USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 876 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 Single : A 1 MET CE :methyl -148:sc=-0.00125 (180deg=-0.456) USER MOD Single : A 1 MET N :NH3+ -147:sc= -0.135! (180deg=-1.27!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot -179:sc= -1.18 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot -121:sc= 0.193 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl -161:sc= -0.13 (180deg=-0.65) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 0:sc= 0.185 USER MOD Single : A 48 ASN : amide:sc= -0.602 K(o=-0.6,f=-5.1!) USER MOD Single : A 49 HIS : no HD1:sc= -0.731 K(o=-0.73,f=-1.9!) USER MOD Single : B 201 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 211 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 213 THR OG1 : rot -68:sc= -0.507 USER MOD Single : B 214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 221 TYR OH : rot 180:sc= 0 USER MOD Single : B 229 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00721) USER MOD Single : B 230 SER OG : rot -29:sc= 0.355 USER MOD Single : B 235 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 236 THR OG1 : rot 180:sc= 0 USER MOD Single : B 237 SER OG : rot 180:sc= 0 USER MOD Single : B 238 MET CE :methyl -164:sc= -0.145 (180deg=-0.582) USER MOD Single : B 239 SER OG : rot 180:sc= 0 USER MOD Single : B 241 TYR OH : rot 30:sc= 0.946 USER MOD Single : B 248 ASN : amide:sc= -0.107 K(o=-0.11,f=-2.2!) USER MOD Single : B 249 HIS : no HD1:sc= -0.445 X(o=-0.44,f=-0.6) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.885 8.501 -1.455 1.00 23.30 N ATOM 2 CA MET A 1 19.898 9.543 -0.388 1.00 3.24 C ATOM 3 C MET A 1 19.791 8.925 1.016 1.00 11.51 C ATOM 4 O MET A 1 19.172 7.877 1.200 1.00 73.41 O ATOM 5 CB MET A 1 18.758 10.553 -0.610 1.00 72.22 C ATOM 6 CG MET A 1 17.385 9.914 -0.774 1.00 35.23 C ATOM 7 SD MET A 1 17.302 8.837 -2.220 1.00 2.20 S ATOM 8 CE MET A 1 15.594 8.300 -2.155 1.00 63.34 C ATOM 0 H1 MET A 1 20.479 8.811 -2.250 1.00 23.30 H new ATOM 0 H2 MET A 1 20.257 7.608 -1.073 1.00 23.30 H new ATOM 0 H3 MET A 1 18.910 8.356 -1.787 1.00 23.30 H new ATOM 0 HA MET A 1 20.855 10.062 -0.450 1.00 3.24 H new ATOM 0 HB2 MET A 1 18.728 11.242 0.234 1.00 72.22 H new ATOM 0 HB3 MET A 1 18.980 11.146 -1.498 1.00 72.22 H new ATOM 0 HG2 MET A 1 17.145 9.338 0.120 1.00 35.23 H new ATOM 0 HG3 MET A 1 16.631 10.696 -0.862 1.00 35.23 H new ATOM 0 HE1 MET A 1 15.516 7.288 -2.551 1.00 63.34 H new ATOM 0 HE2 MET A 1 15.248 8.313 -1.122 1.00 63.34 H new ATOM 0 HE3 MET A 1 14.978 8.972 -2.752 1.00 63.34 H new ATOM 20 N VAL A 2 20.396 9.586 2.006 1.00 72.44 N ATOM 21 CA VAL A 2 20.379 9.099 3.397 1.00 35.12 C ATOM 22 C VAL A 2 18.950 9.006 3.962 1.00 33.12 C ATOM 23 O VAL A 2 18.647 8.129 4.769 1.00 32.15 O ATOM 24 CB VAL A 2 21.242 9.997 4.323 1.00 52.24 C ATOM 25 CG1 VAL A 2 22.701 9.991 3.875 1.00 34.23 C ATOM 26 CG2 VAL A 2 20.697 11.425 4.367 1.00 55.45 C ATOM 0 H VAL A 2 20.905 10.460 1.875 1.00 72.44 H new ATOM 0 HA VAL A 2 20.805 8.096 3.373 1.00 35.12 H new ATOM 0 HB VAL A 2 21.191 9.586 5.331 1.00 52.24 H new ATOM 0 HG11 VAL A 2 23.288 10.627 4.538 1.00 34.23 H new ATOM 0 HG12 VAL A 2 23.089 8.973 3.912 1.00 34.23 H new ATOM 0 HG13 VAL A 2 22.770 10.369 2.855 1.00 34.23 H new ATOM 0 HG21 VAL A 2 21.321 12.032 5.023 1.00 55.45 H new ATOM 0 HG22 VAL A 2 20.706 11.849 3.363 1.00 55.45 H new ATOM 0 HG23 VAL A 2 19.675 11.413 4.747 1.00 55.45 H new ATOM 36 N GLY A 3 18.080 9.917 3.533 1.00 53.30 N ATOM 37 CA GLY A 3 16.691 9.906 3.981 1.00 54.51 C ATOM 38 C GLY A 3 15.926 11.146 3.534 1.00 32.53 C ATOM 39 O GLY A 3 15.326 11.846 4.350 1.00 65.04 O ATOM 0 H GLY A 3 18.310 10.667 2.881 1.00 53.30 H new ATOM 0 HA2 GLY A 3 16.194 9.017 3.593 1.00 54.51 H new ATOM 0 HA3 GLY A 3 16.663 9.838 5.069 1.00 54.51 H new ATOM 43 N ARG A 4 15.943 11.413 2.228 1.00 62.03 N ATOM 44 CA ARG A 4 15.322 12.624 1.674 1.00 45.41 C ATOM 45 C ARG A 4 14.173 12.292 0.712 1.00 13.22 C ATOM 46 O ARG A 4 14.223 11.308 -0.028 1.00 72.34 O ATOM 47 CB ARG A 4 16.366 13.484 0.950 1.00 73.21 C ATOM 48 CG ARG A 4 17.424 14.084 1.872 1.00 75.13 C ATOM 49 CD ARG A 4 18.309 15.083 1.133 1.00 45.32 C ATOM 50 NE ARG A 4 17.515 16.136 0.496 1.00 74.45 N ATOM 51 CZ ARG A 4 17.197 17.271 1.062 1.00 21.51 C ATOM 52 NH1 ARG A 4 17.607 17.552 2.259 1.00 10.41 N ATOM 53 NH2 ARG A 4 16.476 18.132 0.419 1.00 1.23 N ATOM 0 H ARG A 4 16.379 10.809 1.531 1.00 62.03 H new ATOM 0 HA ARG A 4 14.909 13.183 2.514 1.00 45.41 H new ATOM 0 HB2 ARG A 4 16.861 12.876 0.193 1.00 73.21 H new ATOM 0 HB3 ARG A 4 15.856 14.292 0.426 1.00 73.21 H new ATOM 0 HG2 ARG A 4 16.937 14.580 2.712 1.00 75.13 H new ATOM 0 HG3 ARG A 4 18.041 13.287 2.286 1.00 75.13 H new ATOM 0 HD2 ARG A 4 19.015 15.531 1.832 1.00 45.32 H new ATOM 0 HD3 ARG A 4 18.896 14.561 0.377 1.00 45.32 H new ATOM 0 HE ARG A 4 17.187 15.972 -0.456 1.00 74.45 H new ATOM 0 HH11 ARG A 4 18.184 16.884 2.770 1.00 10.41 H new ATOM 0 HH12 ARG A 4 17.352 18.441 2.690 1.00 10.41 H new ATOM 0 HH21 ARG A 4 16.157 17.925 -0.527 1.00 1.23 H new ATOM 0 HH22 ARG A 4 16.227 19.018 0.859 1.00 1.23 H new ATOM 67 N ARG A 5 13.153 13.144 0.712 1.00 31.33 N