USER MOD reduce.3.24.130724 H: found=0, std=0, add=1045, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1045 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 27 THR OG1 : rot 120:sc= -0.0974 USER MOD Set 1.2: A 59 ASN : amide:sc= -0.69 X(o=-0.79,f=-1.2) USER MOD Single : A 10 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0135) USER MOD Single : A 11 THR OG1 : rot -86:sc= 1.22 USER MOD Single : A 14 ASN : amide:sc= -0.118 X(o=-0.12,f=-0.12) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 142:sc= -0.151 (180deg=-1.71!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 140:sc= 0 USER MOD Single : A 41 SER OG : rot 91:sc= 0.342 USER MOD Single : A 45 GLN :FLIP amide:sc= -1.52 F(o=-2,f=-1.5) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 118:sc= 0.339 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -77:sc= -2.95! USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= -0.13 X(o=-0.13,f=-6.4e-05) USER MOD Single : A 72 LYS NZ :NH3+ -147:sc= 1.53 (180deg=0.271) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= 0.636 K(o=0.64,f=-8.3!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 94:sc= 0.124 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0.12) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 98:sc= 1.29 USER MOD Single : A 101 GLN :FLIP amide:sc= 0.588 F(o=0,f=0.59) USER MOD Single : A 102 SER OG : rot 88:sc= 0.289 USER MOD Single : A 104 ASN : amide:sc= -0.0347 X(o=-0.035,f=0.22) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot -103:sc= 1.01 USER MOD Single : A 110 SER OG : rot 105:sc= 0.566 USER MOD Single : A 116 LYS NZ :NH3+ 155:sc= 0.52 (180deg=0.236) USER MOD Single : A 121 GLN : amide:sc= -0.527 X(o=-0.53,f=-0.23) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot -59:sc= 0.738 USER MOD Single : A 129 ASN : amide:sc= -0.0164 K(o=-0.016,f=-1.1) USER MOD Single : A 132 GLN : amide:sc= 0.702 K(o=0.7,f=-4.5!) USER MOD Single : A 141 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 123 N LEU A 9 8.159 9.149 8.278 1.00 64.52 N ATOM 124 CA LEU A 9 8.728 9.275 9.615 1.00 13.44 C ATOM 125 C LEU A 9 10.175 9.752 9.549 1.00 23.52 C ATOM 126 O LEU A 9 10.812 9.692 8.497 1.00 5.23 O ATOM 127 CB LEU A 9 8.652 7.937 10.352 1.00 23.10 C ATOM 128 CG LEU A 9 7.638 7.855 11.493 1.00 74.10 C ATOM 129 CD1 LEU A 9 7.896 8.949 12.517 1.00 42.10 C ATOM 130 CD2 LEU A 9 6.218 7.952 10.953 1.00 43.25 C ATOM 0 HA LEU A 9 8.146 10.017 10.162 1.00 13.44 H new ATOM 0 HB2 LEU A 9 8.416 7.159 9.627 1.00 23.10 H new ATOM 0 HB3 LEU A 9 9.640 7.710 10.753 1.00 23.10 H new ATOM 0 HG LEU A 9 7.753 6.890 11.986 1.00 74.10 H new ATOM 0 HD11 LEU A 9 7.164 8.874 13.321 1.00 42.10 H new ATOM 0 HD12 LEU A 9 8.899 8.834 12.927 1.00 42.10 H new ATOM 0 HD13 LEU A 9 7.810 9.924 12.037 1.00 42.10 H new ATOM 0 HD21 LEU A 9 5.510 7.892 11.779 1.00 43.25 H new ATOM 0 HD22 LEU A 9 6.090 8.902 10.434 1.00 43.25 H new ATOM 0 HD23 LEU A 9 6.036 7.132 10.259 1.00 43.25 H new ATOM 142 N LYS A 10 10.690 10.222 10.680 1.00 2.10 N ATOM 143 CA LYS A 10 12.064 10.705 10.753 1.00 11.30 C ATOM 144 C LYS A 10 12.872 9.898 11.764 1.00 71.44 C ATOM 145 O LYS A 10 12.313 9.289 12.677 1.00 64.20 O ATOM 146 CB LYS A 10 12.085 12.187 11.134 1.00 4.25 C ATOM 147 CG LYS A 10 12.076 13.123 9.938 1.00 13.45 C ATOM 148 CD LYS A 10 10.705 13.743 9.727 1.00 53.44 C ATOM 149 CE LYS A 10 10.576 14.350 8.338 1.00 71.12 C ATOM 150 NZ LYS A 10 11.562 15.444 8.116 1.00 21.54 N ATOM 0 H LYS A 10 10.176 10.279 11.559 1.00 2.10 H new ATOM 0 HA LYS A 10 12.519 10.582 9.770 1.00 11.30 H new ATOM 0 HB2 LYS A 10 11.221 12.404 11.761 1.00 4.25 H new ATOM 0 HB3 LYS A 10 12.973 12.387 11.734 1.00 4.25 H new ATOM 0 HG2 LYS A 10 12.814 13.911 10.086 1.00 13.45 H new ATOM 0 HG3 LYS A 10 12.370 12.575 9.043 1.00 13.45 H new ATOM 0 HD2 LYS A 10 9.936 12.984 9.866 1.00 53.44 H new ATOM 0 HD3 LYS A 10 10.533 14.513 10.479 1.00 53.44 H new ATOM 0 HE2 LYS A 10 10.721 13.573 7.587 1.00 71.12 H new ATOM 0 HE3 LYS A 10 9.566 14.738 8.204 1.00 71.12 H new ATOM 0 HZ1 LYS A 10 11.408 15.865 7.178 1.00 21.54 H new ATOM 0 HZ2 LYS A 10 11.441 16.174 8.847 1.00 21.54 H new ATOM 0 HZ3 LYS A 10 12.526 15.058 8.168 1.00 21.54 H new ATOM 164 N THR A 11 14.191 9.897 11.595 1.00 13.15 N ATOM 165 CA THR A 11 15.075 9.165 12.493 1.00 63.22 C ATOM 166 C THR A 11 15.896 10.118 13.354 1.00 23.41 C ATOM 167 O THR A 11 15.875 11.331 13.148 1.00 61.44 O ATOM 168 CB THR A 11 16.032 8.244 11.711 1.00 14.22 C ATOM 169 OG1 THR A 11 16.968 9.030 10.966 1.00 42.20 O ATOM 170 CG2 THR A 11 15.258 7.337 10.766 1.00 12.32 C ATOM 0 H THR A 11 14.670 10.395 10.845 1.00 13.15 H new ATOM 0 HA THR A 11 14.439 8.556 13.135 1.00 63.22 H new ATOM 0 HB THR A 11 16.569 7.622 12.427 1.00 14.22 H new ATOM 0 HG1 THR A 11 16.579 9.266 10.098 1.00 42.20 H new ATOM 0 HG21 THR A 11 15.954 6.696 10.225 1.00 12.32 H new ATOM 0 HG22 THR A 11 14.567 6.719 11.339 1.00 12.32 H new ATOM 0 HG23 THR A 11 14.698 7.945 10.056 1.00 12.32 H new ATOM 178 N ALA A 12 16.620 9.561 14.320 1.00 74.41 N ATOM 179 CA ALA A 12 17.450 10.361 15.211 1.00 40.31 C ATOM 180 C ALA A 12 18.690 10.878 14.489 1.00 12.10 C ATOM 181 O ALA A 12 19.405 11.739 15.002 1.00 13.21 O ATOM 182 CB ALA A 12 17.849 9.548 16.433 1.00 23.12 C ATOM 0 H ALA A 12 16.648 8.558 14.505 1.00 74.41 H new ATOM 0 HA ALA A 12 16.866 11.222 15.536 1.00 40.31 H new ATOM 0 HB1 ALA A 12 18.469 10.159 17.090 1.00 23.12 H new ATOM 0 HB2 ALA A 12 16.954 9.233 16.969 1.00 23.12 H new ATOM 0 HB3 ALA A 12 18.411 8.669 16.118 1.00 23.12 H new ATOM 188 N ASP A 13 18.939 10.347 13.297 1.00 21.03 N ATOM 189 CA ASP A 13 20.093 10.755 12.504 1.00 0.15 C ATOM 190 C ASP A 13 19.726 11.894 11.557 1.00 24.54 C ATOM 191 O ASP A 13 20.463 12.195 10.620 1.00 43.52 O ATOM 192 CB ASP A 13 20.637 9.568 11.708 1.00 3.13 C ATOM 193 CG ASP A 13 21.317 8.541 12.592 1.00 32.23 C ATOM 194 OD1 ASP A 13 21.309 8.724 13.827 1.00 25.23 O ATOM 195 OD2 ASP A 13 21.857 7.554 12.049 1.00 54.11 O ATOM 0 H ASP A 13 18.357 9.633 12.859 1.00 21.03 H new ATOM 0 HA ASP A 13 20.866 11.109 13.187 1.00 0.15 H new ATOM 0 HB2 ASP A 13 19.820 9.092 11.166 1.00 3.13 H new ATOM 0 HB3 ASP A 13 21.346 9.928 10.963 1.00 3.13 H new ATOM 200 N ASN A 14 18.582 12.521 11.809 1.00 20.33 N ATOM 201 CA ASN A 14 18.117 13.625 10.978 1.00 75.10 C ATOM 202 C ASN A 14 17.834 13.153 9.555 1.00 34.20 C ATOM 203 O ASN A 14 17.888 13.937 8.608 1.00 53.13 O ATOM 204 CB ASN A 14 19.155 14.748 10.958 1.00 40.34 C ATOM 205 CG ASN A 14 18.555 16.083 10.559 1.00 22.03 C ATOM 206 OD1 ASN A 14 18.806 16.587 9.465 1.00 42.05 O ATOM 207 ND2 ASN A 14 17.758 16.662 11.449 1.00 13.22 N ATOM 0 H ASN A 14 17.960 12.284 12.582 1.00 20.33 H new ATOM 0 HA ASN A 14 17.190 14.004 11.407 1.00 75.10 H new ATOM 0 HB2 ASN A 14 19.609 14.837 11.945 1.00 40.34 H new ATOM 0 HB3 ASN A 14 19.953 14.489 10.262 1.00 40.34 H new ATOM 0 HD21 ASN A 14 17.326 17.561 11.238 1.00 13.22 H new ATOM 0 HD22 ASN A 14 17.578 16.207 12.344 1.00 13.22 H new ATOM 214 N ARG A 15 17.531 11.866 9.413 1.00 4.44 N ATOM 215 CA ARG A 15 17.240 11.289 8.106 1.00 4.45 C ATOM 216 C ARG A 15 15.919 10.527 8.131 1.00 53.32 C ATOM 217 O ARG A 15 15.429 10.119 9.184 1.00 74.22 O ATOM 218 CB ARG A 15 18.372 10.355 7.674 1.00 1.23 C ATOM 219 CG ARG A 15 19.321 10.976 6.662 1.00 22.23 C ATOM 220 CD ARG A 15 19.834 9.942 5.672 1.00 75.21 C ATOM 221 NE ARG A 15 20.473 8.812 6.342 1.00 54.25 N ATOM 222 CZ ARG A 15 21.263 7.943 5.723 1.00 63.54 C ATOM 223 NH1 ARG A 15 21.511 8.073 4.427 1.00 62.44 N ATOM 224 NH2 ARG A 15 21.808 6.940 6.400 1.00 4.44 N ATOM 0 H ARG A 15 17.481 11.204 10.187 1.00 4.44 H new ATOM 0 HA ARG A 15 17.156 12.104 7.387 1.00 4.45 H new ATOM 0 HB2 ARG A 15 18.940 10.054 8.555 1.00 1.23 H new ATOM 0 HB3 ARG A 15 17.941 9.449 7.247 1.00 1.23 H new ATOM 0 HG2 ARG A 15 18.809 11.774 6.124 1.00 22.23 H new ATOM 0 HG3 ARG A 15 20.163 11.432 7.183 1.00 22.23 H new ATOM 0 HD2 ARG A 15 19.005 9.581 5.063 1.00 75.21 H new ATOM 0 HD3 ARG A 15 20.547 10.412 4.994 1.00 75.21 H new ATOM 0 HE ARG A 15 20.303 8.684 7.340 1.00 54.25 H new ATOM 0 HH11 ARG A 15 21.094 8.842 3.903 1.00 62.44 H new ATOM 0 HH12 ARG A 15 22.118 7.404 3.954 1.00 62.44 H new ATOM 0 HH21 ARG A 15 21.620 6.836 7.397 1.00 4.44 H new ATOM 0 HH22 ARG A 15 22.415 6.273 5.923 1.00 4.44 H new ATOM 238 N PRO A 16 15.326 10.331 6.943 1.00 5.24 N ATOM 239 CA PRO A 16 14.054 9.617 6.802 1.00 51.43 C ATOM 240 C PRO A 16 14.190 8.126 7.090 1.00 3.32 C ATOM 241 O PRO A 16 15.055 7.453 6.531 1.00 61.12 O ATOM 242 CB PRO A 16 13.680 9.846 5.335 1.00 2.31 C ATOM 243 CG PRO A 16 14.979 10.088 4.647 1.00 40.15 C ATOM 244 CD PRO A 16 15.854 10.791 5.648 1.00 70.44 C ATOM 0 HA PRO A 16 13.305 9.975 7.509 1.00 51.43 H new ATOM 0 HB2 PRO A 16 13.166 8.980 4.918 1.00 2.31 H new ATOM 0 HB3 PRO A 16 13.009 10.698 5.226 1.00 2.31 H new ATOM 0 HG2 PRO A 16 15.431 9.150 4.325 1.00 40.15 H new ATOM 0 HG3 PRO A 16 14.840 10.698 3.754 1.00 40.15 H new ATOM 0 HD2 PRO A 16 16.903 10.523 5.523 1.00 70.44 H new ATOM 0 HD3 PRO A 16 15.788 11.874 5.549 1.00 70.44 H new ATOM 252 N ALA A 17 13.331 7.617 7.966 1.00 33.24 N ATOM 253 CA ALA A 17 13.354 6.205 8.327 1.00 62.30 C ATOM 254 C ALA A 17 13.136 5.322 7.103 1.00 73.10 C ATOM 255 O ALA A 17 13.462 4.135 7.115 1.00 4.14 O ATOM 256 CB ALA A 17 12.301 5.913 9.386 1.00 61.34 C ATOM 0 H ALA A 17 12.610 8.162 8.439 1.00 33.24 H new ATOM 0 HA ALA A 17 14.338 5.976 8.737 1.00 62.30 H new ATOM 0 HB1 ALA A 17 12.330 4.855 9.646 1.00 61.34 H new ATOM 0 HB2 ALA A 17 12.503 6.510 10.275 1.00 61.34 H new ATOM 0 HB3 ALA A 17 11.314 6.164 8.997 1.00 61.34 H new ATOM 262 N SER A 18 12.581 5.909 6.047 1.00 35.43 N ATOM 263 CA SER A 18 12.314 5.174 4.816 1.00 21.44 C ATOM 264 C SER A 18 13.593 4.544 4.272 1.00 33.43 C ATOM 265 O SER A 18 13.562 3.471 3.669 1.00 51.14 O ATOM 266 CB SER A 18 11.702 6.102 3.765 1.00 22.25 C ATOM 267 OG SER A 18 12.671 6.502 2.812 1.00 4.13 O ATOM 0 H SER A 18 12.308 6.891 6.019 1.00 35.43 H new ATOM 0 HA SER A 18 11.605 4.378 5.044 1.00 21.44 H new ATOM 0 HB2 SER A 18 10.880 5.594 3.261 1.00 22.25 H new ATOM 0 HB3 SER A 18 11.282 6.982 4.252 1.00 22.25 H new ATOM 0 HG SER A 18 12.255 7.093 2.150 1.00 4.13 H new ATOM 273 N VAL A 19 14.717 5.218 4.491 1.00 51.52 N ATOM 274 CA VAL A 19 16.007 4.726 4.024 1.00 23.21 C ATOM 275 C VAL A 19 16.299 3.337 4.581 1.00 5.11 C ATOM 276 O VAL A 19 16.951 2.520 3.930 1.00 73.12 O ATOM 277 CB VAL A 19 17.150 5.678 4.424 1.00 12.21 C ATOM 278 CG1 VAL A 19 16.905 7.071 3.863 1.00 23.22 C ATOM 279 CG2 VAL A 19 17.300 5.723 5.937 1.00 25.22 C ATOM 0 H VAL A 19 14.760 6.107 4.989 1.00 51.52 H new ATOM 0 HA VAL A 19 15.951 4.675 2.937 1.00 23.21 H new ATOM 0 HB VAL A 19 18.080 5.300 4.000 1.00 12.21 H new ATOM 0 HG11 VAL A 19 17.722 7.730 4.156 1.00 23.22 H new ATOM 0 HG12 VAL A 19 16.851 7.021 2.776 1.00 23.22 H new ATOM 0 HG13 VAL A 19 15.966 7.461 4.256 1.00 23.22 H new ATOM 0 HG21 VAL A 19 18.112 6.400 6.202 1.00 25.22 H new ATOM 0 HG22 VAL A 19 16.371 6.077 6.384 1.00 25.22 H new ATOM 0 HG23 VAL A 19 17.524 4.724 6.310 1.00 25.22 H new ATOM 289 N TYR A 20 15.813 3.076 5.789 1.00 5.35 N ATOM 290 CA TYR A 20 16.024 1.786 6.436 1.00 50.41 C ATOM 291 C TYR A 20 15.092 0.727 5.855 1.00 41.31 C ATOM 292 O TYR A 20 15.242 -0.465 6.127 1.00 55.25 O ATOM 293 CB TYR A 20 15.801 1.906 7.944 1.00 32.14 C ATOM 294 CG TYR A 20 16.853 2.732 8.649 1.00 64.23 C ATOM 295 CD1 TYR A 20 18.196 2.382 8.586 1.00 24.31 C ATOM 296 CD2 TYR A 20 16.505 3.863 9.376 1.00 14.32 C ATOM 297 CE1 TYR A 20 19.161 3.133 9.229 1.00 42.13 C ATOM 298 CE2 TYR A 20 17.463 4.621 10.021 1.00 52.52 C ATOM 299 CZ TYR A 20 18.790 4.252 9.945 1.00 55.05 C ATOM 300 OH TYR A 20 19.748 5.004 10.585 1.00 72.11 O ATOM 0 H TYR A 20 15.270 3.740 6.340 1.00 5.35 H new ATOM 0 HA TYR A 20 17.053 1.479 6.251 1.00 50.41 H new ATOM 0 HB2 TYR A 20 14.822 2.350 8.124 1.00 32.14 H new ATOM 0 HB3 TYR A 20 15.783 0.907 8.380 1.00 32.14 H new ATOM 0 HD1 TYR A 20 18.491 1.508 8.025 1.00 24.31 H new ATOM 0 HD2 TYR A 20 15.467 4.155 9.438 1.00 14.32 H new ATOM 0 HE1 TYR A 20 20.200 2.845 9.171 1.00 42.13 H new ATOM 0 HE2 TYR A 20 17.175 5.498 10.582 1.00 52.52 H new ATOM 0 HH TYR A 20 19.320 5.758 11.043 1.00 72.11 H new ATOM 310 N LEU A 21 14.130 1.171 5.053 1.00 23.12 N ATOM 311 CA LEU A 21 13.173 0.263 4.432 1.00 72.45 C ATOM 312 C LEU A 21 13.440 0.130 2.936 1.00 51.44 C ATOM 313 O LEU A 21 13.484 1.125 2.211 1.00 34.12 O ATOM 314 CB LEU A 21 11.745 0.758 4.664 1.00 15.34 C ATOM 315 CG LEU A 21 11.560 1.762 5.803 1.00 35.44 C ATOM 316 CD1 LEU A 21 10.132 2.286 5.826 1.00 43.31 C ATOM 317 CD2 LEU A 21 11.917 1.125 7.138 1.00 34.44 C ATOM 0 H LEU A 21 13.993 2.154 4.818 1.00 23.12 H new ATOM 0 HA LEU A 21 13.290 -0.718 4.892 1.00 72.45 H new ATOM 0 HB2 LEU A 21 11.386 1.215 3.742 1.00 15.34 H new ATOM 0 HB3 LEU A 21 11.110 -0.106 4.861 1.00 15.34 H new ATOM 0 HG LEU A 21 12.232 2.603 5.633 1.00 35.44 H new ATOM 0 HD11 LEU A 21 10.019 2.999 6.643 1.00 43.31 H new ATOM 0 HD12 LEU A 21 9.910 2.780 4.880 1.00 43.31 H new ATOM 0 HD13 LEU A 21 9.442 1.455 5.972 1.00 43.31 H new ATOM 0 HD21 LEU A 21 11.780 1.854 7.937 1.00 34.44 H new ATOM 0 HD22 LEU A 21 11.271 0.265 7.315 1.00 34.44 H new ATOM 0 HD23 LEU A 21 12.957 0.799 7.119 1.00 34.44 H new ATOM 329 N LYS A 22 13.616 -1.105 2.478 1.00 11.33 N ATOM 330 CA LYS A 22 13.875 -1.369 1.068 1.00 60.20 C ATOM 331 C LYS A 22 14.045 -2.864 0.817 1.00 32.10 C ATOM 332 O LYS A 22 13.791 -3.685 1.699 1.00 71.13 O ATOM 333 CB LYS A 22 15.127 -0.619 0.609 1.00 43.21 C ATOM 334 CG LYS A 22 14.847 0.452 -0.431 1.00 4.51 C ATOM 335 CD LYS A 22 15.410 0.071 -1.790 1.00 3.22 C ATOM 336 CE LYS A 22 15.340 1.234 -2.768 1.00 60.43 C ATOM 337 NZ LYS A 22 16.581 2.056 -2.742 1.00 51.42 N ATOM 0 H LYS A 22 13.584 -1.939 3.064 1.00 11.33 H new ATOM 0 HA LYS A 22 13.017 -1.017 0.495 1.00 60.20 H new ATOM 0 HB2 LYS A 22 15.602 -0.158 1.475 1.00 43.21 H new ATOM 0 HB3 LYS A 22 15.839 -1.335 0.199 1.00 43.21 H new ATOM 0 HG2 LYS A 22 13.771 0.609 -0.513 1.00 4.51 H new ATOM 0 HG3 LYS A 22 15.283 1.397 -0.108 1.00 4.51 H new ATOM 0 HD2 LYS A 22 16.446 -0.251 -1.679 1.00 3.22 H new ATOM 0 HD3 LYS A 22 14.854 -0.777 -2.191 1.00 3.22 H new ATOM 0 HE2 LYS A 22 15.179 0.852 -3.776 1.00 60.43 H new ATOM 0 HE3 LYS A 22 14.483 1.862 -2.524 1.00 60.43 H new ATOM 0 HZ1 LYS A 22 16.494 2.838 -3.422 1.00 51.42 H new ATOM 0 HZ2 LYS A 22 16.722 2.442 -1.787 1.00 51.42 H new ATOM 0 HZ3 LYS A 22 17.396 1.463 -2.999 1.00 51.42 H new ATOM 351 N LYS A 23 14.477 -3.211 -0.391 1.00 31.45 N ATOM 352 CA LYS A 23 14.684 -4.607 -0.758 1.00 33.35 C ATOM 353 C LYS A 23 13.363 -5.370 -0.763 1.00 13.04 C ATOM 354 O LYS A 23 13.340 -6.592 -0.617 1.00 63.31 O ATOM 355 CB LYS A 23 15.664 -5.271 0.212 1.00 43.01 C ATOM 356 CG LYS A 23 16.937 -4.471 0.432 1.00 32.43 C ATOM 357 CD LYS A 23 17.710 -4.975 1.639 1.00 30.44 C ATOM 358 CE LYS A 23 17.237 -4.309 2.922 1.00 34.43 C ATOM 359 NZ LYS A 23 