USER MOD reduce.3.24.130724 H: found=0, std=0, add=1045, rem=0, adj=24 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 150:sc= 0 USER MOD Set 1.2: A 59 ASN :FLIP amide:sc= -0.619 F(o=-1.5,f=-0.62) USER MOD Set 2.1: A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 30 LYS NZ :NH3+ -179:sc= 0.178 (180deg=0) USER MOD Set 3.2: A 46 THR OG1 : rot -90:sc= 0.171 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -68:sc= 0.553 USER MOD Single : A 14 ASN : amide:sc= -0.0746 K(o=-0.075,f=-1.5!) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -1.9 K(o=-1.9,f=-3.4) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0293) USER MOD Single : A 56 SER OG : rot 180:sc= -0.0241 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -49:sc= 0.119 USER MOD Single : A 65 SER OG : rot 180:sc= -0.0116 USER MOD Single : A 70 HIS : no HD1:sc=-0.00873 X(o=-0.0087,f=-0.13) USER MOD Single : A 72 LYS NZ :NH3+ -123:sc= -2.02 (180deg=-3.46!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.279 K(o=-0.28,f=-1.7!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 138:sc= 0.224 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 86 TYR OH : rot 180:sc= -0.0054 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0426 USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 98 THR OG1 : rot 80:sc= 1.14 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.332 X(o=-0.33,f=-0.76) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot -99:sc= 1.13 USER MOD Single : A 110 SER OG : rot 111:sc= 1.22 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 94:sc= 0.471 USER MOD Single : A 129 ASN : amide:sc= -0.192 K(o=-0.19,f=-0.98) USER MOD Single : A 132 GLN : amide:sc= -0.0772 K(o=-0.077,f=-4.6!) USER MOD Single : A 141 ASN : amide:sc= -0.0829 K(o=-0.083,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 123 N LEU A 9 8.534 9.476 8.612 1.00 71.22 N ATOM 124 CA LEU A 9 9.309 9.315 9.837 1.00 30.12 C ATOM 125 C LEU A 9 10.755 9.753 9.628 1.00 0.13 C ATOM 126 O LEU A 9 11.287 9.669 8.521 1.00 23.53 O ATOM 127 CB LEU A 9 9.268 7.858 10.303 1.00 54.44 C ATOM 128 CG LEU A 9 8.171 7.506 11.308 1.00 30.12 C ATOM 129 CD1 LEU A 9 8.226 6.028 11.661 1.00 34.33 C ATOM 130 CD2 LEU A 9 8.301 8.361 12.561 1.00 61.55 C ATOM 0 HA LEU A 9 8.864 9.948 10.605 1.00 30.12 H new ATOM 0 HB2 LEU A 9 9.149 7.220 9.427 1.00 54.44 H new ATOM 0 HB3 LEU A 9 10.233 7.612 10.747 1.00 54.44 H new ATOM 0 HG LEU A 9 7.204 7.714 10.850 1.00 30.12 H new ATOM 0 HD11 LEU A 9 7.438 5.795 12.377 1.00 34.33 H new ATOM 0 HD12 LEU A 9 8.083 5.433 10.759 1.00 34.33 H new ATOM 0 HD13 LEU A 9 9.196 5.795 12.100 1.00 34.33 H new ATOM 0 HD21 LEU A 9 7.512 8.097 13.265 1.00 61.55 H new ATOM 0 HD22 LEU A 9 9.273 8.185 13.022 1.00 61.55 H new ATOM 0 HD23 LEU A 9 8.211 9.414 12.294 1.00 61.55 H new ATOM 142 N LYS A 10 11.387 10.220 10.700 1.00 71.12 N ATOM 143 CA LYS A 10 12.773 10.668 10.636 1.00 11.35 C ATOM 144 C LYS A 10 13.585 10.092 11.792 1.00 34.20 C ATOM 145 O LYS A 10 13.034 9.728 12.832 1.00 55.53 O ATOM 146 CB LYS A 10 12.838 12.197 10.666 1.00 12.04 C ATOM 147 CG LYS A 10 12.017 12.819 11.783 1.00 73.13 C ATOM 148 CD LYS A 10 12.385 14.277 12.000 1.00 52.01 C ATOM 149 CE LYS A 10 11.151 15.133 12.243 1.00 43.11 C ATOM 150 NZ LYS A 10 10.713 15.838 11.006 1.00 30.15 N ATOM 0 H LYS A 10 10.961 10.298 11.623 1.00 71.12 H new ATOM 0 HA LYS A 10 13.201 10.310 9.700 1.00 11.35 H new ATOM 0 HB2 LYS A 10 13.878 12.506 10.775 1.00 12.04 H new ATOM 0 HB3 LYS A 10 12.489 12.586 9.710 1.00 12.04 H new ATOM 0 HG2 LYS A 10 10.957 12.742 11.542 1.00 73.13 H new ATOM 0 HG3 LYS A 10 12.176 12.262 12.706 1.00 73.13 H new ATOM 0 HD2 LYS A 10 13.060 14.360 12.852 1.00 52.01 H new ATOM 0 HD3 LYS A 10 12.923 14.651 11.129 1.00 52.01 H new ATOM 0 HE2 LYS A 10 10.339 14.505 12.610 1.00 43.11 H new ATOM 0 HE3 LYS A 10 11.364 15.865 13.022 1.00 43.11 H new ATOM 0 HZ1 LYS A 10 9.870 16.411 11.213 1.00 30.15 H new ATOM 0 HZ2 LYS A 10 11.478 16.457 10.670 1.00 30.15 H new ATOM 0 HZ3 LYS A 10 10.485 15.139 10.270 1.00 30.15 H new ATOM 164 N THR A 11 14.898 10.012 11.605 1.00 64.44 N ATOM 165 CA THR A 11 15.786 9.480 12.631 1.00 31.20 C ATOM 166 C THR A 11 16.469 10.603 13.403 1.00 32.11 C ATOM 167 O THR A 11 16.469 11.755 12.971 1.00 43.14 O ATOM 168 CB THR A 11 16.863 8.562 12.022 1.00 12.21 C ATOM 169 OG1 THR A 11 17.618 9.279 11.039 1.00 23.41 O ATOM 170 CG2 THR A 11 16.230 7.333 11.387 1.00 43.35 C ATOM 0 H THR A 11 15.371 10.309 10.751 1.00 64.44 H new ATOM 0 HA THR A 11 15.167 8.898 13.313 1.00 31.20 H new ATOM 0 HB THR A 11 17.527 8.236 12.822 1.00 12.21 H new ATOM 0 HG1 THR A 11 17.047 9.474 10.266 1.00 23.41 H new ATOM 0 HG21 THR A 11 17.010 6.700 10.964 1.00 43.35 H new ATOM 0 HG22 THR A 11 15.680 6.774 12.145 1.00 43.35 H new ATOM 0 HG23 THR A 11 15.546 7.643 10.597 1.00 43.35 H new ATOM 178 N ALA A 12 17.050 10.259 14.548 1.00 42.43 N ATOM 179 CA ALA A 12 17.739 11.239 15.379 1.00 61.04 C ATOM 180 C ALA A 12 18.919 11.856 14.636 1.00 41.23 C ATOM 181 O ALA A 12 19.433 12.904 15.029 1.00 61.44 O ATOM 182 CB ALA A 12 18.208 10.595 16.675 1.00 13.01 C ATOM 0 H ALA A 12 17.057 9.310 14.921 1.00 42.43 H new ATOM 0 HA ALA A 12 17.035 12.037 15.616 1.00 61.04 H new ATOM 0 HB1 ALA A 12 18.721 11.338 17.286 1.00 13.01 H new ATOM 0 HB2 ALA A 12 17.348 10.208 17.221 1.00 13.01 H new ATOM 0 HB3 ALA A 12 18.892 9.777 16.448 1.00 13.01 H new ATOM 188 N ASP A 13 19.344 11.200 13.561 1.00 1.54 N ATOM 189 CA ASP A 13 20.464 11.685 12.763 1.00 51.31 C ATOM 190 C ASP A 13 19.982 12.637 11.673 1.00 40.24 C ATOM 191 O ASP A 13 20.739 13.002 10.774 1.00 23.32 O ATOM 192 CB ASP A 13 21.217 10.511 12.136 1.00 40.12 C ATOM 193 CG ASP A 13 21.266 9.301 13.048 1.00 0.21 C ATOM 194 OD1 ASP A 13 21.615 9.468 14.235 1.00 23.43 O ATOM 195 OD2 ASP A 13 20.956 8.188 12.575 1.00 70.33 O ATOM 0 H ASP A 13 18.930 10.331 13.223 1.00 1.54 H new ATOM 0 HA ASP A 13 21.140 12.229 13.423 1.00 51.31 H new ATOM 0 HB2 ASP A 13 20.737 10.235 11.197 1.00 40.12 H new ATOM 0 HB3 ASP A 13 22.233 10.822 11.895 1.00 40.12 H new ATOM 200 N ASN A 14 18.717 13.035 11.758 1.00 33.12 N ATOM 201 CA ASN A 14 18.133 13.943 10.778 1.00 41.23 C ATOM 202 C ASN A 14 18.088 13.297 9.396 1.00 24.24 C ATOM 203 O ASN A 14 18.373 13.943 8.388 1.00 55.31 O ATOM 204 CB ASN A 14 18.934 15.246 10.718 1.00 71.40 C ATOM 205 CG ASN A 14 18.111 16.407 10.195 1.00 14.05 C ATOM 206 OD1 ASN A 14 16.894 16.453 10.381 1.00 44.32 O ATOM 207 ND2 ASN A 14 18.772 17.352 9.538 1.00 1.40 N ATOM 0 H ASN A 14 18.076 12.743 12.496 1.00 33.12 H new ATOM 0 HA ASN A 14 17.112 14.165 11.089 1.00 41.23 H new ATOM 0 HB2 ASN A 14 19.305 15.487 11.714 1.00 71.40 H new ATOM 0 HB3 ASN A 14 19.805 15.105 10.078 1.00 71.40 H new ATOM 0 HD21 ASN A 14 18.271 18.158 9.163 1.00 1.40 H new ATOM 0 HD22 ASN A 14 19.781 17.272 9.408 1.00 1.40 H new ATOM 214 N ARG A 15 17.729 12.018 9.359 1.00 63.20 N ATOM 215 CA ARG A 15 17.648 11.284 8.102 1.00 33.31 C ATOM 216 C ARG A 15 16.326 10.528 7.999 1.00 61.04 C ATOM 217 O ARG A 15 15.703 10.177 9.001 1.00 1.30 O ATOM 218 CB ARG A 15 18.818 10.305 7.981 1.00 14.44 C ATOM 219 CG ARG A 15 19.913 10.779 7.040 1.00 0.12 C ATOM 220 CD ARG A 15 20.540 9.617 6.285 1.00 12.34 C ATOM 221 NE ARG A 15 20.380 9.753 4.840 1.00 14.32 N ATOM 222 CZ ARG A 15 21.089 9.064 3.954 1.00 61.41 C ATOM 223 NH1 ARG A 15 22.002 8.194 4.363 1.00 23.03 N ATOM 224 NH2 ARG A 15 20.885 9.243 2.655 1.00 24.10 N ATOM 0 H ARG A 15 17.490 11.469 10.185 1.00 63.20 H new ATOM 0 HA ARG A 15 17.700 12.004 7.286 1.00 33.31 H new ATOM 0 HB2 ARG A 15 19.246 10.140 8.970 1.00 14.44 H new ATOM 0 HB3 ARG A 15 18.442 9.343 7.632 1.00 14.44 H new ATOM 0 HG2 ARG A 15 19.499 11.495 6.330 1.00 0.12 H new ATOM 0 HG3 ARG A 15 20.682 11.302 7.609 1.00 0.12 H new ATOM 0 HD2 ARG A 15 21.601 9.557 6.528 1.00 12.34 H new ATOM 0 HD3 ARG A 15 20.084 8.683 6.614 1.00 12.34 H new ATOM 0 HE ARG A 15 19.685 10.414 4.492 1.00 14.32 H new ATOM 0 HH11 ARG A 15 22.161 8.053 5.361 1.00 23.03 H new ATOM 0 HH12 ARG A 15 22.545 7.666 3.680 1.00 23.03 H new ATOM 0 HH21 ARG A 15 20.183 9.911 2.336 1.00 24.10 H new ATOM 0 HH22 ARG A 15 21.430 8.713 1.975 1.00 24.10 H new ATOM 238 N PRO A 16 15.887 10.271 6.758 1.00 54.03 N ATOM 239 CA PRO A 16 14.635 9.555 6.494 1.00 63.44 C ATOM 240 C PRO A 16 14.720 8.081 6.874 1.00 33.54 C ATOM 241 O PRO A 16 15.669 7.388 6.508 1.00 52.43 O ATOM 242 CB PRO A 16 14.452 9.707 4.981 1.00 31.45 C ATOM 243 CG PRO A 16 15.830 9.908 4.451 1.00 35.42 C ATOM 244 CD PRO A 16 16.578 10.660 5.517 1.00 71.51 C ATOM 0 HA PRO A 16 13.806 9.953 7.080 1.00 63.44 H new ATOM 0 HB2 PRO A 16 13.986 8.822 4.548 1.00 31.45 H new ATOM 0 HB3 PRO A 16 13.809 10.554 4.743 1.00 31.45 H new ATOM 0 HG2 PRO A 16 16.309 8.953 4.238 1.00 35.42 H new ATOM 0 HG3 PRO A 16 15.811 10.470 3.517 1.00 35.42 H new ATOM 0 HD2 PRO A 16 17.632 10.383 5.540 1.00 71.51 H new ATOM 0 HD3 PRO A 16 16.535 11.737 5.354 1.00 71.51 H new ATOM 252 N ALA A 17 13.721 7.607 7.612 1.00 72.52 N ATOM 253 CA ALA A 17 13.681 6.214 8.040 1.00 64.31 C ATOM 254 C ALA A 17 13.321 5.293 6.879 1.00 21.43 C ATOM 255 O ALA A 17 13.475 4.075 6.970 1.00 32.32 O ATOM 256 CB ALA A 17 12.690 6.040 9.181 1.00 3.33 C ATOM 0 H ALA A 17 12.929 8.167 7.926 1.00 72.52 H new ATOM 0 HA ALA A 17 14.675 5.940 8.392 1.00 64.31 H new ATOM 0 HB1 ALA A 17 12.671 4.995 9.490 1.00 3.33 H new ATOM 0 HB2 ALA A 17 12.992 6.662 10.023 1.00 3.33 H new ATOM 0 HB3 ALA A 17 11.696 6.338 8.848 1.00 3.33 H new ATOM 262 N SER A 18 12.840 5.882 5.789 1.00 4.12 N ATOM 263 CA SER A 18 12.454 5.113 4.612 1.00 53.40 C ATOM 264 C SER A 18 13.657 4.387 4.018 1.00 31.02 C ATOM 265 O SER A 18 13.523 3.306 3.445 1.00 61.04 O ATOM 266 CB SER A 18 11.828 6.031 3.560 1.00 11.43 C ATOM 267 OG SER A 18 10.592 5.513 3.101 1.00 33.32 O ATOM 0 H SER A 18 12.708 6.889 5.697 1.00 4.12 H new ATOM 0 HA SER A 18 11.719 4.369 4.920 1.00 53.40 H new ATOM 0 HB2 SER A 18 11.675 7.023 3.984 1.00 11.43 H new ATOM 0 HB3 SER A 18 12.512 6.146 2.719 1.00 11.43 H new ATOM 0 HG SER A 18 10.212 6.119 2.431 1.00 33.32 H new ATOM 273 N VAL A 19 14.833 4.989 4.160 1.00 2.53 N ATOM 274 CA VAL A 19 16.061 4.401 3.640 1.00 44.03 C ATOM 275 C VAL A 19 16.287 3.005 4.210 1.00 0.54 C ATOM 276 O VAL A 19 16.806 2.121 3.529 1.00 42.22 O ATOM 277 CB VAL A 19 17.285 5.279 3.962 1.00 40.44 C ATOM 278 CG1 VAL A 19 18.562 4.621 3.461 1.00 14.10 C ATOM 279 CG2 VAL A 19 17.118 6.666 3.358 1.00 25.15 C ATOM 0 H VAL A 19 14.961 5.884 4.631 1.00 2.53 H new ATOM 0 HA VAL A 19 15.946 4.334 2.558 1.00 44.03 H new ATOM 0 HB VAL A 19 17.360 5.385 5.044 1.00 40.44 H new ATOM 0 HG11 VAL A 19 19.416 5.256 3.698 1.00 14.10 H new ATOM 0 HG12 VAL A 19 18.686 3.652 3.944 1.00 14.10 H new ATOM 0 HG13 VAL A 19 18.501 4.483 2.382 1.00 14.10 H new ATOM 0 HG21 VAL A 19 17.991 7.274 3.595 1.00 25.15 H new ATOM 0 HG22 VAL A 19 17.017 6.582 2.276 1.00 25.15 H new ATOM 0 HG23 VAL A 19 16.226 7.137 3.770 1.00 25.15 H new ATOM 289 N TYR A 20 15.893 2.815 5.464 1.00 22.45 N ATOM 290 CA TYR A 20 16.054 1.526 6.128 1.00 1.45 C ATOM 291 C TYR A 20 15.046 0.511 5.599 1.00 64.23 C ATOM 292 O TYR A 20 15.110 -0.675 5.928 1.00 40.54 O ATOM 293 CB TYR A 20 15.889 1.684 7.641 1.00 52.41 C ATOM 294 CG TYR A 20 16.993 2.488 8.290 1.00 22.51 C ATOM 295 CD1 TYR A 20 18.324 2.112 8.155 1.00 51.11 C ATOM 296 CD2 TYR A 20 16.706 3.623 9.038 1.00 34.32 C ATOM 297 CE1 TYR A 20 19.336 2.842 8.747 1.00 11.51 C ATOM 298 CE2 TYR A 20 17.711 4.360 9.633 1.00 42.13 C ATOM 299 CZ TYR A 20 19.025 3.966 9.485 1.00 74.33 C ATOM 300 OH TYR A 20 20.030 4.697 10.075 1.00 71.21 O ATOM 0 H TYR A 20 15.460 3.536 6.041 1.00 22.45 H new ATOM 0 HA TYR A 20 17.058 1.159 5.915 1.00 1.45 H new ATOM 0 HB2 TYR A 20 14.932 2.165 7.845 1.00 52.41 H new ATOM 0 HB3 TYR A 20 15.853 0.696 8.099 1.00 52.41 H new ATOM 0 HD1 TYR A 20 18.571 1.234 7.577 1.00 51.11 H new ATOM 0 HD2 TYR A 20 15.679 3.935 9.156 1.00 34.32 H new ATOM 0 HE1 TYR A 20 20.365 2.535 8.633 1.00 11.51 H new ATOM 0 HE2 TYR A 20 17.470 5.240 10.211 1.00 42.13 H new ATOM 0 HH TYR A 20 19.642 5.457 10.557 1.00 71.21 H new ATOM 310 N LEU A 21 14.117 0.984 4.776 1.00 71.31 N ATOM 311 CA LEU A 21 13.094 0.118 4.198 1.00 5.23 C ATOM 312 C LEU A 21 13.326 -0.076 2.703 1.00 3.32 C ATOM 313 O LEU A 21 13.258 0.876 1.925 1.00 73.45 O ATOM 314 CB LEU A 21 11.704 0.708 4.438 1.00 13.40 C ATOM 315 CG LEU A 21 11.603 1.764 5.540 1.00 64.12 C ATOM 316 CD1 LEU A 21 10.211 2.374 5.569 1.00 52.52 C ATOM 317 CD2 LEU A 21 11.950 1.158 6.892 1.00 44.11 C ATOM 0 H LEU A 21 14.050 1.962 4.494 1.00 71.31 H new ATOM 0 HA LEU A 21 13.158 -0.855 4.686 1.00 5.23 H new ATOM 0 HB2 LEU A 21 11.353 1.150 3.506 1.00 13.40 H new ATOM 0 HB3 LEU A 21 11.022 -0.107 4.680 1.00 13.40 H new ATOM 0 HG LEU A 21 12.320 2.556 5.324 1.00 64.12 H new ATOM 0 HD11 LEU A 21 10.158 3.123 6.359 1.00 52.52 H new ATOM 0 HD12 LEU A 21 10.000 2.844 4.609 1.00 52.52 H new ATOM 0 HD13 LEU A 21 9.475 1.593 5.760 1.00 52.52 H new ATOM 0 HD21 LEU A 21 11.873 1.923 7.664 1.00 44.11 H new ATOM 0 HD22 LEU A 21 11.258 0.346 7.115 1.00 44.11 H new ATOM 0 HD23 LEU A 21 12.968 0.770 6.866 1.00 44.11 H new ATOM 329 N LYS A 22 13.599 -1.315 2.308 1.00 41.52 N ATOM 330 CA LYS A 22 13.838 -1.636 0.906 1.00 54.33 C ATOM 331 C LYS A 22 14.149 -3.119 0.733 1.00 41.24 C ATOM 332 O LYS A 22 14.003 -3.908 1.666 1.00 0.25 O ATOM 333 CB LYS A 22 14.992 -0.794 0.358 1.00 41.23 C ATOM 334 CG LYS A 22 14.574 0.173 -0.737 1.00 20.22 C ATOM 335 CD LYS A 22 15.250 -0.154 -2.058 1.00 21.23 C ATOM 336 CE LYS A 22 14.597 0.584 -3.216 1.00 74.31 C ATOM 337 NZ LYS A 22 15.103 1.979 -3.341 1.00 74.43 N ATOM 0 H LYS A 22 13.660 -2.114 2.940 1.00 41.52 H new ATOM 0 HA LYS A 22 12.931 -1.406 0.347 1.00 54.33 H new ATOM 0 HB2 LYS A 22 15.440 -0.231 1.177 1.00 41.23 H new ATOM 0 HB3 LYS A 22 15.763 -1.459 -0.031 1.00 41.23 H new ATOM 0 HG2 LYS A 22 13.492 0.136 -0.862 1.00 20.22 H new ATOM 0 HG3 LYS A 22 14.826 1.191 -0.440 1.00 20.22 H new ATOM 0 HD2 LYS A 22 16.305 0.113 -2.004 1.00 21.23 H new ATOM 0 HD3 LYS A 22 15.202 -1.228 -2.236 1.00 21.23 H new ATOM 0 HE2 LYS A 22 14.787 0.044 -4.144 1.00 74.31 H new ATOM 0 HE3 LYS A 22 13.517 0.601 -3.073 1.00 74.31 H new ATOM 0 HZ1 LYS A 22 14.633 2.448 -4.142 1.00 74.43 H new ATOM 0 HZ2 LYS A 22 14.899 2.502 -2.465 1.00 74.43 H new ATOM 0 HZ3 LYS A 22 16.130 1.962 -3.503 1.00 74.43 H new ATOM 351 N LYS A 23 14.580 -3.492 -0.467 1.00 44.15 N ATOM 352 CA LYS A 23 14.916 -4.880 -0.763 1.00 53.21 C ATOM 353 C LYS A 23 13.668 -5.757 -0.745 1.00 12.23 C ATOM 354 O LYS A 23 13.750 -6.966 -0.527 1.00 44.30 O ATOM 355 CB LYS A 23 15.937 -5.406 0.248 1.00 14.13 C ATOM 356 CG LYS A 23 17.058 -4.426 0.546 1.00 65.22 C ATOM 357 CD LYS A 23 18.422 -5.086 0.426 1.00 32.30 C ATOM 358 CE LYS A 23 18.776 -5.374 -1.025 1.00 3.31 C ATOM 359 NZ LYS A 23 20.221 -5.138 -1.300 1.00 31.51 N ATOM 0 H LYS A 23 14.705 -2.852 -1.251 1.00 44.15 H new ATOM 0 HA LYS A 23 