USER MOD reduce.3.24.130724 H: found=0, std=0, add=1261, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1263 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 108 ASN : amide:sc= -0.255 X(o=-0.69,f=-0.57) USER MOD Set 1.2: A 127 THR OG1 : rot 106:sc= -0.432 USER MOD Set 2.1: A 102 ASN : amide:sc= 1.31 K(o=2.3,f=-4.7!) USER MOD Set 2.2: A 126 HIS : no HE2:sc= 1.02 K(o=2.3,f=-8.2!) USER MOD Set 3.1: A 68 THR OG1 : rot -12:sc= 1.94 USER MOD Set 3.2: A 70 THR OG1 : rot -87:sc= -0.95! USER MOD Set 4.1: A 61 MET CE :methyl 166:sc= -0.0901 (180deg=0) USER MOD Set 4.2: A 63 GLN :FLIP amide:sc= -0.942 F(o=-2!,f=-1) USER MOD Set 5.1: A 38 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Set 5.2: A 78 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 19 SER OG : rot -25:sc= 0.201 USER MOD Set 6.2: A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN :FLIP amide:sc= -0.521 F(o=-1.4!,f=-0.52) USER MOD Single : A 15 TYR OH : rot 180:sc= -0.014 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0.406 USER MOD Single : A 20 MET CE :methyl -167:sc= 0 (180deg=-0.135) USER MOD Single : A 28 TYR OH : rot -55:sc= -0.162 USER MOD Single : A 30 LYS NZ :NH3+ 166:sc= 1.43 (180deg=1.13) USER MOD Single : A 31 HIS : no HE2:sc= 0.923 K(o=0.92,f=-5.6!) USER MOD Single : A 34 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0668) USER MOD Single : A 35 THR OG1 : rot -170:sc= -0.535 USER MOD Single : A 36 CYS SG : rot -85:sc= 0.294 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -91:sc= 0.725 USER MOD Single : A 49 ASN : amide:sc= -3.16! C(o=-3.2!,f=-8.1!) USER MOD Single : A 51 THR OG1 : rot -48:sc= 0.476 USER MOD Single : A 52 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00771) USER MOD Single : A 54 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 58 LYS NZ :NH3+ -166:sc= -0.014 (180deg=-0.223) USER MOD Single : A 76 SER OG : rot 29:sc= 1.24 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN :FLIP amide:sc= -1.29! C(o=-4.6!,f=-1.3!) USER MOD Single : A 87 HIS : no HD1:sc=-0.00641 X(o=-0.0064,f=-0.0064) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 130:sc= 0 USER MOD Single : A 100 MET CE :methyl -116:sc= -1.37 (180deg=-2.33!) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -48:sc= 0.798 USER MOD Single : A 111 GLN : amide:sc= 0.537 K(o=0.54,f=-0.34) USER MOD Single : A 115 THR OG1 : rot 16:sc= -0.735 USER MOD Single : A 119 THR OG1 : rot 34:sc= 0.0961 USER MOD Single : A 120 GLN : amide:sc= -0.689 X(o=-0.69,f=-0.2) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 CYS SG : rot 180:sc= -0.194 USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 138 MET CE :methyl -106:sc= -1.3 (180deg=-3.3!) USER MOD Single : A 140 ASN : amide:sc= -0.0114 K(o=-0.011,f=-1.5) USER MOD Single : A 144 MET CE :methyl -159:sc= -0.13 (180deg=-0.76) USER MOD Single : A 161 LYS NZ :NH3+ -156:sc= 1.12 (180deg=0.598) USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot 180:sc= 0 USER MOD Single : A 192 HIS : no HD1:sc= 0.147 K(o=0.15,f=-0.71) USER MOD Single : A 195 GLN : amide:sc= -4.21! C(o=-4.2!,f=-7.2!) USER MOD Single : A 196 TYR OH : rot 180:sc= -0.0397 USER MOD Single : A 200 MET CE :methyl -159:sc= -0.964 (180deg=-2.04) USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 151 N PRO A 11 11.659 -17.817 5.782 1.00 53.05 N ATOM 152 CA PRO A 11 11.497 -18.202 7.188 1.00 21.52 C ATOM 153 C PRO A 11 11.904 -17.095 8.162 1.00 72.15 C ATOM 154 O PRO A 11 12.798 -16.296 7.879 1.00 51.34 O ATOM 155 CB PRO A 11 12.426 -19.408 7.328 1.00 72.42 C ATOM 156 CG PRO A 11 12.469 -20.003 5.966 1.00 14.51 C ATOM 157 CD PRO A 11 12.385 -18.846 5.012 1.00 75.53 C ATOM 0 HA PRO A 11 10.455 -18.411 7.432 1.00 21.52 H new ATOM 0 HB2 PRO A 11 13.419 -19.108 7.662 1.00 72.42 H new ATOM 0 HB3 PRO A 11 12.045 -20.120 8.061 1.00 72.42 H new ATOM 0 HG2 PRO A 11 13.389 -20.568 5.815 1.00 14.51 H new ATOM 0 HG3 PRO A 11 11.641 -20.695 5.815 1.00 14.51 H new ATOM 0 HD2 PRO A 11 13.374 -18.500 4.713 1.00 75.53 H new ATOM 0 HD3 PRO A 11 11.852 -19.115 4.100 1.00 75.53 H new ATOM 165 N PRO A 12 11.253 -17.052 9.333 1.00 61.34 N ATOM 166 CA PRO A 12 11.468 -15.997 10.333 1.00 1.25 C ATOM 167 C PRO A 12 12.828 -16.093 11.032 1.00 63.13 C ATOM 168 O PRO A 12 13.215 -15.197 11.786 1.00 14.15 O ATOM 169 CB PRO A 12 10.331 -16.234 11.329 1.00 60.25 C ATOM 170 CG PRO A 12 10.014 -17.682 11.213 1.00 0.32 C ATOM 171 CD PRO A 12 10.244 -18.035 9.773 1.00 24.03 C ATOM 0 HA PRO A 12 11.470 -15.005 9.881 1.00 1.25 H new ATOM 0 HB2 PRO A 12 10.635 -15.976 12.344 1.00 60.25 H new ATOM 0 HB3 PRO A 12 9.463 -15.619 11.091 1.00 60.25 H new ATOM 0 HG2 PRO A 12 10.651 -18.276 11.868 1.00 0.32 H new ATOM 0 HG3 PRO A 12 8.983 -17.882 11.505 1.00 0.32 H new ATOM 0 HD2 PRO A 12 10.606 -19.057 9.663 1.00 24.03 H new ATOM 0 HD3 PRO A 12 9.327 -17.957 9.189 1.00 24.03 H new ATOM 179 N ASN A 13 13.544 -17.175 10.765 1.00 43.44 N ATOM 180 CA ASN A 13 14.854 -17.419 11.359 1.00 62.23 C ATOM 181 C ASN A 13 15.879 -17.638 10.252 1.00 73.11 C ATOM 182 O ASN A 13 15.543 -18.152 9.188 1.00 64.00 O ATOM 183 CB ASN A 13 14.790 -18.652 12.279 1.00 23.40 C ATOM 184 CG ASN A 13 16.147 -19.071 12.829 1.00 23.31 C ATOM 185 OD1 ASN A 13 16.463 -18.641 14.041 1.00 11.13 O flip ATOM 186 ND2 ASN A 13 16.886 -19.818 12.186 1.00 13.31 N flip ATOM 0 H ASN A 13 13.234 -17.911 10.130 1.00 43.44 H new ATOM 0 HA ASN A 13 15.151 -16.555 11.954 1.00 62.23 H new ATOM 0 HB2 ASN A 13 14.119 -18.440 13.112 1.00 23.40 H new ATOM 0 HB3 ASN A 13 14.358 -19.486 11.726 1.00 23.40 H new ATOM 0 HD21 ASN A 13 16.611 -20.130 11.255 1.00 13.31 H new ATOM 0 HD22 ASN A 13 17.773 -20.125 12.585 1.00 13.31 H new ATOM 193 N VAL A 14 17.115 -17.231 10.489 1.00 20.45 N ATOM 194 CA VAL A 14 18.182 -17.430 9.518 1.00 45.21 C ATOM 195 C VAL A 14 19.384 -18.083 10.189 1.00 54.03 C ATOM 196 O VAL A 14 19.648 -17.851 11.371 1.00 75.02 O ATOM 197 CB VAL A 14 18.622 -16.102 8.846 1.00 44.23 C ATOM 198 CG1 VAL A 14 17.451 -15.432 8.141 1.00 63.44 C ATOM 199 CG2 VAL A 14 19.243 -15.153 9.860 1.00 4.32 C ATOM 0 H VAL A 14 17.406 -16.760 11.346 1.00 20.45 H new ATOM 0 HA VAL A 14 17.789 -18.082 8.738 1.00 45.21 H new ATOM 0 HB VAL A 14 19.378 -16.346 8.100 1.00 44.23 H new ATOM 0 HG11 VAL A 14 17.787 -14.504 7.679 1.00 63.44 H new ATOM 0 HG12 VAL A 14 17.059 -16.099 7.373 1.00 63.44 H new ATOM 0 HG13 VAL A 14 16.667 -15.213 8.866 1.00 63.44 H new ATOM 0 HG21 VAL A 14 19.542 -14.231 9.360 1.00 4.32 H new ATOM 0 HG22 VAL A 14 18.515 -14.924 10.638 1.00 4.32 H new ATOM 0 HG23 VAL A 14 20.118 -15.622 10.309 1.00 4.32 H new ATOM 209 N TYR A 15 20.101 -18.910 9.450 1.00 32.21 N ATOM 210 CA TYR A 15 21.274 -19.565 9.999 1.00 33.20 C ATOM 211 C TYR A 15 22.542 -18.958 9.415 1.00 55.41 C ATOM 212 O TYR A 15 22.674 -18.812 8.198 1.00 4.53 O ATOM 213 CB TYR A 15 21.229 -21.088 9.774 1.00 22.22 C ATOM 214 CG TYR A 15 21.376 -21.542 8.334 1.00 51.35 C ATOM 215 CD1 TYR A 15 22.627 -21.822 7.798 1.00 73.22 C ATOM 216 CD2 TYR A 15 20.265 -21.712 7.522 1.00 74.35 C ATOM 217 CE1 TYR A 15 22.765 -22.249 6.493 1.00 73.44 C ATOM 218 CE2 TYR A 15 20.394 -22.142 6.216 1.00 42.25 C ATOM 219 CZ TYR A 15 21.645 -22.409 5.707 1.00 62.52 C ATOM 220 OH TYR A 15 21.777 -22.840 4.409 1.00 70.40 O ATOM 0 H TYR A 15 19.895 -19.142 8.478 1.00 32.21 H new ATOM 0 HA TYR A 15 21.279 -19.400 11.076 1.00 33.20 H new ATOM 0 HB2 TYR A 15 22.022 -21.548 10.364 1.00 22.22 H new ATOM 0 HB3 TYR A 15 20.283 -21.467 10.161 1.00 22.22 H new ATOM 0 HD1 TYR A 15 23.507 -21.703 8.413 1.00 73.22 H new ATOM 0 HD2 TYR A 15 19.282 -21.505 7.918 1.00 74.35 H new ATOM 0 HE1 TYR A 15 23.745 -22.457 6.090 1.00 73.44 H new ATOM 0 HE2 TYR A 15 19.518 -22.268 5.597 1.00 42.25 H new ATOM 0 HH TYR A 15 20.892 -22.901 3.993 1.00 70.40 H new ATOM 230 N LEU A 16 23.450 -18.569 10.293 1.00 63.02 N ATOM 231 CA LEU A 16 24.731 -18.024 9.878 1.00 63.23 C ATOM 232 C LEU A 16 25.836 -19.038 10.136 1.00 73.31 C ATOM 233 O LEU A 16 26.306 -19.194 11.265 1.00 44.34 O ATOM 234 CB LEU A 16 25.041 -16.726 10.630 1.00 41.22 C ATOM 235 CG LEU A 16 23.936 -15.669 10.616 1.00 52.22 C ATOM 236 CD1 LEU A 16 24.353 -14.468 11.443 1.00 32.10 C ATOM 237 CD2 LEU A 16 23.602 -15.246 9.194 1.00 43.31 C ATOM 0 H LEU A 16 23.323 -18.621 11.304 1.00 63.02 H new ATOM 0 HA LEU A 16 24.678 -17.805 8.811 1.00 63.23 H new ATOM 0 HB2 LEU A 16 25.267 -16.974 11.667 1.00 41.22 H new ATOM 0 HB3 LEU A 16 25.943 -16.287 10.203 1.00 41.22 H new ATOM 0 HG LEU A 16 23.039 -16.106 11.055 1.00 52.22 H new ATOM 0 HD11 LEU A 16 23.559 -13.721 11.426 1.00 32.10 H new ATOM 0 HD12 LEU A 16 24.536 -14.780 12.471 1.00 32.10 H new ATOM 0 HD13 LEU A 16 25.264 -14.038 11.027 1.00 32.10 H new ATOM 0 HD21 LEU A 16 22.813 -14.494 9.214 1.00 43.31 H new ATOM 0 HD22 LEU A 16 24.490 -14.828 8.721 1.00 43.31 H new ATOM 0 HD23 LEU A 16 23.263 -16.113 8.627 1.00 43.31 H new ATOM 249 N GLU A 17 26.229 -19.742 9.095 1.00 54.51 N ATOM 250 CA GLU A 17 27.306 -20.710 9.187 1.00 11.31 C ATOM 251 C GLU A 17 28.624 -19.998 8.938 1.00 43.42 C ATOM 252 O GLU A 17 28.858 -19.481 7.848 1.00 24.44 O ATOM 253 CB GLU A 17 27.097 -21.831 8.168 1.00 73.10 C ATOM 254 CG GLU A 17 28.095 -22.971 8.290 1.00 62.33 C ATOM 255 CD GLU A 17 27.854 -24.062 7.266 1.00 33.34 C ATOM 256 OE1 GLU A 17 26.982 -24.925 7.502 1.00 20.53 O ATOM 257 OE2 GLU A 17 28.527 -24.059 6.217 1.00 53.34 O ATOM 0 H GLU A 17 25.815 -19.662 8.166 1.00 54.51 H new ATOM 0 HA GLU A 17 27.318 -21.158 10.181 1.00 11.31 H new ATOM 0 HB2 GLU A 17 26.089 -22.230 8.284 1.00 73.10 H new ATOM 0 HB3 GLU A 17 27.161 -21.412 7.164 1.00 73.10 H new ATOM 0 HG2 GLU A 17 29.105 -22.580 8.170 1.00 62.33 H new ATOM 0 HG3 GLU A 17 28.035 -23.397 9.292 1.00 62.33 H new ATOM 264 N THR A 18 29.473 -19.953 9.947 1.00 62.03 N ATOM 265 CA THR A 18 30.693 -19.167 9.869 1.00 11.20 C ATOM 266 C THR A 18 31.934 -20.045 9.790 1.00 43.35 C ATOM 267 O THR A 18 31.858 -21.271 9.859 1.00 74.12 O ATOM 268 CB THR A 18 30.829 -18.225 11.079 1.00 14.05 C ATOM 269 OG1 THR A 18 30.878 -18.988 12.296 1.00 73.42 O ATOM 270 CG2 THR A 18 29.667 -17.244 11.139 1.00 2.14 C ATOM 0 H THR A 18 29.343 -20.449 10.829 1.00 62.03 H new ATOM 0 HA THR A 18 30.618 -18.580 8.954 1.00 11.20 H new ATOM 0 HB THR A 18 31.755 -17.661 10.966 1.00 14.05 H new ATOM 0 HG1 THR A 18 30.966 -18.380 13.060 1.00 73.42 H new ATOM 0 HG21 THR A 18 29.787 -16.590 12.003 1.00 2.14 H new ATOM 0 HG22 THR A 18 29.650 -16.644 10.229 1.00 2.14 H new ATOM 0 HG23 THR A 18 28.730 -17.794 11.228 1.00 2.14 H new ATOM 278 N SER A 19 33.081 -19.392 9.654 1.00 42.44 N ATOM 279 CA SER A 19 34.367 -20.074 9.615 1.00 15.14 C ATOM 280 C SER A 19 34.728 -20.611 10.997 1.00 71.12 C ATOM 281 O SER A 19 35.671 -21.385 11.150 1.00 34.23 O ATOM 282 CB SER A 19 35.447 -19.109 9.114 1.00 20.42 C ATOM 283 OG SER A 19 36.700 -19.751 8.961 1.00 13.41 O ATOM 0 H SER A 19 33.146 -18.378 9.568 1.00 42.44 H new ATOM 0 HA SER A 19 34.301 -20.919 8.929 1.00 15.14 H new ATOM 0 HB2 SER A 19 35.138 -18.683 8.159 1.00 20.42 H new ATOM 0 HB3 SER A 19 35.547 -18.280 9.815 1.00 20.42 H new ATOM 0 HG SER A 19 36.744 -20.528 9.556 1.00 13.41 H new ATOM 289 N MET A 20 33.963 -20.199 11.996 1.00 33.03 N ATOM 290 CA MET A 20 34.178 -20.647 13.363 1.00 24.51 C ATOM 291 C MET A 20 33.219 -21.773 13.712 1.00 3.22 C ATOM 292 O MET A 20 33.601 -22.754 14.345 1.00 33.20 O ATOM 293 CB MET A 20 33.983 -19.485 14.332 1.00 65.34 C ATOM 294 CG MET A 20 35.060 -18.425 14.235 1.00 60.53 C ATOM 295 SD MET A 20 36.652 -19.018 14.830 1.00 21.40 S ATOM 296 CE MET A 20 37.205 -17.596 15.765 1.00 14.05 C ATOM 0 H MET A 20 33.183 -19.551 11.884 1.00 33.03 H new ATOM 0 HA MET A 20 35.200 -21.017 13.447 1.00 24.51 H new ATOM 0 HB2 MET A 20 33.014 -19.024 14.142 1.00 65.34 H new ATOM 0 HB3 MET A 20 33.958 -19.873 15.350 1.00 65.34 H new ATOM 0 HG2 MET A 20 35.158 -18.103 13.198 1.00 60.53 H new ATOM 0 HG3 MET A 20 34.760 -17.551 14.813 1.00 60.53 H new ATOM 0 HE1 MET A 20 38.263 -17.707 16.004 1.00 14.05 H new ATOM 0 HE2 MET A 20 37.060 -16.692 15.173 1.00 14.05 H new ATOM 0 HE3 MET A 20 36.630 -17.521 16.688 1.00 14.05 H new ATOM 306 N GLY A 21 31.974 -21.623 13.290 1.00 5.14 N ATOM 307 CA GLY A 21 30.964 -22.620 13.569 1.00 52.51 C ATOM 308 C GLY A 21 29.654 -22.262 12.912 1.00 33.22 C ATOM 309 O GLY A 21 29.616 -21.957 11.726 1.00 0.14 O ATOM 0 H GLY A 21 31.643 -20.821 12.754 1.00 5.14 H new ATOM 0 HA2 GLY A 21 31.300 -23.593 13.211 1.00 52.51 H new ATOM 0 HA3 GLY A 21 30.823 -22.708 14.646 1.00 52.51 H new ATOM 313 N ILE A 22 28.583 -22.274 13.678 1.00 75.44 N ATOM 314 CA ILE A 22 27.294 -21.852 13.174 1.00 71.04 C ATOM 315 C ILE A 22 26.516 -21.131 14.262 1.00 4.24 C ATOM 316 O ILE A 22 26.515 -21.543 15.423 1.00 62.12 O ATOM 317 CB ILE A 22 26.460 -23.028 12.622 1.00 22.41 C ATOM 318 CG1 ILE A 22 25.155 -22.494 12.025 1.00 54.32 C ATOM 319 CG2 ILE A 22 26.178 -24.057 13.710 1.00 62.42 C ATOM 320 CD1 ILE A 22 24.365 -23.523 11.259 1.00 55.21 C ATOM 0 H ILE A 22 28.580 -22.572 14.653 1.00 75.44 H new ATOM 0 HA ILE A 22 27.484 -21.172 12.344 1.00 71.04 H new ATOM 0 HB ILE A 22 27.031 -23.528 11.839 1.00 22.41 H new ATOM 0 HG12 ILE A 22 24.534 -22.099 12.829 1.00 54.32 H new ATOM 0 HG13 ILE A 22 25.385 -21.660 11.362 1.00 54.32 H new ATOM 0 HG21 ILE A 22 25.589 -24.874 13.294 1.00 62.42 H new ATOM 0 HG22 ILE A 22 27.120 -24.448 14.094 1.00 62.42 H new ATOM 0 HG23 ILE A 22 25.623 -23.586 14.521 1.00 62.42 H new ATOM 0 HD11 ILE A 22 23.456 -23.067 10.868 1.00 55.21 H new ATOM 0 HD12 ILE A 22 24.966 -23.901 10.432 1.00 55.21 H new ATOM 0 HD13 ILE A 22 24.101 -24.347 11.922 1.00 55.21 H new ATOM 332 N ILE A 23 25.904 -20.029 13.884 1.00 63.40 N ATOM 333 CA ILE A 23 25.062 -19.260 14.786 1.00 22.42 C ATOM 334 C ILE A 23 23.782 -18.882 14.066 1.00 1.31 C ATOM 335 O ILE A 23 23.827 -18.265 13.008 1.00 74.30 O ATOM 336 CB ILE A 23 25.746 -17.961 15.285 1.00 13.34 C ATOM 337 CG1 ILE A 23 27.026 -18.262 16.074 1.00 50.14 C ATOM 338 CG2 ILE A 23 24.787 -17.147 16.140 1.00 43.21 C ATOM 339 CD1 ILE A 23 28.279 -18.316 15.227 1.00 65.12 C ATOM 0 H ILE A 23 25.974 -19.638 12.944 1.00 63.40 H new ATOM 0 HA ILE A 23 24.864 -19.887 15.655 1.00 22.42 H new ATOM 0 HB ILE A 23 26.022 -17.380 14.405 1.00 13.34 H new ATOM 0 HG12 ILE A 23 27.153 -17.500 16.843 1.00 50.14 H new ATOM 0 HG13 ILE A 23 26.907 -19.216 16.588 1.00 50.14 H new ATOM 0 HG21 ILE A 23 25.285 -16.239 16.481 1.00 43.21 H new ATOM 0 HG22 ILE A 23 23.910 -16.880 15.550 1.00 43.21 H new ATOM 0 HG23 ILE A 23 24.478 -17.737 17.003 1.00 43.21 H new ATOM 0 HD11 ILE A 23 29.138 -18.534 15.862 1.00 65.12 H new ATOM 0 HD12 ILE A 23 28.176 -19.098 14.475 1.00 65.12 H new ATOM 0 HD13 ILE A 23 28.426 -17.355 14.734 1.00 65.12 H new ATOM 351 N VAL A 24 22.642 -19.261 14.609 1.00 70.53 N ATOM 352 CA VAL A 24 21.385 -18.879 13.994 1.00 51.23 C ATOM 353 C VAL A 24 20.752 -17.735 14.765 1.00 21.23 C ATOM 354 O VAL A 24 20.963 -17.586 15.972 1.00 4.01 O ATOM 355 CB VAL A 24 20.378 -20.049 13.881 1.00 63.23 C ATOM 356 CG1 VAL A 24 21.055 -21.299 13.336 1.00 72.52 C ATOM 357 CG2 VAL A 24 19.697 -20.328 15.210 1.00 24.04 C ATOM 0 H VAL A 24 22.558 -19.821 15.457 1.00 70.53 H new ATOM 0 HA VAL A 24 21.623 -18.565 12.978 1.00 51.23 H new ATOM 0 HB VAL A 24 19.603 -19.751 13.175 1.00 63.23 H new ATOM 0 HG11 VAL A 24 20.326 -22.106 13.266 1.00 72.52 H new ATOM 0 HG12 VAL A 24 21.461 -21.091 12.346 1.00 72.52 H new ATOM 0 HG13 VAL A 24 21.863 -21.596 14.005 1.00 72.52 H new ATOM 0 HG21 VAL A 24 18.997 -21.155 15.093 1.00 24.04 H new ATOM 0 HG22 VAL A 24 20.448 -20.590 15.956 1.00 24.04 H new ATOM 0 HG23 VAL A 24 19.157 -19.439 15.536 1.00 24.04 H new ATOM 367 N LEU A 25 19.994 -16.923 14.063 1.00 11.20 N ATOM 368 CA LEU A 25 19.296 -15.821 14.682 1.00 24.13 C ATOM 369 C LEU A 25 17.952 -15.630 14.018 1.00 24.31 C ATOM 370 O LEU A 25 17.721 -16.095 12.903 1.00 51.43 O ATOM 371 CB LEU A 25 20.126 -14.527 14.617 1.00 11.04 C ATOM 372 CG LEU A 25 20.366 -13.935 13.219 1.00 73.42 C ATOM 373 CD1 LEU A 25 19.200 -13.055 12.774 1.00 41.03 C ATOM 374 CD2 LEU A 25 21.657 -13.141 13.207 1.00 64.11 C ATOM 0 H LEU A 25 19.845 -17.007 13.057 1.00 11.20 H new ATOM 0 HA LEU A 25 19.142 -16.057 15.735 1.00 24.13 H new ATOM 0 HB2 LEU A 25 19.629 -13.772 15.226 1.00 11.04 H new ATOM 0 HB3 LEU A 25 21.095 -14.720 15.077 1.00 11.04 H new ATOM 0 HG LEU A 25 20.445 -14.762 12.513 1.00 73.42 H new ATOM 0 HD11 LEU A 25 19.405 -12.654 11.781 1.00 41.03 H new ATOM 0 HD12 LEU A 25 18.287 -13.649 12.744 1.00 41.03 H new ATOM 0 HD13 LEU A 25 19.075 -12.233 13.479 1.00 41.03 H new ATOM 0 HD21 LEU A 25 21.819 -12.725 12.213 1.00 64.11 H new ATOM 0 HD22 LEU A 25 21.593 -12.331 13.933 1.00 64.11 H new ATOM 0 HD23 LEU A 25 22.489 -13.795 13.467 1.00 64.11 H new ATOM 386 N GLU A 26 17.077 -14.947 14.705 1.00 55.42 N ATOM 387 CA GLU A 26 15.764 -14.654 14.183 1.00 41.25 C ATOM 388 C GLU A 26 15.410 -13.225 14.519 1.00 5.23 C ATOM 389 O GLU A 26 16.014 -12.629 15.408 1.00 72.45 O ATOM 390 CB GLU A 26 14.733 -15.627 14.745 1.00 44.34 C ATOM 391 CG GLU A 26 14.810 -15.779 16.250 1.00 25.13 C ATOM 392 CD GLU A 26 14.087 -17.011 16.747 1.00 73.52 C ATOM 393 OE1 GLU A 26 14.528 -18.131 16.421 1.00 13.44 O ATOM 394 OE2 GLU A 26 13.073 -16.864 17.462 1.00 23.45 O ATOM 0 H GLU A 26 17.250 -14.578 15.640 1.00 55.42 H new ATOM 0 HA GLU A 26 15.765 -14.774 13.100 1.00 41.25 H new ATOM 0 HB2 GLU A 26 13.735 -15.285 14.472 1.00 44.34 H new ATOM 0 HB3 GLU A 26 14.874 -16.603 14.281 1.00 44.34 H new ATOM 0 HG2 GLU A 26 15.856 -15.828 16.554 1.00 25.13 H new ATOM 0 HG3 GLU A 26 14.382 -14.895 16.723 1.00 25.13 H new ATOM 401 N LEU A 27 14.447 -12.679 13.814 1.00 33.52 N ATOM 402 CA LEU A 27 14.139 -11.266 13.937 1.00 2.43 C ATOM 403 C LEU A 27 12.963 -11.058 14.875 1.00 72.10 C ATOM 404 O LEU A 27 12.329 -12.015 15.316 1.00 5.34 O ATOM 405 CB LEU A 27 13.815 -10.652 12.566 1.00 64.32 C ATOM 406 CG LEU A 27 14.843 -10.885 11.447 1.00 72.00 C ATOM 407 CD1 LEU A 27 16.265 -10.761 11.973 1.00 13.24 C ATOM 408 CD2 LEU A 27 14.627 -12.238 10.778 1.00 74.34 C ATOM 0 H LEU A 27 13.862 -13.187 13.150 1.00 33.52 H new ATOM 0 HA LEU A 27 15.019 -10.769 14.346 1.00 2.43 H new ATOM 0 HB2 LEU A 27 12.855 -11.047 12.234 1.00 64.32 H new ATOM 0 HB3 LEU A 27 13.690 -9.577 12.695 1.00 64.32 H new ATOM 0 HG LEU A 27 14.696 -10.110 10.695 1.00 72.00 H new ATOM 0 HD11 LEU A 27 16.970 -10.931 11.159 1.00 13.24 H new ATOM 0 HD12 LEU A 27 16.416 -9.762 12.381 1.00 13.24 H new ATOM 0 HD13 LEU A 27 