18.365 -3.704 3.682 1.00 2.20 N ATOM 0 H LYS A 23 14.691 -2.544 -1.133 1.00 31.45 H new ATOM 0 HA LYS A 23 15.103 -4.634 -1.764 1.00 33.35 H new ATOM 0 HB2 LYS A 23 15.168 -5.420 1.171 1.00 43.01 H new ATOM 0 HB3 LYS A 23 15.926 -6.258 -0.168 1.00 43.01 H new ATOM 0 HG2 LYS A 23 17.566 -4.534 -0.456 1.00 32.43 H new ATOM 0 HG3 LYS A 23 16.687 -3.419 0.572 1.00 32.43 H new ATOM 0 HD2 LYS A 23 17.591 -6.055 1.723 1.00 30.44 H new ATOM 0 HD3 LYS A 23 18.773 -4.781 1.498 1.00 30.44 H new ATOM 0 HE2 LYS A 23 16.506 -3.537 2.682 1.00 34.43 H new ATOM 0 HE3 LYS A 23 16.731 -5.044 3.547 1.00 34.43 H new ATOM 0 HZ1 LYS A 23 18.001 -3.260 4.549 1.00 2.20 H new ATOM 0 HZ2 LYS A 23 19.051 -4.444 3.933 1.00 2.20 H new ATOM 0 HZ3 LYS A 23 18.832 -2.984 3.095 1.00 2.20 H new ATOM 373 N ASP A 24 12.265 -4.641 -0.932 1.00 70.42 N ATOM 374 CA ASP A 24 10.940 -5.250 -0.959 1.00 30.02 C ATOM 375 C ASP A 24 10.719 -6.124 0.272 1.00 73.35 C ATOM 376 O ASP A 24 9.967 -7.098 0.228 1.00 61.55 O ATOM 377 CB ASP A 24 10.763 -6.082 -2.230 1.00 21.42 C ATOM 378 CG ASP A 24 11.233 -5.350 -3.471 1.00 71.24 C ATOM 379 OD1 ASP A 24 10.903 -4.155 -3.615 1.00 50.40 O ATOM 380 OD2 ASP A 24 11.930 -5.973 -4.300 1.00 31.11 O ATOM 0 H ASP A 24 12.266 -3.628 -1.052 1.00 70.42 H new ATOM 0 HA ASP A 24 10.199 -4.450 -0.952 1.00 30.02 H new ATOM 0 HB2 ASP A 24 11.318 -7.015 -2.130 1.00 21.42 H new ATOM 0 HB3 ASP A 24 9.712 -6.347 -2.344 1.00 21.42 H new ATOM 385 N LYS A 25 11.379 -5.771 1.369 1.00 41.51 N ATOM 386 CA LYS A 25 11.255 -6.522 2.612 1.00 4.45 C ATOM 387 C LYS A 25 10.566 -5.686 3.686 1.00 21.15 C ATOM 388 O LYS A 25 10.591 -4.455 3.660 1.00 33.55 O ATOM 389 CB LYS A 25 12.635 -6.965 3.104 1.00 62.22 C ATOM 390 CG LYS A 25 13.445 -7.706 2.054 1.00 24.22 C ATOM 391 CD LYS A 25 14.336 -8.765 2.682 1.00 34.41 C ATOM 392 CE LYS A 25 13.913 -10.166 2.268 1.00 75.35 C ATOM 393 NZ LYS A 25 15.082 -11.074 2.107 1.00 30.21 N ATOM 0 H LYS A 25 12.006 -4.968 1.423 1.00 41.51 H new ATOM 0 HA LYS A 25 10.645 -7.404 2.415 1.00 4.45 H new ATOM 0 HB2 LYS A 25 13.194 -6.088 3.430 1.00 62.22 H new ATOM 0 HB3 LYS A 25 12.512 -7.607 3.976 1.00 62.22 H new ATOM 0 HG2 LYS A 25 12.771 -8.175 1.337 1.00 24.22 H new ATOM 0 HG3 LYS A 25 14.058 -6.996 1.498 1.00 24.22 H new ATOM 0 HD2 LYS A 25 15.371 -8.594 2.386 1.00 34.41 H new ATOM 0 HD3 LYS A 25 14.297 -8.678 3.768 1.00 34.41 H new ATOM 0 HE2 LYS A 25 13.235 -10.576 3.016 1.00 75.35 H new ATOM 0 HE3 LYS A 25 13.360 -10.116 1.330 1.00 75.35 H new ATOM 0 HZ1 LYS A 25 14.836 -12.022 2.457 1.00 30.21 H new ATOM 0 HZ2 LYS A 25 15.340 -11.133 1.101 1.00 30.21 H new ATOM 0 HZ3 LYS A 25 15.887 -10.703 2.650 1.00 30.21 H new ATOM 407 N PRO A 26 9.937 -6.368 4.655 1.00 21.21 N ATOM 408 CA PRO A 26 9.231 -5.708 5.757 1.00 20.44 C ATOM 409 C PRO A 26 10.185 -5.019 6.727 1.00 62.40 C ATOM 410 O PRO A 26 11.403 -5.050 6.544 1.00 13.21 O ATOM 411 CB PRO A 26 8.502 -6.861 6.452 1.00 25.25 C ATOM 412 CG PRO A 26 9.308 -8.071 6.125 1.00 2.21 C ATOM 413 CD PRO A 26 9.867 -7.836 4.749 1.00 21.10 C ATOM 0 HA PRO A 26 8.568 -4.919 5.402 1.00 20.44 H new ATOM 0 HB2 PRO A 26 8.446 -6.702 7.529 1.00 25.25 H new ATOM 0 HB3 PRO A 26 7.478 -6.958 6.090 1.00 25.25 H new ATOM 0 HG2 PRO A 26 10.107 -8.216 6.852 1.00 2.21 H new ATOM 0 HG3 PRO A 26 8.691 -8.969 6.147 1.00 2.21 H new ATOM 0 HD2 PRO A 26 10.849 -8.293 4.631 1.00 21.10 H new ATOM 0 HD3 PRO A 26 9.224 -8.258 3.977 1.00 21.10 H new ATOM 421 N THR A 27 9.625 -4.398 7.760 1.00 21.14 N ATOM 422 CA THR A 27 10.426 -3.701 8.759 1.00 50.04 C ATOM 423 C THR A 27 9.849 -3.891 10.157 1.00 40.22 C ATOM 424 O THR A 27 8.631 -3.885 10.343 1.00 4.12 O ATOM 425 CB THR A 27 10.517 -2.194 8.453 1.00 11.14 C ATOM 426 OG1 THR A 27 10.842 -1.992 7.074 1.00 64.34 O ATOM 427 CG2 THR A 27 11.566 -1.527 9.330 1.00 40.41 C ATOM 0 H THR A 27 8.619 -4.363 7.927 1.00 21.14 H new ATOM 0 HA THR A 27 11.426 -4.133 8.721 1.00 50.04 H new ATOM 0 HB THR A 27 9.548 -1.743 8.666 1.00 11.14 H new ATOM 0 HG1 THR A 27 10.127 -1.480 6.641 1.00 64.34 H new ATOM 0 HG21 THR A 27 11.613 -0.463 9.096 1.00 40.41 H new ATOM 0 HG22 THR A 27 11.299 -1.657 10.379 1.00 40.41 H new ATOM 0 HG23 THR A 27 12.539 -1.982 9.144 1.00 40.41 H new ATOM 435 N LEU A 28 10.730 -4.058 11.137 1.00 35.42 N ATOM 436 CA LEU A 28 10.307 -4.249 12.520 1.00 22.25 C ATOM 437 C LEU A 28 10.510 -2.974 13.332 1.00 14.14 C ATOM 438 O LEU A 28 11.626 -2.467 13.442 1.00 25.00 O ATOM 439 CB LEU A 28 11.085 -5.402 13.158 1.00 43.14 C ATOM 440 CG LEU A 28 10.441 -6.785 13.054 1.00 11.33 C ATOM 441 CD1 LEU A 28 11.313 -7.720 12.231 1.00 2.04 C ATOM 442 CD2 LEU A 28 10.195 -7.363 14.440 1.00 31.21 C ATOM 0 H LEU A 28 11.741 -4.065 11.000 1.00 35.42 H new ATOM 0 HA LEU A 28 9.245 -4.492 12.519 1.00 22.25 H new ATOM 0 HB2 LEU A 28 12.072 -5.447 12.697 1.00 43.14 H new ATOM 0 HB3 LEU A 28 11.236 -5.172 14.213 1.00 43.14 H new ATOM 0 HG LEU A 28 9.480 -6.681 12.549 1.00 11.33 H new ATOM 0 HD11 LEU A 28 10.838 -8.699 12.168 1.00 2.04 H new ATOM 0 HD12 LEU A 28 11.438 -7.312 11.228 1.00 2.04 H new ATOM 0 HD13 LEU A 28 12.289 -7.820 12.706 1.00 2.04 H new ATOM 0 HD21 LEU A 28 9.736 -8.347 14.348 1.00 31.21 H new ATOM 0 HD22 LEU A 28 11.143 -7.453 14.970 1.00 31.21 H new ATOM 0 HD23 LEU A 28 9.529 -6.703 14.996 1.00 31.21 H new ATOM 454 N ILE A 29 9.423 -2.462 13.901 1.00 62.01 N ATOM 455 CA ILE A 29 9.483 -1.248 14.706 1.00 74.15 C ATOM 456 C ILE A 29 9.441 -1.573 16.195 1.00 70.12 C ATOM 457 O ILE A 29 8.514 -2.227 16.674 1.00 51.24 O ATOM 458 CB ILE A 29 8.324 -0.292 14.368 1.00 53.42 C ATOM 459 CG1 ILE A 29 8.291 -0.006 12.865 1.00 0.40 C ATOM 460 CG2 ILE A 29 8.458 1.003 15.156 1.00 63.30 C ATOM 461 CD1 ILE A 29 7.083 0.793 12.428 1.00 71.20 C ATOM 0 H ILE A 29 8.491 -2.869 13.819 1.00 62.01 H new ATOM 0 HA ILE A 29 10.428 -0.759 14.470 1.00 74.15 H new ATOM 0 HB ILE A 29 7.385 -0.770 14.649 1.00 53.42 H new ATOM 0 HG12 ILE A 29 9.195 0.536 12.587 1.00 0.40 H new ATOM 0 HG13 ILE A 29 8.306 -0.952 12.323 1.00 0.40 H new ATOM 0 HG21 ILE A 29 7.631 1.668 14.906 1.00 63.30 H new ATOM 0 HG22 ILE A 29 8.437 0.783 16.223 1.00 63.30 H new ATOM 0 HG23 ILE A 29 9.402 1.486 14.904 1.00 63.30 H new ATOM 0 HD11 ILE A 29 7.126 0.958 11.351 1.00 71.20 H new ATOM 0 HD12 ILE A 29 6.175 0.244 12.675 1.00 71.20 H new ATOM 0 HD13 ILE A 29 7.077 1.754 12.942 1.00 71.20 H new ATOM 473 N LYS A 30 10.451 -1.111 16.924 1.00 10.10 N ATOM 474 CA LYS A 30 10.530 -1.349 18.360 1.00 0.24 C ATOM 475 C LYS A 30 10.397 -0.042 19.136 1.00 30.44 C ATOM 476 O LYS A 30 11.197 0.878 18.965 1.00 61.54 O ATOM 477 CB LYS A 30 11.854 -2.031 18.713 1.00 34.31 C ATOM 478 CG LYS A 30 12.154 -2.043 20.202 1.00 42.21 C ATOM 479 CD LYS A 30 13.481 -2.721 20.498 1.00 64.15 C ATOM 480 CE LYS A 30 13.371 -3.670 21.681 1.00 72.10 C ATOM 481 NZ LYS A 30 13.888 -3.056 22.935 1.00 43.21 N ATOM 0 H LYS A 30 11.227 -0.569 16.543 1.00 10.10 H new ATOM 0 HA LYS A 30 9.705 -2.004 18.640 1.00 0.24 H new ATOM 0 HB2 LYS A 30 11.833 -3.057 18.347 1.00 34.31 H new ATOM 0 HB3 LYS A 30 12.665 -1.523 18.192 1.00 34.31 H new ATOM 0 HG2 LYS A 30 12.175 -1.020 20.578 1.00 42.21 H new ATOM 0 HG3 LYS A 30 11.354 -2.561 20.731 1.00 42.21 H new ATOM 0 HD2 LYS A 30 13.813 -3.272 19.618 1.00 64.15 H new ATOM 0 HD3 LYS A 30 14.238 -1.965 20.706 1.00 64.15 H new ATOM 0 HE2 LYS A 30 12.329 -3.957 21.820 1.00 72.10 H new ATOM 0 HE3 LYS A 30 13.927 -4.583 21.467 1.00 72.10 H new ATOM 0 HZ1 LYS A 30 13.795 -3.735 23.718 1.00 43.21 H new ATOM 0 HZ2 LYS A 30 14.890 -2.805 22.811 1.00 43.21 H new ATOM 0 HZ3 LYS A 30 13.341 -2.199 23.153 1.00 43.21 H new ATOM 495 N PHE A 31 9.382 0.032 19.991 1.00 24.05 N ATOM 496 CA PHE A 31 9.145 1.226 20.794 1.00 23.15 C ATOM 497 C PHE A 31 9.874 1.135 22.132 1.00 1.40 C ATOM 498 O PHE A 31 9.621 0.232 22.929 1.00 15.10 O ATOM 499 CB PHE A 31 7.646 1.418 21.030 1.00 52.51 C ATOM 500 CG PHE A 31 6.877 1.729 19.777 1.00 4.44 C ATOM 501 CD1 PHE A 31 6.687 0.759 18.807 1.00 34.20 C ATOM 502 CD2 PHE A 31 6.345 2.992 19.571 1.00 64.15 C ATOM 503 CE1 PHE A 31 5.981 1.043 17.653 1.00 34.33 C ATOM 504 CE2 PHE A 31 5.638 3.281 18.419 1.00 41.42 C ATOM 505 CZ PHE A 31 5.455 2.305 17.459 1.00 13.15 C ATOM 0 H PHE A 31 8.711 -0.720 20.145 1.00 24.05 H new ATOM 0 HA PHE A 31 9.533 2.085 20.246 1.00 23.15 H new ATOM 0 HB2 PHE A 31 7.239 0.514 21.482 1.00 52.51 H new ATOM 0 HB3 PHE A 31 7.500 2.226 21.747 1.00 52.51 H new ATOM 0 HD1 PHE A 31 7.095 -0.230 18.954 1.00 34.20 H new ATOM 0 HD2 PHE A 31 6.484 3.759 20.319 1.00 64.15 H new ATOM 0 HE1 PHE A 31 5.841 0.278 16.903 1.00 34.33 H new ATOM 0 HE2 PHE A 31 5.229 4.269 18.270 1.00 41.42 H new ATOM 0 HZ PHE A 31 4.902 2.528 16.559 1.00 13.15 H new ATOM 515 N TRP A 32 10.780 2.077 22.370 1.00 60.22 N ATOM 516 CA TRP A 32 11.547 2.104 23.610 1.00 33.44 C ATOM 517 C TRP A 32 11.513 3.491 24.241 1.00 44.40 C ATOM 518 O TRP A 32 10.800 4.379 23.773 1.00 21.55 O ATOM 519 CB TRP A 32 12.994 1.683 23.349 1.00 51.32 C ATOM 520 CG TRP A 32 13.693 2.553 22.348 1.00 23.32 C ATOM 521 CD1 TRP A 32 13.415 2.656 21.015 1.00 32.42 C ATOM 522 CD2 TRP A 32 14.789 3.440 22.601 1.00 74.41 C ATOM 523 NE1 TRP A 32 14.271 3.553 20.424 1.00 60.01 N ATOM 524 CE2 TRP A 32 15.123 4.049 21.375 1.00 32.54 C ATOM 525 CE3 TRP A 32 15.518 3.780 23.743 1.00 0.21 C ATOM 526 CZ2 TRP A 32 16.155 4.976 21.263 1.00 52.35 C ATOM 527 CZ3 TRP A 32 16.542 4.701 23.629 1.00 22.14 C ATOM 528 CH2 TRP A 32 16.852 5.291 22.397 1.00 65.01 C ATOM 0 H TRP A 32 11.001 2.832 21.721 1.00 60.22 H new ATOM 0 HA TRP A 32 11.092 1.398 24.305 1.00 33.44 H new ATOM 0 HB2 TRP A 32 13.547 1.705 24.288 1.00 51.32 H new ATOM 0 HB3 TRP A 32 13.007 0.652 22.996 1.00 51.32 H new ATOM 0 HD1 TRP A 32 12.636 2.112 20.501 1.00 32.42 H new ATOM 0 HE1 TRP A 32 14.272 3.808 19.437 1.00 60.01 H new ATOM 0 HE3 TRP A 32 15.286 3.331 24.698 1.00 0.21 H new ATOM 0 HZ2 TRP A 32 16.397 5.431 20.314 1.00 52.35 H new ATOM 0 HZ3 TRP A 32 17.113 4.971 24.505 1.00 22.14 H new ATOM 0 HH2 TRP A 32 17.657 6.009 22.341 1.00 65.01 H new ATOM 539 N ALA A 33 12.289 3.672 25.305 1.00 45.24 N ATOM 540 CA ALA A 33 12.350 4.953 25.997 1.00 11.23 C ATOM 541 C ALA A 33 13.614 5.061 26.843 1.00 21.11 C ATOM 542 O ALA A 33 14.127 4.058 27.341 1.00 54.51 O ATOM 543 CB ALA A 33 11.114 5.143 26.865 1.00 64.12 C ATOM 0 H ALA A 33 12.884 2.947 25.706 1.00 45.24 H new ATOM 0 HA ALA A 33 12.379 5.742 25.246 1.00 11.23 H new ATOM 0 HB1 ALA A 33 11.173 6.104 27.376 1.00 64.12 H new ATOM 0 HB2 ALA A 33 10.222 5.119 26.239 1.00 64.12 H new ATOM 0 HB3 ALA A 33 11.061 4.342 27.603 1.00 64.12 H new ATOM 549 N SER A 34 14.113 6.283 27.001 1.00 33.10 N ATOM 550 CA SER A 34 15.320 6.521 27.783 1.00 22.41 C ATOM 551 C SER A 34 15.095 6.168 29.250 1.00 4.14 C ATOM 552 O SER A 34 16.046 5.930 29.995 1.00 10.24 O ATOM 553 CB SER A 34 15.754 7.982 27.659 1.00 42.42 C ATOM 554 OG SER A 34 14.962 8.821 28.482 1.00 41.34 O ATOM 0 H SER A 34 13.700 7.124 26.597 1.00 33.10 H new ATOM 0 HA SER A 34 16.110 5.881 27.390 1.00 22.41 H new ATOM 0 HB2 SER A 34 16.803 8.078 27.939 1.00 42.42 H new ATOM 0 HB3 SER A 34 15.671 8.302 26.621 1.00 42.42 H new ATOM 0 HG SER A 34 15.531 9.501 28.900 1.00 41.34 H new ATOM 560 N TRP A 35 13.832 6.137 29.657 1.00 33.24 N ATOM 561 CA TRP A 35 13.481 5.813 31.036 1.00 53.43 C ATOM 562 C TRP A 35 13.155 4.331 31.181 1.00 53.10 C ATOM 563 O TRP A 35 12.399 3.936 32.069 1.00 20.42 O ATOM 564 CB TRP A 35 12.289 6.657 31.492 1.00 43.44 C ATOM 565 CG TRP A 35 11.077 6.491 30.626 1.00 44.14 C ATOM 566 CD1 TRP A 35 10.810 7.143 29.456 1.00 43.33 C ATOM 567 CD2 TRP A 35 9.968 5.617 30.862 1.00 3.24 C ATOM 568 NE1 TRP A 35 9.602 6.727 28.951 1.00 12.41 N ATOM 569 CE2 TRP A 35 9.066 5.791 29.795 1.00 73.02 C ATOM 570 CE3 TRP A 35 9.651 4.704 31.871 1.00 74.52 C ATOM 571 CZ2 TRP A 35 7.868 5.085 29.710 1.00 4.45 C ATOM 572 CZ3 TRP A 35 8.462 4.004 31.786 1.00 52.33 C ATOM 573 CH2 TRP A 35 7.583 4.197 30.712 1.00 52.53 C ATOM 0 H TRP A 35 13.034 6.332 29.053 1.00 33.24 H new ATOM 0 HA TRP A 35 14.341 6.040 31.666 1.00 53.43 H new ATOM 0 HB2 TRP A 35 12.034 6.388 32.517 1.00 43.44 H new ATOM 0 HB3 TRP A 35 12.579 7.708 31.501 1.00 43.44 H new ATOM 0 HD1 TRP A 35 11.454 7.878 28.995 1.00 43.33 H new ATOM 0 HE1 TRP A 35 9.174 7.061 28.088 1.00 12.41 H new ATOM 0 HE3 TRP A 35 10.323 4.548 32.702 1.00 74.52 H new ATOM 0 HZ2 TRP A 35 7.189 5.233 28.883 1.00 4.45 H new ATOM 0 HZ3 TRP A 35 8.206 3.296 32.561 1.00 52.33 H new ATOM 0 HH2 TRP A 35 6.662 3.634 30.674 1.00 52.53 H new ATOM 584 N CYS A 36 13.729 3.515 30.304 1.00 72.32 N ATOM 585 CA CYS A 36 13.499 2.075 30.334 1.00 2.31 C ATOM 586 C CYS A 36 14.820 1.316 30.422 1.00 73.42 C ATOM 587 O CYS A 36 15.684 1.420 29.551 1.00 12.11 O ATOM 588 CB CYS A 36 12.726 1.635 29.089 1.00 24.23 C ATOM 589 SG CYS A 36 12.424 -0.159 28.998 1.00 32.32 S ATOM 0 H CYS A 36 14.357 3.826 29.563 1.00 72.32 H new ATOM 0 HA CYS A 36 12.908 1.844 31.220 1.00 2.31 H new ATOM 0 HB2 CYS A 36 11.769 2.156 29.066 1.00 24.23 H new ATOM 0 HB3 CYS A 36 13.279 1.945 28.202 1.00 24.23 H new ATOM 594 N PRO A 37 14.981 0.532 31.498 1.00 32.42 N ATOM 595 CA PRO A 37 16.192 -0.262 31.726 1.00 43.25 C ATOM 596 C PRO A 37 16.320 -1.420 30.741 1.00 1.45 C ATOM 597 O PRO A 37 17.372 -1.617 30.132 1.00 43.50 O ATOM 598 CB PRO A 37 16.009 -0.789 33.151 1.00 73.13 C ATOM 599 CG PRO A 37 14.534 -0.802 33.363 1.00 62.22 C ATOM 600 CD PRO A 37 13.992 0.359 32.576 1.00 63.11 C ATOM 0 HA PRO A 37 17.098 0.329 31.589 1.00 43.25 H new ATOM 0 HB2 PRO A 37 16.434 -1.787 33.262 1.00 73.13 H new ATOM 0 HB3 PRO A 37 16.508 -0.148 33.878 1.00 73.13 H new ATOM 0 HG2 PRO A 37 14.099 -1.742 33.022 1.00 62.22 H new ATOM 0 HG3 PRO A 37 14.291 -0.704 34.421 1.00 62.22 H new ATOM 0 HD2 PRO A 37 12.999 0.147 32.180 1.00 63.11 H new ATOM 0 HD3 PRO A 37 13.906 1.255 33.190 1.00 63.11 H new ATOM 608 N LEU A 38 15.243 -2.183 30.590 1.00 5.13 N ATOM 609 CA LEU A 38 15.235 -3.322 29.679 1.00 40.01 C ATOM 610 C LEU A 38 15.389 -2.863 28.232 1.00 20.24 C ATOM 611 O LEU A 38 15.664 -3.667 27.341 1.00 54.13 O ATOM 612 CB LEU A 38 13.939 -4.118 29.838 1.00 34.12 C ATOM 613 CG LEU A 38 13.583 -4.544 31.263 1.00 23.11 C ATOM 614 CD1 LEU A 38 12.243 -5.263 31.287 1.00 42.31 C ATOM 615 CD2 LEU A 38 14.676 -5.430 31.843 1.00 61.20 C ATOM 0 H LEU A 38 14.365 -2.034 31.086 1.00 5.13 H new ATOM 0 HA LEU A 38 16.081 -3.962 29.930 1.00 40.01 H new ATOM 0 HB2 LEU A 38 13.118 -3.520 29.443 1.00 34.12 H new ATOM 0 HB3 LEU A 38 14.007 -5.013 29.219 1.00 34.12 H new ATOM 0 HG LEU A 38 13.502 -3.649 31.880 1.00 23.11 H new ATOM 0 HD11 LEU A 38 12.007 -5.558 32.309 1.00 42.31 H new ATOM 0 HD12 LEU A 38 11.466 -4.597 30.913 1.00 42.31 H new ATOM 0 HD13 LEU A 38 12.295 -6.150 30.656 1.00 42.31 H new ATOM 0 HD21 LEU A 38 14.406 -5.724 32.857 1.00 61.20 H new ATOM 0 HD22 LEU A 38 14.788 -6.321 31.225 1.00 61.20 H new ATOM 0 HD23 LEU A 38 15.617 -4.881 31.863 1.00 61.20 H new ATOM 627 N CYS A 39 15.212 -1.566 28.007 1.00 44.33 N ATOM 628 CA CYS A 39 15.333 -0.998 26.669 1.00 21.22 C ATOM 629 C CYS A 39 16.708 -0.368 26.468 1.00 42.11 C ATOM 630 O CYS A 39 17.424 -0.702 25.523 1.00 42.22 O ATOM 631 CB CYS A 39 14.241 0.048 26.436 1.00 63.22 C ATOM 632 SG CYS A 39 12.581 -0.479 26.969 1.00 52.14 S ATOM 0 H CYS A 39 14.984 -0.888 28.734 1.00 44.33 H new ATOM 0 HA CYS A 39 15.214 -1.805 25.946 1.00 21.22 H new ATOM 0 HB2 CYS A 39 14.509 0.961 26.967 1.00 63.22 H new ATOM 0 HB3 CYS A 39 14.209 0.294 25.375 1.00 63.22 H new ATOM 637 N LEU A 40 17.071 0.545 27.362 1.00 20.34 N ATOM 638 CA LEU A 40 18.361 1.222 27.284 1.00 15.42 C ATOM 639 C LEU A 40 19.507 0.217 27.319 1.00 61.11 C ATOM 640 O LEU A 40 20.513 0.384 26.630 1.00 62.44 O ATOM 641 CB LEU A 40 18.506 2.219 28.436 1.00 71.24 C ATOM 642 CG LEU A 40 19.381 3.441 28.159 1.00 45.43 C ATOM 643 CD1 LEU A 40 18.539 4.593 27.632 1.00 2.13 C ATOM 644 CD2 LEU A 40 20.130 3.857 29.417 1.00 41.23 C ATOM 0 H LEU A 40 16.490 0.834 28.149 1.00 20.34 H new ATOM 0 HA LEU A 40 18.404 1.761 26.337 1.00 15.42 H new ATOM 0 HB2 LEU A 40 17.512 2.565 28.718 1.00 71.24 H new ATOM 0 HB3 LEU A 40 18.916 1.691 29.297 1.00 71.24 H new ATOM 0 HG LEU A 40 20.112 3.174 27.396 1.00 45.43 H new ATOM 0 HD11 LEU A 40 19.179 5.454 27.441 1.00 2.13 H new ATOM 0 HD12 LEU A 40 18.049 4.292 26.706 1.00 2.13 H new ATOM 0 HD13 LEU A 40 17.784 4.860 28.371 1.00 2.13 H new ATOM 0 HD21 LEU A 40 20.748 4.729 29.201 1.00 41.23 H new ATOM 0 HD22 LEU A 40 19.415 4.105 30.201 1.00 41.23 H new ATOM 0 HD23 LEU A 40 20.765 3.036 29.751 1.00 41.23 H new ATOM 656 N SER A 41 19.347 -0.828 28.125 1.00 72.04 N ATOM 657 CA SER A 41 20.369 -1.860 28.250 1.00 21.24 C ATOM 658 C SER A 41 20.366 -2.779 27.032 1.00 5.23 C ATOM 659 O SER A 41 21.359 -3.447 26.744 1.00 13.01 O ATOM 660 CB SER A 41 20.142 -2.680 29.522 1.00 24.01 C ATOM 661 OG SER A 41 20.204 -1.859 30.676 1.00 64.43 O ATOM 0 H SER A 41 18.519 -0.982 28.701 1.00 72.04 H new ATOM 0 HA SER A 41 21.340 -1.369 28.310 1.00 21.24 H new ATOM 0 HB2 SER A 41 19.170 -3.171 29.473 1.00 24.01 H new ATOM 0 HB3 SER A 41 20.894 -3.466 29.590 1.00 24.01 H new ATOM 0 HG SER A 41 19.308 -1.523 30.887 1.00 64.43 H new ATOM 667 N GLU A 42 19.243 -2.806 26.322 1.00 43.55 N ATOM 668 CA GLU A 42 19.111 -3.643 25.135 1.00 51.51 C ATOM 669 C GLU A 42 19.519 -2.876 23.880 1.00 14.10 C ATOM 670 O GLU A 42 19.474 -3.409 22.771 1.00 73.43 O ATOM 671 CB GLU A 42 17.672 -4.143 24.995 1.00 72.31 C ATOM 672 CG GLU A 42 17.436 -5.503 25.632 1.00 54.45 C ATOM 673 CD GLU A 42 16.425 -6.336 24.869 1.00 74.33 C ATOM 674 OE1 GLU A 42 15.706 -5.769 24.020 1.00 43.34 O ATOM 675 OE2 GLU A 42 16.352 -7.557 25.121 1.00 22.43 O ATOM 0 H GLU A 42 18.412 -2.259 26.547 1.00 43.55 H new ATOM 0 HA GLU A 42 19.776 -4.499 25.249 1.00 51.51 H new ATOM 0 HB2 GLU A 42 16.998 -3.417 25.449 1.00 72.31 H new ATOM 0 HB3 GLU A 42 17.416 -4.197 23.937 1.00 72.31 H new ATOM 0 HG2 GLU A 42 18.381 -6.044 25.686 1.00 54.45 H new ATOM 0 HG3 GLU A 42 17.089 -5.365 26.656 1.00 54.45 H new ATOM 682 N LEU A 43 19.916 -1.622 24.063 1.00 14.43 N ATOM 683 CA LEU A 43 20.331 -0.780 22.947 1.00 43.33 C ATOM 684 C LEU A 43 21.329 -1.512 22.055 1.00 41.41 C ATOM 685 O LEU A 43 21.229 -1.470 20.829 1.00 35.55 O ATOM 686 CB LEU A 43 20.951 0.520 23.465 1.00 75.51 C ATOM 687 CG LEU A 43 19.974 1.546 24.040 1.00 32.33 C ATOM 688 CD1 LEU A 43 20.723 2.621 24.813 1.00 74.51 C ATOM 689 CD2 LEU A 43 19.139 2.168 22.931 1.00 72.13 C ATOM 0 H LEU A 43 19.959 -1.166 24.974 1.00 14.43 H new ATOM 0 HA LEU A 43 19.447 -0.543 22.355 1.00 43.33 H new ATOM 0 HB2 LEU A 43 21.680 0.270 24.236 1.00 75.51 H new ATOM 0 HB3 LEU A 43 21.500 0.988 22.648 1.00 75.51 H new ATOM 0 HG LEU A 43 19.302 1.033 24.728 1.00 32.33 H new ATOM 0 HD11 LEU A 43 20.012 3.342 25.215 1.00 74.51 H new ATOM 0 HD12 LEU A 43 21.276 2.161 25.632 1.00 74.51 H new ATOM 0 HD13 LEU A 43 21.419 3.130 24.146 1.00 74.51 H new ATOM 0 HD21 LEU A 43 18.450 2.896 23.359 1.00 72.13 H new ATOM 0 HD22 LEU A 43 19.795 2.666 22.217 1.00 72.13 H new ATOM 0 HD23 LEU A 43 18.573 1.389 22.421 1.00 72.13 H new ATOM 701 N GLY A 44 22.292 -2.184 22.679 1.00 13.55 N ATOM 702 CA GLY A 44 23.293 -2.917 21.927 1.00 34.11 C ATOM 703 C GLY A 44 22.694 -4.047 21.114 1.00 75.40 C ATOM 704 O GLY A 44 23.082 -4.268 19.967 1.00 30.54 O ATOM 0 H GLY A 44 22.396 -2.234 23.692 1.00 13.55 H new ATOM 0 HA2 GLY A 44 23.816 -2.232 21.260 1.00 34.11 H new ATOM 0 HA3 GLY A 44 24.035 -3.322 22.615 1.00 34.11 H new ATOM 708 N GLN A 45 21.746 -4.765 21.709 1.00 25.23 N ATOM 709 CA GLN A 45 21.095 -5.881 21.033 1.00 41.54 C ATOM 710 C GLN A 45 20.547 -5.449 19.677 1.00 74.15 C ATOM 711 O GLN A 45 20.853 -6.055 18.649 1.00 35.31 O ATOM 712 CB GLN A 45 19.965 -6.440 21.899 1.00 61.15 C ATOM 713 CG GLN A 45 19.093 -7.456 21.179 1.00 70.04 C ATOM 714 CD GLN A 45 18.456 -8.454 22.126 1.00 65.13 C ATOM 715 OE1 GLN A 45 17.138 -8.382 22.264 1.00 24.13 O flip ATOM 716 NE2 GLN A 45 19.142 -9.281 22.727 1.00 52.14 N flip ATOM 0 H GLN A 45 21.412 -4.594 22.657 1.00 25.23 H new ATOM 0 HA GLN A 45 21.839 -6.661 20.872 1.00 41.54 H new ATOM 0 HB2 GLN A 45 20.394 -6.906 22.786 1.00 61.15 H new ATOM 0 HB3 GLN A 45 19.340 -5.616 22.243 1.00 61.15 H new ATOM 0 HG2 GLN A 45 18.311 -6.933 20.629 1.00 70.04 H new ATOM 0 HG3 GLN A 45 19.696 -7.991 20.445 1.00 70.04 H new ATOM 0 HE21 GLN A 45 20.153 -9.301 22.591 1.00 52.14 H new ATOM 0 HE22 GLN A 45 18.700 -9.946 23.361 1.00 52.14 H new ATOM 725 N THR A 46 19.733 -4.397 19.680 1.00 63.41 N ATOM 726 CA THR A 46 19.141 -3.886 18.451 1.00 54.42 C ATOM 727 C THR A 46 20.215 -3.420 17.475 1.00 40.41 C ATOM 728 O THR A 46 20.058 -3.543 16.261 1.00 44.03 O ATOM 729 CB THR A 46 18.179 -2.716 18.735 1.00 24.01 C ATOM 730 OG1 THR A 46 17.108 -3.156 19.576 1.00 34.35 O ATOM 731 CG2 THR A 46 17.615 -2.152 17.440 1.00 62.12 C ATOM 0 H THR A 46 19.469 -3.883 20.521 1.00 63.41 H new ATOM 0 HA THR A 46 18.581 -4.708 18.005 1.00 54.42 H new ATOM 0 HB THR A 46 18.738 -1.929 19.241 1.00 24.01 H new ATOM 0 HG1 THR A 46 16.502 -2.406 19.753 1.00 34.35 H new ATOM 0 HG21 THR A 46 16.939 -1.328 17.666 1.00 62.12 H new ATOM 0 HG22 THR A 46 18.431 -1.791 16.815 1.00 62.12 H new ATOM 0 HG23 THR A 46 17.070 -2.933 16.910 1.00 62.12 H new ATOM 739 N GLU A 47 21.306 -2.885 18.014 1.00 0.41 N ATOM 740 CA GLU A 47 22.406 -2.400 17.189 1.00 64.42 C ATOM 741 C GLU A 47 23.051 -3.546 16.414 1.00 31.43 C ATOM 742 O GLU A 47 23.526 -3.364 15.293 1.00 1.23 O ATOM 743 CB GLU A 47 23.456 -1.703 18.057 1.00 31.30 C ATOM 744 CG GLU A 47 24.795 -1.518 17.363 1.00 54.24 C ATOM 745 CD GLU A 47 25.381 -0.138 17.586 1.00 5.41 C ATOM 746 OE1 GLU A 47 26.099 0.046 18.592 1.00 35.42 O ATOM 747 OE2 GLU A 47 25.124 0.759 16.756 1.00 71.20 O ATOM 0 H GLU A 47 21.452 -2.777 19.018 1.00 0.41 H new ATOM 0 HA GLU A 47 22.001 -1.683 16.475 1.00 64.42 H new ATOM 0 HB2 GLU A 47 23.075 -0.727 18.359 1.00 31.30 H new ATOM 0 HB3 GLU A 47 23.605 -2.283 18.968 1.00 31.30 H new ATOM 0 HG2 GLU A 47 25.496 -2.269 17.727 1.00 54.24 H new ATOM 0 HG3 GLU A 47 24.672 -1.688 16.293 1.00 54.24 H new ATOM 754 N LYS A 48 23.064 -4.729 17.020 1.00 12.35 N ATOM 755 CA LYS A 48 23.648 -5.906 16.390 1.00 64.13 C ATOM 756 C LYS A 48 22.647 -6.576 15.455 1.00 71.25 C ATOM 757 O LYS A 48 23.003 -7.015 14.361 1.00 74.12 O ATOM 758 CB LYS A 48 24.114 -6.902 17.454 1.00 32.22 C ATOM 759 CG LYS A 48 25.056 -6.299 18.481 1.00 5.00 C ATOM 760 CD LYS A 48 26.478 -6.214 17.951 1.00 50.00 C ATOM 761 CE LYS A 48 27.194 -4.977 18.471 1.00 53.31 C ATOM 762 NZ LYS A 48 28.430 -4.684 17.695 1.00 43.14 N ATOM 0 H LYS A 48 22.676 -4.897 17.948 1.00 12.35 H new ATOM 0 HA LYS A 48 24.508 -5.583 15.802 1.00 64.13 H new ATOM 0 HB2 LYS A 48 23.242 -7.307 17.967 1.00 32.22 H new ATOM 0 HB3 LYS A 48 24.612 -7.738 16.963 1.00 32.22 H new ATOM 0 HG2 LYS A 48 24.708 -5.303 18.754 1.00 5.00 H new ATOM 0 HG3 LYS A 48 25.040 -6.902 19.389 1.00 5.00 H new ATOM 0 HD2 LYS A 48 27.031 -7.106 18.245 1.00 50.00 H new ATOM 0 HD3 LYS A 48 26.461 -6.194 16.861 1.00 50.00 H new ATOM 0 HE2 LYS A 48 26.522 -4.120 18.420 1.00 53.31 H new ATOM 0 HE3 LYS A 48 27.450 -5.120 19.521 1.00 53.31 H new ATOM 0 HZ1 LYS A 48 28.889 -3.834 18.081 1.00 43.14 H new ATOM 0 HZ2 LYS A 48 29.083 -5.491 17.764 1.00 43.14 H new ATOM 0 HZ3 LYS A 48 28.184 -4.522 16.698 1.00 43.14 H new ATOM 776 N TRP A 49 21.395 -6.650 15.891 1.00 11.02 N ATOM 777 CA TRP A 49 20.342 -7.265 15.091 1.00 33.44 C ATOM 778 C TRP A 49 20.165 -6.532 13.766 1.00 4.14 C ATOM 779 O TRP A 49 20.152 -7.149 12.702 1.00 73.30 O ATOM 780 CB TRP A 49 19.022 -7.270 15.865 1.00 24.43 C ATOM 781 CG TRP A 49 19.014 -8.228 17.018 1.00 33.12 C ATOM 782 CD1 TRP A 49 20.085 -8.899 17.535 1.00 44.51 C ATOM 783 CD2 TRP A 49 17.878 -8.623 17.796 1.00 61.05 C ATOM 784 NE1 TRP A 49 19.684 -9.687 18.587 1.00 44.53 N ATOM 785 CE2 TRP A 49 18.335 -9.535 18.767 1.00 1.33 C ATOM 786 CE3 TRP A 49 16.520 -8.294 17.767 1.00 43.22 C ATOM 787 CZ2 TRP A 49 17.481 -10.120 19.699 1.00 43.34 C ATOM 788 CZ3 TRP A 49 15.674 -8.876 18.692 1.00 42.44 C ATOM 789 CH2 TRP A 49 16.157 -9.779 19.647 1.00 31.53 C ATOM 0 H TRP A 49 21.084 -6.292 16.794 1.00 11.02 H new ATOM 0 HA TRP A 49 20.636 -8.293 14.879 1.00 33.44 H new ATOM 0 HB2 TRP A 49 18.822 -6.265 16.236 1.00 24.43 H new ATOM 0 HB3 TRP A 49 18.210 -7.525 15.184 1.00 24.43 H new ATOM 0 HD1 TRP A 49 21.099 -8.822 17.171 1.00 44.51 H new ATOM 0 HE1 TRP A 49 20.292 -10.288 19.143 1.00 44.53 H new ATOM 0 HE3 TRP A 49 16.139 -7.598 17.035 1.00 43.22 H new ATOM 0 HZ2 TRP A 49 17.851 -10.818 20.436 1.00 43.34 H new ATOM 0 HZ3 TRP A 49 14.622 -8.630 18.678 1.00 42.44 H new ATOM 0 HH2 TRP A 49 15.470 -10.215 20.357 1.00 31.53 H new ATOM 800 N ALA A 50 20.031 -5.212 13.839 1.00 1.30 N ATOM 801 CA ALA A 50 19.858 -4.395 12.644 1.00 1.45 C ATOM 802 C ALA A 50 21.039 -4.556 11.693 1.00 2.34 C ATOM 803 O ALA A 50 20.959 -4.184 10.523 1.00 65.41 O ATOM 804 CB ALA A 50 19.681 -2.932 13.026 1.00 31.52 C ATOM 0 H ALA A 50 20.039 -4.686 14.713 1.00 1.30 H new ATOM 0 HA ALA A 50 18.961 -4.736 12.128 1.00 1.45 H new ATOM 0 HB1 ALA A 50 19.553 -2.333 12.124 1.00 31.52 H new ATOM 0 HB2 ALA A 50 18.801 -2.825 13.660 1.00 31.52 H new ATOM 0 HB3 ALA A 50 20.562 -2.588 13.568 1.00 31.52 H new ATOM 810 N GLN A 51 22.133 -5.110 12.205 1.00 64.42 N ATOM 811 CA GLN A 51 23.331 -5.318 11.400 1.00 24.40 C ATOM 812 C GLN A 51 23.567 -6.804 11.149 1.00 62.11 C ATOM 813 O GLN A 51 24.491 -7.183 10.429 1.00 50.05 O ATOM 814 CB GLN A 51 24.550 -4.707 12.093 1.00 12.45 C ATOM 815 CG GLN A 51 24.478 -3.194 12.226 1.00 3.14 C ATOM 816 CD GLN A 51 25.128 -2.474 11.061 1.00 74.33 C ATOM 817 OE1 GLN A 51 24.640 -2.532 9.931 1.00 2.14 O ATOM 818 NE2 GLN A 51 26.234 -1.791 11.329 1.00 51.42 N ATOM 0 H GLN A 51 22.215 -5.423 13.172 1.00 64.42 H new ATOM 0 HA GLN A 51 23.182 -4.824 10.440 1.00 24.40 H new ATOM 0 HB2 GLN A 51 24.652 -5.146 13.085 1.00 12.45 H new ATOM 0 HB3 GLN A 51 25.447 -4.972 11.533 1.00 12.45 H new ATOM 0 HG2 GLN A 51 23.434 -2.889 12.300 1.00 3.14 H new ATOM 0 HG3 GLN A 51 24.965 -2.891 13.153 1.00 3.14 H new ATOM 0 HE21 GLN A 51 26.603 -1.770 12.280 1.00 51.42 H new ATOM 0 HE22 GLN A 51 26.715 -1.287 10.584 1.00 51.42 H new ATOM 827 N ASP A 52 22.727 -7.641 11.748 1.00 52.25 N ATOM 828 CA ASP A 52 22.843 -9.086 11.588 1.00 4.33 C ATOM 829 C ASP A 52 22.391 -9.517 10.197 1.00 73.31 C ATOM 830 O ASP A 52 21.250 -9.277 9.802 1.00 22.02 O ATOM 831 CB ASP A 52 22.016 -9.806 12.654 1.00 74.13 C ATOM 832 CG ASP A 52 22.662 -11.098 13.113 1.00 32.23 C ATOM 833 OD1 ASP A 52 22.554 -12.107 12.385 1.00 25.42 O ATOM 834 OD2 ASP A 52 23.276 -11.100 14.201 1.00 73.15 O ATOM 0 H ASP A 52 21.958 -7.344 12.349 1.00 52.25 H new ATOM 0 HA ASP A 52 23.892 -9.357 11.709 1.00 4.33 H new ATOM 0 HB2 ASP A 52 21.880 -9.147 13.511 1.00 74.13 H new ATOM 0 HB3 ASP A 52 21.024 -10.020 12.257 1.00 74.13 H new ATOM 839 N ALA A 53 23.293 -10.155 9.458 1.00 51.31 N ATOM 840 CA ALA A 53 22.986 -10.621 8.111 1.00 1.53 C ATOM 841 C ALA A 53 21.721 -11.472 8.100 1.00 40.02 C ATOM 842 O ALA A 53 20.943 -11.434 7.147 1.00 53.44 O ATOM 843 CB ALA A 53 24.159 -11.407 7.545 1.00 50.23 C ATOM 0 H ALA A 53 24.242 -10.361 9.769 1.00 51.31 H new ATOM 0 HA ALA A 53 22.810 -9.748 7.482 1.00 1.53 H new ATOM 0 HB1 ALA A 53 23.916 -11.749 6.539 1.00 50.23 H new ATOM 0 HB2 ALA A 53 25.041 -10.768 7.508 1.00 50.23 H new ATOM 0 HB3 ALA A 53 24.361 -12.268 8.182 1.00 50.23 H new ATOM 849 N LYS A 54 21.522 -12.241 9.165 1.00 75.13 N ATOM 850 CA LYS A 54 20.351 -13.102 9.278 1.00 34.54 C ATOM 851 C LYS A 54 19.070 -12.275 9.336 1.00 23.35 C ATOM 852 O LYS A 54 18.012 -12.718 8.889 1.00 63.32 O ATOM 853 CB LYS A 54 20.459 -13.983 10.526 1.00 54.34 C ATOM 854 CG LYS A 54 21.100 -15.334 10.263 1.00 63.04 C ATOM 855 CD LYS A 54 22.597 -15.301 10.523 1.00 50.32 C ATOM 856 CE LYS A 54 23.029 -16.436 11.438 1.00 10.02 C ATOM 857 NZ LYS A 54 24.490 -16.706 11.336 1.00 51.13 N ATOM 0 H LYS A 54 22.157 -12.286 9.962 1.00 75.13 H new ATOM 0 HA LYS A 54 20.312 -13.738 8.393 1.00 34.54 H new ATOM 0 HB2 LYS A 54 21.040 -13.456 11.283 1.00 54.34 H new ATOM 0 HB3 LYS A 54 19.462 -14.137 10.939 1.00 54.34 H new ATOM 0 HG2 LYS A 54 20.636 -16.088 10.899 1.00 63.04 H new ATOM 0 HG3 LYS A 54 20.916 -15.630 9.230 1.00 63.04 H new ATOM 0 HD2 LYS A 54 23.133 -15.371 9.577 1.00 50.32 H new ATOM 0 HD3 LYS A 54 22.868 -14.346 10.973 1.00 50.32 H new ATOM 0 HE2 LYS A 54 22.777 -16.187 12.469 1.00 10.02 H new ATOM 0 HE3 LYS A 54 22.474 -17.339 11.183 1.00 10.02 H new ATOM 0 HZ1 LYS A 54 24.744 -17.486 11.975 1.00 51.13 H new ATOM 0 HZ2 LYS A 54 24.727 -16.968 10.358 1.00 51.13 H new ATOM 0 HZ3 LYS A 54 25.020 -15.852 11.604 1.00 51.13 H new ATOM 871 N PHE A 55 19.174 -11.071 9.889 1.00 33.33 N ATOM 872 CA PHE A 55 18.024 -10.182 10.005 1.00 12.10 C ATOM 873 C PHE A 55 17.708 -9.524 8.665 1.00 71.10 C ATOM 874 O PHE A 55 16.660 -8.900 8.499 1.00 31.13 O ATOM 875 CB PHE A 55 18.287 -9.109 11.063 1.00 11.34 C ATOM 876 CG PHE A 55 17.611 -9.383 12.376 1.00 31.13 C ATOM 877 CD1 PHE A 55 16.240 -9.234 12.509 1.00 73.31 C ATOM 878 CD2 PHE A 55 18.346 -9.790 13.478 1.00 64.24 C ATOM 879 CE1 PHE A 55 15.615 -9.485 13.716 1.00 24.41 C ATOM 880 CE2 PHE A 55 17.728 -10.043 14.687 1.00 34.24 C ATOM 881 CZ PHE A 55 16.360 -9.892 14.806 1.00 0.53 C ATOM 0 H PHE A 55 20.042 -10.689 10.264 1.00 33.33 H new ATOM 0 HA PHE A 55 17.164 -10.779 10.309 1.00 12.10 H new ATOM 0 HB2 PHE A 55 19.362 -9.027 11.227 1.00 11.34 H new ATOM 0 HB3 PHE A 55 17.948 -8.145 10.683 1.00 11.34 H new ATOM 0 HD1 PHE A 55 15.653 -8.918 11.660 1.00 73.31 H new ATOM 0 HD2 PHE A 55 19.416 -9.911 13.390 1.00 64.24 H new ATOM 0 HE1 PHE A 55 14.546 -9.363 13.807 1.00 24.41 H new ATOM 0 HE2 PHE A 55 18.313 -10.358 15.538 1.00 34.24 H new ATOM 0 HZ PHE A 55 15.874 -10.092 15.749 1.00 0.53 H new ATOM 891 N SER A 56 18.623 -9.668 7.712 1.00 72.25 N ATOM 892 CA SER A 56 18.445 -9.085 6.387 1.00 11.20 C ATOM 893 C SER A 56 17.091 -9.472 5.800 1.00 61.40 C ATOM 894 O SER A 56 16.531 -8.752 4.973 1.00 24.23 O ATOM 895 CB SER A 56 19.568 -9.538 5.452 1.00 73.21 C ATOM 896 OG SER A 56 20.829 -9.084 5.911 1.00 12.43 O ATOM 0 H SER A 56 19.495 -10.183 7.832 1.00 72.25 H new ATOM 0 HA SER A 56 18.481 -8.000 6.487 1.00 11.20 H new ATOM 0 HB2 SER A 56 19.572 -10.626 5.385 1.00 73.21 H new ATOM 0 HB3 SER A 56 19.385 -9.157 4.447 1.00 73.21 H new ATOM 0 HG SER A 56 21.397 -9.854 6.121 1.00 12.43 H new ATOM 902 N SER A 57 16.571 -10.616 6.234 1.00 54.12 N ATOM 903 CA SER A 57 15.284 -11.103 5.749 1.00 3.22 C ATOM 904 C SER A 57 14.191 -10.061 5.970 1.00 63.44 C ATOM 905 O SER A 57 13.187 -10.039 5.259 1.00 62.55 O ATOM 906 CB SER A 57 14.911 -12.408 6.454 1.00 14.04 C ATOM 907 OG SER A 57 14.392 -13.354 5.535 1.00 13.35 O ATOM 0 H SER A 57 17.020 -11.223 6.920 1.00 54.12 H new ATOM 0 HA SER A 57 15.373 -11.289 4.679 1.00 3.22 H new ATOM 0 HB2 SER A 57 15.790 -12.822 6.949 1.00 14.04 H new ATOM 0 HB3 SER A 57 14.173 -12.207 7.230 1.00 14.04 H new ATOM 0 HG SER A 57 14.163 -14.180 6.010 1.00 13.35 H new ATOM 913 N ALA A 58 14.395 -9.200 6.961 1.00 40.33 N ATOM 914 CA ALA A 58 13.429 -8.154 7.275 1.00 60.33 C ATOM 915 C ALA A 58 14.096 -6.991 8.001 1.00 34.13 C ATOM 916 O ALA A 58 14.838 -7.191 8.961 1.00 3.35 O ATOM 917 CB ALA A 58 12.292 -8.721 8.112 1.00 2.45 C ATOM 0 H ALA A 58 15.220 -9.206 7.560 1.00 40.33 H new ATOM 0 HA ALA A 58 13.021 -7.776 6.338 1.00 60.33 H new ATOM 0 HB1 ALA A 58 11.578 -7.930 8.339 1.00 2.45 H new ATOM 0 HB2 ALA A 58 11.791 -9.513 7.556 1.00 2.45 H new ATOM 0 HB3 ALA A 58 12.692 -9.127 9.041 1.00 2.45 H new ATOM 923 N ASN A 59 13.826 -5.776 7.536 1.00 54.22 N ATOM 924 CA ASN A 59 14.401 -4.580 8.141 1.00 31.22 C ATOM 925 C ASN A 59 14.075 -4.514 9.630 1.00 12.31 C ATOM 926 O ASN A 59 13.047 -5.027 10.075 1.00 3.35 O ATOM 927 CB ASN A 59 13.880 -3.326 7.437 1.00 0.31 C ATOM 928 CG ASN A 59 13.933 -3.446 5.926 1.00 21.53 C ATOM 929 OD1 ASN A 59 14.945 -3.861 5.361 1.00 40.22 O ATOM 930 ND2 ASN A 59 12.840 -3.084 5.265 1.00 0.32 N ATOM 0 H ASN A 59 13.212 -5.593 6.742 1.00 54.22 H new ATOM 0 HA ASN A 59 15.484 -4.629 8.026 1.00 31.22 H new ATOM 0 HB2 ASN A 59 12.852 -3.139 7.748 1.00 0.31 H new ATOM 0 HB3 ASN A 59 14.470 -2.465 7.751 1.00 0.31 H new ATOM 0 HD21 ASN A 59 12.816 -3.144 4.247 1.00 0.32 H new ATOM 0 HD22 ASN A 59 12.024 -2.746 5.775 1.00 0.32 H new ATOM 937 N LEU A 60 14.955 -3.878 10.395 1.00 24.11 N ATOM 938 CA LEU A 60 14.762 -3.743 11.835 1.00 73.23 C ATOM 939 C LEU A 60 15.164 -2.351 12.310 1.00 14.31 C ATOM 940 O LEU A 60 16.304 -1.926 12.124 1.00 43.10 O ATOM 941 CB LEU A 60 15.574 -4.803 12.580 1.00 24.30 C ATOM 942 CG LEU A 60 15.072 -5.177 13.975 1.00 15.50 C ATOM 943 CD1 LEU A 60 15.815 -6.394 14.502 1.00 1.25 C ATOM 944 CD2 LEU A 60 15.224 -4.001 14.929 1.00 24.02 C ATOM 0 H LEU A 60 15.810 -3.447 10.042 1.00 24.11 H new ATOM 0 HA LEU A 60 13.703 -3.888 12.050 1.00 73.23 H new ATOM 0 HB2 LEU A 60 15.600 -5.707 11.971 1.00 24.30 H new ATOM 0 HB3 LEU A 60 16.601 -4.449 12.668 1.00 24.30 H new ATOM 0 HG LEU A 60 14.013 -5.427 13.904 1.00 15.50 H new ATOM 0 HD11 LEU A 60 15.444 -6.645 15.496 1.00 1.25 H new ATOM 0 HD12 LEU A 60 15.654 -7.238 13.831 1.00 1.25 H new ATOM 0 HD13 LEU A 60 16.881 -6.173 14.558 1.00 1.25 H new ATOM 0 HD21 LEU A 60 14.862 -4.285 15.917 1.00 24.02 H new ATOM 0 HD22 LEU A 60 16.275 -3.719 14.995 1.00 24.02 H new ATOM 0 HD23 LEU A 60 14.644 -3.155 14.559 1.00 24.02 H new ATOM 956 N ILE A 61 14.220 -1.646 12.926 1.00 62.30 N ATOM 957 CA ILE A 61 14.477 -0.303 13.431 1.00 64.40 C ATOM 958 C ILE A 61 13.655 -0.020 14.683 1.00 30.25 C ATOM 959 O ILE A 61 12.646 -0.678 14.939 1.00 14.34 O ATOM 960 CB ILE A 61 14.161 0.767 12.370 1.00 43.20 C ATOM 961 CG1 ILE A 61 12.654 0.836 12.116 1.00 20.51 C ATOM 962 CG2 ILE A 61 14.909 0.470 11.079 1.00 75.15 C ATOM 963 CD1 ILE A 61 12.262 1.866 11.081 1.00 53.04 C ATOM 0 H ILE A 61 13.271 -1.983 13.087 1.00 62.30 H new ATOM 0 HA ILE A 61 15.538 -0.256 13.678 1.00 64.40 H new ATOM 0 HB ILE A 61 14.492 1.736 12.743 1.00 43.20 H new ATOM 0 HG12 ILE A 61 12.303 -0.144 11.792 1.00 20.51 H new ATOM 0 HG13 ILE A 61 12.146 1.063 13.053 1.00 20.51 H new ATOM 0 HG21 ILE A 61 14.675 1.235 10.339 1.00 75.15 H new ATOM 0 HG22 ILE A 61 15.982 0.468 11.272 1.00 75.15 H new ATOM 0 HG23 ILE A 61 14.607 -0.506 10.700 1.00 75.15 H new ATOM 0 HD11 ILE A 61 11.180 1.859 10.953 1.00 53.04 H new ATOM 0 HD12 ILE A 61 12.582 2.854 11.412 1.00 53.04 H new ATOM 0 HD13 ILE A 61 12.742 1.628 10.131 1.00 53.04 H new ATOM 975 N THR A 62 14.092 0.965 15.462 1.00 62.11 N ATOM 976 CA THR A 62 13.397 1.337 16.688 1.00 72.45 C ATOM 977 C THR A 62 12.644 2.651 16.516 1.00 61.03 C ATOM 978 O THR A 62 12.658 3.250 15.440 1.00 33.12 O ATOM 979 CB THR A 62 14.375 1.469 17.870 1.00 33.12 C ATOM 980 OG1 THR A 62 15.066 2.721 17.797 1.00 54.01 O ATOM 981 CG2 THR A 62 15.381 0.328 17.871 1.00 71.03 C ATOM 0 H THR A 62 14.925 1.520 15.265 1.00 62.11 H new ATOM 0 HA THR A 62 12.686 0.540 16.903 1.00 72.45 H new ATOM 0 HB THR A 62 13.800 1.425 18.795 1.00 33.12 H new ATOM 0 HG1 THR A 62 15.770 2.667 17.118 1.00 54.01 H new ATOM 0 HG21 THR A 62 16.061 0.443 18.715 1.00 71.03 H new ATOM 0 HG22 THR A 62 14.854 -0.622 17.957 1.00 71.03 H new ATOM 0 HG23 THR A 62 15.950 0.344 16.942 1.00 71.03 H new ATOM 989 N VAL A 63 11.988 3.096 17.583 1.00 71.32 N ATOM 990 CA VAL A 63 11.231 4.341 17.550 1.00 15.23 C ATOM 991 C VAL A 63 11.158 4.976 18.934 1.00 12.34 C ATOM 992 O VAL A 63 10.861 4.305 19.922 1.00 72.32 O ATOM 993 CB VAL A 63 9.800 4.115 17.026 1.00 62.24 C ATOM 994 CG1 VAL A 63 9.054 3.132 17.915 1.00 1.44 C ATOM 995 CG2 VAL A 63 9.052 5.436 16.932 1.00 43.22 C ATOM 0 H VAL A 63 11.966 2.613 18.481 1.00 71.32 H new ATOM 0 HA VAL A 63 11.757 5.013 16.871 1.00 15.23 H new ATOM 0 HB VAL A 63 9.862 3.687 16.025 1.00 62.24 H new ATOM 0 HG11 VAL A 63 8.045 2.985 17.529 1.00 1.44 H new ATOM 0 HG12 VAL A 63 9.581 2.178 17.925 1.00 1.44 H new ATOM 0 HG13 VAL A 63 9.000 3.527 18.929 1.00 1.44 H new ATOM 0 HG21 VAL A 63 8.043 5.257 16.560 1.00 43.22 H new ATOM 0 HG22 VAL A 63 8.999 5.895 17.919 1.00 43.22 H new ATOM 0 HG23 VAL A 63 9.577 6.104 16.249 1.00 43.22 H new ATOM 1005 N ALA A 64 11.431 6.275 18.998 1.00 14.52 N ATOM 1006 CA ALA A 64 11.394 7.003 20.261 1.00 74.40 C ATOM 1007 C ALA A 64 10.301 8.066 20.250 1.00 1.51 C ATOM 1008 O ALA A 64 9.911 8.558 19.191 1.00 33.02 O ATOM 1009 CB ALA A 64 12.747 7.636 20.545 1.00 44.41 C ATOM 0 H ALA A 64 11.680 6.845 18.190 1.00 14.52 H new ATOM 0 HA ALA A 64 11.165 6.292 21.055 1.00 74.40 H new ATOM 0 HB1 ALA A 64 12.705 8.176 21.491 1.00 44.41 H new ATOM 0 HB2 ALA A 64 13.507 6.857 20.605 1.00 44.41 H new ATOM 0 HB3 ALA A 64 13.000 8.329 19.743 1.00 44.41 H new ATOM 1015 N SER A 65 9.811 8.417 21.435 1.00 41.12 N ATOM 1016 CA SER A 65 8.760 9.420 21.561 1.00 71.21 C ATOM 1017 C SER A 65 9.179 10.528 22.522 1.00 34.15 C ATOM 1018 O SER A 65 8.864 10.504 23.713 1.00 70.15 O ATOM 1019 CB SER A 65 7.462 8.771 22.047 1.00 64.25 C ATOM 1020 OG SER A 65 7.432 7.390 21.728 1.00 4.30 O ATOM 0 H SER A 65 10.125 8.022 22.321 1.00 41.12 H new ATOM 0 HA SER A 65 8.592 9.860 20.578 1.00 71.21 H new ATOM 0 HB2 SER A 65 7.368 8.901 23.125 1.00 64.25 H new ATOM 0 HB3 SER A 65 6.608 9.272 21.590 1.00 64.25 H new ATOM 0 HG SER A 65 6.594 6.998 22.050 1.00 4.30 H new ATOM 1026 N PRO A 66 9.906 11.524 21.995 1.00 21.14 N ATOM 1027 CA PRO A 66 10.384 12.661 22.788 1.00 32.43 C ATOM 1028 C PRO A 66 9.250 13.585 23.218 1.00 32.11 C ATOM 1029 O PRO A 66 8.568 14.177 22.383 1.00 74.44 O ATOM 1030 CB PRO A 66 11.332 13.387 21.831 1.00 2.02 C ATOM 1031 CG PRO A 66 10.852 13.018 20.470 1.00 44.21 C ATOM 1032 CD PRO A 66 10.318 11.617 20.585 1.00 51.43 C ATOM 0 HA PRO A 66 10.857 12.341 23.716 1.00 32.43 H new ATOM 0 HB2 PRO A 66 11.299 14.466 21.984 1.00 2.02 H new ATOM 0 HB3 PRO A 66 12.365 13.075 21.985 1.00 2.02 H new ATOM 0 HG2 PRO A 66 10.077 13.705 20.130 1.00 44.21 H new ATOM 0 HG3 PRO A 66 11.663 13.068 19.743 1.00 44.21 H new ATOM 0 HD2 PRO A 66 9.479 11.450 19.909 1.00 51.43 H new ATOM 0 HD3 PRO A 66 11.078 10.876 20.339 1.00 51.43 H new ATOM 1040 N GLY A 67 9.054 13.705 24.528 1.00 70.22 N ATOM 1041 CA GLY A 67 8.001 14.559 25.045 1.00 4.44 C ATOM 1042 C GLY A 67 6.697 13.814 25.248 1.00 0.44 C ATOM 1043 O GLY A 67 5.640 14.428 25.395 1.00 74.22 O ATOM 0 H GLY A 67 9.606 13.226 25.240 1.00 70.22 H new ATOM 0 HA2 GLY A 67 8.321 14.991 25.993 1.00 4.44 H new ATOM 0 HA3 GLY A 67 7.839 15.388 24.356 1.00 4.44 H new ATOM 1047 N PHE A 68 6.770 12.488 25.256 1.00 62.52 N ATOM 1048 CA PHE A 68 5.585 11.658 25.440 1.00 64.54 C ATOM 1049 C PHE A 68 5.747 10.738 26.647 1.00 41.33 C ATOM 1050 O PHE A 68 6.823 10.186 26.881 1.00 32.31 O ATOM 1051 CB PHE A 68 5.319 10.826 24.183 1.00 24.10 C ATOM 1052 CG PHE A 68 3.994 10.120 24.201 1.00 71.20 C ATOM 1053 CD1 PHE A 68 2.844 10.786 24.594 1.00 24.11 C ATOM 1054 CD2 PHE A 68 3.898 8.790 23.825 1.00 35.42 C ATOM 1055 CE1 PHE A 68 1.623 10.139 24.611 1.00 11.24 C ATOM 1056 CE2 PHE A 68 2.679 8.138 23.840 1.00 31.21 C ATOM 1057 CZ PHE A 68 1.540 8.813 24.235 1.00 44.01 C ATOM 0 H PHE A 68 7.637 11.964 25.137 1.00 62.52 H new ATOM 0 HA PHE A 68 4.735 12.317 25.619 1.00 64.54 H new ATOM 0 HB2 PHE A 68 5.363 11.477 23.310 1.00 24.10 H new ATOM 0 HB3 PHE A 68 6.113 10.088 24.071 1.00 24.10 H new ATOM 0 HD1 PHE A 68 2.903 11.823 24.890 1.00 24.11 H new ATOM 0 HD2 PHE A 68 4.785 8.257 23.517 1.00 35.42 H new ATOM 0 HE1 PHE A 68 0.734 10.670 24.918 1.00 11.24 H new ATOM 0 HE2 PHE A 68 2.617 7.101 23.543 1.00 31.21 H new ATOM 0 HZ PHE A 68 0.587 8.305 24.250 1.00 44.01 H new ATOM 1067 N LEU A 69 4.672 10.580 27.410 1.00 34.31 N ATOM 1068 CA LEU A 69 4.693 9.728 28.594 1.00 13.13 C ATOM 1069 C LEU A 69 5.681 10.258 29.629 1.00 72.14 C ATOM 1070 O LEU A 69 5.305 10.993 30.542 1.00 11.12 O ATOM 1071 CB LEU A 69 5.060 8.294 28.209 1.00 43.11 C ATOM 1072 CG LEU A 69 3.888 7.350 27.939 1.00 40.20 C ATOM 1073 CD1 LEU A 69 3.244 6.912 29.245 1.00 32.10 C ATOM 1074 CD2 LEU A 69 2.863 8.018 27.034 1.00 12.23 C ATOM 0 H LEU A 69 3.775 11.030 27.230 1.00 34.31 H new ATOM 0 HA LEU A 69 3.696 9.735 29.034 1.00 13.13 H new ATOM 0 HB2 LEU A 69 5.686 8.328 27.317 1.00 43.11 H new ATOM 0 HB3 LEU A 69 5.666 7.868 29.009 1.00 43.11 H new ATOM 0 HG LEU A 69 4.269 6.464 27.431 1.00 40.20 H new ATOM 0 HD11 LEU A 69 2.412 6.241 29.033 1.00 32.10 H new ATOM 0 HD12 LEU A 69 3.981 6.394 29.858 1.00 32.10 H new ATOM 0 HD13 LEU A 69 2.877 7.787 29.781 1.00 32.10 H new ATOM 0 HD21 LEU A 69 2.036 7.332 26.852 1.00 12.23 H new ATOM 0 HD22 LEU A 69 2.487 8.921 27.515 1.00 12.23 H new ATOM 0 HD23 LEU A 69 3.331 8.281 26.085 1.00 12.23 H new ATOM 1086 N HIS A 70 6.947 9.881 29.477 1.00 14.35 N ATOM 1087 CA HIS A 70 7.990 10.321 30.397 1.00 0.10 C ATOM 1088 C HIS A 70 9.344 10.378 29.695 1.00 14.54 C ATOM 1089 O HIS A 70 10.389 10.372 30.344 1.00 64.12 O ATOM 1090 CB HIS A 70 8.066 9.383 31.602 1.00 63.54 C ATOM 1091 CG HIS A 70 7.319 9.883 32.799 1.00 33.11 C ATOM 1092 ND1 HIS A 70 6.470 9.090 33.542 1.00 72.32 N ATOM 1093 CD2 HIS A 70 7.297 11.104 33.383 1.00 65.11 C ATOM 1094 CE1 HIS A 70 5.957 9.802 34.530 1.00 64.43 C ATOM 1095 NE2 HIS A 70 6.444 11.027 34.456 1.00 50.40 N ATOM 0 H HIS A 70 7.275 9.273 28.727 1.00 14.35 H new ATOM 0 HA HIS A 70 7.737 11.323 30.742 1.00 0.10 H new ATOM 0 HB2 HIS A 70 7.670 8.408 31.318 1.00 63.54 H new ATOM 0 HB3 HIS A 70 9.112 9.236 31.872 1.00 63.54 H new ATOM 0 HD2 HIS A 70 7.848 11.976 33.064 1.00 65.11 H new ATOM 0 HE1 HIS A 70 5.259 9.443 35.271 1.00 64.43 H new ATOM 0 HE2 HIS A 70 6.222 11.792 35.093 1.00 50.40 H new ATOM 1103 N GLU A 71 9.315 10.434 28.367 1.00 33.05 N ATOM 1104 CA GLU A 71 10.540 10.491 27.579 1.00 21.41 C ATOM 1105 C GLU A 71 11.079 11.917 27.512 1.00 35.12 C ATOM 1106 O GLU A 71 10.323 12.884 27.613 1.00 72.30 O ATOM 1107 CB GLU A 71 10.288 9.962 26.166 1.00 63.05 C ATOM 1108 CG GLU A 71 10.907 8.598 25.907 1.00 54.45 C ATOM 1109 CD GLU A 71 12.329 8.691 25.390 1.00 42.50 C ATOM 1110 OE1 GLU A 71 13.076 9.573 25.863 1.00 42.33 O ATOM 1111 OE2 GLU A 71 12.695 7.881 24.513 1.00 43.44 O ATOM 0 H GLU A 71 8.457 10.441 27.815 1.00 33.05 H new ATOM 0 HA GLU A 71 11.285 9.863 28.067 1.00 21.41 H new ATOM 0 HB2 GLU A 71 9.213 9.902 25.996 1.00 63.05 H new ATOM 0 HB3 GLU A 71 10.686 10.675 25.444 1.00 63.05 H new ATOM 0 HG2 GLU A 71 10.897 8.018 26.830 1.00 54.45 H new ATOM 0 HG3 GLU A 71 10.296 8.057 25.184 1.00 54.45 H new ATOM 1118 N LYS A 72 12.390 12.040 27.342 1.00 45.31 N ATOM 1119 CA LYS A 72 13.032 13.347 27.261 1.00 64.14 C ATOM 1120 C LYS A 72 12.354 14.222 26.211 1.00 0.04 C ATOM 1121 O LYS A 72 11.637 13.725 25.343 1.00 53.11 O ATOM 1122 CB LYS A 72 14.517 13.189 26.925 1.00 22.43 C ATOM 1123 CG LYS A 72 15.269 12.297 27.898 1.00 32.05 C ATOM 1124 CD LYS A 72 16.680 12.009 27.415 1.00 70.43 C ATOM 1125 CE LYS A 72 17.722 12.617 28.341 1.00 71.21 C ATOM 1126 NZ LYS A 72 18.219 11.631 29.340 1.00 35.05 N ATOM 0 H LYS A 72 13.030 11.250 27.257 1.00 45.31 H new ATOM 0 HA LYS A 72 12.935 13.832 28.232 1.00 64.14 H new ATOM 0 HB2 LYS A 72 14.612 12.777 25.920 1.00 22.43 H new ATOM 0 HB3 LYS A 72 14.985 14.173 26.912 1.00 22.43 H new ATOM 0 HG2 LYS A 72 15.309 12.777 28.876 1.00 32.05 H new ATOM 0 HG3 LYS A 72 14.729 11.359 28.025 1.00 32.05 H new ATOM 0 HD2 LYS A 72 16.831 10.931 27.353 1.00 70.43 H new ATOM 0 HD3 LYS A 72 16.809 12.407 26.409 1.00 70.43 H new ATOM 0 HE2 LYS A 72 18.559 12.989 27.751 1.00 71.21 H new ATOM 0 HE3 LYS A 72 17.291 13.474 28.859 1.00 71.21 H new ATOM 0 HZ1 LYS A 72 18.445 12.121 30.229 1.00 35.05 H new ATOM 0 HZ2 LYS A 72 17.485 10.916 29.516 1.00 35.05 H new ATOM 0 HZ3 LYS A 72 19.074 11.166 28.973 1.00 35.05 H new ATOM 1140 N LYS A 73 12.586 15.527 26.297 1.00 43.54 N ATOM 1141 CA LYS A 73 12.000 16.472 25.353 1.00 4.54 C ATOM 1142 C LYS A 73 12.853 16.583 24.093 1.00 10.14 C ATOM 1143 O LYS A 73 14.053 16.308 24.118 1.00 12.44 O ATOM 1144 CB LYS A 73 11.853 17.849 26.005 1.00 52.54 C ATOM 1145 CG LYS A 73 13.152 18.397 26.570 1.00 52.42 C ATOM 1146 CD LYS A 73 13.023 18.723 28.048 1.00 11.24 C ATOM 1147 CE LYS A 73 13.551 17.591 28.917 1.00 54.44 C ATOM 1148 NZ LYS A 73 14.100 18.092 30.207 1.00 11.01 N ATOM 0 H LYS A 73 13.176 15.955 27.011 1.00 43.54 H new ATOM 0 HA LYS A 73 11.014 16.102 25.071 1.00 4.54 H new ATOM 0 HB2 LYS A 73 11.463 18.551 25.268 1.00 52.54 H new ATOM 0 HB3 LYS A 73 11.116 17.786 26.806 1.00 52.54 H new ATOM 0 HG2 LYS A 73 13.949 17.668 26.426 1.00 52.42 H new ATOM 0 HG3 LYS A 73 13.438 19.295 26.022 1.00 52.42 H new ATOM 0 HD2 LYS A 73 13.571 19.639 28.269 1.00 11.24 H new ATOM 0 HD3 LYS A 73 11.977 18.912 28.290 1.00 11.24 H new ATOM 0 HE2 LYS A 73 12.748 16.881 29.115 1.00 54.44 H new ATOM 0 HE3 LYS A 73 14.328 17.051 28.377 1.00 54.44 H new ATOM 0 HZ1 LYS A 73 14.449 17.291 30.770 