15.351 -4.918 -1.762 1.00 53.21 H new ATOM 0 HB2 LYS A 23 15.423 -5.650 1.177 1.00 14.13 H new ATOM 0 HB3 LYS A 23 16.367 -6.333 -0.131 1.00 14.13 H new ATOM 0 HG2 LYS A 23 16.999 -3.583 -0.143 1.00 65.22 H new ATOM 0 HG3 LYS A 23 16.934 -4.025 1.552 1.00 65.22 H new ATOM 0 HD2 LYS A 23 19.181 -4.438 0.865 1.00 32.30 H new ATOM 0 HD3 LYS A 23 18.429 -6.016 0.995 1.00 32.30 H new ATOM 0 HE2 LYS A 23 18.525 -6.408 -1.262 1.00 3.31 H new ATOM 0 HE3 LYS A 23 18.174 -4.742 -1.678 1.00 3.31 H new ATOM 0 HZ1 LYS A 23 20.423 -5.345 -2.299 1.00 31.51 H new ATOM 0 HZ2 LYS A 23 20.455 -4.145 -1.098 1.00 31.51 H new ATOM 0 HZ3 LYS A 23 20.795 -5.759 -0.695 1.00 31.51 H new ATOM 373 N ASP A 24 12.514 -5.141 -0.976 1.00 11.42 N ATOM 374 CA ASP A 24 11.249 -5.866 -0.988 1.00 52.13 C ATOM 375 C ASP A 24 11.089 -6.701 0.278 1.00 33.11 C ATOM 376 O ASP A 24 10.425 -7.738 0.272 1.00 54.14 O ATOM 377 CB ASP A 24 11.165 -6.766 -2.222 1.00 31.31 C ATOM 378 CG ASP A 24 10.938 -5.980 -3.498 1.00 73.01 C ATOM 379 OD1 ASP A 24 11.613 -4.947 -3.686 1.00 64.13 O ATOM 380 OD2 ASP A 24 10.084 -6.397 -4.308 1.00 74.24 O ATOM 0 H ASP A 24 12.428 -4.141 -1.158 1.00 11.42 H new ATOM 0 HA ASP A 24 10.440 -5.136 -1.024 1.00 52.13 H new ATOM 0 HB2 ASP A 24 12.087 -7.341 -2.312 1.00 31.31 H new ATOM 0 HB3 ASP A 24 10.354 -7.482 -2.091 1.00 31.31 H new ATOM 385 N LYS A 25 11.703 -6.243 1.364 1.00 34.50 N ATOM 386 CA LYS A 25 11.629 -6.947 2.639 1.00 70.10 C ATOM 387 C LYS A 25 10.856 -6.129 3.668 1.00 12.22 C ATOM 388 O LYS A 25 10.762 -4.904 3.580 1.00 61.42 O ATOM 389 CB LYS A 25 13.036 -7.246 3.162 1.00 52.01 C ATOM 390 CG LYS A 25 13.896 -8.027 2.183 1.00 55.41 C ATOM 391 CD LYS A 25 14.821 -8.994 2.902 1.00 73.23 C ATOM 392 CE LYS A 25 16.024 -9.356 2.044 1.00 35.51 C ATOM 393 NZ LYS A 25 15.645 -10.227 0.897 1.00 32.52 N ATOM 0 H LYS A 25 12.258 -5.387 1.387 1.00 34.50 H new ATOM 0 HA LYS A 25 11.101 -7.887 2.477 1.00 70.10 H new ATOM 0 HB2 LYS A 25 13.534 -6.306 3.400 1.00 52.01 H new ATOM 0 HB3 LYS A 25 12.957 -7.809 4.092 1.00 52.01 H new ATOM 0 HG2 LYS A 25 13.256 -8.578 1.494 1.00 55.41 H new ATOM 0 HG3 LYS A 25 14.487 -7.334 1.584 1.00 55.41 H new ATOM 0 HD2 LYS A 25 15.160 -8.548 3.837 1.00 73.23 H new ATOM 0 HD3 LYS A 25 14.272 -9.899 3.162 1.00 73.23 H new ATOM 0 HE2 LYS A 25 16.490 -8.445 1.670 1.00 35.51 H new ATOM 0 HE3 LYS A 25 16.767 -9.866 2.657 1.00 35.51 H new ATOM 0 HZ1 LYS A 25 16.492 -10.451 0.337 1.00 32.52 H new ATOM 0 HZ2 LYS A 25 15.223 -11.108 1.255 1.00 32.52 H new ATOM 0 HZ3 LYS A 25 14.955 -9.731 0.298 1.00 32.52 H new ATOM 407 N PRO A 26 10.289 -6.819 4.669 1.00 3.43 N ATOM 408 CA PRO A 26 9.516 -6.175 5.736 1.00 62.12 C ATOM 409 C PRO A 26 10.394 -5.349 6.670 1.00 34.44 C ATOM 410 O PRO A 26 11.605 -5.249 6.475 1.00 43.33 O ATOM 411 CB PRO A 26 8.898 -7.356 6.488 1.00 75.34 C ATOM 412 CG PRO A 26 9.818 -8.498 6.223 1.00 11.52 C ATOM 413 CD PRO A 26 10.360 -8.280 4.838 1.00 42.33 C ATOM 0 HA PRO A 26 8.782 -5.473 5.341 1.00 62.12 H new ATOM 0 HB2 PRO A 26 8.821 -7.149 7.555 1.00 75.34 H new ATOM 0 HB3 PRO A 26 7.890 -7.569 6.131 1.00 75.34 H new ATOM 0 HG2 PRO A 26 10.623 -8.529 6.957 1.00 11.52 H new ATOM 0 HG3 PRO A 26 9.289 -9.449 6.290 1.00 11.52 H new ATOM 0 HD2 PRO A 26 11.382 -8.646 4.745 1.00 42.33 H new ATOM 0 HD3 PRO A 26 9.765 -8.801 4.087 1.00 42.33 H new ATOM 421 N THR A 27 9.775 -4.759 7.688 1.00 34.34 N ATOM 422 CA THR A 27 10.499 -3.942 8.653 1.00 1.22 C ATOM 423 C THR A 27 10.036 -4.231 10.076 1.00 23.25 C ATOM 424 O THR A 27 8.912 -4.685 10.295 1.00 62.34 O ATOM 425 CB THR A 27 10.321 -2.440 8.363 1.00 54.41 C ATOM 426 OG1 THR A 27 10.485 -2.188 6.963 1.00 62.22 O ATOM 427 CG2 THR A 27 11.324 -1.613 9.153 1.00 13.21 C ATOM 0 H THR A 27 8.773 -4.832 7.865 1.00 34.34 H new ATOM 0 HA THR A 27 11.553 -4.201 8.557 1.00 1.22 H new ATOM 0 HB THR A 27 9.315 -2.151 8.668 1.00 54.41 H new ATOM 0 HG1 THR A 27 9.937 -1.418 6.703 1.00 62.22 H new ATOM 0 HG21 THR A 27 11.179 -0.556 8.931 1.00 13.21 H new ATOM 0 HG22 THR A 27 11.177 -1.784 10.219 1.00 13.21 H new ATOM 0 HG23 THR A 27 12.336 -1.906 8.875 1.00 13.21 H new ATOM 435 N LEU A 28 10.908 -3.965 11.043 1.00 64.34 N ATOM 436 CA LEU A 28 10.588 -4.197 12.447 1.00 4.40 C ATOM 437 C LEU A 28 10.732 -2.912 13.257 1.00 53.02 C ATOM 438 O LEU A 28 11.835 -2.392 13.424 1.00 24.11 O ATOM 439 CB LEU A 28 11.498 -5.282 13.026 1.00 50.13 C ATOM 440 CG LEU A 28 10.899 -6.686 13.107 1.00 21.40 C ATOM 441 CD1 LEU A 28 11.721 -7.666 12.283 1.00 0.34 C ATOM 442 CD2 LEU A 28 10.812 -7.146 14.555 1.00 22.11 C ATOM 0 H LEU A 28 11.842 -3.589 10.880 1.00 64.34 H new ATOM 0 HA LEU A 28 9.552 -4.530 12.508 1.00 4.40 H new ATOM 0 HB2 LEU A 28 12.404 -5.329 12.422 1.00 50.13 H new ATOM 0 HB3 LEU A 28 11.799 -4.979 14.029 1.00 50.13 H new ATOM 0 HG LEU A 28 9.890 -6.654 12.695 1.00 21.40 H new ATOM 0 HD11 LEU A 28 11.279 -8.660 12.353 1.00 0.34 H new ATOM 0 HD12 LEU A 28 11.732 -7.346 11.241 1.00 0.34 H new ATOM 0 HD13 LEU A 28 12.742 -7.695 12.664 1.00 0.34 H new ATOM 0 HD21 LEU A 28 10.383 -8.147 14.594 1.00 22.11 H new ATOM 0 HD22 LEU A 28 11.810 -7.162 14.992 1.00 22.11 H new ATOM 0 HD23 LEU A 28 10.180 -6.459 15.118 1.00 22.11 H new ATOM 454 N ILE A 29 9.610 -2.407 13.759 1.00 51.24 N ATOM 455 CA ILE A 29 9.611 -1.185 14.554 1.00 65.22 C ATOM 456 C ILE A 29 9.442 -1.495 16.037 1.00 2.23 C ATOM 457 O ILE A 29 8.440 -2.078 16.451 1.00 12.31 O ATOM 458 CB ILE A 29 8.493 -0.224 14.111 1.00 41.43 C ATOM 459 CG1 ILE A 29 8.701 0.200 12.655 1.00 24.51 C ATOM 460 CG2 ILE A 29 8.450 0.995 15.021 1.00 24.51 C ATOM 461 CD1 ILE A 29 7.530 0.960 12.074 1.00 44.25 C ATOM 0 H ILE A 29 8.689 -2.825 13.629 1.00 51.24 H new ATOM 0 HA ILE A 29 10.576 -0.704 14.393 1.00 65.22 H new ATOM 0 HB ILE A 29 7.538 -0.744 14.186 1.00 41.43 H new ATOM 0 HG12 ILE A 29 9.595 0.821 12.590 1.00 24.51 H new ATOM 0 HG13 ILE A 29 8.884 -0.687 12.049 1.00 24.51 H new ATOM 0 HG21 ILE A 29 7.654 1.665 14.695 1.00 24.51 H new ATOM 0 HG22 ILE A 29 8.259 0.677 16.046 1.00 24.51 H new ATOM 0 HG23 ILE A 29 9.406 1.517 14.975 1.00 24.51 H new ATOM 0 HD11 ILE A 29 7.747 1.228 11.040 1.00 44.25 H new ATOM 0 HD12 ILE A 29 6.638 0.334 12.107 1.00 44.25 H new ATOM 0 HD13 ILE A 29 7.359 1.866 12.656 1.00 44.25 H new ATOM 473 N LYS A 30 10.429 -1.099 16.835 1.00 75.11 N ATOM 474 CA LYS A 30 10.389 -1.331 18.274 1.00 41.41 C ATOM 475 C LYS A 30 10.311 -0.011 19.035 1.00 32.33 C ATOM 476 O LYS A 30 11.047 0.931 18.742 1.00 51.02 O ATOM 477 CB LYS A 30 11.625 -2.116 18.719 1.00 51.11 C ATOM 478 CG LYS A 30 12.880 -1.267 18.822 1.00 63.20 C ATOM 479 CD LYS A 30 14.054 -2.070 19.357 1.00 20.31 C ATOM 480 CE LYS A 30 13.803 -2.542 20.781 1.00 23.50 C ATOM 481 NZ LYS A 30 14.808 -1.992 21.733 1.00 70.42 N ATOM 0 H LYS A 30 11.266 -0.616 16.509 1.00 75.11 H new ATOM 0 HA LYS A 30 9.496 -1.914 18.499 1.00 41.41 H new ATOM 0 HB2 LYS A 30 11.425 -2.573 19.688 1.00 51.11 H new ATOM 0 HB3 LYS A 30 11.803 -2.928 18.014 1.00 51.11 H new ATOM 0 HG2 LYS A 30 13.130 -0.865 17.840 1.00 63.20 H new ATOM 0 HG3 LYS A 30 12.692 -0.416 19.476 1.00 63.20 H new ATOM 0 HD2 LYS A 30 14.231 -2.931 18.713 1.00 20.31 H new ATOM 0 HD3 LYS A 30 14.957 -1.460 19.328 1.00 20.31 H new ATOM 0 HE2 LYS A 30 12.803 -2.239 21.093 1.00 23.50 H new ATOM 0 HE3 LYS A 30 13.831 -3.631 20.813 1.00 23.50 H new ATOM 0 HZ1 LYS A 30 14.613 -2.350 22.690 1.00 70.42 H new ATOM 0 HZ2 LYS A 30 15.761 -2.287 21.441 1.00 70.42 H new ATOM 0 HZ3 LYS A 30 14.753 -0.953 21.735 1.00 70.42 H new ATOM 495 N PHE A 31 9.415 0.049 20.015 1.00 22.13 N ATOM 496 CA PHE A 31 9.241 1.253 20.819 1.00 25.03 C ATOM 497 C PHE A 31 9.958 1.120 22.160 1.00 62.11 C ATOM 498 O PHE A 31 9.754 0.151 22.891 1.00 11.13 O ATOM 499 CB PHE A 31 7.754 1.528 21.049 1.00 50.54 C ATOM 500 CG PHE A 31 6.931 1.461 19.794 1.00 64.52 C ATOM 501 CD1 PHE A 31 6.451 0.247 19.330 1.00 75.23 C ATOM 502 CD2 PHE A 31 6.639 2.610 19.078 1.00 44.40 C ATOM 503 CE1 PHE A 31 5.693 0.181 18.175 1.00 31.24 C ATOM 504 CE2 PHE A 31 5.882 2.551 17.923 1.00 30.35 C ATOM 505 CZ PHE A 31 5.409 1.334 17.471 1.00 42.31 C ATOM 0 H PHE A 31 8.798 -0.722 20.271 1.00 22.13 H new ATOM 0 HA PHE A 31 9.678 2.090 20.274 1.00 25.03 H new ATOM 0 HB2 PHE A 31 7.366 0.806 21.767 1.00 50.54 H new ATOM 0 HB3 PHE A 31 7.640 2.515 21.496 1.00 50.54 H new ATOM 0 HD1 PHE A 31 6.671 -0.658 19.876 1.00 75.23 H new ATOM 0 HD2 PHE A 31 7.007 3.564 19.426 1.00 44.40 H new ATOM 0 HE1 PHE A 31 5.324 -0.771 17.824 1.00 31.24 H new ATOM 0 HE2 PHE A 31 5.661 3.455 17.375 1.00 30.35 H new ATOM 0 HZ PHE A 31 4.818 1.285 16.568 1.00 42.31 H new ATOM 515 N TRP A 32 10.798 2.099 22.474 1.00 2.31 N ATOM 516 CA TRP A 32 11.546 2.092 23.726 1.00 23.12 C ATOM 517 C TRP A 32 11.562 3.479 24.359 1.00 20.01 C ATOM 518 O TRP A 32 10.894 4.396 23.883 1.00 74.10 O ATOM 519 CB TRP A 32 12.978 1.611 23.486 1.00 43.22 C ATOM 520 CG TRP A 32 13.704 2.406 22.442 1.00 22.55 C ATOM 521 CD1 TRP A 32 13.444 2.429 21.102 1.00 11.21 C ATOM 522 CD2 TRP A 32 14.811 3.289 22.654 1.00 14.21 C ATOM 523 NE1 TRP A 32 14.322 3.275 20.468 1.00 71.55 N ATOM 524 CE2 TRP A 32 15.170 3.815 21.398 1.00 52.24 C ATOM 525 CE3 TRP A 32 15.531 3.689 23.782 1.00 4.15 C ATOM 526 CZ2 TRP A 32 16.218 4.718 21.241 1.00 22.10 C ATOM 527 CZ3 TRP A 32 16.572 4.585 23.625 1.00 32.24 C ATOM 528 CH2 TRP A 32 16.907 5.092 22.363 1.00 71.12 C ATOM 0 H TRP A 32 10.978 2.908 21.879 1.00 2.31 H new ATOM 0 HA TRP A 32 11.050 1.406 24.412 1.00 23.12 H new ATOM 0 HB2 TRP A 32 13.533 1.662 24.423 1.00 43.22 H new ATOM 0 HB3 TRP A 32 12.956 0.564 23.185 1.00 43.22 H new ATOM 0 HD1 TRP A 32 12.663 1.866 20.612 1.00 11.21 H new ATOM 0 HE1 TRP A 32 14.339 3.469 19.467 1.00 71.55 H new ATOM 0 HE3 TRP A 32 15.279 3.305 24.760 1.00 4.15 H new ATOM 0 HZ2 TRP A 32 16.478 5.109 20.269 1.00 22.10 H new ATOM 0 HZ3 TRP A 32 17.137 4.899 24.490 1.00 32.24 H new ATOM 0 HH2 TRP A 32 17.725 5.792 22.273 1.00 71.12 H new ATOM 539 N ALA A 33 12.329 3.625 25.434 1.00 2.53 N ATOM 540 CA ALA A 33 12.433 4.902 26.130 1.00 21.15 C ATOM 541 C ALA A 33 13.659 4.935 27.036 1.00 24.03 C ATOM 542 O ALA A 33 14.111 3.899 27.524 1.00 35.14 O ATOM 543 CB ALA A 33 11.171 5.167 26.938 1.00 51.13 C ATOM 0 H ALA A 33 12.887 2.875 25.842 1.00 2.53 H new ATOM 0 HA ALA A 33 12.545 5.687 25.382 1.00 21.15 H new ATOM 0 HB1 ALA A 33 11.262 6.124 27.452 1.00 51.13 H new ATOM 0 HB2 ALA A 33 10.310 5.195 26.270 1.00 51.13 H new ATOM 0 HB3 ALA A 33 11.035 4.372 27.671 1.00 51.13 H new ATOM 549 N SER A 34 14.195 6.132 27.256 1.00 32.53 N ATOM 550 CA SER A 34 15.372 6.299 28.100 1.00 22.31 C ATOM 551 C SER A 34 15.054 5.952 29.551 1.00 22.24 C ATOM 552 O SER A 34 15.949 5.640 30.337 1.00 63.43 O ATOM 553 CB SER A 34 15.891 7.735 28.009 1.00 23.01 C ATOM 554 OG SER A 34 15.659 8.439 29.217 1.00 24.52 O ATOM 0 H SER A 34 13.833 7.000 26.861 1.00 32.53 H new ATOM 0 HA SER A 34 16.144 5.618 27.743 1.00 22.31 H new ATOM 0 HB2 SER A 34 16.959 7.726 27.789 1.00 23.01 H new ATOM 0 HB3 SER A 34 15.400 8.251 27.184 1.00 23.01 H new ATOM 0 HG SER A 34 16.001 9.353 29.134 1.00 24.52 H new ATOM 560 N TRP A 35 13.774 6.009 29.900 1.00 51.25 N ATOM 561 CA TRP A 35 13.336 5.701 31.256 1.00 5.45 C ATOM 562 C TRP A 35 12.948 4.233 31.383 1.00 32.51 C ATOM 563 O TRP A 35 12.137 3.866 32.234 1.00 31.31 O ATOM 564 CB TRP A 35 12.154 6.590 31.647 1.00 5.02 C ATOM 565 CG TRP A 35 10.992 6.479 30.708 1.00 51.12 C ATOM 566 CD1 TRP A 35 10.818 7.157 29.535 1.00 43.00 C ATOM 567 CD2 TRP A 35 9.841 5.642 30.864 1.00 61.34 C ATOM 568 NE1 TRP A 35 9.629 6.791 28.952 1.00 13.43 N ATOM 569 CE2 TRP A 35 9.011 5.863 29.747 1.00 30.52 C ATOM 570 CE3 TRP A 35 9.432 4.725 31.836 1.00 1.41 C ATOM 571 CZ2 TRP A 35 7.797 5.201 29.580 1.00 63.01 C ATOM 572 CZ3 TRP A 35 8.227 4.070 31.669 1.00 62.22 C ATOM 573 CH2 TRP A 35 7.422 4.309 30.548 1.00 54.44 C ATOM 0 H TRP A 35 13.021 6.266 29.262 1.00 51.25 H new ATOM 0 HA TRP A 35 14.168 5.897 31.933 1.00 5.45 H new ATOM 0 HB2 TRP A 35 11.826 6.325 32.652 1.00 5.02 H new ATOM 0 HB3 TRP A 35 12.485 7.628 31.683 1.00 5.02 H new ATOM 0 HD1 TRP A 35 11.513 7.875 29.126 1.00 43.00 H new ATOM 0 HE1 TRP A 35 9.266 7.152 28.070 1.00 13.43 H new ATOM 0 HE3 TRP A 35 10.047 4.532 32.702 1.00 1.41 H new ATOM 0 HZ2 TRP A 35 7.174 5.385 28.717 1.00 63.01 H new ATOM 0 HZ3 TRP A 35 7.900 3.361 32.416 1.00 62.22 H new ATOM 0 HH2 TRP A 35 6.487 3.779 30.445 1.00 54.44 H new ATOM 584 N CYS A 36 13.531 3.395 30.532 1.00 51.10 N ATOM 585 CA CYS A 36 13.246 1.966 30.548 1.00 35.43 C ATOM 586 C CYS A 36 14.532 1.155 30.676 1.00 3.42 C ATOM 587 O CYS A 36 15.440 1.251 29.850 1.00 23.03 O ATOM 588 CB CYS A 36 12.498 1.559 29.277 1.00 62.13 C ATOM 589 SG CYS A 36 12.175 -0.229 29.144 1.00 15.10 S ATOM 0 H CYS A 36 14.205 3.682 29.822 1.00 51.10 H new ATOM 0 HA CYS A 36 12.618 1.757 31.414 1.00 35.43 H new ATOM 0 HB2 CYS A 36 11.548 2.093 29.241 1.00 62.13 H new ATOM 0 HB3 CYS A 36 13.076 1.878 28.410 1.00 62.13 H new ATOM 594 N PRO A 37 14.614 0.338 31.736 1.00 34.34 N ATOM 595 CA PRO A 37 15.784 -0.506 31.998 1.00 53.24 C ATOM 596 C PRO A 37 15.917 -1.641 30.988 1.00 30.03 C ATOM 597 O PRO A 37 16.991 -1.864 30.427 1.00 13.22 O ATOM 598 CB PRO A 37 15.513 -1.064 33.397 1.00 4.42 C ATOM 599 CG PRO A 37 14.031 -1.028 33.540 1.00 51.24 C ATOM 600 CD PRO A 37 13.569 0.173 32.761 1.00 2.23 C ATOM 0 HA PRO A 37 16.716 0.054 31.921 1.00 53.24 H new ATOM 0 HB2 PRO A 37 15.896 -2.079 33.499 1.00 4.42 H new ATOM 0 HB3 PRO A 37 15.999 -0.462 34.164 1.00 4.42 H new ATOM 0 HG2 PRO A 37 13.579 -1.941 33.153 1.00 51.24 H new ATOM 0 HG3 PRO A 37 13.742 -0.948 34.588 1.00 51.24 H new ATOM 0 HD2 PRO A 37 12.589 0.009 32.313 1.00 2.23 H new ATOM 0 HD3 PRO A 37 13.485 1.055 33.395 1.00 2.23 H new ATOM 608 N LEU A 38 14.821 -2.356 30.761 1.00 13.00 N ATOM 609 CA LEU A 38 14.815 -3.469 29.818 1.00 50.11 C ATOM 610 C LEU A 38 15.044 -2.976 28.393 1.00 75.14 C ATOM 611 O LEU A 38 15.311 -3.766 27.487 1.00 45.24 O ATOM 612 CB LEU A 38 13.489 -4.227 29.901 1.00 11.22 C ATOM 613 CG LEU A 38 13.058 -4.674 31.298 1.00 21.44 C ATOM 614 CD1 LEU A 38 11.676 -5.308 31.254 1.00 64.14 C ATOM 615 CD2 LEU A 38 14.073 -5.645 31.884 1.00 3.01 C ATOM 0 H LEU A 38 13.925 -2.185 31.217 1.00 13.00 H new ATOM 0 HA LEU A 38 15.629 -4.143 30.085 1.00 50.11 H new ATOM 0 HB2 LEU A 38 12.705 -3.594 29.486 1.00 11.22 H new ATOM 0 HB3 LEU A 38 13.557 -5.109 29.264 1.00 11.22 H new ATOM 0 HG LEU A 38 13.012 -3.795 31.941 1.00 21.44 H new ATOM 0 HD11 LEU A 38 11.387 -5.620 32.258 1.00 64.14 H new ATOM 0 HD12 LEU A 38 10.955 -4.583 30.877 1.00 64.14 H new ATOM 0 HD13 LEU A 38 11.695 -6.176 30.596 1.00 64.14 H new ATOM 0 HD21 LEU A 38 13.750 -5.953 32.879 1.00 3.01 H new ATOM 0 HD22 LEU A 38 14.152 -6.521 31.241 1.00 3.01 H new ATOM 0 HD23 LEU A 38 15.045 -5.157 31.953 1.00 3.01 H new ATOM 627 N CYS A 39 14.938 -1.665 28.201 1.00 30.43 N ATOM 628 CA CYS A 39 15.135 -1.066 26.887 1.00 13.41 C ATOM 629 C CYS