USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1129 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 MET CE :methyl -147:sc= -0.521 (180deg=0) USER MOD Set 1.2: A 110 MET CE :methyl 176:sc= -3.49! (180deg=-2.87!) USER MOD Single : A 10 SER OG : rot -12:sc= 0.67 USER MOD Single : A 11 ASN : amide:sc= -0.342 X(o=-0.34,f=-0.086) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.839 K(o=-0.84,f=-3.9) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -106:sc= 0.0521 (180deg=0) USER MOD Single : A 29 SER OG : rot 81:sc= 1.02 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 TYR OH : rot 30:sc= 0 USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 84:sc= 1.23 USER MOD Single : A 57 THR OG1 : rot -29:sc= -0.786 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -56:sc= 0.615 USER MOD Single : A 70 HIS : no HD1:sc= -1.06 X(o=-1.1,f=-1.4) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot 57:sc= 1.23 USER MOD Single : A 89 ASN : amide:sc= -0.637 K(o=-0.64,f=-3.2!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -110:sc= -0.7 (180deg=-4.54!) USER MOD Single : A 92 LYS NZ :NH3+ -142:sc= -0.398 (180deg=-1.7!) USER MOD Single : A 95 GLN : amide:sc= -0.0727 K(o=-0.073,f=-1.7!) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 152:sc= -0.168 (180deg=-1.52!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0742 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -3.81 K(o=-3.8,f=-9.2!) USER MOD Single : A 104 GLN : amide:sc= -0.0543 K(o=-0.054,f=-0.99) USER MOD Single : A 106 TYR OH : rot 66:sc= 2.51 USER MOD Single : A 107 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.288) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -1.95 X(o=-1.9,f=-1.5) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc= -0.223 X(o=-0.22,f=-0.013) USER MOD Single : A 122 LYS NZ :NH3+ -175:sc= -0.195 (180deg=-0.195) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 130 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.0042) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl -174:sc= -0.266 (180deg=-0.384) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 4.799 6.337 -8.968 1.00 74.22 N ATOM 98 CA SER A 10 5.479 7.523 -9.476 1.00 33.42 C ATOM 99 C SER A 10 5.932 7.314 -10.918 1.00 34.34 C ATOM 100 O SER A 10 5.981 8.256 -11.707 1.00 2.23 O ATOM 101 CB SER A 10 6.683 7.862 -8.595 1.00 71.11 C ATOM 102 OG SER A 10 7.170 6.709 -7.931 1.00 32.14 O ATOM 0 HA SER A 10 4.774 8.354 -9.452 1.00 33.42 H new ATOM 0 HB2 SER A 10 7.475 8.295 -9.207 1.00 71.11 H new ATOM 0 HB3 SER A 10 6.399 8.616 -7.861 1.00 71.11 H new ATOM 0 HG SER A 10 6.521 5.981 -8.022 1.00 32.14 H new ATOM 108 N ASN A 11 6.261 6.071 -11.253 1.00 62.35 N ATOM 109 CA ASN A 11 6.711 5.737 -12.600 1.00 31.50 C ATOM 110 C ASN A 11 5.619 6.025 -13.626 1.00 11.25 C ATOM 111 O ASN A 11 5.904 6.296 -14.792 1.00 64.31 O ATOM 112 CB ASN A 11 7.118 4.264 -12.673 1.00 64.42 C ATOM 113 CG ASN A 11 7.707 3.893 -14.021 1.00 34.32 C ATOM 114 OD1 ASN A 11 7.324 2.889 -14.623 1.00 0.24 O ATOM 115 ND2 ASN A 11 8.643 4.703 -14.501 1.00 55.30 N ATOM 0 H ASN A 11 6.225 5.279 -10.611 1.00 62.35 H new ATOM 0 HA ASN A 11 7.576 6.359 -12.832 1.00 31.50 H new ATOM 0 HB2 ASN A 11 7.847 4.052 -11.890 1.00 64.42 H new ATOM 0 HB3 ASN A 11 6.247 3.639 -12.476 1.00 64.42 H new ATOM 0 HD21 ASN A 11 9.076 4.504 -15.403 1.00 55.30 H new ATOM 0 HD22 ASN A 11 8.929 5.524 -13.968 1.00 55.30 H new ATOM 122 N ASP A 12 4.368 5.966 -13.182 1.00 1.21 N ATOM 123 CA ASP A 12 3.232 6.223 -14.060 1.00 65.11 C ATOM 124 C ASP A 12 2.839 7.696 -14.023 1.00 12.22 C ATOM 125 O ASP A 12 2.295 8.230 -14.990 1.00 32.40 O ATOM 126 CB ASP A 12 2.041 5.353 -13.656 1.00 0.42 C ATOM 127 CG ASP A 12 1.413 4.644 -14.840 1.00 5.33 C ATOM 128 OD1 ASP A 12 1.138 5.316 -15.856 1.00 64.13 O ATOM 129 OD2 ASP A 12 1.198 3.418 -14.750 1.00 62.32 O ATOM 0 H ASP A 12 4.115 5.743 -12.219 1.00 1.21 H new ATOM 0 HA ASP A 12 3.527 5.970 -15.079 1.00 65.11 H new ATOM 0 HB2 ASP A 12 2.367 4.613 -12.925 1.00 0.42 H new ATOM 0 HB3 ASP A 12 1.290 5.974 -13.168 1.00 0.42 H new ATOM 134 N LYS A 13 3.116 8.349 -12.899 1.00 41.13 N ATOM 135 CA LYS A 13 2.792 9.761 -12.734 1.00 53.13 C ATOM 136 C LYS A 13 3.541 10.614 -13.753 1.00 54.12 C ATOM 137 O LYS A 13 2.933 11.372 -14.510 1.00 21.33 O ATOM 138 CB LYS A 13 3.136 10.222 -11.316 1.00 54.21 C ATOM 139 CG LYS A 13 1.984 10.911 -10.604 1.00 71.43 C ATOM 140 CD LYS A 13 2.285 11.119 -9.130 1.00 13.34 C ATOM 141 CE LYS A 13 2.397 12.597 -8.787 1.00 50.14 C ATOM 142 NZ LYS A 13 1.063 13.215 -8.553 1.00 54.11 N ATOM 0 H LYS A 13 3.565 7.922 -12.088 1.00 41.13 H new ATOM 0 HA LYS A 13 1.722 9.884 -12.900 1.00 53.13 H new ATOM 0 HB2 LYS A 13 3.451 9.359 -10.729 1.00 54.21 H new ATOM 0 HB3 LYS A 13 3.985 10.904 -11.361 1.00 54.21 H new ATOM 0 HG2 LYS A 13 1.787 11.874 -11.076 1.00 71.43 H new ATOM 0 HG3 LYS A 13 1.079 10.313 -10.711 1.00 71.43 H new ATOM 0 HD2 LYS A 13 1.498 10.664 -8.529 1.00 13.34 H new ATOM 0 HD3 LYS A 13 3.216 10.613 -8.873 1.00 13.34 H new ATOM 0 HE2 LYS A 13 3.014 12.717 -7.897 1.00 50.14 H new ATOM 0 HE3 LYS A 13 2.903 13.121 -9.598 1.00 50.14 H new ATOM 0 HZ1 LYS A 13 1.183 14.222 -8.322 1.00 54.11 H new ATOM 0 HZ2 LYS A 13 0.482 13.123 -9.411 1.00 54.11 H new ATOM 0 HZ3 LYS A 13 0.591 12.732 -7.762 1.00 54.11 H new ATOM 156 N VAL A 14 4.864 10.485 -13.768 1.00 75.23 N ATOM 157 CA VAL A 14 5.695 11.242 -14.696 1.00 61.23 C ATOM 158 C VAL A 14 5.348 10.908 -16.143 1.00 2.22 C ATOM 159 O VAL A 14 5.362 11.780 -17.012 1.00 71.34 O ATOM 160 CB VAL A 14 7.192 10.966 -14.462 1.00 61.51 C ATOM 161 CG1 VAL A 14 7.625 11.487 -13.100 1.00 71.13 C ATOM 162 CG2 VAL A 14 7.485 9.478 -14.591 1.00 4.44 C ATOM 0 H VAL A 14 5.383 9.863 -13.148 1.00 75.23 H new ATOM 0 HA VAL A 14 5.494 12.297 -14.512 1.00 61.23 H new ATOM 0 HB VAL A 14 7.765 11.494 -15.224 1.00 61.51 H new ATOM 0 HG11 VAL A 14 8.686 11.283 -12.953 1.00 71.13 H new ATOM 0 HG12 VAL A 14 7.452 12.562 -13.050 1.00 71.13 H new ATOM 0 HG13 VAL A 14 7.048 10.990 -12.320 1.00 71.13 H new ATOM 0 HG21 VAL A 14 8.547 9.300 -14.423 1.00 4.44 H new ATOM 0 HG22 VAL A 14 6.903 8.927 -13.852 1.00 4.44 H new ATOM 0 HG23 VAL A 14 7.214 9.139 -15.591 1.00 4.44 H new ATOM 172 N TYR A 15 5.037 9.641 -16.393 1.00 52.45 N ATOM 173 CA TYR A 15 4.688 9.191 -17.736 1.00 13.43 C ATOM 174 C TYR A 15 3.292 9.669 -18.125 1.00 31.25 C ATOM 175 O TYR A 15 2.950 9.725 -19.305 1.00 64.03 O ATOM 176 CB TYR A 15 4.759 7.666 -17.819 1.00 74.32 C ATOM 177 CG TYR A 15 4.236 7.106 -19.123 1.00 23.30 C ATOM 178 CD1 TYR A 15 4.713 7.571 -20.342 1.00 73.03 C ATOM 179 CD2 TYR A 15 3.267 6.110 -19.135 1.00 52.42 C ATOM 180 CE1 TYR A 15 4.238 7.063 -21.536 1.00 34.33 C ATOM 181 CE2 TYR A 15 2.787 5.595 -20.324 1.00 11.22 C ATOM 182 CZ TYR A 15 3.275 6.075 -21.521 1.00 60.13 C ATOM 183 OH TYR A 15 2.800 5.565 -22.708 1.00 63.00 O ATOM 0 H TYR A 15 5.019 8.908 -15.684 1.00 52.45 H new ATOM 0 HA TYR A 15 5.407 9.620 -18.434 1.00 13.43 H new ATOM 0 HB2 TYR A 15 5.794 7.351 -17.687 1.00 74.32 H new ATOM 0 HB3 TYR A 15 4.188 7.239 -16.995 1.00 74.32 H new ATOM 0 HD1 TYR A 15 5.468 8.343 -20.357 1.00 73.03 H new ATOM 0 HD2 TYR A 15 2.883 5.732 -18.199 1.00 52.42 H new ATOM 0 HE1 TYR A 15 4.618 7.437 -22.475 1.00 34.33 H new ATOM 0 HE2 TYR A 15 2.034 4.821 -20.316 1.00 11.22 H new ATOM 0 HH TYR A 15 2.128 4.877 -22.523 1.00 63.00 H new ATOM 193 N GLU A 16 2.490 10.012 -17.121 1.00 41.33 N ATOM 194 CA GLU A 16 1.131 10.485 -17.358 1.00 21.02 C ATOM 195 C GLU A 16 1.103 12.002 -17.516 1.00 52.54 C ATOM 196 O GLU A 16 0.703 12.521 -18.558 1.00 20.30 O ATOM 197 CB GLU A 16 0.214 10.064 -16.208 1.00 14.22 C ATOM 198 CG GLU A 16 -0.507 8.749 -16.454 1.00 40.30 C ATOM 199 CD GLU A 16 -1.961 8.944 -16.839 1.00 65.15 C ATOM 200 OE1 GLU A 16 -2.649 9.744 -16.172 1.00 4.32 O ATOM 201 OE2 GLU A 16 -2.410 8.296 -17.808 1.00 10.32 O ATOM 0 H GLU A 16 2.758 9.971 -16.138 1.00 41.33 H new ATOM 0 HA GLU A 16 0.772 10.034 -18.283 1.00 21.02 H new ATOM 0 HB2 GLU A 16 0.805 9.980 -15.296 1.00 14.22 H new ATOM 0 HB3 GLU A 16 -0.525 10.847 -16.038 1.00 14.22 H new ATOM 0 HG2 GLU A 16 0.004 8.201 -17.246 1.00 40.30 H new ATOM 0 HG3 GLU A 16 -0.452 8.135 -15.555 1.00 40.30 H new ATOM 208 N ASN A 17 1.530 12.708 -16.474 1.00 53.54 N ATOM 209 CA ASN A 17 1.552 14.167 -16.497 1.00 24.53 C ATOM 210 C ASN A 17 2.285 14.680 -17.733 1.00 11.35 C ATOM 211 O ASN A 17 1.879 15.671 -18.341 1.00 63.40 O ATOM 212 CB ASN A 17 2.223 14.706 -15.232 1.00 14.33 C ATOM 213 CG ASN A 17 1.739 14.005 -13.977 1.00 0.20 C ATOM 214 OD1 ASN A 17 2.538 13.580 -13.143 1.00 64.40 O ATOM 215 ND2 ASN A 17 0.424 13.882 -13.838 1.00 22.40 N ATOM 0 H ASN A 17 1.865 12.294 -15.604 1.00 53.54 H new ATOM 0 HA ASN A 17 0.522 14.522 -16.534 1.00 24.53 H new ATOM 0 HB2 ASN A 17 3.303 14.587 -15.318 1.00 14.33 H new ATOM 0 HB3 ASN A 17 2.026 15.775 -15.147 1.00 14.33 H new ATOM 0 HD21 ASN A 17 0.039 13.420 -13.014 1.00 22.40 H new ATOM 0 HD22 ASN A 17 -0.201 14.250 -14.555 1.00 22.40 H new ATOM 222 N VAL A 18 3.366 13.999 -18.098 1.00 43.45 N ATOM 223 CA VAL A 18 4.155 14.385 -19.263 1.00 10.15 C ATOM 224 C VAL A 18 3.280 14.501 -20.505 1.00 52.14 C ATOM 225 O VAL A 18 3.591 15.253 -21.430 1.00 73.32 O ATOM 226 CB VAL A 18 5.284 13.374 -19.536 1.00 21.23 C ATOM 227 CG1 VAL A 18 4.708 11.997 -19.829 1.00 63.21 C ATOM 228 CG2 VAL A 18 6.159 13.851 -20.685 1.00 24.42 C ATOM 0 H VAL A 18 3.716 13.178 -17.605 1.00 43.45 H new ATOM 0 HA VAL A 18 4.594 15.357 -19.040 1.00 10.15 H new ATOM 0 HB VAL A 18 5.905 13.299 -18.644 1.00 21.23 H new ATOM 0 HG11 VAL A 18 5.520 11.296 -20.019 1.00 63.21 H new ATOM 0 HG12 VAL A 18 4.127 11.656 -18.972 1.00 63.21 H new ATOM 0 HG13 VAL A 18 4.063 12.052 -20.706 1.00 63.21 H new ATOM 0 HG21 VAL A 18 6.952 13.125 -20.864 1.00 24.42 H new ATOM 0 HG22 VAL A 18 5.553 13.956 -21.585 1.00 24.42 H new ATOM 0 HG23 VAL A 18 6.601 14.815 -20.430 1.00 24.42 H new ATOM 238 N THR A 19 2.182 13.752 -20.521 1.00 73.34 N ATOM 239 CA THR A 19 1.261 13.769 -21.651 1.00 13.43 C ATOM 240 C THR A 19 0.190 14.840 -21.471 1.00 22.44 C ATOM 241 O THR A 19 -0.063 15.636 -22.373 1.00 52.12 O ATOM 242 CB THR A 19 0.577 12.402 -21.839 1.00 51.15 C ATOM 243 OG1 THR A 19 1.562 11.391 -22.082 1.00 54.23 O ATOM 244 CG2 THR A 19 -0.409 12.445 -22.997 1.00 40.32 C ATOM 0 H THR A 19 1.909 13.126 -19.764 1.00 73.34 H new ATOM 0 HA THR A 19 1.853 13.996 -22.538 1.00 13.43 H new ATOM 0 HB THR A 19 0.031 12.165 -20.926 1.00 51.15 H new ATOM 0 HG1 THR A 19 1.119 10.524 -22.199 1.00 54.23 H new ATOM 0 HG21 THR A 19 -0.880 11.468 -23.111 1.00 40.32 H new ATOM 0 HG22 THR A 19 -1.174 13.195 -22.796 1.00 40.32 H new ATOM 0 HG23 THR A 19 0.119 12.702 -23.915 1.00 40.32 H new ATOM 252 N GLY A 20 -0.436 14.853 -20.297 1.00 64.24 N ATOM 253 CA GLY A 20 -1.472 15.830 -20.020 1.00 44.53 C ATOM 254 C GLY A 20 -1.022 17.249 -20.308 1.00 41.10 C ATOM 255 O GLY A 20 -1.687 17.983 -21.041 1.00 21.23 O ATOM 0 H GLY A 20 -0.244 14.204 -19.534 1.00 64.24 H new ATOM 0 HA2 GLY A 20 -2.352 15.602 -20.621 1.00 44.53 H new ATOM 0 HA3 GLY A 20 -1.771 15.752 -18.975 1.00 44.53 H new ATOM 259 N LEU A 21 0.109 17.638 -19.730 1.00 12.35 N ATOM 260 CA LEU A 21 0.647 18.980 -19.926 1.00 54.13 C ATOM 261 C LEU A 21 0.747 19.314 -21.411 1.00 64.02 C ATOM 262 O LEU A 21 0.516 20.452 -21.820 1.00 33.04 O ATOM 263 CB LEU A 21 2.023 19.100 -19.270 1.00 41.41 C ATOM 264 CG LEU A 21 3.178 18.415 -20.002 1.00 13.11 C ATOM 265 CD1 LEU A 21 3.813 19.365 -21.005 1.00 2.43 C ATOM 266 CD2 LEU A 21 4.215 17.913 -19.009 1.00 24.14 C ATOM 0 H LEU A 21 0.672 17.043 -19.122 1.00 12.35 H new ATOM 0 HA LEU A 21 -0.034 19.690 -19.458 1.00 54.13 H new ATOM 0 HB2 LEU A 21 2.262 20.158 -19.165 1.00 41.41 H new ATOM 0 HB3 LEU A 21 1.961 18.686 -18.264 1.00 41.41 H new ATOM 0 HG LEU A 21 2.781 17.558 -20.546 1.00 13.11 H new ATOM 0 HD11 LEU A 21 4.633 18.860 -21.516 1.00 2.43 H new ATOM 0 HD12 LEU A 21 3.066 19.675 -21.736 1.00 2.43 H new ATOM 0 HD13 LEU A 21 4.196 20.242 -20.483 1.00 2.43 H new ATOM 0 HD21 LEU A 21 5.030 17.428 -19.547 1.00 24.14 H new ATOM 0 HD22 LEU A 21 4.608 18.754 -18.437 1.00 24.14 H new ATOM 0 HD23 LEU A 21 3.752 17.197 -18.330 1.00 24.14 H new ATOM 278 N VAL A 22 1.093 18.313 -22.215 1.00 51.53 N ATOM 279 CA VAL A 22 1.221 18.500 -23.656 1.00 20.33 C ATOM 280 C VAL A 22 -0.131 18.797 -24.294 1.00 12.22 C ATOM 281 O VAL A 22 -0.243 19.661 -25.164 1.00 12.10 O ATOM 282 CB VAL A 22 1.832 17.257 -24.330 1.00 44.21 C ATOM 283 CG1 VAL A 22 1.918 17.455 -25.836 1.00 23.41 C ATOM 284 CG2 VAL A 22 3.203 16.954 -23.745 1.00 3.13 C ATOM 0 H VAL A 22 1.290 17.365 -21.893 1.00 51.53 H new ATOM 0 HA VAL A 22 1.885 19.351 -23.807 1.00 20.33 H new ATOM 0 HB VAL A 22 1.183 16.403 -24.136 1.00 44.21 H new ATOM 0 HG11 VAL A 22 2.352 16.567 -26.296 1.00 23.41 H new ATOM 0 HG12 VAL A 22 0.919 17.621 -26.239 1.00 23.41 H new ATOM 0 HG13 VAL A 22 2.545 18.320 -26.054 1.00 23.41 H new ATOM 0 HG21 VAL A 22 3.620 16.073 -24.233 1.00 3.13 H new ATOM 0 HG22 VAL A 22 3.864 17.805 -23.907 1.00 3.13 H new ATOM 0 HG23 VAL A 22 3.109 16.766 -22.675 1.00 3.13 H new ATOM 294 N LYS A 23 -1.158 18.076 -23.855 1.00 45.24 N ATOM 295 CA LYS A 23 -2.505 18.263 -24.381 1.00 65.15 C ATOM 296 C LYS A 23 -2.924 19.727 -24.296 1.00 20.10 C ATOM 297 O LYS A 23 -3.509 20.270 -25.232 1.00 43.45 O ATOM 298 CB LYS A 23 -3.500 17.390 -23.613 1.00 43.51 C ATOM 299 CG LYS A 23 -3.261 15.900 -23.785 1.00 14.30 C ATOM 300 CD LYS A 23 -3.450 15.468 -25.229 1.00 54.34 C ATOM 301 CE LYS A 23 -3.312 13.961 -25.383 1.00 43.42 C ATOM 302 NZ LYS A 23 -4.254 13.419 -26.401 1.00 23.31 N ATOM 0 H LYS A 23 -1.083 17.357 -23.136 1.00 45.24 H new ATOM 0 HA LYS A 23 -2.504 17.965 -25.429 1.00 65.15 H new ATOM 0 HB2 LYS A 23 -3.446 17.638 -22.553 1.00 43.51 H new ATOM 0 HB3 LYS A 23 -4.511 17.628 -23.945 1.00 43.51 H new ATOM 0 HG2 LYS A 23 -2.250 15.653 -23.460 1.00 14.30 H new ATOM 0 HG3 LYS A 23 -3.947 15.344 -23.145 1.00 14.30 H new ATOM 0 HD2 LYS A 23 -4.434 15.782 -25.578 1.00 54.34 H new ATOM 0 HD3 LYS A 23 -2.714 15.968 -25.859 1.00 54.34 H new ATOM 0 HE2 LYS A 23 -2.289 13.717 -25.669 1.00 43.42 H new ATOM 0 HE3 LYS A 23 -3.498 13.479 -24.423 1.00 43.42 H new ATOM 0 HZ1 LYS A 23 -5.029 12.916 -25.924 1.00 23.31 H new ATOM 0 HZ2 LYS A 23 -4.644 14.201 -26.964 1.00 23.31 H new ATOM 0 HZ3 LYS A 23 -3.748 12.761 -27.027 1.00 23.31 H new ATOM 316 N ALA A 24 -2.620 20.360 -23.168 1.00 32.14 N ATOM 317 CA ALA A 24 -2.963 21.762 -22.962 1.00 23.31 C ATOM 318 C ALA A 24 -2.105 22.670 -23.836 1.00 52.33 C ATOM 319 O ALA A 24 -2.602 23.631 -24.425 1.00 64.44 O ATOM 320 CB ALA A 24 -2.804 22.134 -21.495 1.00 42.13 C ATOM 0 H ALA A 24 -2.137 19.924 -22.383 1.00 32.14 H new ATOM 0 HA ALA A 24 -4.005 21.902 -23.250 1.00 23.31 H new ATOM 0 HB1 ALA A 24 -3.063 23.183 -21.356 1.00 42.13 H new ATOM 0 HB2 ALA A 24 -3.464 21.513 -20.889 1.00 42.13 H new ATOM 0 HB3 ALA A 24 -1.771 21.972 -21.188 1.00 42.13 H new ATOM 326 N VAL A 25 -0.815 22.361 -23.916 1.00 42.30 N ATOM 327 CA VAL A 25 0.112 23.150 -24.719 1.00 50.10 C ATOM 328 C VAL A 25 -0.372 23.268 -26.160 1.00 15.53 C ATOM 329 O VAL A 25 -0.321 24.345 -26.756 1.00 32.31 O ATOM 330 CB VAL A 25 1.524 22.535 -24.713 1.00 20.13 C ATOM 331 CG1 VAL A 25 2.467 23.354 -25.580 1.00 44.21 C ATOM 332 CG2 VAL A 25 2.052 22.428 -23.290 1.00 51.30 C ATOM 0 H VAL A 25 -0.388 21.570 -23.435 1.00 42.30 H new ATOM 0 HA VAL A 25 0.154 24.142 -24.270 1.00 50.10 H new ATOM 0 HB VAL A 25 1.466 21.530 -25.131 1.00 20.13 H new ATOM 0 HG11 VAL A 25 3.460 22.904 -25.563 1.00 44.21 H new ATOM 0 HG12 VAL A 25 2.095 23.374 -26.604 1.00 44.21 H new ATOM 0 HG13 VAL A 25 2.524 24.372 -25.195 1.00 44.21 H new ATOM 0 HG21 VAL A 25 3.051 21.991 -23.304 1.00 51.30 H new ATOM 0 HG22 VAL A 25 2.096 23.421 -22.843 1.00 51.30 H new ATOM 0 HG23 VAL A 25 1.388 21.795 -22.702 1.00 51.30 H new ATOM 342 N ILE A 26 -0.843 22.156 -26.713 1.00 60.11 N ATOM 343 CA ILE A 26 -1.338 22.135 -28.084 1.00 14.52 C ATOM 344 C ILE A 26 -2.751 22.704 -28.166 1.00 71.22 C ATOM 345 O ILE A 26 -3.079 23.444 -29.093 