16.429 -11.502 12.756 1.00 13.24 H new ATOM 0 HD21 LEU A 27 15.368 -12.377 9.990 1.00 74.34 H new ATOM 0 HD22 LEU A 27 14.732 -13.031 11.519 1.00 74.34 H new ATOM 0 HD23 LEU A 27 13.627 -12.275 10.346 1.00 74.34 H new ATOM 420 N TYR A 28 12.681 -9.810 15.201 1.00 74.12 N ATOM 421 CA TYR A 28 11.490 -9.497 15.973 1.00 15.33 C ATOM 422 C TYR A 28 10.315 -9.195 15.074 1.00 64.34 C ATOM 423 O TYR A 28 10.136 -8.073 14.611 1.00 64.14 O ATOM 424 CB TYR A 28 11.715 -8.336 16.922 1.00 30.00 C ATOM 425 CG TYR A 28 12.322 -8.772 18.233 1.00 30.31 C ATOM 426 CD1 TYR A 28 13.490 -9.521 18.256 1.00 74.13 C ATOM 427 CD2 TYR A 28 11.721 -8.453 19.442 1.00 73.03 C ATOM 428 CE1 TYR A 28 14.046 -9.938 19.444 1.00 33.44 C ATOM 429 CE2 TYR A 28 12.274 -8.864 20.638 1.00 1.53 C ATOM 430 CZ TYR A 28 13.436 -9.610 20.631 1.00 75.15 C ATOM 431 OH TYR A 28 13.992 -10.023 21.815 1.00 45.24 O ATOM 0 H TYR A 28 13.252 -9.004 14.947 1.00 74.12 H new ATOM 0 HA TYR A 28 11.266 -10.384 16.565 1.00 15.33 H new ATOM 0 HB2 TYR A 28 12.369 -7.604 16.448 1.00 30.00 H new ATOM 0 HB3 TYR A 28 10.765 -7.837 17.113 1.00 30.00 H new ATOM 0 HD1 TYR A 28 13.971 -9.781 17.325 1.00 74.13 H new ATOM 0 HD2 TYR A 28 10.808 -7.875 19.447 1.00 73.03 H new ATOM 0 HE1 TYR A 28 14.956 -10.519 19.443 1.00 33.44 H new ATOM 0 HE2 TYR A 28 11.801 -8.604 21.573 1.00 1.53 H new ATOM 0 HH TYR A 28 14.110 -10.996 21.799 1.00 45.24 H new ATOM 441 N TRP A 29 9.511 -10.208 14.851 1.00 42.34 N ATOM 442 CA TRP A 29 8.346 -10.095 13.994 1.00 22.23 C ATOM 443 C TRP A 29 7.175 -9.497 14.764 1.00 53.50 C ATOM 444 O TRP A 29 6.120 -9.218 14.199 1.00 31.42 O ATOM 445 CB TRP A 29 7.970 -11.478 13.457 1.00 15.22 C ATOM 446 CG TRP A 29 9.144 -12.410 13.388 1.00 24.13 C ATOM 447 CD1 TRP A 29 10.154 -12.391 12.474 1.00 73.33 C ATOM 448 CD2 TRP A 29 9.436 -13.489 14.287 1.00 53.21 C ATOM 449 NE1 TRP A 29 11.055 -13.391 12.745 1.00 13.23 N ATOM 450 CE2 TRP A 29 10.634 -14.081 13.853 1.00 10.34 C ATOM 451 CE3 TRP A 29 8.799 -14.012 15.415 1.00 25.13 C ATOM 452 CZ2 TRP A 29 11.209 -15.168 14.510 1.00 43.43 C ATOM 453 CZ3 TRP A 29 9.367 -15.090 16.064 1.00 11.22 C ATOM 454 CH2 TRP A 29 10.563 -15.658 15.611 1.00 51.42 C ATOM 0 H TRP A 29 9.643 -11.135 15.257 1.00 42.34 H new ATOM 0 HA TRP A 29 8.582 -9.435 13.159 1.00 22.23 H new ATOM 0 HB2 TRP A 29 7.201 -11.915 14.095 1.00 15.22 H new ATOM 0 HB3 TRP A 29 7.536 -11.372 12.463 1.00 15.22 H new ATOM 0 HD1 TRP A 29 10.234 -11.691 11.655 1.00 73.33 H new ATOM 0 HE1 TRP A 29 11.900 -13.589 12.209 1.00 13.23 H new ATOM 0 HE3 TRP A 29 7.877 -13.580 15.774 1.00 25.13 H new ATOM 0 HZ2 TRP A 29 12.132 -15.607 14.162 1.00 43.43 H new ATOM 0 HZ3 TRP A 29 8.880 -15.502 16.936 1.00 11.22 H new ATOM 0 HH2 TRP A 29 10.984 -16.500 16.141 1.00 51.42 H new ATOM 465 N LYS A 30 7.383 -9.297 16.061 1.00 1.22 N ATOM 466 CA LYS A 30 6.346 -8.767 16.933 1.00 2.33 C ATOM 467 C LYS A 30 6.035 -7.314 16.602 1.00 32.34 C ATOM 468 O LYS A 30 4.884 -6.956 16.360 1.00 21.13 O ATOM 469 CB LYS A 30 6.754 -8.871 18.406 1.00 44.11 C ATOM 470 CG LYS A 30 6.621 -10.265 18.994 1.00 63.44 C ATOM 471 CD LYS A 30 7.806 -11.150 18.656 1.00 64.05 C ATOM 472 CE LYS A 30 7.578 -12.568 19.152 1.00 14.12 C ATOM 473 NZ LYS A 30 8.813 -13.391 19.089 1.00 15.31 N ATOM 0 H LYS A 30 8.266 -9.496 16.532 1.00 1.22 H new ATOM 0 HA LYS A 30 5.453 -9.369 16.766 1.00 2.33 H new ATOM 0 HB2 LYS A 30 7.789 -8.543 18.508 1.00 44.11 H new ATOM 0 HB3 LYS A 30 6.142 -8.183 18.990 1.00 44.11 H new ATOM 0 HG2 LYS A 30 6.523 -10.192 20.077 1.00 63.44 H new ATOM 0 HG3 LYS A 30 5.707 -10.728 18.622 1.00 63.44 H new ATOM 0 HD2 LYS A 30 7.964 -11.158 17.578 1.00 64.05 H new ATOM 0 HD3 LYS A 30 8.711 -10.743 19.108 1.00 64.05 H new ATOM 0 HE2 LYS A 30 7.216 -12.538 20.180 1.00 14.12 H new ATOM 0 HE3 LYS A 30 6.799 -13.039 18.553 1.00 14.12 H new ATOM 0 HZ1 LYS A 30 8.681 -14.259 19.646 1.00 15.31 H new ATOM 0 HZ2 LYS A 30 9.013 -13.642 18.100 1.00 15.31 H new ATOM 0 HZ3 LYS A 30 9.611 -12.849 19.477 1.00 15.31 H new ATOM 487 N HIS A 31 7.065 -6.477 16.588 1.00 73.42 N ATOM 488 CA HIS A 31 6.863 -5.046 16.404 1.00 33.41 C ATOM 489 C HIS A 31 7.740 -4.514 15.275 1.00 30.41 C ATOM 490 O HIS A 31 7.793 -3.308 15.033 1.00 21.31 O ATOM 491 CB HIS A 31 7.160 -4.299 17.709 1.00 33.25 C ATOM 492 CG HIS A 31 6.270 -3.113 17.944 1.00 23.24 C ATOM 493 ND1 HIS A 31 6.121 -2.516 19.178 1.00 62.42 N ATOM 494 CD2 HIS A 31 5.463 -2.425 17.100 1.00 14.43 C ATOM 495 CE1 HIS A 31 5.264 -1.519 19.081 1.00 30.54 C ATOM 496 NE2 HIS A 31 4.846 -1.440 17.831 1.00 72.22 N ATOM 0 H HIS A 31 8.038 -6.760 16.701 1.00 73.42 H new ATOM 0 HA HIS A 31 5.821 -4.878 16.131 1.00 33.41 H new ATOM 0 HB2 HIS A 31 7.056 -4.991 18.545 1.00 33.25 H new ATOM 0 HB3 HIS A 31 8.198 -3.966 17.698 1.00 33.25 H new ATOM 0 HD1 HIS A 31 6.599 -2.801 20.033 1.00 62.42 H new ATOM 0 HD2 HIS A 31 5.330 -2.616 16.046 1.00 14.43 H new ATOM 0 HE1 HIS A 31 4.955 -0.874 19.890 1.00 30.54 H new ATOM 505 N ALA A 32 8.435 -5.413 14.592 1.00 10.31 N ATOM 506 CA ALA A 32 9.225 -5.028 13.432 1.00 52.44 C ATOM 507 C ALA A 32 8.887 -5.912 12.230 1.00 21.13 C ATOM 508 O ALA A 32 9.653 -6.804 11.864 1.00 25.14 O ATOM 509 CB ALA A 32 10.709 -5.091 13.755 1.00 33.14 C ATOM 0 H ALA A 32 8.468 -6.407 14.819 1.00 10.31 H new ATOM 0 HA ALA A 32 8.978 -3.999 13.171 1.00 52.44 H new ATOM 0 HB1 ALA A 32 11.285 -4.800 12.877 1.00 33.14 H new ATOM 0 HB2 ALA A 32 10.932 -4.410 14.577 1.00 33.14 H new ATOM 0 HB3 ALA A 32 10.976 -6.108 14.043 1.00 33.14 H new ATOM 515 N PRO A 33 7.716 -5.686 11.610 1.00 20.10 N ATOM 516 CA PRO A 33 7.228 -6.510 10.503 1.00 75.31 C ATOM 517 C PRO A 33 7.938 -6.209 9.186 1.00 23.41 C ATOM 518 O PRO A 33 8.021 -7.065 8.307 1.00 20.42 O ATOM 519 CB PRO A 33 5.737 -6.148 10.396 1.00 61.14 C ATOM 520 CG PRO A 33 5.451 -5.226 11.541 1.00 30.42 C ATOM 521 CD PRO A 33 6.764 -4.619 11.937 1.00 63.02 C ATOM 0 HA PRO A 33 7.410 -7.568 10.690 1.00 75.31 H new ATOM 0 HB2 PRO A 33 5.521 -5.665 9.443 1.00 61.14 H new ATOM 0 HB3 PRO A 33 5.114 -7.041 10.450 1.00 61.14 H new ATOM 0 HG2 PRO A 33 4.739 -4.454 11.249 1.00 30.42 H new ATOM 0 HG3 PRO A 33 5.007 -5.769 12.375 1.00 30.42 H new ATOM 0 HD2 PRO A 33 6.973 -3.704 11.382 1.00 63.02 H new ATOM 0 HD3 PRO A 33 6.790 -4.362 12.996 1.00 63.02 H new ATOM 529 N LYS A 34 8.447 -4.995 9.051 1.00 15.52 N ATOM 530 CA LYS A 34 9.143 -4.596 7.836 1.00 73.23 C ATOM 531 C LYS A 34 10.624 -4.921 7.957 1.00 11.13 C ATOM 532 O LYS A 34 11.242 -5.450 7.029 1.00 31.22 O ATOM 533 CB LYS A 34 8.966 -3.094 7.562 1.00 50.04 C ATOM 534 CG LYS A 34 7.569 -2.680 7.142 1.00 61.54 C ATOM 535 CD LYS A 34 6.591 -2.746 8.299 1.00 72.35 C ATOM 536 CE LYS A 34 5.222 -2.274 7.873 1.00 65.13 C ATOM 537 NZ LYS A 34 5.180 -0.801 7.664 1.00 74.41 N ATOM 0 H LYS A 34 8.392 -4.269 9.766 1.00 15.52 H new ATOM 0 HA LYS A 34 8.712 -5.151 7.002 1.00 73.23 H new ATOM 0 HB2 LYS A 34 9.238 -2.541 8.461 1.00 50.04 H new ATOM 0 HB3 LYS A 34 9.667 -2.797 6.782 1.00 50.04 H new ATOM 0 HG2 LYS A 34 7.594 -1.665 6.745 1.00 61.54 H new ATOM 0 HG3 LYS A 34 7.224 -3.329 6.337 1.00 61.54 H new ATOM 0 HD2 LYS A 34 6.528 -3.769 8.670 1.00 72.35 H new ATOM 0 HD3 LYS A 34 6.953 -2.130 9.122 1.00 72.35 H new ATOM 0 HE2 LYS A 34 4.935 -2.779 6.951 1.00 65.13 H new ATOM 0 HE3 LYS A 34 4.490 -2.554 8.631 1.00 65.13 H new ATOM 0 HZ1 LYS A 34 4.194 -0.496 7.539 1.00 74.41 H new ATOM 0 HZ2 LYS A 34 5.589 -0.321 8.491 1.00 74.41 H new ATOM 0 HZ3 LYS A 34 5.728 -0.555 6.815 1.00 74.41 H new ATOM 551 N THR A 35 11.173 -4.613 9.121 1.00 52.33 N ATOM 552 CA THR A 35 12.589 -4.798 9.393 1.00 23.35 C ATOM 553 C THR A 35 13.006 -6.263 9.245 1.00 5.45 C ATOM 554 O THR A 35 14.054 -6.568 8.672 1.00 10.32 O ATOM 555 CB THR A 35 12.905 -4.318 10.818 1.00 65.10 C ATOM 556 OG1 THR A 35 11.933 -3.342 11.221 1.00 54.44 O ATOM 557 CG2 THR A 35 14.292 -3.705 10.896 1.00 60.40 C ATOM 0 H THR A 35 10.648 -4.227 9.906 1.00 52.33 H new ATOM 0 HA THR A 35 13.150 -4.212 8.665 1.00 23.35 H new ATOM 0 HB THR A 35 12.871 -5.181 11.484 1.00 65.10 H new ATOM 0 HG1 THR A 35 12.220 -2.921 12.058 1.00 54.44 H new ATOM 0 HG21 THR A 35 14.487 -3.375 11.916 1.00 60.40 H new ATOM 0 HG22 THR A 35 15.035 -4.448 10.607 1.00 60.40 H new ATOM 0 HG23 THR A 35 14.351 -2.851 10.221 1.00 60.40 H new ATOM 565 N CYS A 36 12.171 -7.168 9.746 1.00 52.23 N ATOM 566 CA CYS A 36 12.478 -8.593 9.709 1.00 62.20 C ATOM 567 C CYS A 36 12.535 -9.116 8.279 1.00 4.30 C ATOM 568 O CYS A 36 13.323 -10.008 7.970 1.00 72.15 O ATOM 569 CB CYS A 36 11.452 -9.386 10.522 1.00 41.14 C ATOM 570 SG CYS A 36 9.738 -9.150 10.005 1.00 55.44 S ATOM 0 H CYS A 36 11.277 -6.940 10.182 1.00 52.23 H new ATOM 0 HA CYS A 36 13.463 -8.728 10.155 1.00 62.20 H new ATOM 0 HB2 CYS A 36 11.695 -10.446 10.454 1.00 41.14 H new ATOM 0 HB3 CYS A 36 11.543 -9.104 11.571 1.00 41.14 H new ATOM 0 HG CYS A 36 9.254 -8.088 10.578 1.00 55.44 H new ATOM 576 N LYS A 37 11.713 -8.554 7.404 1.00 23.43 N ATOM 577 CA LYS A 37 11.684 -8.995 6.020 1.00 41.50 C ATOM 578 C LYS A 37 12.854 -8.429 5.230 1.00 71.32 C ATOM 579 O LYS A 37 13.350 -9.081 4.317 1.00 33.11 O ATOM 580 CB LYS A 37 10.354 -8.644 5.355 1.00 75.13 C ATOM 581 CG LYS A 37 9.275 -9.696 5.575 1.00 14.05 C ATOM 582 CD LYS A 37 9.718 -11.054 5.041 1.00 31.13 C ATOM 583 CE LYS A 37 9.999 -12.046 6.160 1.00 73.35 C ATOM 584 NZ LYS A 37 8.753 -12.655 6.689 1.00 71.12 N ATOM 0 H LYS A 37 11.064 -7.799 7.626 1.00 23.43 H new ATOM 0 HA LYS A 37 11.781 -10.081 6.022 1.00 41.50 H new ATOM 0 HB2 LYS A 37 10.003 -7.687 5.742 1.00 75.13 H new ATOM 0 HB3 LYS A 37 10.514 -8.515 4.284 1.00 75.13 H new ATOM 0 HG2 LYS A 37 9.051 -9.775 6.639 1.00 14.05 H new ATOM 0 HG3 LYS A 37 8.355 -9.388 5.078 1.00 14.05 H new ATOM 0 HD2 LYS A 37 8.944 -11.456 4.387 1.00 31.13 H new ATOM 0 HD3 LYS A 37 10.615 -10.929 4.434 1.00 31.13 H new ATOM 0 HE2 LYS A 37 10.658 -12.832 5.791 1.00 73.35 H new ATOM 0 HE3 LYS A 37 10.527 -11.541 6.969 1.00 73.35 H new ATOM 0 HZ1 LYS A 37 8.989 -13.324 7.449 1.00 71.12 H new ATOM 0 HZ2 LYS A 37 8.134 -11.908 7.065 1.00 71.12 H new ATOM 0 HZ3 LYS A 37 8.261 -13.160 5.924 1.00 71.12 H new ATOM 598 N ASN A 38 13.315 -7.238 5.594 1.00 13.31 N ATOM 599 CA ASN A 38 14.472 -6.653 4.929 1.00 43.04 C ATOM 600 C ASN A 38 15.702 -7.524 5.170 1.00 45.12 C ATOM 601 O ASN A 38 16.459 -7.821 4.246 1.00 74.23 O ATOM 602 CB ASN A 38 14.716 -5.230 5.433 1.00 41.52 C ATOM 603 CG ASN A 38 15.816 -4.517 4.670 1.00 43.34 C ATOM 604 OD1 ASN A 38 16.032 -4.759 3.482 1.00 61.23 O ATOM 605 ND2 ASN A 38 16.514 -3.628 5.354 1.00 23.23 N ATOM 0 H ASN A 38 12.912 -6.665 6.336 1.00 13.31 H new ATOM 0 HA ASN A 38 14.277 -6.606 3.858 1.00 43.04 H new ATOM 0 HB2 ASN A 38 13.793 -4.657 5.351 1.00 41.52 H new ATOM 0 HB3 ASN A 38 14.977 -5.264 6.491 1.00 41.52 H new ATOM 0 HD21 ASN A 38 17.266 -3.111 4.899 1.00 23.23 H new ATOM 0 HD22 ASN A 38 16.301 -3.459 6.337 1.00 23.23 H new ATOM 612 N PHE A 39 15.872 -7.960 6.416 1.00 30.01 N ATOM 613 CA PHE A 39 16.964 -8.859 6.772 1.00 64.03 C ATOM 614 C PHE A 39 16.794 -10.193 6.046 1.00 30.40 C ATOM 615 O PHE A 39 17.736 -10.720 5.456 1.00 12.22 O ATOM 616 CB PHE A 39 16.984 -9.091 8.289 1.00 52.12 C ATOM 617 CG PHE A 39 18.276 -9.658 8.810 1.00 71.50 C ATOM 618 CD1 PHE A 39 18.553 -11.011 8.697 1.00 45.24 C ATOM 619 CD2 PHE A 39 19.205 -8.837 9.424 1.00 43.14 C ATOM 620 CE1 PHE A 39 19.736 -11.532 9.182 1.00 20.31 C ATOM 621 CE2 PHE A 39 20.392 -9.352 9.911 1.00 35.25 C ATOM 622 CZ PHE A 39 20.657 -10.702 9.791 1.00 50.14 C ATOM 0 H PHE A 39 15.266 -7.704 7.196 1.00 30.01 H new ATOM 0 HA PHE A 39 17.908 -8.404 6.472 1.00 64.03 H new ATOM 0 HB2 PHE A 39 16.787 -8.145 8.792 1.00 52.12 H new ATOM 0 HB3 PHE A 39 16.171 -9.768 8.552 1.00 52.12 H new ATOM 0 HD1 PHE A 39 17.835 -11.665 8.224 1.00 45.24 H new ATOM 0 HD2 PHE A 39 19.001 -7.781 9.524 1.00 43.14 H new ATOM 0 HE1 PHE A 39 19.941 -12.588 9.085 1.00 20.31 H new ATOM 0 HE2 PHE A 39 21.111 -8.700 10.384 1.00 35.25 H new ATOM 0 HZ PHE A 39 21.582 -11.108 10.172 1.00 50.14 H new ATOM 632 N ALA A 40 15.576 -10.724 6.097 1.00 5.03 N ATOM 633 CA ALA A 40 15.250 -11.994 5.447 1.00 51.30 C ATOM 634 C ALA A 40 15.572 -11.976 3.950 1.00 51.43 C ATOM 635 O ALA A 40 16.237 -12.882 3.443 1.00 14.52 O ATOM 636 CB ALA A 40 13.784 -12.335 5.663 1.00 53.41 C ATOM 0 H ALA A 40 14.791 -10.292 6.585 1.00 5.03 H new ATOM 0 HA ALA A 40 15.873 -12.762 5.906 1.00 51.30 H new ATOM 0 HB1 ALA A 40 13.555 -13.282 5.174 1.00 53.41 H new ATOM 0 HB2 ALA A 40 13.584 -12.420 6.731 1.00 53.41 H new ATOM 0 HB3 ALA A 40 13.161 -11.548 5.239 1.00 53.41 H new ATOM 642 N GLU A 41 15.107 -10.948 3.245 1.00 51.54 N ATOM 643 CA GLU A 41 15.326 -10.855 1.805 1.00 3.51 C ATOM 644 C GLU A 41 16.806 -10.628 1.479 1.00 44.00 C ATOM 645 O GLU A 41 17.290 -11.048 0.426 1.00 13.21 O ATOM 646 CB GLU A 41 14.463 -9.751 1.189 1.00 13.42 C ATOM 647 CG GLU A 41 12.961 -10.016 1.276 1.00 20.00 C ATOM 648 CD GLU A 41 12.544 -11.333 0.639 1.00 53.44 C ATOM 649 OE1 GLU A 41 12.604 -11.452 -0.605 1.00 44.05 O ATOM 650 OE2 GLU A 41 12.156 -12.261 1.383 1.00 61.21 O ATOM 0 H GLU A 41 14.579 -10.172 3.645 1.00 51.54 H new ATOM 0 HA GLU A 41 15.028 -11.807 1.366 1.00 3.51 H new ATOM 0 HB2 GLU A 41 14.685 -8.808 1.689 1.00 13.42 H new ATOM 0 HB3 GLU A 41 14.740 -9.629 0.142 1.00 13.42 H new ATOM 0 HG2 GLU A 41 12.659 -10.015 2.323 1.00 20.00 H new ATOM 0 HG3 GLU A 41 12.426 -9.200 0.790 1.00 20.00 H new ATOM 657 N LEU A 42 17.532 -9.978 2.379 1.00 21.10 N ATOM 658 CA LEU A 42 18.973 -9.825 2.216 1.00 3.42 C ATOM 659 C LEU A 42 19.671 -11.170 2.395 1.00 21.25 C ATOM 660 O LEU A 42 20.647 -11.483 1.701 1.00 13.14 O ATOM 661 CB LEU A 42 19.536 -8.810 3.214 1.00 73.40 C ATOM 662 CG LEU A 42 19.916 -7.450 2.623 1.00 0.21 C ATOM 663 CD1 LEU A 42 20.912 -7.629 1.488 1.00 4.13 C ATOM 664 CD2 LEU A 42 18.682 -6.704 2.144 1.00 54.32 C ATOM 0 H LEU A 42 17.151 -9.551 3.223 1.00 21.10 H new ATOM 0 HA LEU A 42 19.159 -9.455 1.208 1.00 3.42 H new ATOM 0 HB2 LEU A 42 18.798 -8.652 4.001 1.00 73.40 H new ATOM 0 HB3 LEU A 42 20.419 -9.241 3.686 1.00 73.40 H new ATOM 0 HG LEU A 42 20.385 -6.853 3.405 1.00 0.21 H new ATOM 0 HD11 LEU A 42 21.174 -6.654 1.077 1.00 4.13 H new ATOM 0 HD12 LEU A 42 21.811 -8.117 1.866 1.00 4.13 H new ATOM 0 HD13 LEU A 42 20.466 -8.245 0.707 1.00 4.13 H new ATOM 0 HD21 LEU A 42 18.978 -5.741 1.728 1.00 54.32 H new ATOM 0 HD22 LEU A 42 18.177 -7.291 1.377 1.00 54.32 H new ATOM 0 HD23 LEU A 42 18.005 -6.545 2.983 1.00 54.32 H new ATOM 676 N ALA A 43 19.159 -11.961 3.329 1.00 44.12 N ATOM 677 CA ALA A 43 19.697 -13.284 3.601 1.00 41.15 C ATOM 678 C ALA A 43 19.507 -14.208 2.404 1.00 12.33 C ATOM 679 O ALA A 43 20.447 -14.873 1.972 1.00 54.01 O ATOM 680 CB ALA A 43 19.047 -13.870 4.846 1.00 3.34 C ATOM 0 H ALA A 43 18.364 -11.704 3.915 1.00 44.12 H new ATOM 0 HA ALA A 43 20.768 -13.189 3.780 1.00 41.15 H new ATOM 0 HB1 ALA A 43 19.458 -14.861 5.039 1.00 3.34 H new ATOM 0 HB2 ALA A 43 19.246 -13.222 5.700 1.00 3.34 H new ATOM 0 HB3 ALA A 43 17.971 -13.948 4.692 1.00 3.34 H new ATOM 686 N ARG A 44 18.296 -14.223 1.856 1.00 2.32 N ATOM 687 CA ARG A 44 17.981 -15.081 0.713 1.00 25.41 C ATOM 688 C ARG A 44 18.722 -14.629 -0.543 1.00 33.24 C ATOM 689 O ARG A 44 19.027 -15.441 -1.415 1.00 73.01 O ATOM 690 CB ARG A 44 16.477 -15.090 0.433 1.00 52.14 C ATOM 691 CG ARG A 44 15.932 -13.727 0.045 1.00 62.25 C ATOM 692 CD ARG A 44 14.550 -13.817 -0.567 1.00 22.14 C ATOM 693 NE ARG A 44 14.560 -14.492 -1.861 1.00 3.40 N ATOM 694 CZ ARG A 44 13.671 -14.256 -2.823 1.00 40.02 C ATOM 695 NH1 ARG A 44 12.740 -13.320 -2.657 1.00 30.21 N ATOM 696 NH2 ARG A 44 13.728 -14.937 -3.965 1.00 61.11 N ATOM 0 H ARG A 44 17.516 -13.653 2.182 1.00 2.32 H new ATOM 0 HA ARG A 44 18.306 -16.089 0.971 1.00 25.41 H new ATOM 0 HB2 ARG A 44 16.267 -15.799 -0.368 1.00 52.14 H new ATOM 0 HB3 ARG A 44 15.951 -15.445 1.319 1.00 52.14 H new ATOM 0 HG2 ARG A 44 15.896 -13.087 0.927 1.00 62.25 H new ATOM 0 HG3 ARG A 44 16.612 -13.254 -0.664 1.00 62.25 H new ATOM 0 HD2 ARG A 44 13.888 -14.352 0.114 1.00 22.14 H new ATOM 0 HD3 ARG A 44 14.142 -12.813 -0.686 1.00 22.14 H new ATOM 0 HE ARG A 44 15.289 -15.183 -2.038 1.00 3.40 H new ATOM 0 HH11 ARG A 44 12.707 -12.782 -1.791 1.00 30.21 H new ATOM 0 HH12 ARG A 44 12.060 -13.141 -3.396 1.00 30.21 H new ATOM 0 HH21 ARG A 44 14.453 -15.641 -4.104 1.00 61.11 H new ATOM 0 HH22 ARG A 44 13.046 -14.755 -4.702 1.00 61.11 H new ATOM 710 N ARG A 45 18.988 -13.328 -0.642 1.00 74.30 N ATOM 711 CA ARG A 45 19.715 -12.790 -1.784 1.00 61.13 C ATOM 712 C ARG A 45 21.152 -13.301 -1.756 1.00 25.32 C ATOM 713 O ARG A 45 21.760 -13.549 -2.797 1.00 12.14 O ATOM 714 CB ARG A 45 19.685 -11.259 -1.769 1.00 43.30 C ATOM 715 CG ARG A 45 19.452 -10.625 -3.139 1.00 53.35 C ATOM 716 CD ARG A 45 20.527 -11.019 -4.142 1.00 20.43 C ATOM 717 NE ARG A 45 20.383 -10.315 -5.416 1.00 31.12 N ATOM 718 CZ ARG A 45 21.325 -10.284 -6.358 1.00 24.12 C ATOM 719 NH1 ARG A 45 22.458 -10.953 -6.191 1.00 20.00 N ATOM 720 NH2 ARG A 45 21.128 -9.592 -7.470 1.00 34.25 N ATOM 0 H ARG A 45 18.712 -12.633 0.051 1.00 74.30 H new ATOM 0 HA ARG A 45 19.235 -13.125 -2.704 1.00 61.13 H new ATOM 0 HB2 ARG A 45 18.899 -10.929 -1.090 1.00 43.30 H new ATOM 0 HB3 ARG A 45 20.629 -10.892 -1.367 1.00 43.30 H new ATOM 0 HG2 ARG A 45 18.476 -10.928 -3.517 1.00 53.35 H new ATOM 0 HG3 ARG A 45 19.432 -9.540 -3.037 1.00 53.35 H new ATOM 0 HD2 ARG A 45 21.509 -10.806 -3.721 1.00 20.43 H new ATOM 0 HD3 ARG A 45 20.481 -12.094 -4.316 1.00 20.43 H new ATOM 0 HE ARG A 45 19.510 -9.818 -5.594 1.00 31.12 H new ATOM 0 HH11 ARG A 45 22.610 -11.493 -5.339 1.00 20.00 H new ATOM 0 HH12 ARG A 45 23.177 -10.927 -6.914 1.00 20.00 H new ATOM 0 HH21 ARG A 45 20.255 -9.082 -7.606 1.00 34.25 H new ATOM 0 HH22 ARG A 45 21.849 -9.569 -8.191 1.00 34.25 H new ATOM 734 N GLY A 46 21.688 -13.446 -0.553 1.00 40.15 N ATOM 735 CA GLY A 46 22.975 -14.083 -0.395 1.00 74.01 C ATOM 736 C GLY A 46 24.085 -13.097 -0.111 1.00 35.14 C ATOM 737 O GLY A 46 25.249 -13.364 -0.399 1.00 52.41 O ATOM 0 H GLY A 46 21.253 -13.133 0.315 1.00 40.15 H new ATOM 0 HA2 GLY A 46 22.920 -14.806 0.419 1.00 74.01 H new ATOM 0 HA3 GLY A 46 23.213 -14.640 -1.301 1.00 74.01 H new ATOM 741 N TYR A 47 23.735 -11.969 0.486 1.00 2.24 N ATOM 742 CA TYR A 47 24.700 -10.912 0.733 1.00 15.42 C ATOM 743 C TYR A 47 25.511 -11.180 1.991 1.00 3.32 C ATOM 744 O TYR A 47 26.674 -10.789 2.079 1.00 33.15 O ATOM 745 CB TYR A 47 23.989 -9.565 0.821 1.00 3.33 C ATOM 746 CG TYR A 47 23.800 -8.905 -0.528 1.00 12.12 C ATOM 747 CD1 TYR A 47 22.870 -9.387 -1.441 1.00 51.11 C ATOM 748 CD2 TYR A 47 24.569 -7.809 -0.894 1.00 13.15 C ATOM 749 CE1 TYR A 47 22.710 -8.791 -2.677 1.00 44.03 C ATOM 750 CE2 TYR A 47 24.416 -7.211 -2.129 1.00 50.41 C ATOM 751 CZ TYR A 47 23.485 -7.705 -3.016 1.00 31.13 C ATOM 752 OH TYR A 47 23.337 -7.117 -4.253 1.00 53.01 O ATOM 0 H TYR A 47 22.789 -11.763 0.808 1.00 2.24 H new ATOM 0 HA TYR A 47 25.399 -10.887 -0.103 1.00 15.42 H new ATOM 0 HB2 TYR A 47 23.015 -9.705 1.290 1.00 3.33 H new ATOM 0 HB3 TYR A 47 24.562 -8.900 1.467 1.00 3.33 H new ATOM 0 HD1 TYR A 47 22.263 -10.241 -1.180 1.00 51.11 H new ATOM 0 HD2 TYR A 47 25.299 -7.417 -0.201 1.00 13.15 H new ATOM 0 HE1 TYR A 47 21.980 -9.175 -3.374 1.00 44.03 H new ATOM 0 HE2 TYR A 47 25.024 -6.360 -2.398 1.00 50.41 H new ATOM 0 HH TYR A 47 23.957 -6.363 -4.333 1.00 53.01 H new ATOM 762 N TYR A 48 24.912 -11.871 2.955 1.00 64.55 N ATOM 763 CA TYR A 48 25.607 -12.186 4.194 1.00 42.23 C ATOM 764 C TYR A 48 26.623 -13.301 3.970 1.00 22.44 C ATOM 765 O TYR A 48 27.547 -13.482 4.758 1.00 30.05 O ATOM 766 CB TYR A 48 24.621 -12.572 5.299 1.00 31.31 C ATOM 767 CG TYR A 48 23.675 -11.457 5.679 1.00 3.13 C ATOM 768 CD1 TYR A 48 24.120 -10.360 6.406 1.00 34.43 C ATOM 769 CD2 TYR A 48 22.340 -11.501 5.310 1.00 34.50 C ATOM 770 CE1 TYR A 48 23.258 -9.337 6.751 1.00 23.32 C ATOM 771 CE2 TYR A 48 21.472 -10.484 5.650 1.00 73.42 C ATOM 772 CZ TYR A 48 21.934 -9.405 6.371 1.00 35.12 C ATOM 773 OH TYR A 48 21.068 -8.393 6.713 1.00 62.42 O ATOM 0 H TYR A 48 23.955 -12.220 2.902 1.00 64.55 H new ATOM 0 HA TYR A 48 26.139 -11.291 4.517 1.00 42.23 H new ATOM 0 HB2 TYR A 48 24.041 -13.435 4.972 1.00 31.31 H new ATOM 0 HB3 TYR A 48 25.180 -12.880 6.182 1.00 31.31 H new ATOM 0 HD1 TYR A 48 25.156 -10.306 6.706 1.00 34.43 H new ATOM 0 HD2 TYR A 48 21.973 -12.346 4.747 1.00 34.50 H new ATOM 0 HE1 TYR A 48 23.619 -8.489 7.315 1.00 23.32 H new ATOM 0 HE2 TYR A 48 20.435 -10.534 5.352 1.00 73.42 H new ATOM 0 HH TYR A 48 20.649 -8.598 7.575 1.00 62.42 H new ATOM 783 N ASN A 49 26.473 -14.018 2.863 1.00 10.41 N ATOM 784 CA ASN A 49 27.403 -15.091 2.513 1.00 64.20 C ATOM 785 C ASN A 49 28.761 -14.514 2.133 1.00 1.23 C ATOM 786 O ASN A 49 29.743 -15.239 1.999 1.00 44.33 O ATOM 787 CB ASN A 49 26.853 -15.938 1.359 1.00 15.54 C ATOM 788 CG ASN A 49 25.640 -16.756 1.764 1.00 55.35 C ATOM 789 OD1 ASN A 49 25.761 -17.896 2.201 1.00 14.22 O ATOM 790 ND2 ASN A 49 24.461 -16.178 1.619 1.00 72.51 N ATOM 0 H ASN A 49 25.718 -13.878 2.191 1.00 10.41 H new ATOM 0 HA ASN A 49 27.521 -15.732 3.386 1.00 64.20 H new ATOM 0 HB2 ASN A 49 26.586 -15.285 0.529 1.00 15.54 H new ATOM 0 HB3 ASN A 49 27.635 -16.607 0.999 1.00 15.54 H new ATOM 0 HD21 ASN A 49 23.611 -16.682 1.874 1.00 72.51 H new ATOM 0 HD22 ASN A 49 24.400 -15.228 1.252 1.00 72.51 H new ATOM 797 N GLY A 50 28.804 -13.201 1.955 1.00 73.11 N ATOM 798 CA GLY A 50 30.050 -12.535 1.651 1.00 2.33 C ATOM 799 C GLY A 50 30.419 -11.510 2.704 1.00 2.32 C ATOM 800 O GLY A 50 31.267 -10.651 2.474 1.00 11.53 O ATOM 0 H GLY A 50 27.993 -12.585 2.016 1.00 73.11 H new ATOM 0 HA2 GLY A 50 30.846 -13.275 1.571 1.00 2.33 H new ATOM 0 HA3 GLY A 50 29.972 -12.045 0.680 1.00 2.33 H new ATOM 804 N THR A 51 29.781 -11.597 3.864 1.00 32.15 N ATOM 805 CA THR A 51 30.043 -10.652 4.938 1.00 1.05 C ATOM 806 C THR A 51 31.036 -11.227 5.941 1.00 21.22 C ATOM 807 O THR A 51 31.233 -12.445 6.012 1.00 44.12 O ATOM 808 CB THR A 51 28.751 -10.230 5.669 1.00 22.51 C ATOM 809 OG1 THR A 51 28.075 -11.368 6.214 1.00 35.24 O ATOM 810 CG2 THR A 51 27.817 -9.480 4.732 1.00 30.01 C ATOM 0 H THR A 51 29.083 -12.308 4.083 1.00 32.15 H new ATOM 0 HA THR A 51 30.474 -9.764 4.475 1.00 1.05 H new ATOM 0 HB THR A 51 29.038 -9.567 6.486 1.00 22.51 H new ATOM 0 HG1 THR A 51 28.012 -12.069 5.532 1.00 35.24 H new ATOM 0 HG21 THR A 51 26.914 -9.194 5.271 1.00 30.01 H new ATOM 0 HG22 THR A 51 28.316 -8.586 4.360 1.00 30.01 H new ATOM 0 HG23 THR A 51 27.550 -10.123 3.893 1.00 30.01 H new ATOM 818 N LYS A 52 31.661 -10.350 6.712 1.00 52.13 N ATOM 819 CA LYS A 52 32.687 -10.753 7.661 1.00 43.22 C ATOM 820 C LYS A 52 32.577 -9.918 8.932 1.00 23.15 C ATOM 821 O LYS A 52 32.045 -8.807 8.908 1.00 44.31 O ATOM 822 CB LYS A 52 34.091 -10.605 7.041 1.00 35.25 C ATOM 823 CG LYS A 52 34.549 -9.163 6.805 1.00 41.10 C ATOM 824 CD LYS A 52 33.708 -8.441 5.758 1.00 12.13 C ATOM 825 CE LYS A 52 33.836 -9.074 4.378 1.00 74.32 C ATOM 826 NZ LYS A 52 35.165 -8.817 3.765 1.00 11.11 N ATOM 0 H LYS A 52 31.473 -9.347 6.698 1.00 52.13 H new ATOM 0 HA LYS A 52 32.535 -11.803 7.913 1.00 43.22 H new ATOM 0 HB2 LYS A 52 34.813 -11.097 7.693 1.00 35.25 H new ATOM 0 HB3 LYS A 52 34.108 -11.136 6.089 1.00 35.25 H new ATOM 0 HG2 LYS A 52 34.502 -8.613 7.745 1.00 41.10 H new ATOM 0 HG3 LYS A 52 35.592 -9.165 6.489 1.00 41.10 H new ATOM 0 HD2 LYS A 52 32.662 -8.452 6.065 1.00 12.13 H new ATOM 0 HD3 LYS A 52 34.014 -7.396 5.706 1.00 12.13 H new ATOM 0 HE2 LYS A 52 33.676 -10.149 4.457 1.00 74.32 H new ATOM 0 HE3 LYS A 52 33.055 -8.682 3.726 1.00 74.32 H new ATOM 0 HZ1 LYS A 52 35.196 -9.237 2.814 1.00 11.11 H new ATOM 0 HZ2 LYS A 52 35.323 -7.791 3.696 1.00 11.11 H new ATOM 0 HZ3 LYS A 52 35.908 -9.243 4.355 1.00 11.11 H new ATOM 840 N PHE A 53 33.069 -10.454 10.035 1.00 61.45 N ATOM 841 CA PHE A 53 33.071 -9.735 11.297 1.00 3.12 C ATOM 842 C PHE A 53 34.292 -8.834 11.362 1.00 12.23 C ATOM 843 O PHE A 53 35.416 -9.288 11.162 1.00 33.44 O ATOM 844 CB PHE A 53 33.056 -10.708 12.478 1.00 4.42 C ATOM 845 CG PHE A 53 31.816 -11.558 12.541 1.00 15.25 C ATOM 846 CD1 PHE A 53 30.624 -11.028 13.002 1.00 50.03 C ATOM 847 CD2 PHE A 53 31.844 -12.884 12.146 1.00 42.23 C ATOM 848 CE1 PHE A 53 29.482 -11.802 13.064 1.00 35.43 C ATOM 849 CE2 PHE A 53 30.707 -13.666 12.207 1.00 23.05 C ATOM 850 CZ PHE A 53 29.523 -13.123 12.669 1.00 14.13 C ATOM 0 H PHE A 53 33.474 -11.389 10.082 1.00 61.45 H new ATOM 0 HA PHE A 53 32.170 -9.124 11.359 1.00 3.12 H new ATOM 0 HB2 PHE A 53 33.929 -11.358 12.414 1.00 4.42 H new ATOM 0 HB3 PHE A 53 33.147 -10.142 13.405 1.00 4.42 H new ATOM 0 HD1 PHE A 53 30.586 -9.996 13.317 1.00 50.03 H new ATOM 0 HD2 PHE A 53 32.767 -13.313 11.785 1.00 42.23 H new ATOM 0 HE1 PHE A 53 28.557 -11.373 13.422 1.00 35.43 H new ATOM 0 HE2 PHE A 53 30.743 -14.699 11.894 1.00 23.05 H new ATOM 0 HZ PHE A 53 28.632 -13.731 12.721 1.00 14.13 H new ATOM 860 N HIS A 54 34.072 -7.554 11.623 1.00 12.21 N ATOM 861 CA HIS A 54 35.162 -6.589 11.591 1.00 42.22 C ATOM 862 C HIS A 54 35.261 -5.799 12.893 1.00 30.43 C ATOM 863 O HIS A 54 36.253 -5.112 13.131 1.00 1.12 O ATOM 864 CB HIS A 54 34.992 -5.638 10.408 1.00 30.22 C ATOM 865 CG HIS A 54 36.216 -5.538 9.548 1.00 21.54 C ATOM 866 ND1 HIS A 54 37.063 -4.453 9.563 1.00 13.43 N ATOM 867 CD2 HIS A 54 36.729 -6.399 8.636 1.00 3.32 C ATOM 868 CE1 HIS A 54 38.041 -4.649 8.697 1.00 30.14 C ATOM 869 NE2 HIS A 54 37.862 -5.822 8.121 1.00 52.45 N ATOM 0 H HIS A 54 33.160 -7.162 11.857 1.00 12.21 H new ATOM 0 HA HIS A 54 36.091 -7.147 11.473 1.00 42.22 H new ATOM 0 HB2 HIS A 54 34.154 -5.974 9.798 1.00 30.22 H new ATOM 0 HB3 HIS A 54 34.737 -4.646 10.781 1.00 30.22 H new ATOM 0 HD2 HIS A 54 36.321 -7.362 8.365 1.00 3.32 H new ATOM 0 HE1 HIS A 54 38.851 -3.964 8.495 1.00 30.14 H new ATOM 0 HE2 HIS A 54 38.467 -6.233 7.410 1.00 52.45 H new ATOM 878 N ARG A 55 34.227 -5.868 13.726 1.00 63.23 N ATOM 879 CA ARG A 55 34.286 -5.246 15.042 1.00 15.10 C ATOM 880 C ARG A 55 34.053 -6.297 16.112 1.00 43.33 C ATOM 881 O ARG A 55 32.918 -6.687 16.362 1.00 2.52 O ATOM 882 CB ARG A 55 33.238 -4.143 15.189 1.00 33.31 C ATOM 883 CG ARG A 55 33.272 -3.097 14.090 1.00 55.13 C ATOM 884 CD ARG A 55 34.462 -2.162 14.232 1.00 11.32 C ATOM 885 NE ARG A 55 34.602 -1.277 13.076 1.00 41.25 N ATOM 886 CZ ARG A 55 33.825 -0.216 12.836 1.00 71.10 C ATOM 887 NH1 ARG A 55 32.830 0.096 13.663 1.00 63.52 N ATOM 888 NH2 ARG A 55 34.052 0.539 11.770 1.00 0.05 N ATOM 0 H ARG A 55 33.349 -6.342 13.516 1.00 63.23 H new ATOM 0 HA ARG A 55 35.274 -4.799 15.157 1.00 15.10 H new ATOM 0 HB2 ARG A 55 32.248 -4.599 15.210 1.00 33.31 H new ATOM 0 HB3 ARG A 55 33.381 -3.648 16.150 1.00 33.31 H new ATOM 0 HG2 ARG A 55 33.313 -3.592 13.120 1.00 55.13 H new ATOM 0 HG3 ARG A 55 32.350 -2.516 14.113 1.00 55.13 H new ATOM 0 HD2 ARG A 55 34.347 -1.563 15.136 1.00 11.32 H new ATOM 0 HD3 ARG A 55 35.373 -2.749 14.352 1.00 11.32 H new ATOM 0 HE ARG A 55 35.344 -1.484 12.407 1.00 41.25 H new ATOM 0 HH11 ARG A 55 32.655 -0.476 14.489 1.00 63.52 H new ATOM 0 HH12 ARG A 55 32.243 0.908 13.471 1.00 63.52 H new ATOM 0 HH21 ARG A 55 34.817 0.309 11.136 1.00 0.05 H new ATOM 0 HH22 ARG A 55 33.461 1.349 11.584 1.00 0.05 H new ATOM 902 N ILE A 56 35.120 -6.753 16.734 1.00 3.25 N ATOM 903 CA ILE A 56 35.029 -7.798 17.736 1.00 24.01 C ATOM 904 C ILE A 56 35.616 -7.284 19.033 1.00 35.33 C ATOM 905 O ILE A 56 36.827 -7.335 19.250 1.00 31.34 O ATOM 906 CB ILE A 56 35.757 -9.110 17.329 1.00 14.13 C ATOM 907 CG1 ILE A 56 35.198 -9.686 16.020 1.00 43.31 C ATOM 908 CG2 ILE A 56 35.639 -10.147 18.440 1.00 11.45 C ATOM 909 CD1 ILE A 56 35.780 -9.066 14.767 1.00 10.41 C ATOM 0 H ILE A 56 36.067 -6.415 16.563 1.00 3.25 H new ATOM 0 HA ILE A 56 33.973 -8.046 17.846 1.00 24.01 H new ATOM 0 HB ILE A 56 36.807 -8.866 17.170 1.00 14.13 H new ATOM 0 HG12 ILE A 56 35.385 -10.760 16.000 1.00 43.31 H new ATOM 0 HG13 ILE A 56 34.117 -9.550 16.010 1.00 43.31 H new ATOM 0 HG21 ILE A 56 36.153 -11.060 18.141 1.00 11.45 H new ATOM 0 HG22 ILE A 56 36.092 -9.757 19.351 1.00 11.45 H new ATOM 0 HG23 ILE A 56 34.587 -10.366 18.623 1.00 11.45 H new ATOM 0 HD11 ILE A 56 35.331 -9.530 13.889 1.00 10.41 H new ATOM 0 HD12 ILE A 56 35.570 -7.996 14.759 1.00 10.41 H new ATOM 0 HD13 ILE A 56 36.858 -9.225 14.750 1.00 10.41 H new ATOM 921 N ILE A 57 34.766 -6.727 19.866 1.00 73.54 N ATOM 922 CA ILE A 57 35.202 -6.229 21.143 1.00 53.40 C ATOM 923 C ILE A 57 34.863 -7.239 22.220 1.00 44.45 C ATOM 924 O ILE A 57 33.697 -7.610 22.379 1.00 51.41 O ATOM 925 CB ILE A 57 34.549 -4.885 21.499 1.00 31.42 C ATOM 926 CG1 ILE A 57 34.634 -3.908 20.326 1.00 12.40 C ATOM 927 CG2 ILE A 57 35.221 -4.299 22.731 1.00 1.24 C ATOM 928 CD1 ILE A 57 33.853 -2.635 20.555 1.00 53.10 C ATOM 0 H ILE A 57 33.770 -6.609 19.679 1.00 73.54 H new ATOM 0 HA ILE A 57 36.279 -6.073 21.081 1.00 53.40 H new ATOM 0 HB ILE A 57 33.494 -5.056 21.715 1.00 31.42 H new ATOM 0 HG12 ILE A 57 35.679 -3.658 20.145 1.00 12.40 H new ATOM 0 HG13 ILE A 57 34.263 -4.398 19.426 1.00 12.40 H new ATOM 0 HG21 ILE A 57 34.755 -3.346 22.981 1.00 1.24 H new ATOM 0 HG22 ILE A 57 35.110 -4.988 23.568 1.00 1.24 H new ATOM 0 HG23 ILE A 57 36.281 -4.143 22.528 1.00 1.24 H new ATOM 0 HD11 ILE A 57 33.954 -1.985 19.686 1.00 53.10 H new ATOM 0 HD12 ILE A 57 32.801 -2.876 20.707 1.00 53.10 H new ATOM 0 HD13 ILE A 57 34.240 -2.125 21.437 1.00 53.10 H new ATOM 940 N LYS A 58 35.888 -7.695 22.927 1.00 23.00 N ATOM 941 CA LYS A 58 35.716 -8.630 24.028 1.00 74.01 C ATOM 942 C LYS A 58 34.636 -8.138 24.992 1.00 12.25 C ATOM 943 O LYS A 58 34.618 -6.963 25.367 1.00 33.43 O ATOM 944 CB LYS A 58 37.045 -8.854 24.770 1.00 1.02 C ATOM 945 CG LYS A 58 37.547 -7.654 25.570 1.00 12.50 C ATOM 946 CD LYS A 58 38.143 -6.562 24.688 1.00 3.02 C ATOM 947 CE LYS A 58 39.450 -7.000 24.048 1.00 70.21 C ATOM 948 NZ LYS A 58 40.523 -7.191 25.058 1.00 4.41 N ATOM 0 H LYS A 58 36.857 -7.428 22.754 1.00 23.00 H new ATOM 0 HA LYS A 58 35.394 -9.585 23.613 1.00 74.01 H new ATOM 0 HB2 LYS A 58 36.928 -9.700 25.447 1.00 1.02 H new ATOM 0 HB3 LYS A 58 37.808 -9.132 24.043 1.00 1.02 H new ATOM 0 HG2 LYS A 58 36.722 -7.238 26.148 1.00 12.50 H new ATOM 0 HG3 LYS A 58 38.299 -7.989 26.284 1.00 12.50 H new ATOM 0 HD2 LYS A 58 37.429 -6.295 23.909 1.00 3.02 H new ATOM 0 HD3 LYS A 58 38.314 -5.666 25.285 1.00 3.02 H new ATOM 0 HE2 LYS A 58 39.294 -7.931 23.503 1.00 70.21 H new ATOM 0 HE3 LYS A 58 39.766 -6.254 23.319 1.00 70.21 H new ATOM 0 HZ1 LYS A 58 41.444 -7.255 24.579 1.00 4.41 H new ATOM 0 HZ2 LYS A 58 40.530 -6.384 25.714 1.00 4.41 H new ATOM 0 HZ3 LYS A 58 40.348 -8.068 25.589 1.00 4.41 H new ATOM 962 N ASP A 59 33.724 -9.052 25.341 1.00 50.12 N ATOM 963 CA ASP A 59 32.596 -8.784 26.251 1.00 13.33 C ATOM 964 C ASP A 59 31.899 -7.454 25.939 1.00 33.22 C ATOM 965 O ASP A 59 31.466 -6.737 26.838 1.00 24.41 O ATOM 966 CB ASP A 59 33.023 -8.868 27.739 1.00 52.12 C ATOM 967 CG ASP A 59 34.090 -7.866 28.163 1.00 72.44 C ATOM 968 OD1 ASP A 59 35.295 -8.185 28.046 1.00 43.32 O ATOM 969 OD2 ASP A 59 33.732 -6.773 28.653 1.00 2.50 O ATOM 0 H ASP A 59 33.745 -10.012 24.997 1.00 50.12 H new ATOM 0 HA ASP A 59 31.864 -9.572 26.077 1.00 13.33 H new ATOM 0 HB2 ASP A 59 32.141 -8.722 28.363 1.00 52.12 H new ATOM 0 HB3 ASP A 59 33.392 -9.874 27.939 1.00 52.12 H new ATOM 974 N PHE A 60 31.741 -7.159 24.651 1.00 53.31 N ATOM 975 CA PHE A 60 31.089 -5.928 24.229 1.00 52.30 C ATOM 976 C PHE A 60 30.089 -6.212 23.117 1.00 53.54 C ATOM 977 O PHE A 60 28.892 -6.354 23.362 1.00 24.25 O ATOM 978 CB PHE A 60 32.117 -4.916 23.732 1.00 0.23 C ATOM 979 CG PHE A 60 31.753 -3.485 24.011 1.00 0.22 C ATOM 980 CD1 PHE A 60 32.150 -2.876 25.190 1.00 45.33 C ATOM 981 CD2 PHE A 60 31.019 -2.748 23.095 1.00 64.34 C ATOM 982 CE1 PHE A 60 31.826 -1.559 25.449 1.00 2.44 C ATOM 983 CE2 PHE A 60 30.691 -1.429 23.350 1.00 12.10 C ATOM 984 CZ PHE A 60 31.094 -0.835 24.529 1.00 43.33 C ATOM 0 H PHE A 60 32.055 -7.755 23.886 1.00 53.31 H new ATOM 0 HA PHE A 60 30.566 -5.513 25.091 1.00 52.30 H new ATOM 0 HB2 PHE A 60 33.079 -5.133 24.197 1.00 0.23 H new ATOM 0 HB3 PHE A 60 32.247 -5.044 22.657 1.00 0.23 H new ATOM 0 HD1 PHE A 60 32.720 -3.438 25.915 1.00 45.33 H new ATOM 0 HD2 PHE A 60 30.700 -3.209 22.172 1.00 64.34 H new ATOM 0 HE1 PHE A 60 32.145 -1.095 26.371 1.00 2.44 H new ATOM 0 HE2 PHE A 60 30.120 -0.864 22.628 1.00 12.10 H new ATOM 0 HZ PHE A 60 30.837 0.194 24.732 1.00 43.33 H new ATOM 994 N MET A 61 30.593 -6.310 21.892 1.00 71.02 N ATOM 995 CA MET A 61 29.747 -6.548 20.731 1.00 71.43 C ATOM 996 C MET A 61 30.573 -7.070 19.561 1.00 60.53 C ATOM 997 O MET A 61 31.780 -6.826 19.486 1.00 3.41 O ATOM 998 CB MET A 61 28.999 -5.269 20.327 1.00 14.05 C ATOM 999 CG MET A 61 29.907 -4.116 19.928 1.00 42.12 C ATOM 1000 SD MET A 61 28.986 -2.635 19.475 1.00 34.22 S ATOM 1001 CE MET A 61 30.323 -1.526 19.041 1.00 31.41 C ATOM 0 H MET A 61 31.587 -6.228 21.678 1.00 71.02 H new ATOM 0 HA MET A 61 29.011 -7.305 21.001 1.00 71.43 H new ATOM 0 HB2 MET A 61 28.334 -5.498 19.494 1.00 14.05 H new ATOM 0 HB3 MET A 61 28.370 -4.951 21.159 1.00 14.05 H new ATOM 0 HG2 MET A 61 30.578 -3.884 20.755 1.00 42.12 H new ATOM 0 HG3 MET A 61 30.530 -4.423 19.088 1.00 42.12 H new ATOM 0 HE1 MET A 61 29.922 -0.664 18.508 1.00 31.41 H new ATOM 0 HE2 MET A 61 30.826 -1.191 19.948 1.00 31.41 H new ATOM 0 HE3 MET A 61 31.036 -2.048 18.402 1.00 31.41 H new ATOM 1011 N ILE A 62 29.914 -7.790 18.661 1.00 11.13 N ATOM 1012 CA ILE A 62 30.560 -8.365 17.491 1.00 14.22 C ATOM 1013 C ILE A 62 29.837 -7.920 16.226 1.00 2.04 C ATOM 1014 O ILE A 62 28.764 -8.429 15.901 1.00 30.03 O ATOM 1015 CB ILE A 62 30.569 -9.905 17.536 1.00 63.54 C ATOM 1016 CG1 ILE A 62 31.083 -10.400 18.882 1.00 40.32 C ATOM 1017 CG2 ILE A 62 31.435 -10.457 16.412 1.00 71.44 C ATOM 1018 CD1 ILE A 62 30.920 -11.890 19.066 1.00 5.34 C ATOM 0 H ILE A 62 28.916 -7.991 18.723 1.00 11.13 H new ATOM 0 HA ILE A 62 31.591 -8.012 17.488 1.00 14.22 H new ATOM 0 HB ILE A 62 29.547 -10.259 17.404 1.00 63.54 H new ATOM 0 HG12 ILE A 62 32.137 -10.141 18.979 1.00 40.32 H new ATOM 0 HG13 ILE A 62 30.552 -9.881 19.680 1.00 40.32 H new ATOM 0 HG21 ILE A 62 31.434 -11.546 16.453 1.00 71.44 H new ATOM 0 HG22 ILE A 62 31.037 -10.130 15.452 1.00 71.44 H new ATOM 0 HG23 ILE A 62 32.455 -10.090 16.525 1.00 71.44 H new ATOM 0 HD11 ILE A 62 31.305 -12.180 20.044 1.00 5.34 H new ATOM 0 HD12 ILE A 62 29.864 -12.151 18.999 1.00 5.34 H new ATOM 0 HD13 ILE A 62 31.474 -12.415 18.288 1.00 5.34 H new ATOM 1030 N GLN A 63 30.412 -6.951 15.542 1.00 31.55 N ATOM 1031 CA GLN A 63 29.838 -6.436 14.306 1.00 13.41 C ATOM 1032 C GLN A 63 30.278 -7.258 13.110 1.00 13.41 C ATOM 1033 O GLN A 63 31.476 -7.397 12.842 1.00 14.13 O ATOM 1034 CB GLN A 63 30.243 -4.984 14.074 1.00 71.45 C ATOM 1035 CG GLN A 63 29.616 -4.007 15.050 1.00 33.34 C ATOM 1036 CD GLN A 63 29.823 -2.552 14.658 1.00 10.13 C ATOM 1037 OE1 GLN A 63 29.817 -2.269 13.362 1.00 21.54 O flip ATOM 1038 NE2 GLN A 63 29.959 -1.683 15.514 1.00 35.12 N flip ATOM 0 H GLN A 63 31.283 -6.499 15.821 1.00 31.55 H new ATOM 0 HA GLN A 63 28.755 -6.500 14.411 1.00 13.41 H new ATOM 0 HB2 GLN A 63 31.328 -4.904 14.142 1.00 71.45 H new ATOM 0 HB3 GLN A 63 29.966 -4.697 13.060 1.00 71.45 H new ATOM 0 HG2 GLN A 63 28.547 -4.209 15.120 1.00 33.34 H new ATOM 0 HG3 GLN A 63 30.038 -4.173 16.041 1.00 33.34 H new ATOM 0 HE21 GLN A 63 29.959 -1.936 16.502 1.00 35.12 H new ATOM 0 HE22 GLN A 63 30.072 -0.708 15.237 1.00 35.12 H new ATOM 1047 N GLY A 64 29.302 -7.778 12.391 1.00 65.51 N ATOM 1048 CA GLY A 64 29.579 -8.531 11.189 1.00 3.35 C ATOM 1049 C GLY A 64 28.753 -8.057 10.019 1.00 1.14 C ATOM 1050 O GLY A 64 27.565 -7.772 10.163 1.00 12.05 O ATOM 0 H GLY A 64 28.312 -7.692 12.620 1.00 65.51 H new ATOM 0 HA2 GLY A 64 30.637 -8.445 10.944 1.00 3.35 H new ATOM 0 HA3 GLY A 64 29.379 -9.587 11.369 1.00 3.35 H new ATOM 1054 N GLY A 65 29.377 -7.955 8.862 1.00 73.12 N ATOM 1055 CA GLY A 65 28.657 -7.534 7.686 1.00 40.43 C ATOM 1056 C GLY A 65 29.559 -6.960 6.617 1.00 1.20 C ATOM 1057 O GLY A 65 30.746 -7.278 6.565 1.00 34.32 O ATOM 0 H GLY A 65 30.366 -8.155 8.716 1.00 73.12 H new ATOM 0 HA2 GLY A 65 28.112 -8.384 7.276 1.00 40.43 H new ATOM 0 HA3 GLY A 65 27.916 -6.786 7.968 1.00 40.43 H new ATOM 1061 N ASP A 66 28.967 -6.123 5.768 1.00 72.14 N ATOM 1062 CA ASP A 66 29.649 -5.467 4.657 1.00 42.01 C ATOM 1063 C ASP A 66 30.314 -6.469 3.714 1.00 34.52 C ATOM 1064 O ASP A 66 31.476 -6.840 3.886 1.00 34.12 O ATOM 1065 CB ASP A 66 30.668 -4.437 5.143 1.00 51.32 C ATOM 1066 CG ASP A 66 31.125 -3.533 4.016 1.00 45.53 C ATOM 1067 OD1 ASP A 66 30.742 -3.785 2.851 1.00 71.22 O ATOM 1068 OD2 ASP A 66 31.858 -2.569 4.274 1.00 73.23 O ATOM 0 H ASP A 66 27.979 -5.877 5.835 1.00 72.14 H new ATOM 0 HA ASP A 66 28.877 -4.942 4.094 1.00 42.01 H new ATOM 0 HB2 ASP A 66 30.228 -3.835 5.938 1.00 51.32 H new ATOM 0 HB3 ASP A 66 31.529 -4.950 5.571 1.00 51.32 H new ATOM 1073 N PRO A 67 29.562 -6.916 2.699 1.00 12.33 N ATOM 1074 CA PRO A 67 30.086 -7.781 1.637 1.00 40.33 C ATOM 1075 C PRO A 67 31.058 -7.042 0.720 1.00 23.31 C ATOM 1076 O PRO A 67 31.842 -7.659 -0.003 1.00 33.54 O ATOM 1077 CB PRO A 67 28.829 -8.177 0.851 1.00 24.52 C ATOM 1078 CG PRO A 67 27.848 -7.094 1.125 1.00 65.01 C ATOM 1079 CD PRO A 67 28.128 -6.631 2.523 1.00 73.54 C ATOM 0 HA PRO A 67 30.645 -8.626 2.039 1.00 40.33 H new ATOM 0 HB2 PRO A 67 29.039 -8.259 -0.215 1.00 24.52 H new ATOM 0 HB3 PRO A 67 28.449 -9.146 1.176 1.00 24.52 H new ATOM 0 HG2 PRO A 67 27.960 -6.276 0.413 1.00 65.01 H new ATOM 0 HG3 PRO A 67 26.826 -7.460 1.032 1.00 65.01 H new ATOM 0 HD2 PRO A 67 27.912 -5.570 2.645 1.00 73.54 H new ATOM 0 HD3 PRO A 67 27.520 -7.166 3.252 1.00 73.54 H new ATOM 1087 N THR A 68 31.010 -5.717 0.768 1.00 43.01 N ATOM 1088 CA THR A 68 31.744 -4.895 -0.181 1.00 71.41 C ATOM 1089 C THR A 68 33.075 -4.404 0.387 1.00 1.33 C ATOM 1090 O THR A 68 34.081 -4.369 -0.320 1.00 21.14 O ATOM 1091 CB THR A 68 30.904 -3.678 -0.628 1.00 43.53 C ATOM 1092 OG1 THR A 68 30.536 -2.870 0.500 1.00 74.32 O ATOM 1093 CG2 THR A 68 29.641 -4.117 -1.348 1.00 34.15 C ATOM 0 H THR A 68 30.470 -5.190 1.454 1.00 43.01 H new ATOM 0 HA THR A 68 31.952 -5.532 -1.041 1.00 71.41 H new ATOM 0 HB THR A 68 31.522 -3.094 -1.310 1.00 43.53 H new ATOM 0 HG1 THR A 68 30.722 -3.360 1.328 1.00 74.32 H new ATOM 0 HG21 THR A 68 29.071 -3.239 -1.650 1.00 34.15 H new ATOM 0 HG22 THR A 68 29.909 -4.698 -2.231 1.00 34.15 H new ATOM 0 HG23 THR A 68 29.036 -4.730 -0.680 1.00 34.15 H new ATOM 1101 N GLY A 69 33.081 -4.034 1.663 1.00 12.55 N ATOM 1102 CA GLY A 69 34.265 -3.435 2.253 1.00 72.31 C ATOM 1103 C GLY A 69 34.284 -1.931 2.062 1.00 34.21 C ATOM 1104 O GLY A 69 35.344 -1.302 2.056 1.00 14.30 O ATOM 0 H GLY A 69 32.290 -4.138 2.298 1.00 12.55 H new ATOM 0 HA2 GLY A 69 34.299 -3.668 3.317 1.00 72.31 H new ATOM 0 HA3 GLY A 69 35.157 -3.871 1.803 1.00 72.31 H new ATOM 1108 N THR A 70 33.100 -1.362 1.900 1.00 0.05 N ATOM 1109 CA THR A 70 32.949 0.067 1.657 1.00 62.02 C ATOM 1110 C THR A 70 32.542 0.793 2.926 1.00 25.35 C ATOM 1111 O THR A 70 32.636 2.018 3.028 1.00 15.21 O ATOM 1112 CB THR A 70 31.883 0.312 0.585 1.00 44.41 C ATOM 1113 OG1 THR A 70 30.645 -0.292 0.989 1.00 62.31 O ATOM 1114 CG2 THR A 70 32.322 -0.288 -0.730 1.00 2.11 C ATOM 0 H THR A 70 32.218 -1.874 1.933 1.00 0.05 H new ATOM 0 HA THR A 70 33.912 0.450 1.318 1.00 62.02 H new ATOM 0 HB THR A 70 31.746 1.387 0.463 1.00 44.41 H new ATOM 0 HG1 THR A 70 30.626 -1.227 0.695 1.00 62.31 H new ATOM 0 HG21 THR A 70 31.557 -0.108 -1.485 1.00 2.11 H new ATOM 0 HG22 THR A 70 33.258 0.172 -1.045 1.00 2.11 H new ATOM 0 HG23 THR A 70 32.468 -1.361 -0.610 1.00 2.11 H new ATOM 1122 N GLY A 71 32.069 0.023 3.881 1.00 51.30 N ATOM 1123 CA GLY A 71 31.615 0.581 5.133 1.00 75.42 C ATOM 1124 C GLY A 71 30.106 0.592 5.238 1.00 11.41 C ATOM 1125 O GLY A 71 29.553 0.723 6.328 1.00 31.53 O ATOM 0 H GLY A 71 31.989 -0.992 3.813 1.00 51.30 H new ATOM 0 HA2 GLY A 71 32.031 0.004 5.959 1.00 75.42 H new ATOM 0 HA3 GLY A 71 31.992 1.599 5.234 1.00 75.42 H new ATOM 1129 N ARG A 72 29.435 0.461 4.101 1.00 65.43 N ATOM 1130 CA ARG A 72 27.982 0.418 4.074 1.00 30.03 C ATOM 1131 C ARG A 72 27.487 -0.999 3.794 1.00 11.42 C ATOM 1132 O ARG A 72 26.462 -1.433 4.323 1.00 34.25 O ATOM 1133 CB ARG A 72 27.460 1.381 3.010 1.00 13.02 C ATOM 1134 CG ARG A 72 28.397 1.513 1.825 1.00 43.23 C ATOM 1135 CD ARG A 72 27.666 1.951 0.579 1.00 51.10 C ATOM 1136 NE ARG A 72 27.066 3.275 0.714 1.00 14.42 N ATOM 1137 CZ ARG A 72 26.448 3.914 -0.278 1.00 55.32 C ATOM 1138 NH1 ARG A 72 26.417 3.390 -1.499 1.00 43.23 N ATOM 1139 NH2 ARG A 72 25.887 5.091 -0.061 1.00 61.04 N ATOM 0 H ARG A 72 29.876 0.383 3.185 1.00 65.43 H new ATOM 0 HA ARG A 72 27.604 0.722 5.050 1.00 30.03 H new ATOM 0 HB2 ARG A 72 26.487 1.036 2.661 1.00 13.02 H new ATOM 0 HB3 ARG A 72 27.308 2.363 3.458 1.00 13.02 H new ATOM 0 HG2 ARG A 72 29.180 2.234 2.059 1.00 43.23 H new ATOM 0 HG3 ARG A 72 28.888 0.557 1.641 1.00 43.23 H new ATOM 0 HD2 ARG A 72 28.360 1.955 -0.262 1.00 51.10 H new ATOM 0 HD3 ARG A 72 26.887 1.225 0.346 1.00 51.10 H new ATOM 0 HE ARG A 72 27.123 3.738 1.621 1.00 14.42 H new ATOM 0 HH11 ARG A 72 26.868 2.493 -1.681 1.00 43.23 H new ATOM 0 HH12 ARG A 72 25.942 3.884 -2.254 1.00 43.23 H new ATOM 0 HH21 ARG A 72 25.927 5.512 0.867 1.00 61.04 H new ATOM 0 HH22 ARG A 72 25.414 5.579 -0.822 1.00 61.04 H new ATOM 1153 N GLY A 73 28.241 -1.730 2.985 1.00 23.33 N ATOM 1154 CA GLY A 73 27.829 -3.061 2.594 1.00 2.11 C ATOM 1155 C GLY A 73 26.944 -3.052 1.367 1.00 3.23 C ATOM 1156 O GLY A 73 26.964 -2.098 0.590 1.00 61.21 O ATOM 0 H GLY A 73 29.131 -1.424 2.593 1.00 23.33 H new ATOM 0 HA2 GLY A 73 28.712 -3.669 2.398 1.00 2.11 H new ATOM 0 HA3 GLY A 73 27.296 -3.531 3.420 1.00 2.11 H new ATOM 1160 N GLY A 74 26.183 -4.122 1.186 1.00 73.01 N ATOM 1161 CA GLY A 74 25.255 -4.199 0.078 1.00 70.01 C ATOM 1162 C GLY A 74 23.913 -3.588 0.434 1.00 72.15 C ATOM 1163 O GLY A 74 23.823 -2.385 0.671 1.00 51.23 O ATOM 0 H GLY A 74 26.193 -4.943 1.792 1.00 73.01 H new ATOM 0 HA2 GLY A 74 25.674 -3.682 -0.785 1.00 70.01 H new ATOM 0 HA3 GLY A 74 25.117 -5.241 -0.210 1.00 70.01 H new ATOM 1167 N ALA A 75 22.877 -4.428 0.485 1.00 61.01 N ATOM 1168 CA ALA A 75 21.533 -4.006 0.902 1.00 12.45 C ATOM 1169 C ALA A 75 20.991 -2.871 0.036 1.00 11.21 C ATOM 1170 O ALA A 75 20.319 -1.968 0.525 1.00 55.40 O ATOM 1171 CB ALA A 75 21.534 -3.598 2.369 1.00 4.42 C ATOM 0 H ALA A 75 22.943 -5.416 0.240 1.00 61.01 H new ATOM 0 HA ALA A 75 20.871 -4.861 0.769 1.00 12.45 H new ATOM 0 HB1 ALA A 75 20.531 -3.288 2.661 1.00 4.42 H new ATOM 0 HB2 ALA A 75 21.845 -4.444 2.982 1.00 4.42 H new ATOM 0 HB3 ALA A 75 22.227 -2.769 2.516 1.00 4.42 H new ATOM 1177 N SER A 76 21.251 -2.941 -1.257 1.00 41.15 N ATOM 1178 CA SER A 76 20.789 -1.919 -2.175 1.00 45.15 C ATOM 1179 C SER A 76 19.677 -2.488 -3.058 1.00 20.03 C ATOM 1180 O SER A 76 19.384 -1.968 -4.134 1.00 25.05 O ATOM 1181 CB SER A 76 21.964 -1.413 -3.024 1.00 4.22 C ATOM 1182 OG SER A 76 21.627 -0.231 -3.735 1.00 54.24 O ATOM 0 H SER A 76 21.780 -3.696 -1.694 1.00 41.15 H new ATOM 0 HA SER A 76 20.386 -1.075 -1.614 1.00 45.15 H new ATOM 0 HB2 SER A 76 22.821 -1.218 -2.380 1.00 4.22 H new ATOM 0 HB3 SER A 76 22.264 -2.188 -3.729 1.00 4.22 H new ATOM 0 HG SER A 76 20.947 0.268 -3.236 1.00 54.24 H new ATOM 1188 N ILE A 77 19.039 -3.555 -2.580 1.00 24.25 N ATOM 1189 CA ILE A 77 17.983 -4.218 -3.342 1.00 73.32 C ATOM 1190 C ILE A 77 16.715 -3.367 -3.377 1.00 11.42 C ATOM 1191 O ILE A 77 15.874 -3.522 -4.261 1.00 32.14 O ATOM 1192 CB ILE A 77 17.644 -5.614 -2.769 1.00 11.45 C ATOM 1193 CG1 ILE A 77 17.109 -5.503 -1.340 1.00 15.40 C ATOM 1194 CG2 ILE A 77 18.871 -6.515 -2.803 1.00 1.23 C ATOM 1195 CD1 ILE A 77 16.608 -6.814 -0.776 1.00 20.40 C ATOM 0 H ILE A 77 19.234 -3.977 -1.672 1.00 24.25 H new ATOM 0 HA ILE A 77 18.364 -4.344 -4.355 1.00 73.32 H new ATOM 0 HB ILE A 77 16.866 -6.056 -3.392 1.00 11.45 H new ATOM 0 HG12 ILE A 77 17.898 -5.118 -0.695 1.00 15.40 H new ATOM 0 HG13 ILE A 77 16.298 -4.775 -1.320 1.00 15.40 H new ATOM 0 HG21 ILE A 77 18.615 -7.493 -2.396 1.00 1.23 H new ATOM 0 HG22 ILE A 77 19.211 -6.628 -3.832 1.00 1.23 H new ATOM 0 HG23 ILE A 77 19.666 -6.070 -2.205 1.00 1.23 H new ATOM 0 HD11 ILE A 77 16.244 -6.658 0.240 1.00 20.40 H new ATOM 0 HD12 ILE A 77 15.796 -7.191 -1.398 1.00 20.40 H new ATOM 0 HD13 ILE A 77 17.422 -7.539 -0.762 1.00 20.40 H new ATOM 1207 N TYR A 78 16.591 -2.466 -2.411 1.00 42.22 N ATOM 1208 CA TYR A 78 15.438 -1.575 -2.332 1.00 42.31 C ATOM 1209 C TYR A 78 15.823 -0.154 -2.735 1.00 42.34 C ATOM 1210 O TYR A 78 15.023 0.781 -2.645 1.00 45.42 O ATOM 1211 CB TYR A 78 14.830 -1.598 -0.925 1.00 45.15 C ATOM 1212 CG TYR A 78 15.820 -1.462 0.214 1.00 4.55 C ATOM 1213 CD1 TYR A 78 16.636 -2.524 0.583 1.00 53.02 C ATOM 1214 CD2 TYR A 78 15.921 -0.282 0.932 1.00 2.31 C ATOM 1215 CE1 TYR A 78 17.524 -2.412 1.632 1.00 63.14 C ATOM 1216 CE2 TYR A 78 16.805 -0.164 1.987 1.00 4.54 C ATOM 1217 CZ TYR A 78 17.605 -1.229 2.331 1.00 2.02 C ATOM 1218 OH TYR A 78 18.487 -1.111 3.378 1.00 70.31 O ATOM 0 H TYR A 78 17.277 -2.332 -1.668 1.00 42.22 H new ATOM 0 HA TYR A 78 14.683 -1.932 -3.033 1.00 42.31 H new ATOM 0 HB2 TYR A 78 14.102 -0.790 -0.849 1.00 45.15 H new ATOM 0 HB3 TYR A 78 14.284 -2.533 -0.799 1.00 45.15 H new ATOM 0 HD1 TYR A 78 16.574 -3.454 0.038 1.00 53.02 H new ATOM 0 HD2 TYR A 78 15.299 0.559 0.663 1.00 2.31 H new ATOM 0 HE1 TYR A 78 18.152 -3.248 1.904 1.00 63.14 H new ATOM 0 HE2 TYR A 78 16.868 0.762 2.540 1.00 4.54 H new ATOM 0 HH TYR A 78 18.419 -0.212 3.763 1.00 70.31 H new ATOM 1228 N GLY A 79 17.059 -0.009 -3.180 1.00 22.23 N ATOM 1229 CA GLY A 79 17.553 1.278 -3.635 1.00 42.03 C ATOM 1230 C GLY A 79 18.590 1.845 -2.692 1.00 4.30 C ATOM 1231 O GLY A 79 19.659 1.257 -2.508 1.00 25.14 O ATOM 0 H GLY A 79 17.739 -0.767 -3.236 1.00 22.23 H new ATOM 0 HA2 GLY A 79 17.986 1.171 -4.630 1.00 42.03 H new ATOM 0 HA3 GLY A 79 16.721 1.977 -3.723 1.00 42.03 H new ATOM 1235 N LYS A 80 18.279 2.991 -2.105 1.00 51.34 N ATOM 1236 CA LYS A 80 19.115 3.566 -1.061 1.00 62.01 C ATOM 1237 C LYS A 80 18.663 3.014 0.284 1.00 73.31 C ATOM 1238 O LYS A 80 17.985 1.993 0.332 1.00 31.23 O ATOM 1239 CB LYS A 80 19.031 5.103 -1.061 1.00 11.42 C ATOM 1240 CG LYS A 80 17.644 5.659 -0.758 1.00 21.50 C ATOM 1241 CD LYS A 80 16.883 6.016 -2.022 1.00 54.14 C ATOM 1242 CE LYS A 80 17.531 7.184 -2.750 1.00 31.01 C ATOM 1243 NZ LYS A 80 16.778 7.558 -3.974 1.00 52.52 N ATOM 0 H LYS A 80 17.452 3.542 -2.334 1.00 51.34 H new ATOM 0 HA LYS A 80 20.154 3.295 -1.248 1.00 62.01 H new ATOM 0 HB2 LYS A 80 19.734 5.493 -0.325 1.00 11.42 H new ATOM 0 HB3 LYS A 80 19.352 5.472 -2.035 1.00 11.42 H new ATOM 0 HG2 LYS A 80 17.076 4.924 -0.189 1.00 21.50 H new ATOM 0 HG3 LYS A 80 17.738 6.545 -0.130 1.00 21.50 H new ATOM 0 HD2 LYS A 80 16.845 5.150 -2.682 1.00 54.14 H new ATOM 0 HD3 LYS A 80 15.853 6.269 -1.769 1.00 54.14 H new ATOM 0 HE2 LYS A 80 17.587 8.043 -2.081 1.00 31.01 H new ATOM 0 HE3 LYS A 80 18.554 6.922 -3.019 1.00 31.01 H new ATOM 0 HZ1 LYS A 80 17.251 8.357 -4.442 1.00 52.52 H new ATOM 0 HZ2 LYS A 80 16.746 6.746 -4.623 1.00 52.52 H new ATOM 0 HZ3 LYS A 80 15.809 7.833 -3.715 1.00 52.52 H new ATOM 1257 N GLN A 81 19.038 3.679 1.366 1.00 64.15 N ATOM 1258 CA GLN A 81 18.577 3.290 2.689 1.00 44.24 C ATOM 1259 C GLN A 81 17.063 3.442 2.782 1.00 71.13 C ATOM 1260 O GLN A 81 16.453 4.191 2.017 1.00 31.54 O ATOM 1261 CB GLN A 81 19.263 4.110 3.790 1.00 23.43 C ATOM 1262 CG GLN A 81 19.040 5.616 3.696 1.00 43.42 C ATOM 1263 CD GLN A 81 19.782 6.277 2.545 1.00 24.12 C ATOM 1264 OE1 GLN A 81 20.920 5.714 2.157 1.00 11.44 O flip ATOM 1265 NE2 GLN A 81 19.331 7.283 1.999 1.00 13.04 N flip ATOM 0 H GLN A 81 19.659 4.488 1.354 1.00 64.15 H new ATOM 0 HA GLN A 81 18.843 2.244 2.842 1.00 44.24 H new ATOM 0 HB2 GLN A 81 18.904 3.763 4.759 1.00 23.43 H new ATOM 0 HB3 GLN A 81 20.334 3.912 3.757 1.00 23.43 H new ATOM 0 HG2 GLN A 81 17.973 5.809 3.587 1.00 43.42 H new ATOM 0 HG3 GLN A 81 19.354 6.079 4.632 1.00 43.42 H new ATOM 0 HE21 GLN A 81 18.453 7.689 2.323 1.00 13.04 H new ATOM 0 HE22 GLN A 81 19.835 7.711 1.222 1.00 13.04 H new ATOM 1274 N PHE A 82 16.469 2.749 3.732 1.00 42.33 N ATOM 1275 CA PHE A 82 15.018 2.645 3.801 1.00 74.31 C ATOM 1276 C PHE A 82 14.435 3.683 4.749 1.00 50.22 C ATOM 1277 O PHE A 82 13.747 4.613 4.323 1.00 63.44 O ATOM 1278 CB PHE A 82 14.610 1.233 4.246 1.00 12.52 C ATOM 1279 CG PHE A 82 13.121 1.016 4.315 1.00 52.04 C ATOM 1280 CD1 PHE A 82 12.359 0.961 3.159 1.00 10.12 C ATOM 1281 CD2 PHE A 82 12.486 0.865 5.539 1.00 43.43 C ATOM 1282 CE1 PHE A 82 10.992 0.760 3.222 1.00 32.11 C ATOM 1283 CE2 PHE A 82 11.121 0.664 5.608 1.00 25.12 C ATOM 1284 CZ PHE A 82 10.373 0.612 4.449 1.00 51.41 C ATOM 0 H PHE A 82 16.965 2.248 4.469 1.00 42.33 H new ATOM 0 HA PHE A 82 14.618 2.836 2.805 1.00 74.31 H new ATOM 0 HB2 PHE A 82 15.040 0.508 3.556 1.00 12.52 H new ATOM 0 HB3 PHE A 82 15.041 1.034 5.227 1.00 12.52 H new ATOM 0 HD1 PHE A 82 12.838 1.076 2.198 1.00 10.12 H new ATOM 0 HD2 PHE A 82 13.066 0.905 6.449 1.00 43.43 H new ATOM 0 HE1 PHE A 82 10.409 0.719 2.314 1.00 32.11 H new ATOM 0 HE2 PHE A 82 10.640 0.548 6.568 1.00 25.12 H new ATOM 0 HZ PHE A 82 9.306 0.456 4.501 1.00 51.41 H new ATOM 1294 N GLU A 83 14.723 3.516 6.029 1.00 60.22 N ATOM 1295 CA GLU A 83 14.151 4.352 7.066 1.00 71.55 C ATOM 1296 C GLU A 83 14.864 4.070 8.378 1.00 53.52 C ATOM 1297 O GLU A 83 15.400 2.976 8.569 1.00 70.14 O ATOM 1298 CB GLU A 83 12.656 4.035 7.208 1.00 22.15 C ATOM 1299 CG GLU A 83 11.907 4.944 8.164 1.00 23.44 C ATOM 1300 CD GLU A 83 11.783 6.354 7.640 1.00 11.34 C ATOM 1301 OE1 GLU A 83 10.845 6.625 6.860 1.00 13.43 O ATOM 1302 OE2 GLU A 83 12.611 7.203 8.008 1.00 15.34 O ATOM 0 H GLU A 83 15.359 2.798 6.376 1.00 60.22 H new ATOM 0 HA GLU A 83 14.271 5.403 6.805 1.00 71.55 H new ATOM 0 HB2 GLU A 83 12.189 4.099 6.225 1.00 22.15 H new ATOM 0 HB3 GLU A 83 12.547 3.005 7.546 1.00 22.15 H new ATOM 0 HG2 GLU A 83 10.912 4.537 8.343 1.00 23.44 H new ATOM 0 HG3 GLU A 83 12.422 4.960 9.124 1.00 23.44 H new ATOM 1309 N ASP A 84 14.904 5.053 9.263 1.00 33.31 N ATOM 1310 CA ASP A 84 15.388 4.825 10.610 1.00 44.31 C ATOM 1311 C ASP A 84 14.305 4.135 11.421 1.00 21.54 C ATOM 1312 O ASP A 84 13.306 4.739 11.802 1.00 15.15 O ATOM 1313 CB ASP A 84 15.838 6.132 11.286 1.00 63.20 C ATOM 1314 CG ASP A 84 14.817 7.249 11.200 1.00 73.35 C ATOM 1315 OD1 ASP A 84 14.690 7.856 10.120 1.00 73.21 O ATOM 1316 OD2 ASP A 84 14.147 7.538 12.214 1.00 71.11 O ATOM 0 H ASP A 84 14.608 6.010 9.072 1.00 33.31 H new ATOM 0 HA ASP A 84 16.267 4.182 10.559 1.00 44.31 H new ATOM 0 HB2 ASP A 84 16.055 5.931 12.335 1.00 63.20 H new ATOM 0 HB3 ASP A 84 16.768 6.466 10.826 1.00 63.20 H new ATOM 1321 N GLU A 85 14.495 2.850 11.658 1.00 64.13 N ATOM 1322 CA GLU A 85 13.514 2.055 12.377 1.00 41.14 C ATOM 1323 C GLU A 85 13.969 1.860 13.808 1.00 4.51 C ATOM 1324 O GLU A 85 13.538 0.934 14.491 1.00 41.42 O ATOM 1325 CB GLU A 85 13.309 0.702 11.692 1.00 44.21 C ATOM 1326 CG GLU A 85 12.652 0.803 10.324 1.00 43.01 C ATOM 1327 CD GLU A 85 12.309 -0.554 9.742 1.00 13.34 C ATOM 1328 OE1 GLU A 85 13.172 -1.153 9.070 1.00 60.23 O ATOM 1329 OE2 GLU A 85 11.176 -1.033 9.965 1.00 64.14 O ATOM 0 H GLU A 85 15.323 2.332 11.362 1.00 64.13 H new ATOM 0 HA GLU A 85 12.560 2.583 12.374 1.00 41.14 H new ATOM 0 HB2 GLU A 85 14.275 0.208 11.586 1.00 44.21 H new ATOM 0 HB3 GLU A 85 12.696 0.069 12.334 1.00 44.21 H new ATOM 0 HG2 GLU A 85 11.744 1.400 10.404 1.00 43.01 H new ATOM 0 HG3 GLU A 85 13.320 1.329 9.642 1.00 43.01 H new ATOM 1336 N LEU A 86 14.840 2.760 14.248 1.00 61.22 N ATOM 1337 CA LEU A 86 15.395 2.718 15.591 1.00 65.44 C ATOM 1338 C LEU A 86 14.282 2.736 16.633 1.00 1.02 C ATOM 1339 O LEU A 86 13.758 3.799 16.972 1.00 20.44 O ATOM 1340 CB LEU A 86 16.298 3.928 15.824 1.00 34.34 C ATOM 1341 CG LEU A 86 17.383 4.159 14.772 1.00 3.12 C ATOM 1342 CD1 LEU A 86 17.971 5.552 14.913 1.00 1.04 C ATOM 1343 CD2 LEU A 86 18.476 3.116 14.897 1.00 42.13 C ATOM 0 H LEU A 86 15.180 3.538 13.683 1.00 61.22 H new ATOM 0 HA LEU A 86 15.971 1.797 15.688 1.00 65.44 H new ATOM 0 HB2 LEU A 86 15.673 4.820 15.876 1.00 34.34 H new ATOM 0 HB3 LEU A 86 16.778 3.818 16.796 1.00 34.34 H new ATOM 0 HG LEU A 86 16.928 4.070 13.786 1.00 3.12 H new ATOM 0 HD11 LEU A 86 18.742 5.700 14.157 1.00 1.04 H new ATOM 0 HD12 LEU A 86 17.184 6.294 14.779 1.00 1.04 H new ATOM 0 HD13 LEU A 86 18.410 5.663 15.905 1.00 1.04 H new ATOM 0 HD21 LEU A 86 19.239 3.296 14.140 1.00 42.13 H new ATOM 0 HD22 LEU A 86 18.926 3.177 15.888 1.00 42.13 H new ATOM 0 HD23 LEU A 86 18.050 2.123 14.753 1.00 42.13 H new ATOM 1355 N HIS A 87 13.918 1.565 17.121 1.00 70.53 N ATOM 1356 CA HIS A 87 12.854 1.435 18.095 1.00 42.21 C ATOM 1357 C HIS A 87 12.856 0.030 18.677 1.00 53.23 C ATOM 1358 O HIS A 87 12.119 -0.845 18.224 1.00 3.25 O ATOM 1359 CB HIS A 87 11.493 1.747 17.462 1.00 74.14 C ATOM 1360 CG HIS A 87 10.337 1.622 18.410 1.00 50.40 C ATOM 1361 ND1 HIS A 87 9.326 0.704 18.244 1.00 1.24 N ATOM 1362 CD2 HIS A 87 10.044 2.299 19.544 1.00 42.34 C ATOM 1363 CE1 HIS A 87 8.459 0.823 19.230 1.00 23.43 C ATOM 1364 NE2 HIS A 87 8.871 1.783 20.036 1.00 72.23 N ATOM 0 H HIS A 87 14.351 0.681 16.854 1.00 70.53 H new ATOM 0 HA HIS A 87 13.027 2.154 18.896 1.00 42.21 H new ATOM 0 HB2 HIS A 87 11.514 2.761 17.062 1.00 74.14 H new ATOM 0 HB3 HIS A 87 11.333 1.075 16.619 1.00 74.14 H new ATOM 0 HD2 HIS A 87 10.625 3.097 19.981 1.00 42.34 H new ATOM 0 HE1 HIS A 87 7.563 0.234 19.357 1.00 23.43 H new ATOM 0 HE2 HIS A 87 8.396 2.091 20.885 1.00 72.23 H new ATOM 1373 N PRO A 88 13.721 -0.215 19.662 1.00 42.34 N ATOM 1374 CA PRO A 88 13.768 -1.495 20.356 1.00 43.30 C ATOM 1375 C PRO A 88 12.521 -1.725 21.201 1.00 34.32 C ATOM 1376 O PRO A 88 12.318 -1.066 22.221 1.00 73.24 O ATOM 1377 CB PRO A 88 15.006 -1.376 21.248 1.00 34.04 C ATOM 1378 CG PRO A 88 15.170 0.089 21.457 1.00 52.22 C ATOM 1379 CD PRO A 88 14.732 0.727 20.172 1.00 35.14 C ATOM 0 HA PRO A 88 13.812 -2.337 19.665 1.00 43.30 H new ATOM 0 HB2 PRO A 88 14.866 -1.899 22.194 1.00 34.04 H new ATOM 0 HB3 PRO A 88 15.884 -1.810 20.770 1.00 34.04 H new ATOM 0 HG2 PRO A 88 14.565 0.436 22.294 1.00 52.22 H new ATOM 0 HG3 PRO A 88 16.206 0.339 21.687 1.00 52.22 H new ATOM 0 HD2 PRO A 88 14.312 1.719 20.337 1.00 35.14 H new ATOM 0 HD3 PRO A 88 15.562 0.844 19.476 1.00 35.14 H new ATOM 1387 N ASP A 89 11.660 -2.621 20.738 1.00 11.02 N ATOM 1388 CA ASP A 89 10.532 -3.076 21.546 1.00 3.22 C ATOM 1389 C ASP A 89 11.078 -3.917 22.692 1.00 10.40 C ATOM 1390 O ASP A 89 10.508 -3.989 23.785 1.00 41.03 O ATOM 1391 CB ASP A 89 9.555 -3.894 20.691 1.00 32.11 C ATOM 1392 CG ASP A 89 8.239 -4.171 21.395 1.00 23.42 C ATOM 1393 OD1 ASP A 89 7.360 -3.284 21.373 1.00 74.51 O ATOM 1394 OD2 ASP A 89 8.068 -5.278 21.946 1.00 42.23 O ATOM 0 H ASP A 89 11.718 -3.046 19.813 1.00 11.02 H new ATOM 0 HA ASP A 89 9.985 -2.220 21.942 1.00 3.22 H new ATOM 0 HB2 ASP A 89 9.358 -3.359 19.762 1.00 32.11 H new ATOM 0 HB3 ASP A 89 10.022 -4.841 20.421 1.00 32.11 H new ATOM 1399 N LEU A 90 12.221 -4.524 22.414 1.00 63.24 N ATOM 1400 CA LEU A 90 12.980 -5.274 23.391 1.00 51.02 C ATOM 1401 C LEU A 90 13.860 -4.320 24.186 1.00 15.51 C ATOM 1402 O LEU A 90 13.878 -3.120 23.922 1.00 5.00 O ATOM 1403 CB LEU A 90 13.849 -6.309 22.662 1.00 24.33 C ATOM 1404 CG LEU A 90 14.907 -5.724 21.711 1.00 3.04 C ATOM 1405 CD1 LEU A 90 16.249 -5.563 22.411 1.00 45.32 C ATOM 1406 CD2 LEU A 90 