A 39 16.535 -0.471 26.765 1.00 54.14 C ATOM 630 O CYS A 39 17.287 -0.809 25.850 1.00 22.31 O ATOM 631 CB CYS A 39 14.084 0.018 26.636 1.00 44.13 C ATOM 632 SG CYS A 39 12.387 -0.474 27.079 1.00 4.25 S ATOM 0 H CYS A 39 14.717 -0.997 28.940 1.00 30.43 H new ATOM 0 HA CYS A 39 15.026 -1.850 26.137 1.00 13.41 H new ATOM 0 HB2 CYS A 39 14.353 0.908 27.205 1.00 44.13 H new ATOM 0 HB3 CYS A 39 14.107 0.294 25.582 1.00 44.13 H new ATOM 637 N LEU A 40 16.877 0.417 27.692 1.00 63.43 N ATOM 638 CA LEU A 40 18.187 1.059 27.689 1.00 40.12 C ATOM 639 C LEU A 40 19.303 0.020 27.726 1.00 2.24 C ATOM 640 O LEU A 40 20.341 0.186 27.085 1.00 30.05 O ATOM 641 CB LEU A 40 18.315 2.006 28.884 1.00 63.43 C ATOM 642 CG LEU A 40 19.198 3.237 28.673 1.00 33.52 C ATOM 643 CD1 LEU A 40 18.481 4.266 27.814 1.00 40.43 C ATOM 644 CD2 LEU A 40 19.598 3.841 30.011 1.00 14.21 C ATOM 0 H LEU A 40 16.266 0.709 28.455 1.00 63.43 H new ATOM 0 HA LEU A 40 18.281 1.633 26.767 1.00 40.12 H new ATOM 0 HB2 LEU A 40 17.317 2.343 29.164 1.00 63.43 H new ATOM 0 HB3 LEU A 40 18.709 1.441 29.729 1.00 63.43 H new ATOM 0 HG LEU A 40 20.104 2.927 28.152 1.00 33.52 H new ATOM 0 HD11 LEU A 40 19.124 5.135 27.674 1.00 40.43 H new ATOM 0 HD12 LEU A 40 18.245 3.829 26.844 1.00 40.43 H new ATOM 0 HD13 LEU A 40 17.559 4.573 28.307 1.00 40.43 H new ATOM 0 HD21 LEU A 40 20.226 4.716 29.842 1.00 14.21 H new ATOM 0 HD22 LEU A 40 18.703 4.137 30.559 1.00 14.21 H new ATOM 0 HD23 LEU A 40 20.152 3.104 30.592 1.00 14.21 H new ATOM 656 N SER A 41 19.082 -1.052 28.480 1.00 34.00 N ATOM 657 CA SER A 41 20.069 -2.118 28.603 1.00 44.34 C ATOM 658 C SER A 41 20.094 -2.982 27.346 1.00 64.41 C ATOM 659 O SER A 41 21.073 -3.680 27.079 1.00 14.35 O ATOM 660 CB SER A 41 19.766 -2.985 29.826 1.00 1.31 C ATOM 661 OG SER A 41 20.926 -3.669 30.267 1.00 44.34 O ATOM 0 H SER A 41 18.227 -1.205 29.015 1.00 34.00 H new ATOM 0 HA SER A 41 21.050 -1.659 28.727 1.00 44.34 H new ATOM 0 HB2 SER A 41 19.380 -2.360 30.632 1.00 1.31 H new ATOM 0 HB3 SER A 41 18.986 -3.706 29.580 1.00 1.31 H new ATOM 0 HG SER A 41 20.706 -4.215 31.051 1.00 44.34 H new ATOM 667 N GLU A 42 19.011 -2.931 26.578 1.00 54.53 N ATOM 668 CA GLU A 42 18.908 -3.710 25.349 1.00 13.35 C ATOM 669 C GLU A 42 19.339 -2.882 24.142 1.00 14.32 C ATOM 670 O GLU A 42 19.293 -3.351 23.004 1.00 35.55 O ATOM 671 CB GLU A 42 17.474 -4.208 25.154 1.00 24.53 C ATOM 672 CG GLU A 42 17.228 -5.593 25.731 1.00 51.45 C ATOM 673 CD GLU A 42 16.284 -6.419 24.879 1.00 35.24 C ATOM 674 OE1 GLU A 42 15.596 -5.833 24.017 1.00 65.03 O ATOM 675 OE2 GLU A 42 16.231 -7.651 25.076 1.00 62.22 O ATOM 0 H GLU A 42 18.192 -2.359 26.785 1.00 54.53 H new ATOM 0 HA GLU A 42 19.575 -4.568 25.436 1.00 13.35 H new ATOM 0 HB2 GLU A 42 16.786 -3.502 25.620 1.00 24.53 H new ATOM 0 HB3 GLU A 42 17.244 -4.221 24.089 1.00 24.53 H new ATOM 0 HG2 GLU A 42 18.179 -6.117 25.826 1.00 51.45 H new ATOM 0 HG3 GLU A 42 16.815 -5.496 26.735 1.00 51.45 H new ATOM 682 N LEU A 43 19.757 -1.647 24.398 1.00 33.11 N ATOM 683 CA LEU A 43 20.196 -0.752 23.333 1.00 12.11 C ATOM 684 C LEU A 43 21.186 -1.451 22.407 1.00 32.54 C ATOM 685 O LEU A 43 21.019 -1.450 21.188 1.00 30.25 O ATOM 686 CB LEU A 43 20.836 0.504 23.927 1.00 14.12 C ATOM 687 CG LEU A 43 19.871 1.538 24.508 1.00 54.52 C ATOM 688 CD1 LEU A 43 20.612 2.513 25.410 1.00 31.53 C ATOM 689 CD2 LEU A 43 19.152 2.283 23.392 1.00 45.30 C ATOM 0 H LEU A 43 19.801 -1.243 25.333 1.00 33.11 H new ATOM 0 HA LEU A 43 19.321 -0.466 22.749 1.00 12.11 H new ATOM 0 HB2 LEU A 43 21.526 0.199 24.713 1.00 14.12 H new ATOM 0 HB3 LEU A 43 21.430 0.987 23.151 1.00 14.12 H new ATOM 0 HG LEU A 43 19.126 1.014 25.107 1.00 54.52 H new ATOM 0 HD11 LEU A 43 19.909 3.241 25.814 1.00 31.53 H new ATOM 0 HD12 LEU A 43 21.080 1.967 26.229 1.00 31.53 H new ATOM 0 HD13 LEU A 43 21.379 3.030 24.834 1.00 31.53 H new ATOM 0 HD21 LEU A 43 18.469 3.015 23.824 1.00 45.30 H new ATOM 0 HD22 LEU A 43 19.883 2.794 22.766 1.00 45.30 H new ATOM 0 HD23 LEU A 43 18.588 1.574 22.786 1.00 45.30 H new ATOM 701 N GLY A 44 22.217 -2.051 22.996 1.00 53.33 N ATOM 702 CA GLY A 44 23.217 -2.748 22.209 1.00 43.20 C ATOM 703 C GLY A 44 22.637 -3.915 21.436 1.00 71.24 C ATOM 704 O GLY A 44 22.974 -4.124 20.271 1.00 73.14 O ATOM 0 H GLY A 44 22.377 -2.066 24.003 1.00 53.33 H new ATOM 0 HA2 GLY A 44 23.679 -2.048 21.512 1.00 43.20 H new ATOM 0 HA3 GLY A 44 24.006 -3.109 22.868 1.00 43.20 H new ATOM 708 N GLN A 45 21.764 -4.678 22.086 1.00 52.05 N ATOM 709 CA GLN A 45 21.138 -5.832 21.451 1.00 13.02 C ATOM 710 C GLN A 45 20.515 -5.447 20.114 1.00 52.45 C ATOM 711 O GLN A 45 20.691 -6.140 19.111 1.00 35.32 O ATOM 712 CB GLN A 45 20.071 -6.430 22.371 1.00 43.35 C ATOM 713 CG GLN A 45 19.035 -7.266 21.637 1.00 24.42 C ATOM 714 CD GLN A 45 18.109 -8.007 22.581 1.00 20.32 C ATOM 715 OE1 GLN A 45 16.886 -7.910 22.473 1.00 63.32 O ATOM 716 NE2 GLN A 45 18.688 -8.754 23.515 1.00 51.44 N ATOM 0 H GLN A 45 21.474 -4.518 23.051 1.00 52.05 H new ATOM 0 HA GLN A 45 21.911 -6.578 21.269 1.00 13.02 H new ATOM 0 HB2 GLN A 45 20.558 -7.049 23.124 1.00 43.35 H new ATOM 0 HB3 GLN A 45 19.565 -5.622 22.900 1.00 43.35 H new ATOM 0 HG2 GLN A 45 18.445 -6.619 20.988 1.00 24.42 H new ATOM 0 HG3 GLN A 45 19.543 -7.985 20.994 1.00 24.42 H new ATOM 0 HE21 GLN A 45 19.705 -8.806 23.568 1.00 51.44 H new ATOM 0 HE22 GLN A 45 18.115 -9.276 24.178 1.00 51.44 H new ATOM 725 N THR A 46 19.785 -4.335 20.104 1.00 21.32 N ATOM 726 CA THR A 46 19.135 -3.858 18.890 1.00 35.35 C ATOM 727 C THR A 46 20.151 -3.276 17.914 1.00 34.34 C ATOM 728 O THR A 46 19.931 -3.275 16.704 1.00 71.43 O ATOM 729 CB THR A 46 18.072 -2.789 19.206 1.00 52.21 C ATOM 730 OG1 THR A 46 17.059 -3.340 20.055 1.00 73.24 O ATOM 731 CG2 THR A 46 17.438 -2.262 17.927 1.00 31.22 C ATOM 0 H THR A 46 19.630 -3.748 20.924 1.00 21.32 H new ATOM 0 HA THR A 46 18.649 -4.719 18.432 1.00 35.35 H new ATOM 0 HB THR A 46 18.563 -1.961 19.718 1.00 52.21 H new ATOM 0 HG1 THR A 46 16.344 -3.724 19.505 1.00 73.24 H new ATOM 0 HG21 THR A 46 16.691 -1.508 18.175 1.00 31.22 H new ATOM 0 HG22 THR A 46 18.207 -1.816 17.296 1.00 31.22 H new ATOM 0 HG23 THR A 46 16.961 -3.083 17.392 1.00 31.22 H new ATOM 739 N GLU A 47 21.263 -2.783 18.449 1.00 0.14 N ATOM 740 CA GLU A 47 22.313 -2.198 17.624 1.00 52.15 C ATOM 741 C GLU A 47 22.979 -3.262 16.756 1.00 54.14 C ATOM 742 O GLU A 47 23.334 -3.008 15.605 1.00 40.25 O ATOM 743 CB GLU A 47 23.361 -1.512 18.502 1.00 12.32 C ATOM 744 CG GLU A 47 24.554 -0.982 17.725 1.00 51.41 C ATOM 745 CD GLU A 47 24.216 0.247 16.903 1.00 13.12 C ATOM 746 OE1 GLU A 47 23.209 0.208 16.165 1.00 70.40 O ATOM 747 OE2 GLU A 47 24.957 1.247 16.998 1.00 51.51 O ATOM 0 H GLU A 47 21.460 -2.777 19.450 1.00 0.14 H new ATOM 0 HA GLU A 47 21.854 -1.455 16.971 1.00 52.15 H new ATOM 0 HB2 GLU A 47 22.891 -0.687 19.037 1.00 12.32 H new ATOM 0 HB3 GLU A 47 23.713 -2.219 19.253 1.00 12.32 H new ATOM 0 HG2 GLU A 47 25.357 -0.739 18.421 1.00 51.41 H new ATOM 0 HG3 GLU A 47 24.929 -1.764 17.065 1.00 51.41 H new ATOM 754 N LYS A 48 23.145 -4.455 17.316 1.00 21.02 N ATOM 755 CA LYS A 48 23.767 -5.559 16.596 1.00 63.44 C ATOM 756 C LYS A 48 22.767 -6.231 15.660 1.00 41.31 C ATOM 757 O LYS A 48 23.112 -6.622 14.545 1.00 43.11 O ATOM 758 CB LYS A 48 24.329 -6.587 17.581 1.00 14.33 C ATOM 759 CG LYS A 48 23.332 -7.018 18.644 1.00 43.23 C ATOM 760 CD LYS A 48 23.861 -8.183 19.463 1.00 35.05 C ATOM 761 CE LYS A 48 23.763 -9.493 18.697 1.00 32.32 C ATOM 762 NZ LYS A 48 24.125 -10.661 19.547 1.00 63.20 N ATOM 0 H LYS A 48 22.857 -4.682 18.268 1.00 21.02 H new ATOM 0 HA LYS A 48 24.583 -5.154 15.998 1.00 63.44 H new ATOM 0 HB2 LYS A 48 24.660 -7.466 17.027 1.00 14.33 H new ATOM 0 HB3 LYS A 48 25.209 -6.168 18.069 1.00 14.33 H new ATOM 0 HG2 LYS A 48 23.115 -6.177 19.303 1.00 43.23 H new ATOM 0 HG3 LYS A 48 22.393 -7.302 18.170 1.00 43.23 H new ATOM 0 HD2 LYS A 48 24.900 -7.996 19.735 1.00 35.05 H new ATOM 0 HD3 LYS A 48 23.298 -8.261 20.393 1.00 35.05 H new ATOM 0 HE2 LYS A 48 22.748 -9.619 18.321 1.00 32.32 H new ATOM 0 HE3 LYS A 48 24.422 -9.457 17.830 1.00 32.32 H new ATOM 0 HZ1 LYS A 48 24.046 -11.535 18.988 1.00 63.20 H new ATOM 0 HZ2 LYS A 48 25.102 -10.554 19.886 1.00 63.20 H new ATOM 0 HZ3 LYS A 48 23.480 -10.711 20.361 1.00 63.20 H new ATOM 776 N TRP A 49 21.528 -6.359 16.120 1.00 20.31 N ATOM 777 CA TRP A 49 20.478 -6.982 15.323 1.00 75.14 C ATOM 778 C TRP A 49 20.303 -6.259 13.992 1.00 41.22 C ATOM 779 O TRP A 49 20.239 -6.889 12.937 1.00 55.44 O ATOM 780 CB TRP A 49 19.156 -6.983 16.094 1.00 65.35 C ATOM 781 CG TRP A 49 19.139 -7.948 17.241 1.00 51.15 C ATOM 782 CD1 TRP A 49 20.194 -8.671 17.720 1.00 51.42 C ATOM 783 CD2 TRP A 49 18.011 -8.296 18.050 1.00 13.24 C ATOM 784 NE1 TRP A 49 19.789 -9.447 18.779 1.00 45.00 N ATOM 785 CE2 TRP A 49 18.455 -9.235 19.002 1.00 12.42 C ATOM 786 CE3 TRP A 49 16.669 -7.904 18.066 1.00 63.43 C ATOM 787 CZ2 TRP A 49 17.604 -9.787 19.956 1.00 11.50 C ATOM 788 CZ3 TRP A 49 15.826 -8.453 19.013 1.00 60.42 C ATOM 789 CH2 TRP A 49 16.296 -9.385 19.948 1.00 74.42 C ATOM 0 H TRP A 49 21.226 -6.040 17.040 1.00 20.31 H new ATOM 0 HA TRP A 49 20.773 -8.011 15.120 1.00 75.14 H new ATOM 0 HB2 TRP A 49 18.962 -5.979 16.470 1.00 65.35 H new ATOM 0 HB3 TRP A 49 18.344 -7.229 15.409 1.00 65.35 H new ATOM 0 HD1 TRP A 49 21.198 -8.638 17.325 1.00 51.42 H new ATOM 0 HE1 TRP A 49 20.386 -10.079 19.313 1.00 45.00 H new ATOM 0 HE3 TRP A 49 16.298 -7.185 17.351 1.00 63.43 H new ATOM 0 HZ2 TRP A 49 17.963 -10.507 20.677 1.00 11.50 H new ATOM 0 HZ3 TRP A 49 14.787 -8.159 19.033 1.00 60.42 H new ATOM 0 HH2 TRP A 49 15.612 -9.794 20.677 1.00 74.42 H new ATOM 800 N ALA A 50 20.228 -4.933 14.049 1.00 32.21 N ATOM 801 CA ALA A 50 20.063 -4.125 12.847 1.00 2.24 C ATOM 802 C ALA A 50 21.235 -4.318 11.891 1.00 2.10 C ATOM 803 O ALA A 50 21.165 -3.932 10.725 1.00 64.25 O ATOM 804 CB ALA A 50 19.917 -2.656 13.216 1.00 55.24 C ATOM 0 H ALA A 50 20.279 -4.396 14.915 1.00 32.21 H new ATOM 0 HA ALA A 50 19.156 -4.453 12.339 1.00 2.24 H new ATOM 0 HB1 ALA A 50 19.795 -2.064 12.309 1.00 55.24 H new ATOM 0 HB2 ALA A 50 19.043 -2.526 13.855 1.00 55.24 H new ATOM 0 HB3 ALA A 50 20.808 -2.324 13.748 1.00 55.24 H new ATOM 810 N GLN A 51 22.310 -4.916 12.393 1.00 24.43 N ATOM 811 CA GLN A 51 23.498 -5.159 11.583 1.00 51.24 C ATOM 812 C GLN A 51 23.753 -6.654 11.424 1.00 30.02 C ATOM 813 O GLN A 51 24.732 -7.064 10.800 1.00 74.03 O ATOM 814 CB GLN A 51 24.718 -4.485 12.213 1.00 31.11 C ATOM 815 CG GLN A 51 24.675 -2.967 12.150 1.00 11.13 C ATOM 816 CD GLN A 51 25.274 -2.419 10.870 1.00 13.40 C ATOM 817 OE1 GLN A 51 24.555 -1.957 9.983 1.00 43.10 O ATOM 818 NE2 GLN A 51 26.597 -2.466 10.767 1.00 32.31 N ATOM 0 H GLN A 51 22.383 -5.241 13.357 1.00 24.43 H new ATOM 0 HA GLN A 51 23.326 -4.732 10.595 1.00 51.24 H new ATOM 0 HB2 GLN A 51 24.796 -4.795 13.255 1.00 31.11 H new ATOM 0 HB3 GLN A 51 25.618 -4.836 11.708 1.00 31.11 H new ATOM 0 HG2 GLN A 51 23.641 -2.633 12.235 1.00 11.13 H new ATOM 0 HG3 GLN A 51 25.214 -2.556 13.004 1.00 11.13 H new ATOM 0 HE21 GLN A 51 27.154 -2.857 11.527 1.00 32.31 H new ATOM 0 HE22 GLN A 51 27.056 -2.111 9.928 1.00 32.31 H new ATOM 827 N ASP A 52 22.867 -7.464 11.994 1.00 42.32 N ATOM 828 CA ASP A 52 22.996 -8.914 11.915 1.00 30.23 C ATOM 829 C ASP A 52 22.714 -9.409 10.500 1.00 3.00 C ATOM 830 O ASP A 52 21.774 -8.955 9.849 1.00 34.42 O ATOM 831 CB ASP A 52 22.042 -9.587 12.903 1.00 15.54 C ATOM 832 CG ASP A 52 22.604 -10.878 13.464 1.00 71.00 C ATOM 833 OD1 ASP A 52 23.450 -11.499 12.788 1.00 70.13 O ATOM 834 OD2 ASP A 52 22.197 -11.268 14.579 1.00 61.23 O ATOM 0 H ASP A 52 22.052 -7.141 12.515 1.00 42.32 H new ATOM 0 HA ASP A 52 24.021 -9.177 12.175 1.00 30.23 H new ATOM 0 HB2 ASP A 52 21.829 -8.901 13.723 1.00 15.54 H new ATOM 0 HB3 ASP A 52 21.094 -9.793 12.405 1.00 15.54 H new ATOM 839 N ALA A 53 23.537 -10.341 10.030 1.00 73.12 N ATOM 840 CA ALA A 53 23.375 -10.898 8.692 1.00 5.24 C ATOM 841 C ALA A 53 22.056 -11.653 8.567 1.00 4.43 C ATOM 842 O ALA A 53 21.432 -11.661 7.506 1.00 14.45 O ATOM 843 CB ALA A 53 24.544 -11.814 8.358 1.00 54.54 C ATOM 0 H ALA A 53 24.322 -10.726 10.555 1.00 73.12 H new ATOM 0 HA ALA A 53 23.359 -10.072 7.981 1.00 5.24 H new ATOM 0 HB1 ALA A 53 24.411 -12.223 7.357 1.00 54.54 H new ATOM 0 HB2 ALA A 53 25.474 -11.246 8.397 1.00 54.54 H new ATOM 0 HB3 ALA A 53 24.586 -12.629 9.081 1.00 54.54 H new ATOM 849 N LYS A 54 21.638 -12.287 9.657 1.00 73.30 N ATOM 850 CA LYS A 54 20.392 -13.045 9.670 1.00 22.34 C ATOM 851 C LYS A 54 19.188 -12.116 9.557 1.00 42.35 C ATOM 852 O LYS A 54 18.146 -12.496 9.021 1.00 5.44 O ATOM 853 CB LYS A 54 20.290 -13.875 10.952 1.00 11.03 C ATOM 854 CG LYS A 54 20.793 -15.300 10.797 1.00 42.44 C ATOM 855 CD LYS A 54 19.812 -16.304 11.377 1.00 72.24 C ATOM 856 CE LYS A 54 18.598 -16.481 10.477 1.00 21.00 C ATOM 857 NZ LYS A 54 18.913 -17.304 9.276 1.00 32.05 N ATOM 0 H LYS A 54 22.143 -12.291 10.543 1.00 73.30 H new ATOM 0 HA LYS A 54 20.394 -13.714 8.809 1.00 22.34 H new ATOM 0 HB2 LYS A 54 20.859 -13.382 11.740 1.00 11.03 H new ATOM 0 HB3 LYS A 54 19.250 -13.899 11.277 1.00 11.03 H new ATOM 0 HG2 LYS A 54 20.955 -15.517 9.741 1.00 42.44 H new ATOM 0 HG3 LYS A 54 21.757 -15.403 11.295 1.00 42.44 H new ATOM 0 HD2 LYS A 54 20.310 -17.264 11.512 1.00 72.24 H new ATOM 0 HD3 LYS A 54 19.489 -15.971 12.364 1.00 72.24 H new ATOM 0 HE2 LYS A 54 17.794 -16.954 11.041 1.00 21.00 H new ATOM 0 HE3 LYS A 54 18.234 -15.503 10.162 1.00 21.00 H new ATOM 0 HZ1 LYS A 54 18.037 -17.501 8.751 1.00 32.05 H new ATOM 0 HZ2 LYS A 54 19.575 -16.786 8.664 1.00 32.05 H new ATOM 0 HZ3 LYS A 54 19.347 -18.201 9.574 1.00 32.05 H new ATOM 871 N PHE A 55 19.338 -10.896 10.062 1.00 45.24 N ATOM 872 CA PHE A 55 18.263 -9.912 10.016 1.00 43.30 C ATOM 873 C PHE A 55 18.185 -9.255 8.641 1.00 61.02 C ATOM 874 O PHE A 55 17.298 -8.443 8.378 1.00 32.32 O ATOM 875 CB PHE A 55 18.474 -8.844 11.092 1.00 61.40 C ATOM 876 CG PHE A 55 17.745 -9.133 12.373 1.00 11.40 C ATOM 877 CD1 PHE A 55 16.360 -9.131 12.412 1.00 32.45 C ATOM 878 CD2 PHE A 55 18.444 -9.405 13.538 1.00 63.24 C ATOM 879 CE1 PHE A 55 15.686 -9.395 13.590 1.00 25.52 C ATOM 880 CE2 PHE A 55 17.776 -9.670 14.718 1.00 23.43 C ATOM 881 CZ PHE A 55 16.395 -9.667 14.744 1.00 5.52 C ATOM 0 H PHE A 55 20.194 -10.565 10.508 1.00 45.24 H new ATOM 0 HA PHE A 55 17.323 -10.429 10.206 1.00 43.30 H new ATOM 0 HB2 PHE A 55 19.540 -8.756 11.302 1.00 61.40 H new ATOM 0 HB3 PHE A 55 18.145 -7.880 10.705 1.00 61.40 H new ATOM 0 HD1 PHE A 55 15.801 -8.921 11.512 1.00 32.45 H new ATOM 0 HD2 PHE A 55 19.524 -9.410 13.523 1.00 63.24 H new ATOM 0 HE1 PHE A 55 14.606 -9.389 13.608 1.00 25.52 H new ATOM 0 HE2 PHE A 55 18.333 -9.879 15.619 1.00 23.43 H new ATOM 0 HZ PHE A 55 15.871 -9.877 15.665 1.00 5.52 H new ATOM 891 N SER A 56 19.121 -9.612 7.767 1.00 71.20 N ATOM 892 CA SER A 56 19.162 -9.055 6.420 1.00 35.10 C ATOM 893 C SER A 56 17.901 -9.421 5.643 1.00 52.24 