1.00 11.01 H new ATOM 0 HZ2 LYS A 73 14.883 18.750 30.019 1.00 11.01 H new ATOM 0 HZ3 LYS A 73 13.352 18.586 30.734 1.00 11.01 H new ATOM 1162 N ASP A 74 12.226 16.988 22.994 1.00 23.13 N ATOM 1163 CA ASP A 74 12.928 17.137 21.725 1.00 44.31 C ATOM 1164 C ASP A 74 14.204 17.954 21.903 1.00 44.34 C ATOM 1165 O ASP A 74 14.255 18.877 22.714 1.00 14.25 O ATOM 1166 CB ASP A 74 12.020 17.805 20.691 1.00 64.21 C ATOM 1167 CG ASP A 74 12.648 17.849 19.312 1.00 43.13 C ATOM 1168 OD1 ASP A 74 12.449 16.889 18.538 1.00 44.12 O ATOM 1169 OD2 ASP A 74 13.338 18.844 19.006 1.00 52.01 O ATOM 0 H ASP A 74 11.233 17.219 22.957 1.00 23.13 H new ATOM 0 HA ASP A 74 13.201 16.143 21.370 1.00 44.31 H new ATOM 0 HB2 ASP A 74 11.074 17.265 20.639 1.00 64.21 H new ATOM 0 HB3 ASP A 74 11.790 18.820 21.015 1.00 64.21 H new ATOM 1174 N GLY A 75 15.235 17.607 21.137 1.00 10.15 N ATOM 1175 CA GLY A 75 16.497 18.317 21.227 1.00 45.24 C ATOM 1176 C GLY A 75 17.445 17.692 22.231 1.00 14.15 C ATOM 1177 O GLY A 75 18.614 17.454 21.928 1.00 11.51 O ATOM 0 H GLY A 75 15.218 16.847 20.457 1.00 10.15 H new ATOM 0 HA2 GLY A 75 16.971 18.334 20.246 1.00 45.24 H new ATOM 0 HA3 GLY A 75 16.308 19.353 21.507 1.00 45.24 H new ATOM 1181 N ASP A 76 16.940 17.427 23.431 1.00 23.44 N ATOM 1182 CA ASP A 76 17.750 16.826 24.485 1.00 31.22 C ATOM 1183 C ASP A 76 17.946 15.334 24.236 1.00 64.25 C ATOM 1184 O ASP A 76 19.053 14.811 24.373 1.00 53.21 O ATOM 1185 CB ASP A 76 17.094 17.045 25.849 1.00 0.24 C ATOM 1186 CG ASP A 76 18.027 17.714 26.839 1.00 0.44 C ATOM 1187 OD1 ASP A 76 18.554 18.799 26.517 1.00 0.52 O ATOM 1188 OD2 ASP A 76 18.231 17.153 27.936 1.00 31.51 O ATOM 0 H ASP A 76 15.974 17.619 23.698 1.00 23.44 H new ATOM 0 HA ASP A 76 18.727 17.309 24.478 1.00 31.22 H new ATOM 0 HB2 ASP A 76 16.201 17.657 25.725 1.00 0.24 H new ATOM 0 HB3 ASP A 76 16.770 16.085 26.251 1.00 0.24 H new ATOM 1193 N PHE A 77 16.866 14.653 23.869 1.00 34.11 N ATOM 1194 CA PHE A 77 16.919 13.220 23.602 1.00 14.32 C ATOM 1195 C PHE A 77 17.932 12.909 22.505 1.00 21.50 C ATOM 1196 O PHE A 77 18.630 11.896 22.561 1.00 40.42 O ATOM 1197 CB PHE A 77 15.536 12.704 23.197 1.00 44.00 C ATOM 1198 CG PHE A 77 15.491 11.218 22.983 1.00 15.11 C ATOM 1199 CD1 PHE A 77 15.319 10.356 24.054 1.00 74.43 C ATOM 1200 CD2 PHE A 77 15.620 10.684 21.711 1.00 31.32 C ATOM 1201 CE1 PHE A 77 15.276 8.988 23.860 1.00 34.33 C ATOM 1202 CE2 PHE A 77 15.577 9.317 21.512 1.00 62.23 C ATOM 1203 CZ PHE A 77 15.406 8.468 22.588 1.00 61.34 C ATOM 0 H PHE A 77 15.943 15.070 23.750 1.00 34.11 H new ATOM 0 HA PHE A 77 17.234 12.716 24.516 1.00 14.32 H new ATOM 0 HB2 PHE A 77 14.816 12.974 23.969 1.00 44.00 H new ATOM 0 HB3 PHE A 77 15.224 13.205 22.281 1.00 44.00 H new ATOM 0 HD1 PHE A 77 15.217 10.757 25.052 1.00 74.43 H new ATOM 0 HD2 PHE A 77 15.756 11.343 20.866 1.00 31.32 H new ATOM 0 HE1 PHE A 77 15.141 8.327 24.703 1.00 34.33 H new ATOM 0 HE2 PHE A 77 15.677 8.913 20.516 1.00 62.23 H new ATOM 0 HZ PHE A 77 15.374 7.399 22.434 1.00 61.34 H new ATOM 1213 N GLN A 78 18.006 13.786 21.509 1.00 34.51 N ATOM 1214 CA GLN A 78 18.932 13.603 20.398 1.00 4.33 C ATOM 1215 C GLN A 78 20.377 13.753 20.864 1.00 12.33 C ATOM 1216 O GLN A 78 21.217 12.891 20.606 1.00 34.33 O ATOM 1217 CB GLN A 78 18.635 14.612 19.288 1.00 41.34 C ATOM 1218 CG GLN A 78 17.499 14.190 18.370 1.00 62.31 C ATOM 1219 CD GLN A 78 16.139 14.605 18.896 1.00 61.45 C ATOM 1220 OE1 GLN A 78 16.009 15.036 20.041 1.00 12.14 O ATOM 1221 NE2 GLN A 78 15.116 14.476 18.058 1.00 3.25 N ATOM 0 H GLN A 78 17.436 14.630 21.449 1.00 34.51 H new ATOM 0 HA GLN A 78 18.798 12.594 20.008 1.00 4.33 H new ATOM 0 HB2 GLN A 78 18.389 15.573 19.739 1.00 41.34 H new ATOM 0 HB3 GLN A 78 19.536 14.760 18.693 1.00 41.34 H new ATOM 0 HG2 GLN A 78 17.652 14.628 17.384 1.00 62.31 H new ATOM 0 HG3 GLN A 78 17.521 13.107 18.245 1.00 62.31 H new ATOM 0 HE21 GLN A 78 15.270 14.114 17.117 1.00 3.25 H new ATOM 0 HE22 GLN A 78 14.177 14.739 18.356 1.00 3.25 H new ATOM 1230 N LYS A 79 20.660 14.854 21.552 1.00 1.30 N ATOM 1231 CA LYS A 79 22.003 15.118 22.056 1.00 52.24 C ATOM 1232 C LYS A 79 22.383 14.117 23.142 1.00 12.52 C ATOM 1233 O LYS A 79 23.564 13.859 23.375 1.00 14.03 O ATOM 1234 CB LYS A 79 22.092 16.543 22.606 1.00 3.30 C ATOM 1235 CG LYS A 79 21.778 16.644 24.089 1.00 70.43 C ATOM 1236 CD LYS A 79 21.246 18.019 24.454 1.00 11.11 C ATOM 1237 CE LYS A 79 22.356 19.059 24.473 1.00 13.04 C ATOM 1238 NZ LYS A 79 21.897 20.348 25.061 1.00 45.40 N ATOM 0 H LYS A 79 19.977 15.578 21.774 1.00 1.30 H new ATOM 0 HA LYS A 79 22.703 15.011 21.227 1.00 52.24 H new ATOM 0 HB2 LYS A 79 23.095 16.930 22.429 1.00 3.30 H new ATOM 0 HB3 LYS A 79 21.402 17.181 22.053 1.00 3.30 H new ATOM 0 HG2 LYS A 79 21.043 15.885 24.359 1.00 70.43 H new ATOM 0 HG3 LYS A 79 22.678 16.436 24.667 1.00 70.43 H new ATOM 0 HD2 LYS A 79 20.480 18.316 23.738 1.00 11.11 H new ATOM 0 HD3 LYS A 79 20.768 17.977 25.433 1.00 11.11 H new ATOM 0 HE2 LYS A 79 23.201 18.678 25.047 1.00 13.04 H new ATOM 0 HE3 LYS A 79 22.712 19.229 23.457 1.00 13.04 H new ATOM 0 HZ1 LYS A 79 22.682 21.031 25.056 1.00 45.40 H new ATOM 0 HZ2 LYS A 79 21.107 20.724 24.499 1.00 45.40 H new ATOM 0 HZ3 LYS A 79 21.581 20.190 26.039 1.00 45.40 H new ATOM 1252 N TRP A 80 21.376 13.557 23.802 1.00 13.11 N ATOM 1253 CA TRP A 80 21.605 12.583 24.863 1.00 3.11 C ATOM 1254 C TRP A 80 21.847 11.194 24.284 1.00 74.43 C ATOM 1255 O TRP A 80 22.736 10.470 24.732 1.00 63.14 O ATOM 1256 CB TRP A 80 20.413 12.550 25.820 1.00 15.01 C ATOM 1257 CG TRP A 80 20.311 11.273 26.599 1.00 40.51 C ATOM 1258 CD1 TRP A 80 20.867 11.011 27.818 1.00 24.12 C ATOM 1259 CD2 TRP A 80 19.612 10.086 26.210 1.00 22.23 C ATOM 1260 NE1 TRP A 80 20.557 9.731 28.211 1.00 54.40 N ATOM 1261 CE2 TRP A 80 19.787 9.143 27.243 1.00 52.34 C ATOM 1262 CE3 TRP A 80 18.854 9.727 25.092 1.00 5.53 C ATOM 1263 CZ2 TRP A 80 19.232 7.868 27.187 1.00 71.52 C ATOM 1264 CZ3 TRP A 80 18.305 8.461 25.038 1.00 33.23 C ATOM 1265 CH2 TRP A 80 18.495 7.543 26.080 1.00 12.53 C ATOM 0 H TRP A 80 20.393 13.761 23.621 1.00 13.11 H new ATOM 0 HA TRP A 80 22.495 12.886 25.414 1.00 3.11 H new ATOM 0 HB2 TRP A 80 20.491 13.386 26.515 1.00 15.01 H new ATOM 0 HB3 TRP A 80 19.495 12.694 25.250 1.00 15.01 H new ATOM 0 HD1 TRP A 80 21.463 11.707 28.390 1.00 24.12 H new ATOM 0 HE1 TRP A 80 20.852 9.290 29.082 1.00 54.40 H new ATOM 0 HE3 TRP A 80 18.700 10.427 24.284 1.00 5.53 H new ATOM 0 HZ2 TRP A 80 19.378 7.160 27.989 1.00 71.52 H new ATOM 0 HZ3 TRP A 80 17.719 8.173 24.178 1.00 33.23 H new ATOM 0 HH2 TRP A 80 18.052 6.561 26.008 1.00 12.53 H new ATOM 1276 N TYR A 81 21.050 10.827 23.286 1.00 31.11 N ATOM 1277 CA TYR A 81 21.176 9.522 22.647 1.00 42.50 C ATOM 1278 C TYR A 81 22.416 9.468 21.760 1.00 42.32 C ATOM 1279 O TYR A 81 23.065 8.429 21.643 1.00 33.04 O ATOM 1280 CB TYR A 81 19.928 9.215 21.818 1.00 63.52 C ATOM 1281 CG TYR A 81 20.193 8.302 20.641 1.00 11.15 C ATOM 1282 CD1 TYR A 81 20.346 6.933 20.820 1.00 31.43 C ATOM 1283 CD2 TYR A 81 20.291 8.809 19.352 1.00 51.23 C ATOM 1284 CE1 TYR A 81 20.588 6.095 19.749 1.00 45.02 C ATOM 1285 CE2 TYR A 81 20.532 7.979 18.274 1.00 13.02 C ATOM 1286 CZ TYR A 81 20.680 6.623 18.478 1.00 70.12 C ATOM 1287 OH TYR A 81 20.921 5.793 17.407 1.00 25.22 O ATOM 0 H TYR A 81 20.310 11.415 22.902 1.00 31.11 H new ATOM 0 HA TYR A 81 21.278 8.770 23.429 1.00 42.50 H new ATOM 0 HB2 TYR A 81 19.178 8.756 22.462 1.00 63.52 H new ATOM 0 HB3 TYR A 81 19.505 10.151 21.453 1.00 63.52 H new ATOM 0 HD1 TYR A 81 20.274 6.517 21.814 1.00 31.43 H new ATOM 0 HD2 TYR A 81 20.177 9.871 19.189 1.00 51.23 H new ATOM 0 HE1 TYR A 81 20.704 5.033 19.906 1.00 45.02 H new ATOM 0 HE2 TYR A 81 20.604 8.390 17.278 1.00 13.02 H new ATOM 0 HH TYR A 81 20.070 5.533 16.997 1.00 25.22 H new ATOM 1297 N ALA A 82 22.739 10.597 21.136 1.00 24.45 N ATOM 1298 CA ALA A 82 23.902 10.680 20.262 1.00 65.02 C ATOM 1299 C ALA A 82 25.198 10.560 21.058 1.00 74.03 C ATOM 1300 O ALA A 82 26.278 10.416 20.486 1.00 13.45 O ATOM 1301 CB ALA A 82 23.881 11.984 19.478 1.00 21.02 C ATOM 0 H ALA A 82 22.211 11.466 21.220 1.00 24.45 H new ATOM 0 HA ALA A 82 23.859 9.846 19.561 1.00 65.02 H new ATOM 0 HB1 ALA A 82 24.756 12.033 18.829 1.00 21.02 H new ATOM 0 HB2 ALA A 82 22.976 12.029 18.872 1.00 21.02 H new ATOM 0 HB3 ALA A 82 23.896 12.825 20.171 1.00 21.02 H new ATOM 1307 N GLY A 83 25.082 10.621 22.381 1.00 73.40 N ATOM 1308 CA GLY A 83 26.252 10.518 23.234 1.00 74.14 C ATOM 1309 C GLY A 83 26.250 9.254 24.070 1.00 62.30 C ATOM 1310 O GLY A 83 26.784 9.234 25.180 1.00 14.21 O ATOM 0 H GLY A 83 24.199 10.740 22.877 1.00 73.40 H new ATOM 0 HA2 GLY A 83 27.151 10.541 22.617 1.00 74.14 H new ATOM 0 HA3 GLY A 83 26.295 11.385 23.893 1.00 74.14 H new ATOM 1314 N LEU A 84 25.648 8.195 23.539 1.00 44.45 N ATOM 1315 CA LEU A 84 25.578 6.921 24.244 1.00 21.43 C ATOM 1316 C LEU A 84 26.695 5.985 23.792 1.00 10.41 C ATOM 1317 O LEU A 84 27.772 5.956 24.386 1.00 34.25 O ATOM 1318 CB LEU A 84 24.218 6.260 24.010 1.00 3.14 C ATOM 1319 CG LEU A 84 23.033 6.883 24.749 1.00 4.23 C ATOM 1320 CD1 LEU A 84 21.720 6.362 24.188 1.00 70.34 C ATOM 1321 CD2 LEU A 84 23.127 6.600 26.242 1.00 41.54 C ATOM 0 H LEU A 84 25.201 8.194 22.622 1.00 44.45 H new ATOM 0 HA LEU A 84 25.702 7.117 25.309 1.00 21.43 H new ATOM 0 HB2 LEU A 84 24.005 6.281 22.941 1.00 3.14 H new ATOM 0 HB3 LEU A 84 24.291 5.212 24.300 1.00 3.14 H new ATOM 0 HG LEU A 84 23.064 7.962 24.601 1.00 4.23 H new ATOM 0 HD11 LEU A 84 20.888 6.817 24.726 1.00 70.34 H new ATOM 0 HD12 LEU A 84 21.650 6.616 23.130 1.00 70.34 H new ATOM 0 HD13 LEU A 84 21.679 5.279 24.304 1.00 70.34 H new ATOM 0 HD21 LEU A 84 22.276 7.051 26.752 1.00 41.54 H new ATOM 0 HD22 LEU A 84 23.122 5.523 26.409 1.00 41.54 H new ATOM 0 HD23 LEU A 84 24.051 7.023 26.635 1.00 41.54 H new ATOM 1333 N ASN A 85 26.431 5.224 22.735 1.00 51.40 N ATOM 1334 CA ASN A 85 27.415 4.289 22.202 1.00 53.25 C ATOM 1335 C ASN A 85 26.808 3.436 21.092 1.00 42.15 C ATOM 1336 O ASN A 85 27.170 2.271 20.922 1.00 53.55 O ATOM 1337 CB ASN A 85 27.951 3.389 23.317 1.00 54.23 C ATOM 1338 CG ASN A 85 29.459 3.467 23.448 1.00 45.04 C ATOM 1339 OD1 ASN A 85 29.983 4.134 24.341 1.00 73.44 O ATOM 1340 ND2 ASN A 85 30.167 2.784 22.555 1.00 74.11 N ATOM 0 H ASN A 85 25.544 5.236 22.231 1.00 51.40 H new ATOM 0 HA ASN A 85 28.239 4.867 21.783 1.00 53.25 H new ATOM 0 HB2 ASN A 85 27.492 3.675 24.263 1.00 54.23 H new ATOM 0 HB3 ASN A 85 27.659 2.358 23.120 1.00 54.23 H new ATOM 0 HD21 ASN A 85 31.186 2.799 22.593 1.00 74.11 H new ATOM 0 HD22 ASN A 85 29.691 2.244 21.832 1.00 74.11 H new ATOM 1347 N TYR A 86 25.885 4.024 20.339 1.00 42.04 N ATOM 1348 CA TYR A 86 25.227 3.318 19.246 1.00 70.02 C ATOM 1349 C TYR A 86 24.983 4.251 18.063 1.00 31.44 C ATOM 1350 O TYR A 86 23.854 4.650 17.777 1.00 0.14 O ATOM 1351 CB TYR A 86 23.901 2.722 19.721 1.00 22.54 C ATOM 1352 CG TYR A 86 23.963 2.146 21.118 1.00 34.12 C ATOM 1353 CD1 TYR A 86 24.431 0.857 21.340 1.00 70.21 C ATOM 1354 CD2 TYR A 86 23.553 2.892 22.217 1.00 71.14 C ATOM 1355 CE1 TYR A 86 24.488 0.327 22.614 1.00 30.23 C ATOM 1356 CE2 TYR A 86 23.608 2.371 23.495 1.00 72.42 C ATOM 1357 CZ TYR A 86 24.076 1.088 23.688 1.00 34.54 C ATOM 1358 OH TYR A 86 24.132 0.564 24.960 1.00 62.34 O ATOM 0 H TYR A 86 25.576 4.988 20.465 1.00 42.04 H new ATOM 0 HA TYR A 86 25.884 2.512 18.920 1.00 70.02 H new ATOM 0 HB2 TYR A 86 23.133 3.495 19.689 1.00 22.54 H new ATOM 0 HB3 TYR A 86 23.595 1.939 19.027 1.00 22.54 H new ATOM 0 HD1 TYR A 86 24.756 0.259 20.502 1.00 70.21 H new ATOM 0 HD2 TYR A 86 23.185 3.897 22.069 1.00 71.14 H new ATOM 0 HE1 TYR A 86 24.853 -0.678 22.768 1.00 30.23 H new ATOM 0 HE2 TYR A 86 23.287 2.965 24.338 1.00 72.42 H new ATOM 0 HH TYR A 86 23.807 1.229 25.602 1.00 62.34 H new ATOM 1368 N PRO A 87 26.067 4.606 17.358 1.00 0.11 N ATOM 1369 CA PRO A 87 25.998 5.495 16.194 1.00 32.42 C ATOM 1370 C PRO A 87 25.317 4.834 15.000 1.00 10.23 C ATOM 1371 O PRO A 87 25.030 5.487 13.996 1.00 23.34 O ATOM 1372 CB PRO A 87 27.468 5.782 15.880 1.00 40.24 C ATOM 1373 CG PRO A 87 28.208 4.610 16.426 1.00 44.44 C ATOM 1374 CD PRO A 87 27.444 4.168 17.642 1.00 33.42 C ATOM 0 HA PRO A 87 25.409 6.389 16.398 1.00 32.42 H new ATOM 0 HB2 PRO A 87 27.630 5.888 14.807 1.00 40.24 H new ATOM 0 HB3 PRO A 87 27.798 6.711 16.346 1.00 40.24 H new ATOM 0 HG2 PRO A 87 28.267 3.808 15.690 1.00 44.44 H new ATOM 0 HG3 PRO A 87 29.231 4.881 16.685 1.00 44.44 H new ATOM 0 HD2 PRO A 87 27.501 3.089 17.782 1.00 33.42 H new ATOM 0 HD3 PRO A 87 27.833 4.629 18.550 1.00 33.42 H new ATOM 1382 N LYS A 88 25.060 3.536 15.116 1.00 72.34 N ATOM 1383 CA LYS A 88 24.411 2.786 14.047 1.00 73.03 C ATOM 1384 C LYS A 88 23.098 2.177 14.529 1.00 70.01 C ATOM 1385 O LYS A 88 22.714 1.087 14.103 1.00 71.13 O ATOM 1386 CB LYS A 88 25.339 1.683 13.533 1.00 32.22 C ATOM 1387 CG LYS A 88 26.338 2.163 12.494 1.00 34.25 C ATOM 1388 CD LYS A 88 25.724 2.197 11.105 1.00 51.51 C ATOM 1389 CE LYS A 88 25.862 3.572 10.469 1.00 51.22 C ATOM 1390 NZ LYS A 88 25.572 3.539 9.009 1.00 51.35 N ATOM 0 H LYS A 88 25.291 2.981 15.940 1.00 72.34 H new ATOM 0 HA LYS A 88 24.193 3.477 13.233 1.00 73.03 H new ATOM 0 HB2 LYS A 88 25.882 1.254 14.376 1.00 32.22 H new ATOM 0 HB3 LYS A 88 24.736 0.884 13.103 1.00 32.22 H new ATOM 0 HG2 LYS A 88 26.692 3.159 12.761 1.00 34.25 H new ATOM 0 HG3 LYS A 88 27.207 1.505 12.493 1.00 34.25 H new ATOM 0 HD2 LYS A 88 26.208 1.452 10.473 1.00 51.51 H new ATOM 0 HD3 LYS A 88 24.670 1.927 11.165 1.00 51.51 H new ATOM 0 HE2 LYS A 88 25.182 4.269 10.959 1.00 51.22 H new ATOM 0 HE3 LYS A 88 26.873 3.947 10.630 1.00 51.22 H new ATOM 0 HZ1 LYS A 88 25.677 4.495 8.613 1.00 51.35 H new ATOM 0 HZ2 LYS A 88 26.237 2.894 8.537 1.00 51.35 H new ATOM 0 HZ3 LYS A 88 24.599 3.205 8.856 1.00 51.35 H new ATOM 1404 N LEU A 89 22.413 2.887 15.418 1.00 0.32 N ATOM 1405 CA LEU A 89 21.142 2.417 15.957 1.00 14.33 C ATOM 1406 C LEU A 89 19.975 3.195 15.357 1.00 32.10 C ATOM 1407 O LEU A 89 19.802 4.389 15.601 1.00 51.33 O ATOM 1408 CB LEU A 89 21.130 2.553 17.481 1.00 52.11 C ATOM 1409 CG LEU A 89 20.276 1.536 18.239 1.00 63.41 C ATOM 1410 CD1 LEU A 89 18.799 1.761 17.955 1.00 23.11 C ATOM 1411 CD2 LEU A 89 20.682 0.117 17.867 1.00 23.24 C ATOM 0 H LEU A 89 22.716 3.791 15.781 1.00 0.32 H new ATOM 0 HA LEU A 89 21.029 1.366 15.691 1.00 14.33 H new ATOM 0 HB2 LEU A 89 22.156 2.476 17.841 1.00 52.11 H new ATOM 0 HB3 LEU A 89 20.778 3.553 17.734 1.00 52.11 H new ATOM 0 HG LEU A 89 20.444 1.673 19.307 1.00 63.41 H new ATOM 0 HD11 LEU A 89 18.207 1.028 18.503 1.00 23.11 H new ATOM 0 HD12 LEU A 89 18.516 2.765 18.271 1.00 23.11 H new ATOM 0 HD13 LEU A 89 18.613 1.652 16.887 1.00 23.11 H new ATOM 0 HD21 LEU A 89 20.064 -0.594 18.416 1.00 23.24 H new ATOM 0 HD22 LEU A 89 20.543 -0.032 16.796 1.00 23.24 H new ATOM 0 HD23 LEU A 89 21.730 -0.040 18.122 1.00 23.24 H new ATOM 1423 N PRO A 90 19.153 2.503 14.555 1.00 75.25 N ATOM 1424 CA PRO A 90 17.986 