15.052 -6.588 20.468 1.00 73.24 C ATOM 0 H LEU A 90 12.650 -4.507 21.489 1.00 63.24 H new ATOM 0 HA LEU A 90 12.305 -5.788 24.075 1.00 51.02 H new ATOM 0 HB2 LEU A 90 14.354 -6.925 23.407 1.00 24.33 H new ATOM 0 HB3 LEU A 90 13.197 -6.970 22.091 1.00 24.33 H new ATOM 0 HG LEU A 90 14.567 -4.735 21.405 1.00 3.04 H new ATOM 0 HD11 LEU A 90 16.976 -5.148 21.713 1.00 45.32 H new ATOM 0 HD12 LEU A 90 16.137 -4.891 23.262 1.00 45.32 H new ATOM 0 HD13 LEU A 90 16.596 -6.535 22.760 1.00 45.32 H new ATOM 0 HD21 LEU A 90 15.805 -6.155 19.810 1.00 73.24 H new ATOM 0 HD22 LEU A 90 15.357 -7.593 20.757 1.00 73.24 H new ATOM 0 HD23 LEU A 90 14.097 -6.635 19.944 1.00 73.24 H new ATOM 1418 N LYS A 91 14.598 -4.848 25.145 1.00 15.44 N ATOM 1419 CA LYS A 91 15.581 -4.044 25.848 1.00 23.40 C ATOM 1420 C LYS A 91 16.831 -4.869 26.114 1.00 43.03 C ATOM 1421 O LYS A 91 16.819 -6.091 25.955 1.00 10.43 O ATOM 1422 CB LYS A 91 15.025 -3.491 27.162 1.00 4.41 C ATOM 1423 CG LYS A 91 15.268 -4.375 28.364 1.00 45.33 C ATOM 1424 CD LYS A 91 15.268 -3.548 29.629 1.00 65.03 C ATOM 1425 CE LYS A 91 15.673 -4.376 30.829 1.00 63.20 C ATOM 1426 NZ LYS A 91 15.724 -3.565 32.072 1.00 60.13 N ATOM 0 H LYS A 91 14.537 -5.819 25.453 1.00 15.44 H new ATOM 0 HA LYS A 91 15.834 -3.195 25.213 1.00 23.40 H new ATOM 0 HB2 LYS A 91 15.471 -2.514 27.349 1.00 4.41 H new ATOM 0 HB3 LYS A 91 13.952 -3.336 27.052 1.00 4.41 H new ATOM 0 HG2 LYS A 91 14.496 -5.142 28.422 1.00 45.33 H new ATOM 0 HG3 LYS A 91 16.222 -4.891 28.258 1.00 45.33 H new ATOM 0 HD2 LYS A 91 15.953 -2.708 29.516 1.00 65.03 H new ATOM 0 HD3 LYS A 91 14.275 -3.129 29.792 1.00 65.03 H new ATOM 0 HE2 LYS A 91 14.966 -5.195 30.959 1.00 63.20 H new ATOM 0 HE3 LYS A 91 16.650 -4.824 30.648 1.00 63.20 H new ATOM 0 HZ1 LYS A 91 16.005 -4.170 32.870 1.00 60.13 H new ATOM 0 HZ2 LYS A 91 16.417 -2.798 31.958 1.00 60.13 H new ATOM 0 HZ3 LYS A 91 14.785 -3.158 32.260 1.00 60.13 H new ATOM 1440 N PHE A 92 17.905 -4.200 26.510 1.00 24.23 N ATOM 1441 CA PHE A 92 19.122 -4.887 26.903 1.00 35.45 C ATOM 1442 C PHE A 92 18.853 -5.741 28.139 1.00 45.51 C ATOM 1443 O PHE A 92 18.373 -5.249 29.162 1.00 5.32 O ATOM 1444 CB PHE A 92 20.254 -3.884 27.169 1.00 4.42 C ATOM 1445 CG PHE A 92 19.961 -2.900 28.271 1.00 32.20 C ATOM 1446 CD1 PHE A 92 19.113 -1.824 28.056 1.00 4.42 C ATOM 1447 CD2 PHE A 92 20.530 -3.059 29.524 1.00 12.31 C ATOM 1448 CE1 PHE A 92 18.839 -0.927 29.070 1.00 51.34 C ATOM 1449 CE2 PHE A 92 20.258 -2.166 30.543 1.00 51.44 C ATOM 1450 CZ PHE A 92 19.412 -1.098 30.315 1.00 61.35 C ATOM 0 H PHE A 92 17.956 -3.183 26.567 1.00 24.23 H new ATOM 0 HA PHE A 92 19.440 -5.536 26.087 1.00 35.45 H new ATOM 0 HB2 PHE A 92 21.160 -4.435 27.420 1.00 4.42 H new ATOM 0 HB3 PHE A 92 20.460 -3.334 26.251 1.00 4.42 H new ATOM 0 HD1 PHE A 92 18.662 -1.686 27.085 1.00 4.42 H new ATOM 0 HD2 PHE A 92 21.194 -3.891 29.707 1.00 12.31 H new ATOM 0 HE1 PHE A 92 18.177 -0.093 28.889 1.00 51.34 H new ATOM 0 HE2 PHE A 92 20.706 -2.303 31.516 1.00 51.44 H new ATOM 0 HZ PHE A 92 19.199 -0.398 31.109 1.00 61.35 H new ATOM 1460 N THR A 93 19.123 -7.024 28.028 1.00 1.30 N ATOM 1461 CA THR A 93 18.868 -7.948 29.116 1.00 54.51 C ATOM 1462 C THR A 93 20.147 -8.672 29.514 1.00 5.11 C ATOM 1463 O THR A 93 20.420 -8.880 30.698 1.00 32.44 O ATOM 1464 CB THR A 93 17.788 -8.964 28.711 1.00 74.53 C ATOM 1465 OG1 THR A 93 18.148 -9.589 27.470 1.00 14.43 O ATOM 1466 CG2 THR A 93 16.434 -8.277 28.566 1.00 22.31 C ATOM 0 H THR A 93 19.521 -7.454 27.193 1.00 1.30 H new ATOM 0 HA THR A 93 18.511 -7.379 29.974 1.00 54.51 H new ATOM 0 HB THR A 93 17.714 -9.722 29.491 1.00 74.53 H new ATOM 0 HG1 THR A 93 18.078 -10.562 27.561 1.00 14.43 H new ATOM 0 HG21 THR A 93 15.682 -9.012 28.279 1.00 22.31 H new ATOM 0 HG22 THR A 93 16.153 -7.822 29.516 1.00 22.31 H new ATOM 0 HG23 THR A 93 16.498 -7.505 27.799 1.00 22.31 H new ATOM 1474 N GLY A 94 20.920 -9.051 28.511 1.00 15.05 N ATOM 1475 CA GLY A 94 22.212 -9.654 28.744 1.00 22.21 C ATOM 1476 C GLY A 94 22.988 -9.807 27.457 1.00 51.45 C ATOM 1477 O GLY A 94 22.851 -8.993 26.547 1.00 13.42 O ATOM 0 H GLY A 94 20.671 -8.950 27.527 1.00 15.05 H new ATOM 0 HA2 GLY A 94 22.781 -9.041 29.443 1.00 22.21 H new ATOM 0 HA3 GLY A 94 22.081 -10.631 29.210 1.00 22.21 H new ATOM 1481 N ALA A 95 23.803 -10.844 27.379 1.00 13.33 N ATOM 1482 CA ALA A 95 24.546 -11.134 26.165 1.00 24.32 C ATOM 1483 C ALA A 95 23.709 -11.970 25.208 1.00 24.44 C ATOM 1484 O ALA A 95 23.039 -12.918 25.621 1.00 54.23 O ATOM 1485 CB ALA A 95 25.839 -11.854 26.496 1.00 25.30 C ATOM 0 H ALA A 95 23.967 -11.500 28.143 1.00 13.33 H new ATOM 0 HA ALA A 95 24.786 -10.189 25.678 1.00 24.32 H new ATOM 0 HB1 ALA A 95 26.384 -12.064 25.576 1.00 25.30 H new ATOM 0 HB2 ALA A 95 26.450 -11.226 27.144 1.00 25.30 H new ATOM 0 HB3 ALA A 95 25.614 -12.790 27.006 1.00 25.30 H new ATOM 1491 N GLY A 96 23.752 -11.616 23.934 1.00 52.23 N ATOM 1492 CA GLY A 96 23.004 -12.349 22.934 1.00 61.12 C ATOM 1493 C GLY A 96 21.952 -11.493 22.266 1.00 34.25 C ATOM 1494 O GLY A 96 21.000 -12.012 21.671 1.00 44.33 O ATOM 0 H GLY A 96 24.294 -10.831 23.573 1.00 52.23 H new ATOM 0 HA2 GLY A 96 23.690 -12.734 22.179 1.00 61.12 H new ATOM 0 HA3 GLY A 96 22.526 -13.211 23.400 1.00 61.12 H new ATOM 1498 N ILE A 97 22.120 -10.181 22.354 1.00 0.35 N ATOM 1499 CA ILE A 97 21.164 -9.265 21.754 1.00 51.41 C ATOM 1500 C ILE A 97 21.538 -9.027 20.300 1.00 22.52 C ATOM 1501 O ILE A 97 22.579 -8.434 20.012 1.00 41.23 O ATOM 1502 CB ILE A 97 21.117 -7.910 22.491 1.00 0.43 C ATOM 1503 CG1 ILE A 97 21.187 -8.108 24.010 1.00 32.51 C ATOM 1504 CG2 ILE A 97 19.858 -7.147 22.114 1.00 42.23 C ATOM 1505 CD1 ILE A 97 20.074 -8.957 24.580 1.00 31.20 C ATOM 0 H ILE A 97 22.902 -9.731 22.831 1.00 0.35 H new ATOM 0 HA ILE A 97 20.177 -9.722 21.829 1.00 51.41 H new ATOM 0 HB ILE A 97 21.986 -7.327 22.185 1.00 0.43 H new ATOM 0 HG12 ILE A 97 22.143 -8.567 24.261 1.00 32.51 H new ATOM 0 HG13 ILE A 97 21.166 -7.131 24.493 1.00 32.51 H new ATOM 0 HG21 ILE A 97 19.839 -6.193 22.642 1.00 42.23 H new ATOM 0 HG22 ILE A 97 19.850 -6.967 21.039 1.00 42.23 H new ATOM 0 HG23 ILE A 97 18.981 -7.732 22.391 1.00 42.23 H new ATOM 0 HD11 ILE A 97 20.200 -9.046 25.659 1.00 31.20 H new ATOM 0 HD12 ILE A 97 19.113 -8.490 24.364 1.00 31.20 H new ATOM 0 HD13 ILE A 97 20.105 -9.949 24.128 1.00 31.20 H new ATOM 1517 N LEU A 98 20.713 -9.519 19.388 1.00 62.31 N ATOM 1518 CA LEU A 98 20.989 -9.370 17.970 1.00 44.21 C ATOM 1519 C LEU A 98 20.411 -8.055 17.454 1.00 62.31 C ATOM 1520 O LEU A 98 19.214 -7.791 17.582 1.00 53.22 O ATOM 1521 CB LEU A 98 20.427 -10.574 17.195 1.00 24.12 C ATOM 1522 CG LEU A 98 20.851 -10.696 15.722 1.00 33.43 C ATOM 1523 CD1 LEU A 98 20.053 -9.756 14.831 1.00 13.05 C ATOM 1524 CD2 LEU A 98 22.340 -10.428 15.577 1.00 0.34 C ATOM 0 H LEU A 98 19.852 -10.022 19.604 1.00 62.31 H new ATOM 0 HA LEU A 98 22.068 -9.343 17.815 1.00 44.21 H new ATOM 0 HB2 LEU A 98 20.727 -11.485 17.714 1.00 24.12 H new ATOM 0 HB3 LEU A 98 19.339 -10.528 17.235 1.00 24.12 H new ATOM 0 HG LEU A 98 20.642 -11.716 15.399 1.00 33.43 H new ATOM 0 HD11 LEU A 98 20.380 -9.870 13.797 1.00 13.05 H new ATOM 0 HD12 LEU A 98 18.993 -9.997 14.905 1.00 13.05 H new ATOM 0 HD13 LEU A 98 20.214 -8.727 15.151 1.00 13.05 H new ATOM 0 HD21 LEU A 98 22.626 -10.518 14.529 1.00 0.34 H new ATOM 0 HD22 LEU A 98 22.564 -9.421 15.929 1.00 0.34 H new ATOM 0 HD23 LEU A 98 22.899 -11.152 16.169 1.00 0.34 H new ATOM 1536 N ALA A 99 21.276 -7.232 16.883 1.00 75.12 N ATOM 1537 CA ALA A 99 20.869 -5.966 16.302 1.00 60.22 C ATOM 1538 C ALA A 99 21.469 -5.809 14.914 1.00 34.14 C ATOM 1539 O ALA A 99 22.369 -6.559 14.531 1.00 74.43 O ATOM 1540 CB ALA A 99 21.301 -4.814 17.191 1.00 32.20 C ATOM 0 H ALA A 99 22.275 -7.423 16.810 1.00 75.12 H new ATOM 0 HA ALA A 99 19.782 -5.954 16.219 1.00 60.22 H new ATOM 0 HB1 ALA A 99 20.989 -3.871 16.742 1.00 32.20 H new ATOM 0 HB2 ALA A 99 20.839 -4.919 18.173 1.00 32.20 H new ATOM 0 HB3 ALA A 99 22.386 -4.823 17.297 1.00 32.20 H new ATOM 1546 N MET A 100 20.978 -4.838 14.165 1.00 41.41 N ATOM 1547 CA MET A 100 21.492 -4.584 12.829 1.00 51.23 C ATOM 1548 C MET A 100 22.354 -3.325 12.844 1.00 25.54 C ATOM 1549 O MET A 100 22.077 -2.381 13.586 1.00 11.50 O ATOM 1550 CB MET A 100 20.337 -4.449 11.831 1.00 72.20 C ATOM 1551 CG MET A 100 20.745 -4.697 10.386 1.00 34.53 C ATOM 1552 SD MET A 100 19.343 -4.750 9.253 1.00 5.14 S ATOM 1553 CE MET A 100 18.817 -3.042 9.298 1.00 31.13 C ATOM 0 H MET A 100 20.226 -4.213 14.457 1.00 41.41 H new ATOM 0 HA MET A 100 22.110 -5.425 12.513 1.00 51.23 H new ATOM 0 HB2 MET A 100 19.550 -5.152 12.103 1.00 72.20 H new ATOM 0 HB3 MET A 100 19.913 -3.448 11.913 1.00 72.20 H new ATOM 0 HG2 MET A 100 21.431 -3.912 10.069 1.00 34.53 H new ATOM 0 HG3 MET A 100 21.289 -5.639 10.325 1.00 34.53 H new ATOM 0 HE1 MET A 100 17.815 -2.981 9.723 1.00 31.13 H new ATOM 0 HE2 MET A 100 19.508 -2.465 9.912 1.00 31.13 H new ATOM 0 HE3 MET A 100 18.807 -2.638 8.286 1.00 31.13 H new ATOM 1563 N ALA A 101 23.411 -3.319 12.047 1.00 35.33 N ATOM 1564 CA ALA A 101 24.340 -2.204 12.037 1.00 63.22 C ATOM 1565 C ALA A 101 24.003 -1.234 10.913 1.00 51.24 C ATOM 1566 O ALA A 101 23.298 -1.583 9.963 1.00 20.44 O ATOM 1567 CB ALA A 101 25.770 -2.703 11.914 1.00 33.53 C ATOM 0 H ALA A 101 23.645 -4.073 11.401 1.00 35.33 H new ATOM 0 HA ALA A 101 24.247 -1.669 12.982 1.00 63.22 H new ATOM 0 HB1 ALA A 101 26.453 -1.853 11.908 1.00 33.53 H new ATOM 0 HB2 ALA A 101 26.004 -3.350 12.759 1.00 33.53 H new ATOM 0 HB3 ALA A 101 25.881 -3.264 10.986 1.00 33.53 H new ATOM 1573 N ASN A 102 24.527 -0.025 11.014 1.00 34.44 N ATOM 1574 CA ASN A 102 24.147 1.048 10.111 1.00 30.03 C ATOM 1575 C ASN A 102 25.217 2.127 10.082 1.00 10.33 C ATOM 1576 O ASN A 102 26.063 2.193 10.976 1.00 40.13 O ATOM 1577 CB ASN A 102 22.797 1.647 10.534 1.00 33.50 C ATOM 1578 CG ASN A 102 22.713 1.938 12.024 1.00 12.23 C ATOM 1579 OD1 ASN A 102 22.383 1.059 12.817 1.00 75.14 O ATOM 1580 ND2 ASN A 102 22.998 3.169 12.417 1.00 45.01 N ATOM 0 H ASN A 102 25.219 0.239 11.715 1.00 34.44 H new ATOM 0 HA ASN A 102 24.048 0.635 9.107 1.00 30.03 H new ATOM 0 HB2 ASN A 102 22.626 2.570 9.980 1.00 33.50 H new ATOM 0 HB3 ASN A 102 21.999 0.958 10.259 1.00 33.50 H new ATOM 0 HD21 ASN A 102 22.947 3.413 13.406 1.00 45.01 H new ATOM 0 HD22 ASN A 102 23.268 3.874 11.731 1.00 45.01 H new ATOM 1587 N ALA A 103 25.169 2.972 9.058 1.00 14.33 N ATOM 1588 CA ALA A 103 26.148 4.043 8.904 1.00 31.14 C ATOM 1589 C ALA A 103 25.579 5.336 9.457 1.00 11.41 C ATOM 1590 O ALA A 103 26.301 6.282 9.764 1.00 51.40 O ATOM 1591 CB ALA A 103 26.534 4.206 7.440 1.00 4.03 C ATOM 0 H ALA A 103 24.463 2.937 8.322 1.00 14.33 H new ATOM 0 HA ALA A 103 27.048 3.787 9.462 1.00 31.14 H new ATOM 0 HB1 ALA A 103 27.265 5.009 7.344 1.00 4.03 H new ATOM 0 HB2 ALA A 103 26.966 3.276 7.072 1.00 4.03 H new ATOM 0 HB3 ALA A 103 25.647 4.450 6.855 1.00 4.03 H new ATOM 1597 N GLY A 104 24.266 5.352 9.571 1.00 64.14 N ATOM 1598 CA GLY A 104 23.558 6.461 10.155 1.00 13.42 C ATOM 1599 C GLY A 104 22.232 5.980 10.682 1.00 60.45 C ATOM 1600 O GLY A 104 21.877 4.829 10.429 1.00 63.11 O ATOM 0 H GLY A 104 23.663 4.591 9.259 1.00 64.14 H new ATOM 0 HA2 GLY A 104 24.146 6.899 10.961 1.00 13.42 H new ATOM 0 HA3 GLY A 104 23.405 7.243 9.411 1.00 13.42 H new ATOM 1604 N PRO A 105 21.480 6.819 11.403 1.00 52.34 N ATOM 1605 CA PRO A 105 20.193 6.432 11.995 1.00 10.35 C ATOM 1606 C PRO A 105 19.264 5.760 10.983 1.00 2.52 C ATOM 1607 O PRO A 105 18.648 4.732 11.269 1.00 14.30 O ATOM 1608 CB PRO A 105 19.594 7.763 12.481 1.00 14.22 C ATOM 1609 CG PRO A 105 20.466 8.836 11.913 1.00 42.32 C ATOM 1610 CD PRO A 105 21.816 8.214 11.705 1.00 51.41 C ATOM 0 HA PRO A 105 20.321 5.699 12.791 1.00 10.35 H new ATOM 0 HB2 PRO A 105 18.565 7.875 12.141 1.00 14.22 H new ATOM 0 HB3 PRO A 105 19.577 7.809 13.570 1.00 14.22 H new ATOM 0 HG2 PRO A 105 20.061 9.209 10.973 1.00 42.32 H new ATOM 0 HG3 PRO A 105 20.530 9.686 12.593 1.00 42.32 H new ATOM 0 HD2 PRO A 105 22.359 8.687 10.887 1.00 51.41 H new ATOM 0 HD3 PRO A 105 22.442 8.297 12.593 1.00 51.41 H new ATOM 1618 N ASP A 106 19.185 6.341 9.795 1.00 13.24 N ATOM 1619 CA ASP A 106 18.340 5.812 8.730 1.00 42.34 C ATOM 1620 C ASP A 106 19.139 4.944 7.780 1.00 32.21 C ATOM 1621 O ASP A 106 18.574 4.139 7.039 1.00 50.12 O ATOM 1622 CB ASP A 106 17.703 6.948 7.938 1.00 64.52 C ATOM 1623 CG ASP A 106 18.734 7.931 7.420 1.00 53.42 C ATOM 1624 OD1 ASP A 106 19.416 7.622 6.419 1.00 45.45 O ATOM 1625 OD2 ASP A 106 18.890 9.010 8.028 1.00 61.11 O ATOM 0 H ASP A 106 19.699 7.185 9.541 1.00 13.24 H new ATOM 0 HA ASP A 106 17.563 5.209 9.200 1.00 42.34 H new ATOM 0 HB2 ASP A 106 17.143 6.535 7.099 1.00 64.52 H new ATOM 0 HB3 ASP A 106 16.988 7.474 8.571 1.00 64.52 H new ATOM 1630 N THR A 107 20.453 5.084 7.821 1.00 62.14 N ATOM 1631 CA THR A 107 21.314 4.413 6.876 1.00 40.13 C ATOM 1632 C THR A 107 21.600 2.992 7.347 1.00 55.11 C ATOM 1633 O THR A 107 22.749 2.546 7.390 1.00 45.21 O ATOM 1634 CB THR A 107 22.620 5.202 6.699 1.00 62.31 C ATOM 1635 OG1 THR A 107 22.327 6.606 6.751 1.00 42.14 O ATOM 1636 CG2 THR A 107 23.286 4.873 5.369 1.00 4.32 C ATOM 0 H THR A 107 20.944 5.661 8.504 1.00 62.14 H new ATOM 0 HA THR A 107 20.811 4.361 5.910 1.00 40.13 H new ATOM 0 HB THR A 107 23.305 4.926 7.500 1.00 62.31 H new ATOM 0 HG1 THR A 107 23.156 7.117 6.640 1.00 42.14 H new ATOM 0 HG21 THR A 107 24.208 5.446 5.272 1.00 4.32 H new ATOM 0 HG22 THR A 107 23.515 3.808 5.331 1.00 4.32 H new ATOM 0 HG23 THR A 107 22.612 5.129 4.551 1.00 4.32 H new ATOM 1644 N ASN A 108 20.529 2.310 7.738 1.00 4.05 N ATOM 1645 CA ASN A 108 20.584 0.906 8.112 1.00 71.24 C ATOM 1646 C ASN A 108 20.981 0.085 6.893 1.00 52.22 C ATOM 1647 O ASN A 108 20.401 0.246 5.821 1.00 23.11 O ATOM 1648 CB ASN A 108 19.221 0.451 8.654 1.00 72.32 C ATOM 1649 CG ASN A 108 18.783 1.240 9.881 1.00 41.55 C ATOM 1650 OD1 ASN A 108 19.098 0.875 11.014 1.00 13.11 O ATOM 1651 ND2 ASN A 108 18.032 2.317 9.669 1.00 50.44 N ATOM 0 H ASN A 108 19.597 2.719 7.804 1.00 4.05 H new ATOM 0 HA ASN A 108 21.325 0.761 8.898 1.00 71.24 H new ATOM 0 HB2 ASN A 108 18.470 0.557 7.872 1.00 72.32 H new ATOM 0 HB3 ASN A 108 19.270 -0.608 8.907 1.00 72.32 H new ATOM 0 HD21 ASN A 108 17.698 2.869 10.459 1.00 50.44 H new ATOM 0 HD22 ASN A 108 17.790 2.591 8.717 1.00 50.44 H new ATOM 1658 N GLY A 109 21.974 -0.778 7.049 1.00 22.31 N ATOM 1659 CA GLY A 109 22.545 -1.437 5.891 1.00 32.24 C ATOM 1660 C GLY A 109 22.596 -2.948 5.997 1.00 71.42 C ATOM 1661 O GLY A 109 21.740 -3.572 6.619 1.00 53.21 O ATOM 0 H GLY A 109 22.391 -1.032 7.945 1.00 22.31 H new ATOM 0 HA2 GLY A 109 21.964 -1.165 5.010 1.00 32.24 H new ATOM 0 HA3 GLY A 109 23.556 -1.061 5.735 1.00 32.24 H new ATOM 1665 N SER A 110 23.635 -3.529 5.405 1.00 62.22 N ATOM 1666 CA SER A 110 23.754 -4.975 5.270 1.00 21.33 C ATOM 1667 C SER A 110 24.666 -5.528 6.355 1.00 15.22 C ATOM 1668 O SER A 110 25.309 -6.565 6.182 1.00 23.03 O ATOM 1669 CB SER A 110 24.317 -5.310 3.883 1.00 52.02 C ATOM 1670 OG SER A 110 24.401 -6.709 3.667 1.00 23.43 O ATOM 0 H SER A 110 24.417 -3.010 5.006 1.00 62.22 H new ATOM 0 HA SER A 110 22.770 -5.431 5.379 1.00 21.33 H new ATOM 0 HB2 SER A 110 23.684 -4.862 3.117 1.00 52.02 H new ATOM 0 HB3 SER A 110 25.307 -4.867 3.777 1.00 52.02 H new ATOM 0 HG SER A 110 24.823 -7.135 4.442 1.00 23.43 H new ATOM 1676 N GLN A 111 24.714 -4.833 7.472 1.00 72.22 N ATOM 1677 CA GLN A 111 25.574 -5.215 8.566 1.00 3.14 C ATOM 1678 C GLN A 111 24.740 -5.517 9.797 1.00 71.32 C ATOM 1679 O GLN A 111 23.658 -4.970 9.956 1.00 20.41 O ATOM 1680 CB GLN A 111 26.552 -4.086 8.861 1.00 31.41 C ATOM 1681 CG GLN A 111 27.404 -3.709 7.670 1.00 33.12 C ATOM 1682 CD GLN A 111 28.233 -2.468 7.902 1.00 1.22 C ATOM 1683 OE1 GLN A 111 28.647 -2.175 9.022 1.00 35.42 O ATOM 1684 NE2 GLN A 111 28.455 -1.723 6.836 1.00 45.24 N ATOM 0 H GLN A 111 24.161 -3.993 7.644 1.00 72.22 H new ATOM 0 HA GLN A 111 26.132 -6.110 8.292 1.00 3.14 H new ATOM 0 HB2 GLN A 111 25.996 -3.210 9.193 1.00 31.41 H new ATOM 0 HB3 GLN A 111 27.201 -4.383 9.685 1.00 31.41 H new ATOM 0 HG2 GLN A 111 28.066 -4.540 7.427 1.00 33.12 H new ATOM 0 HG3 GLN A 111 26.759 -3.551 6.805 1.00 33.12 H new ATOM 0 HE21 GLN A 111 28.090 -2.010 5.928 1.00 45.24 H new ATOM 0 HE22 GLN A 111 28.992 -0.860 6.920 1.00 45.24 H new ATOM 1693 N PHE A 112 25.238 -6.379 10.659 1.00 64.25 N ATOM 1694 CA PHE A 112 24.555 -6.705 11.901 1.00 31.12 C ATOM 1695 C PHE A 112 25.580 -6.838 13.016 1.00 72.12 C ATOM 1696 O PHE A 112 26.782 -6.835 12.754 1.00 10.00 O ATOM 1697 CB PHE A 112 23.749 -8.006 11.752 1.00 44.41 C ATOM 1698 CG PHE A 112 24.586 -9.206 11.397 1.00 22.31 C ATOM 1699 CD1 PHE A 112 24.823 -9.537 10.072 1.00 31.51 C ATOM 1700 CD2 PHE A 112 25.136 -10.002 12.390 1.00 65.31 C ATOM 1701 CE1 PHE A 112 25.594 -10.636 9.745 1.00 24.52 C ATOM 1702 CE2 PHE A 112 25.907 -11.101 12.069 1.00 13.40 C ATOM 1703 CZ PHE A 112 26.137 -11.418 10.744 1.00 43.31 C ATOM 0 H PHE A 112 26.121 -6.872 10.524 1.00 64.25 H new ATOM 0 HA PHE A 112 23.856 -5.905 12.146 1.00 31.12 H new ATOM 0 HB2 PHE A 112 23.224 -8.205 12.686 1.00 44.41 H new ATOM 0 HB3 PHE A 112 22.989 -7.865 10.983 1.00 44.41 H new ATOM 0 HD1 PHE A 112 24.400 -8.929 9.286 1.00 31.51 H new ATOM 0 HD2 PHE A 112 24.959 -9.759 13.427 1.00 65.31 H new ATOM 0 HE1 PHE A 112 25.771 -10.883 8.709 1.00 24.52 H new ATOM 0 HE2 PHE A 112 26.330 -11.712 12.853 1.00 13.40 H new ATOM 0 HZ PHE A 112 26.741 -12.277 10.490 1.00 43.31 H new ATOM 1713 N PHE A 113 25.125 -6.938 14.251 1.00 73.44 N ATOM 1714 CA PHE A 113 26.038 -7.162 15.356 1.00 51.32 C ATOM 1715 C PHE A 113 25.324 -7.790 16.538 1.00 20.34 C ATOM 1716 O PHE A 113 24.126 -7.586 16.743 1.00 31.41 O ATOM 1717 CB PHE A 113 26.735 -5.861 15.778 1.00 41.04 C ATOM 1718 CG PHE A 113 25.846 -4.852 16.441 1.00 74.01 C ATOM 1719 CD1 PHE A 113 25.110 -3.953 15.690 1.00 42.14 C ATOM 1720 CD2 PHE A 113 25.766 -4.795 17.822 1.00 11.33 C ATOM 1721 CE1 PHE A 113 24.308 -3.015 16.306 1.00 55.01 C ATOM 1722 CE2 PHE A 113 24.964 -3.862 18.445 1.00 52.20 C ATOM 1723 CZ PHE A 113 24.234 -2.968 17.686 1.00 71.12 C ATOM 0 H PHE A 113 24.142 -6.869 14.512 1.00 73.44 H new ATOM 0 HA PHE A 113 26.802 -7.858 15.010 1.00 51.32 H new ATOM 0 HB2 PHE A 113 27.550 -6.107 16.458 1.00 41.04 H new ATOM 0 HB3 PHE A 113 27.183 -5.404 14.896 1.00 41.04 H new ATOM 0 HD1 PHE A 113 25.164 -3.986 14.612 1.00 42.14 H new ATOM 0 HD2 PHE A 113 26.339 -5.490 18.419 1.00 11.33 H new ATOM 0 HE1 PHE A 