1.00 33.21 O ATOM 346 CB ILE A 26 -1.337 20.708 -28.662 1.00 21.13 C ATOM 347 CG1 ILE A 26 0.078 20.126 -28.637 1.00 71.15 C ATOM 348 CG2 ILE A 26 -1.891 20.710 -30.079 1.00 24.32 C ATOM 349 CD1 ILE A 26 0.128 18.678 -28.203 1.00 22.11 C ATOM 0 H ILE A 26 -0.892 21.257 -26.233 1.00 60.11 H new ATOM 0 HA ILE A 26 -0.663 22.756 -28.673 1.00 14.52 H new ATOM 0 HB ILE A 26 -1.979 20.080 -28.044 1.00 21.13 H new ATOM 0 HG12 ILE A 26 0.516 20.214 -29.631 1.00 71.15 H new ATOM 0 HG13 ILE A 26 0.695 20.720 -27.963 1.00 71.15 H new ATOM 0 HG21 ILE A 26 -1.884 19.694 -30.474 1.00 24.32 H new ATOM 0 HG22 ILE A 26 -2.913 21.088 -30.069 1.00 24.32 H new ATOM 0 HG23 ILE A 26 -1.273 21.349 -30.710 1.00 24.32 H new ATOM 0 HD11 ILE A 26 1.162 18.332 -28.209 1.00 22.11 H new ATOM 0 HD12 ILE A 26 -0.280 18.586 -27.196 1.00 22.11 H new ATOM 0 HD13 ILE A 26 -0.461 18.072 -28.891 1.00 22.11 H new ATOM 361 N GLU A 27 -3.582 22.353 -27.190 1.00 10.45 N ATOM 362 CA GLU A 27 -4.960 22.830 -27.152 1.00 4.12 C ATOM 363 C GLU A 27 -5.014 24.349 -27.286 1.00 4.22 C ATOM 364 O GLU A 27 -5.666 24.881 -28.184 1.00 23.30 O ATOM 365 CB GLU A 27 -5.637 22.398 -25.850 1.00 22.44 C ATOM 366 CG GLU A 27 -7.105 22.783 -25.770 1.00 24.41 C ATOM 367 CD GLU A 27 -7.991 21.881 -26.607 1.00 65.23 C ATOM 368 OE1 GLU A 27 -7.516 20.805 -27.027 1.00 25.24 O ATOM 369 OE2 GLU A 27 -9.160 22.252 -26.843 1.00 24.32 O ATOM 0 H GLU A 27 -3.326 21.741 -26.416 1.00 10.45 H new ATOM 0 HA GLU A 27 -5.493 22.389 -27.994 1.00 4.12 H new ATOM 0 HB2 GLU A 27 -5.547 21.317 -25.745 1.00 22.44 H new ATOM 0 HB3 GLU A 27 -5.107 22.845 -25.009 1.00 22.44 H new ATOM 0 HG2 GLU A 27 -7.431 22.743 -24.731 1.00 24.41 H new ATOM 0 HG3 GLU A 27 -7.225 23.814 -26.103 1.00 24.41 H new ATOM 376 N MET A 28 -4.324 25.042 -26.385 1.00 63.43 N ATOM 377 CA MET A 28 -4.292 26.499 -26.403 1.00 53.51 C ATOM 378 C MET A 28 -3.785 27.016 -27.746 1.00 14.01 C ATOM 379 O MET A 28 -4.331 27.970 -28.300 1.00 44.42 O ATOM 380 CB MET A 28 -3.405 27.026 -25.273 1.00 71.42 C ATOM 381 CG MET A 28 -1.984 26.489 -25.316 1.00 63.45 C ATOM 382 SD MET A 28 -1.180 26.519 -23.702 1.00 74.35 S ATOM 383 CE MET A 28 0.379 27.298 -24.115 1.00 32.32 C ATOM 0 H MET A 28 -3.780 24.617 -25.634 1.00 63.43 H new ATOM 0 HA MET A 28 -5.310 26.861 -26.255 1.00 53.51 H new ATOM 0 HB2 MET A 28 -3.375 28.114 -25.323 1.00 71.42 H new ATOM 0 HB3 MET A 28 -3.855 26.763 -24.316 1.00 71.42 H new ATOM 0 HG2 MET A 28 -1.998 25.466 -25.692 1.00 63.45 H new ATOM 0 HG3 MET A 28 -1.398 27.079 -26.020 1.00 63.45 H new ATOM 0 HE1 MET A 28 1.167 26.896 -23.478 1.00 32.32 H new ATOM 0 HE2 MET A 28 0.620 27.099 -25.159 1.00 32.32 H new ATOM 0 HE3 MET A 28 0.300 28.374 -23.960 1.00 32.32 H new ATOM 393 N SER A 29 -2.739 26.380 -28.263 1.00 74.31 N ATOM 394 CA SER A 29 -2.157 26.778 -29.539 1.00 43.01 C ATOM 395 C SER A 29 -3.180 26.658 -30.664 1.00 42.55 C ATOM 396 O SER A 29 -3.024 27.260 -31.727 1.00 3.32 O ATOM 397 CB SER A 29 -0.931 25.918 -29.855 1.00 14.00 C ATOM 398 OG SER A 29 0.063 26.061 -28.856 1.00 22.23 O ATOM 0 H SER A 29 -2.277 25.587 -27.818 1.00 74.31 H new ATOM 0 HA SER A 29 -1.850 27.821 -29.461 1.00 43.01 H new ATOM 0 HB2 SER A 29 -1.227 24.872 -29.931 1.00 14.00 H new ATOM 0 HB3 SER A 29 -0.522 26.205 -30.824 1.00 14.00 H new ATOM 0 HG SER A 29 -0.158 25.490 -28.091 1.00 22.23 H new ATOM 404 N SER A 30 -4.227 25.877 -30.423 1.00 34.23 N ATOM 405 CA SER A 30 -5.275 25.674 -31.416 1.00 53.03 C ATOM 406 C SER A 30 -6.222 26.870 -31.459 1.00 63.14 C ATOM 407 O SER A 30 -6.385 27.511 -32.498 1.00 22.12 O ATOM 408 CB SER A 30 -6.061 24.398 -31.107 1.00 10.33 C ATOM 409 OG SER A 30 -6.410 23.713 -32.297 1.00 12.01 O ATOM 0 H SER A 30 -4.373 25.374 -29.548 1.00 34.23 H new ATOM 0 HA SER A 30 -4.801 25.572 -32.392 1.00 53.03 H new ATOM 0 HB2 SER A 30 -5.465 23.745 -30.470 1.00 10.33 H new ATOM 0 HB3 SER A 30 -6.964 24.649 -30.550 1.00 10.33 H new ATOM 0 HG SER A 30 -6.910 22.901 -32.072 1.00 12.01 H new ATOM 415 N LYS A 31 -6.844 27.165 -30.323 1.00 71.02 N ATOM 416 CA LYS A 31 -7.774 28.284 -30.228 1.00 30.02 C ATOM 417 C LYS A 31 -7.073 29.530 -29.696 1.00 51.13 C ATOM 418 O LYS A 31 -7.707 30.407 -29.110 1.00 14.45 O ATOM 419 CB LYS A 31 -8.950 27.920 -29.319 1.00 11.44 C ATOM 420 CG LYS A 31 -8.527 27.394 -27.958 1.00 50.30 C ATOM 421 CD LYS A 31 -9.725 27.165 -27.052 1.00 1.23 C ATOM 422 CE LYS A 31 -9.308 26.567 -25.717 1.00 4.32 C ATOM 423 NZ LYS A 31 -10.370 25.696 -25.143 1.00 30.21 N ATOM 0 H LYS A 31 -6.721 26.644 -29.455 1.00 71.02 H new ATOM 0 HA LYS A 31 -8.149 28.499 -31.229 1.00 30.02 H new ATOM 0 HB2 LYS A 31 -9.577 28.801 -29.180 1.00 11.44 H new ATOM 0 HB3 LYS A 31 -9.563 27.168 -29.816 1.00 11.44 H new ATOM 0 HG2 LYS A 31 -7.980 26.460 -28.082 1.00 50.30 H new ATOM 0 HG3 LYS A 31 -7.845 28.103 -27.489 1.00 50.30 H new ATOM 0 HD2 LYS A 31 -10.241 28.110 -26.883 1.00 1.23 H new ATOM 0 HD3 LYS A 31 -10.433 26.499 -27.545 1.00 1.23 H new ATOM 0 HE2 LYS A 31 -8.395 25.987 -25.848 1.00 4.32 H new ATOM 0 HE3 LYS A 31 -9.078 27.369 -25.016 1.00 4.32 H new ATOM 0 HZ1 LYS A 31 -10.047 25.308 -24.234 1.00 30.21 H new ATOM 0 HZ2 LYS A 31 -11.234 26.255 -24.993 1.00 30.21 H new ATOM 0 HZ3 LYS A 31 -10.572 24.916 -25.800 1.00 30.21 H new ATOM 437 N ILE A 32 -5.763 29.602 -29.907 1.00 31.43 N ATOM 438 CA ILE A 32 -4.978 30.742 -29.451 1.00 21.23 C ATOM 439 C ILE A 32 -5.466 32.037 -30.092 1.00 24.25 C ATOM 440 O ILE A 32 -5.558 33.071 -29.431 1.00 25.23 O ATOM 441 CB ILE A 32 -3.482 30.558 -29.767 1.00 22.43 C ATOM 442 CG1 ILE A 32 -2.688 31.786 -29.316 1.00 70.42 C ATOM 443 CG2 ILE A 32 -3.282 30.307 -31.254 1.00 4.01 C ATOM 444 CD1 ILE A 32 -1.412 31.443 -28.579 1.00 52.31 C ATOM 0 H ILE A 32 -5.223 28.884 -30.391 1.00 31.43 H new ATOM 0 HA ILE A 32 -5.108 30.803 -28.370 1.00 21.23 H new ATOM 0 HB ILE A 32 -3.114 29.690 -29.220 1.00 22.43 H new ATOM 0 HG12 ILE A 32 -2.442 32.391 -30.189 1.00 70.42 H new ATOM 0 HG13 ILE A 32 -3.317 32.399 -28.671 1.00 70.42 H new ATOM 0 HG21 ILE A 32 -2.220 30.179 -31.462 1.00 4.01 H new ATOM 0 HG22 ILE A 32 -3.820 29.405 -31.546 1.00 4.01 H new ATOM 0 HG23 ILE A 32 -3.663 31.157 -31.821 1.00 4.01 H new ATOM 0 HD11 ILE A 32 -0.901 32.361 -28.289 1.00 52.31 H new ATOM 0 HD12 ILE A 32 -1.651 30.864 -27.687 1.00 52.31 H new ATOM 0 HD13 ILE A 32 -0.763 30.856 -29.229 1.00 52.31 H new ATOM 456 N GLN A 33 -5.778 31.971 -31.382 1.00 33.14 N ATOM 457 CA GLN A 33 -6.258 33.139 -32.111 1.00 71.44 C ATOM 458 C GLN A 33 -7.545 33.675 -31.494 1.00 12.41 C ATOM 459 O GLN A 33 -7.611 34.812 -31.025 1.00 63.02 O ATOM 460 CB GLN A 33 -6.492 32.787 -33.582 1.00 22.14 C ATOM 461 CG GLN A 33 -5.381 33.261 -34.505 1.00 22.14 C ATOM 462 CD GLN A 33 -5.887 34.164 -35.612 1.00 14.13 C ATOM 463 OE1 GLN A 33 -6.651 33.736 -36.477 1.00 74.02 O ATOM 464 NE2 GLN A 33 -5.464 35.422 -35.590 1.00 2.51 N ATOM 0 H GLN A 33 -5.707 31.122 -31.943 1.00 33.14 H new ATOM 0 HA GLN A 33 -5.495 33.915 -32.047 1.00 71.44 H new ATOM 0 HB2 GLN A 33 -6.595 31.706 -33.676 1.00 22.14 H new ATOM 0 HB3 GLN A 33 -7.435 33.227 -33.907 1.00 22.14 H new ATOM 0 HG2 GLN A 33 -4.631 33.794 -33.921 1.00 22.14 H new ATOM 0 HG3 GLN A 33 -4.886 32.396 -34.945 1.00 22.14 H new ATOM 0 HE21 GLN A 33 -4.831 35.734 -34.854 1.00 2.51 H new ATOM 0 HE22 GLN A 33 -5.772 36.076 -36.309 1.00 2.51 H new ATOM 473 N PRO A 34 -8.595 32.840 -31.493 1.00 3.23 N ATOM 474 CA PRO A 34 -9.899 33.209 -30.936 1.00 15.23 C ATOM 475 C PRO A 34 -9.868 33.329 -29.416 1.00 31.22 C ATOM 476 O PRO A 34 -10.835 33.773 -28.799 1.00 15.43 O ATOM 477 CB PRO A 34 -10.807 32.053 -31.362 1.00 53.05 C ATOM 478 CG PRO A 34 -9.887 30.895 -31.542 1.00 11.23 C ATOM 479 CD PRO A 34 -8.588 31.471 -32.034 1.00 73.15 C ATOM 0 HA PRO A 34 -10.232 34.184 -31.291 1.00 15.23 H new ATOM 0 HB2 PRO A 34 -11.563 31.844 -30.605 1.00 53.05 H new ATOM 0 HB3 PRO A 34 -11.336 32.285 -32.286 1.00 53.05 H new ATOM 0 HG2 PRO A 34 -9.746 30.359 -30.603 1.00 11.23 H new ATOM 0 HG3 PRO A 34 -10.294 30.181 -32.258 1.00 11.23 H new ATOM 0 HD2 PRO A 34 -7.733 30.900 -31.672 1.00 73.15 H new ATOM 0 HD3 PRO A 34 -8.535 31.469 -33.123 1.00 73.15 H new ATOM 487 N ALA A 35 -8.750 32.929 -28.818 1.00 51.54 N ATOM 488 CA ALA A 35 -8.592 32.995 -27.371 1.00 33.52 C ATOM 489 C ALA A 35 -9.006 34.361 -26.834 1.00 71.33 C ATOM 490 O ALA A 35 -8.313 35.362 -27.016 1.00 61.22 O ATOM 491 CB ALA A 35 -7.154 32.686 -26.982 1.00 41.33 C ATOM 0 H ALA A 35 -7.941 32.556 -29.314 1.00 51.54 H new ATOM 0 HA ALA A 35 -9.246 32.246 -26.925 1.00 33.52 H new ATOM 0 HB1 ALA A 35 -7.051 32.739 -25.898 1.00 41.33 H new ATOM 0 HB2 ALA A 35 -6.892 31.684 -27.323 1.00 41.33 H new ATOM 0 HB3 ALA A 35 -6.487 33.413 -27.446 1.00 41.33 H new ATOM 497 N PRO A 36 -10.163 34.406 -26.158 1.00 32.25 N ATOM 498 CA PRO A 36 -10.695 35.644 -25.581 1.00 12.10 C ATOM 499 C PRO A 36 -9.870 36.133 -24.396 1.00 2.22 C ATOM 500 O PRO A 36 -9.011 35.424 -23.872 1.00 24.21 O ATOM 501 CB PRO A 36 -12.102 35.248 -25.126 1.00 21.33 C ATOM 502 CG PRO A 36 -12.025 33.778 -24.895 1.00 32.11 C ATOM 503 CD PRO A 36 -11.041 33.251 -25.903 1.00 10.45 C ATOM 0 HA PRO A 36 -10.679 36.466 -26.296 1.00 12.10 H new ATOM 0 HB2 PRO A 36 -12.388 35.777 -24.217 1.00 21.33 H new ATOM 0 HB3 PRO A 36 -12.847 35.491 -25.884 1.00 21.33 H new ATOM 0 HG2 PRO A 36 -11.697 33.559 -23.879 1.00 32.11 H new ATOM 0 HG3 PRO A 36 -13.002 33.311 -25.022 1.00 32.11 H new ATOM 0 HD2 PRO A 36 -10.483 32.400 -25.513 1.00 10.45 H new ATOM 0 HD3 PRO A 36 -11.538 32.916 -26.813 1.00 10.45 H new ATOM 511 N PRO A 37 -10.135 37.374 -23.961 1.00 4.10 N ATOM 512 CA PRO A 37 -9.427 37.985 -22.832 1.00 12.03 C ATOM 513 C PRO A 37 -9.790 37.336 -21.501 1.00 31.34 C ATOM 514 O PRO A 37 -9.060 37.464 -20.518 1.00 72.24 O ATOM 515 CB PRO A 37 -9.900 39.441 -22.863 1.00 25.31 C ATOM 516 CG PRO A 37 -11.228 39.394 -23.535 1.00 72.41 C ATOM 517 CD PRO A 37 -11.145 38.276 -24.538 1.00 15.20 C ATOM 0 HA PRO A 37 -8.346 37.871 -22.919 1.00 12.03 H new ATOM 0 HB2 PRO A 37 -9.980 39.853 -21.857 1.00 25.31 H new ATOM 0 HB3 PRO A 37 -9.201 40.073 -23.411 1.00 25.31 H new ATOM 0 HG2 PRO A 37 -12.024 39.213 -22.813 1.00 72.41 H new ATOM 0 HG3 PRO A 37 -11.451 40.342 -24.025 1.00 72.41 H new ATOM 0 HD2 PRO A 37 -12.106 37.776 -24.663 1.00 15.20 H new ATOM 0 HD3 PRO A 37 -10.845 38.639 -25.521 1.00 15.20 H new ATOM 525 N GLU A 38 -10.922 36.639 -21.476 1.00 62.44 N ATOM 526 CA GLU A 38 -11.380 35.970 -20.265 1.00 34.25 C ATOM 527 C GLU A 38 -10.757 34.583 -20.139 1.00 61.45 C ATOM 528 O GLU A 38 -10.683 34.021 -19.047 1.00 72.33 O ATOM 529 CB GLU A 38 -12.906 35.857 -20.264 1.00 34.01 C ATOM 530 CG GLU A 38 -13.453 34.995 -21.390 1.00 15.44 C ATOM 531 CD GLU A 38 -14.800 35.478 -21.892 1.00 13.21 C ATOM 532 OE1 GLU A 38 -14.823 36.337 -22.798 1.00 12.22 O ATOM 533 OE2 GLU A 38 -15.832 34.996 -21.379 1.00 22.04 O ATOM 0 H GLU A 38 -11.538 36.523 -22.281 1.00 62.44 H new ATOM 0 HA GLU A 38 -11.066 36.569 -19.410 1.00 34.25 H new ATOM 0 HB2 GLU A 38 -13.231 35.442 -19.310 1.00 34.01 H new ATOM 0 HB3 GLU A 38 -13.336 36.856 -20.340 1.00 34.01 H new ATOM 0 HG2 GLU A 38 -12.742 34.989 -22.216 1.00 15.44 H new ATOM 0 HG3 GLU A 38 -13.546 33.966 -21.043 1.00 15.44 H new ATOM 540 N GLU A 39 -10.310 34.037 -21.267 1.00 15.04 N ATOM 541 CA GLU A 39 -9.695 32.715 -21.283 1.00 42.32 C ATOM 542 C GLU A 39 -8.188 32.814 -21.066 1.00 4.32 C ATOM 543 O GLU A 39 -7.514 31.808 -20.845 1.00 62.34 O ATOM 544 CB GLU A 39 -9.985 32.010 -22.610 1.00 24.13 C ATOM 545 CG GLU A 39 -11.342 31.329 -22.653 1.00 53.12 C ATOM 546 CD GLU A 39 -11.473 30.223 -21.625 1.00 32.53 C ATOM 547 OE1 GLU A 39 -10.463 29.541 -21.353 1.00 44.43 O ATOM 548 OE2 GLU A 39 -12.587 30.038 -21.091 1.00 53.31 O ATOM 0 H GLU A 39 -10.362 34.489 -22.180 1.00 15.04 H new ATOM 0 HA GLU A 39 -10.125 32.132 -20.468 1.00 42.32 H new ATOM 0 HB2 GLU A 39 -9.928 32.738 -23.419 1.00 24.13 H new ATOM 0 HB3 GLU A 39 -9.209 31.267 -22.794 1.00 24.13 H new ATOM 0 HG2 GLU A 39 -12.122 32.071 -22.484 1.00 53.12 H new ATOM 0 HG3 GLU A 39 -11.505 30.916 -23.648 1.00 53.12 H new ATOM 555 N TYR A 40 -7.666 34.034 -21.130 1.00 43.11 N ATOM 556 CA TYR A 40 -6.238 34.265 -20.944 1.00 13.54 C ATOM 557 C TYR A 40 -5.850 34.120 -19.475 1.00 51.23 C ATOM 558 O TYR A 40 -4.814 33.542 -19.149 1.00 65.43 O ATOM 559 CB TYR A 40 -5.856 35.658 -21.448 1.00 63.25 C ATOM 560 CG TYR A 40 -4.494 35.711 -22.104 1.00 53.12 C ATOM 561 CD1 TYR A 40 -4.189 34.892 -23.184 1.00 73.42 C ATOM 562 CD2 TYR A 40 -3.513 36.580 -21.644 1.00 21.14 C ATOM 563 CE1 TYR A 40 -2.947 34.936 -23.786 1.00 43.32 C ATOM 564 CE2 TYR A 40 -2.268 36.632 -22.240 1.00 51.44 C ATOM 565 CZ TYR A 40 -1.990 35.809 -23.311 1.00 63.40 C ATOM 566 OH TYR A 40 -0.750 35.857 -23.907 1.00 75.13 O ATOM 0 H TYR A 40 -8.210 34.878 -21.309 1.00 43.11 H new ATOM 0 HA TYR A 40 -5.696 33.515 -21.521 1.00 13.54 H new ATOM 0 HB2 TYR A 40 -6.607 35.996 -22.162 1.00 63.25 H new ATOM 0 HB3 TYR A 40 -5.875 36.356 -20.611 1.00 63.25 H new ATOM 0 HD1 TYR A 40 -4.937 34.209 -23.559 1.00 73.42 H new ATOM 0 HD2 TYR A 40 -3.727 37.226 -20.806 1.00 21.14 H new ATOM 0 HE1 TYR A 40 -2.726 34.291 -24.624 1.00 43.32 H new ATOM 0 HE2 TYR A 40 -1.517 37.313 -21.869 1.00 51.44 H new ATOM 0 HH TYR A 40 -0.834 35.625 -24.855 1.00 75.13 H new ATOM 576 N VAL A 41 -6.691 34.650 -18.593 1.00 31.35 N ATOM 577 CA VAL A 41 -6.439 34.579 -17.158 1.00 63.53 C ATOM 578 C VAL A 41 -6.136 33.149 -16.724 1.00 31.12 C ATOM 579 O VAL A 41 -5.089 32.858 -16.146 1.00 24.30 O ATOM 580 CB VAL A 41 -7.639 35.106 -16.350 1.00 74.33 C ATOM 581 CG1 VAL A 41 -7.736 34.392 -15.010 1.00 51.24 C ATOM 582 CG2 VAL A 41 -7.531 36.610 -16.156 1.00 4.53 C ATOM 0 H VAL A 41 -7.553 35.133 -18.846 1.00 31.35 H new ATOM 0 HA VAL A 41 -5.572 35.208 -16.957 1.00 63.53 H new ATOM 0 HB VAL A 41 -8.551 34.900 -16.911 1.00 74.33 H new ATOM 0 HG11 VAL A 41 -8.590 34.778 -14.453 1.00 51.24 H new ATOM 0 HG12 VAL A 41 -7.864 33.322 -15.176 1.00 51.24 H new ATOM 0 HG13 VAL A 41 -6.823 34.564 -14.439 1.00 51.24 H new ATOM 0 HG21 VAL A 41 -8.387 36.965 -15.583 1.00 4.53 H new ATOM 0 HG22 VAL A 41 -6.612 36.842 -15.617 1.00 4.53 H new ATOM 0 HG23 VAL A 41 -7.516 37.102 -17.128 1.00 4.53 H new ATOM 592 N PRO A 42 -7.074 32.233 -17.008 1.00 40.10 N ATOM 593 CA PRO A 42 -6.930 30.817 -16.656 1.00 51.25 C ATOM 594 C PRO A 42 -5.858 30.120 -17.487 1.00 30.22 C ATOM 595 O PRO A 42 -5.234 29.162 -17.032 1.00 64.34 O ATOM 596 CB PRO A 42 -8.311 30.233 -16.966 1.00 64.20 C ATOM 597 CG PRO A 42 -8.881 31.138 -18.003 1.00 32.32 C ATOM 598 CD PRO A 42 -8.347 32.509 -17.695 1.00 1.21 C ATOM 0 HA PRO A 42 -6.618 30.683 -15.620 1.00 51.25 H new ATOM 0 HB2 PRO A 42 -8.235 29.209 -17.333 1.00 64.20 H new ATOM 0 HB3 PRO A 42 -8.939 30.207 -16.075 1.00 64.20 H new ATOM 0 HG2 PRO A 42 -8.586 30.820 -19.003 1.00 32.32 H new ATOM 0 HG3 PRO A 42 -9.971 31.128 -17.974 1.00 32.32 H new ATOM 0 HD2 PRO A 42 -8.195 33.094 -18.602 1.00 1.21 H new ATOM 0 HD3 PRO A 42 -9.031 33.074 -17.062 1.00 1.21 H new ATOM 606 N MET A 43 -5.650 30.607 -18.706 1.00 2.25 N ATOM 607 CA MET A 43 -4.651 30.031 -19.598 1.00 71.33 C ATOM 608 C MET A 43 -3.311 29.876 -18.887 1.00 23.21 C ATOM 609 O MET A 43 -2.672 28.827 -18.967 1.00 63.42 O ATOM 610 CB MET A 43 -4.483 30.905 -20.843 1.00 33.33 C ATOM 611 CG MET A 43 -4.617 30.136 -22.147 1.00 43.25 C ATOM 612 SD MET A 43 -6.258 29.424 -22.370 1.00 12.15 S ATOM 613 CE MET A 43 -6.628 29.942 -24.044 1.00 14.23 C ATOM 0 H MET A 43 -6.160 31.399 -19.098 1.00 2.25 H new ATOM 0 HA MET A 43 -4.998 29.043 -19.900 1.00 71.33 H new ATOM 0 HB2 MET A 43 -5.228 31.701 -20.822 1.00 33.33 H new ATOM 0 HB3 MET A 43 -3.504 31.384 -20.812 1.00 33.33 H new ATOM 0 HG2 MET A 43 -4.398 30.803 -22.981 1.00 43.25 H new ATOM 0 HG3 MET A 43 -3.873 29.339 -22.172 1.00 43.25 H new ATOM 0 HE1 MET A 43 -7.615 29.577 -24.328 1.00 14.23 H new ATOM 0 HE2 MET A 43 -6.614 31.031 -24.099 1.00 14.23 H new ATOM 0 HE3 MET A 43 -5.880 29.535 -24.725 1.00 14.23 H new ATOM 623 N VAL A 44 -2.890 30.927 -18.191 1.00 10.30 N ATOM 624 CA VAL A 44 -1.626 30.907 -17.465 1.00 2.31 C ATOM 625 C VAL A 44 -1.646 29.863 -16.354 1.00 54.13 C ATOM 626 O VAL A 44 -0.618 29.272 -16.023 1.00 53.12 O ATOM 627 CB VAL A 44 -1.308 32.285 -16.853 1.00 60.25 C ATOM 628 CG1 VAL A 44 -2.095 32.493 -15.569 1.00 2.35 C ATOM 629 CG2 VAL A 44 0.186 32.424 -16.602 1.00 71.21 C ATOM 0 H VAL A 44 -3.406 31.803 -18.115 1.00 10.30 H new ATOM 0 HA VAL A 44 -0.851 30.650 -18.187 1.00 2.31 H new ATOM 0 HB VAL A 44 -1.607 33.057 -17.562 1.00 60.25 H new ATOM 0 HG11 VAL A 44 -1.858 33.471 -15.151 1.00 2.35 H new ATOM 0 HG12 VAL A 44 -3.162 32.439 -15.784 1.00 2.35 H new ATOM 0 HG13 VAL A 44 -1.830 31.718 -14.850 1.00 2.35 H new ATOM 0 HG21 VAL A 44 0.393 33.403 -16.170 1.00 71.21 H new ATOM 0 HG22 VAL A 44 0.513 31.646 -15.912 1.00 71.21 H new ATOM 0 HG23 VAL A 44 0.724 32.323 -17.544 1.00 71.21 H new ATOM 639 N LYS A 45 -2.824 29.640 -15.782 1.00 33.44 N ATOM 640 CA LYS A 45 -2.981 28.665 -14.709 1.00 13.04 C ATOM 641 C LYS A 45 -2.598 27.267 -15.183 1.00 21.01 C ATOM 642 O LYS A 45 -1.874 26.546 -14.497 1.00 1.41 O ATOM 643 CB LYS A 45 -4.425 28.664 -14.199 1.00 45.45 C ATOM 644 CG LYS A 45 -4.544 28.935 -12.710 1.00 31.13 C ATOM 645 CD LYS A 45 -5.161 30.297 -12.438 1.00 23.20 C ATOM 646 CE LYS A 45 -4.436 31.023 -11.315 1.00 31.43 C ATOM 647 NZ LYS A 45 -3.390 31.946 -11.835 1.00 71.01 N ATOM 0 H LYS A 45 -3.684 30.121 -16.043 1.00 33.44 H new ATOM 0 HA LYS A 45 -2.314 28.949 -13.895 1.00 13.04 H new ATOM 0 HB2 LYS A 45 -4.994 29.417 -14.744 1.00 45.45 H new ATOM 0 HB3 LYS A 45 -4.879 27.699 -14.422 1.00 45.45 H new ATOM 0 HG2 LYS A 45 -5.153 28.159 -12.246 1.00 31.13 H new ATOM 0 HG3 LYS A 45 -3.557 28.883 -12.250 1.00 31.13 H new ATOM 0 HD2 LYS A 45 -5.127 30.901 -13.345 1.00 23.20 H new ATOM 0 HD3 LYS A 45 -6.212 30.176 -12.175 1.00 23.20 H new ATOM 0 HE2 LYS A 45 -5.156 31.587 -10.723 1.00 31.43 H new ATOM 0 HE3 LYS A 45 -3.977 30.293 -10.648 1.00 31.43 H new ATOM 0 HZ1 LYS A 45 -2.919 32.421 -11.039 1.00 71.01 H new ATOM 0 HZ2 LYS A 45 -2.688 31.404 -12.379 1.00 71.01 H new ATOM 0 HZ3 LYS A 45 -3.831 32.658 -12.452 1.00 71.01 H new ATOM 661 N GLU A 46 -3.087 26.891 -16.361 1.00 12.54 N ATOM 662 CA GLU A 46 -2.794 25.580 -16.926 1.00 31.54 C ATOM 663 C GLU A 46 -1.293 25.401 -17.137 1.00 53.11 C ATOM 664 O GLU A 46 -0.680 24.492 -16.577 1.00 42.34 O ATOM 665 CB GLU A 46 -3.533 25.395 -18.253 1.00 22.42 C ATOM 666 CG GLU A 46 -4.986 24.981 -18.088 1.00 65.12 C ATOM 667 CD GLU A 46 -5.139 23.509 -17.760 1.00 32.51 C ATOM 668 OE1 GLU A 46 -4.179 22.916 -17.224 1.00 55.21 O ATOM 669 OE2 GLU A 46 -6.220 22.949 -18.039 1.00 34.11 O ATOM 0 H GLU A 46 -3.688 27.476 -16.942 1.00 12.54 H new ATOM 0 HA GLU A 46 -3.136 24.824 -16.220 1.00 31.54 H new ATOM 0 HB2 GLU A 46 -3.491 26.328 -18.815 1.00 22.42 H new ATOM 0 HB3 GLU A 46 -3.014 24.642 -18.846 1.00 22.42 H new ATOM 0 HG2 GLU A 46 -5.442 25.575 -17.296 1.00 65.12 H new ATOM 0 HG3 GLU A 46 -5.530 25.203 -19.006 1.00 65.12 H new ATOM 676 N VAL A 47 -0.708 26.275 -17.950 1.00 11.33 N ATOM 677 CA VAL A 47 0.720 26.216 -18.236 1.00 23.24 C ATOM 678 C VAL A 47 1.541 26.307 -16.954 1.00 65.54 C ATOM 679 O VAL A 47 2.577 25.656 -16.821 1.00 42.20 O ATOM 680 CB VAL A 47 1.150 27.347 -19.189 1.00 14.13 C ATOM 681 CG1 VAL A 47 0.807 28.705 -18.594 1.00 65.23 C ATOM 682 CG2 VAL A 47 2.636 27.249 -19.495 1.00 44.43 C ATOM 0 H VAL A 47 -1.202 27.033 -18.422 1.00 11.33 H new ATOM 0 HA VAL A 47 0.907 25.256 -18.717 1.00 23.24 H new ATOM 0 HB VAL A 47 0.602 27.239 -20.125 1.00 14.13 H new ATOM 0 HG11 VAL A 47 1.118 29.492 -19.281 1.00 65.23 H new ATOM 0 HG12 VAL A 47 -0.269 28.770 -18.431 1.00 65.23 H new ATOM 0 HG13 VAL A 47 1.326 28.827 -17.643 1.00 65.23 H new ATOM 0 HG21 VAL A 47 2.923 28.056 -20.170 1.00 44.43 H new ATOM 0 HG22 VAL A 47 3.204 27.332 -18.569 1.00 44.43 H new ATOM 0 HG23 VAL A 47 2.848 26.289 -19.966 1.00 44.43 H new ATOM 692 N GLY A 48 1.071 27.118 -16.012 1.00 51.54 N ATOM 693 CA GLY A 48 1.774 27.280 -14.753 1.00 33.50 C ATOM 694 C GLY A 48 1.797 26.004 -13.935 1.00 21.32 C ATOM 695 O GLY A 48 2.777 25.717 -13.246 1.00 63.54 O ATOM 0 H GLY A 48 0.215 27.666 -16.098 1.00 51.54 H new ATOM 0 HA2 GLY A 48 2.797 27.600 -14.950 1.00 33.50 H new ATOM 0 HA3 GLY A 48 1.298 28.071 -14.174 1.00 33.50 H new ATOM 699 N LEU A 49 0.715 25.236 -14.007 1.00 40.54 N ATOM 700 CA LEU A 49 0.614 23.984 -13.266 1.00 50.10 C ATOM 701 C LEU A 49 1.518 22.917 -13.874 1.00 71.34 C ATOM 702 O LEU A 49 2.125 22.121 -13.158 1.00 0.51 O ATOM 703 CB LEU A 49 -0.835 23.493 -13.250 1.00 42.44 C ATOM 704 CG LEU A 49 -1.277 22.747 -11.991 1.00 52.51 C ATOM 705 CD1 LEU A 49 -2.454 23.455 -11.337 1.00 43.20 C ATOM 706 CD2 LEU A 49 -1.637 21.307 -12.323 1.00 61.43 C ATOM 0 H LEU A 49 -0.105 25.459 -14.571 1.00 40.54 H new ATOM 0 HA LEU A 49 0.939 24.169 -12.242 1.00 50.10 H new ATOM 0 HB2 LEU A 49 -1.490 24.353 -13.387 1.00 42.44 H new ATOM 0 HB3 LEU A 49 -0.985 22.838 -14.108 1.00 42.44 H new ATOM 0 HG LEU A 49 -0.446 22.739 -11.286 1.00 52.51 H new ATOM 0 HD11 LEU A 49 -2.755 22.910 -10.442 1.00 43.20 H new ATOM 0 HD12 LEU A 49 -2.162 24.469 -11.063 1.00 43.20 H new ATOM 0 HD13 LEU A 49 -3.289 23.494 -12.036 1.00 43.20 H new ATOM 0 HD21 LEU A 49 -1.949 20.791 -11.415 1.00 61.43 H new ATOM 0 HD22 LEU A 49 -2.452 21.293 -13.047 1.00 61.43 H new ATOM 0 HD23 LEU A 49 -0.768 20.803 -12.746 1.00 61.43 H new ATOM 718 N ALA A 50 1.604 22.907 -15.201 1.00 12.14 N ATOM 719 CA ALA A 50 2.437 21.941 -15.905 1.00 71.41 C ATOM 720 C ALA A 50 3.904 22.097 -15.520 1.00 61.22 C ATOM 721 O ALA A 50 4.585 21.116 -15.219 1.00 25.13 O ATOM 722 CB ALA A 50 2.265 22.093 -17.409 1.00 73.42 C ATOM 0 H ALA A 50 1.107 23.557 -15.809 1.00 12.14 H new ATOM 0 HA ALA A 50 2.116 20.941 -15.613 1.00 71.41 H new ATOM 0 HB1 ALA A 50 2.893 21.365 -17.922 1.00 73.42 H new ATOM 0 HB2 ALA A 50 1.222 21.924 -17.675 1.00 73.42 H new ATOM 0 HB3 ALA A 50 2.557 23.100 -17.709 1.00 73.42 H new ATOM 728 N LEU A 51 4.386 23.335 -15.533 1.00 75.10 N ATOM 729 CA LEU A 51 5.773 23.620 -15.186 1.00 25.23 C ATOM 730 C LEU A 51 6.052 23.274 -13.726 1.00 74.24 C ATOM 731 O LEU A 51 7.002 22.555 -13.419 1.00 24.21 O ATOM 732 CB LEU A 51 6.092 25.094 -15.442 1.00 33.12 C ATOM 733 CG LEU A 51 6.089 25.537 -16.905 1.00 63.55 C ATOM 734 CD1 LEU A 51 5.243 26.787 -17.083 1.00 55.25 C ATOM 735 CD2 LEU A 51 7.511 25.779 -17.392 1.00 32.04 C ATOM 0 H LEU A 51 3.836 24.158 -15.780 1.00 75.10 H new ATOM 0 HA LEU A 51 6.413 23.002 -15.816 1.00 25.23 H new ATOM 0 HB2 LEU A 51 5.369 25.701 -14.898 1.00 33.12 H new ATOM 0 HB3 LEU A 51 7.073 25.311 -15.019 1.00 33.12 H new ATOM 0 HG LEU A 51 5.651 24.739 -17.505 1.00 63.55 H new ATOM 0 HD11 LEU A 51 5.253 27.087 -18.131 1.00 55.25 H new ATOM 0 HD12 LEU A 51 4.218 26.580 -16.775 1.00 55.25 H new ATOM 0 HD13 LEU A 51 5.650 27.592 -16.471 1.00 55.25 H new ATOM 0 HD21 LEU A 51 7.490 26.094 -18.435 1.00 32.04 H new ATOM 0 HD22 LEU A 51 7.975 26.558 -16.787 1.00 32.04 H new ATOM 0 HD23 LEU A 51 8.088 24.859 -17.302 1.00 32.04 H new ATOM 747 N ARG A 52 5.215 23.789 -12.832 1.00 34.13 N ATOM 748 CA ARG A 52 5.370 23.534 -11.405 1.00 32.43 C ATOM 749 C ARG A 52 5.298 22.038 -11.109 1.00 1.41 C ATOM 750 O ARG A 52 6.077 21.513 -10.313 1.00 3.33 O ATOM 751 CB ARG A 52 4.291 24.273 -10.612 1.00 55.42 C ATOM 752 CG ARG A 52 4.758 25.602 -10.040 1.00 72.22 C ATOM 753 CD ARG A 52 3.929 26.011 -8.833 1.00 14.01 C ATOM 754 NE ARG A 52 2.841 26.915 -9.197 1.00 3.51 N ATOM 755 CZ ARG A 52 3.009 28.214 -9.421 1.00 23.01 C ATOM 756 NH1 ARG A 52 4.214 28.757 -9.319 1.00 45.12 N ATOM 757 NH2 ARG A 52 1.970 28.972 -9.748 1.00 64.10 N ATOM 0 H ARG A 52 4.423 24.385 -13.070 1.00 34.13 H new ATOM 0 HA ARG A 52 6.350 23.901 -11.101 1.00 32.43 H new ATOM 0 HB2 ARG A 52 3.432 24.448 -11.259 1.00 55.42 H new ATOM 0 HB3 ARG A 52 3.951 23.635 -9.796 1.00 55.42 H new ATOM 0 HG2 ARG A 52 5.807 25.528 -9.754 1.00 72.22 H new ATOM 0 HG3 ARG A 52 4.691 26.373 -10.807 1.00 72.22 H new ATOM 0 HD2 ARG A 52 3.517 25.121 -8.358 1.00 14.01 H new ATOM 0 HD3 ARG A 52 4.572 26.495 -8.099 1.00 14.01 H new ATOM 0 HE ARG A 52 1.901 26.528 -9.284 1.00 3.51 H new ATOM 0 HH11 ARG A 52 5.015 28.177 -9.068 1.00 45.12 H new ATOM 0 HH12 ARG A 52 4.340 29.754 -9.491 1.00 45.12 H new ATOM 0 HH21 ARG A 52 1.041 28.558 -9.828 1.00 64.10 H new ATOM 0 HH22 ARG A 52 2.100 29.969 -9.920 1.00 64.10 H new ATOM 771 N THR A 53 4.357 21.357 -11.755 1.00 61.21 N ATOM 772 CA THR A 53 4.182 19.923 -11.561 1.00 1.15 C ATOM 773 C THR A 53 5.353 19.142 -12.146 1.00 32.11 C ATOM 774 O THR A 53 5.822 18.169 -11.553 1.00 51.31 O ATOM 775 CB THR A 53 2.874 19.425 -12.204 1.00 22.55 C ATOM 776 OG1 THR A 53 1.752 20.078 -11.600 1.00 73.52 O ATOM 777 CG2 THR A 53 2.735 17.918 -12.048 1.00 33.33 C ATOM 0 H THR A 53 3.704 21.776 -12.417 1.00 61.21 H new ATOM 0 HA THR A 53 4.137 19.753 -10.485 1.00 1.15 H new ATOM 0 HB THR A 53 2.903 19.663 -13.267 1.00 22.55 H new ATOM 0 HG1 THR A 53 1.605 20.944 -12.034 1.00 73.52 H new ATOM 0 HG21 THR A 53 1.804 17.589 -12.510 1.00 33.33 H new ATOM 0 HG22 THR A 53 3.576 17.423 -12.534 1.00 33.33 H new ATOM 0 HG23 THR A 53 2.725 17.661 -10.989 1.00 33.33 H new ATOM 785 N LEU A 54 5.822 19.573 -13.312 1.00 34.22 N ATOM 786 CA LEU A 54 6.940 18.913 -13.978 1.00 14.53 C ATOM 787 C LEU A 54 8.138 18.794 -13.041 1.00 75.10 C ATOM 788 O LEU A 54 8.843 17.784 -13.044 1.00 1.23 O ATOM 789 CB LEU A 54 7.337 19.687 -15.236 1.00 61.23 C ATOM 790 CG LEU A 54 6.545 19.361 -16.503 1.00 33.43 C ATOM 791 CD1 LEU A 54 6.691 20.476 -17.526 1.00 64.22 C ATOM 792 CD2 LEU A 54 7.000 18.032 -17.089 1.00 40.44 C ATOM 0 H LEU A 54 5.446 20.376 -13.816 1.00 34.22 H new ATOM 0 HA LEU A 54 6.622 17.909 -14.261 1.00 14.53 H new ATOM 0 HB2 LEU A 54 7.233 20.752 -15.031 1.00 61.23 H new ATOM 0 HB3 LEU A 54 8.393 19.502 -15.434 1.00 61.23 H new ATOM 0 HG LEU A 54 5.491 19.276 -16.238 1.00 33.43 H new ATOM 0 HD11 LEU A 54 6.121 20.226 -18.421 1.00 64.22 H new ATOM 0 HD12 LEU A 54 6.315 21.408 -17.104 1.00 64.22 H new ATOM 0 HD13 LEU A 54 7.743 20.594 -17.788 1.00 64.22 H new ATOM 0 HD21 LEU A 54 6.426 17.816 -17.990 1.00 40.44 H new ATOM 0 HD22 LEU A 54 8.060 18.088 -17.339 1.00 40.44 H new ATOM 0 HD23 LEU A 54 6.841 17.239 -16.359 1.00 40.44 H new ATOM 804 N LEU A 55 8.361 19.829 -12.239 1.00 55.33 N ATOM 805 CA LEU A 55 9.472 19.840 -11.295 1.00 21.14 C ATOM 806 C LEU A 55 9.325 18.721 -10.268 1.00 42.13 C ATOM 807 O LEU A 55 10.285 18.013 -9.966 1.00 61.31 O ATOM 808 CB LEU A 55 9.550 21.192 -10.584 1.00 2.31 C ATOM 809 CG LEU A 55 10.767 21.408 -9.684 1.00 2.14 C ATOM 810 CD1 LEU A 55 12.023 21.601 -10.520 1.00 74.32 C ATOM 811 CD2 LEU A 55 10.547 22.602 -8.766 1.00 50.13 C ATOM 0 H LEU A 55 7.787 20.672 -12.224 1.00 55.33 H new ATOM 0 HA LEU A 55 10.393 19.677 -11.854 1.00 21.14 H new ATOM 0 HB2 LEU A 55 9.537 21.978 -11.339 1.00 2.31 H new ATOM 0 HB3 LEU A 55 8.651 21.315 -9.981 1.00 2.31 H new ATOM 0 HG LEU A 55 10.899 20.520 -9.067 1.00 2.14 H new ATOM 0 HD11 LEU A 55 12.878 21.753 -9.862 1.00 74.32 H new ATOM 0 HD12 LEU A 55 12.191 20.716 -11.134 1.00 74.32 H new ATOM 0 HD13 LEU A 55 11.901 22.472 -11.164 1.00 74.32 H new ATOM 0 HD21 LEU A 55 11.423 22.740 -8.133 1.00 50.13 H new ATOM 0 HD22 LEU A 55 10.388 23.498 -9.366 1.00 50.13 H new ATOM 0 HD23 LEU A 55 9.672 22.424 -8.141 1.00 50.13 H new ATOM 823 N ALA A 56 8.117 18.567 -9.737 1.00 74.15 N ATOM 824 CA ALA A 56 7.843 17.532 -8.749 1.00 20.44 C ATOM 825 C ALA A 56 7.871 16.145 -9.383 1.00 55.33 C ATOM 826 O ALA A 56 8.436 15.205 -8.824 1.00 4.42 O ATOM 827 CB ALA A 56 6.499 17.782 -8.081 1.00 21.24 C ATOM 0 H ALA A 56 7.312 19.146 -9.975 1.00 74.15 H new ATOM 0 HA ALA A 56 8.626 17.572 -7.992 1.00 20.44 H new ATOM 0 HB1 ALA A 56 6.307 17.001 -7.345 1.00 21.24 H new ATOM 0 HB2 ALA A 56 6.514 18.752 -7.585 1.00 21.24 H new ATOM 0 HB3 ALA A 56 5.711 17.772 -8.834 1.00 21.24 H new ATOM 833 N THR A 57 7.255 16.024 -10.555 1.00 71.44 N ATOM 834 CA THR A 57 7.207 14.752 -11.265 1.00 63.32 C ATOM 835 C THR A 57 8.609 14.200 -11.501 1.00 11.55 C ATOM 836 O THR A 57 8.930 13.091 -11.074 1.00 4.31 O ATOM 837 CB THR A 57 6.489 14.891 -12.621 1.00 13.35 C ATOM 838 OG1 THR A 57 7.168 15.850 -13.439 1.00 10.23 O ATOM 839 CG2 THR A 57 5.042 15.319 -12.424 1.00 71.45 C ATOM 0 H THR A 57 6.782 16.792 -11.032 1.00 71.44 H new ATOM 0 HA THR A 57 6.648 14.061 -10.635 1.00 63.32 H new ATOM 0 HB THR A 57 6.501 13.920 -13.116 1.00 13.35 H new ATOM 0 HG1 THR A 57 7.601 16.519 -12.868 1.00 10.23 H new ATOM 0 HG21 THR A 57 4.554 15.411 -13.395 1.00 71.45 H new ATOM 0 HG22 THR A 57 4.520 14.573 -11.825 1.00 71.45 H new ATOM 0 HG23 THR A 57 5.014 16.280 -11.911 1.00 71.45 H new ATOM 847 N VAL A 58 9.441 14.982 -12.182 1.00 13.34 N ATOM 848 CA VAL A 58 10.810 14.573 -12.472 1.00 75.20 C ATOM 849 C VAL A 58 11.612 14.388 -11.189 1.00 10.40 C ATOM 850 O VAL A 58 12.458 13.498 -11.096 1.00 14.51 O ATOM 851 CB VAL A 58 11.525 15.601 -13.369 1.00 33.14 C ATOM 852 CG1 VAL A 58 11.594 16.955 -12.679 1.00 33.34 C ATOM 853 CG2 VAL A 58 12.916 15.109 -13.737 1.00 5.33 C ATOM 0 H VAL A 58 9.191 15.902 -12.543 1.00 13.34 H new ATOM 0 HA VAL A 58 10.751 13.621 -13.000 1.00 75.20 H new ATOM 0 HB VAL A 58 10.951 15.718 -14.288 1.00 33.14 H new ATOM 0 HG11 VAL A 58 12.102 17.668 -13.328 1.00 33.34 H new ATOM 0 HG12 VAL A 58 10.584 17.309 -12.471 1.00 33.34 H new ATOM 0 HG13 VAL A 58 12.145 16.859 -11.743 1.00 33.34 H new ATOM 0 HG21 VAL A 58 13.407 15.847 -14.371 1.00 5.33 H new ATOM 0 HG22 VAL A 58 13.502 14.962 -12.830 1.00 5.33 H new ATOM 0 HG23 VAL A 58 12.837 14.164 -14.275 1.00 5.33 H new ATOM 863 N ASP A 59 11.341 15.235 -10.202 1.00 30.24 N ATOM 864 CA ASP A 59 12.037 15.165 -8.922 1.00 34.31 C ATOM 865 C ASP A 59 11.959 13.758 -8.337 1.00 75.13 C ATOM 866 O ASP A 59 12.931 13.254 -7.776 1.00 40.42 O ATOM 867 CB ASP A 59 11.442 16.173 -7.938 1.00 15.12 C ATOM 868 CG ASP A 59 11.809 15.865 -6.500 1.00 21.33 C ATOM 869 OD1 ASP A 59 13.017 15.860 -6.185 1.00 23.14 O ATOM 870 OD2 ASP A 59 10.889 15.627 -5.689 1.00 53.35 O ATOM 0 H ASP A 59 10.645 15.978 -10.263 1.00 30.24 H new ATOM 0 HA ASP A 59 13.085 15.411 -9.093 1.00 34.31 H new ATOM 0 HB2 ASP A 59 11.791 17.174 -8.192 1.00 15.12 H new ATOM 0 HB3 ASP A 59 10.357 16.178 -8.040 1.00 15.12 H new ATOM 875 N GLU A 60 10.795 13.130 -8.472 1.00 55.13 N ATOM 876 CA GLU A 60 10.590 11.782 -7.955 1.00 50.03 C ATOM 877 C GLU A 60 10.967 10.736 -9.000 1.00 60.41 C ATOM 878 O GLU A 60 11.086 9.550 -8.692 1.00 31.13 O ATOM 879 CB GLU A 60 9.133 11.591 -7.529 1.00 10.01 C ATOM 880 CG GLU A 60 8.148 11.654 -8.684 1.00 15.32 C ATOM 881 CD GLU A 60 6.784 11.101 -8.318 1.00 51.01 C ATOM 882 OE1 GLU A 60 6.509 10.953 -7.109 1.00 3.03 O ATOM 883 OE2 GLU A 60 5.992 10.816 -9.240 1.00 72.03 O ATOM 0 H GLU A 60 9.980 13.533 -8.935 1.00 55.13 H new ATOM 0 HA GLU A 60 11.235 11.652 -7.086 1.00 50.03 H new ATOM 0 HB2 GLU A 60 9.033 10.628 -7.029 1.00 10.01 H new ATOM 0 HB3 GLU A 60 8.873 12.357 -6.799 1.00 10.01 H new ATOM 0 HG2 GLU A 60 8.041 12.689 -9.009 1.00 15.32 H new ATOM 0 HG3 GLU A 60 8.548 11.094 -9.529 1.00 15.32 H new ATOM 890 N SER A 61 11.153 11.184 -10.238 1.00 21.25 N ATOM 891 CA SER A 61 11.512 10.287 -11.330 1.00 22.45 C ATOM 892 C SER A 61 12.964 9.834 -11.206 1.00 0.12 C ATOM 893 O SER A 61 13.343 8.778 -11.714 1.00 41.12 O ATOM 894 CB SER A 61 11.294 10.977 -12.677 1.00 63.34 C ATOM 895 OG SER A 61 11.408 10.054 -13.747 1.00 42.20 O ATOM 0 H SER A 61 11.061 12.163 -10.509 1.00 21.25 H new ATOM 0 HA SER A 61 10.870 9.408 -11.272 1.00 22.45 H new ATOM 0 HB2 SER A 61 10.308 11.441 -12.696 1.00 63.34 H new ATOM 0 HB3 SER A 61 12.025 11.776 -12.802 1.00 63.34 H new ATOM 0 HG SER A 61 11.263 10.519 -14.597 1.00 42.20 H new ATOM 901 N LEU A 62 13.772 10.641 -10.527 1.00 24.41 N ATOM 902 CA LEU A 62 15.184 10.325 -10.335 1.00 74.21 C ATOM 903 C LEU A 62 15.358 8.900 -9.818 1.00 55.25 C ATOM 904 O LEU A 62 15.986 8.055 -10.456 1.00 4.04 O ATOM 905 CB LEU A 62 15.820 11.315 -9.358 1.00 51.01 C ATOM 906 CG LEU A 62 16.820 12.303 -9.960 1.00 22.33 C ATOM 907 CD1 LEU A 62 17.404 13.198 -8.877 1.00 74.43 C ATOM 908 CD2 LEU A 62 17.927 11.560 -10.694 1.00 51.12 C ATOM 0 H LEU A 62 13.474 11.518 -10.100 1.00 24.41 H new ATOM 0 HA LEU A 62 15.683 10.405 -11.301 1.00 74.21 H new ATOM 0 HB2 LEU A 62 15.023 11.883 -8.877 1.00 51.01 H new ATOM 0 HB3 LEU A 62 16.325 10.749 -8.575 1.00 51.01 H new ATOM 0 HG LEU A 62 16.293 12.932 -10.678 1.00 22.33 H new ATOM 0 HD11 LEU A 62 18.113 13.894 -9.324 1.00 74.43 H new ATOM 0 HD12 LEU A 62 16.602 13.757 -8.395 1.00 74.43 H new ATOM 0 HD13 LEU A 62 17.916 12.585 -8.135 1.00 74.43 H new ATOM 0 HD21 LEU A 62 18.630 12.279 -11.116 1.00 51.12 H new ATOM 0 HD22 LEU A 62 18.451 10.907 -9.997 1.00 51.12 H new ATOM 0 HD23 LEU A 62 17.494 10.962 -11.496 1.00 51.12 H new ATOM 920 N PRO A 63 14.786 8.625 -8.637 1.00 12.13 N ATOM 921 CA PRO A 63 14.861 7.302 -8.010 1.00 4.35 C ATOM 922 C PRO A 63 14.043 6.257 -8.760 1.00 14.43 C ATOM 923 O PRO A 63 14.478 5.119 -8.931 1.00 34.54 O ATOM 924 CB PRO A 63 14.278 7.538 -6.614 1.00 24.41 C ATOM 925 CG PRO A 63 13.383 8.718 -6.771 1.00 61.14 C ATOM 926 CD PRO A 63 14.021 9.584 -7.822 1.00 50.20 C ATOM 0 HA PRO A 63 15.879 6.912 -8.002 1.00 4.35 H new ATOM 0 HB2 PRO A 63 13.726 6.666 -6.263 1.00 24.41 H new ATOM 0 HB3 PRO A 63 15.064 7.732 -5.884 1.00 24.41 H new ATOM 0 HG2 PRO A 63 12.382 8.411 -7.073 1.00 61.14 H new ATOM 0 HG3 PRO A 63 13.280 9.258 -5.830 1.00 61.14 H new ATOM 0 HD2 PRO A 63 13.274 10.110 -8.416 1.00 50.20 H new ATOM 0 HD3 PRO A 63 14.668 10.341 -7.380 1.00 50.20 H new ATOM 934 N VAL A 64 12.854 6.652 -9.206 1.00 44.24 N ATOM 935 CA VAL A 64 11.975 5.750 -9.940 1.00 61.10 C ATOM 936 C VAL A 64 12.709 5.091 -11.102 1.00 45.45 C ATOM 937 O VAL A 64 12.385 3.972 -11.502 1.00 4.10 O ATOM 938 CB VAL A 64 10.738 6.490 -10.482 1.00 35.40 C ATOM 939 CG1 VAL A 64 9.905 5.567 -11.359 1.00 30.43 C ATOM 940 CG2 VAL A 64 9.905 7.045 -9.336 1.00 71.52 C ATOM 0 H VAL A 64 12.478 7.591 -9.072 1.00 44.24 H new ATOM 0 HA VAL A 64 11.651 4.982 -9.237 1.00 61.10 H new ATOM 0 HB VAL A 64 11.076 7.326 -11.094 1.00 35.40 H new ATOM 0 HG11 VAL A 64 9.035 6.107 -11.733 1.00 30.43 H new ATOM 0 HG12 VAL A 64 10.507 5.223 -12.200 1.00 30.43 H new ATOM 0 HG13 VAL A 64 9.575 4.709 -10.774 1.00 30.43 H new ATOM 0 HG21 VAL A 64 9.035 7.565 -9.737 1.00 71.52 H new ATOM 0 HG22 VAL A 64 9.576 6.227 -8.696 1.00 71.52 H new ATOM 0 HG23 VAL A 64 10.507 7.742 -8.753 1.00 71.52 H new ATOM 950 N LEU A 65 13.701 5.792 -11.642 1.00 13.32 N ATOM 951 CA LEU A 65 14.483 5.276 -12.759 1.00 62.24 C ATOM 952 C LEU A 65 15.928 5.020 -12.341 1.00 14.51 C ATOM 953 O LEU A 65 16.422 5.575 -11.359 1.00 65.41 O ATOM 954 CB LEU A 65 14.446 6.259 -13.931 1.00 72.50 C ATOM 955 CG LEU A 65 13.238 6.147 -14.862 1.00 11.40 C ATOM 956 CD1 LEU A 65 13.542 5.211 -16.021 1.00 74.01 C ATOM 957 CD2 LEU A 65 12.015 5.669 -14.094 1.00 33.23 C ATOM 0 H LEU A 65 13.982 6.719 -11.324 1.00 13.32 H new ATOM 0 HA LEU A 65 14.042 4.330 -13.072 1.00 62.24 H new ATOM 0 HB2 LEU A 65 14.478 7.272 -13.531 1.00 72.50 H new ATOM 0 HB3 LEU A 65 15.350 6.121 -14.524 1.00 72.50 H new ATOM 0 HG LEU A 65 13.023 7.136 -15.268 1.00 11.40 H new ATOM 0 HD11 LEU A 65 12.671 5.144 -16.673 1.00 74.01 H new ATOM 0 HD12 LEU A 65 14.390 5.596 -16.587 1.00 74.01 H new ATOM 0 HD13 LEU A 65 13.784 4.221 -15.635 1.00 74.01 H new ATOM 0 HD21 LEU A 65 11.165 5.595 -14.773 1.00 33.23 H new ATOM 0 HD22 LEU A 65 12.218 4.690 -13.659 1.00 33.23 H new ATOM 0 HD23 LEU A 65 11.784 6.378 -13.299 1.00 33.23 H new ATOM 969 N PRO A 66 16.622 4.163 -13.103 1.00 42.04 N ATOM 970 CA PRO A 66 18.021 3.817 -12.833 1.00 33.12 C ATOM 971 C PRO A 66 18.969 4.980 -13.105 1.00 72.21 C ATOM 972 O PRO A 66 18.836 5.679 -14.109 1.00 65.43 O ATOM 973 CB PRO A 66 18.295 2.665 -13.803 1.00 21.13 C ATOM 974 CG PRO A 66 17.325 2.867 -14.915 1.00 71.00 C ATOM 975 CD PRO A 66 16.096 3.466 -14.289 1.00 31.21 C ATOM 0 HA PRO A 66 18.182 3.558 -11.786 1.00 33.12 H new ATOM 0 HB2 PRO A 66 19.323 2.688 -14.165 1.00 21.13 H new ATOM 0 HB3 PRO A 66 18.149 1.698 -13.321 1.00 21.13 H new ATOM 0 HG2 PRO A 66 17.737 3.529 -15.677 1.00 71.00 H new ATOM 0 HG3 PRO A 66 17.092 1.922 -15.406 1.00 71.00 H new ATOM 0 HD2 PRO A 66 15.593 4.154 -14.969 1.00 31.21 H new ATOM 0 HD3 PRO A 66 15.370 2.700 -14.016 1.00 31.21 H new ATOM 983 N ALA A 67 19.925 5.181 -12.204 1.00 61.15 N ATOM 984 CA ALA A 67 20.897 6.258 -12.350 1.00 32.45 C ATOM 985 C ALA A 67 21.570 6.209 -13.717 1.00 23.12 C ATOM 986 O ALA A 67 22.145 5.190 -14.100 1.00 75.15 O ATOM 987 CB ALA A 67 21.938 6.181 -11.243 1.00 4.20 C ATOM 0 H ALA A 67 20.047 4.613 -11.366 1.00 61.15 H new ATOM 0 HA ALA A 67 20.367 7.207 -12.270 1.00 32.45 H new ATOM 0 HB1 ALA A 67 22.658 6.991 -11.364 1.00 4.20 H new ATOM 0 HB2 ALA A 67 21.447 6.273 -10.274 1.00 4.20 H new ATOM 0 HB3 ALA A 67 22.456 5.224 -11.297 1.00 4.20 H new ATOM 993 N SER A 68 21.495 7.316 -14.448 1.00 43.21 N ATOM 994 CA SER A 68 22.094 7.398 -15.775 1.00 61.12 C ATOM 995 C SER A 68 21.830 8.761 -16.407 1.00 40.14 C ATOM 996 O SER A 68 22.656 9.282 -17.157 1.00 44.22 O ATOM 997 CB SER A 68 21.543 6.290 -16.675 1.00 42.34 C ATOM 998 OG SER A 68 21.651 6.644 -18.043 1.00 54.23 O ATOM 0 H SER A 68 21.025 8.169 -14.144 1.00 43.21 H new ATOM 0 HA SER A 68 23.171 7.269 -15.669 1.00 61.12 H new ATOM 0 HB2 SER A 68 22.087 5.364 -16.492 1.00 42.34 H new ATOM 0 HB3 SER A 68 20.499 6.101 -16.426 1.00 42.34 H new ATOM 0 HG SER A 68 21.294 5.919 -18.598 1.00 54.23 H new ATOM 1004 N THR A 69 20.671 9.335 -16.099 1.00 71.24 N ATOM 1005 CA THR A 69 20.296 10.636 -16.637 1.00 54.31 C ATOM 1006 C THR A 69 20.265 11.696 -15.541 1.00 71.25 C ATOM 1007 O THR A 69 19.546 12.690 -15.645 1.00 51.24 O ATOM 1008 CB THR A 69 18.918 10.584 -17.324 1.00 12.31 C ATOM 1009 OG1 THR A 69 18.605 11.861 -17.891 1.00 15.41 O ATOM 1010 CG2 THR A 69 17.834 10.184 -16.334 1.00 24.30 C ATOM 0 H THR A 69 19.976 8.919 -15.479 1.00 71.24 H new ATOM 0 HA THR A 69 21.052 10.902 -17.375 1.00 54.31 H new ATOM 0 HB THR A 69 18.959 9.835 -18.115 1.00 12.31 H new ATOM 0 HG1 THR A 69 18.647 12.548 -17.193 1.00 15.41 H new ATOM 0 HG21 THR A 69 16.870 10.154 -16.842 1.00 24.30 H new ATOM 0 HG22 THR A 69 18.060 9.199 -15.926 1.00 24.30 H new ATOM 0 HG23 THR A 69 17.795 10.912 -15.524 1.00 24.30 H new ATOM 1018 N HIS A 70 21.050 11.477 -14.491 1.00 51.42 N ATOM 1019 CA HIS A 70 21.113 12.415 -13.376 1.00 3.31 C ATOM 1020 C HIS A 70 21.492 13.811 -13.861 1.00 52.40 C ATOM 1021 O HIS A 70 20.849 14.799 -13.503 1.00 63.32 O ATOM 1022 CB HIS A 70 22.123 11.934 -12.334 1.00 21.42 C ATOM 1023 CG HIS A 70 23.456 11.571 -12.914 1.00 14.04 C ATOM 1024 ND1 HIS A 70 24.504 12.462 -13.005 1.00 22.23 N ATOM 1025 CD2 HIS A 70 23.908 10.405 -13.432 1.00 52.43 C ATOM 1026 CE1 HIS A 70 25.543 11.860 -13.556 1.00 3.31 C ATOM 1027 NE2 HIS A 70 25.208 10.611 -13.824 1.00 54.44 N ATOM 0 H HIS A 70 21.651 10.659 -14.389 1.00 51.42 H new ATOM 0 HA HIS A 70 20.125 12.464 -12.919 1.00 3.31 H new ATOM 0 HB2 HIS A 70 22.262 12.715 -11.587 1.00 21.42 H new ATOM 0 HB3 HIS A 70 21.713 11.067 -11.816 1.00 21.42 H new ATOM 0 HD2 HIS A 70 23.350 9.484 -13.521 1.00 52.43 H new ATOM 0 HE1 HIS A 70 26.503 12.313 -13.754 1.00 3.31 H new ATOM 0 HE2 HIS A 70 25.816 9.913 -14.252 1.00 54.44 H new ATOM 1035 N ARG A 71 22.539 13.886 -14.676 1.00 72.33 N ATOM 1036 CA ARG A 71 23.004 15.161 -15.208 1.00 73.15 C ATOM 1037 C ARG A 71 21.856 15.931 -15.855 1.00 62.15 C ATOM 1038 O ARG A 71 21.569 17.067 -15.480 1.00 22.14 O ATOM 1039 CB ARG A 71 24.120 14.935 -16.230 1.00 2.04 C ATOM 1040 CG ARG A 71 24.788 16.218 -16.696 1.00 55.43 C ATOM 1041 CD ARG A 71 26.303 16.089 -16.700 1.00 73.13 C ATOM 1042 NE ARG A 71 26.769 15.151 -17.718 1.00 41.44 N ATOM 1043 CZ ARG A 71 26.892 15.463 -19.004 1.00 13.42 C ATOM 1044 NH1 ARG A 71 26.584 16.682 -19.426 1.00 3.22 N ATOM 1045 NH2 ARG A 71 27.323 14.555 -19.870 1.00 1.51 N ATOM 0 H ARG A 71 23.081 13.078 -14.982 1.00 72.33 H new ATOM 0 HA ARG A 71 23.394 15.752 -14.379 1.00 73.15 H new ATOM 0 HB2 ARG A 71 24.874 14.281 -15.793 1.00 2.04 H new ATOM 0 HB3 ARG A 71 23.709 14.414 -17.095 1.00 2.04 H new ATOM 0 HG2 ARG A 71 24.441 16.467 -17.699 1.00 55.43 H new ATOM 0 HG3 ARG A 71 24.494 17.040 -16.044 1.00 55.43 H new ATOM 0 HD2 ARG A 71 26.750 17.067 -16.877 1.00 73.13 H new ATOM 0 HD3 ARG A 71 26.641 15.757 -15.719 1.00 73.13 H new ATOM 0 HE ARG A 71 27.013 14.205 -17.426 1.00 41.44 H new ATOM 0 HH11 ARG A 71 26.252 17.382 -18.763 1.00 3.22 H new ATOM 0 HH12 ARG A 71 26.679 16.919 -20.413 1.00 3.22 H new ATOM 0 HH21 ARG A 71 27.560 13.616 -19.549 1.00 1.51 H new ATOM 0 HH22 ARG A 71 27.417 14.796 -20.857 1.00 1.51 H new ATOM 1059 N GLU A 72 21.205 15.304 -16.830 1.00 72.11 N ATOM 1060 CA GLU A 72 20.090 15.931 -17.530 1.00 12.44 C ATOM 1061 C GLU A 72 18.967 16.283 -16.558 1.00 75.33 C ATOM 1062 O GLU A 72 18.442 17.397 -16.576 1.00 25.11 O ATOM 1063 CB GLU A 72 19.560 15.005 -18.626 1.00 31.43 C ATOM 1064 CG GLU A 72 20.358 15.071 -19.917 1.00 73.02 C ATOM 1065 CD GLU A 72 19.585 14.539 -21.108 1.00 73.04 C ATOM 1066 OE1 GLU A 72 18.347 14.704 -21.133 1.00 71.21 O ATOM 1067 OE2 GLU A 72 20.217 13.958 -22.015 1.00 73.00 O ATOM 0 H GLU A 72 21.430 14.363 -17.153 1.00 72.11 H new ATOM 0 HA GLU A 72 20.453 16.851 -17.988 1.00 12.44 H new ATOM 0 HB2 GLU A 72 19.566 13.979 -18.257 1.00 31.43 H new ATOM 0 HB3 GLU A 72 18.522 15.262 -18.837 1.00 31.43 H new ATOM 0 HG2 GLU A 72 20.647 16.104 -20.109 1.00 73.02 H new ATOM 0 HG3 GLU A 72 21.278 14.499 -19.801 1.00 73.02 H new ATOM 1074 N ILE A 73 18.602 15.324 -15.713 1.00 41.41 N ATOM 1075 CA ILE A 73 17.542 15.532 -14.735 1.00 0.25 C ATOM 1076 C ILE A 73 17.831 16.748 -13.861 1.00 1.03 C ATOM 1077 O ILE A 73 16.941 17.551 -13.583 1.00 74.45 O ATOM 1078 CB ILE A 73 17.359 14.298 -13.832 1.00 72.53 C ATOM 1079 CG1 ILE A 73 16.734 13.148 -14.625 1.00 63.42 C ATOM 1080 CG2 ILE A 73 16.498 14.645 -12.627 1.00 5.52 C ATOM 1081 CD1 ILE A 73 15.295 13.397 -15.020 1.00 5.11 C ATOM 0 H ILE A 73 19.025 14.396 -15.686 1.00 41.41 H new ATOM 0 HA ILE A 73 16.623 15.701 -15.297 1.00 0.25 H new ATOM 0 HB ILE A 73 18.338 13.980 -13.474 1.00 72.53 H new ATOM 0 HG12 ILE A 73 17.324 12.975 -15.525 1.00 63.42 H new ATOM 0 HG13 ILE A 73 16.786 12.237 -14.030 1.00 63.42 H new ATOM 0 HG21 ILE A 73 16.378 13.762 -11.999 1.00 5.52 H new ATOM 0 HG22 ILE A 73 16.979 15.437 -12.052 1.00 5.52 H new ATOM 0 HG23 ILE A 73 15.519 14.985 -12.965 1.00 5.52 H new ATOM 0 HD11 ILE A 73 14.918 12.541 -15.579 1.00 5.11 H new ATOM 0 HD12 ILE A 73 14.691 13.540 -14.124 1.00 5.11 H new ATOM 0 HD13 ILE A 73 15.238 14.290 -15.642 1.00 5.11 H new ATOM 1093 N GLU A 74 19.083 16.878 -13.432 1.00 34.55 N ATOM 1094 CA GLU A 74 19.489 17.997 -12.590 1.00 31.22 C ATOM 1095 C GLU A 74 19.262 19.326 -13.305 1.00 24.40 C ATOM 1096 O GLU A 74 18.643 20.239 -12.759 1.00 65.51 O ATOM 1097 CB GLU A 74 20.962 17.861 -12.198 1.00 34.43 C ATOM 1098 CG GLU A 74 21.172 17.515 -10.733 1.00 41.20 C ATOM 1099 CD GLU A 74 22.211 16.429 -10.533 1.00 42.12 C ATOM 1100 OE1 GLU A 74 23.127 16.321 -11.375 1.00 73.14 O ATOM 1101 OE2 GLU A 74 22.108 15.687 -9.534 1.00 4.43 O ATOM 0 H GLU A 74 19.833 16.223 -13.654 1.00 34.55 H new ATOM 0 HA GLU A 74 18.878 17.980 -11.688 1.00 31.22 H new ATOM 0 HB2 GLU A 74 21.424 17.090 -12.815 1.00 34.43 H new ATOM 0 HB3 GLU A 74 21.476 18.796 -12.419 1.00 34.43 H new ATOM 0 HG2 GLU A 74 21.479 18.410 -10.193 1.00 41.20 H new ATOM 0 HG3 GLU A 74 20.225 17.191 -10.301 1.00 41.20 H new ATOM 1108 N MET A 75 19.769 19.426 -14.530 1.00 21.45 N ATOM 1109 CA MET A 75 19.622 20.642 -15.320 1.00 52.21 C ATOM 1110 C MET A 75 18.153 20.913 -15.632 1.00 45.32 C ATOM 1111 O MET A 75 17.762 22.054 -15.878 1.00 31.24 O ATOM 1112 CB MET A 75 20.420 20.531 -16.621 1.00 35.53 C ATOM 1113 CG MET A 75 21.755 21.255 -16.579 1.00 10.43 C ATOM 1114 SD MET A 75 22.952 20.575 -17.743 1.00 74.12 S ATOM 1115 CE MET A 75 24.410 20.472 -16.709 1.00 20.24 C ATOM 0 H MET A 75 20.285 18.680 -14.996 1.00 21.45 H new ATOM 0 HA MET A 75 20.011 21.475 -14.734 1.00 52.21 H new ATOM 0 HB2 MET A 75 20.594 19.478 -16.842 1.00 35.53 H new ATOM 0 HB3 MET A 75 19.823 20.934 -17.439 1.00 35.53 H new ATOM 0 HG2 MET A 75 21.598 22.311 -16.800 1.00 10.43 H new ATOM 0 HG3 MET A 75 22.163 21.198 -15.570 1.00 10.43 H new ATOM 0 HE1 MET A 75 25.240 20.068 -17.289 1.00 20.24 H new ATOM 0 HE2 MET A 75 24.671 21.467 -16.347 1.00 20.24 H new ATOM 0 HE3 MET A 75 24.209 19.819 -15.860 1.00 20.24 H new ATOM 1125 N ALA A 76 17.346 19.858 -15.621 1.00 61.31 N ATOM 1126 CA ALA A 76 15.921 19.983 -15.901 1.00 62.13 C ATOM 1127 C ALA A 76 15.201 20.709 -14.770 1.00 41.54 C ATOM 1128 O ALA A 76 14.243 21.446 -15.005 1.00 62.31 O ATOM 1129 CB ALA A 76 15.305 18.610 -16.126 1.00 51.10 C ATOM 0 H ALA A 76 17.655 18.907 -15.421 1.00 61.31 H new ATOM 0 HA ALA A 76 15.805 20.574 -16.809 1.00 62.13 H new ATOM 0 HB1 ALA A 76 14.241 18.718 -16.334 1.00 51.10 H new ATOM 0 HB2 ALA A 76 15.793 18.127 -16.972 1.00 51.10 H new ATOM 0 HB3 ALA A 76 15.440 18.000 -15.233 1.00 51.10 H new ATOM 1135 N GLN A 77 15.668 20.497 -13.544 1.00 62.45 N ATOM 1136 CA GLN A 77 15.067 21.131 -12.378 1.00 33.05 C ATOM 1137 C GLN A 77 15.183 22.649 -12.463 1.00 1.33 C ATOM 1138 O GLN A 77 14.178 23.356 -12.545 1.00 4.20 O ATOM 1139 CB GLN A 77 15.734 20.628 -11.096 1.00 71.54 C ATOM 1140 CG GLN A 77 15.315 19.219 -10.705 1.00 44.44 C ATOM 1141 CD GLN A 77 15.506 18.943 -9.227 1.00 43.21 C ATOM 1142 OE1 GLN A 77 16.534 19.293 -8.646 1.00 10.00 O ATOM 1143 NE2 GLN A 77 14.514 18.312 -8.610 1.00 3.45 N ATOM 0 H GLN A 77 16.461 19.891 -13.333 1.00 62.45 H new ATOM 0 HA GLN A 77 14.010 20.866 -12.357 1.00 33.05 H new ATOM 0 HB2 GLN A 77 16.816 20.654 -11.225 1.00 71.54 H new ATOM 0 HB3 GLN A 77 15.494 21.309 -10.280 1.00 71.54 H new ATOM 0 HG2 GLN A 77 14.267 19.070 -10.966 1.00 44.44 H new ATOM 0 HG3 GLN A 77 15.893 18.498 -11.283 1.00 44.44 H new ATOM 0 HE21 GLN A 77 13.680 18.040 -9.131 1.00 3.45 H new ATOM 0 HE22 GLN A 77 14.586 18.099 -7.615 1.00 3.45 H new ATOM 1152 N LYS A 78 16.416 23.145 -12.442 1.00 14.31 N ATOM 1153 CA LYS A 78 16.665 24.580 -12.518 1.00 31.13 C ATOM 1154 C LYS A 78 16.056 25.172 -13.785 1.00 31.23 C ATOM 1155 O LYS A 78 15.431 26.233 -13.748 1.00 72.43 O ATOM 1156 CB LYS A 78 18.169 24.859 -12.483 1.00 41.53 C ATOM 1157 CG LYS A 78 18.681 25.269 -11.113 1.00 34.41 C ATOM 1158 CD LYS A 78 20.199 25.317 -11.076 1.00 12.00 C ATOM 1159 CE LYS A 78 20.718 25.440 -9.652 1.00 1.13 C ATOM 1160 NZ LYS A 78 21.792 24.449 -9.365 1.00 41.12 N ATOM 0 H LYS A 78 17.258 22.574 -12.373 1.00 14.31 H new ATOM 0 HA LYS A 78 16.194 25.052 -11.656 1.00 31.13 H new ATOM 0 HB2 LYS A 78 18.703 23.966 -12.809 1.00 41.53 H new ATOM 0 HB3 LYS A 78 18.400 25.648 -13.199 1.00 41.53 H new ATOM 0 HG2 LYS A 78 18.279 26.248 -10.851 1.00 34.41 H new ATOM 0 HG3 LYS A 78 18.320 24.565 -10.363 1.00 34.41 H new ATOM 0 HD2 LYS A 78 20.604 24.415 -11.535 1.00 12.00 H new ATOM 0 HD3 LYS A 78 20.552 26.162 -11.667 1.00 12.00 H new ATOM 0 HE2 LYS A 78 21.101 26.448 -9.491 1.00 1.13 H new ATOM 0 HE3 LYS A 78 19.895 25.296 -8.952 1.00 1.13 H new ATOM 0 HZ1 LYS A 78 22.119 24.566 -8.385 1.00 41.12 H new ATOM 0 HZ2 LYS A 78 21.420 23.487 -9.494 1.00 41.12 H new ATOM 0 HZ3 LYS A 78 22.588 24.602 -10.016 1.00 41.12 H new ATOM 1174 N LEU A 79 16.241 24.480 -14.903 1.00 73.24 N ATOM 1175 CA LEU A 79 15.708 24.936 -16.182 1.00 52.44 C ATOM 1176 C LEU A 79 14.210 25.207 -16.083 1.00 30.21 C ATOM 1177 O LEU A 79 13.729 26.260 -16.503 1.00 1.22 O ATOM 1178 CB LEU A 79 15.979 23.896 -17.271 1.00 13.23 C ATOM 1179 CG LEU A 79 15.374 24.189 -18.644 1.00 62.14 C ATOM 1180 CD1 LEU A 79 16.456 24.199 -19.713 1.00 5.53 C ATOM 1181 CD2 LEU A 79 14.298 23.167 -18.982 1.00 65.05 C ATOM 0 H LEU A 79 16.756 23.601 -14.950 1.00 73.24 H new ATOM 0 HA LEU A 79 16.210 25.867 -16.445 1.00 52.44 H new ATOM 0 HB2 LEU A 79 17.058 23.793 -17.386 1.00 13.23 H new ATOM 0 HB3 LEU A 79 15.601 22.933 -16.928 1.00 13.23 H new ATOM 0 HG LEU A 79 14.913 25.176 -18.613 1.00 62.14 H new ATOM 0 HD11 LEU A 79 16.007 24.409 -20.684 1.00 