3.108 13.905 1.00 31.21 C ATOM 1425 C PRO A 90 16.883 3.454 14.900 1.00 61.32 C ATOM 1426 O PRO A 90 16.292 2.569 15.520 1.00 44.15 O ATOM 1427 CB PRO A 90 17.513 2.018 12.940 1.00 53.34 C ATOM 1428 CG PRO A 90 18.000 0.744 13.538 1.00 15.04 C ATOM 1429 CD PRO A 90 19.298 1.076 14.220 1.00 41.22 C ATOM 0 HA PRO A 90 18.234 4.050 13.417 1.00 31.21 H new ATOM 0 HB2 PRO A 90 16.427 2.020 12.842 1.00 53.34 H new ATOM 0 HB3 PRO A 90 17.923 2.169 11.941 1.00 53.34 H new ATOM 0 HG2 PRO A 90 17.277 0.345 14.249 1.00 15.04 H new ATOM 0 HG3 PRO A 90 18.146 -0.017 12.771 1.00 15.04 H new ATOM 0 HD2 PRO A 90 19.450 0.468 15.111 1.00 41.22 H new ATOM 0 HD3 PRO A 90 20.152 0.902 13.565 1.00 41.22 H new ATOM 1437 N VAL A 91 16.610 4.746 15.048 1.00 52.14 N ATOM 1438 CA VAL A 91 15.576 5.209 15.966 1.00 24.23 C ATOM 1439 C VAL A 91 14.678 6.248 15.305 1.00 44.22 C ATOM 1440 O VAL A 91 15.137 7.322 14.913 1.00 32.51 O ATOM 1441 CB VAL A 91 16.190 5.814 17.243 1.00 42.44 C ATOM 1442 CG1 VAL A 91 15.097 6.309 18.178 1.00 45.11 C ATOM 1443 CG2 VAL A 91 17.080 4.797 17.940 1.00 70.50 C ATOM 0 H VAL A 91 17.091 5.491 14.544 1.00 52.14 H new ATOM 0 HA VAL A 91 14.979 4.338 16.236 1.00 24.23 H new ATOM 0 HB VAL A 91 16.806 6.667 16.960 1.00 42.44 H new ATOM 0 HG11 VAL A 91 15.549 6.733 19.074 1.00 45.11 H new ATOM 0 HG12 VAL A 91 14.506 7.073 17.674 1.00 45.11 H new ATOM 0 HG13 VAL A 91 14.452 5.476 18.457 1.00 45.11 H new ATOM 0 HG21 VAL A 91 17.505 5.242 18.840 1.00 70.50 H new ATOM 0 HG22 VAL A 91 16.489 3.922 18.212 1.00 70.50 H new ATOM 0 HG23 VAL A 91 17.885 4.497 17.269 1.00 70.50 H new ATOM 1453 N VAL A 92 13.395 5.923 15.184 1.00 63.44 N ATOM 1454 CA VAL A 92 12.431 6.829 14.571 1.00 62.41 C ATOM 1455 C VAL A 92 11.842 7.783 15.603 1.00 53.52 C ATOM 1456 O VAL A 92 11.145 7.364 16.527 1.00 34.13 O ATOM 1457 CB VAL A 92 11.286 6.054 13.891 1.00 5.03 C ATOM 1458 CG1 VAL A 92 10.347 7.011 13.174 1.00 74.34 C ATOM 1459 CG2 VAL A 92 11.844 5.018 12.927 1.00 32.43 C ATOM 0 H VAL A 92 12.999 5.039 15.503 1.00 63.44 H new ATOM 0 HA VAL A 92 12.970 7.402 13.816 1.00 62.41 H new ATOM 0 HB VAL A 92 10.716 5.532 14.659 1.00 5.03 H new ATOM 0 HG11 VAL A 92 9.545 6.446 12.700 1.00 74.34 H new ATOM 0 HG12 VAL A 92 9.922 7.711 13.893 1.00 74.34 H new ATOM 0 HG13 VAL A 92 10.900 7.563 12.414 1.00 74.34 H new ATOM 0 HG21 VAL A 92 11.022 4.480 12.455 1.00 32.43 H new ATOM 0 HG22 VAL A 92 12.438 5.516 12.161 1.00 32.43 H new ATOM 0 HG23 VAL A 92 12.473 4.314 13.473 1.00 32.43 H new ATOM 1469 N THR A 93 12.125 9.072 15.439 1.00 24.00 N ATOM 1470 CA THR A 93 11.624 10.088 16.356 1.00 22.42 C ATOM 1471 C THR A 93 10.117 10.263 16.212 1.00 32.32 C ATOM 1472 O THR A 93 9.575 10.179 15.110 1.00 41.43 O ATOM 1473 CB THR A 93 12.312 11.446 16.121 1.00 21.41 C ATOM 1474 OG1 THR A 93 12.067 11.894 14.784 1.00 53.04 O ATOM 1475 CG2 THR A 93 13.811 11.341 16.359 1.00 11.45 C ATOM 0 H THR A 93 12.699 9.437 14.679 1.00 24.00 H new ATOM 0 HA THR A 93 11.852 9.743 17.365 1.00 22.42 H new ATOM 0 HB THR A 93 11.897 12.166 16.827 1.00 21.41 H new ATOM 0 HG1 THR A 93 12.506 12.759 14.643 1.00 53.04 H new ATOM 0 HG21 THR A 93 14.276 12.312 16.187 1.00 11.45 H new ATOM 0 HG22 THR A 93 13.995 11.027 17.387 1.00 11.45 H new ATOM 0 HG23 THR A 93 14.238 10.608 15.674 1.00 11.45 H new ATOM 1483 N ASP A 94 9.445 10.506 17.332 1.00 54.22 N ATOM 1484 CA ASP A 94 7.999 10.695 17.330 1.00 54.12 C ATOM 1485 C ASP A 94 7.594 11.802 18.299 1.00 72.15 C ATOM 1486 O ASP A 94 7.286 11.541 19.461 1.00 71.04 O ATOM 1487 CB ASP A 94 7.292 9.391 17.702 1.00 31.21 C ATOM 1488 CG ASP A 94 6.359 8.905 16.610 1.00 43.42 C ATOM 1489 OD1 ASP A 94 5.733 9.756 15.942 1.00 24.43 O ATOM 1490 OD2 ASP A 94 6.256 7.675 16.422 1.00 40.42 O ATOM 0 H ASP A 94 9.878 10.577 18.253 1.00 54.22 H new ATOM 0 HA ASP A 94 7.697 10.989 16.325 1.00 54.12 H new ATOM 0 HB2 ASP A 94 8.038 8.623 17.907 1.00 31.21 H new ATOM 0 HB3 ASP A 94 6.725 9.538 18.621 1.00 31.21 H new ATOM 1495 N ASN A 95 7.598 13.038 17.811 1.00 0.53 N ATOM 1496 CA ASN A 95 7.233 14.186 18.635 1.00 72.44 C ATOM 1497 C ASN A 95 5.821 14.028 19.191 1.00 51.52 C ATOM 1498 O ASN A 95 4.845 14.435 18.561 1.00 64.43 O ATOM 1499 CB ASN A 95 7.331 15.477 17.820 1.00 63.34 C ATOM 1500 CG ASN A 95 7.667 16.679 18.680 1.00 0.41 C ATOM 1501 OD1 ASN A 95 6.779 17.415 19.112 1.00 42.13 O ATOM 1502 ND2 ASN A 95 8.954 16.885 18.933 1.00 23.33 N ATOM 0 H ASN A 95 7.850 13.271 16.850 1.00 0.53 H new ATOM 0 HA ASN A 95 7.930 14.239 19.471 1.00 72.44 H new ATOM 0 HB2 ASN A 95 8.093 15.360 17.050 1.00 63.34 H new ATOM 0 HB3 ASN A 95 6.385 15.653 17.308 1.00 63.34 H new ATOM 0 HD21 ASN A 95 9.240 17.679 19.506 1.00 23.33 H new ATOM 0 HD22 ASN A 95 9.656 16.249 18.554 1.00 23.33 H new ATOM 1509 N GLY A 96 5.720 13.436 20.377 1.00 2.20 N ATOM 1510 CA GLY A 96 4.424 13.236 20.999 1.00 42.23 C ATOM 1511 C GLY A 96 3.898 11.828 20.802 1.00 10.31 C ATOM 1512 O GLY A 96 2.714 11.566 21.009 1.00 11.11 O ATOM 0 H GLY A 96 6.513 13.091 20.918 1.00 2.20 H new ATOM 0 HA2 GLY A 96 4.500 13.446 22.066 1.00 42.23 H new ATOM 0 HA3 GLY A 96 3.711 13.948 20.584 1.00 42.23 H new ATOM 1516 N GLY A 97 4.780 10.919 20.399 1.00 24.12 N ATOM 1517 CA GLY A 97 4.379 9.542 20.179 1.00 32.24 C ATOM 1518 C GLY A 97 3.176 9.428 19.264 1.00 61.21 C ATOM 1519 O GLY A 97 2.128 8.919 19.663 1.00 53.41 O ATOM 0 H GLY A 97 5.766 11.112 20.221 1.00 24.12 H new ATOM 0 HA2 GLY A 97 5.213 8.988 19.748 1.00 32.24 H new ATOM 0 HA3 GLY A 97 4.148 9.076 21.137 1.00 32.24 H new ATOM 1523 N THR A 98 3.325 9.904 18.031 1.00 20.44 N ATOM 1524 CA THR A 98 2.242 9.856 17.057 1.00 31.45 C ATOM 1525 C THR A 98 1.918 8.418 16.666 1.00 50.41 C ATOM 1526 O THR A 98 0.754 8.017 16.649 1.00 11.32 O ATOM 1527 CB THR A 98 2.592 10.655 15.788 1.00 11.02 C ATOM 1528 OG1 THR A 98 3.779 11.425 16.006 1.00 2.22 O ATOM 1529 CG2 THR A 98 1.447 11.578 15.397 1.00 25.21 C ATOM 0 H THR A 98 4.186 10.327 17.684 1.00 20.44 H new ATOM 0 HA THR A 98 1.370 10.306 17.531 1.00 31.45 H new ATOM 0 HB THR A 98 2.762 9.949 14.976 1.00 11.02 H new ATOM 0 HG1 THR A 98 4.552 10.945 15.642 1.00 2.22 H new ATOM 0 HG21 THR A 98 1.717 12.132 14.498 1.00 25.21 H new ATOM 0 HG22 THR A 98 0.552 10.986 15.203 1.00 25.21 H new ATOM 0 HG23 THR A 98 1.250 12.278 16.209 1.00 25.21 H new ATOM 1537 N ILE A 99 2.954 7.648 16.352 1.00 31.22 N ATOM 1538 CA ILE A 99 2.778 6.254 15.963 1.00 43.24 C ATOM 1539 C ILE A 99 2.374 5.396 17.157 1.00 55.44 C ATOM 1540 O ILE A 99 1.400 4.646 17.093 1.00 11.53 O ATOM 1541 CB ILE A 99 4.064 5.677 15.342 1.00 24.24 C ATOM 1542 CG1 ILE A 99 4.581 6.598 14.235 1.00 11.04 C ATOM 1543 CG2 ILE A 99 3.809 4.279 14.799 1.00 21.34 C ATOM 1544 CD1 ILE A 99 5.851 6.102 13.580 1.00 52.00 C ATOM 0 H ILE A 99 3.923 7.965 16.359 1.00 31.22 H new ATOM 0 HA ILE A 99 1.982 6.232 15.218 1.00 43.24 H new ATOM 0 HB ILE A 99 4.826 5.611 16.119 1.00 24.24 H new ATOM 0 HG12 ILE A 99 3.808 6.707 13.474 1.00 11.04 H new ATOM 0 HG13 ILE A 99 4.760 7.589 14.652 1.00 11.04 H new ATOM 0 HG21 ILE A 99 4.727 3.885 14.363 1.00 21.34 H new ATOM 0 HG22 ILE A 99 3.483 3.628 15.610 1.00 21.34 H new ATOM 0 HG23 ILE A 99 3.034 4.322 14.034 1.00 21.34 H new ATOM 0 HD11 ILE A 99 6.159 6.804 12.805 1.00 52.00 H new ATOM 0 HD12 ILE A 99 6.638 6.019 14.329 1.00 52.00 H new ATOM 0 HD13 ILE A 99 5.672 5.124 13.133 1.00 52.00 H new ATOM 1556 N ALA A 100 3.127 5.514 18.245 1.00 31.21 N ATOM 1557 CA ALA A 100 2.845 4.752 19.455 1.00 15.24 C ATOM 1558 C ALA A 100 1.389 4.914 19.879 1.00 55.22 C ATOM 1559 O ALA A 100 0.693 3.930 20.129 1.00 1.43 O ATOM 1560 CB ALA A 100 3.774 5.184 20.580 1.00 43.03 C ATOM 0 H ALA A 100 3.937 6.130 18.313 1.00 31.21 H new ATOM 0 HA ALA A 100 3.019 3.698 19.239 1.00 15.24 H new ATOM 0 HB1 ALA A 100 3.552 4.606 21.477 1.00 43.03 H new ATOM 0 HB2 ALA A 100 4.809 5.011 20.284 1.00 43.03 H new ATOM 0 HB3 ALA A 100 3.628 6.244 20.786 1.00 43.03 H new ATOM 1566 N GLN A 101 0.935 6.161 19.957 1.00 41.11 N ATOM 1567 CA GLN A 101 -0.438 6.451 20.352 1.00 74.44 C ATOM 1568 C GLN A 101 -1.429 5.803 19.390 1.00 52.02 C ATOM 1569 O GLN A 101 -2.485 5.323 19.801 1.00 32.43 O ATOM 1570 CB GLN A 101 -0.670 7.962 20.400 1.00 62.11 C ATOM 1571 CG GLN A 101 -1.876 8.366 21.233 1.00 44.55 C ATOM 1572 CD GLN A 101 -3.086 8.699 20.383 1.00 13.10 C ATOM 1573 OE1 GLN A 101 -3.271 9.981 20.092 1.00 43.41 O flip ATOM 1574 NE2 GLN A 101 -3.848 7.813 19.993 1.00 52.44 N flip ATOM 0 H GLN A 101 1.498 6.986 19.752 1.00 41.11 H new ATOM 0 HA GLN A 101 -0.599 6.035 21.346 1.00 74.44 H new ATOM 0 HB2 GLN A 101 0.219 8.445 20.805 1.00 62.11 H new ATOM 0 HB3 GLN A 101 -0.800 8.334 19.384 1.00 62.11 H new ATOM 0 HG2 GLN A 101 -2.129 7.556 21.917 1.00 44.55 H new ATOM 0 HG3 GLN A 101 -1.617 9.230 21.845 1.00 44.55 H new ATOM 0 HE21 GLN A 101 -3.668 6.840 20.240 1.00 52.44 H new ATOM 0 HE22 GLN A 101 -4.659 8.052 19.423 1.00 52.44 H new ATOM 1583 N SER A 102 -1.081 5.794 18.107 1.00 55.10 N ATOM 1584 CA SER A 102 -1.942 5.209 17.086 1.00 54.24 C ATOM 1585 C SER A 102 -1.930 3.686 17.172 1.00 13.12 C ATOM 1586 O SER A 102 -2.884 3.022 16.765 1.00 72.32 O ATOM 1587 CB SER A 102 -1.493 5.656 15.693 1.00 32.20 C ATOM 1588 OG SER A 102 -1.837 7.010 15.456 1.00 0.12 O ATOM 0 H SER A 102 -0.209 6.185 17.750 1.00 55.10 H new ATOM 0 HA SER A 102 -2.960 5.557 17.261 1.00 54.24 H new ATOM 0 HB2 SER A 102 -0.415 5.529 15.597 1.00 32.20 H new ATOM 0 HB3 SER A 102 -1.957 5.022 14.937 1.00 32.20 H new ATOM 0 HG SER A 102 -1.115 7.591 15.774 1.00 0.12 H new ATOM 1594 N LEU A 103 -0.844 3.139 17.705 1.00 24.14 N ATOM 1595 CA LEU A 103 -0.705 1.693 17.846 1.00 13.54 C ATOM 1596 C LEU A 103 -1.044 1.250 19.266 1.00 72.01 C ATOM 1597 O LEU A 103 -0.964 0.067 19.593 1.00 60.33 O ATOM 1598 CB LEU A 103 0.718 1.260 17.491 1.00 50.44 C ATOM 1599 CG LEU A 103 0.988 0.993 16.009 1.00 34.24 C ATOM 1600 CD1 LEU A 103 0.086 -0.118 15.495 1.00 73.41 C ATOM 1601 CD2 LEU A 103 0.791 2.262 15.194 1.00 43.33 C ATOM 0 H LEU A 103 -0.046 3.674 18.047 1.00 24.14 H new ATOM 0 HA LEU A 103 -1.405 1.217 17.159 1.00 13.54 H new ATOM 0 HB2 LEU A 103 1.407 2.032 17.832 1.00 50.44 H new ATOM 0 HB3 LEU A 103 0.951 0.355 18.051 1.00 50.44 H new ATOM 0 HG LEU A 103 2.024 0.672 15.900 1.00 34.24 H new ATOM 0 HD11 LEU A 103 0.292 -0.295 14.439 1.00 73.41 H new ATOM 0 HD12 LEU A 103 0.276 -1.031 16.059 1.00 73.41 H new ATOM 0 HD13 LEU A 103 -0.957 0.174 15.618 1.00 73.41 H new ATOM 0 HD21 LEU A 103 0.987 2.053 14.142 1.00 43.33 H new ATOM 0 HD22 LEU A 103 -0.235 2.613 15.309 1.00 43.33 H new ATOM 0 HD23 LEU A 103 1.479 3.031 15.546 1.00 43.33 H new ATOM 1613 N ASN A 104 -1.425 2.208 20.105 1.00 50.03 N ATOM 1614 CA ASN A 104 -1.778 1.916 21.489 1.00 30.13 C ATOM 1615 C ASN A 104 -0.574 1.375 22.255 1.00 13.31 C ATOM 1616 O ASN A 104 -0.725 0.616 23.212 1.00 32.25 O ATOM 1617 CB ASN A 104 -2.926 0.906 21.542 1.00 30.25 C ATOM 1618 CG ASN A 104 -3.792 1.079 22.775 1.00 1.14 C ATOM 1619 OD1 ASN A 104 -3.290 1.343 23.868 1.00 42.40 O ATOM 1620 ND2 ASN A 104 -5.100 0.930 22.605 1.00 54.21 N ATOM 0 H ASN A 104 -1.497 3.193 19.850 1.00 50.03 H new ATOM 0 HA ASN A 104 -2.098 2.845 21.960 1.00 30.13 H new ATOM 0 HB2 ASN A 104 -3.543 1.014 20.650 1.00 30.25 H new ATOM 0 HB3 ASN A 104 -2.518 -0.105 21.527 1.00 30.25 H new ATOM 0 HD21 ASN A 104 -5.733 1.034 23.398 1.00 54.21 H new ATOM 0 HD22 ASN A 104 -5.473 0.711 21.681 1.00 54.21 H new ATOM 1627 N ILE A 105 0.619 1.773 21.827 1.00 22.50 N ATOM 1628 CA ILE A 105 1.848 1.329 22.473 1.00 3.33 C ATOM 1629 C ILE A 105 2.118 2.125 23.746 1.00 31.20 C ATOM 1630 O ILE A 105 2.880 3.091 23.737 1.00 43.14 O ATOM 1631 CB ILE A 105 3.059 1.463 21.531 1.00 5.34 C ATOM 1632 CG1 ILE A 105 2.825 0.665 20.247 1.00 2.22 C ATOM 1633 CG2 ILE A 105 4.327 0.994 22.229 1.00 4.31 C ATOM 1634 CD1 ILE A 105 2.717 -0.826 20.474 1.00 30.40 C ATOM 0 H ILE A 105 0.761 2.402 21.036 1.00 22.50 H new ATOM 0 HA ILE A 105 1.710 0.278 22.727 1.00 3.33 H new ATOM 0 HB ILE A 105 3.180 2.513 21.266 1.00 5.34 H new ATOM 0 HG12 ILE A 105 1.911 1.019 19.770 1.00 2.22 H new ATOM 0 HG13 ILE A 105 3.643 0.860 19.553 1.00 2.22 H new ATOM 0 HG21 ILE A 105 5.174 1.095 21.551 1.00 4.31 H new ATOM 0 HG22 ILE A 105 4.499 1.602 23.117 1.00 4.31 H new ATOM 0 HG23 ILE A 105 4.217 -0.051 22.520 1.00 4.31 H new ATOM 0 HD11 ILE A 105 2.552 -1.328 19.521 1.00 30.40 H new ATOM 0 HD12 ILE A 105 3.640 -1.194 20.922 1.00 30.40 H new ATOM 0 HD13 ILE A 105 1.881 -1.033 21.143 1.00 30.40 H new ATOM 1646 N SER A 106 1.488 1.710 24.841 1.00 43.42 N ATOM 1647 CA SER A 106 1.659 2.385 26.122 1.00 14.22 C ATOM 1648 C SER A 106 2.675 1.651 26.992 1.00 40.52 C ATOM 1649 O SER A 106 3.277 2.237 27.892 1.00 40.11 O ATOM 1650 CB SER A 106 0.319 2.481 26.854 1.00 33.44 C ATOM 1651 OG SER A 106 -0.251 1.197 27.046 1.00 44.04 O ATOM 0 H SER A 106 0.855 0.910 24.866 1.00 43.42 H new ATOM 0 HA SER A 106 2.032 3.391 25.928 1.00 14.22 H new ATOM 0 HB2 SER A 106 0.462 2.967 27.819 1.00 33.44 H new ATOM 0 HB3 SER A 106 -0.367 3.105 26.282 1.00 33.44 H new ATOM 0 HG SER A 106 -1.106 1.286 27.517 1.00 44.04 H new ATOM 1657 N VAL A 107 2.861 0.364 26.716 1.00 50.53 N ATOM 1658 CA VAL A 107 3.805 -0.451 27.471 1.00 52.21 C ATOM 1659 C VAL A 107 5.080 -0.696 26.673 1.00 63.22 C ATOM 1660 O VAL A 107 5.029 -1.062 25.498 1.00 24.13 O ATOM 1661 CB VAL A 107 3.188 -1.807 27.862 1.00 51.13 C ATOM 1662 CG1 VAL A 107 2.133 -1.622 28.942 1.00 71.42 C ATOM 1663 CG2 VAL A 107 2.597 -2.495 26.640 1.00 4.21 C ATOM 0 H VAL A 107 2.370 -0.137 25.975 1.00 50.53 H new ATOM 0 HA VAL A 107 4.048 0.104 28.377 1.00 52.21 H new ATOM 0 HB VAL A 107 3.977 -2.443 28.263 1.00 51.13 H new ATOM 0 HG11 VAL A 107 1.708 -2.591 29.205 1.00 71.42 H new ATOM 0 HG12 VAL A 107 2.590 -1.174 29.824 1.00 71.42 H new ATOM 0 HG13 VAL A 107 1.343 -0.968 28.571 1.00 71.42 H new ATOM 0 HG21 VAL A 107 2.165 -3.452 26.934 1.00 4.21 H new ATOM 0 HG22 VAL A 107 1.820 -1.864 26.207 1.00 4.21 H new ATOM 0 HG23 VAL A 107 3.381 -2.663 25.902 1.00 4.21 H new ATOM 1673 N TYR A 108 6.223 -0.493 27.318 1.00 45.00 N ATOM 1674 CA TYR A 108 7.514 -0.690 26.668 1.00 74.22 C ATOM 1675 C TYR A 108 8.383 -1.657 27.465 1.00 24.23 C ATOM 1676 O TYR A 108 8.237 -1.808 28.678 1.00 21.44 O ATOM 1677 CB TYR A 108 8.236 0.648 26.505 1.00 3.14 C ATOM 1678 CG TYR A 108 7.349 1.756 25.984 1.00 22.01 C ATOM 1679 CD1 TYR A 108 6.607 2.546 26.854 1.00 24.11 C ATOM 1680 CD2 TYR A 108 7.252 2.012 24.622 1.00 12.42 C ATOM 1681 CE1 TYR A 108 5.795 3.559 26.383 1.00 70.25 C ATOM 1682 CE2 TYR A 108 6.443 3.024 24.142 1.00 42.12 C ATOM 1683 CZ TYR A 108 5.717 3.794 25.026 1.00 54.42 C ATOM 1684 OH TYR A 108 4.909 4.802 24.551 1.00 12.21 O ATOM 0 H TYR A 108 6.282 -0.192 28.291 1.00 45.00 H new ATOM 0 HA TYR A 108 7.334 -1.120 25.683 1.00 74.22 H new ATOM 0 HB2 TYR A 108 8.649 0.948 27.468 1.00 3.14 H new ATOM 0 HB3 TYR A 108 9.077 0.517 25.824 1.00 3.14 H new ATOM 0 HD1 TYR A 108 6.666 2.365 27.917 1.00 24.11 H new ATOM 