C ATOM 894 O SER A 56 17.609 -8.835 4.600 1.00 0.42 O ATOM 895 CB SER A 56 20.399 -9.559 5.674 1.00 15.00 C ATOM 896 OG SER A 56 21.588 -9.176 6.342 1.00 42.31 O ATOM 0 H SER A 56 19.861 -10.285 7.968 1.00 71.20 H new ATOM 0 HA SER A 56 19.215 -7.969 6.503 1.00 35.10 H new ATOM 0 HB2 SER A 56 20.359 -10.645 5.589 1.00 15.00 H new ATOM 0 HB3 SER A 56 20.403 -9.160 4.660 1.00 15.00 H new ATOM 0 HG SER A 56 22.364 -9.511 5.847 1.00 42.31 H new ATOM 902 N SER A 57 17.157 -10.394 6.158 1.00 71.40 N ATOM 903 CA SER A 57 15.929 -10.842 5.511 1.00 21.22 C ATOM 904 C SER A 57 14.725 -10.065 6.034 1.00 10.31 C ATOM 905 O SER A 57 13.579 -10.472 5.844 1.00 43.32 O ATOM 906 CB SER A 57 15.723 -12.340 5.743 1.00 72.33 C ATOM 907 OG SER A 57 15.786 -13.058 4.523 1.00 64.43 O ATOM 0 H SER A 57 17.383 -10.888 7.022 1.00 71.40 H new ATOM 0 HA SER A 57 16.023 -10.656 4.441 1.00 21.22 H new ATOM 0 HB2 SER A 57 16.484 -12.713 6.428 1.00 72.33 H new ATOM 0 HB3 SER A 57 14.757 -12.508 6.218 1.00 72.33 H new ATOM 0 HG SER A 57 15.653 -14.013 4.698 1.00 64.43 H new ATOM 913 N ALA A 58 14.994 -8.943 6.694 1.00 21.23 N ATOM 914 CA ALA A 58 13.934 -8.107 7.243 1.00 0.23 C ATOM 915 C ALA A 58 14.509 -6.875 7.935 1.00 71.32 C ATOM 916 O ALA A 58 15.295 -6.990 8.874 1.00 0.21 O ATOM 917 CB ALA A 58 13.079 -8.908 8.213 1.00 35.13 C ATOM 0 H ALA A 58 15.937 -8.592 6.861 1.00 21.23 H new ATOM 0 HA ALA A 58 13.308 -7.769 6.417 1.00 0.23 H new ATOM 0 HB1 ALA A 58 12.291 -8.271 8.615 1.00 35.13 H new ATOM 0 HB2 ALA A 58 12.631 -9.753 7.691 1.00 35.13 H new ATOM 0 HB3 ALA A 58 13.701 -9.275 9.029 1.00 35.13 H new ATOM 923 N ASN A 59 14.112 -5.698 7.463 1.00 12.11 N ATOM 924 CA ASN A 59 14.589 -4.445 8.036 1.00 43.42 C ATOM 925 C ASN A 59 14.259 -4.366 9.523 1.00 5.34 C ATOM 926 O ASN A 59 13.232 -4.877 9.971 1.00 51.13 O ATOM 927 CB ASN A 59 13.969 -3.255 7.301 1.00 51.33 C ATOM 928 CG ASN A 59 14.036 -3.407 5.793 1.00 24.34 C ATOM 929 OD1 ASN A 59 12.900 -3.231 5.130 1.00 70.11 O flip ATOM 930 ND2 ASN A 59 15.098 -3.680 5.233 1.00 72.14 N flip ATOM 0 H ASN A 59 13.461 -5.586 6.685 1.00 12.11 H new ATOM 0 HA ASN A 59 15.672 -4.411 7.920 1.00 43.42 H new ATOM 0 HB2 ASN A 59 12.928 -3.145 7.606 1.00 51.33 H new ATOM 0 HB3 ASN A 59 14.486 -2.341 7.595 1.00 51.33 H new ATOM 0 HD21 ASN A 59 15.947 -3.806 5.784 1.00 72.14 H new ATOM 0 HD22 ASN A 59 15.129 -3.780 4.218 1.00 72.14 H new ATOM 937 N LEU A 60 15.137 -3.722 10.285 1.00 41.22 N ATOM 938 CA LEU A 60 14.940 -3.575 11.723 1.00 53.33 C ATOM 939 C LEU A 60 15.345 -2.180 12.188 1.00 14.30 C ATOM 940 O LEU A 60 16.495 -1.772 12.029 1.00 5.44 O ATOM 941 CB LEU A 60 15.747 -4.631 12.479 1.00 71.30 C ATOM 942 CG LEU A 60 15.168 -5.086 13.819 1.00 32.30 C ATOM 943 CD1 LEU A 60 15.923 -6.298 14.343 1.00 2.42 C ATOM 944 CD2 LEU A 60 15.209 -3.951 14.831 1.00 1.40 C ATOM 0 H LEU A 60 15.992 -3.293 9.931 1.00 41.22 H new ATOM 0 HA LEU A 60 13.880 -3.716 11.936 1.00 53.33 H new ATOM 0 HB2 LEU A 60 15.855 -5.505 11.837 1.00 71.30 H new ATOM 0 HB3 LEU A 60 16.749 -4.238 12.653 1.00 71.30 H new ATOM 0 HG LEU A 60 14.127 -5.371 13.665 1.00 32.30 H new ATOM 0 HD11 LEU A 60 15.497 -6.607 15.297 1.00 2.42 H new ATOM 0 HD12 LEU A 60 15.841 -7.115 13.627 1.00 2.42 H new ATOM 0 HD13 LEU A 60 16.973 -6.041 14.481 1.00 2.42 H new ATOM 0 HD21 LEU A 60 14.793 -4.293 15.779 1.00 1.40 H new ATOM 0 HD22 LEU A 60 16.241 -3.634 14.981 1.00 1.40 H new ATOM 0 HD23 LEU A 60 14.622 -3.111 14.459 1.00 1.40 H new ATOM 956 N ILE A 61 14.392 -1.454 12.764 1.00 22.24 N ATOM 957 CA ILE A 61 14.651 -0.107 13.256 1.00 50.42 C ATOM 958 C ILE A 61 13.889 0.163 14.549 1.00 73.12 C ATOM 959 O ILE A 61 12.894 -0.499 14.846 1.00 33.11 O ATOM 960 CB ILE A 61 14.262 0.957 12.213 1.00 41.45 C ATOM 961 CG1 ILE A 61 12.740 1.042 12.081 1.00 70.53 C ATOM 962 CG2 ILE A 61 14.899 0.639 10.868 1.00 32.41 C ATOM 963 CD1 ILE A 61 12.278 2.041 11.044 1.00 14.42 C ATOM 0 H ILE A 61 13.434 -1.776 12.901 1.00 22.24 H new ATOM 0 HA ILE A 61 15.722 -0.042 13.448 1.00 50.42 H new ATOM 0 HB ILE A 61 14.633 1.925 12.549 1.00 41.45 H new ATOM 0 HG12 ILE A 61 12.350 0.057 11.824 1.00 70.53 H new ATOM 0 HG13 ILE A 61 12.314 1.311 13.048 1.00 70.53 H new ATOM 0 HG21 ILE A 61 14.614 1.400 10.142 1.00 32.41 H new ATOM 0 HG22 ILE A 61 15.984 0.625 10.973 1.00 32.41 H new ATOM 0 HG23 ILE A 61 14.556 -0.337 10.524 1.00 32.41 H new ATOM 0 HD11 ILE A 61 11.189 2.048 11.005 1.00 14.42 H new ATOM 0 HD12 ILE A 61 12.638 3.035 11.311 1.00 14.42 H new ATOM 0 HD13 ILE A 61 12.674 1.762 10.068 1.00 14.42 H new ATOM 975 N THR A 62 14.361 1.141 15.315 1.00 41.30 N ATOM 976 CA THR A 62 13.724 1.500 16.576 1.00 24.30 C ATOM 977 C THR A 62 13.048 2.862 16.482 1.00 14.34 C ATOM 978 O THR A 62 13.295 3.627 15.550 1.00 42.10 O ATOM 979 CB THR A 62 14.742 1.523 17.732 1.00 32.24 C ATOM 980 OG1 THR A 62 15.483 2.748 17.708 1.00 21.33 O ATOM 981 CG2 THR A 62 15.698 0.344 17.636 1.00 72.53 C ATOM 0 H THR A 62 15.183 1.699 15.084 1.00 41.30 H new ATOM 0 HA THR A 62 12.972 0.738 16.779 1.00 24.30 H new ATOM 0 HB THR A 62 14.193 1.449 18.671 1.00 32.24 H new ATOM 0 HG1 THR A 62 15.824 2.906 16.803 1.00 21.33 H new ATOM 0 HG21 THR A 62 16.407 0.382 18.463 1.00 72.53 H new ATOM 0 HG22 THR A 62 15.133 -0.587 17.685 1.00 72.53 H new ATOM 0 HG23 THR A 62 16.240 0.391 16.691 1.00 72.53 H new ATOM 989 N VAL A 63 12.192 3.161 17.455 1.00 51.11 N ATOM 990 CA VAL A 63 11.480 4.433 17.483 1.00 43.31 C ATOM 991 C VAL A 63 11.245 4.900 18.915 1.00 4.11 C ATOM 992 O VAL A 63 10.975 4.094 19.805 1.00 3.20 O ATOM 993 CB VAL A 63 10.125 4.334 16.758 1.00 12.21 C ATOM 994 CG1 VAL A 63 9.539 5.719 16.528 1.00 5.25 C ATOM 995 CG2 VAL A 63 10.278 3.586 15.442 1.00 2.33 C ATOM 0 H VAL A 63 11.975 2.539 18.234 1.00 51.11 H new ATOM 0 HA VAL A 63 12.108 5.158 16.966 1.00 43.31 H new ATOM 0 HB VAL A 63 9.435 3.774 17.390 1.00 12.21 H new ATOM 0 HG11 VAL A 63 8.582 5.628 16.015 1.00 5.25 H new ATOM 0 HG12 VAL A 63 9.391 6.215 17.487 1.00 5.25 H new ATOM 0 HG13 VAL A 63 10.224 6.307 15.917 1.00 5.25 H new ATOM 0 HG21 VAL A 63 9.311 3.526 14.943 1.00 2.33 H new ATOM 0 HG22 VAL A 63 10.984 4.116 14.802 1.00 2.33 H new ATOM 0 HG23 VAL A 63 10.649 2.580 15.636 1.00 2.33 H new ATOM 1005 N ALA A 64 11.350 6.207 19.130 1.00 12.41 N ATOM 1006 CA ALA A 64 11.146 6.783 20.454 1.00 61.41 C ATOM 1007 C ALA A 64 9.962 7.743 20.459 1.00 53.12 C ATOM 1008 O ALA A 64 9.209 7.820 19.488 1.00 13.11 O ATOM 1009 CB ALA A 64 12.407 7.495 20.920 1.00 65.52 C ATOM 0 H ALA A 64 11.575 6.887 18.404 1.00 12.41 H new ATOM 0 HA ALA A 64 10.924 5.970 21.146 1.00 61.41 H new ATOM 0 HB1 ALA A 64 12.240 7.920 21.910 1.00 65.52 H new ATOM 0 HB2 ALA A 64 13.231 6.783 20.965 1.00 65.52 H new ATOM 0 HB3 ALA A 64 12.654 8.293 20.220 1.00 65.52 H new ATOM 1015 N SER A 65 9.802 8.473 21.558 1.00 45.30 N ATOM 1016 CA SER A 65 8.706 9.426 21.691 1.00 64.13 C ATOM 1017 C SER A 65 9.106 10.591 22.591 1.00 54.44 C ATOM 1018 O SER A 65 8.811 10.616 23.786 1.00 74.23 O ATOM 1019 CB SER A 65 7.465 8.732 22.256 1.00 45.21 C ATOM 1020 OG SER A 65 7.693 7.345 22.432 1.00 33.42 O ATOM 0 H SER A 65 10.418 8.423 22.370 1.00 45.30 H new ATOM 0 HA SER A 65 8.475 9.818 20.700 1.00 64.13 H new ATOM 0 HB2 SER A 65 7.195 9.183 23.211 1.00 45.21 H new ATOM 0 HB3 SER A 65 6.622 8.883 21.582 1.00 45.21 H new ATOM 0 HG SER A 65 6.886 6.924 22.795 1.00 33.42 H new ATOM 1026 N PRO A 66 9.794 11.582 22.004 1.00 53.12 N ATOM 1027 CA PRO A 66 10.248 12.770 22.733 1.00 64.21 C ATOM 1028 C PRO A 66 9.093 13.679 23.137 1.00 3.42 C ATOM 1029 O PRO A 66 8.335 14.150 22.290 1.00 21.13 O ATOM 1030 CB PRO A 66 11.159 13.477 21.726 1.00 52.11 C ATOM 1031 CG PRO A 66 10.669 13.028 20.392 1.00 3.43 C ATOM 1032 CD PRO A 66 10.180 11.619 20.583 1.00 1.34 C ATOM 0 HA PRO A 66 10.744 12.510 23.668 1.00 64.21 H new ATOM 0 HB2 PRO A 66 11.095 14.560 21.827 1.00 52.11 H new ATOM 0 HB3 PRO A 66 12.203 13.204 21.877 1.00 52.11 H new ATOM 0 HG2 PRO A 66 9.868 13.674 20.033 1.00 3.43 H new ATOM 0 HG3 PRO A 66 11.466 13.067 19.650 1.00 3.43 H new ATOM 0 HD2 PRO A 66 9.336 11.395 19.931 1.00 1.34 H new ATOM 0 HD3 PRO A 66 10.958 10.890 20.359 1.00 1.34 H new ATOM 1040 N GLY A 67 8.965 13.924 24.438 1.00 24.50 N ATOM 1041 CA GLY A 67 7.900 14.777 24.931 1.00 21.45 C ATOM 1042 C GLY A 67 6.590 14.032 25.096 1.00 22.21 C ATOM 1043 O GLY A 67 5.522 14.642 25.143 1.00 41.41 O ATOM 0 H GLY A 67 9.580 13.547 25.159 1.00 24.50 H new ATOM 0 HA2 GLY A 67 8.195 15.204 25.890 1.00 21.45 H new ATOM 0 HA3 GLY A 67 7.757 15.609 24.242 1.00 21.45 H new ATOM 1047 N PHE A 68 6.671 12.708 25.183 1.00 53.25 N ATOM 1048 CA PHE A 68 5.482 11.879 25.340 1.00 72.40 C ATOM 1049 C PHE A 68 5.699 10.814 26.412 1.00 41.52 C ATOM 1050 O PHE A 68 6.812 10.317 26.593 1.00 55.40 O ATOM 1051 CB PHE A 68 5.119 11.213 24.011 1.00 53.11 C ATOM 1052 CG PHE A 68 3.848 10.414 24.068 1.00 25.41 C ATOM 1053 CD1 PHE A 68 2.701 10.951 24.629 1.00 20.31 C ATOM 1054 CD2 PHE A 68 3.802 9.125 23.560 1.00 13.34 C ATOM 1055 CE1 PHE A 68 1.531 10.217 24.684 1.00 62.24 C ATOM 1056 CE2 PHE A 68 2.634 8.387 23.612 1.00 65.42 C ATOM 1057 CZ PHE A 68 1.497 8.934 24.173 1.00 25.33 C ATOM 0 H PHE A 68 7.547 12.187 25.147 1.00 53.25 H new ATOM 0 HA PHE A 68 4.660 12.523 25.653 1.00 72.40 H new ATOM 0 HB2 PHE A 68 5.022 11.981 23.244 1.00 53.11 H new ATOM 0 HB3 PHE A 68 5.936 10.559 23.706 1.00 53.11 H new ATOM 0 HD1 PHE A 68 2.721 11.954 25.028 1.00 20.31 H new ATOM 0 HD2 PHE A 68 4.688 8.693 23.119 1.00 13.34 H new ATOM 0 HE1 PHE A 68 0.644 10.646 25.126 1.00 62.24 H new ATOM 0 HE2 PHE A 68 2.611 7.383 23.214 1.00 65.42 H new ATOM 0 HZ PHE A 68 0.583 8.360 24.212 1.00 25.33 H new ATOM 1067 N LEU A 69 4.629 10.470 27.120 1.00 25.01 N ATOM 1068 CA LEU A 69 4.702 9.465 28.175 1.00 13.23 C ATOM 1069 C LEU A 69 5.589 9.941 29.321 1.00 45.23 C ATOM 1070 O LEU A 69 5.102 10.473 30.319 1.00 73.24 O ATOM 1071 CB LEU A 69 5.236 8.146 27.615 1.00 42.12 C ATOM 1072 CG LEU A 69 4.193 7.062 27.340 1.00 24.01 C ATOM 1073 CD1 LEU A 69 3.837 6.327 28.623 1.00 62.32 C ATOM 1074 CD2 LEU A 69 2.949 7.667 26.707 1.00 40.12 C ATOM 0 H LEU A 69 3.701 10.872 26.983 1.00 25.01 H new ATOM 0 HA LEU A 69 3.695 9.307 28.561 1.00 13.23 H new ATOM 0 HB2 LEU A 69 5.765 8.357 26.686 1.00 42.12 H new ATOM 0 HB3 LEU A 69 5.969 7.747 28.316 1.00 42.12 H new ATOM 0 HG LEU A 69 4.619 6.344 26.640 1.00 24.01 H new ATOM 0 HD11 LEU A 69 3.094 5.559 28.408 1.00 62.32 H new ATOM 0 HD12 LEU A 69 4.732 5.860 29.035 1.00 62.32 H new ATOM 0 HD13 LEU A 69 3.430 7.034 29.346 1.00 62.32 H new ATOM 0 HD21 LEU A 69 2.218 6.881 26.518 1.00 40.12 H new ATOM 0 HD22 LEU A 69 2.520 8.407 27.383 1.00 40.12 H new ATOM 0 HD23 LEU A 69 3.217 8.147 25.766 1.00 40.12 H new ATOM 1086 N HIS A 70 6.896 9.749 29.169 1.00 20.43 N ATOM 1087 CA HIS A 70 7.853 10.161 30.190 1.00 71.10 C ATOM 1088 C HIS A 70 9.255 10.286 29.602 1.00 60.35 C ATOM 1089 O HIS A 70 10.250 10.196 30.321 1.00 54.45 O ATOM 1090 CB HIS A 70 7.860 9.161 31.346 1.00 33.15 C ATOM 1091 CG HIS A 70 7.476 9.764 32.662 1.00 14.24 C ATOM 1092 ND1 HIS A 70 8.069 10.900 33.171 1.00 10.23 N ATOM 1093 CD2 HIS A 70 6.551 9.384 33.574 1.00 34.04 C ATOM 1094 CE1 HIS A 70 7.527 11.192 34.340 1.00 32.52 C ATOM 1095 NE2 HIS A 70 6.602 10.287 34.608 1.00 42.04 N ATOM 0 H HIS A 70 7.316 9.311 28.349 1.00 20.43 H new ATOM 0 HA HIS A 70 7.547 11.137 30.566 1.00 71.10 H new ATOM 0 HB2 HIS A 70 7.174 8.346 31.115 1.00 33.15 H new ATOM 0 HB3 HIS A 70 8.855 8.725 31.432 1.00 33.15 H new ATOM 0 HD2 HIS A 70 5.895 8.529 33.502 1.00 34.04 H new ATOM 0 HE1 HIS A 70 7.794 12.028 34.969 1.00 32.52 H new ATOM 0 HE2 HIS A 70 6.021 10.263 35.446 1.00 42.04 H new ATOM 1103 N GLU A 71 9.325 10.492 28.290 1.00 21.40 N ATOM 1104 CA GLU A 71 10.606 10.627 27.606 1.00 31.41 C ATOM 1105 C GLU A 71 11.067 12.081 27.596 1.00 12.34 C ATOM 1106 O GLU A 71 10.275 12.997 27.821 1.00 42.20 O ATOM 1107 CB GLU A 71 10.501 10.104 26.172 1.00 71.12 C ATOM 1108 CG GLU A 71 10.997 8.677 26.006 1.00 11.31 C ATOM 1109 CD GLU A 71 12.502 8.599 25.840 1.00 21.42 C ATOM 1110 OE1 GLU A 71 13.220 9.262 26.618 1.00 55.42 O ATOM 1111 OE2 GLU A 71 12.963 7.874 24.933 1.00 14.25 O ATOM 0 H GLU A 71 8.511 10.569 27.681 1.00 21.40 H new ATOM 0 HA GLU A 71 11.343 10.034 28.148 1.00 31.41 H new ATOM 0 HB2 GLU A 71 9.461 10.158 25.850 1.00 71.12 H new ATOM 0 HB3 GLU A 71 11.073 10.757 25.513 1.00 71.12 H new ATOM 0 HG2 GLU A 71 10.700 8.090 26.875 1.00 11.31 H new ATOM 0 HG3 GLU A 71 10.515 8.228 25.138 1.00 11.31 H new ATOM 1118 N LYS A 72 12.353 12.286 27.335 1.00 4.33 N ATOM 1119 CA LYS A 72 12.922 13.628 27.295 1.00 1.32 C ATOM 1120 C LYS A 72 12.262 14.466 26.205 1.00 44.52 C ATOM 1121 O LYS A 72 11.562 13.939 25.340 1.00 12.44 O ATOM 1122 CB LYS A 72 14.432 13.558 27.056 1.00 71.33 C ATOM 1123 CG LYS A 72 15.164 12.672 28.048 1.00 25.34 C ATOM 1124 CD LYS A 72 16.466 12.144 27.470 1.00 63.54 C ATOM 1125 CE LYS A 72 17.647 13.017 27.865 1.00 50.33 C ATOM 1126 NZ LYS A 72 17.832 14.158 26.925 1.00 21.40 N ATOM 0 H LYS A 72 13.022 11.539 27.148 1.00 4.33 H new ATOM 0 HA LYS A 72 12.735 14.104 28.258 1.00 1.32 H new ATOM 0 HB2 LYS A 72 14.615 13.188 26.047 1.00 71.33 H new ATOM 0 HB3 LYS A 72 14.846 14.565 27.106 1.00 71.33 H new ATOM 0 HG2 LYS A 72 15.371 13.236 28.957 1.00 25.34 H new ATOM 0 HG3 LYS A 72 14.525 11.836 28.331 1.00 25.34 H new ATOM 0 HD2 LYS A 72 16.633 11.125 27.819 1.00 63.54 H new ATOM 0 HD3 LYS A 72 16.392 12.101 26.383 1.00 63.54 H new ATOM 0 HE2 LYS A 72 17.495 13.399 28.874 1.00 50.33 H new ATOM 0 HE3 LYS A 72 18.554 12.413 27.886 1.00 50.33 H new ATOM 0 HZ1 LYS A 72 18.792 14.127 26.527 1.00 21.40 H new ATOM 0 HZ2 LYS A 72 17.136 14.090 26.155 1.00 21.40 H new ATOM 0 HZ3 LYS A 72 17.697 15.054 27.436 1.00 21.40 H new ATOM 1140 N LYS A 73 12.492 15.774 26.250 1.00 12.41 N ATOM 1141 CA LYS A 73 11.923 16.686 25.265 1.00 55.20 C ATOM 1142 C LYS A 73 12.745 16.682 23.980 1.00 32.52 C ATOM 1143 O LYS A 73 13.910 16.285 23.980 1.00 44.25 O ATOM 1144 CB LYS A 73 11.853 18.105 25.833 1.00 10.34 C ATOM 1145 CG LYS A 73 13.189 18.627 26.332 1.00 24.12 C ATOM 1146 CD LYS A 73 13.075 19.206 27.732 1.00 15.13 C ATOM 1147 CE LYS A 73 13.260 18.134 28.796 1.00 51.43 C ATOM 1148 NZ LYS A 73 13.168 18.697 30.172 1.00 72.44 N ATOM 0 H LYS A 73 13.069 16.226 26.959 1.00 12.41 H new ATOM 0 HA LYS A 73 10.915 16.344 25.032 1.00 55.20 H new ATOM 0 HB2 LYS A 73 11.474 18.777 25.063 1.00 10.34 H new ATOM 0 HB3 LYS A 73 11.136 18.124 26.653 1.00 10.34 H new ATOM 0 HG2 LYS A 73 13.920 17.818 26.330 1.00 24.12 H new ATOM 0 HG3 LYS A 73 13.559 19.392 25.650 1.00 24.12 H new ATOM 0 HD2 LYS A 73 13.824 19.986 27.866 1.00 15.13 H new ATOM 0 HD3 LYS A 73 12.099 19.676 27.854 1.00 15.13 H new ATOM 0 HE2 LYS A 73 12.502 17.361 28.668 1.00 51.43 H new ATOM 0 HE3 LYS A 73 14.230 17.655 28.664 1.00 51.43 H new ATOM 0 HZ1 LYS A 73 13.299 17.936 30.868 1.00 72.44 H new ATOM 0 HZ2 LYS A 73 13.907 