5.53 H new ATOM 0 HD12 LEU A 79 17.191 24.969 -19.479 1.00 5.53 H new ATOM 0 HD13 LEU A 79 16.947 23.226 -19.743 1.00 5.53 H new ATOM 0 HD21 LEU A 79 13.878 23.391 -19.963 1.00 65.05 H new ATOM 0 HD22 LEU A 79 14.735 22.169 -18.994 1.00 65.05 H new ATOM 0 HD23 LEU A 79 13.508 23.208 -18.232 1.00 65.05 H new ATOM 1193 N LEU A 80 13.477 24.250 -15.523 1.00 45.41 N ATOM 1194 CA LEU A 80 12.033 24.386 -15.366 1.00 25.23 C ATOM 1195 C LEU A 80 11.682 25.696 -14.669 1.00 2.25 C ATOM 1196 O LEU A 80 10.794 26.426 -15.108 1.00 24.31 O ATOM 1197 CB LEU A 80 11.475 23.205 -14.569 1.00 55.43 C ATOM 1198 CG LEU A 80 10.615 22.214 -15.354 1.00 33.44 C ATOM 1199 CD1 LEU A 80 11.346 21.743 -16.601 1.00 25.42 C ATOM 1200 CD2 LEU A 80 10.233 21.029 -14.478 1.00 3.24 C ATOM 0 H LEU A 80 13.859 23.372 -15.170 1.00 45.41 H new ATOM 0 HA LEU A 80 11.583 24.393 -16.359 1.00 25.23 H new ATOM 0 HB2 LEU A 80 12.311 22.661 -14.129 1.00 55.43 H new ATOM 0 HB3 LEU A 80 10.881 23.597 -13.744 1.00 55.43 H new ATOM 0 HG LEU A 80 9.701 22.721 -15.664 1.00 33.44 H new ATOM 0 HD11 LEU A 80 10.718 21.038 -17.146 1.00 25.42 H new ATOM 0 HD12 LEU A 80 11.568 22.599 -17.238 1.00 25.42 H new ATOM 0 HD13 LEU A 80 12.276 21.253 -16.314 1.00 25.42 H new ATOM 0 HD21 LEU A 80 9.621 20.334 -15.053 1.00 3.24 H new ATOM 0 HD22 LEU A 80 11.136 20.522 -14.138 1.00 3.24 H new ATOM 0 HD23 LEU A 80 9.668 21.382 -13.615 1.00 3.24 H new ATOM 1212 N ASN A 81 12.387 25.989 -13.580 1.00 71.03 N ATOM 1213 CA ASN A 81 12.151 27.213 -12.823 1.00 74.20 C ATOM 1214 C ASN A 81 12.187 28.434 -13.737 1.00 65.21 C ATOM 1215 O ASN A 81 11.208 29.172 -13.843 1.00 44.33 O ATOM 1216 CB ASN A 81 13.194 27.360 -11.714 1.00 0.42 C ATOM 1217 CG ASN A 81 13.023 28.645 -10.926 1.00 41.15 C ATOM 1218 OD1 ASN A 81 13.708 29.637 -11.179 1.00 34.20 O ATOM 1219 ND2 ASN A 81 12.106 28.633 -9.966 1.00 22.41 N ATOM 0 H ASN A 81 13.126 25.396 -13.203 1.00 71.03 H new ATOM 0 HA ASN A 81 11.160 27.148 -12.374 1.00 74.20 H new ATOM 0 HB2 ASN A 81 13.122 26.509 -11.036 1.00 0.42 H new ATOM 0 HB3 ASN A 81 14.192 27.336 -12.152 1.00 0.42 H new ATOM 0 HD21 ASN A 81 11.946 29.468 -9.403 1.00 22.41 H new ATOM 0 HD22 ASN A 81 11.561 27.788 -9.791 1.00 22.41 H new ATOM 1226 N SER A 82 13.324 28.639 -14.396 1.00 13.15 N ATOM 1227 CA SER A 82 13.490 29.772 -15.298 1.00 51.14 C ATOM 1228 C SER A 82 12.359 29.823 -16.321 1.00 35.43 C ATOM 1229 O SER A 82 11.721 30.859 -16.506 1.00 55.12 O ATOM 1230 CB SER A 82 14.838 29.686 -16.017 1.00 30.54 C ATOM 1231 OG SER A 82 15.255 28.339 -16.158 1.00 21.44 O ATOM 0 H SER A 82 14.143 28.035 -14.322 1.00 13.15 H new ATOM 0 HA SER A 82 13.461 30.685 -14.703 1.00 51.14 H new ATOM 0 HB2 SER A 82 14.760 30.151 -17.000 1.00 30.54 H new ATOM 0 HB3 SER A 82 15.588 30.246 -15.458 1.00 30.54 H new ATOM 0 HG SER A 82 14.567 27.832 -16.638 1.00 21.44 H new ATOM 1237 N ASP A 83 12.116 28.696 -16.981 1.00 70.12 N ATOM 1238 CA ASP A 83 11.061 28.610 -17.985 1.00 22.45 C ATOM 1239 C ASP A 83 9.735 29.112 -17.423 1.00 34.51 C ATOM 1240 O ASP A 83 9.023 29.878 -18.073 1.00 42.43 O ATOM 1241 CB ASP A 83 10.910 27.168 -18.473 1.00 54.44 C ATOM 1242 CG ASP A 83 12.203 26.607 -19.032 1.00 13.34 C ATOM 1243 OD1 ASP A 83 13.181 27.375 -19.148 1.00 33.24 O ATOM 1244 OD2 ASP A 83 12.236 25.401 -19.353 1.00 64.14 O ATOM 0 H ASP A 83 12.635 27.829 -16.839 1.00 70.12 H new ATOM 0 HA ASP A 83 11.341 29.243 -18.827 1.00 22.45 H new ATOM 0 HB2 ASP A 83 10.573 26.542 -17.647 1.00 54.44 H new ATOM 0 HB3 ASP A 83 10.137 27.126 -19.241 1.00 54.44 H new ATOM 1249 N LEU A 84 9.407 28.673 -16.212 1.00 41.53 N ATOM 1250 CA LEU A 84 8.165 29.077 -15.563 1.00 12.33 C ATOM 1251 C LEU A 84 8.072 30.596 -15.462 1.00 52.52 C ATOM 1252 O LEU A 84 7.203 31.217 -16.075 1.00 23.21 O ATOM 1253 CB LEU A 84 8.070 28.456 -14.168 1.00 61.22 C ATOM 1254 CG LEU A 84 6.861 28.871 -13.329 1.00 2.10 C ATOM 1255 CD1 LEU A 84 5.572 28.650 -14.105 1.00 12.34 C ATOM 1256 CD2 LEU A 84 6.834 28.102 -12.016 1.00 1.51 C ATOM 0 H LEU A 84 9.984 28.038 -15.661 1.00 41.53 H new ATOM 0 HA LEU A 84 7.334 28.720 -16.171 1.00 12.33 H new ATOM 0 HB2 LEU A 84 8.057 27.371 -14.275 1.00 61.22 H new ATOM 0 HB3 LEU A 84 8.975 28.711 -13.616 1.00 61.22 H new ATOM 0 HG LEU A 84 6.947 29.934 -13.103 1.00 2.10 H new ATOM 0 HD11 LEU A 84 4.722 28.951 -13.492 1.00 12.34 H new ATOM 0 HD12 LEU A 84 5.590 29.246 -15.018 1.00 12.34 H new ATOM 0 HD13 LEU A 84 5.478 27.595 -14.362 1.00 12.34 H new ATOM 0 HD21 LEU A 84 5.967 28.410 -11.432 1.00 1.51 H new ATOM 0 HD22 LEU A 84 6.772 27.033 -12.221 1.00 1.51 H new ATOM 0 HD23 LEU A 84 7.744 28.311 -11.453 1.00 1.51 H new ATOM 1268 N ALA A 85 8.974 31.189 -14.687 1.00 51.41 N ATOM 1269 CA ALA A 85 8.996 32.636 -14.510 1.00 2.10 C ATOM 1270 C ALA A 85 8.993 33.354 -15.855 1.00 74.03 C ATOM 1271 O ALA A 85 8.270 34.332 -16.045 1.00 32.51 O ATOM 1272 CB ALA A 85 10.211 33.049 -13.692 1.00 41.04 C ATOM 0 H ALA A 85 9.699 30.690 -14.172 1.00 51.41 H new ATOM 0 HA ALA A 85 8.093 32.925 -13.972 1.00 2.10 H new ATOM 0 HB1 ALA A 85 10.215 34.132 -13.568 1.00 41.04 H new ATOM 0 HB2 ALA A 85 10.170 32.571 -12.713 1.00 41.04 H new ATOM 0 HB3 ALA A 85 11.120 32.740 -14.209 1.00 41.04 H new ATOM 1278 N GLU A 86 9.805 32.862 -16.785 1.00 44.44 N ATOM 1279 CA GLU A 86 9.896 33.459 -18.113 1.00 11.53 C ATOM 1280 C GLU A 86 8.555 33.380 -18.837 1.00 43.25 C ATOM 1281 O GLU A 86 8.194 34.279 -19.599 1.00 20.24 O ATOM 1282 CB GLU A 86 10.977 32.759 -18.939 1.00 12.03 C ATOM 1283 CG GLU A 86 11.694 33.681 -19.910 1.00 55.44 C ATOM 1284 CD GLU A 86 11.358 33.378 -21.358 1.00 24.12 C ATOM 1285 OE1 GLU A 86 11.318 32.184 -21.720 1.00 73.32 O ATOM 1286 OE2 GLU A 86 11.137 34.336 -22.128 1.00 75.41 O ATOM 0 H GLU A 86 10.409 32.052 -16.644 1.00 44.44 H new ATOM 0 HA GLU A 86 10.164 34.509 -17.994 1.00 11.53 H new ATOM 0 HB2 GLU A 86 11.709 32.317 -18.263 1.00 12.03 H new ATOM 0 HB3 GLU A 86 10.523 31.940 -19.497 1.00 12.03 H new ATOM 0 HG2 GLU A 86 11.428 34.714 -19.688 1.00 55.44 H new ATOM 0 HG3 GLU A 86 12.770 33.590 -19.764 1.00 55.44 H new ATOM 1293 N LEU A 87 7.822 32.299 -18.596 1.00 43.03 N ATOM 1294 CA LEU A 87 6.521 32.101 -19.226 1.00 23.33 C ATOM 1295 C LEU A 87 5.468 33.005 -18.595 1.00 54.51 C ATOM 1296 O LEU A 87 4.796 33.769 -19.289 1.00 12.41 O ATOM 1297 CB LEU A 87 6.092 30.637 -19.105 1.00 11.53 C ATOM 1298 CG LEU A 87 5.136 30.127 -20.184 1.00 21.05 C ATOM 1299 CD1 LEU A 87 3.813 30.875 -20.122 1.00 64.02 C ATOM 1300 CD2 LEU A 87 5.765 30.265 -21.562 1.00 64.22 C ATOM 0 H LEU A 87 8.106 31.546 -17.969 1.00 43.03 H new ATOM 0 HA LEU A 87 6.611 32.361 -20.281 1.00 23.33 H new ATOM 0 HB2 LEU A 87 6.987 30.015 -19.117 1.00 11.53 H new ATOM 0 HB3 LEU A 87 5.619 30.497 -18.133 1.00 11.53 H new ATOM 0 HG LEU A 87 4.941 29.070 -20.000 1.00 21.05 H new ATOM 0 HD11 LEU A 87 3.146 30.499 -20.897 1.00 64.02 H new ATOM 0 HD12 LEU A 87 3.355 30.724 -19.144 1.00 64.02 H new ATOM 0 HD13 LEU A 87 3.989 31.939 -20.280 1.00 64.02 H new ATOM 0 HD21 LEU A 87 5.071 29.897 -22.317 1.00 64.22 H new ATOM 0 HD22 LEU A 87 5.990 31.314 -21.756 1.00 64.22 H new ATOM 0 HD23 LEU A 87 6.686 29.683 -21.602 1.00 64.22 H new ATOM 1312 N ILE A 88 5.330 32.915 -17.277 1.00 4.35 N ATOM 1313 CA ILE A 88 4.361 33.728 -16.553 1.00 1.35 C ATOM 1314 C ILE A 88 4.641 35.215 -16.741 1.00 54.45 C ATOM 1315 O ILE A 88 3.719 36.017 -16.884 1.00 54.23 O ATOM 1316 CB ILE A 88 4.367 33.404 -15.047 1.00 73.40 C ATOM 1317 CG1 ILE A 88 4.214 31.897 -14.827 1.00 50.14 C ATOM 1318 CG2 ILE A 88 3.256 34.163 -14.337 1.00 50.23 C ATOM 1319 CD1 ILE A 88 2.955 31.322 -15.438 1.00 63.04 C ATOM 0 H ILE A 88 5.877 32.287 -16.688 1.00 4.35 H new ATOM 0 HA ILE A 88 3.380 33.490 -16.964 1.00 1.35 H new ATOM 0 HB ILE A 88 5.322 33.719 -14.627 1.00 73.40 H new ATOM 0 HG12 ILE A 88 5.079 31.387 -15.250 1.00 50.14 H new ATOM 0 HG13 ILE A 88 4.215 31.692 -13.756 1.00 50.14 H new ATOM 0 HG21 ILE A 88 3.274 33.923 -13.274 1.00 50.23 H new ATOM 0 HG22 ILE A 88 3.405 35.235 -14.470 1.00 50.23 H new ATOM 0 HG23 ILE A 88 2.292 33.876 -14.758 1.00 50.23 H new ATOM 0 HD11 ILE A 88 2.913 30.250 -15.243 1.00 63.04 H new ATOM 0 HD12 ILE A 88 2.083 31.806 -14.998 1.00 63.04 H new ATOM 0 HD13 ILE A 88 2.961 31.495 -16.514 1.00 63.04 H new ATOM 1331 N ASN A 89 5.920 35.576 -16.743 1.00 12.02 N ATOM 1332 CA ASN A 89 6.321 36.967 -16.916 1.00 5.32 C ATOM 1333 C ASN A 89 5.868 37.500 -18.272 1.00 31.04 C ATOM 1334 O ASN A 89 5.037 38.405 -18.349 1.00 42.33 O ATOM 1335 CB ASN A 89 7.840 37.102 -16.785 1.00 30.54 C ATOM 1336 CG ASN A 89 8.294 38.548 -16.781 1.00 3.44 C ATOM 1337 OD1 ASN A 89 7.940 39.324 -17.669 1.00 4.25 O ATOM 1338 ND2 ASN A 89 9.083 38.918 -15.778 1.00 71.10 N ATOM 0 H ASN A 89 6.696 34.925 -16.627 1.00 12.02 H new ATOM 0 HA ASN A 89 5.841 37.557 -16.135 1.00 5.32 H new ATOM 0 HB2 ASN A 89 8.167 36.619 -15.864 1.00 30.54 H new ATOM 0 HB3 ASN A 89 8.321 36.575 -17.609 1.00 30.54 H new ATOM 0 HD21 ASN A 89 9.420 39.879 -15.722 1.00 71.10 H new ATOM 0 HD22 ASN A 89 9.351 38.241 -15.064 1.00 71.10 H new ATOM 1345 N LYS A 90 6.419 36.931 -19.339 1.00 13.43 N ATOM 1346 CA LYS A 90 6.071 37.346 -20.693 1.00 14.24 C ATOM 1347 C LYS A 90 4.558 37.341 -20.891 1.00 63.14 C ATOM 1348 O LYS A 90 4.011 38.198 -21.584 1.00 43.14 O ATOM 1349 CB LYS A 90 6.734 36.423 -21.717 1.00 74.22 C ATOM 1350 CG LYS A 90 6.288 36.681 -23.146 1.00 64.13 C ATOM 1351 CD LYS A 90 7.420 36.448 -24.134 1.00 33.25 C ATOM 1352 CE LYS A 90 7.559 34.974 -24.484 1.00 1.24 C ATOM 1353 NZ LYS A 90 8.824 34.696 -25.219 1.00 10.03 N ATOM 0 H LYS A 90 7.109 36.181 -19.292 1.00 13.43 H new ATOM 0 HA LYS A 90 6.435 38.363 -20.841 1.00 14.24 H new ATOM 0 HB2 LYS A 90 7.816 36.543 -21.655 1.00 74.22 H new ATOM 0 HB3 LYS A 90 6.513 35.388 -21.457 1.00 74.22 H new ATOM 0 HG2 LYS A 90 5.450 36.028 -23.390 1.00 64.13 H new ATOM 0 HG3 LYS A 90 5.930 37.706 -23.237 1.00 64.13 H new ATOM 0 HD2 LYS A 90 7.236 37.023 -25.042 1.00 33.25 H new ATOM 0 HD3 LYS A 90 8.356 36.812 -23.710 1.00 33.25 H new ATOM 0 HE2 LYS A 90 7.531 34.380 -23.571 1.00 1.24 H new ATOM 0 HE3 LYS A 90 6.710 34.663 -25.092 1.00 1.24 H new ATOM 0 HZ1 LYS A 90 8.882 33.681 -25.439 1.00 10.03 H new ATOM 0 HZ2 LYS A 90 8.839 35.244 -26.103 1.00 10.03 H new ATOM 0 HZ3 LYS A 90 9.636 34.969 -24.629 1.00 10.03 H new ATOM 1367 N MET A 91 3.889 36.371 -20.278 1.00 33.42 N ATOM 1368 CA MET A 91 2.439 36.257 -20.386 1.00 31.50 C ATOM 1369 C MET A 91 1.751 37.477 -19.783 1.00 41.43 C ATOM 1370 O MET A 91 0.902 38.102 -20.420 1.00 32.34 O ATOM 1371 CB MET A 91 1.952 34.986 -19.687 1.00 24.41 C ATOM 1372 CG MET A 91 0.447 34.787 -19.766 1.00 24.22 C ATOM 1373 SD MET A 91 -0.418 35.460 -18.334 1.00 70.23 S ATOM 1374 CE MET A 91 -2.116 35.383 -18.898 1.00 73.33 C ATOM 0 H MET A 91 4.327 35.653 -19.701 1.00 33.42 H new ATOM 0 HA MET A 91 2.182 36.203 -21.444 1.00 31.50 H new ATOM 0 HB2 MET A 91 2.448 34.124 -20.132 1.00 24.41 H new ATOM 0 HB3 MET A 91 2.251 35.020 -18.639 1.00 24.41 H new ATOM 0 HG2 MET A 91 0.068 35.262 -20.671 1.00 24.22 H new ATOM 0 HG3 MET A 91 0.229 33.722 -19.850 1.00 24.22 H new ATOM 0 HE1 MET A 91 -2.487 36.393 -19.075 1.00 73.33 H new ATOM 0 HE2 MET A 91 -2.166 34.810 -19.824 1.00 73.33 H new ATOM 0 HE3 MET A 91 -2.730 34.899 -18.138 1.00 73.33 H new ATOM 1384 N LYS A 92 2.123 37.813 -18.553 1.00 33.14 N ATOM 1385 CA LYS A 92 1.543 38.960 -17.864 1.00 32.45 C ATOM 1386 C LYS A 92 1.623 40.213 -18.730 1.00 25.44 C ATOM 1387 O LYS A 92 0.759 41.087 -18.656 1.00 3.30 O ATOM 1388 CB LYS A 92 2.262 39.199 -16.534 1.00 34.32 C ATOM 1389 CG LYS A 92 1.324 39.541 -15.389 1.00 23.24 C ATOM 1390 CD LYS A 92 2.086 40.065 -14.182 1.00 74.35 C ATOM 1391 CE LYS A 92 2.287 41.570 -14.261 1.00 50.34 C ATOM 1392 NZ LYS A 92 3.456 41.930 -15.111 1.00 73.24 N ATOM 0 H LYS A 92 2.824 37.307 -18.012 1.00 33.14 H new ATOM 0 HA LYS A 92 0.493 38.742 -17.668 1.00 32.45 H new ATOM 0 HB2 LYS A 92 2.831 38.307 -16.273 1.00 34.32 H new ATOM 0 HB3 LYS A 92 2.980 40.010 -16.659 1.00 34.32 H new ATOM 0 HG2 LYS A 92 0.603 40.289 -15.719 1.00 23.24 H new ATOM 0 HG3 LYS A 92 0.756 38.655 -15.105 1.00 23.24 H new ATOM 0 HD2 LYS A 92 1.542 39.817 -13.271 1.00 74.35 H new ATOM 0 HD3 LYS A 92 3.055 39.570 -14.119 1.00 74.35 H new ATOM 0 HE2 LYS A 92 1.388 42.036 -14.664 1.00 50.34 H new ATOM 0 HE3 LYS A 92 2.431 41.970 -13.257 1.00 50.34 H new ATOM 0 HZ1 LYS A 92 3.954 42.740 -14.691 1.00 73.24 H new ATOM 0 HZ2 LYS A 92 4.104 41.119 -15.172 1.00 73.24 H new ATOM 0 HZ3 LYS A 92 3.127 42.183 -16.065 1.00 73.24 H new ATOM 1406 N LEU A 93 2.665 40.293 -19.550 1.00 71.24 N ATOM 1407 CA LEU A 93 2.857 41.439 -20.432 1.00 65.34 C ATOM 1408 C LEU A 93 1.768 41.495 -21.498 1.00 72.43 C ATOM 1409 O LEU A 93 1.139 42.532 -21.703 1.00 42.45 O ATOM 1410 CB LEU A 93 4.234 41.370 -21.097 1.00 14.32 C ATOM 1411 CG LEU A 93 5.254 42.411 -20.635 1.00 25.32 C ATOM 1412 CD1 LEU A 93 4.708 43.817 -20.827 1.00 32.22 C ATOM 1413 CD2 LEU A 93 5.632 42.177 -19.179 1.00 43.53 C ATOM 0 H LEU A 93 3.389 39.579 -19.623 1.00 71.24 H new ATOM 0 HA LEU A 93 2.796 42.345 -19.829 1.00 65.34 H new ATOM 0 HB2 LEU A 93 4.651 40.378 -20.921 1.00 14.32 H new ATOM 0 HB3 LEU A 93 4.101 41.473 -22.174 1.00 14.32 H new ATOM 0 HG LEU A 93 6.152 42.307 -21.244 1.00 25.32 H new ATOM 0 HD11 LEU A 93 5.448 44.544 -20.492 1.00 32.22 H new ATOM 0 HD12 LEU A 93 4.489 43.981 -21.882 1.00 32.22 H new ATOM 0 HD13 LEU A 93 3.794 43.935 -20.244 1.00 32.22 H new ATOM 0 HD21 LEU A 93 6.359 42.927 -18.867 1.00 43.53 H new ATOM 0 HD22 LEU A 93 4.741 42.253 -18.555 1.00 43.53 H new ATOM 0 HD23 LEU A 93 6.067 41.183 -19.071 1.00 43.53 H new ATOM 1425 N ALA A 94 1.548 40.370 -22.172 1.00 44.54 N ATOM 1426 CA ALA A 94 0.532 40.290 -23.214 1.00 12.31 C ATOM 1427 C ALA A 94 -0.837 40.696 -22.678 1.00 3.33 C ATOM 1428 O ALA A 94 -1.575 41.434 -23.330 1.00 65.13 O ATOM 1429 CB ALA A 94 0.478 38.884 -23.792 1.00 63.11 C ATOM 0 H ALA A 94 2.060 39.502 -22.015 1.00 44.54 H new ATOM 0 HA ALA A 94 0.805 40.987 -24.007 1.00 12.31 H new ATOM 0 HB1 ALA A 94 -0.285 38.839 -24.569 1.00 63.11 H new ATOM 0 HB2 ALA A 94 1.447 38.629 -24.220 1.00 63.11 H new ATOM 0 HB3 ALA A 94 0.233 38.175 -23.001 1.00 63.11 H new ATOM 1435 N GLN A 95 -1.169 40.209 -21.486 1.00 43.24 N ATOM 1436 CA GLN A 95 -2.450 40.521 -20.864 1.00 41.02 C ATOM 1437 C GLN A 95 -2.634 42.028 -20.723 1.00 2.44 C ATOM 1438 O GLN A 95 -3.759 42.525 -20.694 1.00 53.21 O ATOM 1439 CB GLN A 95 -2.551 39.852 -19.492 1.00 61.13 C ATOM 1440 CG GLN A 95 -3.952 39.369 -19.153 1.00 24.52 C ATOM 1441 CD GLN A 95 -4.841 40.478 -18.628 1.00 3.45 C ATOM 1442 OE1 GLN A 95 -4.358 41.470 -18.080 1.00 24.35 O ATOM 1443 NE2 GLN A 95 -6.148 40.318 -18.792 1.00 75.25 N ATOM 0 H GLN A 95 -0.569 39.597 -20.933 1.00 43.24 H new ATOM 0 HA GLN A 95 -3.241 40.136 -21.507 1.00 41.02 H new ATOM 0 HB2 GLN A 95 -1.866 39.005 -19.458 1.00 61.13 H new ATOM 0 HB3 GLN A 95 -2.224 40.557 -18.728 1.00 61.13 H new ATOM 0 HG2 GLN A 95 -4.407 38.934 -20.043 1.00 24.52 H new ATOM 0 HG3 GLN A 95 -3.888 38.576 -18.408 1.00 24.52 H new ATOM 0 HE21 GLN A 95 -6.506 39.481 -19.252 1.00 75.25 H new ATOM 0 HE22 GLN A 95 -6.795 41.032 -18.459 1.00 75.25 H new ATOM 1452 N GLN A 96 -1.521 42.750 -20.634 1.00 62.40 N ATOM 1453 CA GLN A 96 -1.560 44.200 -20.494 1.00 54.42 C ATOM 1454 C GLN A 96 -1.466 44.881 -21.856 1.00 13.33 C ATOM 1455 O GLN A 96 -1.938 46.005 -22.033 1.00 24.21 O ATOM 1456 CB GLN A 96 -0.421 44.678 -19.592 1.00 13.20 C ATOM 1457 CG GLN A 96 -0.811 44.788 -18.127 1.00 21.44 C ATOM 1458 CD GLN A 96 -1.023 46.222 -17.685 1.00 2.14 C ATOM 1459 OE1 GLN A 96 -0.084 46.900 -17.266 1.00 40.12 O ATOM 1460 NE2 GLN A 96 -2.261 46.693 -17.775 1.00 51.04 N ATOM 0 H GLN A 96 -0.581 42.354 -20.656 1.00 62.40 H new ATOM 0 HA GLN A 96 -2.512 44.470 -20.038 1.00 54.42 H new ATOM 0 HB2 GLN A 96 0.419 43.989 -19.685 1.00 13.20 H new ATOM 0 HB3 GLN A 96 -0.076 45.651 -19.942 1.00 13.20 H new ATOM 0 HG2 GLN A 96 -1.725 44.220 -17.955 1.00 21.44 H new ATOM 0 HG3 GLN A 96 -0.033 44.334 -17.513 1.00 21.44 H new ATOM 0 HE21 GLN A 96 -3.009 