0 HD2 TYR A 108 7.818 1.410 23.927 1.00 12.42 H new ATOM 0 HE1 TYR A 108 5.225 4.163 27.073 1.00 70.25 H new ATOM 0 HE2 TYR A 108 6.380 3.211 23.080 1.00 42.12 H new ATOM 0 HH TYR A 108 4.090 4.416 24.177 1.00 12.21 H new ATOM 1694 N PRO A 109 9.312 -2.328 26.768 1.00 23.23 N ATOM 1695 CA PRO A 109 9.495 -2.157 25.324 1.00 43.20 C ATOM 1696 C PRO A 109 8.335 -2.733 24.520 1.00 32.32 C ATOM 1697 O PRO A 109 7.400 -3.303 25.083 1.00 13.50 O ATOM 1698 CB PRO A 109 10.783 -2.932 25.035 1.00 21.21 C ATOM 1699 CG PRO A 109 10.865 -3.949 26.121 1.00 10.32 C ATOM 1700 CD PRO A 109 10.255 -3.306 27.336 1.00 22.34 C ATOM 0 HA PRO A 109 9.542 -1.105 25.041 1.00 43.20 H new ATOM 0 HB2 PRO A 109 10.749 -3.403 24.053 1.00 21.21 H new ATOM 0 HB3 PRO A 109 11.652 -2.273 25.043 1.00 21.21 H new ATOM 0 HG2 PRO A 109 10.327 -4.856 25.848 1.00 10.32 H new ATOM 0 HG3 PRO A 109 11.899 -4.237 26.309 1.00 10.32 H new ATOM 0 HD2 PRO A 109 9.746 -4.037 27.964 1.00 22.34 H new ATOM 0 HD3 PRO A 109 11.010 -2.823 27.956 1.00 22.34 H new ATOM 1708 N SER A 110 8.402 -2.582 23.201 1.00 32.53 N ATOM 1709 CA SER A 110 7.354 -3.085 22.320 1.00 24.52 C ATOM 1710 C SER A 110 7.902 -3.348 20.920 1.00 14.14 C ATOM 1711 O SER A 110 9.000 -2.909 20.579 1.00 13.42 O ATOM 1712 CB SER A 110 6.196 -2.088 22.249 1.00 63.33 C ATOM 1713 OG SER A 110 5.214 -2.377 23.228 1.00 13.22 O ATOM 0 H SER A 110 9.171 -2.116 22.719 1.00 32.53 H new ATOM 0 HA SER A 110 6.988 -4.026 22.731 1.00 24.52 H new ATOM 0 HB2 SER A 110 6.574 -1.076 22.396 1.00 63.33 H new ATOM 0 HB3 SER A 110 5.745 -2.119 21.257 1.00 63.33 H new ATOM 0 HG SER A 110 5.284 -1.732 23.962 1.00 13.22 H new ATOM 1719 N TRP A 111 7.128 -4.067 20.115 1.00 10.22 N ATOM 1720 CA TRP A 111 7.534 -4.389 18.752 1.00 43.41 C ATOM 1721 C TRP A 111 6.342 -4.342 17.803 1.00 33.41 C ATOM 1722 O TRP A 111 5.192 -4.298 18.239 1.00 52.41 O ATOM 1723 CB TRP A 111 8.186 -5.772 18.705 1.00 52.30 C ATOM 1724 CG TRP A 111 9.594 -5.783 19.219 1.00 14.13 C ATOM 1725 CD1 TRP A 111 9.989 -5.852 20.525 1.00 53.03 C ATOM 1726 CD2 TRP A 111 10.792 -5.721 18.438 1.00 32.30 C ATOM 1727 NE1 TRP A 111 11.360 -5.837 20.602 1.00 5.01 N ATOM 1728 CE2 TRP A 111 11.877 -5.758 19.336 1.00 73.22 C ATOM 1729 CE3 TRP A 111 11.054 -5.641 17.068 1.00 50.22 C ATOM 1730 CZ2 TRP A 111 13.200 -5.716 18.906 1.00 42.15 C ATOM 1731 CZ3 TRP A 111 12.368 -5.599 16.642 1.00 1.45 C ATOM 1732 CH2 TRP A 111 13.428 -5.637 17.558 1.00 13.15 C ATOM 0 H TRP A 111 6.216 -4.438 20.382 1.00 10.22 H new ATOM 0 HA TRP A 111 8.260 -3.642 18.430 1.00 43.41 H new ATOM 0 HB2 TRP A 111 7.587 -6.468 19.292 1.00 52.30 H new ATOM 0 HB3 TRP A 111 8.179 -6.134 17.677 1.00 52.30 H new ATOM 0 HD1 TRP A 111 9.321 -5.910 21.372 1.00 53.03 H new ATOM 0 HE1 TRP A 111 11.905 -5.878 21.463 1.00 5.01 H new ATOM 0 HE3 TRP A 111 10.244 -5.612 16.354 1.00 50.22 H new ATOM 0 HZ2 TRP A 111 14.018 -5.745 19.611 1.00 42.15 H new ATOM 0 HZ3 TRP A 111 12.582 -5.536 15.585 1.00 1.45 H new ATOM 0 HH2 TRP A 111 14.444 -5.603 17.194 1.00 13.15 H new ATOM 1743 N ALA A 112 6.623 -4.354 16.504 1.00 4.34 N ATOM 1744 CA ALA A 112 5.573 -4.315 15.495 1.00 70.45 C ATOM 1745 C ALA A 112 6.144 -4.545 14.099 1.00 20.14 C ATOM 1746 O ALA A 112 6.988 -3.781 13.629 1.00 0.12 O ATOM 1747 CB ALA A 112 4.834 -2.987 15.552 1.00 13.22 C ATOM 0 H ALA A 112 7.570 -4.390 16.126 1.00 4.34 H new ATOM 0 HA ALA A 112 4.869 -5.119 15.709 1.00 70.45 H new ATOM 0 HB1 ALA A 112 4.052 -2.973 14.792 1.00 13.22 H new ATOM 0 HB2 ALA A 112 4.385 -2.863 16.537 1.00 13.22 H new ATOM 0 HB3 ALA A 112 5.535 -2.173 15.367 1.00 13.22 H new ATOM 1753 N LEU A 113 5.680 -5.602 13.442 1.00 52.11 N ATOM 1754 CA LEU A 113 6.145 -5.933 12.100 1.00 42.05 C ATOM 1755 C LEU A 113 5.361 -5.159 11.045 1.00 52.20 C ATOM 1756 O LEU A 113 4.157 -4.943 11.187 1.00 72.41 O ATOM 1757 CB LEU A 113 6.013 -7.436 11.849 1.00 73.13 C ATOM 1758 CG LEU A 113 7.205 -8.111 11.170 1.00 23.14 C ATOM 1759 CD1 LEU A 113 6.937 -9.595 10.971 1.00 55.41 C ATOM 1760 CD2 LEU A 113 7.513 -7.439 9.840 1.00 33.21 C ATOM 0 H LEU A 113 4.982 -6.245 13.817 1.00 52.11 H new ATOM 0 HA LEU A 113 7.195 -5.649 12.026 1.00 42.05 H new ATOM 0 HB2 LEU A 113 5.838 -7.930 12.805 1.00 73.13 H new ATOM 0 HB3 LEU A 113 5.128 -7.605 11.236 1.00 73.13 H new ATOM 0 HG LEU A 113 8.075 -8.004 11.818 1.00 23.14 H new ATOM 0 HD11 LEU A 113 7.797 -10.058 10.486 1.00 55.41 H new ATOM 0 HD12 LEU A 113 6.768 -10.067 11.939 1.00 55.41 H new ATOM 0 HD13 LEU A 113 6.054 -9.725 10.345 1.00 55.41 H new ATOM 0 HD21 LEU A 113 8.364 -7.933 9.371 1.00 33.21 H new ATOM 0 HD22 LEU A 113 6.645 -7.513 9.185 1.00 33.21 H new ATOM 0 HD23 LEU A 113 7.751 -6.389 10.009 1.00 33.21 H new ATOM 1772 N ILE A 114 6.051 -4.745 9.987 1.00 34.33 N ATOM 1773 CA ILE A 114 5.418 -3.998 8.907 1.00 34.35 C ATOM 1774 C ILE A 114 5.761 -4.599 7.549 1.00 45.34 C ATOM 1775 O ILE A 114 6.904 -4.529 7.099 1.00 64.42 O ATOM 1776 CB ILE A 114 5.841 -2.518 8.924 1.00 53.42 C ATOM 1777 CG1 ILE A 114 5.443 -1.866 10.250 1.00 51.54 C ATOM 1778 CG2 ILE A 114 5.214 -1.775 7.753 1.00 4.10 C ATOM 1779 CD1 ILE A 114 3.947 -1.735 10.434 1.00 22.31 C ATOM 0 H ILE A 114 7.048 -4.914 9.855 1.00 34.33 H new ATOM 0 HA ILE A 114 4.342 -4.061 9.067 1.00 34.35 H new ATOM 0 HB ILE A 114 6.925 -2.464 8.825 1.00 53.42 H new ATOM 0 HG12 ILE A 114 5.852 -2.454 11.072 1.00 51.54 H new ATOM 0 HG13 ILE A 114 5.896 -0.877 10.310 1.00 51.54 H new ATOM 0 HG21 ILE A 114 5.522 -0.730 7.778 1.00 4.10 H new ATOM 0 HG22 ILE A 114 5.542 -2.228 6.817 1.00 4.10 H new ATOM 0 HG23 ILE A 114 4.128 -1.835 7.824 1.00 4.10 H new ATOM 0 HD11 ILE A 114 3.738 -1.265 11.395 1.00 22.31 H new ATOM 0 HD12 ILE A 114 3.534 -1.122 9.633 1.00 22.31 H new ATOM 0 HD13 ILE A 114 3.489 -2.724 10.407 1.00 22.31 H new ATOM 1791 N GLY A 115 4.762 -5.187 6.898 1.00 65.43 N ATOM 1792 CA GLY A 115 4.979 -5.790 5.595 1.00 12.03 C ATOM 1793 C GLY A 115 5.702 -4.862 4.640 1.00 43.20 C ATOM 1794 O GLY A 115 5.699 -3.644 4.823 1.00 62.31 O ATOM 0 H GLY A 115 3.807 -5.257 7.249 1.00 65.43 H new ATOM 0 HA2 GLY A 115 5.557 -6.706 5.714 1.00 12.03 H new ATOM 0 HA3 GLY A 115 4.018 -6.073 5.164 1.00 12.03 H new ATOM 1798 N LYS A 116 6.326 -5.437 3.618 1.00 64.04 N ATOM 1799 CA LYS A 116 7.059 -4.654 2.629 1.00 34.22 C ATOM 1800 C LYS A 116 6.154 -3.609 1.984 1.00 71.31 C ATOM 1801 O LYS A 116 6.606 -2.524 1.618 1.00 33.03 O ATOM 1802 CB LYS A 116 7.644 -5.572 1.553 1.00 13.13 C ATOM 1803 CG LYS A 116 6.595 -6.375 0.803 1.00 24.32 C ATOM 1804 CD LYS A 116 6.549 -5.996 -0.667 1.00 53.43 C ATOM 1805 CE LYS A 116 5.428 -5.007 -0.953 1.00 22.54 C ATOM 1806 NZ LYS A 116 5.034 -5.015 -2.389 1.00 3.03 N ATOM 0 H LYS A 116 6.339 -6.443 3.452 1.00 64.04 H new ATOM 0 HA LYS A 116 7.873 -4.139 3.140 1.00 34.22 H new ATOM 0 HB2 LYS A 116 8.207 -4.970 0.840 1.00 13.13 H new ATOM 0 HB3 LYS A 116 8.351 -6.259 2.018 1.00 13.13 H new ATOM 0 HG2 LYS A 116 6.813 -7.439 0.899 1.00 24.32 H new ATOM 0 HG3 LYS A 116 5.617 -6.208 1.254 1.00 24.32 H new ATOM 0 HD2 LYS A 116 7.504 -5.561 -0.962 1.00 53.43 H new ATOM 0 HD3 LYS A 116 6.408 -6.892 -1.271 1.00 53.43 H new ATOM 0 HE2 LYS A 116 4.562 -5.252 -0.338 1.00 22.54 H new ATOM 0 HE3 LYS A 116 5.747 -4.004 -0.670 1.00 22.54 H new ATOM 0 HZ1 LYS A 116 4.051 -4.688 -2.481 1.00 3.03 H new ATOM 0 HZ2 LYS A 116 5.661 -4.382 -2.925 1.00 3.03 H new ATOM 0 HZ3 LYS A 116 5.114 -5.981 -2.766 1.00 3.03 H new ATOM 1820 N ASP A 117 4.875 -3.943 1.848 1.00 23.24 N ATOM 1821 CA ASP A 117 3.907 -3.032 1.250 1.00 75.44 C ATOM 1822 C ASP A 117 3.549 -1.907 2.216 1.00 62.33 C ATOM 1823 O ASP A 117 2.894 -0.936 1.839 1.00 63.41 O ATOM 1824 CB ASP A 117 2.643 -3.793 0.843 1.00 3.20 C ATOM 1825 CG ASP A 117 2.113 -3.354 -0.508 1.00 21.21 C ATOM 1826 OD1 ASP A 117 1.385 -2.341 -0.559 1.00 3.14 O ATOM 1827 OD2 ASP A 117 2.425 -4.025 -1.514 1.00 42.24 O ATOM 0 H ASP A 117 4.485 -4.838 2.144 1.00 23.24 H new ATOM 0 HA ASP A 117 4.360 -2.592 0.361 1.00 75.44 H new ATOM 0 HB2 ASP A 117 2.858 -4.861 0.816 1.00 3.20 H new ATOM 0 HB3 ASP A 117 1.872 -3.642 1.599 1.00 3.20 H new ATOM 1832 N GLY A 118 3.984 -2.046 3.465 1.00 74.02 N ATOM 1833 CA GLY A 118 3.699 -1.035 4.466 1.00 52.31 C ATOM 1834 C GLY A 118 2.613 -1.465 5.432 1.00 24.35 C ATOM 1835 O GLY A 118 2.354 -0.788 6.427 1.00 10.41 O ATOM 0 H GLY A 118 4.528 -2.840 3.801 1.00 74.02 H new ATOM 0 HA2 GLY A 118 4.609 -0.813 5.023 1.00 52.31 H new ATOM 0 HA3 GLY A 118 3.396 -0.113 3.970 1.00 52.31 H new ATOM 1839 N ASP A 119 1.977 -2.594 5.140 1.00 54.32 N ATOM 1840 CA ASP A 119 0.912 -3.114 5.990 1.00 2.34 C ATOM 1841 C ASP A 119 1.475 -3.628 7.312 1.00 52.31 C ATOM 1842 O ASP A 119 2.679 -3.551 7.558 1.00 54.10 O ATOM 1843 CB ASP A 119 0.158 -4.234 5.273 1.00 61.24 C ATOM 1844 CG ASP A 119 -1.314 -3.919 5.093 1.00 43.55 C ATOM 1845 OD1 ASP A 119 -2.022 -3.790 6.113 1.00 63.40 O ATOM 1846 OD2 ASP A 119 -1.758 -3.801 3.931 1.00 2.51 O ATOM 0 H ASP A 119 2.180 -3.167 4.321 1.00 54.32 H new ATOM 0 HA ASP A 119 0.220 -2.299 6.202 1.00 2.34 H new ATOM 0 HB2 ASP A 119 0.612 -4.406 4.297 1.00 61.24 H new ATOM 0 HB3 ASP A 119 0.262 -5.159 5.840 1.00 61.24 H new ATOM 1851 N VAL A 120 0.595 -4.151 8.160 1.00 23.21 N ATOM 1852 CA VAL A 120 1.004 -4.678 9.457 1.00 51.12 C ATOM 1853 C VAL A 120 0.938 -6.201 9.477 1.00 41.12 C ATOM 1854 O VAL A 120 0.083 -6.803 8.828 1.00 44.05 O ATOM 1855 CB VAL A 120 0.123 -4.122 10.591 1.00 31.03 C ATOM 1856 CG1 VAL A 120 -1.303 -4.636 10.461 1.00 23.23 C ATOM 1857 CG2 VAL A 120 0.708 -4.486 11.947 1.00 23.42 C ATOM 0 H VAL A 120 -0.405 -4.221 7.972 1.00 23.21 H new ATOM 0 HA VAL A 120 2.034 -4.360 9.618 1.00 51.12 H new ATOM 0 HB VAL A 120 0.101 -3.035 10.510 1.00 31.03 H new ATOM 0 HG11 VAL A 120 -1.910 -4.232 11.271 1.00 23.23 H new ATOM 0 HG12 VAL A 120 -1.718 -4.320 9.504 1.00 23.23 H new ATOM 0 HG13 VAL A 120 -1.304 -5.725 10.515 1.00 23.23 H new ATOM 0 HG21 VAL A 120 0.073 -4.085 12.737 1.00 23.42 H new ATOM 0 HG22 VAL A 120 0.762 -5.571 12.040 1.00 23.42 H new ATOM 0 HG23 VAL A 120 1.709 -4.063 12.037 1.00 23.42 H new ATOM 1867 N GLN A 121 1.846 -6.817 10.227 1.00 60.23 N ATOM 1868 CA GLN A 121 1.891 -8.271 10.331 1.00 53.11 C ATOM 1869 C GLN A 121 1.539 -8.726 11.743 1.00 31.52 C ATOM 1870 O GLN A 121 0.909 -9.767 11.931 1.00 33.22 O ATOM 1871 CB GLN A 121 3.278 -8.788 9.946 1.00 32.40 C ATOM 1872 CG GLN A 121 3.251 -9.847 8.855 1.00 1.22 C ATOM 1873 CD GLN A 121 2.512 -11.101 9.277 1.00 33.20 C ATOM 1874 OE1 GLN A 121 2.861 -11.736 10.273 1.00 73.34 O ATOM 1875 NE2 GLN A 121 1.483 -11.465 8.520 1.00 23.40 N ATOM 0 H GLN A 121 2.560 -6.333 10.771 1.00 60.23 H new ATOM 0 HA GLN A 121 1.154 -8.683 9.642 1.00 53.11 H new ATOM 0 HB2 GLN A 121 3.889 -7.950 9.612 1.00 32.40 H new ATOM 0 HB3 GLN A 121 3.761 -9.202 10.831 1.00 32.40 H new ATOM 0 HG2 GLN A 121 2.778 -9.434 7.964 1.00 1.22 H new ATOM 0 HG3 GLN A 121 4.273 -10.107 8.581 1.00 1.22 H new ATOM 0 HE21 GLN A 121 1.229 -10.909 7.703 1.00 23.40 H new ATOM 0 HE22 GLN A 121 0.947 -12.300 8.755 1.00 23.40 H new ATOM 1884 N ARG A 122 1.950 -7.941 12.733 1.00 44.31 N ATOM 1885 CA ARG A 122 1.680 -8.264 14.128 1.00 32.44 C ATOM 1886 C ARG A 122 2.240 -7.189 15.055 1.00 42.15 C ATOM 1887 O ARG A 122 2.880 -6.239 14.603 1.00 52.34 O ATOM 1888 CB ARG A 122 2.283 -9.624 14.485 1.00 61.31 C ATOM 1889 CG ARG A 122 3.714 -9.801 14.003 1.00 74.22 C ATOM 1890 CD ARG A 122 4.622 -10.287 15.121 1.00 4.34 C ATOM 1891 NE ARG A 122 4.733 -9.308 16.200 1.00 21.41 N ATOM 1892 CZ ARG A 122 5.617 -8.317 16.205 1.00 12.30 C ATOM 1893 NH1 ARG A 122 6.462 -8.172 15.194 1.00 71.43 N ATOM 1894 NH2 ARG A 122 5.656 -7.466 17.223 1.00 60.40 N ATOM 0 H ARG A 122 2.472 -7.076 12.594 1.00 44.31 H new ATOM 0 HA ARG A 122 0.599 -8.306 14.261 1.00 32.44 H new ATOM 0 HB2 ARG A 122 2.255 -9.752 15.567 1.00 61.31 H new ATOM 0 HB3 ARG A 122 1.664 -10.411 14.055 1.00 61.31 H new ATOM 0 HG2 ARG A 122 3.736 -10.514 13.179 1.00 74.22 H new ATOM 0 HG3 ARG A 122 4.088 -8.854 13.615 1.00 74.22 H new ATOM 0 HD2 ARG A 122 4.235 -11.225 15.520 1.00 4.34 H new ATOM 0 HD3 ARG A 122 5.613 -10.497 14.718 1.00 4.34 H new ATOM 0 HE ARG A 122 4.097 -9.390 16.993 1.00 21.41 H new ATOM 0 HH11 ARG A 122 6.434 -8.823 14.409 1.00 71.43 H new ATOM 0 HH12 ARG A 122 7.140 -7.410 15.201 1.00 71.43 H new ATOM 0 HH21 ARG A 122 5.007 -7.573 18.002 1.00 60.40 H new ATOM 0 HH22 ARG A 122 6.335 -6.705 17.226 1.00 60.40 H new ATOM 1908 N ILE A 123 1.995 -7.346 16.351 1.00 40.40 N ATOM 1909 CA ILE A 123 2.475 -6.389 17.340 1.00 45.51 C ATOM 1910 C ILE A 123 2.697 -7.059 18.691 1.00 23.13 C ATOM 1911 O ILE A 123 1.903 -7.897 19.119 1.00 53.40 O ATOM 1912 CB ILE A 123 1.490 -5.218 17.516 1.00 60.13 C ATOM 1913 CG1 ILE A 123 1.502 -4.322 16.276 1.00 71.15 C ATOM 1914 CG2 ILE A 123 1.839 -4.415 18.760 1.00 54.43 C ATOM 1915 CD1 ILE A 123 0.532 -3.164 16.358 1.00 44.14 C ATOM 0 H ILE A 123 1.467 -8.127 16.741 1.00 40.40 H new ATOM 0 HA ILE A 123 3.424 -6.002 16.969 1.00 45.51 H new ATOM 0 HB ILE A 123 0.485 -5.623 17.639 1.00 60.13 H new ATOM 0 HG12 ILE A 123 2.509 -3.932 16.129 1.00 71.15 H new ATOM 0 HG13 ILE A 123 1.263 -4.925 15.400 1.00 71.15 H new ATOM 0 HG21 ILE A 123 1.134 -3.591 18.871 1.00 54.43 H new ATOM 0 HG22 ILE A 123 1.784 -5.060 19.637 1.00 54.43 H new ATOM 0 HG23 ILE A 123 2.850 -4.018 18.665 1.00 54.43 H new ATOM 0 HD11 ILE A 123 0.594 -2.572 15.445 1.00 44.14 H new ATOM 0 HD12 ILE A 123 -0.482 -3.546 16.474 1.00 44.14 H new ATOM 0 HD13 ILE A 123 0.784 -2.538 17.214 1.00 44.14 H new ATOM 1927 N VAL A 124 3.782 -6.684 19.361 1.00 5.31 N ATOM 1928 CA VAL A 124 4.108 -7.246 20.666 1.00 21.32 C ATOM 1929 C VAL A 124 4.344 -6.147 21.695 1.00 10.43 C ATOM 1930 O VAL A 124 4.904 -5.096 21.381 1.00 23.30 O ATOM 1931 CB VAL A 124 5.358 -8.144 20.595 1.00 52.25 C ATOM 1932 CG1 VAL A 124 5.824 -8.522 21.992 1.00 63.41 C ATOM 1933 CG2 VAL A 124 5.074 -9.386 19.763 1.00 1.05 C ATOM 0 H VAL A 124 4.451 -5.993 19.021 1.00 5.31 H new ATOM 0 HA VAL A 124 3.253 -7.849 20.972 1.00 21.32 H new ATOM 0 HB VAL A 124 6.159 -7.586 20.111 1.00 52.25 H new ATOM 0 HG11 VAL A 124 6.708 -9.156 21.922 1.00 63.41 H new ATOM 0 HG12 VAL A 124 6.069 -7.619 22.551 1.00 63.41 H new ATOM 0 HG13 VAL A 124 5.030 -9.062 22.507 1.00 63.41 H new ATOM 0 HG21 VAL A 124 5.967 -10.009 19.723 1.00 1.05 H new ATOM 0 HG22 VAL A 124 4.259 -9.949 20.217 1.00 1.05 H new ATOM 0 HG23 VAL A 124 4.792 -9.090 18.752 1.00 1.05 H new ATOM 1943 N LYS A 125 3.913 -6.395 22.927 1.00 1.34 N ATOM 1944 CA LYS A 125 4.078 -5.427 24.006 1.00 62.14 C ATOM 1945 C LYS A 125 5.201 -5.849 24.948 1.00 40.20 C ATOM 1946 O LYS A 125 4.972 -6.095 26.131 1.00 33.52 O ATOM 1947 CB LYS A 125 2.771 -5.276 24.788 1.00 64.14 C ATOM 1948 CG LYS A 125 1.784 -4.319 24.143 1.00 11.20 C ATOM 1949 CD LYS A 125 0.945 -5.013 23.083 1.00 44.11 C ATOM 1950 CE LYS A 125 0.202 -4.009 22.215 1.00 63.14 C ATOM 1951 NZ LYS A 125 -1.020 -4.601 21.605 1.00 74.32 N ATOM 0 H LYS A 125 3.446 -7.259 23.204 1.00 1.34 