19.417 30.303 1.00 72.44 H new ATOM 0 HZ3 LYS A 73 12.233 19.132 30.307 1.00 72.44 H new ATOM 1162 N ASP A 74 12.131 17.125 22.889 1.00 40.41 N ATOM 1163 CA ASP A 74 12.807 17.175 21.598 1.00 64.31 C ATOM 1164 C ASP A 74 14.140 17.908 21.710 1.00 3.14 C ATOM 1165 O ASP A 74 14.271 18.867 22.470 1.00 33.34 O ATOM 1166 CB ASP A 74 11.919 17.861 20.559 1.00 44.31 C ATOM 1167 CG ASP A 74 11.167 19.046 21.133 1.00 74.45 C ATOM 1168 OD1 ASP A 74 11.780 20.123 21.279 1.00 54.44 O ATOM 1169 OD2 ASP A 74 9.965 18.894 21.436 1.00 15.33 O ATOM 0 H ASP A 74 11.166 17.455 22.873 1.00 40.41 H new ATOM 0 HA ASP A 74 13.002 16.151 21.278 1.00 64.31 H new ATOM 0 HB2 ASP A 74 12.534 18.195 19.723 1.00 44.31 H new ATOM 0 HB3 ASP A 74 11.205 17.139 20.162 1.00 44.31 H new ATOM 1174 N GLY A 75 15.129 17.449 20.948 1.00 13.44 N ATOM 1175 CA GLY A 75 16.439 18.073 20.978 1.00 30.34 C ATOM 1176 C GLY A 75 17.349 17.459 22.024 1.00 61.02 C ATOM 1177 O GLY A 75 18.506 17.144 21.742 1.00 14.51 O ATOM 0 H GLY A 75 15.046 16.657 20.311 1.00 13.44 H new ATOM 0 HA2 GLY A 75 16.904 17.981 19.997 1.00 30.34 H new ATOM 0 HA3 GLY A 75 16.326 19.138 21.179 1.00 30.34 H new ATOM 1181 N ASP A 76 16.828 17.290 23.234 1.00 73.33 N ATOM 1182 CA ASP A 76 17.602 16.710 24.326 1.00 55.25 C ATOM 1183 C ASP A 76 17.835 15.220 24.095 1.00 1.41 C ATOM 1184 O ASP A 76 18.975 14.757 24.068 1.00 24.13 O ATOM 1185 CB ASP A 76 16.884 16.926 25.659 1.00 54.33 C ATOM 1186 CG ASP A 76 17.820 17.411 26.748 1.00 15.52 C ATOM 1187 OD1 ASP A 76 18.715 18.226 26.441 1.00 20.34 O ATOM 1188 OD2 ASP A 76 17.657 16.976 27.908 1.00 41.23 O ATOM 0 H ASP A 76 15.873 17.546 23.484 1.00 73.33 H new ATOM 0 HA ASP A 76 18.570 17.210 24.358 1.00 55.25 H new ATOM 0 HB2 ASP A 76 16.082 17.652 25.523 1.00 54.33 H new ATOM 0 HB3 ASP A 76 16.419 15.992 25.973 1.00 54.33 H new ATOM 1193 N PHE A 77 16.747 14.475 23.930 1.00 25.32 N ATOM 1194 CA PHE A 77 16.834 13.037 23.704 1.00 34.31 C ATOM 1195 C PHE A 77 17.828 12.720 22.591 1.00 74.33 C ATOM 1196 O PHE A 77 18.605 11.771 22.691 1.00 72.21 O ATOM 1197 CB PHE A 77 15.457 12.471 23.350 1.00 14.31 C ATOM 1198 CG PHE A 77 15.442 10.977 23.202 1.00 21.35 C ATOM 1199 CD1 PHE A 77 15.613 10.157 24.306 1.00 35.51 C ATOM 1200 CD2 PHE A 77 15.259 10.392 21.960 1.00 75.22 C ATOM 1201 CE1 PHE A 77 15.599 8.781 24.174 1.00 64.32 C ATOM 1202 CE2 PHE A 77 15.244 9.017 21.821 1.00 20.25 C ATOM 1203 CZ PHE A 77 15.416 8.210 22.930 1.00 51.25 C ATOM 0 H PHE A 77 15.796 14.843 23.949 1.00 25.32 H new ATOM 0 HA PHE A 77 17.186 12.571 24.624 1.00 34.31 H new ATOM 0 HB2 PHE A 77 14.745 12.758 24.124 1.00 14.31 H new ATOM 0 HB3 PHE A 77 15.116 12.924 22.419 1.00 14.31 H new ATOM 0 HD1 PHE A 77 15.759 10.598 25.281 1.00 35.51 H new ATOM 0 HD2 PHE A 77 15.126 11.018 21.090 1.00 75.22 H new ATOM 0 HE1 PHE A 77 15.731 8.153 25.043 1.00 64.32 H new ATOM 0 HE2 PHE A 77 15.098 8.574 20.847 1.00 20.25 H new ATOM 0 HZ PHE A 77 15.407 7.135 22.824 1.00 51.25 H new ATOM 1213 N GLN A 78 17.795 13.521 21.531 1.00 71.23 N ATOM 1214 CA GLN A 78 18.692 13.325 20.398 1.00 52.12 C ATOM 1215 C GLN A 78 20.150 13.436 20.832 1.00 15.11 C ATOM 1216 O GLN A 78 20.984 12.610 20.461 1.00 51.42 O ATOM 1217 CB GLN A 78 18.394 14.350 19.302 1.00 63.33 C ATOM 1218 CG GLN A 78 17.623 13.775 18.124 1.00 24.24 C ATOM 1219 CD GLN A 78 16.406 14.603 17.763 1.00 2.13 C ATOM 1220 OE1 GLN A 78 15.799 15.243 18.623 1.00 44.15 O ATOM 1221 NE2 GLN A 78 16.042 14.596 16.486 1.00 23.52 N ATOM 0 H GLN A 78 17.157 14.311 21.433 1.00 71.23 H new ATOM 0 HA GLN A 78 18.525 12.323 20.004 1.00 52.12 H new ATOM 0 HB2 GLN A 78 17.824 15.173 19.732 1.00 63.33 H new ATOM 0 HB3 GLN A 78 19.334 14.767 18.941 1.00 63.33 H new ATOM 0 HG2 GLN A 78 18.283 13.711 17.259 1.00 24.24 H new ATOM 0 HG3 GLN A 78 17.309 12.759 18.362 1.00 24.24 H new ATOM 0 HE21 GLN A 78 16.574 14.051 15.807 1.00 23.52 H new ATOM 0 HE22 GLN A 78 15.231 15.135 16.184 1.00 23.52 H new ATOM 1230 N LYS A 79 20.450 14.462 21.620 1.00 2.55 N ATOM 1231 CA LYS A 79 21.807 14.682 22.107 1.00 41.41 C ATOM 1232 C LYS A 79 22.209 13.601 23.105 1.00 44.04 C ATOM 1233 O LYS A 79 23.272 12.992 22.979 1.00 52.11 O ATOM 1234 CB LYS A 79 21.919 16.062 22.761 1.00 62.44 C ATOM 1235 CG LYS A 79 21.490 17.202 21.853 1.00 31.53 C ATOM 1236 CD LYS A 79 20.964 18.382 22.652 1.00 12.21 C ATOM 1237 CE LYS A 79 20.519 19.517 21.742 1.00 32.12 C ATOM 1238 NZ LYS A 79 21.559 20.577 21.628 1.00 34.25 N ATOM 0 H LYS A 79 19.771 15.155 21.936 1.00 2.55 H new ATOM 0 HA LYS A 79 22.484 14.635 21.254 1.00 41.41 H new ATOM 0 HB2 LYS A 79 21.308 16.078 23.663 1.00 62.44 H new ATOM 0 HB3 LYS A 79 22.951 16.225 23.072 1.00 62.44 H new ATOM 0 HG2 LYS A 79 22.336 17.522 21.244 1.00 31.53 H new ATOM 0 HG3 LYS A 79 20.718 16.852 21.168 1.00 31.53 H new ATOM 0 HD2 LYS A 79 20.126 18.060 23.270 1.00 12.21 H new ATOM 0 HD3 LYS A 79 21.740 18.740 23.329 1.00 12.21 H new ATOM 0 HE2 LYS A 79 20.294 19.121 20.752 1.00 32.12 H new ATOM 0 HE3 LYS A 79 19.598 19.952 22.129 1.00 32.12 H new ATOM 0 HZ1 LYS A 79 21.218 21.332 21.000 1.00 34.25 H new ATOM 0 HZ2 LYS A 79 21.756 20.973 22.569 1.00 34.25 H new ATOM 0 HZ3 LYS A 79 22.431 20.167 21.235 1.00 34.25 H new ATOM 1252 N TRP A 80 21.354 13.367 24.093 1.00 10.11 N ATOM 1253 CA TRP A 80 21.621 12.357 25.111 1.00 15.43 C ATOM 1254 C TRP A 80 21.905 11.002 24.473 1.00 42.41 C ATOM 1255 O TRP A 80 22.810 10.283 24.898 1.00 40.44 O ATOM 1256 CB TRP A 80 20.434 12.244 26.070 1.00 52.33 C ATOM 1257 CG TRP A 80 20.385 10.938 26.803 1.00 74.14 C ATOM 1258 CD1 TRP A 80 20.925 10.664 28.027 1.00 60.15 C ATOM 1259 CD2 TRP A 80 19.762 9.728 26.357 1.00 65.04 C ATOM 1260 NE1 TRP A 80 20.676 9.356 28.368 1.00 4.42 N ATOM 1261 CE2 TRP A 80 19.964 8.761 27.361 1.00 41.10 C ATOM 1262 CE3 TRP A 80 19.053 9.368 25.208 1.00 60.32 C ATOM 1263 CZ2 TRP A 80 19.483 7.460 27.248 1.00 35.42 C ATOM 1264 CZ3 TRP A 80 18.576 8.076 25.097 1.00 20.53 C ATOM 1265 CH2 TRP A 80 18.792 7.134 26.113 1.00 55.32 C ATOM 0 H TRP A 80 20.470 13.862 24.211 1.00 10.11 H new ATOM 0 HA TRP A 80 22.504 12.666 25.671 1.00 15.43 H new ATOM 0 HB2 TRP A 80 20.482 13.057 26.794 1.00 52.33 H new ATOM 0 HB3 TRP A 80 19.509 12.372 25.508 1.00 52.33 H new ATOM 0 HD1 TRP A 80 21.468 11.371 28.637 1.00 60.15 H new ATOM 0 HE1 TRP A 80 20.973 8.902 29.232 1.00 4.42 H new ATOM 0 HE3 TRP A 80 18.881 10.087 24.421 1.00 60.32 H new ATOM 0 HZ2 TRP A 80 19.649 6.733 28.029 1.00 35.42 H new ATOM 0 HZ3 TRP A 80 18.028 7.787 24.213 1.00 20.53 H new ATOM 0 HH2 TRP A 80 18.406 6.132 25.997 1.00 55.32 H new ATOM 1276 N TYR A 81 21.128 10.660 23.451 1.00 23.24 N ATOM 1277 CA TYR A 81 21.296 9.389 22.756 1.00 2.30 C ATOM 1278 C TYR A 81 22.536 9.415 21.867 1.00 72.50 C ATOM 1279 O TYR A 81 23.194 8.393 21.672 1.00 41.34 O ATOM 1280 CB TYR A 81 20.058 9.077 21.914 1.00 33.15 C ATOM 1281 CG TYR A 81 20.336 8.159 20.745 1.00 13.33 C ATOM 1282 CD1 TYR A 81 20.620 6.814 20.945 1.00 41.14 C ATOM 1283 CD2 TYR A 81 20.313 8.638 19.441 1.00 70.21 C ATOM 1284 CE1 TYR A 81 20.875 5.973 19.879 1.00 25.43 C ATOM 1285 CE2 TYR A 81 20.566 7.803 18.369 1.00 14.24 C ATOM 1286 CZ TYR A 81 20.847 6.472 18.594 1.00 71.42 C ATOM 1287 OH TYR A 81 21.099 5.636 17.530 1.00 43.22 O ATOM 0 H TYR A 81 20.376 11.245 23.086 1.00 23.24 H new ATOM 0 HA TYR A 81 21.424 8.608 23.505 1.00 2.30 H new ATOM 0 HB2 TYR A 81 19.301 8.620 22.552 1.00 33.15 H new ATOM 0 HB3 TYR A 81 19.639 10.011 21.540 1.00 33.15 H new ATOM 0 HD1 TYR A 81 20.642 6.419 21.950 1.00 41.14 H new ATOM 0 HD2 TYR A 81 20.094 9.680 19.262 1.00 70.21 H new ATOM 0 HE1 TYR A 81 21.095 4.930 20.051 1.00 25.43 H new ATOM 0 HE2 TYR A 81 20.544 8.191 17.361 1.00 14.24 H new ATOM 0 HH TYR A 81 20.467 5.829 16.806 1.00 43.22 H new ATOM 1297 N ALA A 82 22.848 10.590 21.331 1.00 12.03 N ATOM 1298 CA ALA A 82 24.009 10.751 20.465 1.00 23.24 C ATOM 1299 C ALA A 82 25.306 10.648 21.261 1.00 11.34 C ATOM 1300 O ALA A 82 26.395 10.603 20.690 1.00 15.12 O ATOM 1301 CB ALA A 82 23.941 12.083 19.733 1.00 62.30 C ATOM 0 H ALA A 82 22.312 11.445 21.481 1.00 12.03 H new ATOM 0 HA ALA A 82 23.999 9.945 19.731 1.00 23.24 H new ATOM 0 HB1 ALA A 82 24.815 12.190 19.090 1.00 62.30 H new ATOM 0 HB2 ALA A 82 23.037 12.119 19.126 1.00 62.30 H new ATOM 0 HB3 ALA A 82 23.923 12.896 20.458 1.00 62.30 H new ATOM 1307 N GLY A 83 25.181 10.613 22.585 1.00 64.12 N ATOM 1308 CA GLY A 83 26.352 10.517 23.438 1.00 53.04 C ATOM 1309 C GLY A 83 26.392 9.221 24.224 1.00 52.54 C ATOM 1310 O GLY A 83 27.095 9.118 25.229 1.00 2.25 O ATOM 0 H GLY A 83 24.291 10.649 23.081 1.00 64.12 H new ATOM 0 HA2 GLY A 83 27.251 10.595 22.826 1.00 53.04 H new ATOM 0 HA3 GLY A 83 26.363 11.359 24.130 1.00 53.04 H new ATOM 1314 N LEU A 84 25.635 8.230 23.766 1.00 15.54 N ATOM 1315 CA LEU A 84 25.585 6.935 24.435 1.00 73.44 C ATOM 1316 C LEU A 84 26.686 6.014 23.919 1.00 20.44 C ATOM 1317 O LEU A 84 27.778 5.961 24.482 1.00 25.15 O ATOM 1318 CB LEU A 84 24.218 6.282 24.223 1.00 74.20 C ATOM 1319 CG LEU A 84 23.064 6.859 25.043 1.00 12.45 C ATOM 1320 CD1 LEU A 84 21.735 6.296 24.566 1.00 75.14 C ATOM 1321 CD2 LEU A 84 23.266 6.571 26.524 1.00 12.50 C ATOM 0 H LEU A 84 25.048 8.298 22.935 1.00 15.54 H new ATOM 0 HA LEU A 84 25.742 7.098 25.501 1.00 73.44 H new ATOM 0 HB2 LEU A 84 23.961 6.359 23.167 1.00 74.20 H new ATOM 0 HB3 LEU A 84 24.305 5.220 24.453 1.00 74.20 H new ATOM 0 HG LEU A 84 23.049 7.940 24.901 1.00 12.45 H new ATOM 0 HD11 LEU A 84 20.926 6.719 25.162 1.00 75.14 H new ATOM 0 HD12 LEU A 84 21.586 6.554 23.517 1.00 75.14 H new ATOM 0 HD13 LEU A 84 21.739 5.212 24.676 1.00 75.14 H new ATOM 0 HD21 LEU A 84 22.435 6.989 27.093 1.00 12.50 H new ATOM 0 HD22 LEU A 84 23.309 5.493 26.683 1.00 12.50 H new ATOM 0 HD23 LEU A 84 24.199 7.024 26.859 1.00 12.50 H new ATOM 1333 N ASN A 85 26.391 5.291 22.844 1.00 73.41 N ATOM 1334 CA ASN A 85 27.357 4.373 22.251 1.00 34.43 C ATOM 1335 C ASN A 85 26.719 3.564 21.126 1.00 51.14 C ATOM 1336 O ASN A 85 27.069 2.404 20.905 1.00 15.30 O ATOM 1337 CB ASN A 85 27.916 3.429 23.318 1.00 0.32 C ATOM 1338 CG ASN A 85 29.429 3.489 23.407 1.00 72.22 C ATOM 1339 OD1 ASN A 85 30.124 3.439 22.392 1.00 74.23 O ATOM 1340 ND2 ASN A 85 29.946 3.596 24.625 1.00 22.11 N ATOM 0 H ASN A 85 25.491 5.323 22.365 1.00 73.41 H new ATOM 0 HA ASN A 85 28.173 4.963 21.833 1.00 34.43 H new ATOM 0 HB2 ASN A 85 27.487 3.685 24.287 1.00 0.32 H new ATOM 0 HB3 ASN A 85 27.608 2.408 23.093 1.00 0.32 H new ATOM 0 HD21 ASN A 85 30.958 3.640 24.748 1.00 22.11 H new ATOM 0 HD22 ASN A 85 29.332 3.634 25.438 1.00 22.11 H new ATOM 1347 N TYR A 86 25.783 4.184 20.416 1.00 14.44 N ATOM 1348 CA TYR A 86 25.094 3.522 19.314 1.00 4.55 C ATOM 1349 C TYR A 86 24.854 4.492 18.161 1.00 1.03 C ATOM 1350 O TYR A 86 23.719 4.837 17.833 1.00 51.41 O ATOM 1351 CB TYR A 86 23.763 2.941 19.793 1.00 52.23 C ATOM 1352 CG TYR A 86 23.838 2.301 21.160 1.00 20.52 C ATOM 1353 CD1 TYR A 86 24.260 0.985 21.310 1.00 3.22 C ATOM 1354 CD2 TYR A 86 23.486 3.010 22.302 1.00 61.41 C ATOM 1355 CE1 TYR A 86 24.330 0.395 22.557 1.00 0.25 C ATOM 1356 CE2 TYR A 86 23.554 2.428 23.553 1.00 1.31 C ATOM 1357 CZ TYR A 86 23.976 1.121 23.676 1.00 64.02 C ATOM 1358 OH TYR A 86 24.044 0.538 24.920 1.00 22.14 O ATOM 0 H TYR A 86 25.484 5.145 20.584 1.00 14.44 H new ATOM 0 HA TYR A 86 25.728 2.711 18.956 1.00 4.55 H new ATOM 0 HB2 TYR A 86 23.016 3.735 19.813 1.00 52.23 H new ATOM 0 HB3 TYR A 86 23.420 2.199 19.072 1.00 52.23 H new ATOM 0 HD1 TYR A 86 24.538 0.414 20.436 1.00 3.22 H new ATOM 0 HD2 TYR A 86 23.154 4.033 22.210 1.00 61.41 H new ATOM 0 HE1 TYR A 86 24.660 -0.629 22.656 1.00 0.25 H new ATOM 0 HE2 TYR A 86 23.278 2.994 24.430 1.00 1.31 H new ATOM 0 HH TYR A 86 23.762 1.185 25.600 1.00 22.14 H new ATOM 1368 N PRO A 87 25.949 4.942 17.530 1.00 12.14 N ATOM 1369 CA PRO A 87 25.885 5.877 16.403 1.00 14.11 C ATOM 1370 C PRO A 87 25.306 5.233 15.148 1.00 63.22 C ATOM 1371 O PRO A 87 25.039 5.911 14.156 1.00 53.31 O ATOM 1372 CB PRO A 87 27.349 6.264 16.180 1.00 55.34 C ATOM 1373 CG PRO A 87 28.130 5.114 16.714 1.00 4.30 C ATOM 1374 CD PRO A 87 27.334 4.573 17.868 1.00 35.54 C ATOM 0 HA PRO A 87 25.233 6.725 16.613 1.00 14.11 H new ATOM 0 HB2 PRO A 87 27.559 6.428 15.123 1.00 55.34 H new ATOM 0 HB3 PRO A 87 27.598 7.188 16.702 1.00 55.34 H new ATOM 0 HG2 PRO A 87 28.275 4.352 15.948 1.00 4.30 H new ATOM 0 HG3 PRO A 87 29.121 5.432 17.038 1.00 4.30 H new ATOM 0 HD2 PRO A 87 27.450 3.494 17.965 1.00 35.54 H new ATOM 0 HD3 PRO A 87 27.648 5.014 18.814 1.00 35.54 H new ATOM 1382 N LYS A 88 25.115 3.919 15.197 1.00 22.22 N ATOM 1383 CA LYS A 88 24.567 3.182 14.065 1.00 72.11 C ATOM 1384 C LYS A 88 23.201 2.596 14.407 1.00 31.33 C ATOM 1385 O LYS A 88 22.724 1.676 13.741 1.00 52.10 O ATOM 1386 CB LYS A 88 25.523 2.063 13.647 1.00 64.03 C ATOM 1387 CG LYS A 88 26.242 2.335 12.336 1.00 12.04 C ATOM 1388 CD LYS A 88 26.920 1.085 11.802 1.00 32.40 C ATOM 1389 CE LYS A 88 28.136 1.428 10.956 1.00 3.32 C ATOM 1390 NZ LYS A 88 28.714 0.223 10.300 1.00 23.22 N ATOM 0 H LYS A 88 25.332 3.342 16.010 1.00 22.22 H new ATOM 0 HA LYS A 88 24.447 3.878 13.235 1.00 72.11 H new ATOM 0 HB2 LYS A 88 26.263 1.916 14.434 1.00 64.03 H new ATOM 0 HB3 LYS A 88 24.963 1.132 13.558 1.00 64.03 H new ATOM 0 HG2 LYS A 88 25.529 2.706 11.599 1.00 12.04 H new ATOM 0 HG3 LYS A 88 26.985 3.118 12.483 1.00 12.04 H new ATOM 0 HD2 LYS A 88 27.222 0.450 12.635 1.00 32.40 H new ATOM 0 HD3 LYS A 88 26.210 0.512 11.205 1.00 32.40 H new ATOM 0 HE2 LYS A 88 27.855 2.156 10.195 1.00 3.32 H new ATOM 0 HE3 LYS A 88 28.893 1.898 11.583 1.00 3.32 H new ATOM 0 HZ1 LYS A 88 29.541 0.499 9.733 1.00 23.22 H new ATOM 0 HZ2 LYS A 88 29.006 -0.462 11.027 1.00 23.22 H new ATOM 0 HZ3 LYS A 88 28.000 -0.212 9.682 1.00 23.22 H new ATOM 1404 N LEU A 89 22.576 3.134 15.448 1.00 35.15 N ATOM 1405 CA LEU A 89 21.263 2.665 15.878 1.00 13.14 C ATOM 1406 C LEU A 89 20.152 3.481 15.225 1.00 1.52 C ATOM 1407 O LEU A 89 20.048 4.694 15.411 1.00 12.03 O ATOM 1408 CB LEU A 89 21.143 2.747 17.401 1.00 5.42 C ATOM 1409 CG LEU A 89 21.146 1.413 18.148 1.00 70.12 C ATOM 1410 CD1 LEU A 89 20.870 1.629 19.628 1.00 73.44 C ATOM 1411 CD2 LEU A 89 20.122 0.463 17.545 1.00 34.30 C ATOM 0 H LEU A 89 22.957 3.895 16.010 1.00 35.15 H new ATOM 0 HA LEU A 89 21.157 1.626 15.567 1.00 13.14 H new ATOM 0 HB2 LEU A 89 21.967 3.353 17.778 1.00 5.42 H new ATOM 0 HB3 LEU A 89 20.221 3.275 17.645 1.00 5.42 H new ATOM 0 HG LEU A 89 22.134 0.963 18.046 1.00 70.12 H new ATOM 0 HD11 LEU A 89 20.876 0.668 20.143 1.00 73.44 H new ATOM 0 HD12 LEU A 89 21.641 2.273 20.052 1.00 73.44 H new ATOM 0 HD13 LEU A 89 19.895 2.101 19.751 1.00 73.44 H new ATOM 0 HD21 LEU A 89 20.138 -0.482 18.089 1.00 34.30 H new ATOM 0 HD22 LEU A 89 19.129 0.906 17.616 1.00 34.30 H new ATOM 0 HD23 LEU A 89 20.365 0.283 16.498 1.00 34.30 H new ATOM 1423 N PRO A 90 19.300 2.803 14.442 1.00 23.45 N ATOM 1424 CA PRO A 90 18.180 3.445 13.748 1.00 63.40 C ATOM 1425 