ATOM 68 CA ARG A 5 11.952 12.937 -0.102 1.00 31.43 C ATOM 69 C ARG A 5 11.704 14.133 -1.040 1.00 61.53 C ATOM 70 O ARG A 5 12.116 15.257 -0.743 1.00 64.33 O ATOM 71 CB ARG A 5 10.746 12.729 0.825 1.00 43.14 C ATOM 72 CG ARG A 5 10.861 11.494 1.717 1.00 2.15 C ATOM 73 CD ARG A 5 9.784 11.471 2.798 1.00 72.43 C ATOM 74 NE ARG A 5 9.957 12.553 3.767 1.00 21.01 N ATOM 75 CZ ARG A 5 9.292 12.652 4.885 1.00 22.53 C ATOM 76 NH1 ARG A 5 8.386 11.781 5.197 1.00 51.31 N ATOM 77 NH2 ARG A 5 9.535 13.632 5.690 1.00 4.52 N ATOM 0 H ARG A 5 13.132 13.996 1.273 1.00 31.33 H new ATOM 0 HA ARG A 5 12.096 12.053 -0.724 1.00 31.43 H new ATOM 0 HB2 ARG A 5 10.627 13.611 1.455 1.00 43.14 H new ATOM 0 HB3 ARG A 5 9.844 12.646 0.219 1.00 43.14 H new ATOM 0 HG2 ARG A 5 10.781 10.595 1.105 1.00 2.15 H new ATOM 0 HG3 ARG A 5 11.845 11.474 2.185 1.00 2.15 H new ATOM 0 HD2 ARG A 5 8.802 11.554 2.333 1.00 72.43 H new ATOM 0 HD3 ARG A 5 9.811 10.512 3.316 1.00 72.43 H new ATOM 0 HE ARG A 5 10.643 13.278 3.555 1.00 21.01 H new ATOM 0 HH11 ARG A 5 8.185 11.006 4.565 1.00 51.31 H new ATOM 0 HH12 ARG A 5 7.873 11.870 6.074 1.00 51.31 H new ATOM 0 HH21 ARG A 5 10.244 14.325 5.451 1.00 4.52 H new ATOM 0 HH22 ARG A 5 9.017 13.713 6.565 1.00 4.52 H new ATOM 91 N PRO A 6 11.036 13.912 -2.193 1.00 40.42 N ATOM 92 CA PRO A 6 10.720 14.993 -3.150 1.00 62.13 C ATOM 93 C PRO A 6 9.678 15.992 -2.603 1.00 71.50 C ATOM 94 O PRO A 6 9.368 15.992 -1.411 1.00 71.41 O ATOM 95 CB PRO A 6 10.165 14.245 -4.379 1.00 65.50 C ATOM 96 CG PRO A 6 10.489 12.801 -4.156 1.00 72.55 C ATOM 97 CD PRO A 6 10.548 12.610 -2.668 1.00 20.14 C ATOM 0 HA PRO A 6 11.597 15.601 -3.369 1.00 62.13 H new ATOM 0 HB2 PRO A 6 9.090 14.394 -4.475 1.00 65.50 H new ATOM 0 HB3 PRO A 6 10.621 14.611 -5.299 1.00 65.50 H new ATOM 0 HG2 PRO A 6 9.729 12.158 -4.601 1.00 72.55 H new ATOM 0 HG3 PRO A 6 11.440 12.539 -4.620 1.00 72.55 H new ATOM 0 HD2 PRO A 6 9.570 12.368 -2.252 1.00 20.14 H new ATOM 0 HD3 PRO A 6 11.222 11.799 -2.390 1.00 20.14 H new ATOM 105 N GLY A 7 9.145 16.847 -3.477 1.00 30.04 N ATOM 106 CA GLY A 7 8.154 17.838 -3.057 1.00 25.21 C ATOM 107 C GLY A 7 7.061 18.075 -4.097 1.00 11.14 C ATOM 108 O GLY A 7 7.290 18.746 -5.108 1.00 25.31 O ATOM 0 H GLY A 7 9.380 16.874 -4.469 1.00 30.04 H new ATOM 0 HA2 GLY A 7 7.694 17.510 -2.125 1.00 25.21 H new ATOM 0 HA3 GLY A 7 8.659 18.781 -2.849 1.00 25.21 H new ATOM 112 N GLY A 8 5.870 17.537 -3.844 1.00 44.04 N ATOM 113 CA GLY A 8 4.753 17.694 -4.776 1.00 62.14 C ATOM 114 C GLY A 8 3.682 16.620 -4.600 1.00 5.53 C ATOM 115 O GLY A 8 2.525 16.923 -4.295 1.00 73.04 O ATOM 0 H GLY A 8 5.653 16.993 -3.009 1.00 44.04 H new ATOM 0 HA2 GLY A 8 4.303 18.677 -4.635 1.00 62.14 H new ATOM 0 HA3 GLY A 8 5.131 17.660 -5.798 1.00 62.14 H new ATOM 119 N GLY A 9 4.064 15.364 -4.813 1.00 42.44 N ATOM 120 CA GLY A 9 3.159 14.241 -4.581 1.00 35.32 C ATOM 121 C GLY A 9 2.428 13.763 -5.837 1.00 2.25 C ATOM 122 O GLY A 9 2.099 12.582 -5.954 1.00 22.50 O ATOM 0 H GLY A 9 4.991 15.098 -5.145 1.00 42.44 H new ATOM 0 HA2 GLY A 9 3.727 13.409 -4.165 1.00 35.32 H new ATOM 0 HA3 GLY A 9 2.422 14.530 -3.832 1.00 35.32 H new ATOM 126 N LEU A 10 2.179 14.673 -6.778 1.00 24.13 N ATOM 127 CA LEU A 10 1.421 14.341 -7.995 1.00 75.34 C ATOM 128 C LEU A 10 2.235 13.467 -8.963 1.00 22.14 C ATOM 129 O LEU A 10 1.679 12.615 -9.661 1.00 63.04 O ATOM 130 CB LEU A 10 0.970 15.622 -8.713 1.00 20.24 C ATOM 131 CG LEU A 10 0.045 16.545 -7.901 1.00 13.40 C ATOM 132 CD1 LEU A 10 -0.334 17.775 -8.721 1.00 33.24 C ATOM 133 CD2 LEU A 10 -1.207 15.797 -7.441 1.00 63.43 C ATOM 0 H LEU A 10 2.488 15.644 -6.726 1.00 24.13 H new ATOM 0 HA LEU A 10 0.547 13.770 -7.681 1.00 75.34 H new ATOM 0 HB2 LEU A 10 1.856 16.187 -9.002 1.00 20.24 H new ATOM 0 HB3 LEU A 10 0.458 15.341 -9.633 1.00 20.24 H new ATOM 0 HG LEU A 10 0.586 16.874 -7.014 1.00 13.40 H new ATOM 0 HD11 LEU A 10 -0.989 18.417 -8.132 1.00 33.24 H new ATOM 0 HD12 LEU A 10 0.568 18.325 -8.990 1.00 33.24 H new ATOM 0 HD13 LEU A 10 -0.852 17.462 -9.627 1.00 33.24 H new ATOM 0 HD21 LEU A 10 -1.844 16.472 -6.869 1.00 63.43 H new ATOM 0 HD22 LEU A 10 -1.753 15.432 -8.311 1.00 63.43 H new ATOM 0 HD23 LEU A 10 -0.917 14.953 -6.815 1.00 63.43 H new ATOM 145 N LYS A 11 3.546 13.685 -9.008 1.00 62.33 N ATOM 146 CA LYS A 11 4.433 12.929 -9.909 1.00 61.22 C ATOM 147 C LYS A 11 5.739 12.523 -9.207 1.00 51.10 C ATOM 148 O LYS A 11 6.720 12.156 -9.853 1.00 2.12 O ATOM 149 CB LYS A 11 4.741 13.773 -11.154 1.00 11.22 C ATOM 150 CG LYS A 11 5.334 15.144 -10.835 1.00 23.43 C ATOM 151 CD LYS A 11 5.639 15.946 -12.099 1.00 41.14 C ATOM 152 CE LYS A 11 4.389 16.187 -12.946 1.00 13.45 C ATOM 153 NZ LYS A 11 4.685 17.026 -14.138 1.00 65.15 N ATOM 0 H LYS A 11 4.025 14.378 -8.433 1.00 62.33 H new ATOM 0 HA LYS A 11 3.920 12.014 -10.204 1.00 61.22 H new ATOM 0 HB2 LYS A 11 5.436 13.225 -11.790 1.00 11.22 H new ATOM 0 HB3 LYS A 11 3.823 13.908 -11.727 1.00 11.22 H new ATOM 0 HG2 LYS A 11 4.638 15.703 -10.210 1.00 23.43 H new ATOM 0 HG3 LYS A 11 6.249 15.017 -10.257 1.00 23.43 H new ATOM 0 HD2 LYS A 11 6.078 16.904 -11.822 1.00 41.14 H new ATOM 0 HD3 LYS A 11 6.382 15.415 -12.694 1.00 41.14 H new ATOM 0 HE2 LYS A 