113 23.738 -2.317 15.711 1.00 55.01 H new ATOM 0 HE2 PHE A 113 24.907 -3.830 19.523 1.00 52.20 H new ATOM 0 HZ PHE A 113 23.607 -2.234 18.169 1.00 71.12 H new ATOM 1733 N VAL A 114 26.068 -8.570 17.298 1.00 35.33 N ATOM 1734 CA VAL A 114 25.547 -9.184 18.511 1.00 12.52 C ATOM 1735 C VAL A 114 26.256 -8.596 19.716 1.00 40.21 C ATOM 1736 O VAL A 114 27.460 -8.349 19.674 1.00 21.14 O ATOM 1737 CB VAL A 114 25.739 -10.716 18.522 1.00 33.11 C ATOM 1738 CG1 VAL A 114 24.972 -11.353 19.672 1.00 4.13 C ATOM 1739 CG2 VAL A 114 25.319 -11.321 17.195 1.00 31.02 C ATOM 0 H VAL A 114 27.042 -8.797 17.098 1.00 35.33 H new ATOM 0 HA VAL A 114 24.477 -8.978 18.547 1.00 12.52 H new ATOM 0 HB VAL A 114 26.799 -10.921 18.670 1.00 33.11 H new ATOM 0 HG11 VAL A 114 25.124 -12.432 19.657 1.00 4.13 H new ATOM 0 HG12 VAL A 114 25.333 -10.949 20.618 1.00 4.13 H new ATOM 0 HG13 VAL A 114 23.909 -11.135 19.566 1.00 4.13 H new ATOM 0 HG21 VAL A 114 25.463 -12.401 17.226 1.00 31.02 H new ATOM 0 HG22 VAL A 114 24.268 -11.100 17.011 1.00 31.02 H new ATOM 0 HG23 VAL A 114 25.924 -10.897 16.394 1.00 31.02 H new ATOM 1749 N THR A 115 25.521 -8.372 20.782 1.00 3.25 N ATOM 1750 CA THR A 115 26.096 -7.793 21.978 1.00 31.11 C ATOM 1751 C THR A 115 26.503 -8.888 22.951 1.00 14.51 C ATOM 1752 O THR A 115 25.696 -9.760 23.301 1.00 61.25 O ATOM 1753 CB THR A 115 25.122 -6.829 22.681 1.00 52.44 C ATOM 1754 OG1 THR A 115 24.024 -7.560 23.227 1.00 41.54 O ATOM 1755 CG2 THR A 115 24.601 -5.776 21.717 1.00 71.00 C ATOM 0 H THR A 115 24.525 -8.581 20.847 1.00 3.25 H new ATOM 0 HA THR A 115 26.972 -7.224 21.667 1.00 31.11 H new ATOM 0 HB THR A 115 25.664 -6.326 23.482 1.00 52.44 H new ATOM 0 HG1 THR A 115 24.249 -8.513 23.258 1.00 41.54 H new ATOM 0 HG21 THR A 115 23.916 -5.110 22.241 1.00 71.00 H new ATOM 0 HG22 THR A 115 25.437 -5.199 21.322 1.00 71.00 H new ATOM 0 HG23 THR A 115 24.076 -6.263 20.895 1.00 71.00 H new ATOM 1763 N LEU A 116 27.761 -8.847 23.362 1.00 25.32 N ATOM 1764 CA LEU A 116 28.287 -9.782 24.346 1.00 11.43 C ATOM 1765 C LEU A 116 28.007 -9.276 25.756 1.00 41.05 C ATOM 1766 O LEU A 116 28.242 -9.969 26.743 1.00 33.21 O ATOM 1767 CB LEU A 116 29.790 -9.944 24.143 1.00 71.44 C ATOM 1768 CG LEU A 116 30.211 -10.211 22.702 1.00 70.54 C ATOM 1769 CD1 LEU A 116 31.720 -10.278 22.594 1.00 35.14 C ATOM 1770 CD2 LEU A 116 29.578 -11.495 22.198 1.00 41.01 C ATOM 0 H LEU A 116 28.444 -8.168 23.025 1.00 25.32 H new ATOM 0 HA LEU A 116 27.797 -10.747 24.217 1.00 11.43 H new ATOM 0 HB2 LEU A 116 30.290 -9.041 24.492 1.00 71.44 H new ATOM 0 HB3 LEU A 116 30.141 -10.765 24.768 1.00 71.44 H new ATOM 0 HG LEU A 116 29.862 -9.388 22.079 1.00 70.54 H new ATOM 0 HD11 LEU A 116 32.003 -10.469 21.559 1.00 35.14 H new ATOM 0 HD12 LEU A 116 32.150 -9.331 22.919 1.00 35.14 H new ATOM 0 HD13 LEU A 116 32.095 -11.082 23.227 1.00 35.14 H new ATOM 0 HD21 LEU A 116 29.887 -11.673 21.168 1.00 41.01 H new ATOM 0 HD22 LEU A 116 29.899 -12.329 22.823 1.00 41.01 H new ATOM 0 HD23 LEU A 116 28.492 -11.407 22.241 1.00 41.01 H new ATOM 1782 N ALA A 117 27.504 -8.057 25.826 1.00 63.31 N ATOM 1783 CA ALA A 117 27.161 -7.419 27.088 1.00 74.21 C ATOM 1784 C ALA A 117 25.964 -6.495 26.887 1.00 12.41 C ATOM 1785 O ALA A 117 25.665 -6.108 25.754 1.00 75.34 O ATOM 1786 CB ALA A 117 28.358 -6.642 27.626 1.00 74.10 C ATOM 0 H ALA A 117 27.320 -7.478 25.007 1.00 63.31 H new ATOM 0 HA ALA A 117 26.895 -8.183 27.818 1.00 74.21 H new ATOM 0 HB1 ALA A 117 28.090 -6.169 28.571 1.00 74.10 H new ATOM 0 HB2 ALA A 117 29.193 -7.325 27.786 1.00 74.10 H new ATOM 0 HB3 ALA A 117 28.648 -5.877 26.906 1.00 74.10 H new ATOM 1792 N PRO A 118 25.247 -6.145 27.969 1.00 53.34 N ATOM 1793 CA PRO A 118 24.095 -5.244 27.889 1.00 10.12 C ATOM 1794 C PRO A 118 24.496 -3.805 27.557 1.00 12.05 C ATOM 1795 O PRO A 118 25.179 -3.135 28.337 1.00 53.51 O ATOM 1796 CB PRO A 118 23.475 -5.322 29.287 1.00 21.20 C ATOM 1797 CG PRO A 118 24.590 -5.738 30.181 1.00 13.24 C ATOM 1798 CD PRO A 118 25.490 -6.610 29.350 1.00 64.20 C ATOM 0 HA PRO A 118 23.411 -5.535 27.092 1.00 10.12 H new ATOM 0 HB2 PRO A 118 23.064 -4.359 29.591 1.00 21.20 H new ATOM 0 HB3 PRO A 118 22.657 -6.041 29.316 1.00 21.20 H new ATOM 0 HG2 PRO A 118 25.130 -4.870 30.560 1.00 13.24 H new ATOM 0 HG3 PRO A 118 24.213 -6.282 31.047 1.00 13.24 H new ATOM 0 HD2 PRO A 118 26.536 -6.493 29.634 1.00 64.20 H new ATOM 0 HD3 PRO A 118 25.245 -7.666 29.467 1.00 64.20 H new ATOM 1806 N THR A 119 24.078 -3.336 26.393 1.00 33.21 N ATOM 1807 CA THR A 119 24.386 -1.986 25.964 1.00 63.40 C ATOM 1808 C THR A 119 23.146 -1.102 26.053 1.00 74.31 C ATOM 1809 O THR A 119 22.142 -1.355 25.390 1.00 5.33 O ATOM 1810 CB THR A 119 24.941 -1.975 24.528 1.00 32.22 C ATOM 1811 OG1 THR A 119 24.118 -2.784 23.677 1.00 51.54 O ATOM 1812 CG2 THR A 119 26.372 -2.489 24.498 1.00 51.10 C ATOM 0 H THR A 119 23.523 -3.874 25.728 1.00 33.21 H new ATOM 0 HA THR A 119 25.152 -1.589 26.630 1.00 63.40 H new ATOM 0 HB THR A 119 24.934 -0.947 24.167 1.00 32.22 H new ATOM 0 HG1 THR A 119 23.185 -2.725 23.971 1.00 51.54 H new ATOM 0 HG21 THR A 119 26.743 -2.472 23.473 1.00 51.10 H new ATOM 0 HG22 THR A 119 27.000 -1.853 25.122 1.00 51.10 H new ATOM 0 HG23 THR A 119 26.400 -3.511 24.877 1.00 51.10 H new ATOM 1820 N GLN A 120 23.213 -0.067 26.878 1.00 34.54 N ATOM 1821 CA GLN A 120 22.063 0.799 27.093 1.00 62.14 C ATOM 1822 C GLN A 120 22.280 2.153 26.443 1.00 33.33 C ATOM 1823 O GLN A 120 21.609 3.131 26.768 1.00 32.15 O ATOM 1824 CB GLN A 120 21.761 0.930 28.595 1.00 61.31 C ATOM 1825 CG GLN A 120 22.964 1.246 29.479 1.00 43.10 C ATOM 1826 CD GLN A 120 23.339 2.714 29.481 1.00 12.00 C ATOM 1827 OE1 GLN A 120 22.822 3.496 30.281 1.00 52.00 O ATOM 1828 NE2 GLN A 120 24.260 3.093 28.614 1.00 34.52 N ATOM 0 H GLN A 120 24.046 0.192 27.406 1.00 34.54 H new ATOM 0 HA GLN A 120 21.192 0.347 26.619 1.00 62.14 H new ATOM 0 HB2 GLN A 120 21.015 1.713 28.731 1.00 61.31 H new ATOM 0 HB3 GLN A 120 21.312 -0.001 28.941 1.00 61.31 H new ATOM 0 HG2 GLN A 120 22.748 0.932 30.500 1.00 43.10 H new ATOM 0 HG3 GLN A 120 23.819 0.661 29.140 1.00 43.10 H new ATOM 0 HE21 GLN A 120 24.663 2.414 27.968 1.00 34.52 H new ATOM 0 HE22 GLN A 120 24.568 4.065 28.590 1.00 34.52 H new ATOM 1837 N TRP A 121 23.210 2.188 25.501 1.00 61.13 N ATOM 1838 CA TRP A 121 23.556 3.420 24.819 1.00 54.14 C ATOM 1839 C TRP A 121 23.504 3.240 23.302 1.00 71.55 C ATOM 1840 O TRP A 121 23.883 4.134 22.547 1.00 2.23 O ATOM 1841 CB TRP A 121 24.948 3.881 25.264 1.00 33.33 C ATOM 1842 CG TRP A 121 26.008 2.825 25.146 1.00 61.23 C ATOM 1843 CD1 TRP A 121 26.273 2.044 24.063 1.00 14.11 C ATOM 1844 CD2 TRP A 121 26.958 2.453 26.149 1.00 42.51 C ATOM 1845 NE1 TRP A 121 27.309 1.192 24.335 1.00 10.34 N ATOM 1846 CE2 TRP A 121 27.753 1.427 25.609 1.00 14.11 C ATOM 1847 CE3 TRP A 121 27.210 2.884 27.453 1.00 72.33 C ATOM 1848 CZ2 TRP A 121 28.782 0.828 26.328 1.00 22.02 C ATOM 1849 CZ3 TRP A 121 28.232 2.288 28.165 1.00 45.54 C ATOM 1850 CH2 TRP A 121 29.007 1.270 27.601 1.00 64.41 C ATOM 0 H TRP A 121 23.739 1.372 25.192 1.00 61.13 H new ATOM 0 HA TRP A 121 22.826 4.185 25.085 1.00 54.14 H new ATOM 0 HB2 TRP A 121 25.242 4.744 24.667 1.00 33.33 H new ATOM 0 HB3 TRP A 121 24.895 4.214 26.301 1.00 33.33 H new ATOM 0 HD1 TRP A 121 25.742 2.090 23.124 1.00 14.11 H new ATOM 0 HE1 TRP A 121 27.688 0.496 23.694 1.00 10.34 H new ATOM 0 HE3 TRP A 121 26.616 3.669 27.897 1.00 72.33 H new ATOM 0 HZ2 TRP A 121 29.382 0.041 25.895 1.00 22.02 H new ATOM 0 HZ3 TRP A 121 28.436 2.614 29.174 1.00 45.54 H new ATOM 0 HH2 TRP A 121 29.800 0.824 28.184 1.00 64.41 H new ATOM 1861 N LEU A 122 23.061 2.066 22.863 1.00 25.44 N ATOM 1862 CA LEU A 122 22.935 1.783 21.439 1.00 33.24 C ATOM 1863 C LEU A 122 21.476 1.663 21.022 1.00 53.41 C ATOM 1864 O LEU A 122 21.174 1.495 19.838 1.00 55.13 O ATOM 1865 CB LEU A 122 23.673 0.492 21.096 1.00 72.51 C ATOM 1866 CG LEU A 122 25.171 0.524 21.370 1.00 73.45 C ATOM 1867 CD1 LEU A 122 25.791 -0.824 21.065 1.00 75.14 C ATOM 1868 CD2 LEU A 122 25.829 1.627 20.560 1.00 50.21 C ATOM 0 H LEU A 122 22.784 1.297 23.473 1.00 25.44 H new ATOM 0 HA LEU A 122 23.378 2.616 20.893 1.00 33.24 H new ATOM 0 HB2 LEU A 122 23.231 -0.326 21.665 1.00 72.51 H new ATOM 0 HB3 LEU A 122 23.515 0.268 20.041 1.00 72.51 H new ATOM 0 HG LEU A 122 25.334 0.737 22.427 1.00 73.45 H new ATOM 0 HD11 LEU A 122 26.862 -0.786 21.266 1.00 75.14 H new ATOM 0 HD12 LEU A 122 25.331 -1.587 21.694 1.00 75.14 H new ATOM 0 HD13 LEU A 122 25.627 -1.071 20.016 1.00 75.14 H new ATOM 0 HD21 LEU A 122 26.900 1.640 20.765 1.00 50.21 H new ATOM 0 HD22 LEU A 122 25.665 1.446 19.498 1.00 50.21 H new ATOM 0 HD23 LEU A 122 25.396 2.589 20.835 1.00 50.21 H new ATOM 1880 N ASP A 123 20.575 1.791 21.988 1.00 2.51 N ATOM 1881 CA ASP A 123 19.145 1.594 21.743 1.00 55.45 C ATOM 1882 C ASP A 123 18.566 2.722 20.892 1.00 71.41 C ATOM 1883 O ASP A 123 17.429 2.647 20.424 1.00 2.23 O ATOM 1884 CB ASP A 123 18.382 1.481 23.068 1.00 33.12 C ATOM 1885 CG ASP A 123 18.370 2.773 23.863 1.00 65.04 C ATOM 1886 OD1 ASP A 123 19.458 3.247 24.249 1.00 74.55 O ATOM 1887 OD2 ASP A 123 17.272 3.311 24.122 1.00 53.21 O ATOM 0 H ASP A 123 20.806 2.031 22.952 1.00 2.51 H new ATOM 0 HA ASP A 123 19.029 0.662 21.190 1.00 55.45 H new ATOM 0 HB2 ASP A 123 17.355 1.178 22.864 1.00 33.12 H new ATOM 0 HB3 ASP A 123 18.832 0.694 23.673 1.00 33.12 H new ATOM 1892 N GLY A 124 19.355 3.766 20.697 1.00 51.53 N ATOM 1893 CA GLY A 124 18.952 4.856 19.830 1.00 52.35 C ATOM 1894 C GLY A 124 19.988 5.139 18.768 1.00 74.24 C ATOM 1895 O GLY A 124 19.994 6.212 18.161 1.00 12.32 O ATOM 0 H GLY A 124 20.273 3.880 21.126 1.00 51.53 H new ATOM 0 HA2 GLY A 124 18.002 4.611 19.355 1.00 52.35 H new ATOM 0 HA3 GLY A 124 18.788 5.754 20.426 1.00 52.35 H new ATOM 1899 N LYS A 125 20.874 4.175 18.553 1.00 25.42 N ATOM 1900 CA LYS A 125 21.939 4.316 17.566 1.00 2.20 C ATOM 1901 C LYS A 125 21.848 3.202 16.531 1.00 55.22 C ATOM 1902 O LYS A 125 22.282 3.359 15.390 1.00 50.24 O ATOM 1903 CB LYS A 125 23.311 4.263 18.247 1.00 33.13 C ATOM 1904 CG LYS A 125 23.405 5.099 19.513 1.00 50.43 C ATOM 1905 CD LYS A 125 23.160 6.577 19.250 1.00 13.10 C ATOM 1906 CE LYS A 125 24.264 7.192 18.401 1.00 23.21 C ATOM 1907 NZ LYS A 125 24.113 8.666 18.280 1.00 1.14 N ATOM 0 H LYS A 125 20.877 3.284 19.050 1.00 25.42 H new ATOM 0 HA LYS A 125 21.821 5.281 17.072 1.00 2.20 H new ATOM 0 HB2 LYS A 125 23.545 3.226 18.490 1.00 33.13 H new ATOM 0 HB3 LYS A 125 24.069 4.604 17.542 1.00 33.13 H new ATOM 0 HG2 LYS A 125 22.678 4.736 20.240 1.00 50.43 H new ATOM 0 HG3 LYS A 125 24.392 4.970 19.958 1.00 50.43 H new ATOM 0 HD2 LYS A 125 22.202 6.702 18.746 1.00 13.10 H new ATOM 0 HD3 LYS A 125 23.093 7.109 20.199 1.00 13.10 H new ATOM 0 HE2 LYS A 125 25.233 6.961 18.843 1.00 23.21 H new ATOM 0 HE3 LYS A 125 24.251 6.743 17.408 1.00 23.21 H new ATOM 0 HZ1 LYS A 125 24.884 9.047 17.695 1.00 1.14 H new ATOM 0 HZ2 LYS A 125 23.199 8.886 17.835 1.00 1.14 H new ATOM 0 HZ3 LYS A 125 24.151 9.098 19.225 1.00 1.14 H new ATOM 1921 N HIS A 126 21.304 2.062 16.948 1.00 30.32 N ATOM 1922 CA HIS A 126 21.148 0.914 16.063 1.00 23.40 C ATOM 1923 C HIS A 126 19.800 0.247 16.295 1.00 63.32 C ATOM 1924 O HIS A 126 19.389 0.055 17.440 1.00 43.43 O ATOM 1925 CB HIS A 126 22.263 -0.115 16.289 1.00 45.41 C ATOM 1926 CG HIS A 126 23.644 0.409 16.043 1.00 4.25 C ATOM 1927 ND1 HIS A 126 24.118 0.722 14.791 1.00 1.32 N ATOM 1928 CD2 HIS A 126 24.653 0.682 16.902 1.00 50.52 C ATOM 1929 CE1 HIS A 126 25.359 1.159 14.887 1.00 74.34 C ATOM 1930 NE2 HIS A 126 25.709 1.147 16.159 1.00 41.43 N ATOM 0 H HIS A 126 20.963 1.910 17.897 1.00 30.32 H new ATOM 0 HA HIS A 126 21.207 1.278 15.037 1.00 23.40 H new ATOM 0 HB2 HIS A 126 22.203 -0.479 17.314 1.00 45.41 H new ATOM 0 HB3 HIS A 126 22.090 -0.970 15.636 1.00 45.41 H new ATOM 0 HD1 HIS A 126 23.592 0.630 13.922 1.00 1.32 H new ATOM 0 HD2 HIS A 126 24.631 0.557 17.975 1.00 50.52 H new ATOM 0 HE1 HIS A 126 25.983 1.473 14.064 1.00 74.34 H new ATOM 1939 N THR A 127 19.105 -0.080 15.215 1.00 32.45 N ATOM 1940 CA THR A 127 17.852 -0.807 15.310 1.00 13.33 C ATOM 1941 C THR A 127 18.106 -2.244 15.779 1.00 52.32 C ATOM 1942 O THR A 127 18.723 -3.045 15.069 1.00 63.33 O ATOM 1943 CB THR A 127 17.125 -0.821 13.951 1.00 23.12 C ATOM 1944 OG1 THR A 127 17.051 0.509 13.419 1.00 50.11 O ATOM 1945 CG2 THR A 127 15.724 -1.398 14.082 1.00 53.31 C ATOM 0 H THR A 127 19.390 0.148 14.263 1.00 32.45 H new ATOM 0 HA THR A 127 17.219 -0.300 16.039 1.00 13.33 H new ATOM 0 HB THR A 127 17.695 -1.455 13.272 1.00 23.12 H new ATOM 0 HG1 THR A 127 17.689 0.602 12.681 1.00 50.11 H new ATOM 0 HG21 THR A 127 15.236 -1.395 13.107 1.00 53.31 H new ATOM 0 HG22 THR A 127 15.785 -2.421 14.454 1.00 53.31 H new ATOM 0 HG23 THR A 127 15.145 -0.793 14.779 1.00 53.31 H new ATOM 1953 N ILE A 128 17.657 -2.555 16.989 1.00 11.12 N ATOM 1954 CA ILE A 128 17.848 -3.880 17.560 1.00 74.50 C ATOM 1955 C ILE A 128 16.589 -4.718 17.387 1.00 33.23 C ATOM 1956 O ILE A 128 15.523 -4.355 17.888 1.00 33.51 O ATOM 1957 CB ILE A 128 18.190 -3.813 19.065 1.00 64.34 C ATOM 1958 CG1 ILE A 128 19.332 -2.828 19.323 1.00 22.15 C ATOM 1959 CG2 ILE A 128 18.563 -5.199 19.581 1.00 73.34 C ATOM 1960 CD1 ILE A 128 19.658 -2.651 20.791 1.00 23.33 C ATOM 0 H ILE A 128 17.157 -1.904 17.594 1.00 11.12 H new ATOM 0 HA ILE A 128 18.683 -4.337 17.029 1.00 74.50 H new ATOM 0 HB ILE A 128 17.309 -3.460 19.600 1.00 64.34 H new ATOM 0 HG12 ILE A 128 20.224 -3.173 18.800 1.00 22.15 H new ATOM 0 HG13 ILE A 128 19.068 -1.859 18.898 1.00 22.15 H new ATOM 0 HG21 ILE A 128 18.802 -5.140 20.643 1.00 73.34 H new ATOM 0 HG22 ILE A 128 17.724 -5.879 19.435 1.00 73.34 H new ATOM 0 HG23 ILE A 128 19.430 -5.570 19.034 1.00 73.34 H new ATOM 0 HD11 ILE A 128 20.477 -1.939 20.899 1.00 23.33 H new ATOM 0 HD12 ILE A 128 18.780 -2.276 21.316 1.00 23.33 H new ATOM 0 HD13 ILE A 128 19.953 -3.610 21.216 1.00 23.33 H new ATOM 1972 N PHE A 129 16.712 -5.833 16.679 1.00 14.04 N ATOM 1973 CA PHE A 129 15.580 -6.726 16.463 1.00 2.51 C ATOM 1974 C PHE A 129 16.064 -8.147 16.145 1.00 15.22 C ATOM 1975 O PHE A 129 15.986 -8.613 15.011 1.00 72.34 O ATOM 1976 CB PHE A 129 14.695 -6.182 15.317 1.00 22.44 C ATOM 1977 CG PHE A 129 15.386 -6.101 13.975 1.00 52.30 C ATOM 1978 CD1 PHE A 129 16.428 -5.214 13.761 1.00 10.14 C ATOM 1979 CD2 PHE A 129 14.994 -6.926 12.930 1.00 22.11 C ATOM 1980 CE1 PHE A 129 17.068 -5.154 12.540 1.00 43.11 C ATOM 1981 CE2 PHE A 129 15.630 -6.869 11.706 1.00 0.42 C ATOM 1982 CZ PHE A 129 16.668 -5.983 11.510 1.00 3.43 C ATOM 0 H PHE A 129 17.582 -6.141 16.245 1.00 14.04 H new ATOM 0 HA PHE A 129 14.987 -6.770 17.376 1.00 2.51 H new ATOM 0 HB2 PHE A 129 13.816 -6.819 15.221 1.00 22.44 H new ATOM 0 HB3 PHE A 129 14.340 -5.188 15.589 1.00 22.44 H new ATOM 0 HD1 PHE A 129 16.744 -4.560 14.561 1.00 10.14 H new ATOM 0 HD2 PHE A 129 14.181 -7.622 13.076 1.00 22.11 H new ATOM 0 HE1 PHE A 129 17.881 -4.459 12.390 1.00 43.11 H new ATOM 0 HE2 PHE A 129 15.315 -7.518 10.902 1.00 0.42 H new ATOM 0 HZ PHE A 129 17.167 -5.937 10.553 1.00 3.43 H new ATOM 1992 N GLY A 130 16.542 -8.856 17.151 1.00 55.43 N ATOM 1993 CA GLY A 130 17.008 -10.198 16.901 1.00 33.22 C ATOM 1994 C GLY A 130 17.140 -11.053 18.145 1.00 13.21 C ATOM 1995 O GLY A 130 17.275 -10.545 19.258 1.00 1.24 O ATOM 0 H GLY A 130 16.615 -8.535 18.116 1.00 55.43 H new ATOM 0 HA2 GLY A 130 16.321 -10.686 16.210 1.00 33.22 H new ATOM 0 HA3 GLY A 130 17.977 -10.147 16.404 1.00 33.22 H new ATOM 1999 N ARG A 131 17.111 -12.358 17.931 1.00 64.32 N ATOM 2000 CA ARG A 131 17.352 -13.344 18.971 1.00 62.01 C ATOM 2001 C ARG A 131 18.460 -14.277 18.507 1.00 32.32 C ATOM 2002 O ARG A 131 18.363 -14.845 17.420 1.00 44.44 O ATOM 2003 CB ARG A 131 16.104 -14.203 19.217 1.00 42.05 C ATOM 2004 CG ARG A 131 14.857 -13.459 19.662 1.00 5.50 C ATOM 2005 CD ARG A 131 13.615 -14.226 19.215 1.00 40.51 C ATOM 2006 NE ARG A 131 12.495 -14.145 20.158 1.00 52.12 N ATOM 2007 CZ ARG A 131 11.660 -15.167 20.393 1.00 11.23 C ATOM 2008 NH1 ARG A 131 11.770 -16.295 19.702 1.00 4.13 N ATOM 2009 NH2 ARG A 131 10.684 -15.050 21.285 1.00 35.34 N ATOM 0 H ARG A 131 16.917 -12.768 17.017 1.00 64.32 H new ATOM 0 HA ARG A 131 17.619 -12.817 19.887 1.00 62.01 H new ATOM 0 HB2 ARG A 131 15.872 -14.742 18.298 1.00 42.05 H new ATOM 0 HB3 ARG A 131 16.346 -14.950 19.973 1.00 42.05 H new ATOM 0 HG2 ARG A 131 14.856 -13.346 20.746 1.00 5.50 H new ATOM 0 HG3 ARG A 131 14.849 -12.455 19.237 1.00 5.50 H new ATOM 0 HD2 ARG A 131 13.291 -13.842 18.248 1.00 40.51 H new ATOM 0 HD3 ARG A 131 13.880 -15.273 19.069 1.00 40.51 H new ATOM 0 HE ARG A 131 12.344 -13.269 20.659 1.00 52.12 H new ATOM 0 HH11 ARG A 131 12.493 -16.387 18.988 1.00 4.13 H new ATOM 0 HH12 ARG A 131 11.132 -17.069 19.885 1.00 4.13 H new ATOM 0 HH21 ARG A 131 10.564 -14.177 21.799 1.00 35.34 H new ATOM 0 HH22 ARG A 131 10.054 -15.833 21.457 1.00 35.34 H new ATOM 2023 N VAL A 132 19.511 -14.430 19.292 1.00 11.02 N ATOM 2024 CA VAL A 132 20.528 -15.429 18.972 1.00 5.10 C ATOM 2025 C VAL A 132 20.152 -16.781 19.587 1.00 33.21 C ATOM 2026 O VAL A 132 19.776 -16.861 20.758 1.00 3.30 O ATOM 2027 CB VAL A 132 21.940 -15.008 19.443 1.00 62.13 C ATOM 2028 CG1 VAL A 132 21.988 -14.853 20.948 1.00 71.10 C ATOM 2029 CG2 VAL A 132 22.982 -16.014 18.981 1.00 30.42 C ATOM 0 H VAL A 132 19.686 -13.890 20.140 1.00 11.02 H new ATOM 0 HA VAL A 132 20.562 -15.515 17.886 1.00 5.10 H new ATOM 0 HB VAL A 132 22.168 -14.041 18.994 1.00 62.13 H new ATOM 0 HG11 VAL A 132 22.992 -14.557 21.251 1.00 71.10 H new ATOM 0 HG12 VAL A 132 21.275 -14.089 21.258 1.00 71.10 H new ATOM 0 HG13 VAL A 132 21.732 -15.802 21.420 1.00 71.10 H new ATOM 0 HG21 VAL A 132 23.968 -15.699 19.323 1.00 30.42 H new ATOM 0 HG22 VAL A 132 22.750 -16.995 19.396 1.00 30.42 H new ATOM 0 HG23 VAL A 132 22.976 -16.070 17.892 1.00 30.42 H new ATOM 2039 N CYS A 133 20.239 -17.841 18.798 1.00 20.22 N ATOM 2040 CA CYS A 133 19.842 -19.160 19.264 1.00 42.42 C ATOM 2041 C CYS A 133 20.809 -20.232 18.768 1.00 43.32 C ATOM 2042 O CYS A 133 21.452 -20.058 17.732 1.00 13.41 O ATOM 2043 CB CYS A 133 18.416 -19.468 18.796 1.00 31.45 C ATOM 2044 SG CYS A 133 17.731 -20.999 19.469 1.00 40.54 S ATOM 0 H CYS A 133 20.579 -17.814 17.837 1.00 20.22 H new ATOM 0 HA CYS A 133 19.870 -19.164 20.354 1.00 42.42 H new ATOM 0 HB2 CYS A 133 17.767 -18.639 19.076 1.00 31.45 H new ATOM 0 HB3 CYS A 133 18.407 -19.527 17.708 1.00 31.45 H new ATOM 0 HG CYS A 133 16.524 -21.170 19.017 1.00 40.54 H new ATOM 