C PRO A 90 17.088 3.901 14.709 1.00 54.15 C ATOM 1426 O PRO A 90 16.099 3.199 14.919 1.00 74.33 O ATOM 1427 CB PRO A 90 17.655 2.341 12.826 1.00 2.11 C ATOM 1428 CG PRO A 90 18.057 1.070 13.490 1.00 23.41 C ATOM 1429 CD PRO A 90 19.365 1.356 14.176 1.00 74.23 C ATOM 0 HA PRO A 90 18.490 4.348 13.221 1.00 63.40 H new ATOM 0 HB2 PRO A 90 16.573 2.403 12.711 1.00 2.11 H new ATOM 0 HB3 PRO A 90 18.086 2.420 11.828 1.00 2.11 H new ATOM 0 HG2 PRO A 90 17.302 0.749 14.208 1.00 23.41 H new ATOM 0 HG3 PRO A 90 18.166 0.267 12.761 1.00 23.41 H new ATOM 0 HD2 PRO A 90 19.470 0.782 15.097 1.00 74.23 H new ATOM 0 HD3 PRO A 90 20.215 1.101 13.543 1.00 74.23 H new ATOM 1437 N VAL A 91 17.272 5.082 15.289 1.00 1.43 N ATOM 1438 CA VAL A 91 16.301 5.633 16.227 1.00 51.52 C ATOM 1439 C VAL A 91 15.410 6.669 15.550 1.00 72.23 C ATOM 1440 O VAL A 91 15.864 7.756 15.192 1.00 33.21 O ATOM 1441 CB VAL A 91 16.996 6.284 17.438 1.00 61.24 C ATOM 1442 CG1 VAL A 91 15.966 6.831 18.415 1.00 64.35 C ATOM 1443 CG2 VAL A 91 17.916 5.285 18.123 1.00 32.23 C ATOM 0 H VAL A 91 18.085 5.676 15.126 1.00 1.43 H new ATOM 0 HA VAL A 91 15.688 4.801 16.573 1.00 51.52 H new ATOM 0 HB VAL A 91 17.602 7.118 17.083 1.00 61.24 H new ATOM 0 HG11 VAL A 91 16.476 7.287 19.264 1.00 64.35 H new ATOM 0 HG12 VAL A 91 15.352 7.580 17.915 1.00 64.35 H new ATOM 0 HG13 VAL A 91 15.331 6.018 18.767 1.00 64.35 H new ATOM 0 HG21 VAL A 91 18.399 5.761 18.976 1.00 32.23 H new ATOM 0 HG22 VAL A 91 17.334 4.430 18.466 1.00 32.23 H new ATOM 0 HG23 VAL A 91 18.676 4.947 17.418 1.00 32.23 H new ATOM 1453 N VAL A 92 14.138 6.324 15.377 1.00 54.12 N ATOM 1454 CA VAL A 92 13.181 7.224 14.744 1.00 40.21 C ATOM 1455 C VAL A 92 12.386 8.002 15.786 1.00 11.32 C ATOM 1456 O VAL A 92 11.873 7.429 16.748 1.00 53.11 O ATOM 1457 CB VAL A 92 12.202 6.455 13.837 1.00 44.25 C ATOM 1458 CG1 VAL A 92 11.321 7.422 13.061 1.00 14.22 C ATOM 1459 CG2 VAL A 92 12.962 5.538 12.890 1.00 4.03 C ATOM 0 H VAL A 92 13.746 5.428 15.666 1.00 54.12 H new ATOM 0 HA VAL A 92 13.757 7.921 14.136 1.00 40.21 H new ATOM 0 HB VAL A 92 11.559 5.839 14.466 1.00 44.25 H new ATOM 0 HG11 VAL A 92 10.636 6.860 12.426 1.00 14.22 H new ATOM 0 HG12 VAL A 92 10.750 8.034 13.759 1.00 14.22 H new ATOM 0 HG13 VAL A 92 11.945 8.066 12.441 1.00 14.22 H new ATOM 0 HG21 VAL A 92 12.255 5.002 12.257 1.00 4.03 H new ATOM 0 HG22 VAL A 92 13.630 6.132 12.266 1.00 4.03 H new ATOM 0 HG23 VAL A 92 13.546 4.822 13.468 1.00 4.03 H new ATOM 1469 N THR A 93 12.287 9.313 15.589 1.00 14.44 N ATOM 1470 CA THR A 93 11.554 10.171 16.512 1.00 5.53 C ATOM 1471 C THR A 93 10.079 10.249 16.138 1.00 33.53 C ATOM 1472 O THR A 93 9.732 10.581 15.005 1.00 44.33 O ATOM 1473 CB THR A 93 12.140 11.596 16.540 1.00 64.20 C ATOM 1474 OG1 THR A 93 12.526 11.992 15.219 1.00 4.53 O ATOM 1475 CG2 THR A 93 13.343 11.668 17.469 1.00 42.24 C ATOM 0 H THR A 93 12.705 9.804 14.799 1.00 14.44 H new ATOM 0 HA THR A 93 11.652 9.725 17.502 1.00 5.53 H new ATOM 0 HB THR A 93 11.372 12.274 16.913 1.00 64.20 H new ATOM 0 HG1 THR A 93 12.896 12.899 15.244 1.00 4.53 H new ATOM 0 HG21 THR A 93 13.740 12.683 17.473 1.00 42.24 H new ATOM 0 HG22 THR A 93 13.039 11.394 18.479 1.00 42.24 H new ATOM 0 HG23 THR A 93 14.113 10.979 17.122 1.00 42.24 H new ATOM 1483 N ASP A 94 9.213 9.940 17.098 1.00 63.34 N ATOM 1484 CA ASP A 94 7.773 9.976 16.869 1.00 25.11 C ATOM 1485 C ASP A 94 7.209 11.359 17.177 1.00 40.34 C ATOM 1486 O ASP A 94 6.006 11.589 17.061 1.00 41.32 O ATOM 1487 CB ASP A 94 7.073 8.923 17.729 1.00 75.22 C ATOM 1488 CG ASP A 94 5.698 8.565 17.199 1.00 32.24 C ATOM 1489 OD1 ASP A 94 5.228 9.242 16.261 1.00 12.53 O ATOM 1490 OD2 ASP A 94 5.092 7.606 17.722 1.00 1.45 O ATOM 0 H ASP A 94 9.483 9.662 18.041 1.00 63.34 H new ATOM 0 HA ASP A 94 7.591 9.755 15.817 1.00 25.11 H new ATOM 0 HB2 ASP A 94 7.689 8.024 17.771 1.00 75.22 H new ATOM 0 HB3 ASP A 94 6.981 9.294 18.750 1.00 75.22 H new ATOM 1495 N ASN A 95 8.087 12.277 17.570 1.00 75.20 N ATOM 1496 CA ASN A 95 7.675 13.638 17.896 1.00 63.41 C ATOM 1497 C ASN A 95 6.378 13.636 18.700 1.00 44.25 C ATOM 1498 O ASN A 95 5.321 14.009 18.193 1.00 62.55 O ATOM 1499 CB ASN A 95 7.495 14.458 16.617 1.00 1.22 C ATOM 1500 CG ASN A 95 7.708 15.942 16.848 1.00 64.14 C ATOM 1501 OD1 ASN A 95 7.432 16.459 17.930 1.00 55.43 O ATOM 1502 ND2 ASN A 95 8.203 16.634 15.828 1.00 73.34 N ATOM 0 H ASN A 95 9.087 12.103 17.670 1.00 75.20 H new ATOM 0 HA ASN A 95 8.457 14.093 18.504 1.00 63.41 H new ATOM 0 HB2 ASN A 95 8.197 14.106 15.861 1.00 1.22 H new ATOM 0 HB3 ASN A 95 6.492 14.295 16.222 1.00 1.22 H new ATOM 0 HD21 ASN A 95 8.369 17.636 15.924 1.00 73.34 H new ATOM 0 HD22 ASN A 95 8.417 16.164 14.949 1.00 73.34 H new ATOM 1509 N GLY A 96 6.468 13.215 19.957 1.00 24.25 N ATOM 1510 CA GLY A 96 5.296 13.173 20.812 1.00 52.25 C ATOM 1511 C GLY A 96 4.633 11.810 20.820 1.00 11.02 C ATOM 1512 O GLY A 96 3.606 11.616 21.469 1.00 74.44 O ATOM 0 H GLY A 96 7.332 12.902 20.399 1.00 24.25 H new ATOM 0 HA2 GLY A 96 5.582 13.440 21.829 1.00 52.25 H new ATOM 0 HA3 GLY A 96 4.578 13.921 20.476 1.00 52.25 H new ATOM 1516 N GLY A 97 5.222 10.863 20.096 1.00 35.43 N ATOM 1517 CA GLY A 97 4.666 9.523 20.035 1.00 4.15 C ATOM 1518 C GLY A 97 3.414 9.453 19.184 1.00 23.41 C ATOM 1519 O GLY A 97 2.464 8.745 19.520 1.00 11.23 O ATOM 0 H GLY A 97 6.073 10.999 19.551 1.00 35.43 H new ATOM 0 HA2 GLY A 97 5.414 8.841 19.632 1.00 4.15 H new ATOM 0 HA3 GLY A 97 4.435 9.183 21.044 1.00 4.15 H new ATOM 1523 N THR A 98 3.411 10.189 18.077 1.00 14.44 N ATOM 1524 CA THR A 98 2.265 10.210 17.177 1.00 70.13 C ATOM 1525 C THR A 98 1.847 8.797 16.786 1.00 23.11 C ATOM 1526 O THR A 98 0.725 8.373 17.062 1.00 34.00 O ATOM 1527 CB THR A 98 2.569 11.015 15.899 1.00 22.21 C ATOM 1528 OG1 THR A 98 3.630 11.945 16.147 1.00 75.32 O ATOM 1529 CG2 THR A 98 1.333 11.763 15.423 1.00 32.43 C ATOM 0 H THR A 98 4.190 10.778 17.782 1.00 14.44 H new ATOM 0 HA THR A 98 1.449 10.692 17.716 1.00 70.13 H new ATOM 0 HB THR A 98 2.873 10.316 15.120 1.00 22.21 H new ATOM 0 HG1 THR A 98 4.490 11.477 16.109 1.00 75.32 H new ATOM 0 HG21 THR A 98 1.573 12.324 14.520 1.00 32.43 H new ATOM 0 HG22 THR A 98 0.537 11.050 15.207 1.00 32.43 H new ATOM 0 HG23 THR A 98 1.002 12.452 16.201 1.00 32.43 H new ATOM 1537 N ILE A 99 2.757 8.072 16.144 1.00 40.44 N ATOM 1538 CA ILE A 99 2.482 6.706 15.717 1.00 25.11 C ATOM 1539 C ILE A 99 2.120 5.822 16.905 1.00 33.52 C ATOM 1540 O ILE A 99 1.089 5.149 16.900 1.00 50.33 O ATOM 1541 CB ILE A 99 3.690 6.092 14.984 1.00 33.40 C ATOM 1542 CG1 ILE A 99 4.135 7.002 13.838 1.00 62.02 C ATOM 1543 CG2 ILE A 99 3.343 4.705 14.462 1.00 1.14 C ATOM 1544 CD1 ILE A 99 5.328 6.471 13.073 1.00 11.44 C ATOM 0 H ILE A 99 3.691 8.408 15.908 1.00 40.44 H new ATOM 0 HA ILE A 99 1.636 6.753 15.031 1.00 25.11 H new ATOM 0 HB ILE A 99 4.515 5.998 15.690 1.00 33.40 H new ATOM 0 HG12 ILE A 99 3.302 7.138 13.148 1.00 62.02 H new ATOM 0 HG13 ILE A 99 4.379 7.985 14.240 1.00 62.02 H new ATOM 0 HG21 ILE A 99 4.206 4.284 13.946 1.00 1.14 H new ATOM 0 HG22 ILE A 99 3.069 4.060 15.297 1.00 1.14 H new ATOM 0 HG23 ILE A 99 2.505 4.776 13.768 1.00 1.14 H new ATOM 0 HD11 ILE A 99 5.588 7.167 12.276 1.00 11.44 H new ATOM 0 HD12 ILE A 99 6.175 6.362 13.750 1.00 11.44 H new ATOM 0 HD13 ILE A 99 5.081 5.501 12.642 1.00 11.44 H new ATOM 1556 N ALA A 100 2.973 5.829 17.924 1.00 64.23 N ATOM 1557 CA ALA A 100 2.741 5.030 19.121 1.00 41.41 C ATOM 1558 C ALA A 100 1.326 5.234 19.651 1.00 52.43 C ATOM 1559 O ALA A 100 0.633 4.272 19.981 1.00 1.41 O ATOM 1560 CB ALA A 100 3.763 5.377 20.193 1.00 3.52 C ATOM 0 H ALA A 100 3.831 6.379 17.944 1.00 64.23 H new ATOM 0 HA ALA A 100 2.853 3.979 18.854 1.00 41.41 H new ATOM 0 HB1 ALA A 100 3.578 4.773 21.081 1.00 3.52 H new ATOM 0 HB2 ALA A 100 4.766 5.174 19.819 1.00 3.52 H new ATOM 0 HB3 ALA A 100 3.678 6.433 20.448 1.00 3.52 H new ATOM 1566 N GLN A 101 0.904 6.492 19.729 1.00 11.32 N ATOM 1567 CA GLN A 101 -0.429 6.821 20.221 1.00 41.22 C ATOM 1568 C GLN A 101 -1.504 6.175 19.353 1.00 21.34 C ATOM 1569 O GLN A 101 -2.511 5.681 19.861 1.00 51.33 O ATOM 1570 CB GLN A 101 -0.625 8.338 20.251 1.00 63.15 C ATOM 1571 CG GLN A 101 -1.704 8.793 21.219 1.00 54.21 C ATOM 1572 CD GLN A 101 -2.426 10.039 20.745 1.00 51.24 C ATOM 1573 OE1 GLN A 101 -3.366 9.963 19.953 1.00 32.31 O ATOM 1574 NE2 GLN A 101 -1.989 11.197 21.227 1.00 32.54 N ATOM 0 H GLN A 101 1.465 7.300 19.458 1.00 11.32 H new ATOM 0 HA GLN A 101 -0.522 6.430 21.234 1.00 41.22 H new ATOM 0 HB2 GLN A 101 0.318 8.812 20.522 1.00 63.15 H new ATOM 0 HB3 GLN A 101 -0.879 8.683 19.249 1.00 63.15 H new ATOM 0 HG2 GLN A 101 -2.427 7.989 21.355 1.00 54.21 H new ATOM 0 HG3 GLN A 101 -1.255 8.986 22.193 1.00 54.21 H new ATOM 0 HE21 GLN A 101 -1.207 11.214 21.881 1.00 32.54 H new ATOM 0 HE22 GLN A 101 -2.436 12.069 20.943 1.00 32.54 H new ATOM 1583 N SER A 102 -1.283 6.181 18.043 1.00 50.53 N ATOM 1584 CA SER A 102 -2.235 5.599 17.104 1.00 51.40 C ATOM 1585 C SER A 102 -2.172 4.075 17.142 1.00 54.54 C ATOM 1586 O SER A 102 -3.135 3.394 16.786 1.00 21.25 O ATOM 1587 CB SER A 102 -1.954 6.098 15.685 1.00 33.11 C ATOM 1588 OG SER A 102 -2.389 7.436 15.519 1.00 13.33 O ATOM 0 H SER A 102 -0.453 6.583 17.607 1.00 50.53 H new ATOM 0 HA SER A 102 -3.237 5.911 17.399 1.00 51.40 H new ATOM 0 HB2 SER A 102 -0.886 6.031 15.478 1.00 33.11 H new ATOM 0 HB3 SER A 102 -2.459 5.456 14.964 1.00 33.11 H new ATOM 0 HG SER A 102 -2.196 7.732 14.605 1.00 13.33 H new ATOM 1594 N LEU A 103 -1.033 3.547 17.574 1.00 1.21 N ATOM 1595 CA LEU A 103 -0.842 2.103 17.659 1.00 55.32 C ATOM 1596 C LEU A 103 -1.151 1.595 19.063 1.00 20.14 C ATOM 1597 O LEU A 103 -1.038 0.402 19.341 1.00 74.32 O ATOM 1598 CB LEU A 103 0.591 1.735 17.274 1.00 24.22 C ATOM 1599 CG LEU A 103 0.843 1.479 15.788 1.00 40.23 C ATOM 1600 CD1 LEU A 103 0.094 0.239 15.325 1.00 1.01 C ATOM 1601 CD2 LEU A 103 0.435 2.690 14.962 1.00 54.22 C ATOM 0 H LEU A 103 -0.227 4.097 17.871 1.00 1.21 H new ATOM 0 HA LEU A 103 -1.532 1.628 16.961 1.00 55.32 H new ATOM 0 HB2 LEU A 103 1.251 2.538 17.601 1.00 24.22 H new ATOM 0 HB3 LEU A 103 0.877 0.842 17.829 1.00 24.22 H new ATOM 0 HG LEU A 103 1.910 1.308 15.644 1.00 40.23 H new ATOM 0 HD11 LEU A 103 0.286 0.073 14.265 1.00 1.01 H new ATOM 0 HD12 LEU A 103 0.434 -0.626 15.895 1.00 1.01 H new ATOM 0 HD13 LEU A 103 -0.975 0.380 15.483 1.00 1.01 H new ATOM 0 HD21 LEU A 103 0.621 2.490 13.907 1.00 54.22 H new ATOM 0 HD22 LEU A 103 -0.626 2.892 15.111 1.00 54.22 H new ATOM 0 HD23 LEU A 103 1.017 3.557 15.275 1.00 54.22 H new ATOM 1613 N ASN A 104 -1.543 2.509 19.945 1.00 23.23 N ATOM 1614 CA ASN A 104 -1.869 2.153 21.321 1.00 34.43 C ATOM 1615 C ASN A 104 -0.635 1.642 22.059 1.00 52.32 C ATOM 1616 O ASN A 104 -0.746 0.904 23.038 1.00 70.53 O ATOM 1617 CB ASN A 104 -2.969 1.089 21.347 1.00 0.04 C ATOM 1618 CG ASN A 104 -3.593 0.936 22.721 1.00 24.32 C ATOM 1619 OD1 ASN A 104 -3.875 1.923 23.401 1.00 62.24 O ATOM 1620 ND2 ASN A 104 -3.811 -0.307 23.137 1.00 45.45 N ATOM 0 H ASN A 104 -1.643 3.501 19.731 1.00 23.23 H new ATOM 0 HA ASN A 104 -2.227 3.050 21.827 1.00 34.43 H new ATOM 0 HB2 ASN A 104 -3.743 1.353 20.627 1.00 0.04 H new ATOM 0 HB3 ASN A 104 -2.553 0.132 21.031 1.00 0.04 H new ATOM 0 HD21 ASN A 104 -4.228 -0.472 24.053 1.00 45.45 H new ATOM 0 HD22 ASN A 104 -3.562 -1.096 22.540 1.00 45.45 H new ATOM 1627 N ILE A 105 0.539 2.042 21.583 1.00 61.14 N ATOM 1628 CA ILE A 105 1.794 1.627 22.198 1.00 74.44 C ATOM 1629 C ILE A 105 2.073 2.422 23.468 1.00 12.13 C ATOM 1630 O ILE A 105 2.833 3.390 23.453 1.00 65.34 O ATOM 1631 CB ILE A 105 2.979 1.796 21.229 1.00 72.32 C ATOM 1632 CG1 ILE A 105 2.770 0.938 19.979 1.00 65.00 C ATOM 1633 CG2 ILE A 105 4.284 1.428 21.919 1.00 72.21 C ATOM 1634 CD1 ILE A 105 2.807 -0.549 20.254 1.00 71.12 C ATOM 0 H ILE A 105 0.648 2.653 20.773 1.00 61.14 H new ATOM 0 HA ILE A 105 1.688 0.572 22.449 1.00 74.44 H new ATOM 0 HB ILE A 105 3.034 2.841 20.924 1.00 72.32 H new ATOM 0 HG12 ILE A 105 1.810 1.192 19.530 1.00 65.00 H new ATOM 0 HG13 ILE A 105 3.539 1.183 19.247 1.00 65.00 H new ATOM 0 HG21 ILE A 105 5.112 1.553 21.221 1.00 72.21 H new ATOM 0 HG22 ILE A 105 4.435 2.077 22.781 1.00 72.21 H new ATOM 0 HG23 ILE A 105 4.241 0.390 22.249 1.00 72.21 H new ATOM 0 HD11 ILE A 105 2.652 -1.095 19.323 1.00 71.12 H new ATOM 0 HD12 ILE A 105 3.776 -0.817 20.675 1.00 71.12 H new ATOM 0 HD13 ILE A 105 2.020 -0.808 20.962 1.00 71.12 H new ATOM 1646 N SER A 106 1.453 2.006 24.568 1.00 2.43 N ATOM 1647 CA SER A 106 1.633 2.681 25.848 1.00 2.34 C ATOM 1648 C SER A 106 2.611 1.915 26.734 1.00 34.51 C ATOM 1649 O SER A 106 3.209 2.478 27.650 1.00 25.13 O ATOM 1650 CB SER A 106 0.289 2.831 26.563 1.00 30.04 C ATOM 1651 OG SER A 106 -0.254 4.125 26.364 1.00 65.22 O ATOM 0 H SER A 106 0.822 1.205 24.598 1.00 2.43 H new ATOM 0 HA SER A 106 2.045 3.671 25.654 1.00 2.34 H new ATOM 0 HB2 SER A 106 -0.409 2.080 26.193 1.00 30.04 H new ATOM 0 HB3 SER A 106 0.419 2.648 27.630 1.00 30.04 H new ATOM 0 HG SER A 106 -1.114 4.194 26.830 1.00 65.22 H new ATOM 1657 N VAL A 107 2.767 0.625 26.454 1.00 72.44 N ATOM 1658 CA VAL A 107 3.672 -0.221 27.223 1.00 14.00 C ATOM 1659 C VAL A 107 4.969 -0.472 26.462 1.00 32.55 C ATOM 1660 O VAL A 107 4.951 -0.822 25.282 1.00 52.41 O ATOM 1661 CB VAL A 107 3.020 -1.574 27.566 1.00 1.22 C ATOM 1662 CG1 VAL A 107 1.924 -1.390 28.604 1.00 33.45 C ATOM 1663 CG2 VAL A 107 2.472 -2.234 26.310 1.00 35.35 C ATOM 0 H VAL A 107 2.278 0.143 25.700 1.00 72.44 H new ATOM 0 HA VAL A 107 3.894 0.311 28.148 1.00 14.00 H new ATOM 0 HB VAL A 107 3.782 -2.229 27.990 1.00 1.22 H new ATOM 0 HG11 VAL A 107 1.475 -2.356 28.834 1.00 33.45 H new ATOM 0 HG12 VAL A 107 2.350 -0.963 29.512 1.00 33.45 H new ATOM 0 HG13 VAL A 107 1.160 -0.719 28.211 1.00 33.45 H new ATOM 0 HG21 VAL A 107 2.015 -3.189 26.570 1.00 35.35 H new ATOM 0 HG22 VAL A 107 1.723 -1.585 25.855 1.00 35.35 H new ATOM 0 HG23 VAL A 107 3.284 -2.402 25.603 1.00 35.35 H new ATOM 1673 N TYR A 108 6.093 -0.293 27.147 1.00 62.25 N ATOM 1674 CA TYR A 108 7.401 -0.499 26.535 1.00 12.30 C ATOM 1675 C TYR A 108 8.239 -1.474 27.356 1.00 1.43 C ATOM 1676 O TYR A 108 8.060 -1.621 28.566 1.00 44.55 O ATOM 1677 CB TYR A 108 8.138 0.834 26.397 1.00 11.53 C ATOM 1678 CG TYR A 108 7.285 1.941 25.818 1.00 64.44 C ATOM 1679 CD1 TYR A 108 6.525 2.762 26.640 1.00 14.12 C ATOM 1680 CD2 TYR A 108 7.242 2.165 24.447 1.00 73.31 C ATOM 1681 CE1 TYR A 108 5.744 3.773 26.115 1.00 51.23 C ATOM 1682 CE2 TYR A 108 6.465 3.175 23.913 1.00 71.53 C ATOM 1683 CZ TYR A 108 5.717 3.976 24.751 1.00 64.35 C ATOM 1684 OH TYR A 108 4.942 4.983 24.223 1.00 20.23 O ATOM 0 H TYR A 108 6.125 -0.006 28.125 1.00 62.25 H new ATOM 0 HA TYR A 108 7.247 -0.926 25.544 1.00 12.30 H new ATOM 0 HB2 TYR A 108 8.501 1.142 27.377 1.00 11.53 H new ATOM 0 HB3 TYR A 108 9.013 0.692 25.763 1.00 11.53 H new ATOM 0 HD1 TYR A 108 6.545 2.607 27.709 1.00 14.12 H new ATOM 0 HD2 TYR A 108 7.826 1.539 23.788 1.00 