H new ATOM 0 HA LYS A 125 4.341 -4.467 23.562 1.00 62.14 H new ATOM 0 HB2 LYS A 125 2.302 -6.255 24.889 1.00 64.14 H new ATOM 0 HB3 LYS A 125 2.998 -4.926 25.795 1.00 64.14 H new ATOM 0 HG2 LYS A 125 1.131 -3.899 24.908 1.00 11.20 H new ATOM 0 HG3 LYS A 125 2.324 -3.486 23.693 1.00 11.20 H new ATOM 0 HD2 LYS A 125 1.587 -5.632 22.457 1.00 44.11 H new ATOM 0 HD3 LYS A 125 0.229 -5.680 23.563 1.00 44.11 H new ATOM 0 HE2 LYS A 125 -0.075 -3.144 22.817 1.00 63.14 H new ATOM 0 HE3 LYS A 125 0.864 -3.650 21.427 1.00 63.14 H new ATOM 0 HZ1 LYS A 125 -1.498 -3.885 21.021 1.00 74.32 H new ATOM 0 HZ2 LYS A 125 -0.753 -5.411 21.010 1.00 74.32 H new ATOM 0 HZ3 LYS A 125 -1.664 -4.920 22.357 1.00 74.32 H new ATOM 1965 N GLY A 126 6.417 -5.928 24.415 1.00 74.20 N ATOM 1966 CA GLY A 126 7.557 -6.319 25.223 1.00 11.12 C ATOM 1967 C GLY A 126 8.860 -6.267 24.451 1.00 61.23 C ATOM 1968 O GLY A 126 9.031 -5.430 23.564 1.00 22.42 O ATOM 0 H GLY A 126 6.632 -5.728 23.438 1.00 74.20 H new ATOM 0 HA2 GLY A 126 7.626 -5.663 26.090 1.00 11.12 H new ATOM 0 HA3 GLY A 126 7.402 -7.330 25.600 1.00 11.12 H new ATOM 1972 N SER A 127 9.782 -7.163 24.788 1.00 3.12 N ATOM 1973 CA SER A 127 11.079 -7.212 24.124 1.00 62.45 C ATOM 1974 C SER A 127 11.428 -8.641 23.719 1.00 61.41 C ATOM 1975 O SER A 127 11.959 -9.413 24.519 1.00 15.40 O ATOM 1976 CB SER A 127 12.167 -6.650 25.040 1.00 44.41 C ATOM 1977 OG SER A 127 13.395 -7.333 24.854 1.00 72.05 O ATOM 0 H SER A 127 9.655 -7.865 25.517 1.00 3.12 H new ATOM 0 HA SER A 127 11.021 -6.601 23.223 1.00 62.45 H new ATOM 0 HB2 SER A 127 12.304 -5.588 24.837 1.00 44.41 H new ATOM 0 HB3 SER A 127 11.852 -6.738 26.080 1.00 44.41 H new ATOM 0 HG SER A 127 13.272 -8.286 25.046 1.00 72.05 H new ATOM 1983 N ILE A 128 11.126 -8.987 22.472 1.00 44.22 N ATOM 1984 CA ILE A 128 11.409 -10.322 21.960 1.00 74.10 C ATOM 1985 C ILE A 128 12.906 -10.612 21.975 1.00 13.42 C ATOM 1986 O ILE A 128 13.725 -9.699 21.880 1.00 25.32 O ATOM 1987 CB ILE A 128 10.878 -10.499 20.525 1.00 14.21 C ATOM 1988 CG1 ILE A 128 11.344 -9.342 19.639 1.00 12.43 C ATOM 1989 CG2 ILE A 128 9.359 -10.591 20.530 1.00 40.10 C ATOM 1990 CD1 ILE A 128 11.672 -9.759 18.223 1.00 23.20 C ATOM 0 H ILE A 128 10.685 -8.361 21.798 1.00 44.22 H new ATOM 0 HA ILE A 128 10.899 -11.026 22.617 1.00 74.10 H new ATOM 0 HB ILE A 128 11.278 -11.428 20.117 1.00 14.21 H new ATOM 0 HG12 ILE A 128 10.566 -8.579 19.613 1.00 12.43 H new ATOM 0 HG13 ILE A 128 12.225 -8.884 20.088 1.00 12.43 H new ATOM 0 HG21 ILE A 128 8.999 -10.716 19.509 1.00 40.10 H new ATOM 0 HG22 ILE A 128 9.048 -11.445 21.131 1.00 40.10 H new ATOM 0 HG23 ILE A 128 8.941 -9.678 20.953 1.00 40.10 H new ATOM 0 HD11 ILE A 128 11.995 -8.888 17.653 1.00 23.20 H new ATOM 0 HD12 ILE A 128 12.471 -10.500 18.238 1.00 23.20 H new ATOM 0 HD13 ILE A 128 10.786 -10.190 17.756 1.00 23.20 H new ATOM 2002 N ASN A 129 13.255 -11.889 22.094 1.00 53.52 N ATOM 2003 CA ASN A 129 14.654 -12.299 22.120 1.00 31.20 C ATOM 2004 C ASN A 129 15.142 -12.658 20.720 1.00 51.02 C ATOM 2005 O ASN A 129 14.377 -12.618 19.757 1.00 61.33 O ATOM 2006 CB ASN A 129 14.839 -13.493 23.058 1.00 20.44 C ATOM 2007 CG ASN A 129 14.995 -13.072 24.507 1.00 42.13 C ATOM 2008 OD1 ASN A 129 14.741 -11.921 24.861 1.00 54.43 O ATOM 2009 ND2 ASN A 129 15.416 -14.005 25.352 1.00 21.43 N ATOM 0 H ASN A 129 12.589 -12.657 22.174 1.00 53.52 H new ATOM 0 HA ASN A 129 15.246 -11.461 22.488 1.00 31.20 H new ATOM 0 HB2 ASN A 129 13.981 -14.160 22.967 1.00 20.44 H new ATOM 0 HB3 ASN A 129 15.718 -14.060 22.751 1.00 20.44 H new ATOM 0 HD21 ASN A 129 15.541 -13.780 26.339 1.00 21.43 H new ATOM 0 HD22 ASN A 129 15.615 -14.947 25.014 1.00 21.43 H new ATOM 2016 N GLU A 130 16.420 -13.009 20.616 1.00 1.51 N ATOM 2017 CA GLU A 130 17.010 -13.374 19.333 1.00 34.04 C ATOM 2018 C GLU A 130 16.180 -14.452 18.641 1.00 5.10 C ATOM 2019 O GLU A 130 15.492 -14.184 17.657 1.00 14.33 O ATOM 2020 CB GLU A 130 18.445 -13.866 19.529 1.00 62.15 C ATOM 2021 CG GLU A 130 19.492 -12.939 18.935 1.00 4.34 C ATOM 2022 CD GLU A 130 20.567 -12.556 19.935 1.00 35.42 C ATOM 2023 OE1 GLU A 130 21.536 -13.329 20.088 1.00 72.00 O ATOM 2024 OE2 GLU A 130 20.438 -11.486 20.565 1.00 41.34 O ATOM 0 H GLU A 130 17.066 -13.048 21.404 1.00 1.51 H new ATOM 0 HA GLU A 130 17.022 -12.487 18.700 1.00 34.04 H new ATOM 0 HB2 GLU A 130 18.638 -13.982 20.595 1.00 62.15 H new ATOM 0 HB3 GLU A 130 18.547 -14.853 19.077 1.00 62.15 H new ATOM 0 HG2 GLU A 130 19.956 -13.424 18.076 1.00 4.34 H new ATOM 0 HG3 GLU A 130 19.005 -12.036 18.567 1.00 4.34 H new ATOM 2031 N ALA A 131 16.253 -15.672 19.162 1.00 23.24 N ATOM 2032 CA ALA A 131 15.509 -16.790 18.596 1.00 22.53 C ATOM 2033 C ALA A 131 14.041 -16.429 18.398 1.00 43.34 C ATOM 2034 O ALA A 131 13.392 -16.919 17.474 1.00 11.04 O ATOM 2035 CB ALA A 131 15.637 -18.015 19.490 1.00 73.54 C ATOM 0 H ALA A 131 16.820 -15.911 19.975 1.00 23.24 H new ATOM 0 HA ALA A 131 15.934 -17.020 17.619 1.00 22.53 H new ATOM 0 HB1 ALA A 131 15.076 -18.843 19.055 1.00 73.54 H new ATOM 0 HB2 ALA A 131 16.687 -18.294 19.577 1.00 73.54 H new ATOM 0 HB3 ALA A 131 15.239 -17.787 20.479 1.00 73.54 H new ATOM 2041 N GLN A 132 13.525 -15.569 19.270 1.00 2.00 N ATOM 2042 CA GLN A 132 12.133 -15.143 19.190 1.00 32.51 C ATOM 2043 C GLN A 132 11.887 -14.318 17.931 1.00 22.13 C ATOM 2044 O GLN A 132 10.911 -14.537 17.215 1.00 51.32 O ATOM 2045 CB GLN A 132 11.754 -14.331 20.429 1.00 0.52 C ATOM 2046 CG GLN A 132 10.800 -15.056 21.364 1.00 11.24 C ATOM 2047 CD GLN A 132 11.143 -14.846 22.826 1.00 22.10 C ATOM 2048 OE1 GLN A 132 11.435 -13.729 23.253 1.00 50.40 O ATOM 2049 NE2 GLN A 132 11.110 -15.923 23.603 1.00 41.34 N ATOM 0 H GLN A 132 14.050 -15.154 20.040 1.00 2.00 H new ATOM 0 HA GLN A 132 11.509 -16.035 19.145 1.00 32.51 H new ATOM 0 HB2 GLN A 132 12.661 -14.075 20.976 1.00 0.52 H new ATOM 0 HB3 GLN A 132 11.297 -13.393 20.113 1.00 0.52 H new ATOM 0 HG2 GLN A 132 9.783 -14.709 21.180 1.00 11.24 H new ATOM 0 HG3 GLN A 132 10.818 -16.123 21.140 1.00 11.24 H new ATOM 0 HE21 GLN A 132 10.863 -16.830 23.207 1.00 41.34 H new ATOM 0 HE22 GLN A 132 11.332 -15.843 24.595 1.00 41.34 H new ATOM 2058 N ALA A 133 12.780 -13.369 17.669 1.00 54.04 N ATOM 2059 CA ALA A 133 12.660 -12.512 16.495 1.00 25.15 C ATOM 2060 C ALA A 133 12.634 -13.337 15.213 1.00 33.24 C ATOM 2061 O ALA A 133 11.869 -13.047 14.292 1.00 23.31 O ATOM 2062 CB ALA A 133 13.804 -11.509 16.456 1.00 31.12 C ATOM 0 H ALA A 133 13.593 -13.174 18.253 1.00 54.04 H new ATOM 0 HA ALA A 133 11.717 -11.970 16.566 1.00 25.15 H new ATOM 0 HB1 ALA A 133 13.703 -10.875 15.575 1.00 31.12 H new ATOM 0 HB2 ALA A 133 13.776 -10.890 17.353 1.00 31.12 H new ATOM 0 HB3 ALA A 133 14.754 -12.042 16.412 1.00 31.12 H new ATOM 2068 N LEU A 134 13.473 -14.366 15.160 1.00 52.42 N ATOM 2069 CA LEU A 134 13.546 -15.233 13.989 1.00 30.23 C ATOM 2070 C LEU A 134 12.199 -15.894 13.716 1.00 55.20 C ATOM 2071 O LEU A 134 11.687 -15.844 12.598 1.00 63.23 O ATOM 2072 CB LEU A 134 14.620 -16.304 14.190 1.00 42.43 C ATOM 2073 CG LEU A 134 16.028 -15.792 14.500 1.00 75.30 C ATOM 2074 CD1 LEU A 134 16.844 -16.868 15.200 1.00 51.30 C ATOM 2075 CD2 LEU A 134 16.723 -15.338 13.225 1.00 11.51 C ATOM 0 H LEU A 134 14.112 -14.620 15.914 1.00 52.42 H new ATOM 0 HA LEU A 134 13.810 -14.618 13.128 1.00 30.23 H new ATOM 0 HB2 LEU A 134 14.305 -16.958 15.003 1.00 42.43 H new ATOM 0 HB3 LEU A 134 14.668 -16.916 13.289 1.00 42.43 H new ATOM 0 HG LEU A 134 15.944 -14.935 15.169 1.00 75.30 H new ATOM 0 HD11 LEU A 134 17.843 -16.487 15.413 1.00 51.30 H new ATOM 0 HD12 LEU A 134 16.355 -17.146 16.134 1.00 51.30 H new ATOM 0 HD13 LEU A 134 16.920 -17.744 14.556 1.00 51.30 H new ATOM 0 HD21 LEU A 134 17.723 -14.977 13.465 1.00 11.51 H new ATOM 0 HD22 LEU A 134 16.796 -16.176 12.532 1.00 11.51 H new ATOM 0 HD23 LEU A 134 16.148 -14.535 12.764 1.00 11.51 H new ATOM 2087 N ALA A 135 11.628 -16.510 14.746 1.00 72.01 N ATOM 2088 CA ALA A 135 10.338 -17.176 14.618 1.00 73.41 C ATOM 2089 C ALA A 135 9.206 -16.162 14.495 1.00 34.24 C ATOM 2090 O ALA A 135 8.116 -16.487 14.021 1.00 1.32 O ATOM 2091 CB ALA A 135 10.099 -18.096 15.806 1.00 33.21 C ATOM 0 H ALA A 135 12.039 -16.562 15.678 1.00 72.01 H new ATOM 0 HA ALA A 135 10.355 -17.774 13.707 1.00 73.41 H new ATOM 0 HB1 ALA A 135 9.132 -18.587 15.697 1.00 33.21 H new ATOM 0 HB2 ALA A 135 10.886 -18.849 15.847 1.00 33.21 H new ATOM 0 HB3 ALA A 135 10.108 -17.512 16.726 1.00 33.21 H new ATOM 2097 N LEU A 136 9.469 -14.934 14.926 1.00 3.50 N ATOM 2098 CA LEU A 136 8.472 -13.871 14.865 1.00 13.12 C ATOM 2099 C LEU A 136 8.320 -13.347 13.441 1.00 43.12 C ATOM 2100 O LEU A 136 7.255 -12.863 13.057 1.00 60.00 O ATOM 2101 CB LEU A 136 8.859 -12.726 15.803 1.00 21.43 C ATOM 2102 CG LEU A 136 7.859 -11.574 15.905 1.00 43.14 C ATOM 2103 CD1 LEU A 136 6.770 -11.899 16.915 1.00 70.54 C ATOM 2104 CD2 LEU A 136 8.570 -10.283 16.282 1.00 5.40 C ATOM 0 H LEU A 136 10.365 -14.649 15.322 1.00 3.50 H new ATOM 0 HA LEU A 136 7.516 -14.286 15.184 1.00 13.12 H new ATOM 0 HB2 LEU A 136 9.012 -13.137 16.801 1.00 21.43 H new ATOM 0 HB3 LEU A 136 9.816 -12.321 15.474 1.00 21.43 H new ATOM 0 HG LEU A 136 7.392 -11.437 14.930 1.00 43.14 H new ATOM 0 HD11 LEU A 136 6.068 -11.067 16.973 1.00 70.54 H new ATOM 0 HD12 LEU A 136 6.241 -12.799 16.602 1.00 70.54 H new ATOM 0 HD13 LEU A 136 7.219 -12.064 17.894 1.00 70.54 H new ATOM 0 HD21 LEU A 136 7.843 -9.474 16.350 1.00 5.40 H new ATOM 0 HD22 LEU A 136 9.065 -10.408 17.245 1.00 5.40 H new ATOM 0 HD23 LEU A 136 9.312 -10.041 15.521 1.00 5.40 H new ATOM 2116 N ILE A 137 9.392 -13.449 12.662 1.00 53.35 N ATOM 2117 CA ILE A 137 9.376 -12.988 11.279 1.00 64.34 C ATOM 2118 C ILE A 137 9.066 -14.134 10.321 1.00 13.22 C ATOM 2119 O ILE A 137 8.252 -13.990 9.409 1.00 73.32 O ATOM 2120 CB ILE A 137 10.722 -12.353 10.882 1.00 61.12 C ATOM 2121 CG1 ILE A 137 11.041 -11.169 11.796 1.00 3.33 C ATOM 2122 CG2 ILE A 137 10.691 -11.912 9.426 1.00 12.01 C ATOM 2123 CD1 ILE A 137 12.491 -11.109 12.224 1.00 30.22 C ATOM 0 H ILE A 137 10.281 -13.846 12.965 1.00 53.35 H new ATOM 0 HA ILE A 137 8.592 -12.234 11.207 1.00 64.34 H new ATOM 0 HB ILE A 137 11.508 -13.100 10.998 1.00 61.12 H new ATOM 0 HG12 ILE A 137 10.784 -10.243 11.281 1.00 3.33 H new ATOM 0 HG13 ILE A 137 10.411 -11.225 12.683 1.00 3.33 H new ATOM 0 HG21 ILE A 137 11.649 -11.465 9.161 1.00 12.01 H new ATOM 0 HG22 ILE A 137 10.504 -12.776 8.788 1.00 12.01 H new ATOM 0 HG23 ILE A 137 9.897 -11.178 9.285 1.00 12.01 H new ATOM 0 HD11 ILE A 137 12.644 -10.245 12.870 1.00 30.22 H new ATOM 0 HD12 ILE A 137 12.748 -12.018 12.767 1.00 30.22 H new ATOM 0 HD13 ILE A 137 13.127 -11.021 11.343 1.00 30.22 H new ATOM 2135 N ARG A 138 9.718 -15.271 10.537 1.00 63.33 N ATOM 2136 CA ARG A 138 9.511 -16.442 9.693 1.00 24.44 C ATOM 2137 C ARG A 138 8.076 -16.947 9.807 1.00 20.50 C ATOM 2138 O ARG A 138 7.551 -17.569 8.883 1.00 40.21 O ATOM 2139 CB ARG A 138 10.487 -17.555 10.081 1.00 61.11 C ATOM 2140 CG ARG A 138 10.403 -18.779 9.183 1.00 11.22 C ATOM 2141 CD ARG A 138 11.734 -19.065 8.505 1.00 14.21 C ATOM 2142 NE ARG A 138 11.616 -20.102 7.484 1.00 53.14 N ATOM 2143 CZ ARG A 138 12.659 -20.676 6.895 1.00 41.41 C ATOM 2144 NH1 ARG A 138 13.892 -20.315 7.225 1.00 34.30 N ATOM 2145 NH2 ARG A 138 12.471 -21.612 5.974 1.00 32.31 N ATOM 0 H ARG A 138 10.394 -15.407 11.289 1.00 63.33 H new ATOM 0 HA ARG A 138 9.694 -16.151 8.659 1.00 24.44 H new ATOM 0 HB2 ARG A 138 11.503 -17.162 10.051 1.00 61.11 H new ATOM 0 HB3 ARG A 138 10.291 -17.856 11.110 1.00 61.11 H new ATOM 0 HG2 ARG A 138 10.101 -19.644 9.773 1.00 11.22 H new ATOM 0 HG3 ARG A 138 9.634 -18.624 8.426 1.00 11.22 H new ATOM 0 HD2 ARG A 138 12.113 -18.150 8.050 1.00 14.21 H new ATOM 0 HD3 ARG A 138 12.463 -19.375 9.254 1.00 14.21 H new ATOM 0 HE ARG A 138 10.681 -20.402 7.208 1.00 53.14 H new ATOM 0 HH11 ARG A 138 14.041 -19.595 7.932 1.00 34.30 H new ATOM 0 HH12 ARG A 138 14.691 -20.757 6.771 1.00 34.30 H new ATOM 0 HH21 ARG A 138 11.524 -21.892 5.717 1.00 32.31 H new ATOM 0 HH22 ARG A 138 13.273 -22.052 5.523 1.00 32.31 H new ATOM 2159 N ASP A 139 7.448 -16.677 10.946 1.00 53.23 N ATOM 2160 CA ASP A 139 6.073 -17.103 11.180 1.00 31.14 C ATOM 2161 C ASP A 139 5.111 -15.926 11.059 1.00 13.53 C ATOM 2162 O ASP A 139 5.161 -14.969 11.833 1.00 42.13 O ATOM 2163 CB ASP A 139 5.944 -17.743 12.564 1.00 71.04 C ATOM 2164 CG ASP A 139 4.647 -18.512 12.727 1.00 4.42 C ATOM 2165 OD1 ASP A 139 3.737 -18.324 11.893 1.00 71.51 O ATOM 2166 OD2 ASP A 139 4.544 -19.301 13.689 1.00 15.11 O ATOM 0 H ASP A 139 7.869 -16.165 11.722 1.00 53.23 H new ATOM 0 HA ASP A 139 5.813 -17.841 10.421 1.00 31.14 H new ATOM 0 HB2 ASP A 139 6.785 -18.416 12.730 1.00 71.04 H new ATOM 0 HB3 ASP A 139 6.001 -16.967 13.327 1.00 71.04 H new ATOM 2171 N PRO A 140 4.213 -15.994 10.065 1.00 31.32 N ATOM 2172 CA PRO A 140 3.222 -14.942 9.819 1.00 64.22 C ATOM 2173 C PRO A 140 2.157 -14.882 10.908 1.00 22.23 C ATOM 2174 O PRO A 140 1.525 -13.847 11.115 1.00 24.22 O ATOM 2175 CB PRO A 140 2.598 -15.349 8.482 1.00 73.11 C ATOM 2176 CG PRO A 140 2.795 -16.824 8.405 1.00 13.20 C ATOM 2177 CD PRO A 140 4.095 -17.105 9.105 1.00 3.13 C ATOM 0 HA PRO A 140 3.674 -13.950 9.810 1.00 64.22 H new ATOM 0 HB2 PRO A 140 1.540 -15.088 8.443 1.00 73.11 H new ATOM 0 HB3 PRO A 140 3.082 -14.841 7.648 1.00 73.11 H new ATOM 0 HG2 PRO A 140 1.971 -17.353 8.884 1.00 13.20 H new ATOM 0 HG3 PRO A 140 2.829 -17.160 7.369 1.00 13.20 H new ATOM 0 HD2 PRO A 140 4.079 -18.071 9.609 1.00 3.13 H new ATOM 0 HD3 PRO A 140 4.932 -17.123 8.407 1.00 3.13 H new ATOM 2185 N ASN A 141 1.964 -15.999 11.602 1.00 33.04 N ATOM 2186 CA ASN A 141 0.974 -16.073 12.671 1.00 3.13 C ATOM 2187 C ASN A 141 1.639 -15.941 14.038 1.00 22.31 C ATOM 2188 O ASN A 141 1.097 -16.388 15.049 1.00 43.52 O ATOM 2189 CB ASN A 141 0.204 -17.393 12.591 1.00 1.53 C ATOM 2190 CG ASN A 141 -1.296 -17.183 12.513 1.00 2.22 C ATOM 2191 OD1 ASN A 141 -1.782 -16.392 11.704 1.00 21.14 O ATOM 2192 ND2 ASN A 141 -2.037 -17.892 13.357 1.00 61.15 N ATOM 0 H ASN A 141 2.480 -16.865 11.444 1.00 33.04 H new ATOM 0 HA ASN A 141 0.276 -15.245 12.544 1.00 3.13 H new ATOM 0 HB2 ASN A 141 0.536 -17.952 11.716 1.00 1.53 H new ATOM 0 HB3 ASN A 141 0.438 -18.001 13.465 1.00 1.53 H new ATOM 0 HD21 ASN A 141 -3.052 -17.793 13.352 1.00 61.15 H new ATOM 0 HD22 ASN A 141 -1.591 -18.536 14.010 1.00 61.15 H new ATOM 2199 N ALA A 142 2.816 -15.325 14.060 1.00 4.04 N ATOM 2200 CA ALA A 142 3.554 -15.132 15.303 1.00 42.13 C ATOM 2201 C ALA A 142 2.833 -14.153 16.223 1.00 41.32 C ATOM 2202 O ALA A 142 2.791 -12.952 15.956 1.00 54.32 O ATOM 2203 CB ALA A 142 4.964 -14.642 15.008 1.00 3.04 C ATOM 0 H ALA A 142 3.279 -14.951 13.232 1.00 4.04 H new ATOM 0 HA ALA A 142 3.614 -16.093 15.814 1.00 42.13 H new ATOM 0 HB1 ALA A 142 5.504 -14.502 15.944 1.00 3.04 H new ATOM 0 HB2 ALA A 142 5.484 -15.378 14.396 1.00 3.04 H new ATOM 0 HB3 ALA A 142 4.915 -13.694 14.472 1.00 3.04 H new