11 3.977 15.230 -13.268 1.00 13.45 H new ATOM 0 HE3 LYS A 11 3.626 16.674 -12.339 1.00 13.45 H new ATOM 0 HZ1 LYS A 11 3.814 17.168 -14.688 1.00 65.15 H new ATOM 0 HZ2 LYS A 11 5.054 17.948 -13.830 1.00 65.15 H new ATOM 0 HZ3 LYS A 11 5.394 16.549 -14.731 1.00 65.15 H new ATOM 167 N ASP A 12 5.731 12.567 -7.877 1.00 25.12 N ATOM 168 CA ASP A 12 6.934 12.308 -7.071 1.00 23.04 C ATOM 169 C ASP A 12 6.872 10.945 -6.361 1.00 61.33 C ATOM 170 O ASP A 12 7.649 10.671 -5.442 1.00 21.42 O ATOM 171 CB ASP A 12 7.087 13.427 -6.038 1.00 74.22 C ATOM 172 CG ASP A 12 7.039 14.799 -6.681 1.00 71.21 C ATOM 173 OD1 ASP A 12 5.917 15.311 -6.896 1.00 15.54 O ATOM 174 OD2 ASP A 12 8.110 15.361 -6.984 1.00 5.15 O ATOM 0 H ASP A 12 4.900 12.781 -7.326 1.00 25.12 H new ATOM 0 HA ASP A 12 7.795 12.284 -7.739 1.00 23.04 H new ATOM 0 HB2 ASP A 12 6.294 13.346 -5.295 1.00 74.22 H new ATOM 0 HB3 ASP A 12 8.033 13.307 -5.509 1.00 74.22 H new ATOM 179 N THR A 13 5.954 10.088 -6.796 1.00 32.15 N ATOM 180 CA THR A 13 5.751 8.783 -6.153 1.00 71.13 C ATOM 181 C THR A 13 5.981 7.617 -7.130 1.00 72.54 C ATOM 182 O THR A 13 5.702 7.722 -8.328 1.00 72.14 O ATOM 183 CB THR A 13 4.329 8.666 -5.552 1.00 10.11 C ATOM 184 OG1 THR A 13 3.334 8.783 -6.582 1.00 71.14 O ATOM 185 CG2 THR A 13 4.087 9.736 -4.488 1.00 32.30 C ATOM 0 H THR A 13 5.338 10.268 -7.589 1.00 32.15 H new ATOM 0 HA THR A 13 6.488 8.719 -5.353 1.00 71.13 H new ATOM 0 HB THR A 13 4.252 7.685 -5.084 1.00 10.11 H new ATOM 0 HG1 THR A 13 2.441 8.721 -6.183 1.00 71.14 H new ATOM 0 HG21 THR A 13 3.080 9.627 -4.085 1.00 32.30 H new ATOM 0 HG22 THR A 13 4.814 9.621 -3.684 1.00 32.30 H new ATOM 0 HG23 THR A 13 4.194 10.724 -4.935 1.00 32.30 H new ATOM 193 N LYS A 14 6.504 6.511 -6.603 1.00 4.12 N ATOM 194 CA LYS A 14 6.785 5.304 -7.394 1.00 61.34 C ATOM 195 C LYS A 14 5.579 4.344 -7.401 1.00 41.25 C ATOM 196 O LYS A 14 5.067 3.976 -6.343 1.00 33.23 O ATOM 197 CB LYS A 14 8.014 4.583 -6.820 1.00 40.53 C ATOM 198 CG LYS A 14 9.286 5.425 -6.830 1.00 51.41 C ATOM 199 CD LYS A 14 9.794 5.675 -8.247 1.00 0.24 C ATOM 200 CE LYS A 14 10.254 4.385 -8.920 1.00 23.13 C ATOM 201 NZ LYS A 14 10.638 4.606 -10.338 1.00 0.42 N ATOM 0 H LYS A 14 6.746 6.422 -5.616 1.00 4.12 H new ATOM 0 HA LYS A 14 6.981 5.611 -8.421 1.00 61.34 H new ATOM 0 HB2 LYS A 14 7.799 4.279 -5.795 1.00 40.53 H new ATOM 0 HB3 LYS A 14 8.189 3.672 -7.392 1.00 40.53 H new ATOM 0 HG2 LYS A 14 9.093 6.379 -6.340 1.00 51.41 H new ATOM 0 HG3 LYS A 14 10.060 4.920 -6.251 1.00 51.41 H new ATOM 0 HD2 LYS A 14 9.003 6.133 -8.841 1.00 0.24 H new ATOM 0 HD3 LYS A 14 10.621 6.384 -8.217 1.00 0.24 H new ATOM 0 HE2 LYS A 14 11.103 3.973 -8.374 1.00 23.13 H new ATOM 0 HE3 LYS A 14 9.455 3.645 -8.871 1.00 23.13 H new ATOM 0 HZ1 LYS A 14 10.944 3.706 -10.759 1.00 0.42 H new ATOM 0 HZ2 LYS A 14 9.821 4.975 -10.865 1.00 0.42 H new ATOM 0 HZ3 LYS A 14 11.418 5.293 -10.384 1.00 0.42 H new ATOM 215 N PRO A 15 5.104 3.933 -8.596 1.00 21.12 N ATOM 216 CA PRO A 15 3.979 2.987 -8.730 1.00 12.13 C ATOM 217 C PRO A 15 4.330 1.555 -8.285 1.00 0.14 C ATOM 218 O PRO A 15 5.452 1.080 -8.497 1.00 44.10 O ATOM 219 CB PRO A 15 3.653 3.016 -10.239 1.00 63.34 C ATOM 220 CG PRO A 15 4.387 4.203 -10.781 1.00 51.12 C ATOM 221 CD PRO A 15 5.598 4.369 -9.910 1.00 71.54 C ATOM 0 HA PRO A 15 3.145 3.276 -8.090 1.00 12.13 H new ATOM 0 HB2 PRO A 15 3.976 2.097 -10.729 1.00 63.34 H new ATOM 0 HB3 PRO A 15 2.580 3.107 -10.408 1.00 63.34 H new ATOM 0 HG2 PRO A 15 4.672 4.045 -11.821 1.00 51.12 H new ATOM 0 HG3 PRO A 15 3.761 5.095 -10.754 1.00 51.12 H new ATOM 0 HD2 PRO A 15 6.432 3.758 -10.254 1.00 71.54 H new ATOM 0 HD3 PRO A 15 5.946 5.402 -9.891 1.00 71.54 H new ATOM 229 N VAL A 16 3.364 0.880 -7.663 1.00 21.21 N ATOM 230 CA VAL A 16 3.519 -0.519 -7.246 1.00 1.33 C ATOM 231 C VAL A 16 2.158 -1.241 -7.216 1.00 3.12 C ATOM 232 O VAL A 16 1.204 -0.779 -6.583 1.00 12.14 O ATOM 233 CB VAL A 16 4.205 -0.626 -5.853 1.00 41.42 C ATOM 234 CG1 VAL A 16 3.439 0.168 -4.792 1.00 52.51 C ATOM 235 CG2 VAL A 16 4.363 -2.090 -5.434 1.00 25.42 C ATOM 0 H VAL A 16 2.455 1.282 -7.433 1.00 21.21 H new ATOM 0 HA VAL A 16 4.159 -1.005 -7.982 1.00 1.33 H new ATOM 0 HB VAL A 16 5.200 -0.188 -5.938 1.00 41.42 H new ATOM 0 HG11 VAL A 16 3.944 0.072 -3.831 1.00 52.51 H new ATOM 0 HG12 VAL A 16 3.402 1.219 -5.080 1.00 52.51 H new ATOM 0 HG13 VAL A 16 2.424 -0.221 -4.709 1.00 52.51 H new ATOM 0 HG21 VAL A 16 4.845 -2.139 -4.457 1.00 25.42 H new ATOM 0 HG22 VAL A 16 3.381 -2.560 -5.378 1.00 25.42 H new ATOM 0 HG23 VAL A 16 4.976 -2.614 -6.167 1.00 25.42 H new ATOM 245 N VAL A 17 2.062 -2.368 -7.918 1.00 34.03 N ATOM 246 CA VAL A 17 0.819 -3.143 -7.961 1.00 52.33 C ATOM 247 C VAL A 17 0.690 -4.083 -6.744 1.00 41.12 C ATOM 248 O VAL A 17 1.380 -5.100 -6.636 1.00 62.41 O ATOM 249 CB VAL A 17 0.695 -3.947 -9.286 1.00 3.53 C ATOM 250 CG1 VAL A 17 1.889 -4.880 -9.491 1.00 2.04 C ATOM 251 CG2 VAL A 17 -0.622 -4.727 -9.329 1.00 73.21 C ATOM 0 H VAL A 17 2.826 -2.766 -8.464 1.00 34.03 H new ATOM 0 HA VAL A 17 -0.002 -2.427 -7.920 1.00 52.33 H new ATOM 0 HB VAL A 17 0.694 -3.230 -10.107 1.00 3.53 H new ATOM 0 HG11 VAL A 17 1.768 -5.426 -10.427 1.00 2.04 H new ATOM 