -3.176 1.00 14.31 H new ATOM 0 HD13 LEU A 117 7.018 3.732 -3.934 1.00 14.31 H new ATOM 0 HD21 LEU A 117 4.547 2.532 -2.541 1.00 54.22 H new ATOM 0 HD22 LEU A 117 6.112 1.694 -2.672 1.00 54.22 H new ATOM 0 HD23 LEU A 117 5.367 1.943 -1.075 1.00 54.22 H new ATOM 1877 N VAL A 118 6.761 4.654 1.372 1.00 14.12 N ATOM 1878 CA VAL A 118 5.773 5.151 2.323 1.00 20.31 C ATOM 1879 C VAL A 118 6.111 6.566 2.778 1.00 10.32 C ATOM 1880 O VAL A 118 5.262 7.456 2.749 1.00 3.20 O ATOM 1881 CB VAL A 118 5.673 4.236 3.557 1.00 14.23 C ATOM 1882 CG1 VAL A 118 4.703 4.816 4.576 1.00 44.31 C ATOM 1883 CG2 VAL A 118 5.252 2.833 3.148 1.00 35.31 C ATOM 0 H VAL A 118 7.112 3.719 1.578 1.00 14.12 H new ATOM 0 HA VAL A 118 4.813 5.159 1.807 1.00 20.31 H new ATOM 0 HB VAL A 118 6.657 4.175 4.022 1.00 14.23 H new ATOM 0 HG11 VAL A 118 4.646 4.155 5.441 1.00 44.31 H new ATOM 0 HG12 VAL A 118 5.052 5.799 4.893 1.00 44.31 H new ATOM 0 HG13 VAL A 118 3.715 4.910 4.125 1.00 44.31 H new ATOM 0 HG21 VAL A 118 5.187 2.200 4.033 1.00 35.31 H new ATOM 0 HG22 VAL A 118 4.279 2.873 2.658 1.00 35.31 H new ATOM 0 HG23 VAL A 118 5.988 2.418 2.459 1.00 35.31 H new ATOM 1893 N GLN A 119 7.357 6.765 3.198 1.00 72.04 N ATOM 1894 CA GLN A 119 7.806 8.073 3.660 1.00 62.42 C ATOM 1895 C GLN A 119 7.552 9.141 2.603 1.00 72.44 C ATOM 1896 O GLN A 119 7.207 10.279 2.924 1.00 63.44 O ATOM 1897 CB GLN A 119 9.296 8.029 4.009 1.00 74.50 C ATOM 1898 CG GLN A 119 9.581 7.443 5.383 1.00 12.30 C ATOM 1899 CD GLN A 119 10.437 8.355 6.239 1.00 72.20 C ATOM 1900 OE1 GLN A 119 10.021 8.786 7.315 1.00 2.21 O ATOM 1901 NE2 GLN A 119 11.641 8.655 5.766 1.00 75.21 N ATOM 0 H GLN A 119 8.072 6.038 3.228 1.00 72.04 H new ATOM 0 HA GLN A 119 7.237 8.330 4.553 1.00 62.42 H new ATOM 0 HB2 GLN A 119 9.820 7.440 3.256 1.00 74.50 H new ATOM 0 HB3 GLN A 119 9.702 9.040 3.963 1.00 74.50 H new ATOM 0 HG2 GLN A 119 8.638 7.250 5.895 1.00 12.30 H new ATOM 0 HG3 GLN A 119 10.083 6.482 5.267 1.00 12.30 H new ATOM 0 HE21 GLN A 119 11.946 8.276 4.869 1.00 75.21 H new ATOM 0 HE22 GLN A 119 12.261 9.265 6.299 1.00 75.21 H new ATOM 1910 N THR A 120 7.722 8.768 1.338 1.00 65.14 N ATOM 1911 CA THR A 120 7.513 9.695 0.232 1.00 32.24 C ATOM 1912 C THR A 120 6.052 10.121 0.143 1.00 61.30 C ATOM 1913 O THR A 120 5.750 11.298 -0.047 1.00 52.14 O ATOM 1914 CB THR A 120 7.938 9.071 -1.111 1.00 1.40 C ATOM 1915 OG1 THR A 120 9.167 8.355 -0.951 1.00 54.11 O ATOM 1916 CG2 THR A 120 8.106 10.146 -2.176 1.00 34.51 C ATOM 0 H THR A 120 8.004 7.830 1.054 1.00 65.14 H new ATOM 0 HA THR A 120 8.133 10.570 0.429 1.00 32.24 H new ATOM 0 HB THR A 120 7.156 8.382 -1.431 1.00 1.40 H new ATOM 0 HG1 THR A 120 8.997 7.516 -0.473 1.00 54.11 H new ATOM 0 HG21 THR A 120 8.406 9.683 -3.116 1.00 34.51 H new ATOM 0 HG22 THR A 120 7.161 10.671 -2.316 1.00 34.51 H new ATOM 0 HG23 THR A 120 8.871 10.855 -1.860 1.00 34.51 H new ATOM 1924 N ALA A 121 5.149 9.155 0.282 1.00 54.24 N ATOM 1925 CA ALA A 121 3.719 9.433 0.218 1.00 23.44 C ATOM 1926 C ALA A 121 3.255 10.204 1.449 1.00 62.41 C ATOM 1927 O ALA A 121 2.174 10.792 1.452 1.00 21.54 O ATOM 1928 CB ALA A 121 2.936 8.135 0.079 1.00 22.24 C ATOM 0 H ALA A 121 5.382 8.175 0.439 1.00 54.24 H new ATOM 0 HA ALA A 121 3.532 10.053 -0.659 1.00 23.44 H new ATOM 0 HB1 ALA A 121 1.870 8.356 0.032 1.00 22.24 H new ATOM 0 HB2 ALA A 121 3.240 7.622 -0.833 