73.31 H new ATOM 0 HE1 TYR A 108 5.158 4.401 26.769 1.00 51.23 H new ATOM 0 HE2 TYR A 108 6.443 3.337 22.845 1.00 71.53 H new ATOM 0 HH TYR A 108 4.099 4.608 23.892 1.00 20.23 H new ATOM 1694 N PRO A 109 9.178 -2.157 26.684 1.00 11.53 N ATOM 1695 CA PRO A 109 9.399 -1.990 25.245 1.00 64.42 C ATOM 1696 C PRO A 109 8.253 -2.556 24.413 1.00 43.41 C ATOM 1697 O PRO A 109 7.271 -3.061 24.955 1.00 35.11 O ATOM 1698 CB PRO A 109 10.685 -2.781 24.990 1.00 3.23 C ATOM 1699 CG PRO A 109 10.728 -3.796 26.080 1.00 1.30 C ATOM 1700 CD PRO A 109 10.095 -3.144 27.278 1.00 11.11 C ATOM 0 HA PRO A 109 9.464 -0.939 24.962 1.00 64.42 H new ATOM 0 HB2 PRO A 109 10.670 -3.255 24.008 1.00 3.23 H new ATOM 0 HB3 PRO A 109 11.561 -2.133 25.018 1.00 3.23 H new ATOM 0 HG2 PRO A 109 10.186 -4.698 25.795 1.00 1.30 H new ATOM 0 HG3 PRO A 109 11.754 -4.095 26.295 1.00 1.30 H new ATOM 0 HD2 PRO A 109 9.562 -3.868 27.895 1.00 11.11 H new ATOM 0 HD3 PRO A 109 10.839 -2.668 27.917 1.00 11.11 H new ATOM 1708 N SER A 110 8.386 -2.467 23.093 1.00 22.23 N ATOM 1709 CA SER A 110 7.360 -2.967 22.186 1.00 35.04 C ATOM 1710 C SER A 110 7.942 -3.238 20.803 1.00 63.23 C ATOM 1711 O SER A 110 9.053 -2.810 20.491 1.00 43.15 O ATOM 1712 CB SER A 110 6.210 -1.963 22.080 1.00 1.13 C ATOM 1713 OG SER A 110 5.243 -2.186 23.092 1.00 61.12 O ATOM 0 H SER A 110 9.194 -2.053 22.628 1.00 22.23 H new ATOM 0 HA SER A 110 6.979 -3.905 22.590 1.00 35.04 H new ATOM 0 HB2 SER A 110 6.600 -0.949 22.163 1.00 1.13 H new ATOM 0 HB3 SER A 110 5.741 -2.045 21.100 1.00 1.13 H new ATOM 0 HG SER A 110 5.264 -1.446 23.734 1.00 61.12 H new ATOM 1719 N TRP A 111 7.184 -3.952 19.978 1.00 23.25 N ATOM 1720 CA TRP A 111 7.625 -4.281 18.628 1.00 72.45 C ATOM 1721 C TRP A 111 6.455 -4.247 17.650 1.00 2.21 C ATOM 1722 O TRP A 111 5.294 -4.225 18.058 1.00 43.22 O ATOM 1723 CB TRP A 111 8.283 -5.662 18.606 1.00 50.12 C ATOM 1724 CG TRP A 111 9.666 -5.670 19.183 1.00 0.32 C ATOM 1725 CD1 TRP A 111 10.006 -5.847 20.494 1.00 31.10 C ATOM 1726 CD2 TRP A 111 10.894 -5.490 18.469 1.00 31.50 C ATOM 1727 NE1 TRP A 111 11.371 -5.789 20.638 1.00 42.23 N ATOM 1728 CE2 TRP A 111 11.939 -5.572 19.410 1.00 11.21 C ATOM 1729 CE3 TRP A 111 11.212 -5.271 17.126 1.00 25.32 C ATOM 1730 CZ2 TRP A 111 13.277 -5.440 19.049 1.00 22.31 C ATOM 1731 CZ3 TRP A 111 12.541 -5.141 16.770 1.00 41.44 C ATOM 1732 CH2 TRP A 111 13.560 -5.226 17.728 1.00 62.25 C ATOM 0 H TRP A 111 6.262 -4.314 20.221 1.00 23.25 H new ATOM 0 HA TRP A 111 8.355 -3.533 18.319 1.00 72.45 H new ATOM 0 HB2 TRP A 111 7.661 -6.362 19.163 1.00 50.12 H new ATOM 0 HB3 TRP A 111 8.324 -6.021 17.578 1.00 50.12 H new ATOM 0 HD1 TRP A 111 9.305 -6.009 21.299 1.00 31.10 H new ATOM 0 HE1 TRP A 111 11.879 -5.891 21.516 1.00 42.23 H new ATOM 0 HE3 TRP A 111 10.434 -5.205 16.380 1.00 25.32 H new ATOM 0 HZ2 TRP A 111 14.064 -5.504 19.786 1.00 22.31 H new ATOM 0 HZ3 TRP A 111 12.799 -4.971 15.735 1.00 41.44 H new ATOM 0 HH2 TRP A 111 14.589 -5.120 17.417 1.00 62.25 H new ATOM 1743 N ALA A 112 6.769 -4.242 16.359 1.00 73.34 N ATOM 1744 CA ALA A 112 5.743 -4.213 15.324 1.00 51.35 C ATOM 1745 C ALA A 112 6.338 -4.510 13.952 1.00 64.43 C ATOM 1746 O ALA A 112 7.147 -3.739 13.434 1.00 62.02 O ATOM 1747 CB ALA A 112 5.041 -2.863 15.315 1.00 51.24 C ATOM 0 H ALA A 112 7.725 -4.258 16.005 1.00 73.34 H new ATOM 0 HA ALA A 112 5.012 -4.990 15.550 1.00 51.35 H new ATOM 0 HB1 ALA A 112 4.277 -2.855 14.537 1.00 51.24 H new ATOM 0 HB2 ALA A 112 4.574 -2.689 16.284 1.00 51.24 H new ATOM 0 HB3 ALA A 112 5.769 -2.076 15.117 1.00 51.24 H new ATOM 1753 N LEU A 113 5.935 -5.633 13.368 1.00 72.32 N ATOM 1754 CA LEU A 113 6.429 -6.034 12.055 1.00 4.31 C ATOM 1755 C LEU A 113 5.622 -5.370 10.944 1.00 64.44 C ATOM 1756 O LEU A 113 4.410 -5.192 11.065 1.00 20.21 O ATOM 1757 CB LEU A 113 6.368 -7.555 11.907 1.00 10.04 C ATOM 1758 CG LEU A 113 7.564 -8.211 11.217 1.00 60.14 C ATOM 1759 CD1 LEU A 113 7.417 -9.725 11.218 1.00 1.34 C ATOM 1760 CD2 LEU A 113 7.711 -7.689 9.795 1.00 71.23 C ATOM 0 H LEU A 113 5.267 -6.283 13.783 1.00 72.32 H new ATOM 0 HA LEU A 113 7.466 -5.709 11.970 1.00 4.31 H new ATOM 0 HB2 LEU A 113 6.262 -7.993 12.900 1.00 10.04 H new ATOM 0 HB3 LEU A 113 5.467 -7.810 11.349 1.00 10.04 H new ATOM 0 HG LEU A 113 8.466 -7.954 11.773 1.00 60.14 H new ATOM 0 HD11 LEU A 113 8.278 -10.174 10.723 1.00 1.34 H new ATOM 0 HD12 LEU A 113 7.361 -10.084 12.246 1.00 1.34 H new ATOM 0 HD13 LEU A 113 6.507 -10.003 10.687 1.00 1.34 H new ATOM 0 HD21 LEU A 113 8.567 -8.167 9.319 1.00 71.23 H new ATOM 0 HD22 LEU A 113 6.808 -7.916 9.229 1.00 71.23 H new ATOM 0 HD23 LEU A 113 7.864 -6.610 9.817 1.00 71.23 H new ATOM 1772 N ILE A 114 6.302 -5.009 9.861 1.00 63.34 N ATOM 1773 CA ILE A 114 5.648 -4.369 8.726 1.00 33.25 C ATOM 1774 C ILE A 114 6.000 -5.072 7.420 1.00 71.21 C ATOM 1775 O ILE A 114 7.159 -5.098 7.010 1.00 64.13 O ATOM 1776 CB ILE A 114 6.036 -2.883 8.618 1.00 42.14 C ATOM 1777 CG1 ILE A 114 5.922 -2.202 9.983 1.00 21.00 C ATOM 1778 CG2 ILE A 114 5.158 -2.179 7.594 1.00 72.52 C ATOM 1779 CD1 ILE A 114 7.199 -2.252 10.792 1.00 45.34 C ATOM 0 H ILE A 114 7.306 -5.149 9.746 1.00 63.34 H new ATOM 0 HA ILE A 114 4.574 -4.444 8.897 1.00 33.25 H new ATOM 0 HB ILE A 114 7.072 -2.817 8.286 1.00 42.14 H new ATOM 0 HG12 ILE A 114 5.634 -1.161 9.838 1.00 21.00 H new ATOM 0 HG13 ILE A 114 5.123 -2.677 10.551 1.00 21.00 H new ATOM 0 HG21 ILE A 114 5.445 -1.129 7.529 1.00 72.52 H new ATOM 0 HG22 ILE A 114 5.286 -2.651 6.620 1.00 72.52 H new ATOM 0 HG23 ILE A 114 4.114 -2.252 7.898 1.00 72.52 H new ATOM 0 HD11 ILE A 114 7.044 -1.750 11.747 1.00 45.34 H new ATOM 0 HD12 ILE A 114 7.477 -3.291 10.969 1.00 45.34 H new ATOM 0 HD13 ILE A 114 7.997 -1.751 10.244 1.00 45.34 H new ATOM 1791 N GLY A 115 4.989 -5.641 6.769 1.00 45.32 N ATOM 1792 CA GLY A 115 5.212 -6.335 5.514 1.00 4.20 C ATOM 1793 C GLY A 115 6.002 -5.502 4.523 1.00 34.42 C ATOM 1794 O GLY A 115 6.014 -4.274 4.604 1.00 44.13 O ATOM 0 H GLY A 115 4.020 -5.634 7.088 1.00 45.32 H new ATOM 0 HA2 GLY A 115 5.744 -7.266 5.707 1.00 4.20 H new ATOM 0 HA3 GLY A 115 4.251 -6.602 5.075 1.00 4.20 H new ATOM 1798 N LYS A 116 6.664 -6.172 3.586 1.00 51.23 N ATOM 1799 CA LYS A 116 7.460 -5.487 2.574 1.00 24.14 C ATOM 1800 C LYS A 116 6.627 -4.439 1.844 1.00 44.23 C ATOM 1801 O LYS A 116 7.136 -3.385 1.461 1.00 72.04 O ATOM 1802 CB LYS A 116 8.025 -6.496 1.571 1.00 14.41 C ATOM 1803 CG LYS A 116 6.989 -7.028 0.596 1.00 51.32 C ATOM 1804 CD LYS A 116 6.944 -6.199 -0.677 1.00 14.42 C ATOM 1805 CE LYS A 116 7.122 -7.066 -1.914 1.00 11.24 C ATOM 1806 NZ LYS A 116 5.901 -7.866 -2.211 1.00 5.22 N ATOM 0 H LYS A 116 6.665 -7.189 3.506 1.00 51.23 H new ATOM 0 HA LYS A 116 8.286 -4.983 3.076 1.00 24.14 H new ATOM 0 HB2 LYS A 116 8.832 -6.025 1.010 1.00 14.41 H new ATOM 0 HB3 LYS A 116 8.462 -7.332 2.116 1.00 14.41 H new ATOM 0 HG2 LYS A 116 7.219 -8.064 0.349 1.00 51.32 H new ATOM 0 HG3 LYS A 116 6.007 -7.024 1.069 1.00 51.32 H new ATOM 0 HD2 LYS A 116 5.992 -5.671 -0.735 1.00 14.42 H new ATOM 0 HD3 LYS A 116 7.727 -5.441 -0.647 1.00 14.42 H new ATOM 0 HE2 LYS A 116 7.359 -6.434 -2.770 1.00 11.24 H new ATOM 0 HE3 LYS A 116 7.969 -7.736 -1.769 1.00 11.24 H new ATOM 0 HZ1 LYS A 116 6.062 -8.443 -3.061 1.00 5.22 H new ATOM 0 HZ2 LYS A 116 5.689 -8.488 -1.405 1.00 5.22 H new ATOM 0 HZ3 LYS A 116 5.098 -7.226 -2.375 1.00 5.22 H new ATOM 1820 N ASP A 117 5.346 -4.734 1.655 1.00 20.23 N ATOM 1821 CA ASP A 117 4.442 -3.816 0.973 1.00 50.22 C ATOM 1822 C ASP A 117 4.050 -2.659 1.887 1.00 33.53 C ATOM 1823 O ASP A 117 3.651 -1.594 1.421 1.00 55.54 O ATOM 1824 CB ASP A 117 3.190 -4.556 0.500 1.00 33.13 C ATOM 1825 CG ASP A 117 2.803 -4.192 -0.920 1.00 22.03 C ATOM 1826 OD1 ASP A 117 3.220 -3.113 -1.389 1.00 54.42 O ATOM 1827 OD2 ASP A 117 2.084 -4.986 -1.561 1.00 75.13 O ATOM 0 H ASP A 117 4.910 -5.602 1.965 1.00 20.23 H new ATOM 0 HA ASP A 117 4.963 -3.410 0.106 1.00 50.22 H new ATOM 0 HB2 ASP A 117 3.362 -5.631 0.562 1.00 33.13 H new ATOM 0 HB3 ASP A 117 2.361 -4.326 1.169 1.00 33.13 H new ATOM 1832 N GLY A 118 4.165 -2.879 3.194 1.00 45.04 N ATOM 1833 CA GLY A 118 3.818 -1.847 4.153 1.00 50.01 C ATOM 1834 C GLY A 118 2.529 -2.151 4.890 1.00 22.24 C ATOM 1835 O GLY A 118 1.622 -1.320 4.938 1.00 3.14 O ATOM 0 H GLY A 118 4.492 -3.753 3.605 1.00 45.04 H new ATOM 0 HA2 GLY A 118 4.628 -1.738 4.874 1.00 50.01 H new ATOM 0 HA3 GLY A 118 3.721 -0.892 3.636 1.00 50.01 H new ATOM 1839 N ASP A 119 2.446 -3.346 5.465 1.00 4.13 N ATOM 1840 CA ASP A 119 1.258 -3.758 6.204 1.00 65.53 C ATOM 1841 C ASP A 119 1.642 -4.455 7.505 1.00 24.43 C ATOM 1842 O ASP A 119 2.365 -5.452 7.498 1.00 32.34 O ATOM 1843 CB ASP A 119 0.397 -4.688 5.348 1.00 61.43 C ATOM 1844 CG ASP A 119 1.227 -5.570 4.435 1.00 3.24 C ATOM 1845 OD1 ASP A 119 1.686 -6.636 4.897 1.00 55.41 O ATOM 1846 OD2 ASP A 119 1.420 -5.193 3.260 1.00 34.31 O ATOM 0 H ASP A 119 3.187 -4.046 5.434 1.00 4.13 H new ATOM 0 HA ASP A 119 0.683 -2.864 6.448 1.00 65.53 H new ATOM 0 HB2 ASP A 119 -0.212 -5.315 5.999 1.00 61.43 H new ATOM 0 HB3 ASP A 119 -0.289 -4.092 4.747 1.00 61.43 H new ATOM 1851 N VAL A 120 1.155 -3.923 8.622 1.00 61.23 N ATOM 1852 CA VAL A 120 1.447 -4.494 9.931 1.00 0.33 C ATOM 1853 C VAL A 120 1.208 -5.999 9.940 1.00 24.44 C ATOM 1854 O VAL A 120 0.094 -6.462 9.699 1.00 12.03 O ATOM 1855 CB VAL A 120 0.588 -3.842 11.031 1.00 20.34 C ATOM 1856 CG1 VAL A 120 -0.889 -3.933 10.679 1.00 0.54 C ATOM 1857 CG2 VAL A 120 0.864 -4.493 12.378 1.00 24.51 C ATOM 0 H VAL A 120 0.556 -3.097 8.646 1.00 61.23 H new ATOM 0 HA VAL A 120 2.499 -4.295 10.136 1.00 0.33 H new ATOM 0 HB VAL A 120 0.856 -2.788 11.101 1.00 20.34 H new ATOM 0 HG11 VAL A 120 -1.480 -3.467 11.467 1.00 0.54 H new ATOM 0 HG12 VAL A 120 -1.071 -3.417 9.736 1.00 0.54 H new ATOM 0 HG13 VAL A 120 -1.176 -4.980 10.581 1.00 0.54 H new ATOM 0 HG21 VAL A 120 0.249 -4.020 13.144 1.00 24.51 H new ATOM 0 HG22 VAL A 120 0.624 -5.555 12.325 1.00 24.51 H new ATOM 0 HG23 VAL A 120 1.917 -4.371 12.632 1.00 24.51 H new ATOM 1867 N GLN A 121 2.263 -6.758 10.221 1.00 71.44 N ATOM 1868 CA GLN A 121 2.168 -8.213 10.261 1.00 55.11 C ATOM 1869 C GLN A 121 1.916 -8.703 11.683 1.00 3.32 C ATOM 1870 O GLN A 121 1.379 -9.791 11.889 1.00 15.24 O ATOM 1871 CB GLN A 121 3.447 -8.844 9.710 1.00 61.42 C ATOM 1872 CG GLN A 121 3.229 -9.653 8.441 1.00 41.30 C ATOM 1873 CD GLN A 121 4.446 -10.470 8.054 1.00 75.25 C ATOM 1874 OE1 GLN A 121 5.136 -10.156 7.084 1.00 41.32 O ATOM 1875 NE2 GLN A 121 4.715 -11.527 8.811 1.00 12.13 N ATOM 0 H GLN A 121 3.192 -6.390 10.424 1.00 71.44 H new ATOM 0 HA GLN A 121 1.326 -8.514 9.638 1.00 55.11 H new ATOM 0 HB2 GLN A 121 4.173 -8.056 9.509 1.00 61.42 H new ATOM 0 HB3 GLN A 121 3.881 -9.490 10.473 1.00 61.42 H new ATOM 0 HG2 GLN A 121 2.378 -10.320 8.581 1.00 41.30 H new ATOM 0 HG3 GLN A 121 2.974 -8.978 7.624 1.00 41.30 H new ATOM 0 HE21 GLN A 121 4.116 -11.751 9.606 1.00 12.13 H new ATOM 0 HE22 GLN A 121 5.520 -12.115 8.598 1.00 12.13 H new ATOM 1884 N ARG A 122 2.309 -7.893 12.661 1.00 44.32 N ATOM 1885 CA ARG A 122 2.128 -8.245 14.064 1.00 41.31 C ATOM 1886 C ARG A 122 2.657 -7.140 14.974 1.00 33.02 C ATOM 1887 O ARG A 122 3.435 -6.288 14.545 1.00 50.12 O ATOM 1888 CB ARG A 122 2.839 -9.562 14.377 1.00 24.32 C ATOM 1889 CG ARG A 122 2.037 -10.489 15.275 1.00 35.32 C ATOM 1890 CD ARG A 122 0.808 -11.031 14.561 1.00 64.23 C ATOM 1891 NE ARG A 122 1.158 -12.020 13.544 1.00 3.22 N ATOM 1892 CZ ARG A 122 0.330 -12.409 12.582 1.00 72.03 C ATOM 1893 NH1 ARG A 122 -0.890 -11.895 12.505 1.00 71.54 N ATOM 1894 NH2 ARG A 122 0.721 -13.313 11.693 1.00 23.52 N ATOM 0 H ARG A 122 2.755 -6.989 12.507 1.00 44.32 H new ATOM 0 HA ARG A 122 1.060 -8.364 14.248 1.00 41.31 H new ATOM 0 HB2 ARG A 122 3.060 -10.077 13.442 1.00 24.32 H new ATOM 0 HB3 ARG A 122 3.795 -9.345 14.854 1.00 24.32 H new ATOM 0 HG2 ARG A 122 2.666 -11.318 15.599 1.00 35.32 H new ATOM 0 HG3 ARG A 122 1.730 -9.952 16.173 1.00 35.32 H new ATOM 0 HD2 ARG A 122 0.135 -11.483 15.290 1.00 64.23 H new ATOM 0 HD3 ARG A 122 0.267 -10.208 14.095 1.00 64.23 H new ATOM 0 HE ARG A 122 2.090 -12.434 13.575 1.00 3.22 H new ATOM 0 HH11 ARG A 122 -1.194 -11.199 13.186 1.00 71.54 H new ATOM 0 HH12 ARG A 122 -1.524 -12.196 11.765 1.00 71.54 H new ATOM 0 HH21 ARG A 122 1.659 -13.710 11.748 1.00 23.52 H new ATOM 0 HH22 ARG A 122 0.084 -13.611 10.954 1.00 23.52 H new ATOM 1908 N ILE A 123 2.228 -7.161 16.232 1.00 63.22 N ATOM 1909 CA ILE A 123 2.659 -6.162 17.202 1.00 72.21 C ATOM 1910 C ILE A 123 2.802 -6.772 18.592 1.00 3.01 C ATOM 1911 O ILE A 123 1.827 -7.239 19.181 1.00 62.54 O ATOM 1912 CB ILE A 123 1.671 -4.982 17.271 1.00 65.14 C ATOM 1913 CG1 ILE A 123 1.734 -4.160 15.981 1.00 24.44 C ATOM 1914 CG2 ILE A 123 1.975 -4.108 18.478 1.00 53.50 C ATOM 1915 CD1 ILE A 123 0.566 -3.215 15.810 1.00 4.41 C ATOM 0 H ILE A 123 1.583 -7.859 16.603 1.00 63.22 H new ATOM 0 HA ILE A 123 3.629 -5.794 16.867 1.00 72.21 H new ATOM 0 HB ILE A 123 0.661 -5.378 17.378 1.00 65.14 H new ATOM 0 HG12 ILE A 123 2.660 -3.586 15.971 1.00 24.44 H new ATOM 0 HG13 ILE A 123 1.770 -4.838 15.129 1.00 24.44 H new ATOM 0 HG21 ILE A 123 1.269 -3.278 18.514 1.00 53.50 H new ATOM 0 HG22 ILE A 123 1.885 -4.701 19.388 1.00 53.50 H new ATOM 0 HG23 ILE A 123 2.990 -3.718 18.398 1.00 53.50 H new ATOM 0 HD11 ILE A 123 0.676 -2.665 14.875 1.00 4.41 H new ATOM 0 HD12 ILE A 123 -0.363 -3.785 15.788 1.00 4.41 H new ATOM 0 HD13 ILE A 123 0.541 -2.513 16.643 1.00 4.41 H new ATOM 1927 N VAL A 124 4.025 -6.762 19.113 1.00 21.33 N ATOM 1928 CA VAL A 124 4.297 -7.312 20.436 1.00 13.22 C ATOM 1929 C VAL A 124 4.466 -6.202 21.468 1.00 30.30 C ATOM 1930 O VAL A 124 5.025 -5.145 21.174 1.00 72.40 O ATOM 1931 CB VAL A 124 5.562 -8.190 20.430 1.00 2.33 C ATOM 1932 CG1 VAL A 124 5.934 -8.600 21.847 1.00 43.01 C ATOM 1933 CG2 VAL A 124 5.358 -9.412 19.549 1.00 72.44 C ATOM 0 H VAL A 124 4.843 -6.379 18.639 1.00 21.33 H new ATOM 0 HA VAL A 124 3.439 -7.927 20.706 1.00 13.22 H new ATOM 0 HB VAL A 124 6.386 -7.607 20.018 1.00 2.33 H new ATOM 0 HG11 VAL A 124 6.830 -9.220 21.823 1.00 43.01 H new ATOM 0 HG12 VAL A 124 6.125 -7.709 22.445 1.00 43.01 H new ATOM 0 HG13 VAL A 124 5.114 -9.165 22.289 1.00 43.01 H new ATOM 0 HG21 VAL A 124 6.262 -10.021 19.557 1.00 72.44 H new ATOM 0 HG22 VAL A 124 4.522 -9.999 19.929 1.00 72.44 H new ATOM 0 HG23 VAL A 124 5.144 -9.093 18.529 1.00 72.44 H new ATOM 1943 N LYS A 125 3.980 -6.450 22.680 1.00 51.43 N ATOM 1944 CA LYS A 125 4.078 -5.473 23.758 1.00 61.10 C ATOM 1945 C LYS A 125 5.192 -5.847 24.730 1.00 3.45 C ATOM 1946 O LYS A 125 4.941 -6.108 25.906 1.00 24.11 O ATOM 1947 CB LYS A 125 2.747 -5.373 24.506 1.00 55.45 C ATOM 1948 CG LYS A 125 1.660 -4.660 23.719 1.00 33.41 C ATOM 1949 CD LYS A 125 0.278 -5.174 24.087 1.00 73.12 C ATOM 1950 CE LYS A 125 -0.788 -4.624 23.152 1.00 73.03 C ATOM 1951 NZ LYS A 125 -2.064 -5.384 23.257 1.00 34.31 N ATOM 0 H LYS A 125 3.514 -7.319 22.940 1.00 51.43 H new ATOM 0 HA LYS