0 HG12 VAL A 17 2.807 -4.293 -9.529 1.00 2.04 H new ATOM 0 HG13 VAL A 17 1.944 -5.587 -8.663 1.00 2.04 H new ATOM 0 HG21 VAL A 17 -0.686 -5.282 -10.265 1.00 73.21 H new ATOM 0 HG22 VAL A 17 -0.660 -5.423 -8.491 1.00 73.21 H new ATOM 0 HG23 VAL A 17 -1.459 -4.032 -9.261 1.00 73.21 H new ATOM 261 N VAL A 18 -0.187 -3.716 -5.817 1.00 23.25 N ATOM 262 CA VAL A 18 -0.459 -4.525 -4.621 1.00 61.02 C ATOM 263 C VAL A 18 -1.722 -5.378 -4.835 1.00 42.41 C ATOM 264 O VAL A 18 -2.436 -5.185 -5.811 1.00 31.25 O ATOM 265 CB VAL A 18 -0.646 -3.609 -3.379 1.00 21.52 C ATOM 266 CG1 VAL A 18 -0.712 -4.422 -2.087 1.00 3.10 C ATOM 267 CG2 VAL A 18 0.470 -2.569 -3.304 1.00 71.44 C ATOM 0 H VAL A 18 -0.731 -2.854 -5.867 1.00 23.25 H new ATOM 0 HA VAL A 18 0.392 -5.184 -4.448 1.00 61.02 H new ATOM 0 HB VAL A 18 -1.598 -3.090 -3.492 1.00 21.52 H new ATOM 0 HG11 VAL A 18 -0.843 -3.749 -1.240 1.00 3.10 H new ATOM 0 HG12 VAL A 18 -1.553 -5.113 -2.135 1.00 3.10 H new ATOM 0 HG13 VAL A 18 0.213 -4.985 -1.964 1.00 3.10 H new ATOM 0 HG21 VAL A 18 0.321 -1.938 -2.428 1.00 71.44 H new ATOM 0 HG22 VAL A 18 1.433 -3.074 -3.228 1.00 71.44 H new ATOM 0 HG23 VAL A 18 0.454 -1.952 -4.203 1.00 71.44 H new ATOM 277 N ARG A 19 -1.989 -6.338 -3.950 1.00 24.20 N ATOM 278 CA ARG A 19 -3.239 -7.106 -4.015 1.00 74.35 C ATOM 279 C ARG A 19 -3.963 -7.109 -2.660 1.00 34.22 C ATOM 280 O ARG A 19 -3.340 -7.291 -1.616 1.00 10.12 O ATOM 281 CB ARG A 19 -2.995 -8.558 -4.468 1.00 20.31 C ATOM 282 CG ARG A 19 -2.342 -8.706 -5.843 1.00 22.33 C ATOM 283 CD ARG A 19 -2.676 -10.054 -6.496 1.00 4.20 C ATOM 284 NE ARG A 19 -2.493 -11.192 -5.588 1.00 14.44 N ATOM 285 CZ ARG A 19 -2.727 -12.442 -5.913 1.00 23.11 C ATOM 286 NH1 ARG A 19 -3.110 -12.762 -7.110 1.00 42.13 N ATOM 287 NH2 ARG A 19 -2.578 -13.381 -5.038 1.00 12.14 N ATOM 0 H ARG A 19 -1.367 -6.603 -3.187 1.00 24.20 H new ATOM 0 HA ARG A 19 -3.869 -6.613 -4.755 1.00 74.35 H new ATOM 0 HB2 ARG A 19 -2.365 -9.052 -3.728 1.00 20.31 H new ATOM 0 HB3 ARG A 19 -3.949 -9.085 -4.477 1.00 20.31 H new ATOM 0 HG2 ARG A 19 -2.676 -7.896 -6.492 1.00 22.33 H new ATOM 0 HG3 ARG A 19 -1.261 -8.609 -5.743 1.00 22.33 H new ATOM 0 HD2 ARG A 19 -3.709 -10.037 -6.844 1.00 4.20 H new ATOM 0 HD3 ARG A 19 -2.046 -10.192 -7.374 1.00 4.20 H new ATOM 0 HE ARG A 19 -2.162 -10.999 -4.643 1.00 14.44 H new ATOM 0 HH11 ARG A 19 -3.234 -12.037 -7.817 1.00 42.13 H new ATOM 0 HH12 ARG A 19 -3.287 -13.739 -7.345 1.00 42.13 H new ATOM 0 HH21 ARG A 19 -2.277 -13.152 -4.091 1.00 12.14 H new ATOM 0 HH22 ARG A 19 -2.761 -14.351 -5.295 1.00 12.14 H new ATOM 301 N LEU A 20 -5.280 -6.903 -2.691 1.00 33.35 N ATOM 302 CA LEU A 20 -6.118 -6.946 -1.483 1.00 1.25 C ATOM 303 C LEU A 20 -7.420 -7.721 -1.766 1.00 21.14 C ATOM 304 O LEU A 20 -7.905 -7.727 -2.898 1.00 12.52 O ATOM 305 CB LEU A 20 -6.432 -5.516 -1.005 1.00 21.12 C ATOM 306 CG LEU A 20 -7.242 -5.415 0.303 1.00 1.31 C ATOM 307 CD1 LEU A 20 -6.483 -6.050 1.466 1.00 65.52 C ATOM 308 CD2 LEU A 20 -7.585 -3.958 0.613 1.00 40.24 C ATOM 0 H LEU A 20 -5.798 -6.702 -3.547 1.00 33.35 H new ATOM 0 HA LEU A 20 -5.573 -7.463 -0.693 1.00 1.25 H new ATOM 0 HB2 LEU A 20 -5.491 -4.982 -0.871 1.00 21.12 H new ATOM 0 HB3 LEU A 20 -6.982 -5.001 -1.793 1.00 21.12 H new ATOM 0 HG LEU A 20 -8.173 -5.965 0.168 1.00 1.31 H new ATOM 0 HD11 LEU A 20 -7.076 -5.966 2.377 1.00 65.52 H new ATOM 0 HD12 LEU A 20 -6.299 -7.102 1.249 1.00 65.52 H new ATOM 0 HD13 LEU A 20 -5.532 -5.536 1.603 1.00 65.52 H new ATOM 0 HD21 LEU A 20 -8.157 -3.908 1.540 1.00 40.24 H new ATOM 0 HD22 LEU A 20 -6.665 -3.383 0.722 1.00 40.24 H new ATOM 0 HD23 LEU A 20 -8.178 -3.542 -0.202 1.00 40.24 H new ATOM 320 N TYR A 21 -7.973 -8.387 -0.751 1.00 12.04 N ATOM 321 CA TYR A 21 -9.178 -9.210 -0.935 1.00 55.24 C ATOM 322 C TYR A 21 -10.362 -8.371 -1.452 1.00 10.22 C ATOM 323 O TYR A 21 -10.710 -7.346 -0.865 1.00 2.11 O ATOM 324 CB TYR A 21 -9.548 -9.920 0.374 1.00 14.23 C ATOM 325 CG TYR A 21 -8.497 -10.920 0.828 1.00 54.03 C ATOM 326 CD1 TYR A 21 -7.402 -10.516 1.587 1.00 30.22 C ATOM 327 CD2 TYR A 21 -8.591 -12.265 0.480 1.00 64.35 C ATOM 328 CE1 TYR A 21 -6.436 -11.421 1.985 1.00 30.25 C ATOM 329 CE2 TYR A 21 -7.628 -13.175 0.879 1.00 70.24 C ATOM 330 CZ TYR A 21 -6.554 -12.746 1.630 1.00 50.31 C ATOM 331 OH TYR A 21 -5.587 -13.647 2.021 1.00 30.33 O ATOM 0 H TYR A 21 -7.611 -8.376 0.203 1.00 12.04 H new ATOM 0 HA TYR A 21 -8.954 -9.964 -1.690 1.00 55.24 H new ATOM 0 HB2 TYR A 21 -9.693 -9.175 1.156 1.00 14.23 H new ATOM 0 HB3 TYR A 21 -10.499 -10.436 0.244 1.00 14.23 H new ATOM 0 HD1 TYR A 21 -7.306 -9.478 1.870 1.00 30.22 H new ATOM 0 HD2 TYR A 21 -9.429 -12.603 -0.111 1.00 64.35 H new ATOM 0 HE1 TYR A 21 -5.592 -11.090 2.572 1.00 30.25 H new ATOM 0 HE2 TYR A 21 -7.717 -14.216 0.604 1.00 70.24 H new ATOM 0 HH TYR A 21 -5.196 -14.071 1.229 1.00 30.33 H new ATOM 341 N PRO A 22 -11.004 -8.812 -2.559 1.00 72.23 N ATOM 342 CA PRO A 22 -12.077 -8.049 -3.233 1.00 73.24 C ATOM 343 C PRO A 22 -13.181 -7.565 -2.275 1.00 75.52 C ATOM 344 O PRO A 22 -13.639 -6.424 -2.366 1.00 75.43 O ATOM 345 CB PRO A 22 -12.648 -9.049 -4.263 1.00 73.42 C ATOM 346 CG PRO A 22 -12.069 -10.379 -3.898 1.00 51.24 C ATOM 347 CD PRO A 