1.00 22.24 H new ATOM 0 HB3 ALA A 121 3.136 7.495 0.939 1.00 22.24 H new ATOM 1934 N GLU A 122 4.078 10.195 2.493 1.00 3.25 N ATOM 1935 CA GLU A 122 3.750 10.893 3.730 1.00 54.41 C ATOM 1936 C GLU A 122 2.574 10.223 4.437 1.00 44.30 C ATOM 1937 O GLU A 122 1.762 10.888 5.082 1.00 5.14 O ATOM 1938 CB GLU A 122 3.417 12.358 3.442 1.00 52.21 C ATOM 1939 CG GLU A 122 4.086 13.333 4.397 1.00 13.51 C ATOM 1940 CD GLU A 122 3.978 14.772 3.932 1.00 3.52 C ATOM 1941 OE1 GLU A 122 2.913 15.387 4.150 1.00 3.35 O ATOM 1942 OE2 GLU A 122 4.958 15.284 3.350 1.00 33.05 O ATOM 0 H GLU A 122 4.976 9.712 2.506 1.00 3.25 H new ATOM 0 HA GLU A 122 4.620 10.847 4.385 1.00 54.41 H new ATOM 0 HB2 GLU A 122 3.718 12.597 2.422 1.00 52.21 H new ATOM 0 HB3 GLU A 122 2.337 12.494 3.495 1.00 52.21 H new ATOM 0 HG2 GLU A 122 3.632 13.239 5.383 1.00 13.51 H new ATOM 0 HG3 GLU A 122 5.138 13.068 4.504 1.00 13.51 H new ATOM 1949 N LEU A 123 2.489 8.904 4.310 1.00 64.35 N ATOM 1950 CA LEU A 123 1.413 8.143 4.936 1.00 64.45 C ATOM 1951 C LEU A 123 1.823 7.660 6.323 1.00 40.52 C ATOM 1952 O LEU A 123 2.479 6.628 6.465 1.00 64.12 O ATOM 1953 CB LEU A 123 1.031 6.948 4.060 1.00 40.01 C ATOM 1954 CG LEU A 123 0.620 7.273 2.623 1.00 32.11 C ATOM 1955 CD1 LEU A 123 0.901 6.092 1.707 1.00 11.42 C ATOM 1956 CD2 LEU A 123 -0.852 7.657 2.565 1.00 64.03 C ATOM 0 H LEU A 123 3.152 8.339 3.779 1.00 64.35 H new ATOM 0 HA LEU A 123 0.550 8.800 5.041 1.00 64.45 H new ATOM 0 HB2 LEU A 123 1.877 6.261 4.028 1.00 40.01 H new ATOM 0 HB3 LEU A 123 0.209 6.419 4.541 1.00 40.01 H new ATOM 0 HG LEU A 123 1.211 8.121 2.279 1.00 32.11 H new ATOM 0 HD11 LEU A 123 0.602 6.342 0.689 1.00 11.42 H new ATOM 0 HD12 LEU A 123 1.966 5.862 1.726 1.00 11.42 H new ATOM 0 HD13 LEU A 123 0.336 5.224 2.048 1.00 11.42 H new ATOM 0 HD21 LEU A 123 -1.128 7.885 1.536 1.00 64.03 H new ATOM 0 HD22 LEU A 123 -1.459 6.828 2.928 1.00 64.03 H new ATOM 0 HD23 LEU A 123 -1.024 8.533 3.190 1.00 64.03 H new ATOM 1968 N THR A 124 1.430 8.413 7.346 1.00 1.02 N ATOM 1969 CA THR A 124 1.756 8.062 8.722 1.00 14.25 C ATOM 1970 C THR A 124 1.133 6.725 9.111 1.00 1.45 C ATOM 1971 O THR A 124 1.606 6.051 10.026 1.00 34.32 O ATOM 1972 CB THR A 124 1.275 9.145 9.707 1.00 12.14 C ATOM 1973 OG1 THR A 124 1.486 8.711 11.055 1.00 70.25 O ATOM 1974 CG2 THR A 124 -0.199 9.454 9.494 1.00 53.44 C ATOM 0 H THR A 124 0.885 9.270 7.247 1.00 1.02 H new ATOM 0 HA THR A 124 2.842 7.985 8.780 1.00 14.25 H new ATOM 0 HB THR A 124 1.851 10.052 9.524 1.00 12.14 H new ATOM 0 HG1 THR A 124 1.179 9.406 11.674 1.00 70.25 H new ATOM 0 HG21 THR A 124 -0.516 10.221 10.201 1.00 53.44 H new ATOM 0 HG22 THR A 124 -0.352 9.813 8.476 1.00 53.44 H new ATOM 0 HG23 THR A 124 -0.787 8.550 9.652 1.00 53.44 H new ATOM 1982 N LYS A 125 0.069 6.348 8.410 1.00 11.03 N ATOM 1983 CA LYS A 125 -0.619 5.090 8.680 1.00 3.42 C ATOM 1984 C LYS A 125 -0.217 4.023 7.667 1.00 23.32 C ATOM 1985 O LYS A 125 -0.709 4.007 6.540 1.00 73.53 O ATOM 1986 CB LYS A 125 -2.135 5.297 8.646 1.00 43.14 C ATOM 1987 CG LYS A 125 -2.627 6.352 9.621 1.00 22.45 C ATOM 1988 CD LYS A 125 -3.440 5.733 10.747 1.00 24.24 C ATOM 1989 CE LYS A 125 -4.749 6.476 10.963 1.00 53.42 C ATOM 1990 NZ LYS A 125 -4.568 7.681 11.820 1.00 71.32 N ATOM 0 H LYS A 125 -0.336 6.895 7.651 1.00 11.03 H new ATOM 0 HA LYS A 125 -0.328 4.750 9.674 1.00 3.42 H new