46.096 -18.128 1.00 51.04 H new ATOM 0 HE22 GLN A 96 -2.464 47.651 -17.491 1.00 51.04 H new ATOM 1469 N TYR A 97 -0.855 44.194 -22.814 1.00 4.21 N ATOM 1470 CA TYR A 97 -0.696 44.734 -24.159 1.00 71.11 C ATOM 1471 C TYR A 97 -1.806 44.237 -25.080 1.00 34.02 C ATOM 1472 O TYR A 97 -1.634 44.163 -26.296 1.00 64.35 O ATOM 1473 CB TYR A 97 0.668 44.344 -24.730 1.00 62.23 C ATOM 1474 CG TYR A 97 1.783 45.283 -24.330 1.00 24.02 C ATOM 1475 CD1 TYR A 97 2.230 45.341 -23.015 1.00 42.43 C ATOM 1476 CD2 TYR A 97 2.390 46.112 -25.265 1.00 55.51 C ATOM 1477 CE1 TYR A 97 3.248 46.198 -22.644 1.00 43.44 C ATOM 1478 CE2 TYR A 97 3.409 46.971 -24.904 1.00 2.45 C ATOM 1479 CZ TYR A 97 3.835 47.011 -23.592 1.00 71.12 C ATOM 1480 OH TYR A 97 4.849 47.866 -23.228 1.00 5.23 O ATOM 0 H TYR A 97 -0.462 43.262 -22.684 1.00 4.21 H new ATOM 0 HA TYR A 97 -0.759 45.820 -24.097 1.00 71.11 H new ATOM 0 HB2 TYR A 97 0.917 43.336 -24.398 1.00 62.23 H new ATOM 0 HB3 TYR A 97 0.602 44.314 -25.818 1.00 62.23 H new ATOM 0 HD1 TYR A 97 1.774 44.705 -22.271 1.00 42.43 H new ATOM 0 HD2 TYR A 97 2.059 46.084 -26.293 1.00 55.51 H new ATOM 0 HE1 TYR A 97 3.583 46.232 -21.618 1.00 43.44 H new ATOM 0 HE2 TYR A 97 3.870 47.608 -25.644 1.00 2.45 H new ATOM 0 HH TYR A 97 5.153 48.366 -24.014 1.00 5.23 H new ATOM 1490 N VAL A 98 -2.948 43.898 -24.490 1.00 13.04 N ATOM 1491 CA VAL A 98 -4.089 43.410 -25.255 1.00 70.32 C ATOM 1492 C VAL A 98 -5.170 44.478 -25.372 1.00 73.01 C ATOM 1493 O VAL A 98 -5.881 44.549 -26.374 1.00 72.31 O ATOM 1494 CB VAL A 98 -4.697 42.148 -24.614 1.00 24.12 C ATOM 1495 CG1 VAL A 98 -5.203 42.452 -23.212 1.00 54.34 C ATOM 1496 CG2 VAL A 98 -5.814 41.593 -25.485 1.00 5.21 C ATOM 0 H VAL A 98 -3.107 43.953 -23.484 1.00 13.04 H new ATOM 0 HA VAL A 98 -3.719 43.161 -26.250 1.00 70.32 H new ATOM 0 HB VAL A 98 -3.918 41.390 -24.536 1.00 24.12 H new ATOM 0 HG11 VAL A 98 -5.629 41.549 -22.775 1.00 54.34 H new ATOM 0 HG12 VAL A 98 -4.375 42.799 -22.594 1.00 54.34 H new ATOM 0 HG13 VAL A 98 -5.968 43.227 -23.261 1.00 54.34 H new ATOM 0 HG21 VAL A 98 -6.232 40.702 -25.017 1.00 5.21 H new ATOM 0 HG22 VAL A 98 -6.596 42.344 -25.597 1.00 5.21 H new ATOM 0 HG23 VAL A 98 -5.416 41.335 -26.466 1.00 5.21 H new ATOM 1506 N MET A 99 -5.288 45.308 -24.341 1.00 13.01 N ATOM 1507 CA MET A 99 -6.283 46.375 -24.329 1.00 25.20 C ATOM 1508 C MET A 99 -5.908 47.478 -25.314 1.00 1.15 C ATOM 1509 O MET A 99 -6.766 48.234 -25.771 1.00 4.41 O ATOM 1510 CB MET A 99 -6.420 46.957 -22.921 1.00 33.01 C ATOM 1511 CG MET A 99 -5.225 47.790 -22.488 1.00 63.10 C ATOM 1512 SD MET A 99 -5.500 49.560 -22.696 1.00 24.25 S ATOM 1513 CE MET A 99 -3.886 50.206 -22.264 1.00 63.12 C ATOM 0 H MET A 99 -4.708 45.263 -23.503 1.00 13.01 H new ATOM 0 HA MET A 99 -7.240 45.950 -24.633 1.00 25.20 H new ATOM 0 HB2 MET A 99 -7.317 47.574 -22.878 1.00 33.01 H new ATOM 0 HB3 MET A 99 -6.560 46.141 -22.212 1.00 33.01 H new ATOM 0 HG2 MET A 99 -5.002 47.581 -21.442 1.00 63.10 H new ATOM 0 HG3 MET A 99 -4.350 47.492 -23.066 1.00 63.10 H new ATOM 0 HE1 MET A 99 -3.719 51.148 -22.786 1.00 63.12 H new ATOM 0 HE2 MET A 99 -3.837 50.374 -21.188 1.00 63.12 H new ATOM 0 HE3 MET A 99 -3.118 49.489 -22.554 1.00 63.12 H new ATOM 1523 N THR A 100 -4.621 47.565 -25.636 1.00 52.45 N ATOM 1524 CA THR A 100 -4.133 48.577 -26.565 1.00 72.23 C ATOM 1525 C THR A 100 -4.437 48.190 -28.008 1.00 44.33 C ATOM 1526 O THR A 100 -5.328 48.758 -28.639 1.00 15.13 O ATOM 1527 CB THR A 100 -2.616 48.795 -26.412 1.00 71.13 C ATOM 1528 OG1 THR A 100 -2.047 47.744 -25.624 1.00 71.50 O ATOM 1529 CG2 THR A 100 -2.325 50.138 -25.761 1.00 15.43 C ATOM 0 H THR A 100 -3.898 46.947 -25.267 1.00 52.45 H new ATOM 0 HA THR A 100 -4.652 49.505 -26.324 1.00 72.23 H new ATOM 0 HB THR A 100 -2.168 48.787 -27.406 1.00 71.13 H new ATOM 0 HG1 THR A 100 -1.082 47.889 -25.533 1.00 71.50 H new ATOM 0 HG21 THR A 100 -1.247 50.269 -25.664 1.00 15.43 H new ATOM 0 HG22 THR A 100 -2.734 50.938 -26.379 1.00 15.43 H new ATOM 0 HG23 THR A 100 -2.785 50.171 -24.773 1.00 15.43 H new ATOM 1537 N SER A 101 -3.689 47.220 -28.526 1.00 15.41 N ATOM 1538 CA SER A 101 -3.877 46.760 -29.897 1.00 21.13 C ATOM 1539 C SER A 101 -2.902 45.635 -30.230 1.00 21.20 C ATOM 1540 O SER A 101 -3.233 44.711 -30.975 1.00 24.15 O ATOM 1541 CB SER A 101 -3.689 47.920 -30.877 1.00 34.42 C ATOM 1542 OG SER A 101 -3.285 47.450 -32.151 1.00 74.13 O ATOM 0 H SER A 101 -2.948 46.738 -28.017 1.00 15.41 H new ATOM 0 HA SER A 101 -4.893 46.377 -29.990 1.00 21.13 H new ATOM 0 HB2 SER A 101 -4.622 48.476 -30.970 1.00 34.42 H new ATOM 0 HB3 SER A 101 -2.942 48.612 -30.488 1.00 34.42 H new ATOM 0 HG SER A 101 -3.173 48.210 -32.760 1.00 74.13 H new ATOM 1548 N LEU A 102 -1.699 45.719 -29.674 1.00 4.44 N ATOM 1549 CA LEU A 102 -0.673 44.709 -29.911 1.00 33.14 C ATOM 1550 C LEU A 102 -0.956 43.446 -29.103 1.00 55.13 C ATOM 1551 O LEU A 102 -0.206 43.101 -28.191 1.00 33.21 O ATOM 1552 CB LEU A 102 0.707 45.260 -29.549 1.00 41.23 C ATOM 1553 CG LEU A 102 1.076 46.607 -30.171 1.00 53.54 C ATOM 1554 CD1 LEU A 102 2.482 47.017 -29.763 1.00 1.12 C ATOM 1555 CD2 LEU A 102 0.955 46.546 -31.687 1.00 63.21 C ATOM 0 H LEU A 102 -1.409 46.477 -29.055 1.00 4.44 H new ATOM 0 HA LEU A 102 -0.689 44.453 -30.970 1.00 33.14 H new ATOM 0 HB2 LEU A 102 0.765 45.355 -28.465 1.00 41.23 H new ATOM 0 HB3 LEU A 102 1.458 44.528 -29.846 1.00 41.23 H new ATOM 0 HG LEU A 102 0.379 47.359 -29.801 1.00 53.54 H new ATOM 0 HD11 LEU A 102 2.726 47.978 -30.215 1.00 1.12 H new ATOM 0 HD12 LEU A 102 2.535 47.103 -28.678 1.00 1.12 H new ATOM 0 HD13 LEU A 102 3.194 46.264 -30.103 1.00 1.12 H new ATOM 0 HD21 LEU A 102 1.221 47.514 -32.112 1.00 63.21 H new ATOM 0 HD22 LEU A 102 1.628 45.781 -32.075 1.00 63.21 H new ATOM 0 HD23 LEU A 102 -0.071 46.300 -31.960 1.00 63.21 H new ATOM 1567 N GLN A 103 -2.042 42.761 -29.447 1.00 52.04 N ATOM 1568 CA GLN A 103 -2.423 41.535 -28.755 1.00 42.51 C ATOM 1569 C GLN A 103 -1.869 40.310 -29.474 1.00 72.31 C ATOM 1570 O GLN A 103 -1.115 39.528 -28.896 1.00 32.13 O ATOM 1571 CB GLN A 103 -3.946 41.436 -28.651 1.00 24.34 C ATOM 1572 CG GLN A 103 -4.433 40.090 -28.137 1.00 53.44 C ATOM 1573 CD GLN A 103 -4.589 39.066 -29.243 1.00 72.55 C ATOM 1574 OE1 GLN A 103 -3.805 38.122 -29.346 1.00 31.51 O ATOM 1575 NE2 GLN A 103 -5.605 39.246 -30.079 1.00 72.13 N ATOM 0 H GLN A 103 -2.673 43.034 -30.200 1.00 52.04 H new ATOM 0 HA GLN A 103 -1.999 41.567 -27.751 1.00 42.51 H new ATOM 0 HB2 GLN A 103 -4.309 42.222 -27.988 1.00 24.34 H new ATOM 0 HB3 GLN A 103 -4.382 41.620 -29.633 1.00 24.34 H new ATOM 0 HG2 GLN A 103 -3.730 39.713 -27.394 1.00 53.44 H new ATOM 0 HG3 GLN A 103 -5.390 40.223 -27.632 1.00 53.44 H new ATOM 0 HE21 GLN A 103 -6.231 40.042 -29.957 1.00 72.13 H new ATOM 0 HE22 GLN A 103 -5.760 38.588 -30.843 1.00 72.13 H new ATOM 1584 N GLN A 104 -2.249 40.149 -30.738 1.00 12.14 N ATOM 1585 CA GLN A 104 -1.791 39.017 -31.535 1.00 10.34 C ATOM 1586 C GLN A 104 -0.270 38.913 -31.508 1.00 43.21 C ATOM 1587 O GLN A 104 0.287 37.816 -31.536 1.00 12.11 O ATOM 1588 CB GLN A 104 -2.280 39.152 -32.978 1.00 21.52 C ATOM 1589 CG GLN A 104 -3.790 39.052 -33.120 1.00 70.34 C ATOM 1590 CD GLN A 104 -4.406 40.309 -33.701 1.00 1.41 C ATOM 1591 OE1 GLN A 104 -3.966 41.422 -33.408 1.00 75.21 O ATOM 1592 NE2 GLN A 104 -5.429 40.140 -34.530 1.00 35.44 N ATOM 0 H GLN A 104 -2.872 40.788 -31.232 1.00 12.14 H new ATOM 0 HA GLN A 104 -2.207 38.107 -31.102 1.00 10.34 H new ATOM 0 HB2 GLN A 104 -1.949 40.111 -33.377 1.00 21.52 H new ATOM 0 HB3 GLN A 104 -1.814 38.376 -33.585 1.00 21.52 H new ATOM 0 HG2 GLN A 104 -4.036 38.203 -33.758 1.00 70.34 H new ATOM 0 HG3 GLN A 104 -4.231 38.854 -32.143 1.00 70.34 H new ATOM 0 HE21 GLN A 104 -5.761 39.200 -34.745 1.00 35.44 H new ATOM 0 HE22 GLN A 104 -5.883 40.950 -34.952 1.00 35.44 H new ATOM 1601 N GLU A 105 0.396 40.062 -31.455 1.00 4.53 N ATOM 1602 CA GLU A 105 1.854 40.099 -31.426 1.00 12.21 C ATOM 1603 C GLU A 105 2.399 39.201 -30.319 1.00 11.41 C ATOM 1604 O GLU A 105 3.134 38.249 -30.582 1.00 54.14 O ATOM 1605 CB GLU A 105 2.346 41.534 -31.223 1.00 20.31 C ATOM 1606 CG GLU A 105 3.856 41.648 -31.102 1.00 23.44 C ATOM 1607 CD GLU A 105 4.402 42.897 -31.766 1.00 24.42 C ATOM 1608 OE1 GLU A 105 3.971 43.203 -32.897 1.00 63.23 O ATOM 1609 OE2 GLU A 105 5.260 43.567 -31.155 1.00 44.30 O ATOM 0 H GLU A 105 -0.050 40.979 -31.431 1.00 4.53 H new ATOM 0 HA GLU A 105 2.221 39.729 -32.384 1.00 12.21 H new ATOM 0 HB2 GLU A 105 2.010 42.146 -32.060 1.00 20.31 H new ATOM 0 HB3 GLU A 105 1.886 41.943 -30.324 1.00 20.31 H new ATOM 0 HG2 GLU A 105 4.133 41.651 -30.048 1.00 23.44 H new ATOM 0 HG3 GLU A 105 4.320 40.770 -31.551 1.00 23.44 H new ATOM 1616 N TYR A 106 2.034 39.512 -29.080 1.00 43.31 N ATOM 1617 CA TYR A 106 2.489 38.736 -27.932 1.00 55.32 C ATOM 1618 C TYR A 106 2.055 37.279 -28.054 1.00 61.30 C ATOM 1619 O TYR A 106 2.713 36.377 -27.535 1.00 23.10 O ATOM 1620 CB TYR A 106 1.941 39.336 -26.636 1.00 2.11 C ATOM 1621 CG TYR A 106 2.630 40.617 -26.223 1.00 42.23 C ATOM 1622 CD1 TYR A 106 2.369 41.813 -26.881 1.00 32.13 C ATOM 1623 CD2 TYR A 106 3.542 40.632 -25.175 1.00 22.11 C ATOM 1624 CE1 TYR A 106 2.997 42.985 -26.507 1.00 54.45 C ATOM 1625 CE2 TYR A 106 4.174 41.800 -24.794 1.00 13.11 C ATOM 1626 CZ TYR A 106 3.898 42.974 -25.463 1.00 70.05 C ATOM 1627 OH TYR A 106 4.524 44.140 -25.088 1.00 4.23 O ATOM 0 H TYR A 106 1.425 40.296 -28.845 1.00 43.31 H new ATOM 0 HA TYR A 106 3.578 38.771 -27.909 1.00 55.32 H new ATOM 0 HB2 TYR A 106 0.875 39.529 -26.757 1.00 2.11 H new ATOM 0 HB3 TYR A 106 2.043 38.604 -25.835 1.00 2.11 H new ATOM 0 HD1 TYR A 106 1.663 41.826 -27.698 1.00 32.13 H new ATOM 0 HD2 TYR A 106 3.761 39.715 -24.649 1.00 22.11 H new ATOM 0 HE1 TYR A 106 2.783 43.906 -27.030 1.00 54.45 H new ATOM 0 HE2 TYR A 106 4.880 41.794 -23.977 1.00 13.11 H new ATOM 0 HH TYR A 106 3.862 44.764 -24.723 1.00 4.23 H new ATOM 1637 N LYS A 107 0.942 37.055 -28.745 1.00 3.02 N ATOM 1638 CA LYS A 107 0.419 35.708 -28.939 1.00 21.15 C ATOM 1639 C LYS A 107 1.391 34.858 -29.751 1.00 41.30 C ATOM 1640 O LYS A 107 1.608 33.684 -29.450 1.00 12.44 O ATOM 1641 CB LYS A 107 -0.939 35.762 -29.642 1.00 43.24 C ATOM 1642 CG LYS A 107 -2.061 35.113 -28.851 1.00 24.23 C ATOM 1643 CD LYS A 107 -2.527 36.003 -27.712 1.00 12.55 C ATOM 1644 CE LYS A 107 -4.019 35.850 -27.460 1.00 13.35 C ATOM 1645 NZ LYS A 107 -4.532 36.885 -26.519 1.00 52.15 N ATOM 0 H LYS A 107 0.385 37.790 -29.180 1.00 3.02 H new ATOM 0 HA LYS A 107 0.295 35.249 -27.958 1.00 21.15 H new ATOM 0 HB2 LYS A 107 -1.197 36.803 -29.835 1.00 43.24 H new ATOM 0 HB3 LYS A 107 -0.857 35.269 -30.611 1.00 43.24 H new ATOM 0 HG2 LYS A 107 -2.899 34.901 -29.514 1.00 24.23 H new ATOM 0 HG3 LYS A 107 -1.721 34.158 -28.452 1.00 24.23 H new ATOM 0 HD2 LYS A 107 -1.976 35.753 -26.805 1.00 12.55 H new ATOM 0 HD3 LYS A 107 -2.301 37.043 -27.946 1.00 12.55 H new ATOM 0 HE2 LYS A 107 -4.556 35.921 -28.406 1.00 13.35 H new ATOM 0 HE3 LYS A 107 -4.219 34.859 -27.053 1.00 13.35 H new ATOM 0 HZ1 LYS A 107 -5.128 36.433 -25.797 1.00 52.15 H new ATOM 0 HZ2 LYS A 107 -3.731 37.363 -26.058 1.00 52.15 H new ATOM 0 HZ3 LYS A 107 -5.095 37.583 -27.045 1.00 52.15 H new ATOM 1659 N LYS A 108 1.976 35.459 -30.782 1.00 14.10 N ATOM 1660 CA LYS A 108 2.927 34.759 -31.637 1.00 2.31 C ATOM 1661 C LYS A 108 4.154 34.324 -30.843 1.00 23.25 C ATOM 1662 O LYS A 108 4.495 33.142 -30.810 1.00 24.22 O ATOM 1663 CB LYS A 108 3.353 35.656 -32.802 1.00 75.30 C ATOM 1664 CG LYS A 108 3.083 35.047 -34.167 1.00 44.24 C ATOM 1665 CD LYS A 108 2.154 35.920 -34.994 1.00 2.52 C ATOM 1666 CE LYS A 108 2.932 36.918 -35.838 1.00 54.34 C ATOM 1667 NZ LYS A 108 2.997 38.259 -35.193 1.00 62.21 N ATOM 0 H LYS A 108 1.808 36.430 -31.046 1.00 14.10 H new ATOM 0 HA LYS A 108 2.436 33.869 -32.031 1.00 2.31 H new ATOM 0 HB2 LYS A 108 2.828 36.608 -32.728 1.00 75.30 H new ATOM 0 HB3 LYS A 108 4.418 35.872 -32.713 1.00 75.30 H new ATOM 0 HG2 LYS A 108 4.025 34.911 -34.698 1.00 44.24 H new ATOM 0 HG3 LYS A 108 2.641 34.058 -34.044 1.00 44.24 H new ATOM 0 HD2 LYS A 108 1.544 35.291 -35.642 1.00 2.52 H new ATOM 0 HD3 LYS A 108 1.471 36.455 -34.333 1.00 2.52 H new ATOM 0 HE2 LYS A 108 3.943 36.545 -36.002 1.00 54.34 H new ATOM 0 HE3 LYS A 108 2.463 37.009 -36.818 1.00 54.34 H new ATOM 0 HZ1 LYS A 108 3.535 38.910 -35.799 1.00 62.21 H new ATOM 0 HZ2 LYS A 108 2.034 38.627 -35.059 1.00 62.21 H new ATOM 0 HZ3 LYS A 108 3.468 38.177 -34.269 1.00 62.21 H new ATOM 1681 N GLN A 109 4.812 35.286 -30.203 1.00 71.23 N ATOM 1682 CA GLN A 109 6.001 35.000 -29.409 1.00 35.15 C ATOM 1683 C GLN A 109 5.695 33.974 -28.322 1.00 1.10 C ATOM 1684 O GLN A 109 6.526 33.122 -28.009 1.00 34.31 O ATOM 1685 CB GLN A 109 6.539 36.285 -28.777 1.00 35.13 C ATOM 1686 CG GLN A 109 5.509 37.031 -27.944 1.00 35.11 C ATOM 1687 CD GLN A 109 6.009 38.381 -27.469 1.00 30.32 C ATOM 1688 OE1 GLN A 109 6.611 39.136 -28.232 1.00 51.43 O ATOM 1689 NE2 GLN A 109 5.762 38.691 -26.202 1.00 1.44 N ATOM 0 H GLN A 109 4.542 36.269 -30.219 1.00 71.23 H new ATOM 0 HA GLN A 109 6.760 34.585 -30.072 1.00 35.15 H new ATOM 0 HB2 GLN A 109 7.394 36.040 -28.148 1.00 35.13 H new ATOM 0 HB3 GLN A 109 6.902 36.944 -29.566 1.00 35.13 H new ATOM 0 HG2 GLN A 109 4.603 37.170 -28.533 1.00 35.11 H new ATOM 0 HG3 GLN A 109 5.237 36.424 -27.080 1.00 35.11 H new ATOM 0 HE21 GLN A 109 5.259 38.034 -25.605 1.00 1.44 H new ATOM 0 HE22 GLN A 109 6.075 39.586 -25.826 1.00 1.44 H new ATOM 1698 N MET A 110 4.499 34.063 -27.750 1.00 54.34 N ATOM 1699 CA MET A 110 4.084 33.142 -26.699 1.00 72.20 C ATOM 1700 C MET A 110 4.172 31.696 -27.177 1.00 42.03 C ATOM 1701 O MET A 110 4.770 30.848 -26.514 1.00 63.42 O ATOM 1702 CB MET A 110 2.656 33.456 -26.250 1.00 15.30 C ATOM 1703 CG MET A 110 2.088 32.439 -25.273 1.00 52.42 C ATOM 1704 SD MET A 110 0.822 31.393 -26.018 1.00 25.44 S ATOM 1705 CE MET A 110 1.612 29.788 -25.924 1.00 25.24 C ATOM 0 H MET A 110 3.800 34.764 -27.997 1.00 54.34 H new ATOM 0 HA MET A 110 4.759 33.269 -25.853 1.00 72.20 H new ATOM 0 HB2 MET A 110 2.638 34.442 -25.786 1.00 15.30 H new ATOM 0 HB3 MET A 110 2.011 33.505 -27.127 1.00 15.30 H new ATOM 0 HG2 MET A 110 2.896 31.812 -24.896 1.00 52.42 H new ATOM 0 HG3 MET A 110 1.664 32.962 -24.416 1.00 52.42 H new ATOM 0 HE1 MET A 110 0.924 29.022 -26.282 1.00 25.24 H new ATOM 0 HE2 MET A 110 2.509 29.787 -26.543 1.00 25.24 H new ATOM 0 HE3 MET A 110 1.884 29.577 -24.890 1.00 25.24 H new ATOM 1715 N LEU A 111 3.573 31.422 -28.331 1.00 23.31 N ATOM 1716 CA LEU A 111 3.584 30.078 -28.898 1.00 23.41 C ATOM 1717 C LEU A 111 5.011 29.557 -29.038 1.00 43.42 C ATOM 1718 O LEU A 111 5.292 28.395 -28.745 1.00 60.31 O ATOM 1719 CB LEU A 111 2.891 30.072 -30.261 1.00 40.45 C ATOM 1720 CG LEU A 111 2.160 28.783 -30.638 1.00 43.00 C ATOM 1721 CD1 LEU A 111 1.724 28.823 -32.094 1.00 74.32 C ATOM 1722 CD2 LEU A 111 3.045 27.573 -30.378 1.00 24.14 C ATOM 0 H LEU A 111 3.074 32.112 -28.892 1.00 23.31 H new ATOM 0 HA LEU A 111 3.042 29.420 -28.219 1.00 23.41 H new ATOM 0 HB2 LEU A 111 2.174 30.893 -30.285 1.00 40.45 H new ATOM 0 HB3 LEU A 111 3.638 30.279 -31.027 1.00 40.45 H new ATOM 0 HG LEU A 111 1.269 28.698 -30.016 1.00 43.00 H new ATOM 0 HD11 LEU A 111 1.206 27.897 -32.344 1.00 74.32 H new ATOM 0 HD12 LEU A 111 1.053 29.668 -32.250 1.00 74.32 H new ATOM 0 HD13 LEU A 111 2.600 28.932 -32.733 1.00 74.32 H new ATOM 0 HD21 LEU A 111 2.509 26.664 -30.652 1.00 24.14 H new ATOM 0 HD22 LEU A 111 3.954 27.652 -30.975 1.00 24.14 H new ATOM 0 HD23 LEU A 111 3.307 27.535 -29.321 1.00 24.14 H new ATOM 1734 N THR A 112 5.911 30.427 -29.487 1.00 24.03 N ATOM 1735 CA THR A 112 7.310 30.056 -29.665 1.00 14.31 C ATOM 1736 C THR A 112 7.870 29.402 -28.407 1.00 15.20 C ATOM 1737 O THR A 112 8.422 28.304 -28.461 1.00 22.04 O ATOM 1738 CB THR A 112 8.174 31.280 -30.022 1.00 1.24 C ATOM 1739 OG1 THR A 112 7.652 31.926 -31.188 1.00 73.22 O ATOM 1740 CG2 THR A 112 9.618 30.870 -30.267 1.00 23.32 C ATOM 0 H THR A 112 5.696 31.393 -29.734 1.00 24.03 H new ATOM 0 HA THR A 112 7.346 29.342 -30.488 1.00 14.31 H new ATOM 0 HB THR A 112 8.147 31.973 -29.181 1.00 1.24 H new ATOM 0 HG1 THR A 112 8.206 32.704 -31.407 1.00 73.22 H new ATOM 0 HG21 THR A 112 10.209 31.751 -30.517 1.00 23.32 H new ATOM 0 HG22 THR A 112 10.022 30.406 -29.367 1.00 23.32 H new ATOM 0 HG23 THR A 112 9.659 30.159 -31.092 1.00 23.32 H new ATOM 1748 N ALA A 113 7.722 30.084 -27.276 1.00 23.45 N ATOM 1749 CA ALA A 113 8.211 29.567 -26.003 1.00 61.23 C ATOM 1750 C ALA A 113 7.538 28.244 -25.653 1.00 12.32 C ATOM 1751 O ALA A 113 8.208 27.242 -25.407 1.00 72.20 O ATOM 1752 CB ALA A 113 7.984 30.586 -24.897 1.00 51.51 C ATOM 0 H ALA A 113 7.268 30.995 -27.215 1.00 23.45 H new ATOM 0 HA ALA A 113 9.281 29.386 -26.100 1.00 61.23 H new ATOM 0 HB1 ALA A 113 8.354 30.186 -23.953 1.00 51.51 H new ATOM 0 HB2 ALA A 113 8.517 31.506 -25.135 1.00 51.51 H new ATOM 0 HB3 ALA A 113 6.918 30.796 -24.809 1.00 51.51 H new ATOM 1758 N ALA A 114 6.209 28.250 -25.631 1.00 71.31 N ATOM 1759 CA ALA A 114 5.445 27.050 -25.312 1.00 23.12 C ATOM 1760 C ALA A 114 5.832 25.893 -26.227 1.00 52.34 C ATOM 1761 O ALA A 114 5.722 24.726 -25.850 1.00 4.20 O ATOM 1762 CB ALA A 114 3.953 27.331 -25.414 1.00 65.05 C ATOM 0 H ALA A 114 5.639 29.072 -25.830 1.00 71.31 H new ATOM 0 HA ALA A 114 5.679 26.762 -24.287 1.00 23.12 H new ATOM 0 HB1 ALA A 114 3.395 26.426 -25.173 1.00 65.05 H new ATOM 0 HB2 ALA A 114 3.683 28.121 -24.713 1.00 65.05 H new ATOM 0 HB3 ALA A 114 3.711 27.647 -26.429 1.00 65.05 H new ATOM 1768 N HIS A 115 6.284 26.224 -27.433 1.00 13.41 N ATOM 1769 CA HIS A 115 6.687 25.212 -28.403 1.00 14.22 C ATOM 1770 C HIS A 115 7.881 24.414 -27.890 1.00 64.33 C ATOM 1771 O HIS A 115 7.823 23.189 -27.786 1.00 71.12 O ATOM 1772 CB HIS A 115 7.032 25.867 -29.741 1.00 32.41 C ATOM 1773 CG HIS A 115 7.022 24.912 -30.895 1.00 21.23 C ATOM 1774 ND1 HIS A 115 6.825 25.311 -32.200 1.00 20.41 N ATOM 1775 CD2 HIS A 115 7.188 23.569 -30.934 1.00 44.12 C ATOM 1776 CE1 HIS A 115 6.869 24.254 -32.992 1.00 52.31 C ATOM 1777 NE2 HIS A 115 7.089 23.185 -32.249 1.00 34.22 N ATOM 0 H HIS A 115 6.380 27.185 -27.761 1.00 13.41 H new ATOM 0 HA HIS A 115 5.851 24.528 -28.547 1.00 14.22 H new ATOM 0 HB2 HIS A 115 6.321 26.669 -29.938 1.00 32.41 H new ATOM 0 HB3 HIS A 115 8.018 26.326 -29.668 1.00 32.41 H new ATOM 0 HD2 HIS A 115 7.365 22.920 -30.089 1.00 44.12 H new ATOM 0 HE1 HIS A 115 6.746 24.263 -34.065 1.00 52.31 H new ATOM 0 HE2 HIS A 115 7.172 22.229 -32.595 1.00 34.22 H new ATOM 1785 N ALA A 116 8.964 25.116 -27.573 1.00 11.05 N ATOM 1786 CA ALA A 116 10.172 24.473 -27.070 1.00 75.30 C ATOM 1787 C ALA A 116 9.931 23.846 -25.701 1.00 14.12 C ATOM 1788 O ALA A 116 10.530 22.826 -25.359 1.00 62.35 O ATOM 1789 CB ALA A 116 11.314 25.476 -27.000 1.00 73.41 C ATOM 0 H ALA A 116 9.030 26.131 -27.656 1.00 11.05 H new ATOM 0 HA ALA A 116 10.445 23.676 -27.762 1.00 75.30 H new ATOM 0 HB1 ALA A 116 12.209 24.982 -26.623 1.00 73.41 H new ATOM 0 HB2 ALA A 116 11.511 25.873 -27.996 1.00 73.41 H new ATOM 0 HB3 ALA A 116 11.041 26.292 -26.331 1.00 73.41 H new ATOM 1795 N LEU A 117 9.051 24.463 -24.920 1.00 33.12 N ATOM 1796 CA LEU A 117 8.731 23.966 -23.586 1.00 72.42 C ATOM 1797 C LEU A 117 8.021 22.617 -23.663 1.00 44.54 C ATOM 1798 O LEU A 117 8.419 21.657 -23.005 1.00 1.02 O ATOM 1799 CB LEU A 117 7.855 24.974 -22.841 1.00 75.10 C ATOM 1800 CG LEU A 117 7.964 24.960 -21.316 1.00 0.21 C ATOM 1801 CD1 LEU A 117 7.493 23.626 -20.759 1.00 30.21 C ATOM 1802 CD2 LEU A 117 9.394 25.247 -20.881 1.00 71.13 C ATOM 0 H LEU A 117 8.546 25.308 -25.187 1.00 33.12 H new ATOM 0 HA LEU A 117 9.666 23.834 -23.041 1.00 72.42 H new ATOM 0 HB2 LEU A 117 8.106 25.974 -23.194 1.00 75.10 H new ATOM 0 HB3 LEU A 117 6.815 24.792 -23.113 1.00 75.10 H new ATOM 0 HG LEU A 117 7.320 25.744 -20.918 1.00 0.21 H new ATOM 0 HD11 LEU A 117 7.578 23.635 -19.672 1.00 30.21 H new ATOM 0 HD12 LEU A 117 6.453 23.461 -21.040 1.00 30.21 H new ATOM 0 HD13 LEU A 117 8.110 22.824 -21.165 1.00 30.21 H new ATOM 0 HD21 LEU A 117 9.453 25.233 -19.793 1.00 71.13 H new ATOM 0 HD22 LEU A 117 10.058 24.486 -21.290 1.00 71.13 H new ATOM 0 HD23 LEU A 117 9.696 26.228 -21.248 1.00 71.13 H new ATOM 1814 N ALA A 118 6.970 22.553 -24.474 1.00 1.41 N ATOM 1815 CA ALA A 118 6.208 21.322 -24.641 1.00 0.22 C ATOM 1816 C ALA A 118 7.124 20.151 -24.981 1.00 0.43 C ATOM 1817 O ALA A 118 7.100 19.117 -24.313 1.00 40.23 O ATOM 1818 CB ALA A 118 5.151 21.498 -25.720 1.00 55.24 C ATOM 0 H ALA A 118 6.627 23.339 -25.026 1.00 1.41 H new ATOM 0 HA ALA A 118 5.713 21.099 -23.696 1.00 0.22 H new ATOM 0 HB1 ALA A 118 4.590 20.571 -25.834 1.00 55.24 H new ATOM 0 HB2 ALA A 118 4.471 22.301 -25.436 1.00 55.24 H new ATOM 0 HB3 ALA A 118 5.634 21.748 -26.665 1.00 55.24 H new ATOM 1824 N VAL A 119 7.931 20.320 -26.024 1.00 12.55 N ATOM 1825 CA VAL A 119 8.855 19.278 -26.452 1.00 23.40 C ATOM 1826 C VAL A 119 9.758 18.838 -25.305 1.00 11.24 C ATOM 1827 O VAL A 119 10.106 17.663 -25.190 1.00 62.13 O ATOM 1828 CB VAL A 119 9.731 19.752 -27.627 1.00 30.11 C ATOM 1829 CG1 VAL A 119 10.628 18.624 -28.114 1.00 53.00 C ATOM 1830 CG2 VAL A 119 8.863 20.280 -28.759 1.00 13.44 C ATOM 0 H VAL A 119 7.963 21.169 -26.588 1.00 12.55 H new ATOM 0 HA VAL A 119 8.249 18.433 -26.778 1.00 23.40 H new ATOM 0 HB VAL A 119 10.368 20.565 -27.278 1.00 30.11 H new ATOM 0 HG11 VAL A 119 11.239 18.978 -28.944 1.00 53.00 H new ATOM 0 HG12 VAL A 119 11.275 18.297 -27.300 1.00 53.00 H new ATOM 0 HG13 VAL A 119 10.013 17.788 -28.447 1.00 53.00 H new ATOM 0 HG21 VAL A 119 9.498 20.611 -29.581 1.00 13.44 H new ATOM 0 HG22 VAL A 119 8.200 19.489 -29.109 1.00 13.44 H new ATOM 0 HG23 VAL A 119 8.268 21.120 -28.400 1.00 13.44 H new ATOM 1840 N ASP A 120 10.133 19.790 -24.457 1.00 20.52 N ATOM 1841 CA ASP A 120 10.995 19.501 -23.316 1.00 75.11 C ATOM 1842 C ASP A 120 10.318 18.526 -22.357 1.00 11.50 C ATOM 1843 O ASP A 120 10.909 17.525 -21.954 1.00 4.51 O ATOM 1844 CB ASP A 120 11.353 20.793 -22.581 1.00 4.21 C ATOM 1845 CG ASP A 120 12.801 20.821 -22.132 1.00 21.11 C ATOM 1846 OD1 ASP A 120 13.668 21.204 -22.946 1.00 31.42 O ATOM 1847 OD2 ASP A 120 13.067 20.461 -20.966 1.00 63.23 O ATOM 0 H ASP A 120 9.854 20.768 -24.538 1.00 20.52 H new ATOM 0 HA ASP A 120 11.909 19.039 -23.690 1.00 75.11 H new ATOM 0 HB2 ASP A 120 11.162 21.644 -23.234 1.00 4.21 H new ATOM 0 HB3 ASP A 120 10.704 20.905 -21.713 1.00 4.21 H new ATOM 1852 N ALA A 121 9.075 18.827 -21.995 1.00 1.41 N ATOM 1853 CA ALA A 121 8.318 17.978 -21.084 1.00 71.11 C ATOM 1854 C ALA A 121 8.330 16.526 -21.550 1.00 21.23 C ATOM 1855 O ALA A 121 8.463 15.605 -20.743 1.00 15.20 O ATOM 1856 CB ALA A 121 6.888 18.482 -20.958 1.00 72.24 C ATOM 0 H ALA A 121 8.571 19.653 -22.319 1.00 1.41 H new ATOM 0 HA ALA A 121 8.795 18.022 -20.105 1.00 71.11 H new ATOM 0 HB1 ALA A 121 6.334 17.838 -20.275 1.00 72.24 H new ATOM 0 HB2 ALA A 121 6.894 19.501 -20.572 1.00 72.24 H new ATOM 0 HB3 ALA A 121 6.410 18.468 -21.937 1.00 72.24 H new ATOM 1862 N LYS A 122 8.190 16.327 -22.856 1.00 5.10 N ATOM 1863 CA LYS A 122 8.186 14.987 -23.430 1.00 71.13 C ATOM 1864 C LYS A 122 9.594 14.401 -23.456 1.00 41.34 C ATOM 1865 O LYS A 122 9.817 13.276 -23.012 1.00 14.13 O ATOM 1866 CB LYS A 122 7.609 15.019 -24.847 1.00 41.05 C ATOM 1867 CG LYS A 122 7.505 13.648 -25.493 1.00 40.10 C ATOM 1868 CD LYS A 122 8.777 13.286 -26.242 1.00 13.40 C ATOM 1869 CE LYS A 122 8.548 12.129 -27.202 1.00 40.11 C ATOM 1870 NZ LYS A 122 7.941 12.583 -28.484 1.00 10.42 N ATOM 0 H LYS A 122 8.078 17.078 -23.537 1.00 5.10 H new ATOM 0 HA LYS A 122 7.560 14.352 -22.803 1.00 71.13 H new ATOM 0 HB2 LYS A 122 6.619 15.473 -24.817 1.00 41.05 H new ATOM 0 HB3 LYS A 122 8.234 15.659 -25.470 1.00 41.05 H new ATOM 0 HG2 LYS A 122 7.307 12.898 -24.727 1.00 40.10 H new ATOM 0 HG3 LYS A 122 6.660 13.632 -26.181 1.00 40.10 H new ATOM 0 HD2 LYS A 122 9.134 14.154 -26.796 1.00 13.40 H new ATOM 0 HD3 LYS A 122 9.557 13.020 -25.529 1.00 13.40 H new ATOM 0 HE2 LYS A 122 9.497 11.633 -27.405 1.00 40.11 H new ATOM 0 HE3 LYS A 122 7.897 11.392 -26.733 1.00 40.11 H new ATOM 0 HZ1 LYS A 122 7.723 11.757 -29.077 1.00 10.42 H new ATOM 0 HZ2 LYS A 122 7.065 13.108 -28.287 1.00 10.42 H new ATOM 0 HZ3 LYS A 122 8.610 13.201 -28.985 1.00 10.42 H new ATOM 1884 N ASN A 123 10.541 15.173 -23.979 1.00 45.20 N ATOM 1885 CA ASN A 123 11.929 14.731 -24.062 1.00 33.42 C ATOM 1886 C ASN A 123 12.448 14.309 -22.691 1.00 32.24 C ATOM 1887 O ASN A 123 13.309 13.434 -22.582 1.00 54.44 O ATOM 1888 CB ASN A 123 12.808 15.845 -24.632 1.00 3.22 C ATOM 1889 CG ASN A 123 14.168 15.339 -25.075 1.00 55.40 C ATOM 1890 OD1 ASN A 123 14.266 14.467 -25.938 1.00 24.45 O ATOM 1891 ND2 ASN A 123 15.224 15.887 -24.485 1.00 14.11 N ATOM 0 H ASN A 123 10.373 16.108 -24.352 1.00 45.20 H new ATOM 0 HA ASN A 123 11.970 13.869 -24.728 1.00 33.42 H new ATOM 0 HB2 ASN A 123 12.301 16.306 -25.480 1.00 3.22 H new ATOM 0 HB3 ASN A 123 12.940 16.621 -23.879 1.00 3.22 H new ATOM 0 HD21 ASN A 123 16.165 15.588 -24.743 1.00 14.11 H new ATOM 0 HD22 ASN A 123 15.095 16.607 -23.774 1.00 14.11 H new ATOM 1898 N LEU A 124 11.919 14.935 -21.646 1.00 14.35 N ATOM 1899 CA LEU A 124 12.327 14.625 -20.280 1.00 24.01 C ATOM 1900 C LEU A 124 12.245 13.125 -20.014 1.00 53.32 C ATOM 1901 O LEU A 124 13.236 12.493 -19.646 1.00 51.41 O ATOM 1902 CB LEU A 124 11.451 15.381 -19.280 1.00 33.21 C ATOM 1903 CG LEU A 124 12.121 16.541 -18.542 1.00 72.43 C ATOM 1904 CD1 LEU A 124 12.629 17.579 -19.530 1.00 51.13 C ATOM 1905 CD2 LEU A 124 11.154 17.172 -17.552 1.00 13.43 C ATOM 0 H LEU A 124 11.206 15.661 -21.718 1.00 14.35 H new ATOM 0 HA LEU A 124 13.363 14.941 -20.156 1.00 24.01 H new ATOM 0 HB2 LEU A 124 10.581 15.768 -19.810 1.00 33.21 H new ATOM 0 HB3 LEU A 124 11.083 14.670 -18.540 1.00 33.21 H new ATOM 0 HG LEU A 124 12.974 16.150 -17.987 1.00 72.43 H new ATOM 0 HD11 LEU A 124 13.103 18.397 -18.987 1.00 51.13 H new ATOM 0 HD12 LEU A 124 13.356 17.119 -20.200 1.00 51.13 H new ATOM 0 HD13 LEU A 124 11.793 17.966 -20.113 1.00 51.13 H new ATOM 0 HD21 LEU A 124 11.647 17.996 -17.036 1.00 13.43 H new ATOM 0 HD22 LEU A 124 10.281 17.549 -18.086 1.00 13.43 H new ATOM 0 HD23 LEU A 124 10.839 16.424 -16.824 1.00 13.43 H new ATOM 1917 N LEU A 125 11.057 12.561 -20.205 1.00 25.40 N ATOM 1918 CA LEU A 125 10.845 11.134 -19.988 1.00 62.32 C ATOM 1919 C LEU A 125 11.513 10.311 -21.086 1.00 13.04 C ATOM 1920 O LEU A 125 12.033 9.225 -20.831 1.00 61.33 O ATOM 1921 CB LEU A 125 9.348 10.822 -19.941 1.00 3.24 C ATOM 1922 CG LEU A 125 8.911 9.789 -18.902 1.00 35.11 C ATOM 1923 CD1 LEU A 125 7.926 10.404 -17.919 1.00 63.11 C ATOM 1924 CD2 LEU A 125 8.298 8.574 -19.583 1.00 51.14 C ATOM 0 H LEU A 125 10.227 13.070 -20.509 1.00 25.40 H new ATOM 0 HA LEU A 125 11.296 10.866 -19.033 1.00 62.32 H new ATOM 0 HB2 LEU A 125 8.809 11.750 -19.750 1.00 3.24 H new ATOM 0 HB3 LEU A 125 9.039 10.471 -20.926 1.00 3.24 H new ATOM 0 HG LEU A 125 9.792 9.465 -18.348 1.00 35.11 H new ATOM 0 HD11 LEU A 125 7.626 9.654 -17.187 1.00 63.11 H new ATOM 0 HD12 LEU A 125 8.398 11.242 -17.407 1.00 63.11 H new ATOM 0 HD13 LEU A 125 7.047 10.757 -18.458 1.00 63.11 H new ATOM 0 HD21 LEU A 125 7.993 7.849 -18.828 1.00 51.14 H new ATOM 0 HD22 LEU A 125 7.428 8.882 -20.163 1.00 51.14 H new ATOM 0 HD23 LEU A 125 9.034 8.119 -20.246 1.00 51.14 H new ATOM 1936 N ASP A 126 11.496 10.837 -22.305 1.00 54.03 N ATOM 1937 CA ASP A 126 12.102 10.153 -23.442 1.00 2.15 C ATOM 1938 C ASP A 126 13.580 9.874 -23.183 1.00 15.54 C ATOM 1939 O ASP A 126 14.077 8.786 -23.471 1.00 34.32 O ATOM 1940 CB ASP A 126 11.943 10.990 -24.712 1.00 22.21 C ATOM 1941 CG ASP A 126 11.028 10.333 -25.727 1.00 11.43 C ATOM 1942 OD1 ASP A 126 9.907 9.938 -25.345 1.00 73.12 O ATOM 1943 OD2 ASP A 126 11.433 10.214 -26.902 1.00 41.42 O ATOM 0 H ASP A 126 11.069 11.735 -22.532 1.00 54.03 H new ATOM 0 HA ASP A 126 11.589 9.201 -23.578 1.00 2.15 H new ATOM 0 HB2 ASP A 126 11.546 11.971 -24.450 1.00 22.21 H new ATOM 0 HB3 ASP A 126 12.923 11.153 -25.162 1.00 22.21 H new ATOM 1948 N VAL A 127 14.277 10.866 -22.638 1.00 10.42 N ATOM 1949 CA VAL A 127 15.698 10.728 -22.340 1.00 15.41 C ATOM 1950 C VAL A 127 15.933 9.680 -21.259 1.00 20.15 C ATOM 1951 O VAL A 127 16.617 8.682 -21.486 1.00 61.33 O ATOM 1952 CB VAL A 127 16.308 12.067 -21.883 1.00 72.14 C ATOM 1953 CG1 VAL A 127 17.770 11.886 -21.506 1.00 2.02 C ATOM 1954 CG2 VAL A 127 16.156 13.120 -22.971 1.00 33.32 C ATOM 0 H VAL A 127 13.881 11.774 -22.394 1.00 10.42 H new ATOM 0 HA VAL A 127 16.186 10.411 -23.262 1.00 15.41 H new ATOM 0 HB VAL A 127 15.769 12.410 -21.000 1.00 72.14 H new ATOM 0 HG11 VAL A 127 18.184 12.842 -21.186 1.00 2.02 H new ATOM 0 HG12 VAL A 127 17.849 11.165 -20.692 1.00 2.02 H new ATOM 0 HG13 VAL A 127 18.326 11.521 -22.370 1.00 2.02 H new ATOM 0 HG21 VAL A 127 16.592 14.059 -22.632 1.00 33.32 H new ATOM 0 HG22 VAL A 127 16.668 12.787 -23.874 1.00 33.32 H new ATOM 0 HG23 VAL A 127 15.098 13.269 -23.188 1.00 33.32 H new ATOM 1964 N ILE A 128 15.362 9.913 -20.082 1.00 13.12 N ATOM 1965 CA ILE A 128 15.508 8.988 -18.965 1.00 62.43 C ATOM 1966 C ILE A 128 15.040 7.587 -19.347 1.00 0.41 C ATOM 1967 O ILE A 128 15.508 6.593 -18.793 1.00 24.40 O ATOM 1968 CB ILE A 128 14.717 9.463 -17.732 1.00 41.04 C ATOM 1969 CG1 ILE A 128 15.021 8.569 -16.528 1.00 41.24 C ATOM 1970 CG2 ILE A 128 13.225 9.470 -18.031 1.00 22.33 C ATOM 1971 CD1 ILE A 128 14.746 9.234 -15.198 1.00 34.43 C ATOM 0 H ILE A 128 14.794 10.735 -19.877 1.00 13.12 H new ATOM 0 HA ILE A 128 16.569 8.959 -18.716 1.00 62.43 H new ATOM 0 HB ILE A 128 15.024 10.481 -17.491 1.00 41.04 H new ATOM 0 HG12 ILE A 128 14.424 7.660 -16.601 1.00 41.24 H new ATOM 0 HG13 ILE A 128 16.068 8.267 -16.565 1.00 41.24 H new ATOM 0 HG21 ILE A 128 12.679 9.808 -17.150 1.00 22.33 H new ATOM 0 HG22 ILE A 128 13.024 10.144 -18.863 1.00 22.33 H new ATOM 0 HG23 ILE A 128 12.902 8.463 -18.294 1.00 22.33 H new ATOM 0 HD11 ILE A 128 14.984 8.543 -14.390 1.00 34.43 H new ATOM 0 HD12 ILE A 128 15.362 10.128 -15.104 1.00 34.43 H new ATOM 0 HD13 ILE A 128 13.693 9.511 -15.141 1.00 34.43 H new ATOM 1983 N ASP A 129 14.115 7.518 -20.297 1.00 73.35 N ATOM 1984 CA ASP A 129 13.585 6.239 -20.756 1.00 73.12 C ATOM 1985 C ASP A 129 14.702 5.348 -21.290 1.00 73.24 C ATOM 1986 O ASP A 129 14.668 4.129 -21.125 1.00 20.21 O ATOM 1987 CB ASP A 129 12.529 6.460 -21.841 1.00 32.45 C ATOM 1988 CG ASP A 129 11.953 5.158 -22.361 1.00 73.43 C ATOM 1989 OD1 ASP A 129 11.185 4.510 -21.619 1.00 52.44 O ATOM 1990 OD2 ASP A 129 12.270 4.785 -23.510 1.00 45.44 O ATOM 0 H ASP A 129 13.716 8.332 -20.765 1.00 73.35 H new ATOM 0 HA ASP A 129 13.122 5.739 -19.905 1.00 73.12 H new ATOM 0 HB2 ASP A 129 11.724 7.076 -21.440 1.00 32.45 H new ATOM 0 HB3 ASP A 129 12.973 7.014 -22.668 1.00 32.45 H new ATOM 1995 N GLN A 130 15.689 5.965 -21.932 1.00 15.00 N ATOM 1996 CA GLN A 130 16.814 5.227 -22.492 1.00 24.21 C ATOM 1997 C GLN A 130 17.621 4.547 -21.391 1.00 23.13 C ATOM 1998 O GLN A 130 18.245 3.510 -21.615 1.00 33.12 O ATOM 1999 CB GLN A 130 17.716 6.164 -23.297 1.00 4.12 C ATOM 2000 CG GLN A 130 17.698 5.890 -24.792 1.00 5.20 C ATOM 2001 CD GLN A 130 18.584 4.723 -25.182 1.00 41.32 C ATOM 2002 OE1 GLN A 130 18.122 3.751 -25.780 1.00 41.12 O ATOM 2003 NE2 GLN A 130 19.865 4.814 -24.845 1.00 64.42 N ATOM 0 H GLN A 130 15.732 6.974 -22.077 1.00 15.00 H new ATOM 0 HA GLN A 130 16.418 4.458 -23.155 1.00 24.21 H new ATOM 0 HB2 GLN A 130 17.405 7.194 -23.121 1.00 4.12 H new ATOM 0 HB3 GLN A 130 18.739 6.073 -22.932 1.00 4.12 H new ATOM 0 HG2 GLN A 130 16.675 5.686 -25.108 1.00 5.20 H new ATOM 0 HG3 GLN A 130 18.024 6.783 -25.325 1.00 5.20 H new ATOM 0 HE21 GLN A 130 20.205 5.638 -24.350 1.00 64.42 H new ATOM 0 HE22 GLN A 130 20.509 4.060 -25.081 1.00 64.42 H new ATOM 2012 N ALA A 131 17.605 5.139 -20.201 1.00 31.52 N ATOM 2013 CA ALA A 131 18.334 4.589 -19.064 1.00 74.03 C ATOM 2014 C ALA A 131 17.657 3.328 -18.536 1.00 43.41 C ATOM 2015 O ALA A 131 18.323 2.346 -18.210 1.00 22.24 O ATOM 2016 CB ALA A 131 18.452 5.629 -17.960 1.00 53.11 C ATOM 0 H ALA A 131 17.095 5.999 -19.999 1.00 31.52 H new ATOM 0 HA ALA A 131 19.335 4.318 -19.401 1.00 74.03 H new ATOM 0 HB1 