22 -10.747 -10.090 -3.246 1.00 71.41 C ATOM 0 HA PRO A 22 -11.687 -7.133 -3.677 1.00 73.24 H new ATOM 0 HB2 PRO A 22 -13.737 -9.072 -4.225 1.00 73.42 H new ATOM 0 HB3 PRO A 22 -12.371 -8.766 -5.279 1.00 73.42 H new ATOM 0 HG2 PRO A 22 -12.729 -10.919 -3.219 1.00 51.24 H new ATOM 0 HG3 PRO A 22 -11.940 -11.004 -4.782 1.00 51.24 H new ATOM 0 HD2 PRO A 22 -10.458 -10.876 -2.548 1.00 71.41 H new ATOM 0 HD3 PRO A 22 -9.944 -10.003 -3.978 1.00 71.41 H new ATOM 355 N ASP A 23 -13.598 -8.433 -1.356 1.00 61.33 N ATOM 356 CA ASP A 23 -14.659 -8.098 -0.403 1.00 50.31 C ATOM 357 C ASP A 23 -14.210 -6.990 0.575 1.00 52.01 C ATOM 358 O ASP A 23 -15.023 -6.189 1.042 1.00 42.12 O ATOM 359 CB ASP A 23 -15.094 -9.361 0.357 1.00 44.45 C ATOM 360 CG ASP A 23 -16.382 -9.163 1.135 1.00 53.03 C ATOM 361 OD1 ASP A 23 -17.328 -8.564 0.578 1.00 52.33 O ATOM 362 OD2 ASP A 23 -16.464 -9.619 2.291 1.00 43.50 O ATOM 0 H ASP A 23 -13.219 -9.374 -1.249 1.00 61.33 H new ATOM 0 HA ASP A 23 -15.512 -7.710 -0.959 1.00 50.31 H new ATOM 0 HB2 ASP A 23 -15.224 -10.179 -0.351 1.00 44.45 H new ATOM 0 HB3 ASP A 23 -14.301 -9.658 1.044 1.00 44.45 H new ATOM 367 N GLU A 24 -12.911 -6.938 0.871 1.00 11.44 N ATOM 368 CA GLU A 24 -12.359 -5.882 1.728 1.00 33.54 C ATOM 369 C GLU A 24 -12.203 -4.571 0.944 1.00 62.20 C ATOM 370 O GLU A 24 -12.424 -3.486 1.482 1.00 63.14 O ATOM 371 CB GLU A 24 -11.012 -6.313 2.323 1.00 12.20 C ATOM 372 CG GLU A 24 -11.110 -7.548 3.213 1.00 41.01 C ATOM 373 CD GLU A 24 -9.800 -7.874 3.909 1.00 63.44 C ATOM 374 OE1 GLU A 24 -8.892 -8.411 3.246 1.00 14.23 O ATOM 375 OE2 GLU A 24 -9.685 -7.610 5.125 1.00 63.33 O ATOM 0 H GLU A 24 -12.222 -7.610 0.533 1.00 11.44 H new ATOM 0 HA GLU A 24 -13.058 -5.712 2.547 1.00 33.54 H new ATOM 0 HB2 GLU A 24 -10.312 -6.514 1.512 1.00 12.20 H new ATOM 0 HB3 GLU A 24 -10.599 -5.488 2.903 1.00 12.20 H new ATOM 0 HG2 GLU A 24 -11.885 -7.390 3.963 1.00 41.01 H new ATOM 0 HG3 GLU A 24 -11.419 -8.402 2.610 1.00 41.01 H new ATOM 382 N ILE A 25 -11.832 -4.679 -0.335 1.00 41.42 N ATOM 383 CA ILE A 25 -11.792 -3.514 -1.229 1.00 21.14 C ATOM 384 C ILE A 25 -13.185 -2.872 -1.330 1.00 3.13 C ATOM 385 O ILE A 25 -13.322 -1.646 -1.381 1.00 71.41 O ATOM 386 CB ILE A 25 -11.297 -3.899 -2.648 1.00 61.20 C ATOM 387 CG1 ILE A 25 -9.897 -4.531 -2.568 1.00 31.23 C ATOM 388 CG2 ILE A 25 -11.290 -2.680 -3.574 1.00 63.22 C ATOM 389 CD1 ILE A 25 -9.340 -4.964 -3.910 1.00 31.25 C ATOM 0 H ILE A 25 -11.556 -5.557 -0.775 1.00 41.42 H new ATOM 0 HA ILE A 25 -11.088 -2.799 -0.803 1.00 21.14 H new ATOM 0 HB ILE A 25 -11.986 -4.632 -3.067 1.00 61.20 H new ATOM 0 HG12 ILE A 25 -9.211 -3.815 -2.115 1.00 31.23 H new ATOM 0 HG13 ILE A 25 -9.937 -5.396 -1.906 1.00 31.23 H new ATOM 0 HG21 ILE A 25 -10.939 -2.976 -4.563 1.00 63.22 H new ATOM 0 HG22 ILE A 25 -12.300 -2.277 -3.653 1.00 63.22 H new ATOM 0 HG23 ILE A 25 -10.626 -1.917 -3.167 1.00 63.22 H new ATOM 0 HD11 ILE A 25 -8.351 -5.400 -3.770 1.00 31.25 H new ATOM 0 HD12 ILE A 25 -10.003 -5.705 -4.357 1.00 31.25 H new ATOM 0 HD13 ILE A 25 -9.266 -4.099 -4.569 1.00 31.25 H new ATOM 401 N GLU A 26 -14.212 -3.722 -1.340 1.00 64.42 N ATOM 402 CA GLU A 26 -15.610 -3.279 -1.305 1.00 24.34 C ATOM 403 C GLU A 26 -15.864 -2.346 -0.104 1.00 72.21 C ATOM 404 O GLU A 26 -16.511 -1.306 -0.231 1.00 54.32 O ATOM 405 CB GLU A 26 -16.531 -4.509 -1.226 1.00 22.55 C ATOM 406 CG GLU A 26 -18.021 -4.204 -1.362 1.00 11.24 C ATOM 407 CD GLU A 26 -18.398 -3.680 -2.741 1.00 44.42 C ATOM 408 OE1 GLU A 26 -17.866 -4.196 -3.750 1.00 54.32 O ATOM 409 OE2 GLU A 26 -19.230 -2.755 -2.823 1.00 21.43 O ATOM 0 H GLU A 26 -14.101 -4.735 -1.373 1.00 64.42 H new ATOM 0 HA GLU A 26 -15.824 -2.719 -2.215 1.00 24.34 H new ATOM 0 HB2 GLU A 26 -16.245 -5.210 -2.010 1.00 22.55 H new ATOM 0 HB3 GLU A 26 -16.363 -5.011 -0.273 1.00 22.55 H new ATOM 0 HG2 GLU A 26 -18.592 -5.109 -1.155 1.00 11.24 H new ATOM 0 HG3 GLU A 26 -18.306 -3.468 -0.610 1.00 11.24 H new ATOM 416 N ALA A 27 -15.338 -2.727 1.061 1.00 42.11 N ATOM 417 CA ALA A 27 -15.449 -1.905 2.272 1.00 70.23 C ATOM 418 C ALA A 27 -14.495 -0.698 2.222 1.00 52.41 C ATOM 419 O ALA A 27 -14.804 0.377 2.739 1.00 13.41 O ATOM 420 CB ALA A 27 -15.171 -2.756 3.510 1.00 24.31 C ATOM 0 H ALA A 27 -14.829 -3.601 1.194 1.00 42.11 H new ATOM 0 HA ALA A 27 -16.467 -1.519 2.327 1.00 70.23 H new ATOM 0 HB1 ALA A 27 -15.256 -2.137 4.403 1.00 24.31 H new ATOM 0 HB2 ALA A 27 -15.894 -3.570 3.562 1.00 24.31 H new ATOM 0 HB3 ALA A 27 -14.164 -3.169 3.449 1.00 24.31 H new ATOM 426 N LEU A 28 -13.339 -0.885 1.584 1.00 52.34 N ATOM 427 CA LEU A 28 -12.340 0.183 1.434 1.00 24.14 C ATOM 428 C LEU A 28 -12.934 1.420 0.741 1.00 11.04 C ATOM 429 O LEU A 28 -12.956 2.511 1.305 1.00 23.32 O ATOM 430 CB LEU A 28 -11.135 -0.336 0.635 1.00 62.11 C ATOM 431 CG LEU A 28 -10.003 0.681 0.398 1.00 2.33 C ATOM 432 CD1 LEU A 28 -9.364 1.109 1.718 1.00 40.31 C ATOM 433 CD2 LEU A 28 -8.956 0.102 -0.554 1.00 13.30 C ATOM 0 H LEU A 28 -13.067 -1.771 1.159 1.00 52.34 H new ATOM 0 HA LEU A 28 -12.017 0.481 2.431 1.00 24.14 H new ATOM 0 HB2 LEU A 28 -10.720 -1.198 1.157 1.00 62.11 H new ATOM 0 HB3 LEU A 28 -11.489 -0.690 -0.333 1.00 62.11 H new ATOM 0 HG LEU A 28 -10.434 1.569 -0.065 1.00 2.33 H new ATOM 0 HD11 LEU A 28 -8.568 1.827 1.521 1.00 40.31 H new ATOM 0 HD12 LEU A 28 -10.119 1.570 2.355 1.00 40.31 H new ATOM 0 HD13 LEU A 28 -8.949 0.236 2.221 1.00 40.31 H new ATOM 0 HD21 LEU A 28 -8.163 0.833 -0.711 1.00 13.30 H new ATOM 0 HD22 LEU A 28 -8.533 -0.805 -0.122 1.00 13.30 H new ATOM 0 HD23 LEU A 28 -9.425 -0.136 -1.509 1.00 13.30 H new ATOM 445 N LYS A 29 -13.436 1.239 -0.479 1.00 21.41 N ATOM 446 CA LYS A 29 -14.033 2.347 -1.237 1.00 45.13 C ATOM 447 C LYS A 29 -15.311 2.876 -0.561 1.00 22.22 C ATOM 448 O LYS A 29 -15.785 3.972 -0.870 1.00 22.42 O ATOM 449 CB LYS A 29 -14.319 1.914 -2.684 1.00 1.34 C ATOM 450 CG LYS A 29 -15.222 0.689 -2.808 1.00 52.32 C ATOM 451 CD LYS A 29 -15.328 0.219 -4.258 1.00 73.14 C ATOM 452 CE LYS A 29 -16.162 -1.048 -4.385 1.00 53.22 C ATOM 453 NZ LYS A 29 -16.164 -1.576 -5.777 1.00 23.31 N ATOM 0 H LYS A 29 -13.444 0.342 -0.965 1.00 21.41 H new ATOM 0 HA LYS A 29 -13.313 3.165 -1.253 1.00 45.13 H new ATOM 0 HB2 LYS A 29 -14.781 2.746 -3.215 1.00 1.34 H new ATOM 0 HB3 LYS A 29 -13.372 1.704 -3.182 1.00 1.34 H new ATOM 0 HG2 LYS A 29 -14.829 -0.118 -2.190 1.00 52.32 H new ATOM 0 HG3 LYS A 29 -16.215 0.927 -2.428 1.00 52.32 H new ATOM 0 HD2 LYS A 29 -15.773 1.008 -4.864 1.00 73.14 H new ATOM 0 HD3 LYS A 29 -14.329 0.037 -4.655 1.00 73.14 H new ATOM 0 HE2 LYS A 29 -15.771 -1.809 -3.709 1.00 53.22 H new ATOM 0 HE3 LYS A 29 -17.186 -0.841 -4.074 1.00 53.22 H new ATOM 0 HZ1 LYS A 29 -16.743 -2.439 -5.820 1.00 23.31 H new ATOM 0 HZ2 LYS A 29 -16.560 -0.860 -6.419 1.00 23.31 H new ATOM 0 HZ3 LYS A 29 -15.190 -1.798 -6.065 1.00 23.31 H new ATOM 467 N SER A 30 -15.857 2.094 0.371 1.00 3.10 N ATOM 468 CA SER A 30 -17.036 2.506 1.148 1.00 51.21 C ATOM 469 C SER A 30 -16.660 3.454 2.301 1.00 34.24 C ATOM 470 O SER A 30 -17.370 4.422 2.579 1.00 52.43 O ATOM 471 CB SER A 30 -17.755 1.272 1.710 1.00 33.35 C ATOM 472 OG SER A 30 -18.840 1.634 2.550 1.00 1.32 O ATOM 0 H SER A 30 -15.503 1.168 0.610 1.00 3.10 H new ATOM 0 HA SER A 30 -17.700 3.045 0.473 1.00 51.21 H new ATOM 0 HB2 SER A 30 -18.121 0.658 0.887 1.00 33.35 H new ATOM 0 HB3 SER A 30 -17.047 0.663 2.272 1.00 33.35 H new ATOM 0 HG SER A 30 -19.276 0.824 2.889 1.00 1.32 H new ATOM 478 N ARG A 31 -15.539 3.175 2.972 1.00 43.12 N ATOM 479 CA ARG A 31 -15.097 3.984 4.121 1.00 45.32 C ATOM 480 C ARG A 31 -14.359 5.269 3.694 1.00 63.14 C ATOM 481 O ARG A 31 -14.187 6.187 4.499 1.00 30.33 O ATOM 482 CB ARG A 31 -14.189 3.153 5.045 1.00 21.40 C ATOM 483 CG ARG A 31 -12.946 2.602 4.354 1.00 4.21 C ATOM 484 CD ARG A 31 -12.011 1.893 5.328 1.00 43.20 C ATOM 485 NE ARG A 31 -11.361 2.826 6.250 1.00 45.43 N ATOM 486 CZ ARG A 31 -10.907 2.502 7.431 1.00 3.11 C ATOM 487 NH1 ARG A 31 -11.069 1.311 7.909 1.00 31.41 N ATOM 488 NH2 ARG A 31 -10.301 3.387 8.145 1.00 75.43 N ATOM 0 H ARG A 31 -14.919 2.398 2.743 1.00 43.12 H new ATOM 0 HA ARG A 31 -15.998 4.284 4.656 1.00 45.32 H new ATOM 0 HB2 ARG A 31 -13.881 3.772 5.888 1.00 21.40 H new ATOM 0 HB3 ARG A 31 -14.765 2.322 5.453 1.00 21.40 H new ATOM 0 HG2 ARG A 31 -13.246 1.907 3.570 1.00 4.21 H new ATOM 0 HG3 ARG A 31 -12.411 3.418 3.868 1.00 4.21 H new ATOM 0 HD2 ARG A 31 -12.575 1.155 5.898 1.00 43.20 H new ATOM 0 HD3 ARG A 31 -11.250 1.349 4.768 1.00 43.20 H new ATOM 0 HE ARG A 31 -11.255 3.795 5.950 1.00 45.43 H new ATOM 0 HH11 ARG A 31 -11.559 0.604 7.361 1.00 31.41 H new ATOM 0 HH12 ARG A 31 -10.706 1.079 8.834 1.00 31.41 H new ATOM 0 HH21 ARG A 31 -10.178 4.334 7.787 1.00 75.43 H new ATOM 0 HH22 ARG A 31 -9.944 3.140 9.068 1.00 75.43 H new ATOM 502 N VAL A 32 -13.915 5.332 2.440 1.00 55.40 N ATOM 503 CA VAL A 32 -13.164 6.499 1.949 1.00 52.22 C ATOM 504 C VAL A 32 -14.086 7.537 1.275 1.00 15.30 C ATOM 505 O VAL A 32 -15.028 7.175 0.566 1.00 23.45 O ATOM 506 CB VAL A 32 -12.054 6.077 0.949 1.00 30.23 C ATOM 507 CG1 VAL A 32 -11.158 5.008 1.564 1.00 54.24 C ATOM 508 CG2 VAL A 32 -12.646 5.593 -0.374 1.00 3.51 C ATOM 0 H VAL A 32 -14.058 4.598 1.746 1.00 55.40 H new ATOM 0 HA VAL A 32 -12.704 6.958 2.824 1.00 52.22 H new ATOM 0 HB VAL A 32 -11.447 6.957 0.735 1.00 30.23 H new ATOM 0 HG11 VAL A 32 -10.386 4.725 0.849 1.00 54.24 H new ATOM 0 HG12 VAL A 32 -10.690 5.401 2.467 1.00 54.24 H new ATOM 0 HG13 VAL A 32 -11.757 4.133 1.817 1.00 54.24 H new ATOM 0 HG21 VAL A 32 -11.840 5.306 -1.050 1.00 3.51 H new ATOM 0 HG22 VAL A 32 -13.290 4.733 -0.191 1.00 3.51 H new ATOM 0 HG23 VAL A 32 -13.230 6.394 -0.826 1.00 3.51 H new ATOM 518 N PRO A 33 -13.832 8.844 1.498 1.00 13.35 N ATOM 519 CA PRO A 33 -14.582 9.921 0.823 1.00 20.44 C ATOM 520 C PRO A 33 -14.442 9.858 -0.712 1.00 13.11 C ATOM 521 O PRO A 33 -13.409 9.437 -1.231 1.00 33.33 O ATOM 522 CB PRO A 33 -13.940 11.209 1.374 1.00 73.25 C ATOM 523 CG PRO A 33 -13.284 10.795 2.649 1.00 55.55 C ATOM 524 CD PRO A 33 -12.820 9.380 2.426 1.00 41.20 C ATOM 0 HA PRO A 33 -15.653 9.852 1.013 1.00 20.44 H new ATOM 0 HB2 PRO A 33 -13.215 11.621 0.672 1.00 73.25 H new ATOM 0 HB3 PRO A 33 -14.689 11.981 1.548 1.00 73.25 H new ATOM 0 HG2 PRO A 33 -12.446 11.449 2.889 1.00 55.55 H new ATOM 0 HG3 PRO A 33 -13.981 10.852 3.485 1.00 55.55 H new ATOM 0 HD2 PRO A 33 -11.819 