ATOM 0 HB2 LYS A 125 -2.432 5.581 7.636 1.00 43.14 H new ATOM 0 HB3 LYS A 125 -2.628 4.351 8.869 1.00 43.14 H new ATOM 0 HG2 LYS A 125 -1.775 6.889 10.038 1.00 22.45 H new ATOM 0 HG3 LYS A 125 -3.236 7.084 9.090 1.00 22.45 H new ATOM 0 HD2 LYS A 125 -3.647 4.688 10.516 1.00 24.24 H new ATOM 0 HD3 LYS A 125 -2.857 5.746 11.668 1.00 24.24 H new ATOM 0 HE2 LYS A 125 -5.161 6.775 9.999 1.00 53.42 H new ATOM 0 HE3 LYS A 125 -5.474 5.807 11.426 1.00 53.42 H new ATOM 0 HZ1 LYS A 125 -5.483 8.160 11.943 1.00 71.32 H new ATOM 0 HZ2 LYS A 125 -4.199 7.394 12.749 1.00 71.32 H new ATOM 0 HZ3 LYS A 125 -3.895 8.332 11.367 1.00 71.32 H new ATOM 2004 N VAL A 126 0.680 3.132 8.078 1.00 60.42 N ATOM 2005 CA VAL A 126 1.146 2.059 7.208 1.00 74.12 C ATOM 2006 C VAL A 126 1.034 0.704 7.897 1.00 24.41 C ATOM 2007 O VAL A 126 1.688 0.456 8.911 1.00 71.02 O ATOM 2008 CB VAL A 126 2.606 2.283 6.773 1.00 44.30 C ATOM 2009 CG1 VAL A 126 3.403 2.932 7.893 1.00 41.42 C ATOM 2010 CG2 VAL A 126 3.242 0.968 6.348 1.00 64.02 C ATOM 0 H VAL A 126 1.098 3.132 9.008 1.00 60.42 H new ATOM 0 HA VAL A 126 0.507 2.068 6.325 1.00 74.12 H new ATOM 0 HB VAL A 126 2.613 2.958 5.917 1.00 44.30 H new ATOM 0 HG11 VAL A 126 4.432 3.082 7.567 1.00 41.42 H new ATOM 0 HG12 VAL A 126 2.958 3.894 8.146 1.00 41.42 H new ATOM 0 HG13 VAL A 126 3.391 2.285 8.770 1.00 41.42 H new ATOM 0 HG21 VAL A 126 4.274 1.144 6.044 1.00 64.02 H new ATOM 0 HG22 VAL A 126 3.225 0.269 7.184 1.00 64.02 H new ATOM 0 HG23 VAL A 126 2.684 0.547 5.512 1.00 64.02 H new ATOM 2020 N PHE A 127 0.202 -0.170 7.342 1.00 42.22 N ATOM 2021 CA PHE A 127 0.004 -1.502 7.903 1.00 11.34 C ATOM 2022 C PHE A 127 0.665 -2.564 7.030 1.00 54.04 C ATOM 2023 O PHE A 127 0.943 -2.330 5.854 1.00 30.10 O ATOM 2024 CB PHE A 127 -1.489 -1.800 8.048 1.00 34.51 C ATOM 2025 CG PHE A 127 -2.265 -0.684 8.689 1.00 24.43 C ATOM 2026 CD1 PHE A 127 -1.805 -0.083 9.850 1.00 54.43 C ATOM 2027 CD2 PHE A 127 -3.452 -0.238 8.132 1.00 53.02 C ATOM 2028 CE1 PHE A 127 -2.518 0.943 10.443 1.00 4.10 C ATOM 2029 CE2 PHE A 127 -4.168 0.788 8.720 1.00 24.24 C ATOM 2030 CZ PHE A 127 -3.699 1.380 9.877 1.00 61.34 C ATOM 0 H PHE A 127 -0.347 0.020 6.503 1.00 42.22 H new ATOM 0 HA PHE A 127 0.469 -1.527 8.888 1.00 11.34 H new ATOM 0 HB2 PHE A 127 -1.908 -2.003 7.062 1.00 34.51 H new ATOM 0 HB3 PHE A 127 -1.614 -2.706 8.641 1.00 34.51 H new ATOM 0 HD1 PHE A 127 -0.881 -0.419 10.296 1.00 54.43 H new ATOM 0 HD2 PHE A 127 -3.823 -0.697 7.228 1.00 53.02 H new ATOM 0 HE1 PHE A 127 -2.151 1.402 11.349 1.00 4.10 H new ATOM 0 HE2 PHE A 127 -5.092 1.126 8.276 1.00 24.24 H new ATOM 0 HZ PHE A 127 -4.255 2.183 10.338 1.00 61.34 H new ATOM 2040 N GLU A 128 0.913 -3.732 7.615 1.00 44.11 N ATOM 2041 CA GLU A 128 1.542 -4.829 6.891 1.00 21.21 C ATOM 2042 C GLU A 128 0.722 -6.109 7.024 1.00 72.43 C ATOM 2043 O GLU A 128 0.435 -6.563 8.131 1.00 22.53 O ATOM 2044 CB GLU A 128 2.962 -5.065 7.410 1.00 5.23 C ATOM 2045 CG GLU A 128 3.725 -6.128 6.636 1.00 12.24 C ATOM 2046 CD GLU A 128 4.380 -7.151 7.543 1.00 74.23 C ATOM 2047 OE1 GLU A 128 5.118 -6.742 8.463 1.00 31.33 O ATOM 2048 OE2 GLU A 128 4.155 -8.361 7.332 1.00 70.52 O ATOM 0 H GLU A 128 0.688 -3.942 8.587 1.00 44.11 H new ATOM 0 HA GLU A 128 1.589 -4.555 5.837 1.00 21.21 H new ATOM 0 HB2 GLU A 128 3.516 -4.128 7.366 1.00 5.23 H new ATOM 0 HB3 GLU A 128 2.912 -5.357 8.459 1.00 5.23 H new ATOM 0 HG2 GLU A 128 3.043 -6.636 5.954 1.00 12.24 H new ATOM 0 HG3 GLU A 128 4.489 -5.649 6.024 1.00 12.24 H new ATOM 2055 N ILE A 129 0.348 -6.686 5.886 1.00 32.11 N ATOM 2056 CA ILE A 129 -0.439 -7.913 5.874 1.00 20.14 C ATOM 2057 C ILE A 129 0.421 -9.114 5.497 1.00 44.22 C ATOM 2058 O ILE A 129 1.323 -9.007 4.665 1.00 23.22 O ATOM 2059 CB ILE A 129 -1.622 -7.813 4.894 1.00 64.44 C ATOM 2060 CG1 ILE A 129 -1.113 -7.740 3.452 1.00 21.14 C ATOM 2061 CG2 ILE A 129 -2.481 -6.602 5.221 1.00 61.34 C ATOM 2062 CD1 ILE A 129 -2.219 -7.648 2.424 1.00 4.52 C ATOM 0 H ILE A 129 0.578 -6.323 4.961 1.00 32.11 H new ATOM 0 HA ILE A 129 -0.826 -8.050 6.884 1.00 20.14 H new ATOM 0 HB ILE A 129 -2.237 -8.707 4.998 1.00 64.44 H new ATOM 0 HG12 ILE A 129 -0.460 -6.873 3.349 1.00 21.14 H new ATOM 0 HG13 ILE A 129 -0.507 -8.622 3.244 1.00 21.14 H new ATOM 0 HG21 ILE A 129 -3.313 -6.546 4.519 1.00 61.34 H new ATOM 0 HG22 ILE A 129 -2.868 -6.694 6.236 1.00 61.34 H new ATOM 0 HG23 ILE A 129 -1.879 -5.697 5.143 1.00 61.34 H new ATOM 0 HD11 ILE A 129 -1.785 -7.600 1.425 1.00 4.52 H new ATOM 0 HD12 ILE A 129 -2.859 -8.527 2.499 1.00 4.52 H new ATOM 0 HD13 ILE A 129 -2.811 -6.751 2.606 1.00 4.52 H new ATOM 2074 N ARG A 130 0.135 -10.257 6.111 1.00 44.33 N ATOM 2075 CA ARG A 130 0.883 -11.479 5.839 1.00 41.42 C ATOM 2076 C ARG A 130 0.344 -12.180 4.596 1.00 52.25 C ATOM 2077 O ARG A 130 1.009 -13.039 4.015 1.00 1.12 O ATOM 2078 CB ARG A 130 0.814 -12.423 7.040 1.00 14.50 C ATOM 2079 CG ARG A 130 1.347 -13.817 6.752 1.00 53.23 C ATOM 2080 CD ARG A 130 2.844 -13.797 6.489 1.00 42.10 C ATOM 2081 NE ARG A 130 3.616 -14.079 7.696 1.00 34.03 N ATOM 2082 CZ ARG A 130 4.931 -13.911 7.785 1.00 53.32 C ATOM 2083 NH1 ARG A 130 5.617 -13.463 6.742 1.00 71.11 N ATOM 2084 NH2 ARG A 130 5.562 -14.190 8.918 1.00 41.13 N ATOM 0 H ARG A 130 -0.609 -10.363 6.800 1.00 44.33 H new ATOM 0 HA ARG A 130 1.923 -11.206 5.660 1.00 41.42 H new ATOM 0 HB2 ARG A 130 1.381 -11.990 7.864 1.00 14.50 H new ATOM 0 HB3 ARG A 130 -0.222 -12.501 7.371 1.00 14.50 H new ATOM 0 HG2 ARG A 130 1.134 -14.471 7.597 1.00 53.23 H new ATOM 0 HG3 ARG A 130 0.830 -14.234 5.888 1.00 53.23 H new ATOM 0 HD2 ARG A 130 3.087 -14.533 5.723 1.00 42.10 H new ATOM 0 HD3 ARG A 130 3.130 -12.821 6.096 1.00 42.10 H new ATOM 0 HE ARG A 130 3.118 -14.424 8.517 1.00 34.03 H new ATOM 0 HH11 ARG A 130 5.135 -13.247 5.869 1.00 71.11 H new ATOM 0 HH12 ARG A 130 6.626 -13.335 6.812 1.00 71.11 H new ATOM 0 HH21 ARG A 130 5.038 -14.534 9.722 1.00 41.13 H new ATOM 0 HH22 ARG A 130 6.572 -14.061 8.985 1.00 41.13 H new ATOM 2098 N THR A 131 -0.867 -11.808 4.191 1.00 41.34 N ATOM 2099 CA THR A 131 -1.496 -12.402 3.017 1.00 13.23 C ATOM 2100 C THR A 131 -2.702 -11.584 2.568 1.00 72.51 C ATOM 2101 O THR A 131 -3.448 -11.053 3.391 1.00 0.54 O ATOM 2102 CB THR A 131 -1.945 -13.849 3.293 1.00 52.11 C ATOM 2103 OG1 THR A 131 -2.826 -14.294 2.256 1.00 30.23 O ATOM 2104 CG2 THR A 131 -2.646 -13.951 4.639 1.00 33.12 C ATOM 0 H THR A 131 -1.431 -11.099 4.658 1.00 41.34 H new ATOM 0 HA THR A 131 -0.748 -12.407 2.224 1.00 13.23 H new ATOM 0 HB THR A 131 -1.059 -14.483 3.314 1.00 52.11 H new ATOM 0 HG1 THR A 131 -3.106 -15.215 2.438 1.00 30.23 H new ATOM 0 HG21 THR A 131 -2.954 -14.982 4.812 1.00 33.12 H new ATOM 0 HG22 THR A 131 -1.963 -13.639 5.429 1.00 