ALA A 131 18.998 5.205 -17.118 1.00 53.11 H new ATOM 0 HB2 ALA A 131 18.986 6.501 -18.337 1.00 53.11 H new ATOM 0 HB3 ALA A 131 17.456 5.927 -17.633 1.00 53.11 H new ATOM 2022 N ARG A 132 16.331 3.364 -18.454 1.00 63.12 N ATOM 2023 CA ARG A 132 15.565 2.225 -17.963 1.00 64.55 C ATOM 2024 C ARG A 132 15.867 0.973 -18.783 1.00 52.32 C ATOM 2025 O ARG A 132 16.165 -0.087 -18.231 1.00 41.32 O ATOM 2026 CB ARG A 132 14.067 2.531 -18.012 1.00 64.34 C ATOM 2027 CG ARG A 132 13.291 1.961 -16.837 1.00 14.24 C ATOM 2028 CD ARG A 132 11.864 2.487 -16.804 1.00 2.30 C ATOM 2029 NE ARG A 132 10.887 1.435 -17.069 1.00 54.34 N ATOM 2030 CZ ARG A 132 9.620 1.673 -17.390 1.00 14.32 C ATOM 2031 NH1 ARG A 132 9.179 2.920 -17.484 1.00 43.34 N ATOM 2032 NH2 ARG A 132 8.790 0.663 -17.617 1.00 23.43 N ATOM 0 H ARG A 132 15.765 4.169 -18.721 1.00 63.12 H new ATOM 0 HA ARG A 132 15.857 2.041 -16.929 1.00 64.55 H new ATOM 0 HB2 ARG A 132 13.926 3.612 -18.040 1.00 64.34 H new ATOM 0 HB3 ARG A 132 13.653 2.132 -18.938 1.00 64.34 H new ATOM 0 HG2 ARG A 132 13.278 0.873 -16.902 1.00 14.24 H new ATOM 0 HG3 ARG A 132 13.797 2.219 -15.906 1.00 14.24 H new ATOM 0 HD2 ARG A 132 11.664 2.931 -15.829 1.00 2.30 H new ATOM 0 HD3 ARG A 132 11.753 3.280 -17.544 1.00 2.30 H new ATOM 0 HE ARG A 132 11.194 0.464 -17.004 1.00 54.34 H new ATOM 0 HH11 ARG A 132 9.813 3.700 -17.310 1.00 43.34 H new ATOM 0 HH12 ARG A 132 8.206 3.100 -17.731 1.00 43.34 H new ATOM 0 HH21 ARG A 132 9.124 -0.298 -17.545 1.00 23.43 H new ATOM 0 HH22 ARG A 132 7.818 0.848 -17.863 1.00 23.43 H new ATOM 2046 N LEU A 133 15.786 1.103 -20.103 1.00 3.42 N ATOM 2047 CA LEU A 133 16.050 -0.017 -20.999 1.00 51.35 C ATOM 2048 C LEU A 133 17.514 -0.437 -20.930 1.00 25.02 C ATOM 2049 O LEU A 133 17.843 -1.613 -21.090 1.00 52.24 O ATOM 2050 CB LEU A 133 15.683 0.358 -22.436 1.00 73.45 C ATOM 2051 CG LEU A 133 14.374 -0.228 -22.969 1.00 65.02 C ATOM 2052 CD1 LEU A 133 14.476 -1.741 -23.087 1.00 51.25 C ATOM 2053 CD2 LEU A 133 13.210 0.162 -22.070 1.00 24.42 C ATOM 0 H LEU A 133 15.540 1.973 -20.576 1.00 3.42 H new ATOM 0 HA LEU A 133 15.435 -0.858 -20.680 1.00 51.35 H new ATOM 0 HB2 LEU A 133 15.626 1.444 -22.504 1.00 73.45 H new ATOM 0 HB3 LEU A 133 16.494 0.040 -23.092 1.00 73.45 H new ATOM 0 HG LEU A 133 14.192 0.182 -23.963 1.00 65.02 H new ATOM 0 HD11 LEU A 133 13.536 -2.140 -23.468 1.00 51.25 H new ATOM 0 HD12 LEU A 133 15.284 -1.999 -23.772 1.00 51.25 H new ATOM 0 HD13 LEU A 133 14.682 -2.169 -22.106 1.00 51.25 H new ATOM 0 HD21 LEU A 133 12.287 -0.263 -22.464 1.00 24.42 H new ATOM 0 HD22 LEU A 133 13.384 -0.219 -21.064 1.00 24.42 H new ATOM 0 HD23 LEU A 133 13.124 1.248 -22.037 1.00 24.42 H new ATOM 2065 N LYS A 134 18.392 0.531 -20.687 1.00 54.13 N ATOM 2066 CA LYS A 134 19.822 0.263 -20.592 1.00 74.43 C ATOM 2067 C LYS A 134 20.108 -0.788 -19.524 1.00 61.12 C ATOM 2068 O LYS A 134 20.982 -1.637 -19.695 1.00 23.24 O ATOM 2069 CB LYS A 134 20.583 1.551 -20.273 1.00 22.13 C ATOM 2070 CG LYS A 134 21.382 2.092 -21.446 1.00 10.23 C ATOM 2071 CD LYS A 134 21.793 3.538 -21.221 1.00 74.21 C ATOM 2072 CE LYS A 134 23.292 3.663 -20.998 1.00 50.11 C ATOM 2073 NZ LYS A 134 23.673 3.343 -19.595 1.00 33.24 N ATOM 0 H LYS A 134 18.137 1.509 -20.552 1.00 54.13 H new ATOM 0 HA LYS A 134 20.160 -0.121 -21.555 1.00 74.43 H new ATOM 0 HB2 LYS A 134 19.873 2.311 -19.946 1.00 22.13 H new ATOM 0 HB3 LYS A 134 21.259 1.366 -19.438 1.00 22.13 H new ATOM 0 HG2 LYS A 134 22.271 1.479 -21.596 1.00 10.23 H new ATOM 0 HG3 LYS A 134 20.788 2.019 -22.357 1.00 10.23 H new ATOM 0 HD2 LYS A 134 21.501 4.139 -22.082 1.00 74.21 H new ATOM 0 HD3 LYS A 134 21.261 3.939 -20.358 1.00 74.21 H new ATOM 0 HE2 LYS A 134 23.817 2.993 -21.679 1.00 50.11 H new ATOM 0 HE3 LYS A 134 23.612 4.677 -21.239 1.00 50.11 H new ATOM 0 HZ1 LYS A 134 24.703 3.440 -19.484 1.00 33.24 H new ATOM 0 HZ2 LYS A 134 23.192 3.998 -18.947 1.00 33.24 H new ATOM 0 HZ3 LYS A 134 23.391 2.367 -19.373 1.00 33.24 H new ATOM 2087 N MET A 135 19.365 -0.725 -18.424 1.00 71.02 N ATOM 2088 CA MET A 135 19.538 -1.673 -17.330 1.00 62.40 C ATOM 2089 C MET A 135 18.898 -3.016 -17.668 1.00 32.03 C ATOM 2090 O MET A 135 19.515 -4.068 -17.500 1.00 21.14 O ATOM 2091 CB MET A 135 18.931 -1.115 -16.042 1.00 34.02 C ATOM 2092 CG MET A 135 19.588 -1.648 -14.779 1.00 72.10 C ATOM 2093 SD MET A 135 18.405 -2.399 -13.644 1.00 52.21 S ATOM 2094 CE MET A 135 17.748 -0.945 -12.829 1.00 62.22 C ATOM 0 H MET A 135 18.638 -0.028 -18.267 1.00 71.02 H new ATOM 0 HA MET A 135 20.607 -1.827 -17.182 1.00 62.40 H new ATOM 0 HB2 MET A 135 19.012 -0.028 -16.053 1.00 34.02 H new ATOM 0 HB3 MET A 135 17.868 -1.355 -16.018 1.00 34.02 H new ATOM 0 HG2 MET A 135 20.343 -2.385 -15.051 1.00 72.10 H new ATOM 0 HG3 MET A 135 20.105 -0.834 -14.272 1.00 72.10 H new ATOM 0 HE1 MET A 135 17.081 -1.250 -12.023 1.00 62.22 H new ATOM 0 HE2 MET A 135 18.568 -0.356 -12.418 1.00 62.22 H new ATOM 0 HE3 MET A 135 17.195 -0.343 -13.550 1.00 62.22 H new ATOM 2104 N ILE A 136 17.658 -2.972 -18.144 1.00 21.12 N ATOM 2105 CA ILE A 136 16.936 -4.185 -18.505 1.00 73.43 C ATOM 2106 C ILE A 136 17.752 -5.046 -19.463 1.00 61.42 C ATOM 2107 O ILE A 136 18.053 -6.204 -19.171 1.00 2.41 O ATOM 2108 CB ILE A 136 15.578 -3.860 -19.156 1.00 2.33 C ATOM 2109 CG1 ILE A 136 14.722 -3.018 -18.207 1.00 23.22 C ATOM 2110 CG2 ILE A 136 14.852 -5.141 -19.537 1.00 23.44 C ATOM 2111 CD1 ILE A 136 13.564 -2.326 -18.891 1.00 3.11 C ATOM 0 H ILE A 136 17.133 -2.110 -18.288 1.00 21.12 H new ATOM 0 HA ILE A 136 16.764 -4.736 -17.580 1.00 73.43 H new ATOM 0 HB ILE A 136 15.756 -3.283 -20.064 1.00 2.33 H new ATOM 0 HG12 ILE A 136 14.335 -3.659 -17.415 1.00 23.22 H new ATOM 0 HG13 ILE A 136 15.353 -2.268 -17.731 1.00 23.22 H new ATOM 0 HG21 ILE A 136 13.895 -4.894 -19.996 1.00 23.44 H new ATOM 0 HG22 ILE A 136 15.458 -5.706 -20.245 1.00 23.44 H new ATOM 0 HG23 ILE A 136 14.682 -5.742 -18.644 1.00 23.44 H new ATOM 0 HD11 ILE A 136 13.001 -1.748 -18.158 1.00 3.11 H new ATOM 0 HD12 ILE A 136 13.944 -1.659 -19.665 1.00 3.11 H new ATOM 0 HD13 ILE A 136 12.911 -3.072 -19.344 1.00 3.11 H new ATOM 2123 N SER A 137 18.109 -4.473 -20.608 1.00 51.10 N ATOM 2124 CA SER A 137 18.889 -5.188 -21.611 1.00 24.43 C ATOM 2125 C SER A 137 20.370 -5.197 -21.242 1.00 51.24 C ATOM 2126 O SER A 137 21.202 -4.646 -21.963 1.00 20.42 O ATOM 2127 CB SER A 137 18.698 -4.550 -22.988 1.00 3.54 C ATOM 2128 OG SER A 137 19.313 -5.327 -24.000 1.00 70.14 O ATOM 0 H SER A 137 17.870 -3.515 -20.864 1.00 51.10 H new ATOM 0 HA SER A 137 18.534 -6.218 -21.645 1.00 24.43 H new ATOM 0 HB2 SER A 137 17.634 -4.448 -23.200 1.00 3.54 H new ATOM 0 HB3 SER A 137 19.121 -3.546 -22.989 1.00 3.54 H new ATOM 0 HG SER A 137 19.175 -4.899 -24.871 1.00 70.14 H new ATOM 2272 N GLU A 162 1.822 9.897 -31.259 1.00 31.30 N ATOM 2273 CA GLU A 162 0.661 10.753 -31.045 1.00 73.54 C ATOM 2274 C GLU A 162 1.090 12.171 -30.680 1.00 31.40 C ATOM 2275 O GLU A 162 0.522 13.149 -31.168 1.00 63.44 O ATOM 2276 CB GLU A 162 -0.229 10.177 -29.942 1.00 21.33 C ATOM 2277 CG GLU A 162 -1.714 10.257 -30.253 1.00 0.31 C ATOM 2278 CD GLU A 162 -2.555 10.526 -29.020 1.00 4.40 C ATOM 2279 OE1 GLU A 162 -2.387 11.604 -28.412 1.00 3.41 O ATOM 2280 OE2 GLU A 162 -3.380 9.660 -28.663 1.00 23.20 O ATOM 0 HA GLU A 162 0.094 10.792 -31.975 1.00 73.54 H new ATOM 0 HB2 GLU A 162 0.043 9.135 -29.775 1.00 21.33 H new ATOM 0 HB3 GLU A 162 -0.032 10.711 -29.012 1.00 21.33 H new ATOM 0 HG2 GLU A 162 -1.886 11.046 -30.985 1.00 0.31 H new ATOM 0 HG3 GLU A 162 -2.036 9.322 -30.711 1.00 0.31 H new ATOM 2287 N LEU A 163 2.095 12.274 -29.818 1.00 11.35 N ATOM 2288 CA LEU A 163 2.601 13.572 -29.385 1.00 1.30 C ATOM 2289 C LEU A 163 3.382 14.253 -30.505 1.00 14.12 C ATOM 2290 O LEU A 163 3.366 15.478 -30.630 1.00 73.35 O ATOM 2291 CB LEU A 163 3.493 13.409 -28.153 1.00 15.24 C ATOM 2292 CG LEU A 163 2.770 13.133 -26.834 1.00 2.05 C ATOM 2293 CD1 LEU A 163 2.709 11.638 -26.561 1.00 44.11 C ATOM 2294 CD2 LEU A 163 3.459 13.858 -25.686 1.00 55.45 C ATOM 0 H LEU A 163 2.576 11.475 -29.405 1.00 11.35 H new ATOM 0 HA LEU A 163 1.748 14.199 -29.128 1.00 1.30 H new ATOM 0 HB2 LEU A 163 4.191 12.593 -28.340 1.00 15.24 H new ATOM 0 HB3 LEU A 163 4.087 14.316 -28.036 1.00 15.24 H new ATOM 0 HG LEU A 163 1.750 13.509 -26.916 1.00 2.05 H new ATOM 0 HD11 LEU A 163 2.191 11.461 -25.618 1.00 44.11 H new ATOM 0 HD12 LEU A 163 2.171 11.142 -27.369 1.00 44.11 H new ATOM 0 HD13 LEU A 163 3.721 11.238 -26.500 1.00 44.11 H new ATOM 0 HD21 LEU A 163 2.931 13.650 -24.755 1.00 55.45 H new ATOM 0 HD22 LEU A 163 4.489 13.512 -25.604 1.00 55.45 H new ATOM 0 HD23 LEU A 163 3.450 14.931 -25.876 1.00 55.45 H new ATOM 2306 N ASP A 164 4.062 13.451 -31.317 1.00 13.32 N ATOM 2307 CA ASP A 164 4.846 13.976 -32.429 1.00 31.12 C ATOM 2308 C ASP A 164 3.949 14.680 -33.442 1.00 13.11 C ATOM 2309 O ASP A 164 4.090 15.879 -33.682 1.00 55.35 O ATOM 2310 CB ASP A 164 5.620 12.847 -33.112 1.00 51.50 C ATOM 2311 CG ASP A 164 6.740 12.306 -32.245 1.00 53.02 C ATOM 2312 OD1 ASP A 164 6.821 12.704 -31.064 1.00 23.51 O ATOM 2313 OD2 ASP A 164 7.534 11.484 -32.748 1.00 11.12 O ATOM 0 H ASP A 164 4.086 12.435 -31.226 1.00 13.32 H new ATOM 0 HA ASP A 164 5.554 14.703 -32.031 1.00 31.12 H new ATOM 0 HB2 ASP A 164 4.933 12.038 -33.360 1.00 51.50 H new ATOM 0 HB3 ASP A 164 6.035 13.212 -34.051 1.00 51.50 H new ATOM 2318 N ARG A 165 3.027 13.927 -34.033 1.00 64.42 N ATOM 2319 CA ARG A 165 2.109 14.478 -35.022 1.00 51.00 C ATOM 2320 C ARG A 165 1.400 15.714 -34.476 1.00 32.22 C ATOM 2321 O ARG A 165 1.230 16.708 -35.182 1.00 53.34 O ATOM 2322 CB ARG A 165 1.078 13.426 -35.434 1.00 71.34 C ATOM 2323 CG ARG A 165 0.345 13.763 -36.723 1.00 25.12 C ATOM 2324 CD ARG A 165 1.205 13.474 -37.944 1.00 14.31 C ATOM 2325 NE ARG A 165 0.398 13.137 -39.114 1.00 13.05 N ATOM 2326 CZ ARG A 165 -0.179 11.954 -39.292 1.00 61.31 C ATOM 2327 NH1 ARG A 165 -0.039 11.000 -38.382 1.00 3.14 N ATOM 2328 NH2 ARG A 165 -0.898 11.723 -40.383 1.00 31.30 N ATOM 0 H ARG A 165 2.896 12.933 -33.844 1.00 64.42 H new ATOM 0 HA ARG A 165 2.690 14.770 -35.897 1.00 51.00 H new ATOM 0 HB2 ARG A 165 1.579 12.465 -35.551 1.00 71.34 H new ATOM 0 HB3 ARG A 165 0.350 13.310 -34.632 1.00 71.34 H new ATOM 0 HG2 ARG A 165 -0.577 13.184 -36.781 1.00 25.12 H new ATOM 0 HG3 ARG A 165 0.061 14.815 -36.717 1.00 25.12 H new ATOM 0 HD2 ARG A 165 1.822 14.345 -38.167 1.00 14.31 H new ATOM 0 HD3 ARG A 165 1.884 12.651 -37.723 1.00 14.31 H new ATOM 0 HE ARG A 165 0.271 13.849 -39.833 1.00 13.05 H new ATOM 0 HH11 ARG A 165 0.513 11.173 -37.542 1.00 3.14 H new ATOM 0 HH12 ARG A 165 -0.483 10.093 -38.522 1.00 3.14 H new ATOM 0 HH21 ARG A 165 -1.008 12.454 -41.086 1.00 31.30 H new ATOM 0 HH22 ARG A 165 -1.341 10.814 -40.519 1.00 31.30 H new ATOM 2342 N LEU A 166 0.988 15.644 -33.215 1.00 32.11 N ATOM 2343 CA LEU A 166 0.296 16.757 -32.573 1.00 62.31 C ATOM 2344 C LEU A 166 1.141 18.026 -32.625 1.00 61.41 C ATOM 2345 O LEU A 166 0.647 19.099 -32.973 1.00 5.34 O ATOM 2346 CB LEU A 166 -0.033 16.409 -31.120 1.00 70.44 C ATOM 2347 CG LEU A 166 -1.512 16.185 -30.802 1.00 41.24 C ATOM 2348 CD1 LEU A 166 -1.686 15.738 -29.359 1.00 62.23 C ATOM 2349 CD2 LEU A 166 -2.312 17.451 -31.070 1.00 53.44 C ATOM 0 H LEU A 166 1.121 14.829 -32.617 1.00 32.11 H new ATOM 0 HA LEU A 166 -0.632 16.938 -33.116 1.00 62.31 H new ATOM 0 HB2 LEU A 166 0.517 15.507 -30.850 1.00 70.44 H new ATOM 0 HB3 LEU A 166 0.338 17.211 -30.482 1.00 70.44 H new ATOM 0 HG LEU A 166 -1.889 15.396 -31.453 1.00 41.24 H new ATOM 0 HD11 LEU A 166 -2.745 15.584 -29.151 1.00 62.23 H new ATOM 0 HD12 LEU A 166 -1.145 14.805 -29.199 1.00 62.23 H new ATOM 0 HD13 LEU A 166 -1.293 16.504 -28.691 1.00 62.23 H new ATOM 0 HD21 LEU A 166 -3.362 17.274 -30.838 1.00 53.44 H new ATOM 0 HD22 LEU A 166 -1.934 18.260 -30.444 1.00 53.44 H new ATOM 0 HD23 LEU A 166 -2.214 17.728 -32.120 1.00 53.44 H new ATOM 2361 N LEU A 167 2.417 17.895 -32.280 1.00 21.14 N ATOM 2362 CA LEU A 167 3.332 19.031 -32.289 1.00 25.21 C ATOM 2363 C LEU A 167 3.504 19.581 -33.701 1.00 73.54 C ATOM 2364 O LEU A 167 3.622 20.791 -33.898 1.00 62.30 O ATOM 2365 CB LEU A 167 4.692 18.620 -31.721 1.00 21.10 C ATOM 2366 CG LEU A 167 5.677 19.757 -31.448 1.00 12.42 C ATOM 2367 CD1 LEU A 167 5.490 20.298 -30.039 1.00 10.42 C ATOM 2368 CD2 LEU A 167 7.108 19.284 -31.654 1.00 45.50 C ATOM 0 H LEU A 167 2.841 17.014 -31.991 1.00 21.14 H new ATOM 0 HA LEU A 167 2.905 19.815 -31.663 1.00 25.21 H new ATOM 0 HB2 LEU A 167 4.526 18.079 -30.790 1.00 21.10 H new ATOM 0 HB3 LEU A 167 5.158 17.922 -32.417 1.00 21.10 H new ATOM 0 HG LEU A 167 5.477 20.563 -32.154 1.00 12.42 H new ATOM 0 HD11 LEU A 167 6.199 21.106 -29.863 1.00 10.42 H new ATOM 0 HD12 LEU A 167 4.474 20.676 -29.926 1.00 10.42 H new ATOM 0 HD13 LEU A 167 5.662 19.500 -29.317 1.00 10.42 H new ATOM 0 HD21 LEU A 167 7.795 20.106 -31.455 1.00 45.50 H new ATOM 0 HD22 LEU A 167 7.321 18.461 -30.972 1.00 45.50 H new ATOM 0 HD23 LEU A 167 7.235 18.946 -32.682 1.00 45.50 H new ATOM 2380 N LEU A 168 3.514 18.685 -34.682 1.00 71.51 N ATOM 2381 CA LEU A 168 3.668 19.080 -36.078 1.00 21.31 C ATOM 2382 C LEU A 168 2.652 20.153 -36.455 1.00 44.23 C ATOM 2383 O LEU A 168 3.011 21.194 -37.006 1.00 30.42 O ATOM 2384 CB LEU A 168 3.507 17.865 -36.993 1.00 70.32 C ATOM 2385 CG LEU A 168 4.572 17.695 -38.077 1.00 51.13 C ATOM 2386 CD1 LEU A 168 4.456 16.326 -38.730 1.00 0.41 C ATOM 2387 CD2 LEU A 168 4.452 18.797 -39.120 1.00 13.11 C ATOM 0 H LEU A 168 3.417 17.680 -34.537 1.00 71.51 H new ATOM 0 HA LEU A 168 4.669 19.493 -36.205 1.00 21.31 H new ATOM 0 HB2 LEU A 168 3.501 16.968 -36.374 1.00 70.32 H new ATOM 0 HB3 LEU A 168 2.532 17.926 -37.476 1.00 70.32 H new ATOM 0 HG LEU A 168 5.554 17.770 -37.609 1.00 51.13 H new ATOM 0 HD11 LEU A 168 5.222 16.223 -39.499 1.00 0.41 H new ATOM 0 HD12 LEU A 168 4.592 15.551 -37.976 1.00 0.41 H new ATOM 0 HD13 LEU A 168 3.470 16.222 -39.184 1.00 0.41 H new ATOM 0 HD21 LEU A 168 5.218 18.660 -39.884 1.00 13.11 H new ATOM 0 HD22 LEU A 168 3.466 18.754 -39.583 1.00 13.11 H new ATOM 0 HD23 LEU A 168 4.586 19.767 -38.641 1.00 13.11 H new ATOM 2399 N GLU A 169 1.384 19.893 -36.153 1.00 41.22 N ATOM 2400 CA GLU A 169 0.317 20.839 -36.460 1.00 62.40 C ATOM 2401 C GLU A 169 0.554 22.173 -35.758 1.00 62.24 C ATOM 2402 O GLU A 169 0.459 23.236 -36.373 1.00 53.10 O ATOM 2403 CB GLU A 169 -1.039 20.264 -36.043 1.00 44.54 C ATOM 2404 CG GLU A 169 -2.044 20.191 -37.180 1.00 63.25 C ATOM 2405 CD GLU A 169 -2.690 21.531 -37.476 1.00 22.53 C ATOM 2406 OE1 GLU A 169 -3.309 22.107 -36.557 1.00 61.41 O ATOM 2407 OE2 GLU A 169 -2.576 22.003 -38.626 1.00 64.23 O ATOM 0 H GLU A 169 1.070 19.036 -35.697 1.00 41.22 H new ATOM 0 HA GLU A 169 0.316 21.010 -37.536 1.00 62.40 H new ATOM 0 HB2 GLU A 169 -0.890 19.264 -35.636 1.00 44.54 H new ATOM 0 HB3 GLU A 169 -1.453 20.876 -35.242 1.00 44.54 H new ATOM 0 HG2 GLU A 169 -1.545 19.826 -38.078 1.00 63.25 H new ATOM 0 HG3 GLU A 169 -2.818 19.466 -36.929 1.00 63.25 H new ATOM 2414 N LEU A 170 0.863 22.109 -34.468 1.00 11.10 N ATOM 2415 CA LEU A 170 1.113 23.312 -33.681 1.00 23.41 C ATOM 2416 C LEU A 170 2.155 24.197 -34.357 1.00 2.54 C ATOM 2417 O LEU A 170 2.033 25.422 -34.363 1.00 21.51 O ATOM 2418 CB LEU A 170 1.582 22.936 -32.274 1.00 71.21 C ATOM 2419 CG LEU A 170 2.227 24.057 -31.460 1.00 4.44 C ATOM 2420 CD1 LEU A 170 1.870 23.922 -29.988 1.00 13.13 C ATOM 2421 CD2 LEU A 170 3.738 24.051 -31.646 1.00 74.12 C ATOM 0 H LEU A 170 0.947 21.238 -33.945 1.00 11.10 H new ATOM 0 HA LEU A 170 0.180 23.871 -33.609 1.00 23.41 H new ATOM 0 HB2 LEU A 170 0.726 22.556 -31.717 1.00 71.21 H new ATOM 0 HB3 LEU A 170 2.297 22.117 -32.358 1.00 71.21 H new ATOM 0 HG LEU A 170 1.840 25.010 -31.821 1.00 4.44 H new ATOM 0 HD11 LEU A 170 2.338 24.729 -29.425 1.00 13.13 H new ATOM 0 HD12 LEU A 170 0.788 23.977 -29.870 1.00 13.13 H new ATOM 0 HD13 LEU A 170 2.228 22.963 -29.613 1.00 13.13 H new ATOM 0 HD21 LEU A 170 4.180 24.856 -31.059 1.00 74.12 H new ATOM 0 HD22 LEU A 170 4.142 23.095 -31.313 1.00 74.12 H new ATOM 0 HD23 LEU A 170 3.975 24.198 -32.700 1.00 74.12 H new