2050 N GLN A 134 20.917 -21.318 19.548 1.00 24.44 N ATOM 2051 CA GLN A 134 21.742 -22.500 19.228 1.00 74.43 C ATOM 2052 C GLN A 134 23.111 -22.137 18.638 1.00 41.11 C ATOM 2053 O GLN A 134 23.656 -22.858 17.804 1.00 54.03 O ATOM 2054 CB GLN A 134 20.993 -23.469 18.303 1.00 64.12 C ATOM 2055 CG GLN A 134 20.813 -22.976 16.881 1.00 1.41 C ATOM 2056 CD GLN A 134 20.560 -24.107 15.911 1.00 65.45 C ATOM 2057 OE1 GLN A 134 19.419 -24.453 15.609 1.00 33.15 O ATOM 2058 NE2 GLN A 134 21.639 -24.713 15.446 1.00 53.45 N ATOM 0 H GLN A 134 20.425 -21.404 20.437 1.00 24.44 H new ATOM 0 HA GLN A 134 21.932 -23.000 20.178 1.00 74.43 H new ATOM 0 HB2 GLN A 134 21.531 -24.416 18.279 1.00 64.12 H new ATOM 0 HB3 GLN A 134 20.011 -23.671 18.730 1.00 64.12 H new ATOM 0 HG2 GLN A 134 19.979 -22.275 16.844 1.00 1.41 H new ATOM 0 HG3 GLN A 134 21.704 -22.428 16.573 1.00 1.41 H new ATOM 0 HE21 GLN A 134 22.565 -24.390 15.725 1.00 53.45 H new ATOM 0 HE22 GLN A 134 21.545 -25.503 14.808 1.00 53.45 H new ATOM 2067 N GLY A 135 23.681 -21.040 19.113 1.00 11.43 N ATOM 2068 CA GLY A 135 24.971 -20.608 18.619 1.00 71.54 C ATOM 2069 C GLY A 135 25.672 -19.675 19.581 1.00 34.53 C ATOM 2070 O GLY A 135 26.639 -19.010 19.216 1.00 15.43 O ATOM 0 H GLY A 135 23.273 -20.442 19.831 1.00 11.43 H new ATOM 0 HA2 GLY A 135 25.599 -21.480 18.440 1.00 71.54 H new ATOM 0 HA3 GLY A 135 24.841 -20.106 17.660 1.00 71.54 H new ATOM 2074 N ILE A 136 25.202 -19.642 20.821 1.00 4.41 N ATOM 2075 CA ILE A 136 25.714 -18.689 21.796 1.00 43.23 C ATOM 2076 C ILE A 136 27.120 -19.077 22.239 1.00 44.12 C ATOM 2077 O ILE A 136 27.954 -18.213 22.504 1.00 61.22 O ATOM 2078 CB ILE A 136 24.783 -18.569 23.025 1.00 43.34 C ATOM 2079 CG1 ILE A 136 25.192 -17.383 23.902 1.00 41.32 C ATOM 2080 CG2 ILE A 136 24.790 -19.854 23.840 1.00 53.44 C ATOM 2081 CD1 ILE A 136 25.052 -16.041 23.216 1.00 31.22 C ATOM 0 H ILE A 136 24.471 -20.260 21.174 1.00 4.41 H new ATOM 0 HA ILE A 136 25.751 -17.715 21.309 1.00 43.23 H new ATOM 0 HB ILE A 136 23.770 -18.398 22.661 1.00 43.34 H new ATOM 0 HG12 ILE A 136 24.583 -17.384 24.806 1.00 41.32 H new ATOM 0 HG13 ILE A 136 26.228 -17.514 24.215 1.00 41.32 H new ATOM 0 HG21 ILE A 136 24.128 -19.744 24.699 1.00 53.44 H new ATOM 0 HG22 ILE A 136 24.445 -20.681 23.219 1.00 53.44 H new ATOM 0 HG23 ILE A 136 25.803 -20.059 24.187 1.00 53.44 H new ATOM 0 HD11 ILE A 136 25.360 -15.249 23.899 1.00 31.22 H new ATOM 0 HD12 ILE A 136 25.683 -16.019 22.327 1.00 31.22 H new ATOM 0 HD13 ILE A 136 24.012 -15.887 22.927 1.00 31.22 H new ATOM 2093 N GLY A 137 27.383 -20.380 22.299 1.00 44.21 N ATOM 2094 CA GLY A 137 28.704 -20.851 22.644 1.00 43.24 C ATOM 2095 C GLY A 137 29.734 -20.366 21.653 1.00 23.22 C ATOM 2096 O GLY A 137 30.850 -20.009 22.029 1.00 15.44 O ATOM 0 H GLY A 137 26.701 -21.115 22.114 1.00 44.21 H new ATOM 0 HA2 GLY A 137 28.966 -20.505 23.644 1.00 43.24 H new ATOM 0 HA3 GLY A 137 28.708 -21.941 22.673 1.00 43.24 H new ATOM 2100 N MET A 138 29.345 -20.322 20.382 1.00 14.32 N ATOM 2101 CA MET A 138 30.237 -19.854 19.337 1.00 42.42 C ATOM 2102 C MET A 138 30.436 -18.352 19.448 1.00 72.05 C ATOM 2103 O MET A 138 31.564 -17.878 19.448 1.00 22.14 O ATOM 2104 CB MET A 138 29.708 -20.215 17.947 1.00 64.12 C ATOM 2105 CG MET A 138 29.372 -21.687 17.780 1.00 55.13 C ATOM 2106 SD MET A 138 30.702 -22.785 18.311 1.00 3.23 S ATOM 2107 CE MET A 138 32.020 -22.303 17.202 1.00 35.03 C ATOM 0 H MET A 138 28.421 -20.605 20.056 1.00 14.32 H new ATOM 0 HA MET A 138 31.197 -20.352 19.470 1.00 42.42 H new ATOM 0 HB2 MET A 138 28.815 -19.623 17.744 1.00 64.12 H new ATOM 0 HB3 MET A 138 30.453 -19.935 17.202 1.00 64.12 H new ATOM 0 HG2 MET A 138 28.472 -21.915 18.351 1.00 55.13 H new ATOM 0 HG3 MET A 138 29.143 -21.884 16.733 1.00 55.13 H new ATOM 0 HE1 MET A 138 32.159 -23.075 16.445 1.00 35.03 H new ATOM 0 HE2 MET A 138 31.762 -21.361 16.717 1.00 35.03 H new ATOM 0 HE3 MET A 138 32.944 -22.179 17.767 1.00 35.03 H new ATOM 2117 N VAL A 139 29.340 -17.609 19.561 1.00 24.22 N ATOM 2118 CA VAL A 139 29.410 -16.154 19.739 1.00 3.42 C ATOM 2119 C VAL A 139 30.261 -15.796 20.958 1.00 10.45 C ATOM 2120 O VAL A 139 30.936 -14.770 20.979 1.00 24.13 O ATOM 2121 CB VAL A 139 27.999 -15.537 19.898 1.00 20.24 C ATOM 2122 CG1 VAL A 139 28.072 -14.032 20.109 1.00 31.24 C ATOM 2123 CG2 VAL A 139 27.139 -15.853 18.687 1.00 2.40 C ATOM 0 H VAL A 139 28.392 -17.985 19.533 1.00 24.22 H new ATOM 0 HA VAL A 139 29.873 -15.741 18.843 1.00 3.42 H new ATOM 0 HB VAL A 139 27.542 -15.981 20.782 1.00 20.24 H new ATOM 0 HG11 VAL A 139 27.064 -13.630 20.217 1.00 31.24 H new ATOM 0 HG12 VAL A 139 28.646 -13.818 21.010 1.00 31.24 H new ATOM 0 HG13 VAL A 139 28.558 -13.567 19.251 1.00 31.24 H new ATOM 0 HG21 VAL A 139 26.151 -15.411 18.817 1.00 2.40 H new ATOM 0 HG22 VAL A 139 27.606 -15.442 17.792 1.00 2.40 H new ATOM 0 HG23 VAL A 139 27.042 -16.934 18.582 1.00 2.40 H new ATOM 2133 N ASN A 140 30.255 -16.673 21.947 1.00 72.34 N ATOM 2134 CA ASN A 140 31.022 -16.459 23.164 1.00 21.44 C ATOM 2135 C ASN A 140 32.511 -16.606 22.890 1.00 65.32 C ATOM 2136 O ASN A 140 33.304 -15.727 23.214 1.00 32.21 O ATOM 2137 CB ASN A 140 30.577 -17.444 24.254 1.00 54.01 C ATOM 2138 CG ASN A 140 31.626 -17.656 25.333 1.00 20.15 C ATOM 2139 OD1 ASN A 140 31.729 -16.884 26.283 1.00 14.33 O ATOM 2140 ND2 ASN A 140 32.386 -18.734 25.205 1.00 4.12 N ATOM 0 H ASN A 140 29.725 -17.544 21.931 1.00 72.34 H new ATOM 0 HA ASN A 140 30.837 -15.444 23.516 1.00 21.44 H new ATOM 0 HB2 ASN A 140 29.660 -17.076 24.715 1.00 54.01 H new ATOM 0 HB3 ASN A 140 30.340 -18.403 23.793 1.00 54.01 H new ATOM 0 HD21 ASN A 140 33.090 -18.949 25.912 1.00 4.12 H new ATOM 0 HD22 ASN A 140 32.267 -19.349 24.400 1.00 4.12 H new ATOM 2147 N ARG A 141 32.877 -17.709 22.262 1.00 24.34 N ATOM 2148 CA ARG A 141 34.277 -17.997 21.978 1.00 14.22 C ATOM 2149 C ARG A 141 34.791 -17.163 20.803 1.00 63.34 C ATOM 2150 O ARG A 141 35.994 -17.079 20.568 1.00 24.24 O ATOM 2151 CB ARG A 141 34.454 -19.493 21.707 1.00 12.45 C ATOM 2152 CG ARG A 141 33.564 -20.014 20.594 1.00 42.41 C ATOM 2153 CD ARG A 141 34.318 -20.161 19.281 1.00 24.23 C ATOM 2154 NE ARG A 141 35.171 -21.347 19.282 1.00 60.33 N ATOM 2155 CZ ARG A 141 35.813 -21.813 18.211 1.00 64.13 C ATOM 2156 NH1 ARG A 141 35.763 -21.159 17.058 1.00 44.02 N ATOM 2157 NH2 ARG A 141 36.515 -22.933 18.299 1.00 4.22 N ATOM 0 H ARG A 141 32.225 -18.423 21.937 1.00 24.34 H new ATOM 0 HA ARG A 141 34.870 -17.724 22.851 1.00 14.22 H new ATOM 0 HB2 ARG A 141 35.495 -19.687 21.450 1.00 12.45 H new ATOM 0 HB3 ARG A 141 34.242 -20.048 22.621 1.00 12.45 H new ATOM 0 HG2 ARG A 141 33.149 -20.980 20.884 1.00 42.41 H new ATOM 0 HG3 ARG A 141 32.723 -19.335 20.455 1.00 42.41 H new ATOM 0 HD2 ARG A 141 33.607 -20.224 18.457 1.00 24.23 H new ATOM 0 HD3 ARG A 141 34.927 -19.274 19.109 1.00 24.23 H new ATOM 0 HE ARG A 141 35.283 -21.852 20.161 1.00 60.33 H new ATOM 0 HH11 ARG A 141 35.230 -20.292 16.986 1.00 44.02 H new ATOM 0 HH12 ARG A 141 36.257 -21.523 16.243 1.00 44.02 H new ATOM 0 HH21 ARG A 141 36.563 -23.436 19.185 1.00 4.22 H new ATOM 0 HH22 ARG A 141 37.007 -23.292 17.481 1.00 4.22 H new ATOM 2171 N VAL A 142 33.873 -16.555 20.064 1.00 1.50 N ATOM 2172 CA VAL A 142 34.241 -15.655 18.976 1.00 43.03 C ATOM 2173 C VAL A 142 34.326 -14.224 19.493 1.00 21.03 C ATOM 2174 O VAL A 142 35.068 -13.404 18.967 1.00 0.32 O ATOM 2175 CB VAL A 142 33.239 -15.738 17.793 1.00 71.14 C ATOM 2176 CG1 VAL A 142 33.518 -14.672 16.745 1.00 62.13 C ATOM 2177 CG2 VAL A 142 33.286 -17.116 17.152 1.00 4.30 C ATOM 0 H VAL A 142 32.868 -16.668 20.197 1.00 1.50 H new ATOM 0 HA VAL A 142 35.216 -15.966 18.602 1.00 43.03 H new ATOM 0 HB VAL A 142 32.242 -15.562 18.197 1.00 71.14 H new ATOM 0 HG11 VAL A 142 32.796 -14.762 15.933 1.00 62.13 H new ATOM 0 HG12 VAL A 142 33.432 -13.685 17.199 1.00 62.13 H new ATOM 0 HG13 VAL A 142 34.526 -14.804 16.351 1.00 62.13 H new ATOM 0 HG21 VAL A 142 32.578 -17.157 16.325 1.00 4.30 H new ATOM 0 HG22 VAL A 142 34.292 -17.309 16.779 1.00 4.30 H new ATOM 0 HG23 VAL A 142 33.023 -17.871 17.893 1.00 4.30 H new ATOM 2187 N GLY A 143 33.575 -13.938 20.543 1.00 32.40 N ATOM 2188 CA GLY A 143 33.600 -12.612 21.127 1.00 62.43 C ATOM 2189 C GLY A 143 34.589 -12.486 22.267 1.00 63.34 C ATOM 2190 O GLY A 143 34.821 -11.390 22.774 1.00 73.30 O ATOM 0 H GLY A 143 32.948 -14.599 21.003 1.00 32.40 H new ATOM 0 HA2 GLY A 143 33.850 -11.885 20.354 1.00 62.43 H new ATOM 0 HA3 GLY A 143 32.603 -12.362 21.489 1.00 62.43 H new ATOM 2194 N MET A 144 35.163 -13.605 22.683 1.00 5.54 N ATOM 2195 CA MET A 144 36.153 -13.590 23.753 1.00 10.42 C ATOM 2196 C MET A 144 37.534 -13.291 23.192 1.00 3.31 C ATOM 2197 O MET A 144 38.477 -13.037 23.941 1.00 45.00 O ATOM 2198 CB MET A 144 36.179 -14.926 24.502 1.00 13.22 C ATOM 2199 CG MET A 144 36.703 -16.082 23.666 1.00 34.11 C ATOM 2200 SD MET A 144 36.794 -17.632 24.584 1.00 65.22 S ATOM 2201 CE MET A 144 37.999 -17.198 25.834 1.00 4.53 C ATOM 0 H MET A 144 34.963 -14.529 22.300 1.00 5.54 H new ATOM 0 HA MET A 144 35.871 -12.806 24.455 1.00 10.42 H new ATOM 0 HB2 MET A 144 36.799 -14.822 25.392 1.00 13.22 H new ATOM 0 HB3 MET A 144 35.171 -15.162 24.842 1.00 13.22 H new ATOM 0 HG2 MET A 144 36.057 -16.218 22.798 1.00 34.11 H new ATOM 0 HG3 MET A 144 37.694 -15.831 23.289 1.00 34.11 H new ATOM 0 HE1 MET A 144 38.445 -18.106 26.240 1.00 4.53 H new ATOM 0 HE2 MET A 144 38.778 -16.578 25.389 1.00 4.53 H new ATOM 0 HE3 MET A 144 37.509 -16.645 26.635 1.00 4.53 H new ATOM 2211 N VAL A 145 37.652 -13.328 21.871 1.00 2.22 N ATOM 2212 CA VAL A 145 38.925 -13.064 21.223 1.00 14.24 C ATOM 2213 C VAL A 145 39.184 -11.570 21.133 1.00 14.23 C ATOM 2214 O VAL A 145 38.271 -10.755 21.271 1.00 51.25 O ATOM 2215 CB VAL A 145 39.000 -13.662 19.803 1.00 31.04 C ATOM 2216 CG1 VAL A 145 38.790 -15.162 19.828 1.00 42.42 C ATOM 2217 CG2 VAL A 145 37.994 -13.001 18.877 1.00 64.35 C ATOM 0 H VAL A 145 36.885 -13.537 21.232 1.00 2.22 H new ATOM 0 HA VAL A 145 39.685 -13.543 21.840 1.00 14.24 H new ATOM 0 HB VAL A 145 40.000 -13.465 19.418 1.00 31.04 H new ATOM 0 HG11 VAL A 145 38.848 -15.555 18.813 1.00 42.42 H new ATOM 0 HG12 VAL A 145 39.561 -15.627 20.442 1.00 42.42 H new ATOM 0 HG13 VAL A 145 37.809 -15.385 20.247 1.00 42.42 H new ATOM 0 HG21 VAL A 145 38.069 -13.442 17.883 1.00 64.35 H new ATOM 0 HG22 VAL A 145 36.987 -13.153 19.266 1.00 64.35 H new ATOM 0 HG23 VAL A 145 38.202 -11.933 18.816 1.00 64.35 H new ATOM 2388 N VAL A 157 37.131 -13.196 10.465 1.00 13.44 N ATOM 2389 CA VAL A 157 36.023 -14.084 10.816 1.00 21.42 C ATOM 2390 C VAL A 157 34.892 -13.840 9.826 1.00 42.11 C ATOM 2391 O VAL A 157 34.425 -12.714 9.688 1.00 45.12 O ATOM 2392 CB VAL A 157 35.493 -13.863 12.255 1.00 45.55 C ATOM 2393 CG1 VAL A 157 34.474 -14.936 12.614 1.00 65.41 C ATOM 2394 CG2 VAL A 157 36.624 -13.847 13.271 1.00 73.14 C ATOM 0 HA VAL A 157 36.392 -15.109 10.772 1.00 21.42 H new ATOM 0 HB VAL A 157 35.007 -12.888 12.284 1.00 45.55 H new ATOM 0 HG11 VAL A 157 34.110 -14.768 13.628 1.00 65.41 H new ATOM 0 HG12 VAL A 157 33.638 -14.891 11.916 1.00 65.41 H new ATOM 0 HG13 VAL A 157 34.944 -15.918 12.555 1.00 65.41 H new ATOM 0 HG21 VAL A 157 36.215 -13.690 14.269 1.00 73.14 H new ATOM 0 HG22 VAL A 157 37.153 -14.800 13.242 1.00 73.14 H new ATOM 0 HG23 VAL A 157 37.317 -13.040 13.032 1.00 73.14 H new ATOM 2404 N LYS A 158 34.450 -14.879 9.128 1.00 42.22 N ATOM 2405 CA LYS A 158 33.566 -14.677 7.988 1.00 40.30 C ATOM 2406 C LYS A 158 32.315 -15.525 8.101 1.00 10.44 C ATOM 2407 O LYS A 158 32.321 -16.586 8.735 1.00 13.12 O ATOM 2408 CB LYS A 158 34.274 -15.013 6.665 1.00 52.34 C ATOM 2409 CG LYS A 158 35.571 -14.250 6.427 1.00 31.11 C ATOM 2410 CD LYS A 158 36.730 -14.860 7.197 1.00 63.45 C ATOM 2411 CE LYS A 158 37.111 -16.231 6.653 1.00 62.14 C ATOM 2412 NZ LYS A 158 38.141 -16.902 7.492 1.00 41.42 N ATOM 0 H LYS A 158 34.684 -15.852 9.326 1.00 42.22 H new ATOM 0 HA LYS A 158 33.288 -13.623 7.992 1.00 40.30 H new ATOM 0 HB2 LYS A 158 34.488 -16.082 6.644 1.00 52.34 H new ATOM 0 HB3 LYS A 158 33.591 -14.808 5.841 1.00 52.34 H new ATOM 0 HG2 LYS A 158 35.802 -14.248 5.362 1.00 31.11 H new ATOM 0 HG3 LYS A 158 35.442 -13.210 6.727 1.00 31.11 H new ATOM 0 HD2 LYS A 158 37.592 -14.195 7.143 1.00 63.45 H new ATOM 0 HD3 LYS A 158 36.461 -14.948 8.250 1.00 63.45 H new ATOM 0 HE2 LYS A 158 36.222 -16.859 6.601 1.00 62.14 H new ATOM 0 HE3 LYS A 158 37.487 -16.125 5.635 1.00 62.14 H new ATOM 0 HZ1 LYS A 158 38.369 -17.831 7.084 1.00 41.42 H new ATOM 0 HZ2 LYS A 158 39.000 -16.316 7.522 1.00 41.42 H new ATOM 0 HZ3 LYS A 158 37.774 -17.028 8.457 1.00 41.42 H new ATOM 2426 N ILE A 159 31.250 -15.042 7.483 1.00 62.14 N ATOM 2427 CA ILE A 159 30.028 -15.810 7.339 1.00 45.15 C ATOM 2428 C ILE A 159 30.108 -16.604 6.043 1.00 34.11 C ATOM 2429 O ILE A 159 30.086 -16.033 4.954 1.00 14.23 O ATOM 2430 CB ILE A 159 28.761 -14.915 7.319 1.00 4.23 C ATOM 2431 CG1 ILE A 159 28.559 -14.203 8.662 1.00 24.23 C ATOM 2432 CG2 ILE A 159 27.527 -15.737 6.976 1.00 3.13 C ATOM 2433 CD1 ILE A 159 29.425 -12.977 8.855 1.00 31.01 C ATOM 0 H ILE A 159 31.209 -14.111 7.069 1.00 62.14 H new ATOM 0 HA ILE A 159 29.940 -16.470 8.202 1.00 45.15 H new ATOM 0 HB ILE A 159 28.907 -14.157 6.549 1.00 4.23 H new ATOM 0 HG12 ILE A 159 27.512 -13.912 8.751 1.00 24.23 H new ATOM 0 HG13 ILE A 159 28.763 -14.908 9.468 1.00 24.23 H new ATOM 0 HG21 ILE A 159 26.650 -15.090 6.967 1.00 3.13 H new ATOM 0 HG22 ILE A 159 27.653 -16.190 5.993 1.00 3.13 H new ATOM 0 HG23 ILE A 159 27.393 -16.520 7.722 1.00 3.13 H new ATOM 0 HD11 ILE A 159 29.218 -12.535 9.830 1.00 31.01 H new ATOM 0 HD12 ILE A 159 30.476 -13.262 8.801 1.00 31.01 H new ATOM 0 HD13 ILE A 159 29.205 -12.250 8.073 1.00 31.01 H new ATOM 2445 N ILE A 160 30.243 -17.911 6.170 1.00 33.14 N ATOM 2446 CA ILE A 160 30.422 -18.780 5.018 1.00 3.44 C ATOM 2447 C ILE A 160 29.097 -18.992 4.292 1.00 52.33 C ATOM 2448 O ILE A 160 28.999 -18.801 3.078 1.00 22.22 O ATOM 2449 CB ILE A 160 30.998 -20.145 5.450 1.00 62.21 C ATOM 2450 CG1 ILE A 160 32.203 -19.947 6.377 1.00 1.31 C ATOM 2451 CG2 ILE A 160 31.383 -20.977 4.237 1.00 71.34 C ATOM 2452 CD1 ILE A 160 33.321 -19.118 5.779 1.00 53.42 C ATOM 0 H ILE A 160 30.232 -18.399 7.066 1.00 33.14 H new ATOM 0 HA ILE A 160 31.125 -18.296 4.340 1.00 3.44 H new ATOM 0 HB ILE A 160 30.226 -20.685 5.998 1.00 62.21 H new ATOM 0 HG12 ILE A 160 31.864 -19.469 7.296 1.00 1.31 H new ATOM 0 HG13 ILE A 160 32.599 -20.924 6.653 1.00 1.31 H new ATOM 0 HG21 ILE A 160 31.787 -21.935 4.566 1.00 71.34 H new ATOM 0 HG22 ILE A 160 30.502 -21.148 3.618 1.00 71.34 H new ATOM 0 HG23 ILE A 160 32.137 -20.446 3.656 1.00 71.34 H new ATOM 0 HD11 ILE A 160 34.133 -19.028 6.501 1.00 53.42 H new ATOM 0 HD12 ILE A 160 33.691 -19.603 4.876 1.00 53.42 H new ATOM 0 HD13 ILE A 160 32.945 -18.126 5.530 1.00 53.42 H new ATOM 2464 N LYS A 161 28.086 -19.389 5.051 1.00 52.22 N ATOM 2465 CA LYS A 161 26.745 -19.594 4.520 1.00 71.14 C ATOM 2466 C LYS A 161 25.722 -18.904 5.406 1.00 34.24 C ATOM 2467 O LYS A 161 25.728 -19.078 6.619 1.00 3.14 O ATOM 2468 CB LYS A 161 26.396 -21.084 4.426 1.00 43.21 C ATOM 2469 CG LYS A 161 26.855 -21.776 3.151 1.00 53.10 C ATOM 2470 CD LYS A 161 28.324 -22.149 3.204 1.00 21.11 C ATOM 2471 CE LYS A 161 28.542 -23.602 2.816 1.00 14.23 C ATOM 2472 NZ LYS A 161 27.845 -24.530 3.744 1.00 63.43 N ATOM 0 H LYS A 161 28.171 -19.578 6.050 1.00 52.22 H new ATOM 0 HA LYS A 161 26.723 -19.168 3.517 1.00 71.14 H new ATOM 0 HB2 LYS A 161 26.837 -21.599 5.279 1.00 43.21 H new ATOM 0 HB3 LYS A 161 25.315 -21.194 4.511 1.00 43.21 H new ATOM 0 HG2 LYS A 161 26.258 -22.674 2.991 1.00 53.10 H new ATOM 0 HG3 LYS A 161 26.678 -21.120 2.299 1.00 53.10 H new ATOM 0 HD2 LYS A 161 28.889 -21.503 2.532 1.00 21.11 H new ATOM 0 HD3 LYS A 161 28.708 -21.978 4.210 1.00 21.11 H new ATOM 0 HE2 LYS A 161 28.182 -23.765 1.800 1.00 14.23 H new ATOM 0 HE3 LYS A 161 29.610 -23.822 2.815 1.00 14.23 H new ATOM 0 HZ1 LYS A 161 28.313 -25.459 3.723 1.00 63.43 H new ATOM 0 HZ2 LYS A 161 27.881 -24.147 4.710 1.00 63.43 H new ATOM 0 HZ3 LYS A 161 26.853 -24.635 3.450 1.00 63.43 H new ATOM 2486 N ALA A 162 24.851 -18.121 4.804 1.00 53.32 N ATOM 2487 CA ALA A 162 23.803 -17.450 5.549 1.00 45.20 C ATOM 2488 C ALA A 162 22.507 -17.443 4.766 1.00 60.11 C ATOM 2489 O ALA A 162 22.390 -16.770 3.741 1.00 22.10 O ATOM 2490 CB ALA A 162 24.218 -16.037 5.899 1.00 3.20 C ATOM 0 H ALA A 162 24.847 -17.933 3.802 1.00 53.32 H new ATOM 0 HA ALA A 162 23.640 -18.001 6.475 1.00 45.20 H new ATOM 0 HB1 ALA A 162 23.418 -15.551 6.458 1.00 3.20 H new ATOM 0 HB2 ALA A 162 25.122 -16.063 6.508 1.00 3.20 H new ATOM 0 HB3 ALA A 162 24.413 -15.478 4.984 1.00 3.20 H new ATOM 2496 N TYR A 163 21.542 -18.201 5.255 1.00 71.32 N ATOM 2497 CA TYR A 163 20.251 -18.329 4.594 1.00 44.44 C ATOM 2498 C TYR A 163 19.152 -18.479 5.638 1.00 1.45 C ATOM 2499 O TYR A 163 19.420 -18.907 6.762 1.00 34.40 O ATOM 2500 CB TYR A 163 20.233 -19.543 3.649 1.00 3.41 C ATOM 2501 CG TYR A 163 21.208 -19.453 2.493 1.00 34.31 C ATOM 2502 CD1 TYR A 163 20.980 -18.587 1.430 1.00 25.11 C ATOM 2503 CD2 TYR A 163 22.355 -20.237 2.465 1.00 23.34 C ATOM 2504 CE1 TYR A 163 21.865 -18.507 0.371 1.00 63.24 C ATOM 2505 CE2 TYR A 163 23.246 -20.163 1.411 1.00 40.54 C ATOM 2506 CZ TYR A 163 22.998 -19.297 0.368 1.00 42.21 C ATOM 2507 OH TYR A 163 23.883 -19.221 -0.686 1.00 23.22 O ATOM 0 H TYR A 163 21.627 -18.743 6.115 1.00 71.32 H new ATOM 0 HA TYR A 163 20.078 -17.429 4.003 1.00 44.44 H new ATOM 0 HB2 TYR A 163 20.455 -20.440 4.226 1.00 3.41 H new ATOM 0 HB3 TYR A 163 19.226 -19.662 3.250 1.00 3.41 H new ATOM 0 HD1 TYR A 163 20.096 -17.966 1.431 1.00 25.11 H new ATOM 0 HD2 TYR A 163 22.554 -20.916 3.281 1.00 23.34 H new ATOM 0 HE1 TYR A 163 21.672 -17.831 -0.449 1.00 63.24 H new ATOM 0 HE2 TYR A 163 24.132 -20.781 1.405 1.00 40.54 H new ATOM 0 HH TYR A 163 24.627 -19.840 -0.534 1.00 23.22 H new ATOM 2517 N PRO A 164 17.908 -18.108 5.298 1.00 41.43 N ATOM 2518 CA PRO A 164 16.763 -18.307 6.186 1.00 53.12 C ATOM 2519 C PRO A 164 16.429 -19.789 6.338 1.00 2.23 C ATOM 2520 O PRO A 164 16.452 -20.544 5.364 1.00 33.23 O ATOM 2521 CB PRO A 164 15.626 -17.558 5.485 1.00 61.33 C ATOM 2522 CG PRO A 164 16.018 -17.524 4.050 1.00 62.21 C ATOM 2523 CD PRO A 164 17.521 -17.460 4.031 1.00 75.44 C ATOM 0 HA PRO A 164 16.950 -17.945 7.197 1.00 53.12 H new ATOM 0 HB2 PRO A 164 14.673 -18.069 5.622 1.00 61.33 H new ATOM 0 HB3 PRO A 164 15.509 -16.551 5.887 1.00 61.33 H new