33.12 H new ATOM 0 HG23 THR A 131 -3.524 -13.305 4.642 1.00 33.12 H new ATOM 2112 N THR A 132 -2.889 -11.488 1.256 1.00 75.14 N ATOM 2113 CA THR A 132 -4.005 -10.735 0.696 1.00 11.42 C ATOM 2114 C THR A 132 -5.287 -10.984 1.483 1.00 2.13 C ATOM 2115 O THR A 132 -6.013 -10.048 1.819 1.00 64.31 O ATOM 2116 CB THR A 132 -4.245 -11.100 -0.781 1.00 63.15 C ATOM 2117 OG1 THR A 132 -4.337 -12.521 -0.926 1.00 72.23 O ATOM 2118 CG2 THR A 132 -3.122 -10.567 -1.659 1.00 74.33 C ATOM 0 H THR A 132 -2.282 -11.922 0.561 1.00 75.14 H new ATOM 0 HA THR A 132 -3.739 -9.680 0.764 1.00 11.42 H new ATOM 0 HB THR A 132 -5.182 -10.642 -1.098 1.00 63.15 H new ATOM 0 HG1 THR A 132 -4.491 -12.744 -1.868 1.00 72.23 H new ATOM 0 HG21 THR A 132 -3.313 -10.837 -2.698 1.00 74.33 H new ATOM 0 HG22 THR A 132 -3.074 -9.482 -1.569 1.00 74.33 H new ATOM 0 HG23 THR A 132 -2.174 -11.000 -1.340 1.00 74.33 H new ATOM 2126 N ASP A 133 -5.559 -12.252 1.776 1.00 0.42 N ATOM 2127 CA ASP A 133 -6.753 -12.623 2.526 1.00 23.33 C ATOM 2128 C ASP A 133 -7.018 -11.630 3.653 1.00 1.43 C ATOM 2129 O ASP A 133 -8.165 -11.275 3.925 1.00 45.33 O ATOM 2130 CB ASP A 133 -6.602 -14.034 3.098 1.00 55.44 C ATOM 2131 CG ASP A 133 -6.973 -15.108 2.094 1.00 61.25 C ATOM 2132 OD1 ASP A 133 -7.998 -14.944 1.402 1.00 52.54 O ATOM 2133 OD2 ASP A 133 -6.237 -16.113 2.000 1.00 2.53 O ATOM 0 H ASP A 133 -4.969 -13.039 1.506 1.00 0.42 H new ATOM 0 HA ASP A 133 -7.602 -12.604 1.843 1.00 23.33 H new ATOM 0 HB2 ASP A 133 -5.572 -14.183 3.422 1.00 55.44 H new ATOM 0 HB3 ASP A 133 -7.232 -14.134 3.982 1.00 55.44 H new ATOM 2138 N ASP A 134 -5.949 -11.186 4.307 1.00 32.01 N ATOM 2139 CA ASP A 134 -6.066 -10.234 5.406 1.00 73.05 C ATOM 2140 C ASP A 134 -6.836 -8.992 4.968 1.00 54.10 C ATOM 2141 O ASP A 134 -7.763 -8.549 5.650 1.00 64.33 O ATOM 2142 CB ASP A 134 -4.680 -9.837 5.914 1.00 25.02 C ATOM 2143 CG ASP A 134 -4.096 -10.864 6.863 1.00 24.34 C ATOM 2144 OD1 ASP A 134 -3.652 -11.928 6.386 1.00 62.41 O ATOM 2145 OD2 ASP A 134 -4.083 -10.604 8.085 1.00 2.02 O ATOM 0 H ASP A 134 -4.993 -11.470 4.095 1.00 32.01 H new ATOM 0 HA ASP A 134 -6.617 -10.715 6.215 1.00 73.05 H new ATOM 0 HB2 ASP A 134 -4.008 -9.707 5.065 1.00 25.02 H new ATOM 0 HB3 ASP A 134 -4.744 -8.874 6.420 1.00 25.02 H new ATOM 2150 N LEU A 135 -6.447 -8.431 3.827 1.00 32.45 N ATOM 2151 CA LEU A 135 -7.099 -7.239 3.299 1.00 51.11 C ATOM 2152 C LEU A 135 -8.609 -7.440 3.204 1.00 23.35 C ATOM 2153 O LEU A 135 -9.128 -7.849 2.166 1.00 71.30 O ATOM 2154 CB LEU A 135 -6.533 -6.892 1.921 1.00 61.12 C ATOM 2155 CG LEU A 135 -7.335 -5.881 1.101 1.00 4.21 C ATOM 2156 CD1 LEU A 135 -7.785 -4.722 1.976 1.00 42.23 C ATOM 2157 CD2 LEU A 135 -6.512 -5.376 -0.075 1.00 44.33 C ATOM 0 H LEU A 135 -5.683 -8.784 3.251 1.00 32.45 H new ATOM 0 HA LEU A 135 -6.903 -6.415 3.985 1.00 51.11 H new ATOM 0 HB2 LEU A 135 -5.523 -6.503 2.053 1.00 61.12 H new ATOM 0 HB3 LEU A 135 -6.448 -7.812 1.343 1.00 61.12 H new ATOM 0 HG LEU A 135 -8.222 -6.380 0.710 1.00 4.21 H new ATOM 0 HD11 LEU A 135 -8.354 -4.012 1.376 1.00 42.23 H new ATOM 0 HD12 LEU A 135 -8.412 -5.098 2.784 1.00 42.23 H new ATOM 0 HD13 LEU A 135 -6.912 -4.223 2.396 1.00 42.23 H new ATOM 0 HD21 LEU A 135 -7.098 -4.657 -0.648 1.00 44.33 H new ATOM 0 HD22 LEU A 135 -5.607 -4.894 0.295 1.00 44.33 H new ATOM 0 HD23 LEU A 135 -6.240 -6.215 -0.716 1.00 