A 125 4.313 -4.504 23.317 1.00 61.10 H new ATOM 0 HB2 LYS A 125 2.404 -6.377 24.756 1.00 55.45 H new ATOM 0 HB3 LYS A 125 2.907 -4.847 25.447 1.00 55.45 H new ATOM 0 HG2 LYS A 125 1.714 -3.588 23.911 1.00 33.41 H new ATOM 0 HG3 LYS A 125 1.830 -4.802 22.652 1.00 33.41 H new ATOM 0 HD2 LYS A 125 0.271 -6.263 24.048 1.00 73.12 H new ATOM 0 HD3 LYS A 125 0.045 -4.891 25.113 1.00 73.12 H new ATOM 0 HE2 LYS A 125 -0.970 -3.575 23.386 1.00 73.03 H new ATOM 0 HE3 LYS A 125 -0.425 -4.663 22.125 1.00 73.03 H new ATOM 0 HZ1 LYS A 125 -2.765 -4.978 22.604 1.00 34.31 H new ATOM 0 HZ2 LYS A 125 -1.896 -6.380 23.009 1.00 34.31 H new ATOM 0 HZ3 LYS A 125 -2.424 -5.325 24.231 1.00 34.31 H new ATOM 1965 N GLY A 126 6.425 -5.868 24.232 1.00 73.12 N ATOM 1966 CA GLY A 126 7.559 -6.209 25.071 1.00 74.32 C ATOM 1967 C GLY A 126 8.876 -6.130 24.325 1.00 1.45 C ATOM 1968 O GLY A 126 9.041 -5.301 23.430 1.00 63.31 O ATOM 0 H GLY A 126 6.659 -5.655 23.262 1.00 73.12 H new ATOM 0 HA2 GLY A 126 7.589 -5.535 25.927 1.00 74.32 H new ATOM 0 HA3 GLY A 126 7.427 -7.217 25.463 1.00 74.32 H new ATOM 1972 N SER A 127 9.817 -6.992 24.696 1.00 2.25 N ATOM 1973 CA SER A 127 11.129 -7.012 24.060 1.00 3.24 C ATOM 1974 C SER A 127 11.542 -8.438 23.711 1.00 20.53 C ATOM 1975 O SER A 127 12.096 -9.157 24.544 1.00 43.03 O ATOM 1976 CB SER A 127 12.175 -6.377 24.979 1.00 13.33 C ATOM 1977 OG SER A 127 13.435 -7.006 24.829 1.00 45.12 O ATOM 0 H SER A 127 9.695 -7.686 25.434 1.00 2.25 H new ATOM 0 HA SER A 127 11.067 -6.434 23.138 1.00 3.24 H new ATOM 0 HB2 SER A 127 12.266 -5.315 24.752 1.00 13.33 H new ATOM 0 HB3 SER A 127 11.848 -6.454 26.016 1.00 13.33 H new ATOM 0 HG SER A 127 13.973 -6.509 24.178 1.00 45.12 H new ATOM 1983 N ILE A 128 11.268 -8.841 22.475 1.00 34.32 N ATOM 1984 CA ILE A 128 11.611 -10.181 22.015 1.00 32.10 C ATOM 1985 C ILE A 128 13.121 -10.393 22.016 1.00 10.32 C ATOM 1986 O ILE A 128 13.891 -9.440 22.126 1.00 43.24 O ATOM 1987 CB ILE A 128 11.068 -10.446 20.598 1.00 33.14 C ATOM 1988 CG1 ILE A 128 11.385 -9.266 19.678 1.00 64.02 C ATOM 1989 CG2 ILE A 128 9.568 -10.700 20.645 1.00 64.01 C ATOM 1990 CD1 ILE A 128 11.217 -9.584 18.208 1.00 10.55 C ATOM 0 H ILE A 128 10.809 -8.259 21.774 1.00 34.32 H new ATOM 0 HA ILE A 128 11.148 -10.881 22.710 1.00 32.10 H new ATOM 0 HB ILE A 128 11.555 -11.335 20.198 1.00 33.14 H new ATOM 0 HG12 ILE A 128 10.736 -8.429 19.937 1.00 64.02 H new ATOM 0 HG13 ILE A 128 12.410 -8.942 19.857 1.00 64.02 H new ATOM 0 HG21 ILE A 128 9.199 -10.886 19.636 1.00 64.01 H new ATOM 0 HG22 ILE A 128 9.366 -11.569 21.271 1.00 64.01 H new ATOM 0 HG23 ILE A 128 9.064 -9.828 21.061 1.00 64.01 H new ATOM 0 HD11 ILE A 128 11.459 -8.702 17.615 1.00 10.55 H new ATOM 0 HD12 ILE A 128 11.886 -10.400 17.934 1.00 10.55 H new ATOM 0 HD13 ILE A 128 10.186 -9.880 18.015 1.00 10.55 H new ATOM 2002 N ASN A 129 13.537 -11.649 21.892 1.00 41.10 N ATOM 2003 CA ASN A 129 14.956 -11.986 21.877 1.00 31.14 C ATOM 2004 C ASN A 129 15.410 -12.365 20.471 1.00 24.43 C ATOM 2005 O ASN A 129 14.679 -12.175 19.500 1.00 3.10 O ATOM 2006 CB ASN A 129 15.238 -13.138 22.845 1.00 54.25 C ATOM 2007 CG ASN A 129 16.279 -12.777 23.886 1.00 43.42 C ATOM 2008 OD1 ASN A 129 16.371 -11.626 24.315 1.00 64.42 O ATOM 2009 ND2 ASN A 129 17.070 -13.761 24.297 1.00 45.30 N ATOM 0 H ASN A 129 12.912 -12.450 21.800 1.00 41.10 H new ATOM 0 HA ASN A 129 15.517 -11.107 22.196 1.00 31.14 H new ATOM 0 HB2 ASN A 129 14.312 -13.424 23.345 1.00 54.25 H new ATOM 0 HB3 ASN A 129 15.578 -14.007 22.282 1.00 54.25 H new ATOM 0 HD21 ASN A 129 17.790 -13.578 24.996 1.00 45.30 H new ATOM 0 HD22 ASN A 129 16.958 -14.700 23.914 1.00 45.30 H new ATOM 2016 N GLU A 130 16.622 -12.904 20.372 1.00 51.52 N ATOM 2017 CA GLU A 130 17.174 -13.309 19.084 1.00 35.13 C ATOM 2018 C GLU A 130 16.281 -14.350 18.414 1.00 43.22 C ATOM 2019 O GLU A 130 15.659 -14.080 17.387 1.00 61.21 O ATOM 2020 CB GLU A 130 18.585 -13.871 19.264 1.00 63.25 C ATOM 2021 CG GLU A 130 19.472 -13.017 20.154 1.00 10.00 C ATOM 2022 CD GLU A 130 19.495 -13.501 21.591 1.00 61.12 C ATOM 2023 OE1 GLU A 130 19.833 -14.682 21.814 1.00 31.22 O ATOM 2024 OE2 GLU A 130 19.175 -12.698 22.492 1.00 3.31 O ATOM 0 H GLU A 130 17.239 -13.070 21.167 1.00 51.52 H new ATOM 0 HA GLU A 130 17.221 -12.429 18.443 1.00 35.13 H new ATOM 0 HB2 GLU A 130 18.516 -14.873 19.688 1.00 63.25 H new ATOM 0 HB3 GLU A 130 19.055 -13.970 18.285 1.00 63.25 H new ATOM 0 HG2 GLU A 130 20.487 -13.019 19.758 1.00 10.00 H new ATOM 0 HG3 GLU A 130 19.121 -11.985 20.128 1.00 10.00 H new ATOM 2031 N ALA A 131 16.225 -15.540 19.002 1.00 22.04 N ATOM 2032 CA ALA A 131 15.409 -16.621 18.464 1.00 40.12 C ATOM 2033 C ALA A 131 13.982 -16.152 18.200 1.00 20.32 C ATOM 2034 O ALA A 131 13.426 -16.400 17.130 1.00 2.45 O ATOM 2035 CB ALA A 131 15.409 -17.808 19.416 1.00 5.51 C ATOM 0 H ALA A 131 16.736 -15.780 19.852 1.00 22.04 H new ATOM 0 HA ALA A 131 15.843 -16.932 17.514 1.00 40.12 H new ATOM 0 HB1 ALA A 131 14.795 -18.607 19.001 1.00 5.51 H new ATOM 0 HB2 ALA A 131 16.430 -18.166 19.551 1.00 5.51 H new ATOM 0 HB3 ALA A 131 15.002 -17.502 20.380 1.00 5.51 H new ATOM 2041 N GLN A 132 13.395 -15.476 19.182 1.00 4.33 N ATOM 2042 CA GLN A 132 12.032 -14.974 19.056 1.00 61.34 C ATOM 2043 C GLN A 132 11.899 -14.060 17.842 1.00 10.23 C ATOM 2044 O GLN A 132 11.011 -14.242 17.010 1.00 14.34 O ATOM 2045 CB GLN A 132 11.623 -14.222 20.323 1.00 31.23 C ATOM 2046 CG GLN A 132 10.605 -14.968 21.171 1.00 12.30 C ATOM 2047 CD GLN A 132 10.719 -14.637 22.646 1.00 4.30 C ATOM 2048 OE1 GLN A 132 11.485 -13.756 23.039 1.00 61.12 O ATOM 2049 NE2 GLN A 132 9.956 -15.343 23.472 1.00 3.54 N ATOM 0 H GLN A 132 13.842 -15.263 20.074 1.00 4.33 H new ATOM 0 HA GLN A 132 11.368 -15.828 18.920 1.00 61.34 H new ATOM 0 HB2 GLN A 132 12.512 -14.028 20.924 1.00 31.23 H new ATOM 0 HB3 GLN A 132 11.210 -13.253 20.043 1.00 31.23 H new ATOM 0 HG2 GLN A 132 9.601 -14.724 20.824 1.00 12.30 H new ATOM 0 HG3 GLN A 132 10.738 -16.041 21.032 1.00 12.30 H new ATOM 0 HE21 GLN A 132 9.336 -16.064 23.103 1.00 3.54 H new ATOM 0 HE22 GLN A 132 9.990 -15.165 24.476 1.00 3.54 H new ATOM 2058 N ALA A 133 12.788 -13.076 17.749 1.00 73.14 N ATOM 2059 CA ALA A 133 12.770 -12.134 16.636 1.00 23.33 C ATOM 2060 C ALA A 133 12.866 -12.862 15.300 1.00 52.35 C ATOM 2061 O ALA A 133 12.064 -12.626 14.394 1.00 25.22 O ATOM 2062 CB ALA A 133 13.906 -11.131 16.776 1.00 20.51 C ATOM 0 H ALA A 133 13.529 -12.911 18.430 1.00 73.14 H new ATOM 0 HA ALA A 133 11.821 -11.598 16.660 1.00 23.33 H new ATOM 0 HB1 ALA A 133 13.881 -10.434 15.939 1.00 20.51 H new ATOM 0 HB2 ALA A 133 13.792 -10.581 17.710 1.00 20.51 H new ATOM 0 HB3 ALA A 133 14.859 -11.659 16.780 1.00 20.51 H new ATOM 2068 N LEU A 134 13.850 -13.746 15.181 1.00 4.44 N ATOM 2069 CA LEU A 134 14.051 -14.508 13.954 1.00 43.32 C ATOM 2070 C LEU A 134 12.802 -15.309 13.599 1.00 4.55 C ATOM 2071 O LEU A 134 12.335 -15.276 12.462 1.00 74.52 O ATOM 2072 CB LEU A 134 15.248 -15.448 14.104 1.00 24.11 C ATOM 2073 CG LEU A 134 16.565 -14.796 14.528 1.00 60.13 C ATOM 2074 CD1 LEU A 134 17.445 -15.797 15.260 1.00 61.20 C ATOM 2075 CD2 LEU A 134 17.293 -14.229 13.318 1.00 54.53 C ATOM 0 H LEU A 134 14.522 -13.953 15.920 1.00 4.44 H new ATOM 0 HA LEU A 134 14.250 -13.803 13.147 1.00 43.32 H new ATOM 0 HB2 LEU A 134 14.993 -16.214 14.836 1.00 24.11 H new ATOM 0 HB3 LEU A 134 15.407 -15.956 13.153 1.00 24.11 H new ATOM 0 HG LEU A 134 16.339 -13.976 15.209 1.00 60.13 H new ATOM 0 HD11 LEU A 134 18.377 -15.315 15.554 1.00 61.20 H new ATOM 0 HD12 LEU A 134 16.926 -16.156 16.149 1.00 61.20 H new ATOM 0 HD13 LEU A 134 17.663 -16.639 14.603 1.00 61.20 H new ATOM 0 HD21 LEU A 134 18.228 -13.769 13.638 1.00 54.53 H new ATOM 0 HD22 LEU A 134 17.507 -15.032 12.613 1.00 54.53 H new ATOM 0 HD23 LEU A 134 16.667 -13.479 12.835 1.00 54.53 H new ATOM 2087 N ALA A 135 12.266 -16.025 14.582 1.00 3.44 N ATOM 2088 CA ALA A 135 11.069 -16.830 14.375 1.00 22.15 C ATOM 2089 C ALA A 135 9.848 -15.948 14.140 1.00 32.04 C ATOM 2090 O ALA A 135 8.834 -16.402 13.608 1.00 21.53 O ATOM 2091 CB ALA A 135 10.838 -17.748 15.567 1.00 64.02 C ATOM 0 H ALA A 135 12.642 -16.064 15.529 1.00 3.44 H new ATOM 0 HA ALA A 135 11.221 -17.440 13.484 1.00 22.15 H new ATOM 0 HB1 ALA A 135 9.941 -18.344 15.399 1.00 64.02 H new ATOM 0 HB2 ALA A 135 11.695 -18.410 15.688 1.00 64.02 H new ATOM 0 HB3 ALA A 135 10.712 -17.149 16.469 1.00 64.02 H new ATOM 2097 N LEU A 136 9.950 -14.685 14.540 1.00 20.45 N ATOM 2098 CA LEU A 136 8.853 -13.739 14.374 1.00 54.22 C ATOM 2099 C LEU A 136 8.736 -13.290 12.921 1.00 65.15 C ATOM 2100 O LEU A 136 7.650 -12.953 12.450 1.00 74.42 O ATOM 2101 CB LEU A 136 9.059 -12.524 15.280 1.00 42.44 C ATOM 2102 CG LEU A 136 7.864 -11.581 15.421 1.00 52.44 C ATOM 2103 CD1 LEU A 136 6.732 -12.263 16.173 1.00 12.52 C ATOM 2104 CD2 LEU A 136 8.278 -10.297 16.125 1.00 55.31 C ATOM 0 H LEU A 136 10.782 -14.293 14.982 1.00 20.45 H new ATOM 0 HA LEU A 136 7.928 -14.241 14.655 1.00 54.22 H new ATOM 0 HB2 LEU A 136 9.335 -12.879 16.273 1.00 42.44 H new ATOM 0 HB3 LEU A 136 9.905 -11.952 14.900 1.00 42.44 H new ATOM 0 HG LEU A 136 7.507 -11.325 14.423 1.00 52.44 H new ATOM 0 HD11 LEU A 136 5.890 -11.577 16.264 1.00 12.52 H new ATOM 0 HD12 LEU A 136 6.417 -13.153 15.628 1.00 12.52 H new ATOM 0 HD13 LEU A 136 7.076 -12.549 17.167 1.00 12.52 H new ATOM 0 HD21 LEU A 136 7.415 -9.638 16.217 1.00 55.31 H new ATOM 0 HD22 LEU A 136 8.661 -10.534 17.118 1.00 55.31 H new ATOM 0 HD23 LEU A 136 9.055 -9.799 15.546 1.00 55.31 H new ATOM 2116 N ILE A 137 9.862 -13.290 12.215 1.00 64.20 N ATOM 2117 CA ILE A 137 9.886 -12.886 10.815 1.00 72.43 C ATOM 2118 C ILE A 137 9.738 -14.092 9.892 1.00 2.33 C ATOM 2119 O ILE A 137 8.949 -14.071 8.948 1.00 14.40 O ATOM 2120 CB ILE A 137 11.188 -12.143 10.465 1.00 44.11 C ATOM 2121 CG1 ILE A 137 11.346 -10.903 11.347 1.00 40.42 C ATOM 2122 CG2 ILE A 137 11.200 -11.758 8.993 1.00 13.11 C ATOM 2123 CD1 ILE A 137 12.633 -10.886 12.142 1.00 73.11 C ATOM 0 H ILE A 137 10.770 -13.565 12.590 1.00 64.20 H new ATOM 0 HA ILE A 137 9.042 -12.212 10.667 1.00 72.43 H new ATOM 0 HB ILE A 137 12.030 -12.809 10.653 1.00 44.11 H new ATOM 0 HG12 ILE A 137 11.305 -10.013 10.719 1.00 40.42 H new ATOM 0 HG13 ILE A 137 10.503 -10.847 12.035 1.00 40.42 H new ATOM 0 HG21 ILE A 137 12.127 -11.234 8.762 1.00 13.11 H new ATOM 0 HG22 ILE A 137 11.129 -12.657 8.381 1.00 13.11 H new ATOM 0 HG23 ILE A 137 10.352 -11.107 8.780 1.00 13.11 H new ATOM 0 HD11 ILE A 137 12.677 -9.978 12.744 1.00 73.11 H new ATOM 0 HD12 ILE A 137 12.668 -11.757 12.796 1.00 73.11 H new ATOM 0 HD13 ILE A 137 13.483 -10.910 11.460 1.00 73.11 H new ATOM 2135 N ARG A 138 10.502 -15.142 10.174 1.00 62.23 N ATOM 2136 CA ARG A 138 10.456 -16.358 9.370 1.00 41.42 C ATOM 2137 C ARG A 138 9.064 -16.981 9.406 1.00 52.33 C ATOM 2138 O ARG A 138 8.653 -17.662 8.466 1.00 42.22 O ATOM 2139 CB ARG A 138 11.491 -17.366 9.872 1.00 60.11 C ATOM 2140 CG ARG A 138 11.621 -18.597 8.989 1.00 14.41 C ATOM 2141 CD ARG A 138 12.939 -19.317 9.227 1.00 53.51 C ATOM 2142 NE ARG A 138 12.830 -20.323 10.279 1.00 24.33 N ATOM 2143 CZ ARG A 138 13.879 -20.860 10.894 1.00 72.04 C ATOM 2144 NH1 ARG A 138 15.107 -20.488 10.562 1.00 5.14 N ATOM 2145 NH2 ARG A 138 13.699 -21.771 11.842 1.00 41.32 N ATOM 0 H ARG A 138 11.160 -15.176 10.953 1.00 62.23 H new ATOM 0 HA ARG A 138 10.689 -16.091 8.339 1.00 41.42 H new ATOM 0 HB2 ARG A 138 12.461 -16.874 9.940 1.00 60.11 H new ATOM 0 HB3 ARG A 138 11.221 -17.680 10.880 1.00 60.11 H new ATOM 0 HG2 ARG A 138 10.793 -19.277 9.187 1.00 14.41 H new ATOM 0 HG3 ARG A 138 11.549 -18.304 7.942 1.00 14.41 H new ATOM 0 HD2 ARG A 138 13.264 -19.793 8.302 1.00 53.51 H new ATOM 0 HD3 ARG A 138 13.705 -18.591 9.498 1.00 53.51 H new ATOM 0 HE ARG A 138 11.898 -20.631 10.557 1.00 24.33 H new ATOM 0 HH11 ARG A 138 15.248 -19.788 9.833 1.00 5.14 H new ATOM 0 HH12 ARG A 138 15.911 -20.901 11.035 1.00 5.14 H new ATOM 0 HH21 ARG A 138 12.755 -22.060 12.099 1.00 41.32 H new ATOM 0 HH22 ARG A 138 14.505 -22.183 12.313 1.00 41.32 H new ATOM 2159 N ASP A 139 8.343 -16.743 10.496 1.00 60.21 N ATOM 2160 CA ASP A 139 6.997 -17.280 10.654 1.00 35.45 C ATOM 2161 C ASP A 139 5.948 -16.230 10.303 1.00 74.24 C ATOM 2162 O ASP A 139 5.812 -15.205 10.970 1.00 2.50 O ATOM 2163 CB ASP A 139 6.785 -17.770 12.088 1.00 42.10 C ATOM 2164 CG ASP A 139 5.612 -18.723 12.207 1.00 0.34 C ATOM 2165 OD1 ASP A 139 4.457 -18.248 12.185 1.00 50.13 O ATOM 2166 OD2 ASP A 139 5.849 -19.943 12.323 1.00 71.23 O ATOM 0 H ASP A 139 8.668 -16.182 11.283 1.00 60.21 H new ATOM 0 HA ASP A 139 6.886 -18.122 9.970 1.00 35.45 H new ATOM 0 HB2 ASP A 139 7.690 -18.267 12.436 1.00 42.10 H new ATOM 0 HB3 ASP A 139 6.621 -16.913 12.741 1.00 42.10 H new ATOM 2171 N PRO A 140 5.187 -16.489 9.228 1.00 23.44 N ATOM 2172 CA PRO A 140 4.138 -15.578 8.763 1.00 75.20 C ATOM 2173 C PRO A 140 2.948 -15.530 9.715 1.00 34.04 C ATOM 2174 O PRO A 140 2.117 -14.626 9.640 1.00 74.22 O ATOM 2175 CB PRO A 140 3.721 -16.175 7.416 1.00 31.35 C ATOM 2176 CG PRO A 140 4.066 -17.621 7.520 1.00 42.20 C ATOM 2177 CD PRO A 140 5.294 -17.692 8.386 1.00 74.43 C ATOM 0 HA PRO A 140 4.492 -14.549 8.698 1.00 75.20 H new ATOM 0 HB2 PRO A 140 2.656 -16.034 7.233 1.00 31.35 H new ATOM 0 HB3 PRO A 140 4.251 -15.700 6.591 1.00 31.35 H new ATOM 0 HG2 PRO A 140 3.245 -18.188 7.960 1.00 42.20 H new ATOM 0 HG3 PRO A 140 4.257 -18.048 6.536 1.00 42.20 H new ATOM 0 HD2 PRO A 140 5.311 -18.602 8.986 1.00 74.43 H new ATOM 0 HD3 PRO A 140 6.207 -17.686 7.790 1.00 74.43 H new ATOM 2185 N ASN A 141 2.873 -16.509 10.612 1.00 52.35 N ATOM 2186 CA ASN A 141 1.784 -16.577 11.579 1.00 32.41 C ATOM 2187 C ASN A 141 2.311 -16.432 13.003 1.00 25.23 C ATOM 2188 O ASN A 141 1.675 -16.873 13.960 1.00 51.22 O ATOM 2189 CB ASN A 141 1.029 -17.900 11.435 1.00 32.44 C ATOM 2190 CG ASN A 141 -0.081 -17.824 10.404 1.00 5.12 C ATOM 2191 OD1 ASN A 141 -0.304 -16.779 9.792 1.00 24.15 O ATOM 2192 ND2 ASN A 141 -0.782 -18.934 10.207 1.00 14.21 N ATOM 0 H ASN A 141 3.553 -17.265 10.689 1.00 52.35 H new ATOM 0 HA ASN A 141 1.101 -15.752 11.378 1.00 32.41 H new ATOM 0 HB2 ASN A 141 1.730 -18.686 11.153 1.00 32.44 H new ATOM 0 HB3 ASN A 141 0.606 -18.181 12.400 1.00 32.44 H new ATOM 0 HD21 ASN A 141 -1.541 -18.944 9.525 1.00 14.21 H new ATOM 0 HD22 ASN A 141 -0.562 -19.777 10.737 1.00 14.21 H new ATOM 2199 N ALA A 142 3.479 -15.811 13.135 1.00 12.14 N ATOM 2200 CA ALA A 142 4.091 -15.605 14.442 1.00 30.02 C ATOM 2201 C ALA A 142 3.206 -14.739 15.332 1.00 5.24 C ATOM 2202 O ALA A 142 3.108 -13.528 15.135 1.00 13.42 O ATOM 2203 CB ALA A 142 5.467 -14.973 14.287 1.00 75.50 C ATOM 0 H ALA A 142 4.020 -15.442 12.353 1.00 12.14 H new ATOM 0 HA ALA A 142 4.202 -16.578 14.921 1.00 30.02 H new ATOM 0 HB1 ALA A 142 5.912 -14.825 15.271 1.00 75.50 H new ATOM 0 HB2 ALA A 142 6.105 -15.630 13.695 1.00 75.50 H new ATOM 0 HB3 ALA A 142 5.371 -14.011 13.784 1.00 75.50 H new