ATOM 0 HG2 PRO A 164 15.659 -18.410 3.527 1.00 62.21 H new ATOM 0 HG3 PRO A 164 15.584 -16.659 3.548 1.00 62.21 H new ATOM 0 HD2 PRO A 164 17.934 -17.984 3.169 1.00 75.44 H new ATOM 0 HD3 PRO A 164 17.879 -16.432 3.980 1.00 75.44 H new ATOM 2531 N SER A 165 16.131 -20.208 7.558 1.00 41.22 N ATOM 2532 CA SER A 165 15.854 -21.608 7.831 1.00 73.53 C ATOM 2533 C SER A 165 14.645 -21.754 8.749 1.00 52.11 C ATOM 2534 O SER A 165 14.365 -20.881 9.572 1.00 32.21 O ATOM 2535 CB SER A 165 17.078 -22.275 8.465 1.00 32.13 C ATOM 2536 OG SER A 165 17.006 -23.689 8.360 1.00 45.33 O ATOM 0 H SER A 165 16.075 -19.598 8.374 1.00 41.22 H new ATOM 0 HA SER A 165 15.629 -22.101 6.886 1.00 73.53 H new ATOM 0 HB2 SER A 165 17.984 -21.917 7.976 1.00 32.13 H new ATOM 0 HB3 SER A 165 17.148 -21.989 9.514 1.00 32.13 H new ATOM 0 HG SER A 165 17.801 -24.088 8.771 1.00 45.33 H new ATOM 2684 N ASP A 184 22.002 -24.506 22.819 1.00 41.24 N ATOM 2685 CA ASP A 184 22.543 -23.162 22.928 1.00 41.43 C ATOM 2686 C ASP A 184 21.439 -22.132 22.766 1.00 64.22 C ATOM 2687 O ASP A 184 20.308 -22.457 22.406 1.00 54.22 O ATOM 2688 CB ASP A 184 23.613 -22.894 21.866 1.00 21.02 C ATOM 2689 CG ASP A 184 24.969 -23.490 22.177 1.00 3.33 C ATOM 2690 OD1 ASP A 184 25.123 -24.725 22.093 1.00 31.14 O ATOM 2691 OD2 ASP A 184 25.898 -22.713 22.474 1.00 10.52 O ATOM 0 HA ASP A 184 22.995 -23.081 23.916 1.00 41.43 H new ATOM 0 HB2 ASP A 184 23.267 -23.290 20.911 1.00 21.02 H new ATOM 0 HB3 ASP A 184 23.723 -21.817 21.743 1.00 21.02 H new ATOM 2696 N GLY A 185 21.798 -20.889 23.000 1.00 64.12 N ATOM 2697 CA GLY A 185 20.874 -19.789 22.854 1.00 60.52 C ATOM 2698 C GLY A 185 21.289 -18.619 23.709 1.00 34.04 C ATOM 2699 O GLY A 185 21.831 -18.811 24.799 1.00 44.02 O ATOM 0 H GLY A 185 22.735 -20.614 23.296 1.00 64.12 H new ATOM 0 HA2 GLY A 185 20.830 -19.483 21.809 1.00 60.52 H new ATOM 0 HA3 GLY A 185 19.871 -20.112 23.135 1.00 60.52 H new ATOM 2703 N GLY A 186 21.074 -17.413 23.213 1.00 64.31 N ATOM 2704 CA GLY A 186 21.456 -16.238 23.964 1.00 52.13 C ATOM 2705 C GLY A 186 20.446 -15.883 25.031 1.00 64.13 C ATOM 2706 O GLY A 186 19.568 -16.682 25.362 1.00 0.11 O ATOM 0 H GLY A 186 20.644 -17.226 22.307 1.00 64.31 H new ATOM 0 HA2 GLY A 186 22.427 -16.407 24.429 1.00 52.13 H new ATOM 0 HA3 GLY A 186 21.571 -15.396 23.282 1.00 52.13 H new ATOM 2710 N ALA A 187 20.574 -14.685 25.570 1.00 61.54 N ATOM 2711 CA ALA A 187 19.634 -14.197 26.562 1.00 10.40 C ATOM 2712 C ALA A 187 18.349 -13.752 25.873 1.00 63.14 C ATOM 2713 O ALA A 187 18.270 -13.745 24.643 1.00 10.13 O ATOM 2714 CB ALA A 187 20.250 -13.058 27.362 1.00 50.01 C ATOM 0 H ALA A 187 21.321 -14.031 25.337 1.00 61.54 H new ATOM 0 HA ALA A 187 19.395 -15.001 27.258 1.00 10.40 H new ATOM 0 HB1 ALA A 187 19.532 -12.703 28.102 1.00 50.01 H new ATOM 0 HB2 ALA A 187 21.148 -13.413 27.868 1.00 50.01 H new ATOM 0 HB3 ALA A 187 20.512 -12.241 26.690 1.00 50.01 H new ATOM 2720 N PHE A 188 17.351 -13.364 26.647 1.00 60.01 N ATOM 2721 CA PHE A 188 16.065 -13.001 26.080 1.00 72.24 C ATOM 2722 C PHE A 188 15.816 -11.514 26.237 1.00 55.50 C ATOM 2723 O PHE A 188 15.480 -11.043 27.319 1.00 22.21 O ATOM 2724 CB PHE A 188 14.937 -13.806 26.730 1.00 25.14 C ATOM 2725 CG PHE A 188 15.018 -15.280 26.450 1.00 70.41 C ATOM 2726 CD1 PHE A 188 14.507 -15.802 25.273 1.00 41.35 C ATOM 2727 CD2 PHE A 188 15.607 -16.144 27.361 1.00 31.14 C ATOM 2728 CE1 PHE A 188 14.580 -17.156 25.009 1.00 71.22 C ATOM 2729 CE2 PHE A 188 15.683 -17.499 27.103 1.00 50.03 C ATOM 2730 CZ PHE A 188 15.169 -18.006 25.926 1.00 25.35 C ATOM 0 H PHE A 188 17.405 -13.292 27.663 1.00 60.01 H new ATOM 0 HA PHE A 188 16.083 -13.238 25.016 1.00 72.24 H new ATOM 0 HB2 PHE A 188 14.961 -13.647 27.808 1.00 25.14 H new ATOM 0 HB3 PHE A 188 13.979 -13.428 26.373 1.00 25.14 H new ATOM 0 HD1 PHE A 188 14.046 -15.142 24.553 1.00 41.35 H new ATOM 0 HD2 PHE A 188 16.011 -15.753 28.283 1.00 31.14 H new ATOM 0 HE1 PHE A 188 14.177 -17.550 24.087 1.00 71.22 H new ATOM 0 HE2 PHE A 188 16.144 -18.161 27.821 1.00 50.03 H new ATOM 0 HZ PHE A 188 15.227 -19.065 25.722 1.00 25.35 H new ATOM 2740 N PRO A 189 15.998 -10.751 25.152 1.00 43.12 N ATOM 2741 CA PRO A 189 15.762 -9.312 25.143 1.00 54.41 C ATOM 2742 C PRO A 189 14.279 -9.002 25.007 1.00 74.14 C ATOM 2743 O PRO A 189 13.834 -7.877 25.239 1.00 63.14 O ATOM 2744 CB PRO A 189 16.520 -8.817 23.901 1.00 42.03 C ATOM 2745 CG PRO A 189 17.137 -10.026 23.265 1.00 3.11 C ATOM 2746 CD PRO A 189 16.447 -11.227 23.840 1.00 45.50 C ATOM 0 HA PRO A 189 16.093 -8.835 26.065 1.00 54.41 H new ATOM 0 HB2 PRO A 189 15.843 -8.317 23.208 1.00 42.03 H new ATOM 0 HB3 PRO A 189 17.285 -8.092 24.178 1.00 42.03 H new ATOM 0 HG2 PRO A 189 17.018 -9.995 22.182 1.00 3.11 H new ATOM 0 HG3 PRO A 189 18.208 -10.063 23.467 1.00 3.11 H new ATOM 0 HD2 PRO A 189 15.611 -11.548 23.219 1.00 45.50 H new ATOM 0 HD3 PRO A 189 17.123 -12.077 23.929 1.00 45.50 H new ATOM 2754 N GLU A 190 13.521 -10.031 24.647 1.00 2.13 N ATOM 2755 CA GLU A 190 12.100 -9.889 24.369 1.00 52.40 C ATOM 2756 C GLU A 190 11.347 -9.629 25.662 1.00 62.31 C ATOM 2757 O GLU A 190 10.366 -8.886 25.694 1.00 54.31 O ATOM 2758 CB GLU A 190 11.588 -11.153 23.681 1.00 12.40 C ATOM 2759 CG GLU A 190 10.237 -10.992 23.009 1.00 21.03 C ATOM 2760 CD GLU A 190 9.907 -12.171 22.123 1.00 73.21 C ATOM 2761 OE1 GLU A 190 10.331 -12.176 20.946 1.00 0.20 O ATOM 2762 OE2 GLU A 190 9.254 -13.117 22.600 1.00 74.04 O ATOM 0 H GLU A 190 13.873 -10.982 24.540 1.00 2.13 H new ATOM 0 HA GLU A 190 11.936 -9.041 23.703 1.00 52.40 H new ATOM 0 HB2 GLU A 190 12.317 -11.468 22.935 1.00 12.40 H new ATOM 0 HB3 GLU A 190 11.521 -11.953 24.418 1.00 12.40 H new ATOM 0 HG2 GLU A 190 9.464 -10.881 23.769 1.00 21.03 H new ATOM 0 HG3 GLU A 190 10.233 -10.078 22.415 1.00 21.03 H new ATOM 2769 N ILE A 191 11.822 -10.250 26.724 1.00 44.35 N ATOM 2770 CA ILE A 191 11.334 -9.958 28.052 1.00 12.22 C ATOM 2771 C ILE A 191 12.216 -8.879 28.653 1.00 12.54 C ATOM 2772 O ILE A 191 13.359 -8.710 28.235 1.00 62.10 O ATOM 2773 CB ILE A 191 11.347 -11.207 28.954 1.00 43.13 C ATOM 2774 CG1 ILE A 191 12.788 -11.668 29.204 1.00 40.32 C ATOM 2775 CG2 ILE A 191 10.523 -12.322 28.321 1.00 64.11 C ATOM 2776 CD1 ILE A 191 12.885 -12.928 30.029 1.00 12.44 C ATOM 0 H ILE A 191 12.550 -10.964 26.689 1.00 44.35 H new ATOM 0 HA ILE A 191 10.300 -9.621 27.983 1.00 12.22 H new ATOM 0 HB ILE A 191 10.899 -10.953 29.915 1.00 43.13 H new ATOM 0 HG12 ILE A 191 13.279 -11.833 28.245 1.00 40.32 H new ATOM 0 HG13 ILE A 191 13.333 -10.870 29.709 1.00 40.32 H new ATOM 0 HG21 ILE A 191 10.540 -13.199 28.968 1.00 64.11 H new ATOM 0 HG22 ILE A 191 9.494 -11.986 28.192 1.00 64.11 H new ATOM 0 HG23 ILE A 191 10.945 -12.580 27.349 1.00 64.11 H new ATOM 0 HD11 ILE A 191 13.933 -13.194 30.165 1.00 12.44 H new ATOM 0 HD12 ILE A 191 12.423 -12.762 31.002 1.00 12.44 H new ATOM 0 HD13 ILE A 191 12.369 -13.739 29.516 1.00 12.44 H new ATOM 2788 N HIS A 192 11.708 -8.140 29.613 1.00 4.30 N ATOM 2789 CA HIS A 192 12.477 -7.042 30.167 1.00 2.54 C ATOM 2790 C HIS A 192 12.996 -7.388 31.555 1.00 42.24 C ATOM 2791 O HIS A 192 12.477 -6.919 32.566 1.00 64.14 O ATOM 2792 CB HIS A 192 11.660 -5.749 30.197 1.00 53.45 C ATOM 2793 CG HIS A 192 11.449 -5.118 28.847 1.00 54.32 C ATOM 2794 ND1 HIS A 192 11.098 -3.796 28.689 1.00 3.33 N ATOM 2795 CD2 HIS A 192 11.530 -5.632 27.594 1.00 31.12 C ATOM 2796 CE1 HIS A 192 10.972 -3.523 27.403 1.00 52.02 C ATOM 2797 NE2 HIS A 192 11.226 -4.620 26.713 1.00 74.11 N ATOM 0 H HIS A 192 10.783 -8.273 30.022 1.00 4.30 H new ATOM 0 HA HIS A 192 13.335 -6.877 29.515 1.00 2.54 H new ATOM 0 HB2 HIS A 192 10.688 -5.958 30.643 1.00 53.45 H new ATOM 0 HB3 HIS A 192 12.161 -5.031 30.846 1.00 53.45 H new ATOM 0 HD2 HIS A 192 11.786 -6.649 27.336 1.00 31.12 H new ATOM 0 HE1 HIS A 192 10.706 -2.563 26.985 1.00 52.02 H new ATOM 0 HE2 HIS A 192 11.201 -4.703 25.697 1.00 74.11 H new ATOM 2806 N VAL A 193 14.012 -8.235 31.586 1.00 34.43 N ATOM 2807 CA VAL A 193 14.665 -8.620 32.826 1.00 34.10 C ATOM 2808 C VAL A 193 16.131 -8.931 32.539 1.00 14.24 C ATOM 2809 O VAL A 193 16.466 -9.367 31.441 1.00 43.42 O ATOM 2810 CB VAL A 193 13.974 -9.845 33.479 1.00 53.23 C ATOM 2811 CG1 VAL A 193 14.274 -11.125 32.712 1.00 44.25 C ATOM 2812 CG2 VAL A 193 14.375 -9.978 34.942 1.00 63.11 C ATOM 0 H VAL A 193 14.406 -8.674 30.754 1.00 34.43 H new ATOM 0 HA VAL A 193 14.590 -7.792 33.531 1.00 34.10 H new ATOM 0 HB VAL A 193 12.897 -9.681 33.437 1.00 53.23 H new ATOM 0 HG11 VAL A 193 13.775 -11.965 33.196 1.00 44.25 H new ATOM 0 HG12 VAL A 193 13.912 -11.029 31.688 1.00 44.25 H new ATOM 0 HG13 VAL A 193 15.350 -11.299 32.702 1.00 44.25 H new ATOM 0 HG21 VAL A 193 13.878 -10.844 35.378 1.00 63.11 H new ATOM 0 HG22 VAL A 193 15.455 -10.106 35.013 1.00 63.11 H new ATOM 0 HG23 VAL A 193 14.080 -9.079 35.483 1.00 63.11 H new ATOM 2822 N ALA A 194 17.002 -8.690 33.502 1.00 51.14 N ATOM 2823 CA ALA A 194 18.424 -8.909 33.292 1.00 23.02 C ATOM 2824 C ALA A 194 18.795 -10.360 33.564 1.00 33.31 C ATOM 2825 O ALA A 194 18.627 -10.851 34.680 1.00 35.44 O ATOM 2826 CB ALA A 194 19.239 -7.974 34.169 1.00 61.22 C ATOM 0 H ALA A 194 16.754 -8.346 34.430 1.00 51.14 H new ATOM 0 HA ALA A 194 18.653 -8.692 32.249 1.00 23.02 H new ATOM 0 HB1 ALA A 194 20.301 -8.150 34.000 1.00 61.22 H new ATOM 0 HB2 ALA A 194 18.999 -6.940 33.920 1.00 61.22 H new ATOM 0 HB3 ALA A 194 19.003 -8.159 35.217 1.00 61.22 H new ATOM 2832 N GLN A 195 19.296 -11.045 32.543 1.00 24.04 N ATOM 2833 CA GLN A 195 19.719 -12.429 32.688 1.00 12.43 C ATOM 2834 C GLN A 195 20.819 -12.733 31.682 1.00 33.53 C ATOM 2835 O GLN A 195 20.905 -12.095 30.634 1.00 3.35 O ATOM 2836 CB GLN A 195 18.540 -13.409 32.523 1.00 11.52 C ATOM 2837 CG GLN A 195 18.368 -13.992 31.120 1.00 72.44 C ATOM 2838 CD GLN A 195 17.459 -13.176 30.215 1.00 25.31 C ATOM 2839 OE1 GLN A 195 16.802 -13.722 29.336 1.00 11.41 O ATOM 2840 NE2 GLN A 195 17.416 -11.874 30.413 1.00 41.24 N ATOM 0 H GLN A 195 19.419 -10.662 31.605 1.00 24.04 H new ATOM 0 HA GLN A 195 20.106 -12.564 33.698 1.00 12.43 H new ATOM 0 HB2 GLN A 195 18.671 -14.231 33.227 1.00 11.52 H new ATOM 0 HB3 GLN A 195 17.620 -12.895 32.801 1.00 11.52 H new ATOM 0 HG2 GLN A 195 19.348 -14.077 30.651 1.00 72.44 H new ATOM 0 HG3 GLN A 195 17.967 -15.002 31.205 1.00 72.44 H new ATOM 0 HE21 GLN A 195 17.976 -11.452 31.154 1.00 41.24 H new ATOM 0 HE22 GLN A 195 16.823 -11.288 29.825 1.00 41.24 H new ATOM 2849 N TYR A 196 21.665 -13.691 32.008 1.00 12.14 N ATOM 2850 CA TYR A 196 22.795 -14.021 31.159 1.00 3.40 C ATOM 2851 C TYR A 196 22.735 -15.467 30.707 1.00 42.31 C ATOM 2852 O TYR A 196 22.430 -16.356 31.498 1.00 52.21 O ATOM 2853 CB TYR A 196 24.104 -13.736 31.890 1.00 31.41 C ATOM 2854 CG TYR A 196 24.365 -12.262 32.053 1.00 53.05 C ATOM 2855 CD1 TYR A 196 23.728 -11.527 33.044 1.00 13.44 C ATOM 2856 CD2 TYR A 196 25.232 -11.604 31.201 1.00 5.24 C ATOM 2857 CE1 TYR A 196 23.948 -10.172 33.178 1.00 44.33 C ATOM 2858 CE2 TYR A 196 25.463 -10.250 31.331 1.00 4.22 C ATOM 2859 CZ TYR A 196 24.817 -9.537 32.320 1.00 40.12 C ATOM 2860 OH TYR A 196 25.038 -8.186 32.446 1.00 32.41 O ATOM 0 H TYR A 196 21.592 -14.255 32.855 1.00 12.14 H new ATOM 0 HA TYR A 196 22.749 -13.394 30.269 1.00 3.40 H new ATOM 0 HB2 TYR A 196 24.078 -14.208 32.872 1.00 31.41 H new ATOM 0 HB3 TYR A 196 24.929 -14.189 31.341 1.00 31.41 H new ATOM 0 HD1 TYR A 196 23.049 -12.024 33.721 1.00 13.44 H new ATOM 0 HD2 TYR A 196 25.736 -12.158 30.422 1.00 5.24 H new ATOM 0 HE1 TYR A 196 23.442 -9.613 33.951 1.00 44.33 H new ATOM 0 HE2 TYR A 196 26.147 -9.750 30.661 1.00 4.22 H new ATOM 0 HH TYR A 196 25.679 -7.894 31.764 1.00 32.41 H new ATOM 2870 N PRO A 197 23.042 -15.710 29.423 1.00 51.22 N ATOM 2871 CA PRO A 197 22.934 -17.039 28.815 1.00 3.23 C ATOM 2872 C PRO A 197 23.857 -18.061 29.485 1.00 63.41 C ATOM 2873 O PRO A 197 23.405 -19.099 29.966 1.00 22.41 O ATOM 2874 CB PRO A 197 23.348 -16.804 27.355 1.00 1.53 C ATOM 2875 CG PRO A 197 24.132 -15.539 27.375 1.00 2.34 C ATOM 2876 CD PRO A 197 23.522 -14.704 28.460 1.00 32.53 C ATOM 0 HA PRO A 197 21.932 -17.455 28.919 1.00 3.23 H new ATOM 0 HB2 PRO A 197 23.946 -17.633 26.976 1.00 1.53 H new ATOM 0 HB3 PRO A 197 22.476 -16.718 26.707 1.00 1.53 H new ATOM 0 HG2 PRO A 197 25.185 -15.734 27.576 1.00 2.34 H new ATOM 0 HG3 PRO A 197 24.080 -15.030 26.412 1.00 2.34 H new ATOM 0 HD2 PRO A 197 24.252 -14.031 28.910 1.00 32.53 H new ATOM 0 HD3 PRO A 197 22.708 -14.085 28.083 1.00 32.53 H new ATOM 2884 N LEU A 198 25.151 -17.756 29.531 1.00 22.10 N ATOM 2885 CA LEU A 198 26.125 -18.669 30.120 1.00 24.44 C ATOM 2886 C LEU A 198 27.169 -17.918 30.940 1.00 2.30 C ATOM 2887 O LEU A 198 28.198 -18.491 31.295 1.00 75.33 O ATOM 2888 CB LEU A 198 26.843 -19.463 29.024 1.00 1.23 C ATOM 2889 CG LEU A 198 27.749 -18.630 28.111 1.00 55.12 C ATOM 2890 CD1 LEU A 198 29.092 -19.313 27.920 1.00 54.24 C ATOM 2891 CD2 LEU A 198 27.089 -18.393 26.765 1.00 54.23 C ATOM 0 H LEU A 198 25.547 -16.889 29.170 1.00 22.10 H new ATOM 0 HA LEU A 198 25.577 -19.346 30.776 1.00 24.44 H new ATOM 0 HB2 LEU A 198 27.443 -20.242 29.494 1.00 1.23 H new ATOM 0 HB3 LEU A 198 26.095 -19.964 28.410 1.00 1.23 H new ATOM 0 HG LEU A 198 27.912 -17.665 28.591 1.00 55.12 H new ATOM 0 HD11 LEU A 198 29.720 -18.705 27.269 1.00 54.24 H new ATOM 0 HD12 LEU A 198 29.580 -19.432 28.887 1.00 54.24 H new ATOM 0 HD13 LEU A 198 28.941 -20.293 27.467 1.00 54.24 H new ATOM 0 HD21 LEU A 198 27.751 -17.800 26.135 1.00 54.23 H new ATOM 0 HD22 LEU A 198 26.891 -19.350 26.283 1.00 54.23 H new ATOM 0 HD23 LEU A 198 26.150 -17.858 26.909 1.00 54.23 H new ATOM 2903 N ASP A 199 26.889 -16.650 31.263 1.00 53.11 N ATOM 2904 CA ASP A 199 27.894 -15.770 31.864 1.00 42.11 C ATOM 2905 C ASP A 199 29.060 -15.590 30.900 1.00 32.53 C ATOM 2906 O ASP A 199 30.072 -16.286 30.951 1.00 20.23 O ATOM 2907 CB ASP A 199 28.353 -16.285 33.238 1.00 24.50 C ATOM 2908 CG ASP A 199 29.707 -15.755 33.680 1.00 41.24 C ATOM 2909 OD1 ASP A 199 29.928 -14.535 33.605 1.00 21.42 O ATOM 2910 OD2 ASP A 199 30.549 -16.563 34.121 1.00 62.34 O ATOM 0 H ASP A 199 25.979 -16.213 31.119 1.00 53.11 H new ATOM 0 HA ASP A 199 27.443 -14.794 32.042 1.00 42.11 H new ATOM 0 HB2 ASP A 199 27.607 -16.012 33.984 1.00 24.50 H new ATOM 0 HB3 ASP A 199 28.393 -17.374 33.211 1.00 24.50 H new ATOM 2915 N MET A 200 28.848 -14.699 29.955 1.00 0.20 N ATOM 2916 CA MET A 200 29.867 -14.355 28.983 1.00 4.44 C ATOM 2917 C MET A 200 30.032 -12.850 28.895 1.00 70.13 C ATOM 2918 O MET A 200 30.963 -12.353 28.266 1.00 65.21 O ATOM 2919 CB MET A 200 29.499 -14.915 27.608 1.00 64.20 C ATOM 2920 CG MET A 200 28.053 -14.640 27.222 1.00 31.43 C ATOM 2921 SD MET A 200 27.703 -14.973 25.489 1.00 42.33 S ATOM 2922 CE MET A 200 28.660 -13.676 24.716 1.00 30.43 C ATOM 0 H MET A 200 27.969 -14.194 29.838 1.00 0.20 H new ATOM 0 HA MET A 200 30.810 -14.795 29.307 1.00 4.44 H new ATOM 0 HB2 MET A 200 30.159 -14.481 26.857 1.00 64.20 H new ATOM 0 HB3 MET A 200 29.673 -15.991 27.602 1.00 64.20 H new ATOM 0 HG2 MET A 200 27.396 -15.251 27.842 1.00 31.43 H new ATOM 0 HG3 MET A 200 27.818 -13.598 27.439 1.00 31.43 H new ATOM 0 HE1 MET A 200 28.281 -13.494 23.710 1.00 30.43 H new ATOM 0 HE2 MET A 200 28.578 -12.763 25.306 1.00 30.43 H new ATOM 0 HE3 MET A 200 29.705 -13.979 24.660 1.00 30.43 H new ATOM 2932 N GLY A 201 29.117 -12.130 29.525 1.00 64.00 N ATOM 2933 CA GLY A 201 29.183 -10.691 29.507 1.00 41.13 C ATOM 2934 C GLY A 201 28.776 -10.070 30.822 1.00 63.15 C ATOM 2935 O GLY A 201 28.503 -8.876 30.878 1.00 14.22 O ATOM 0 H GLY A 201 28.332 -12.519 30.047 1.00 64.00 H new ATOM 0 HA2 GLY A 201 30.199 -10.381 29.263 1.00 41.13 H new ATOM 0 HA3 GLY A 201 28.536 -10.312 28.716 1.00 41.13 H new ATOM 2939 N ARG A 202 28.712 -10.864 31.891 1.00 33.53 N ATOM 2940 CA ARG A 202 28.329 -10.298 33.182 1.00 23.32 C ATOM 2941 C ARG A 202 29.559 -9.999 34.028 1.00 35.20 C ATOM 2942 O ARG A 202 29.585 -9.021 34.772 1.00 3.24 O ATOM 2943 CB ARG A 202 27.372 -11.223 33.938 1.00 43.25 C ATOM 2944 CG ARG A 202 27.981 -12.547 34.324 1.00 54.30 C ATOM 2945 CD ARG A 202 26.967 -13.465 34.980 1.00 41.42 C ATOM 2946 NE ARG A 202 27.508 -14.101 36.181 1.00 13.25 N ATOM 2947 CZ ARG A 202 27.114 -15.285 36.653 1.00 60.14 C ATOM 2948 NH1 ARG A 202 26.206 -16.005 36.002 1.00 63.41 N ATOM 2949 NH2 ARG A 202 27.647 -15.754 37.774 1.00 75.43 N ATOM 0 H ARG A 202 28.912 -11.864 31.892 1.00 33.53 H new ATOM 0 HA ARG A 202 27.806 -9.362 32.987 1.00 23.32 H new ATOM 0 HB2 ARG A 202 27.028 -10.716 34.839 1.00 43.25 H new ATOM 0 HB3 ARG A 202 26.493 -11.405 33.319 1.00 43.25 H new ATOM 0 HG2 ARG A 202 28.389 -13.031 33.437 1.00 54.30 H new ATOM 0 HG3 ARG A 202 28.814 -12.379 35.007 1.00 54.30 H new ATOM 0 HD2 ARG A 202 26.075 -12.895 35.241 1.00 41.42 H new ATOM 0 HD3 ARG A 202 26.658 -14.232 34.270 1.00 41.42 H new ATOM 0 HE ARG A 202 28.237 -13.605 36.693 1.00 13.25 H new ATOM 0 HH11 ARG A 202 25.804 -15.653 35.133 1.00 63.41 H new ATOM 0 HH12 ARG A 202 25.912 -16.909 36.371 1.00 63.41 H new ATOM 0 HH21 ARG A 202 28.353 -15.210 38.269 1.00 75.43 H new ATOM 0 HH22 ARG A 202 27.350 -16.658 38.140 1.00 75.43 H new ATOM 2963 N LYS A 203 30.576 -10.838 33.903 1.00 51.54 N ATOM 2964 CA LYS A 203 31.807 -10.681 34.661 1.00 51.02 C ATOM 2965 C LYS A 203 32.990 -11.176 33.844 1.00 33.22 C ATOM 2966 O LYS A 203 33.191 -12.406 33.771 1.00 73.43 O ATOM 2967 CB LYS A 203 31.737 -11.437 35.999 1.00 64.23 C ATOM 2968 CG LYS A 203 30.789 -10.823 37.028 1.00 65.43 C ATOM 2969 CD LYS A 203 31.449 -9.715 37.852 1.00 21.15 C ATOM 2970 CE LYS A 203 31.903 -8.539 36.997 1.00 61.24 C ATOM 2971 NZ LYS A 203 32.478 -7.440 37.815 1.00 51.24 N ATOM 2972 OXT LYS A 203 33.718 -10.334 33.285 1.00 0.00 O ATOM 0 H LYS A 203 30.571 -11.643 33.276 1.00 51.54 H new ATOM 0 HA LYS A 203 31.938 -9.621 34.877 1.00 51.02 H new ATOM 0 HB2 LYS A 203 31.426 -12.464 35.805 1.00 64.23 H new ATOM 0 HB3 LYS A 203 32.738 -11.483 36.428 1.00 64.23 H new ATOM 0 HG2 LYS A 203 29.916 -10.418 36.516 1.00 65.43 H new ATOM 0 HG3 LYS A 203 30.431 -11.605 37.698 1.00 65.43 H new ATOM 0 HD2 LYS A 203 30.746 -9.361 38.606 1.00 21.15 H new ATOM 0 HD3 LYS A 203 32.307 -10.125 38.384 1.00 21.15 H new ATOM 0 HE2 LYS A 203 32.646 -8.881 36.277 1.00 61.24 H new ATOM 0 HE3 LYS A 203 31.056 -8.159 36.425 1.00 61.24 H new ATOM 0 HZ1 LYS A 203 32.773 -6.661 37.192 1.00 51.24 H new ATOM 0 HZ2 LYS A 203 31.762 -7.095 38.485 1.00 51.24 H new ATOM 0 HZ3 LYS A 203 33.302 -7.794 38.341 1.00 51.24 H new