44.33 H new ATOM 2169 N THR A 136 -9.309 -7.149 4.296 1.00 22.45 N ATOM 2170 CA THR A 136 -10.758 -7.297 4.337 1.00 2.14 C ATOM 2171 C THR A 136 -11.423 -6.043 4.894 1.00 12.34 C ATOM 2172 O THR A 136 -10.863 -5.362 5.752 1.00 42.30 O ATOM 2173 CB THR A 136 -11.175 -8.509 5.193 1.00 42.54 C ATOM 2174 OG1 THR A 136 -10.317 -8.621 6.334 1.00 64.24 O ATOM 2175 CG2 THR A 136 -11.116 -9.791 4.378 1.00 31.32 C ATOM 0 H THR A 136 -8.895 -6.809 5.164 1.00 22.45 H new ATOM 0 HA THR A 136 -11.089 -7.455 3.311 1.00 2.14 H new ATOM 0 HB THR A 136 -12.202 -8.356 5.526 1.00 42.54 H new ATOM 0 HG1 THR A 136 -9.430 -8.925 6.048 1.00 64.24 H new ATOM 0 HG21 THR A 136 -11.414 -10.633 5.002 1.00 31.32 H new ATOM 0 HG22 THR A 136 -11.793 -9.713 3.527 1.00 31.32 H new ATOM 0 HG23 THR A 136 -10.099 -9.948 4.019 1.00 31.32 H new ATOM 2183 N GLU A 137 -12.621 -5.745 4.401 1.00 71.24 N ATOM 2184 CA GLU A 137 -13.361 -4.573 4.850 1.00 10.31 C ATOM 2185 C GLU A 137 -13.196 -4.368 6.354 1.00 54.05 C ATOM 2186 O GLU A 137 -13.090 -3.237 6.830 1.00 32.53 O ATOM 2187 CB GLU A 137 -14.845 -4.714 4.502 1.00 60.40 C ATOM 2188 CG GLU A 137 -15.707 -3.584 5.040 1.00 65.22 C ATOM 2189 CD GLU A 137 -17.044 -4.068 5.563 1.00 30.14 C ATOM 2190 OE1 GLU A 137 -17.073 -5.119 6.237 1.00 32.53 O ATOM 2191 OE2 GLU A 137 -18.063 -3.396 5.299 1.00 11.44 O ATOM 0 H GLU A 137 -13.099 -6.299 3.691 1.00 71.24 H new ATOM 0 HA GLU A 137 -12.957 -3.701 4.336 1.00 10.31 H new ATOM 0 HB2 GLU A 137 -14.953 -4.757 3.418 1.00 60.40 H new ATOM 0 HB3 GLU A 137 -15.214 -5.661 4.897 1.00 60.40 H new ATOM 0 HG2 GLU A 137 -15.172 -3.073 5.840 1.00 65.22 H new ATOM 0 HG3 GLU A 137 -15.874 -2.852 4.250 1.00 65.22 H new ATOM 2198 N THR A 138 -13.178 -5.471 7.095 1.00 5.13 N ATOM 2199 CA THR A 138 -13.028 -5.413 8.544 1.00 34.33 C ATOM 2200 C THR A 138 -11.582 -5.139 8.938 1.00 44.44 C ATOM 2201 O THR A 138 -11.262 -4.069 9.456 1.00 53.52 O ATOM 2202 CB THR A 138 -13.489 -6.725 9.209 1.00 71.23 C ATOM 2203 OG1 THR A 138 -14.706 -7.179 8.605 1.00 34.01 O ATOM 2204 CG2 THR A 138 -13.699 -6.531 10.703 1.00 44.54 C ATOM 0 H THR A 138 -13.265 -6.414 6.717 1.00 5.13 H new ATOM 0 HA THR A 138 -13.658 -4.595 8.894 1.00 34.33 H new ATOM 0 HB THR A 138 -12.710 -7.473 9.063 1.00 71.23 H new ATOM 0 HG1 THR A 138 -14.991 -8.014 9.032 1.00 34.01 H new ATOM 0 HG21 THR A 138 -14.024 -7.471 11.150 1.00 44.54 H new ATOM 0 HG22 THR A 138 -12.763 -6.215 11.164 1.00 44.54 H new ATOM 0 HG23 THR A 138 -14.460 -5.769 10.867 1.00 44.54 H new ATOM 2212 N TRP A 139 -10.711 -6.110 8.688 1.00 53.35 N ATOM 2213 CA TRP A 139 -9.296 -5.970 9.015 1.00 33.40 C ATOM 2214 C TRP A 139 -8.790 -4.577 8.662 1.00 22.24 C ATOM 2215 O TRP A 139 -7.807 -4.101 9.230 1.00 3.51 O ATOM 2216 CB TRP A 139 -8.475 -7.028 8.276 1.00 25.31 C ATOM 2217 CG TRP A 139 -7.032 -6.654 8.114 1.00 54.51 C ATOM 2218 CD1 TRP A 139 -5.974 -7.141 8.826 1.00 11.31 C ATOM 2219 CD2 TRP A 139 -6.492 -5.709 7.183 1.00 21.32 C ATOM 2220 NE1 TRP A 139 -4.808 -6.558 8.393 1.00 1.45 N ATOM 2221 CE2 TRP A 139 -5.099 -5.676 7.385 1.00 23.33 C ATOM 2222 CE3 TRP A 139 -7.049 -4.891 6.197 1.00 33.01 C ATOM 2223 CZ2 TRP A 139 -4.257 -4.856 6.638 1.00 21.33 C ATOM 2224 CZ3 TRP A 139 -6.213 -4.078 5.456 1.00 44.44 C ATOM 2225 CH2 TRP A 139 -4.830 -4.065 5.679 1.00 61.01 C ATOM 0 H TRP A 139 -10.959 -7.002 8.260 1.00 53.35 H new ATOM 0 HA TRP A 139 -9.181 -6.115 10.089 1.00 33.40 H new ATOM 0 HB2 TRP A 139 -8.540 -7.972 8.818 1.00 25.31 H new ATOM 0 HB3 TRP A 139 -8.912 -7.195 7.292 1.00 25.31 H new ATOM 0 HD1 TRP A 139 -6.043 -7.876 9.614 1.00 11.31 H new ATOM 0 HE1 TRP A 139 -3.877 -6.750 8.762 1.00 1.45 H new ATOM 0 HE3 TRP A 139 -8.114 -4.894 6.017 1.00 33.01 H new ATOM 0 HZ2 TRP A 139 -3.191 -4.845 6.809 1.00 21.33 H new ATOM 0 HZ3 TRP A 139 -6.633 -3.441 4.691 1.00 44.44 H new ATOM 0 HH2 TRP A 139 -4.204 -3.418 5.083 1.00 61.01 H new ATOM 2236 N LEU A 140 -9.467 -3.927 7.722 1.00 52.20 N ATOM 2237 CA LEU A 140 -9.085 -2.586 7.293 1.00 33.02 C ATOM 2238 C LEU A 140 -9.688 -1.528 8.212 1.00 70.11 C ATOM 2239 O LEU A 140 -8.967 -0.761 8.850 1.00 23.22 O ATOM 2240 CB LEU A 140 -9.537 -2.342 5.852 1.00 21.22 C ATOM 2241 CG LEU A 140 -9.534 -0.886 5.385 1.00 14.22 C ATOM 2242 CD1 LEU A 140 -10.809 -0.182 5.826 1.00 22.12 C ATOM 2243 CD2 LEU A 140 -8.309 -0.157 5.917 1.00 55.23 C ATOM 0 H LEU A 140 -10.283 -4.307 7.242 1.00 52.20 H new ATOM 0 HA LEU A 140 -7.999 -2.510 7.345 1.00 33.02 H new ATOM 0 HB2 LEU A 140 -8.892 -2.917 5.188 1.00 21.22 H new ATOM 0 HB3 LEU A 140 -10.546 -2.737 5.737 1.00 21.22 H new ATOM 0 HG LEU A 140 -9.494 -0.874 4.296 1.00 14.22 H new ATOM 0 HD11 LEU A 140 -10.790 0.853 5.485 1.00 22.12 H new ATOM 0 HD12 LEU A 140 -11.672 -0.690 5.396 1.00 22.12 H new ATOM 0 HD13 LEU A 140 -10.880 -0.204 6.913 1.00 22.12 H new ATOM 0 HD21 LEU A 140 -8.324 0.878 5.574 1.00 55.23 H new ATOM 0 HD22 LEU A 140 -8.318 -0.179 7.007 1.00 55.23 H new ATOM 0 HD23 LEU A 140 -7.407 -0.647 5.551 1.00 55.23 H new ATOM 2255 N LYS A 141 -11.015 -1.494 8.276 1.00 23.04 N ATOM 2256 CA LYS A 141 -11.715 -0.534 9.120 1.00 53.12 C ATOM 2257 C LYS A 141 -11.259 -0.649 10.571 1.00 52.12 C ATOM 2258 O LYS A 141 -11.332 0.315 11.332 1.00 2.35 O ATOM 2259 CB LYS A 141 -13.228 -0.753 9.030 1.00 2.53 C ATOM 2260 CG LYS A 141 -13.932 0.232 8.113 1.00 71.34 C ATOM 2261 CD LYS A 141 -15.066 -0.432 7.349 1.00 3.12 C ATOM 2262 CE LYS A 141 -16.421 -0.064 7.934 1.00 51.15 C ATOM 2263 NZ LYS A 141 -17.537 -0.428 7.017 1.00 11.33 N ATOM 0 H LYS A 141 -11.627 -2.121 7.753 1.00 23.04 H new ATOM 0 HA LYS A 141 -11.477 0.468 8.762 1.00 53.12 H new ATOM 0 HB2 LYS A 141 -13.420 -1.766 8.677 1.00 2.53 H new ATOM 0 HB3 LYS A 141 -13.658 -0.677 10.029 1.00 2.53 H new ATOM 0 HG2 LYS A 141 -14.325 1.062 8.701 1.00 71.34 H new ATOM 0 HG3 LYS A 141 -13.214 0.652 7.409 1.00 71.34 H new ATOM 0 HD2 LYS A 141 -15.026 -0.131 6.302 1.00 3.12 H new ATOM 0 HD3 LYS A 141 -14.939 -1.514 7.375 1.00 3.12 H new ATOM 0 HE2 LYS A 141 -16.555 -0.572 8.889 1.00 51.15 H new ATOM 0 HE3 LYS A 141 -16.451 1.007 8.136 1.00 51.15 H new ATOM 0 HZ1 LYS A 141 -18.380 0.132 7.257 1.00 11.33 H new ATOM 0 HZ2 LYS A 141 -17.258 -0.230 6.035 1.00 11.33 H new ATOM 0 HZ3 LYS A 141 -17.753 -1.440 7.118 1.00 11.33 H new ATOM 2277 N GLU A 142 -10.789 -1.834 10.946 1.00 22.34 N ATOM 2278 CA GLU A 142 -10.321 -2.074 12.306 1.00 23.03 C ATOM 2279 C GLU A 142 -9.093 -1.222 12.617 1.00 55.10 C ATOM 2280 O GLU A 142 -9.010 -0.594 13.672 1.00 25.04 O ATOM 2281 CB GLU A 142 -9.990 -3.555 12.503 1.00 73.01 C ATOM 2282 CG GLU A 142 -11.184 -4.394 12.927 1.00 23.00 C ATOM 2283 CD GLU A 142 -10.787 -5.582 13.781 1.00 22.33 C ATOM 2284 OE1 GLU A 142 -9.733 -6.191 13.499 1.00 52.13 O ATOM 2285 OE2 GLU A 142 -11.528 -5.904 14.733 1.00 53.33 O ATOM 0 H GLU A 142 -10.722 -2.643 10.328 1.00 22.34 H new ATOM 0 HA GLU A 142 -11.121 -1.794 12.992 1.00 23.03 H new ATOM 0 HB2 GLU A 142 -9.587 -3.956 11.573 1.00 73.01 H new ATOM 0 HB3 GLU A 142 -9.207 -3.647 13.255 1.00 73.01 H new ATOM 0 HG2 GLU A 142 -11.884 -3.769 13.482 1.00 23.00 H new ATOM 0 HG3 GLU A 142 -11.708 -4.748 12.039 1.00 23.00 H new ATOM 2292 N LYS A 143 -8.142 -1.207 11.690 1.00 1.24 N ATOM 2293 CA LYS A 143 -6.917 -0.433 11.863 1.00 54.24 C ATOM 2294 C LYS A 143 -7.221 1.062 11.906 1.00 11.22 C ATOM 2295 O LYS A 143 -6.558 1.820 12.615 1.00 5.01 O ATOM 2296 CB LYS A 143 -5.937 -0.732 10.727 1.00 52.55 C ATOM 2297 CG LYS A 143 -5.715 -2.216 10.489 1.00 14.24 C ATOM 2298 CD LYS A 143 -4.580 -2.753 11.343 1.00 21.23 C ATOM 2299 CE LYS A 143 -3.598 -3.569 10.516 1.00 71.13 C ATOM 2300 NZ LYS A 143 -2.251 -3.621 11.147 1.00 25.24 N ATOM 0 H LYS A 143 -8.195 -1.722 10.811 1.00 1.24 H new ATOM 0 HA LYS A 143 -6.464 -0.722 12.811 1.00 54.24 H new ATOM 0 HB2 LYS A 143 -6.309 -0.277 9.809 1.00 52.55 H new ATOM 0 HB3 LYS A 143 -4.980 -0.261 10.951 1.00 52.55 H new ATOM 0 HG2 LYS A 143 -6.631 -2.763 10.714 1.00 14.24 H new ATOM 0 HG3 LYS A 143 -5.492 -2.387 9.436 1.00 14.24 H new ATOM 0 HD2 LYS A 143 -4.056 -1.923 11.817 1.00 21.23 H new ATOM 0 HD3 LYS A 143 -4.986 -3.372 12.143 1.00 21.23 H new ATOM 0 HE2 LYS A 143 -3.981 -4.582 10.393 1.00 71.13 H new ATOM 0 HE3 LYS A 143 -3.516 -3.136 9.519 1.00 71.13 H new ATOM 0 HZ1 LYS A 143 -1.611 -4.186 10.553 1.00 25.24 H new ATOM 0 HZ2 LYS A 143 -1.874 -2.656 11.241 1.00 25.24 H new ATOM 0 HZ3 LYS A 143 -2.325 -4.057 12.088 1.00 25.24 H new ATOM 2314 N LEU A 144 -8.227 1.479 11.146 1.00 50.13 N ATOM 2315 CA LEU A 144 -8.619 2.884 11.099 1.00 30.13 C ATOM 2316 C LEU A 144 -9.352 3.287 12.374 1.00 2.34 C ATOM 2317 O LEU A 144 -9.078 4.338 12.953 1.00 5.32 O ATOM 2318 CB LEU A 144 -9.508 3.145 9.883 1.00 75.23 C ATOM 2319 CG LEU A 144 -9.048 2.516 8.567 1.00 22.23 C ATOM 2320 CD1 LEU A 144 -10.102 2.705 7.487 1.00 25.14 C ATOM 2321 CD2 LEU A 144 -7.718 3.111 8.128 1.00 52.41 C ATOM 0 H LEU A 144 -8.786 0.865 10.554 1.00 50.13 H new ATOM 0 HA LEU A 144 -7.714 3.486 11.016 1.00 30.13 H new ATOM 0 HB2 LEU A 144 -10.511 2.780 10.106 1.00 75.23 H new ATOM 0 HB3 LEU A 144 -9.586 4.223 9.740 1.00 75.23 H new ATOM 0 HG LEU A 144 -8.910 1.447 8.726 1.00 22.23 H new ATOM 0 HD11 LEU A 144 -9.757 2.251 6.558 1.00 25.14 H new ATOM 0 HD12 LEU A 144 -11.032 2.230 7.799 1.00 25.14 H new ATOM 0 HD13 LEU A 144 -10.274 3.770 7.328 1.00 25.14 H new ATOM 0 HD21 LEU A 144 -7.406 2.652 7.190 1.00 52.41 H new ATOM 0 HD22 LEU A 144 -7.829 4.186 7.986 1.00 52.41 H new ATOM 0 HD23 LEU A 144 -6.965 2.922 8.893 1.00 52.41 H new ATOM 2333 N ALA A 145 -10.282 2.443 12.808 1.00 35.00 N ATOM 2334 CA ALA A 145 -11.051 2.710 14.017 1.00 2.34 C ATOM 2335 C ALA A 145 -10.132 2.958 15.209 1.00 14.52 C ATOM 2336 O ALA A 145 -8.909 2.956 15.072 1.00 3.33 O ATOM 2337 CB ALA A 145 -11.994 1.553 14.309 1.00 54.14 C ATOM 0 H ALA A 145 -10.521 1.569 12.340 1.00 35.00 H new ATOM 0 HA ALA A 145 -11.640 3.612 13.851 1.00 2.34 H new ATOM 0 HB1 ALA A 145 -12.562 1.766 15.215 1.00 54.14 H new ATOM 0 HB2 ALA A 145 -12.680 1.423 13.472 1.00 54.14 H new ATOM 0 HB3 ALA A 145 -11.416 0.639 14.450 1.00 54.14 H new