9.346 1.996 1.00 41.20 H new ATOM 0 HD3 PRO A 33 -12.786 8.814 3.357 1.00 41.20 H new ATOM 532 N ALA A 34 -15.480 10.293 -1.429 1.00 32.11 N ATOM 533 CA ALA A 34 -15.489 10.244 -2.902 1.00 2.00 C ATOM 534 C ALA A 34 -14.283 10.979 -3.518 1.00 64.13 C ATOM 535 O ALA A 34 -13.793 10.609 -4.585 1.00 15.44 O ATOM 536 CB ALA A 34 -16.790 10.831 -3.437 1.00 1.55 C ATOM 0 H ALA A 34 -16.328 10.684 -1.018 1.00 32.11 H new ATOM 0 HA ALA A 34 -15.413 9.196 -3.193 1.00 2.00 H new ATOM 0 HB1 ALA A 34 -16.787 10.790 -4.526 1.00 1.55 H new ATOM 0 HB2 ALA A 34 -17.633 10.256 -3.055 1.00 1.55 H new ATOM 0 HB3 ALA A 34 -16.882 11.868 -3.113 1.00 1.55 H new ATOM 542 N ASN A 35 -13.813 12.024 -2.838 1.00 34.21 N ATOM 543 CA ASN A 35 -12.650 12.798 -3.296 1.00 0.53 C ATOM 544 C ASN A 35 -11.327 12.043 -3.079 1.00 63.11 C ATOM 545 O ASN A 35 -10.360 12.233 -3.824 1.00 3.31 O ATOM 546 CB ASN A 35 -12.607 14.144 -2.565 1.00 2.31 C ATOM 547 CG ASN A 35 -13.767 15.041 -2.949 1.00 41.44 C ATOM 548 OD1 ASN A 35 -14.240 15.015 -4.082 1.00 52.33 O ATOM 549 ND2 ASN A 35 -14.238 15.840 -2.017 1.00 63.41 N ATOM 0 H ASN A 35 -14.219 12.358 -1.964 1.00 34.21 H new ATOM 0 HA ASN A 35 -12.762 12.958 -4.368 1.00 0.53 H new ATOM 0 HB2 ASN A 35 -12.624 13.972 -1.489 1.00 2.31 H new ATOM 0 HB3 ASN A 35 -11.668 14.649 -2.792 1.00 2.31 H new ATOM 0 HD21 ASN A 35 -15.019 16.462 -2.226 1.00 63.41 H new ATOM 0 HD22 ASN A 35 -13.823 15.837 -1.085 1.00 63.41 H new ATOM 556 N THR A 36 -11.290 11.186 -2.065 1.00 0.43 N ATOM 557 CA THR A 36 -10.077 10.434 -1.723 1.00 63.14 C ATOM 558 C THR A 36 -10.010 9.106 -2.487 1.00 1.52 C ATOM 559 O THR A 36 -10.643 8.122 -2.101 1.00 13.20 O ATOM 560 CB THR A 36 -9.994 10.151 -0.200 1.00 45.11 C ATOM 561 OG1 THR A 36 -10.068 11.383 0.532 1.00 4.50 O ATOM 562 CG2 THR A 36 -8.701 9.423 0.161 1.00 61.20 C ATOM 0 H THR A 36 -12.087 10.991 -1.460 1.00 0.43 H new ATOM 0 HA THR A 36 -9.231 11.056 -2.014 1.00 63.14 H new ATOM 0 HB THR A 36 -10.835 9.511 0.067 1.00 45.11 H new ATOM 0 HG1 THR A 36 -10.017 11.196 1.493 1.00 4.50 H new ATOM 0 HG21 THR A 36 -8.674 9.240 1.235 1.00 61.20 H new ATOM 0 HG22 THR A 36 -8.658 8.472 -0.370 1.00 61.20 H new ATOM 0 HG23 THR A 36 -7.846 10.037 -0.124 1.00 61.20 H new ATOM 570 N SER A 37 -9.250 9.086 -3.583 1.00 60.23 N ATOM 571 CA SER A 37 -9.082 7.870 -4.392 1.00 4.24 C ATOM 572 C SER A 37 -8.412 6.746 -3.585 1.00 64.54 C ATOM 573 O SER A 37 -7.604 7.007 -2.690 1.00 21.42 O ATOM 574 CB SER A 37 -8.252 8.169 -5.651 1.00 51.45 C ATOM 575 OG SER A 37 -8.905 9.110 -6.492 1.00 15.34 O ATOM 0 H SER A 37 -8.740 9.896 -3.934 1.00 60.23 H new ATOM 0 HA SER A 37 -10.076 7.535 -4.688 1.00 4.24 H new ATOM 0 HB2 SER A 37 -7.275 8.555 -5.361 1.00 51.45 H new ATOM 0 HB3 SER A 37 -8.079 7.245 -6.202 1.00 51.45 H new ATOM 0 HG SER A 37 -8.352 9.281 -7.283 1.00 15.34 H new ATOM 581 N MET A 38 -8.736 5.495 -3.922 1.00 12.44 N ATOM 582 CA MET A 38 -8.201 4.326 -3.203 1.00 25.13 C ATOM 583 C MET A 38 -6.668 4.368 -3.119 1.00 2.13 C ATOM 584 O MET A 38 -6.093 4.132 -2.058 1.00 51.44 O ATOM 585 CB MET A 38 -8.651 3.025 -3.881 1.00 25.04 C ATOM 586 CG MET A 38 -10.163 2.829 -3.898 1.00 23.23 C ATOM 587 SD MET A 38 -10.654 1.262 -4.647 1.00 11.43 S ATOM 588 CE MET A 38 -9.944 1.417 -6.286 1.00 70.45 C ATOM 0 H MET A 38 -9.367 5.261 -4.689 1.00 12.44 H new ATOM 0 HA MET A 38 -8.597 4.357 -2.188 1.00 25.13 H new ATOM 0 HB2 MET A 38 -8.281 3.014 -4.906 1.00 25.04 H new ATOM 0 HB3 MET A 38 -8.191 2.181 -3.367 1.00 25.04 H new ATOM 0 HG2 MET A 38 -10.543 2.874 -2.877 1.00 23.23 H new ATOM 0 HG3 MET A 38 -10.625 3.650 -4.446 1.00 23.23 H new ATOM 0 HE1 MET A 38 -10.430 0.712 -6.961 1.00 70.45 H new ATOM 0 HE2 MET A 38 -10.093 2.433 -6.653 1.00 70.45 H new ATOM 0 HE3 MET A 38 -8.877 1.200 -6.242 1.00 70.45 H new ATOM 598 N SER A 39 -6.016 4.678 -4.241 1.00 74.43 N ATOM 599 CA SER A 39 -4.549 4.810 -4.282 1.00 63.40 C ATOM 600 C SER A 39 -4.049 5.829 -3.249 1.00 53.33 C ATOM 601 O SER A 39 -3.057 5.597 -2.557 1.00 10.13 O ATOM 602 CB SER A 39 -4.086 5.237 -5.683 1.00 10.13 C ATOM 603 OG SER A 39 -2.686 5.475 -5.716 1.00 30.24 O ATOM 0 H SER A 39 -6.476 4.843 -5.136 1.00 74.43 H new ATOM 0 HA SER A 39 -4.127 3.834 -4.040 1.00 63.40 H new ATOM 0 HB2 SER A 39 -4.342 4.461 -6.405 1.00 10.13 H new ATOM 0 HB3 SER A 39 -4.617 6.140 -5.984 1.00 10.13 H new ATOM 0 HG SER A 39 -2.421 5.743 -6.621 1.00 30.24 H new ATOM 609 N ALA A 40 -4.752 6.954 -3.139 1.00 20.32 N ATOM 610 CA ALA A 40 -4.385 8.014 -2.195 1.00 24.40 C ATOM 611 C ALA A 40 -4.627 7.585 -0.739 1.00 34.30 C ATOM 612 O ALA A 40 -3.848 7.920 0.156 1.00 11.35 O ATOM 613 CB ALA A 40 -5.155 9.290 -2.518 1.00 55.30 C ATOM 0 H ALA A 40 -5.583 7.158 -3.694 1.00 20.32 H new ATOM 0 HA ALA A 40 -3.318 8.207 -2.302 1.00 24.40 H new ATOM 0 HB1 ALA A 40 -4.876 10.072 -1.812 1.00 55.30 H new ATOM 0 HB2 ALA A 40 -4.915 9.613 -3.531 1.00 55.30 H new ATOM 0 HB3 ALA A 40 -6.225 9.098 -2.443 1.00 55.30 H new ATOM 619 N TYR A 41 -5.704 6.837 -0.506 1.00 11.44 N ATOM 620 CA TYR A 41 -6.028 6.360 0.840 1.00 40.22 C ATOM 621 C TYR A 41 -5.032 5.283 1.295 1.00 34.34 C ATOM 622 O TYR A 41 -4.505 5.339 2.405 1.00 14.14 O ATOM 623 CB TYR A 41 -7.460 5.818 0.897 1.00 2.41 C ATOM 624 CG TYR A 41 -7.945 5.560 2.315 1.00 33.15 C ATOM 625 CD1 TYR A 41 -8.399 6.609 3.110 1.00 12.33 C ATOM 626 CD2 TYR A 41 -7.943 4.277 2.861 1.00 13.23 C ATOM 627 CE1 TYR A 41 -8.837 6.388 4.401 1.00 14.13 C ATOM 628 CE2 TYR A 41 -8.381 4.054 4.153 1.00 44.32 C ATOM 629 CZ TYR A 41 -8.825 5.111 4.918 1.00 30.35 C ATOM 630 OH TYR A 41 -9.264 4.891 6.206 1.00 34.55 O ATOM 0 H TYR A 41 -6.365 6.548 -1.227 1.00 11.44 H new ATOM 0 HA TYR A 41 -5.953 7.208 1.521 1.00 40.22 H new ATOM 0 HB2 TYR A 41 -8.130 6.529 0.414 1.00 2.41 H new ATOM 0 HB3 TYR A 41 -7.514 4.891 0.327 1.00 2.41 H new ATOM 0 HD1 TYR A 41 -8.409 7.612 2.710 1.00 12.33 H new ATOM 0 HD2 TYR A 41 -7.594 3.446 2.266 1.00 13.23 H new ATOM 0 HE1 TYR A 41 -9.188 7.213 5.003 1.00 14.13 H new ATOM 0 HE2 TYR A 41 -8.375 3.054 4.562 1.00 44.32 H new ATOM 0 HH TYR A 41 -9.546 5.741 6.605 1.00 34.55 H new ATOM 640 N ILE A 42 -4.773 4.303 0.432 1.00 31.15 N ATOM 641 CA ILE A 42 -3.760 3.284 0.716 1.00 72.31 C ATOM 642 C ILE A 42 -2.379 3.935 0.870 1.00 72.55 C ATOM 643 O ILE A 42 -1.561 3.503 1.685 1.00 5.50 O ATOM 644 CB ILE A 42 -3.709 2.194 -0.391 1.00 22.31 C ATOM 645 CG1 ILE A 42 -5.075 1.498 -0.527 1.00 5.42 C ATOM 646 CG2 ILE A 42 -2.611 1.168 -0.095 1.00 20.34 C ATOM 647 CD1 ILE A 42 -5.527 0.780 0.730 1.00 23.43 C ATOM 0 H ILE A 42 -5.246 4.191 -0.465 1.00 31.15 H new ATOM 0 HA ILE A 42 -4.040 2.798 1.651 1.00 72.31 H new ATOM 0 HB ILE A 42 -3.473 2.681 -1.337 1.00 22.31 H new ATOM 0 HG12 ILE A 42 -5.825 2.241 -0.799 1.00 5.42 H new ATOM 0 HG13 ILE A 42 -5.026 0.780 -1.346 1.00 5.42 H new ATOM 0 HG21 ILE A 42 -2.594 0.415 -0.883 1.00 20.34 H new ATOM 0 HG22 ILE A 42 -1.645 1.671 -0.053 1.00 20.34 H new ATOM 0 HG23 ILE A 42 -2.811 0.687 0.862 1.00 20.34 H new ATOM 0 HD11 ILE A 42 -6.497 0.315 0.555 1.00 23.43 H new ATOM 0 HD12 ILE A 42 -4.799 0.012 0.992 1.00 23.43 H new ATOM 0 HD13 ILE A 42 -5.610 1.496 1.548 1.00 23.43 H new ATOM 659 N ARG A 43 -2.134 4.995 0.095 1.00 3.55 N ATOM 660 CA ARG A 43 -0.887 5.757 0.205 1.00 41.53 C ATOM 661 C ARG A 43 -0.706 6.330 1.617 1.00 64.21 C ATOM 662 O ARG A 43 0.326 6.119 2.234 1.00 45.11 O ATOM 663 CB ARG A 43 -0.831 6.887 -0.839 1.00 52.10 C ATOM 664 CG ARG A 43 0.479 7.679 -0.815 1.00 40.44 C ATOM 665 CD ARG A 43 0.629 8.593 -2.032 1.00 43.40 C ATOM 666 NE ARG A 43 -0.354 9.676 -2.057 1.00 12.34 N ATOM 667 CZ ARG A 43 -0.705 10.323 -3.138 1.00 24.21 C ATOM 668 NH1 ARG A 43 -0.231 9.979 -4.297 1.00 41.11 N ATOM 669 NH2 ARG A 43 -1.536 11.310 -3.056 1.00 14.34 N ATOM 0 H ARG A 43 -2.780 5.344 -0.613 1.00 3.55 H new ATOM 0 HA ARG A 43 -0.067 5.066 0.009 1.00 41.53 H new ATOM 0 HB2 ARG A 43 -0.970 6.460 -1.832 1.00 52.10 H new ATOM 0 HB3 ARG A 43 -1.662 7.571 -0.667 1.00 52.10 H new ATOM 0 HG2 ARG A 43 0.521 8.279 0.094 1.00 40.44 H new ATOM 0 HG3 ARG A 43 1.319 6.986 -0.779 1.00 40.44 H new ATOM 0 HD2 ARG A 43 1.632 9.020 -2.038 1.00 43.40 H new ATOM 0 HD3 ARG A 43 0.530 7.999 -2.940 1.00 43.40 H new ATOM 0 HE ARG A 43 -0.793 9.943 -1.176 1.00 12.34 H new ATOM 0 HH11 ARG A 43 0.421 9.198 -4.370 1.00 41.11 H new ATOM 0 HH12 ARG A 43 -0.511 10.490 -5.134 1.00 41.11 H new ATOM 0 HH21 ARG A 43 -1.916 11.583 -2.150 1.00 14.34 H new ATOM 0 HH22 ARG A 43 -1.811 11.816 -3.898 1.00 14.34 H new ATOM 683 N ARG A 44 -1.711 7.046 2.131 1.00 25.41 N ATOM 684 CA ARG A 44 -1.630 7.614 3.490 1.00 10.22 C ATOM 685 C ARG A 44 -1.599 6.514 4.573 1.00 23.43 C ATOM 686 O ARG A 44 -1.189 6.763 5.705 1.00 33.11 O ATOM 687 CB ARG A 44 -2.786 8.598 3.756 1.00 51.33 C ATOM 688 CG ARG A 44 -4.173 8.012 3.526 1.00 71.23 C ATOM 689 CD ARG A 44 -5.289 8.989 3.897 1.00 11.15 C ATOM 690 NE ARG A 44 -5.396 9.187 5.343 1.00 4.33 N ATOM 691 CZ ARG A 44 -6.532 9.266 5.995 1.00 31.30 C ATOM 692 NH1 ARG A 44 -7.661 9.239 5.359 1.00 13.21 N ATOM 693 NH2 ARG A 44 -6.534 9.390 7.282 1.00 4.13 N ATOM 0 H ARG A 44 -2.581 7.247 1.638 1.00 25.41 H new ATOM 0 HA ARG A 44 -0.690 8.164 3.547 1.00 10.22 H new ATOM 0 HB2 ARG A 44 -2.719 8.949 4.786 1.00 51.33 H new ATOM 0 HB3 ARG A 44 -2.661 9.469 3.113 1.00 51.33 H new ATOM 0 HG2 ARG A 44 -4.275 7.729 2.478 1.00 71.23 H new ATOM 0 HG3 ARG A 44 -4.281 7.101 4.114 1.00 71.23 H new ATOM 0 HD2 ARG A 44 -5.104 9.948 3.414 1.00 11.15 H new ATOM 0 HD3 ARG A 44 -6.238 8.616 3.512 1.00 11.15 H new ATOM 0 HE ARG A 44 -4.532 9.269 5.879 1.00 4.33 H new ATOM 0 HH11 ARG A 44 -7.672 9.156 4.342 1.00 13.21 H new ATOM 0 HH12 ARG A 44 -8.539 9.301 5.875 1.00 13.21 H new ATOM 0 HH21 ARG A 44 -5.652 9.427 7.792 1.00 4.13 H new ATOM 0 HH22 ARG A 44 -7.418 9.451 7.787 1.00 4.13 H new ATOM 707 N ILE A 45 -2.040 5.303 4.224 1.00 41.44 N ATOM 708 CA ILE A 45 -1.932 4.151 5.134 1.00 73.04 C ATOM 709 C ILE A 45 -0.472 3.689 5.272 1.00 13.54 C ATOM 710 O ILE A 45 0.073 3.632 6.376 1.00 22.40 O ATOM 711 CB ILE A 45 -2.801 2.956 4.656 1.00 75.23 C ATOM 712 CG1 ILE A 45 -4.295 3.304 4.748 1.00 75.35 C ATOM 713 CG2 ILE A 45 -2.488 1.692 5.463 1.00 54.34 C ATOM 714 CD1 ILE A 45 -5.213 2.194 4.276 1.00 2.23 C ATOM 0 H ILE A 45 -2.473 5.091 3.325 1.00 41.44 H new ATOM 0 HA ILE A 45 -2.299 4.485 6.104 1.00 73.04 H new ATOM 0 HB ILE A 45 -2.558 2.757 3.612 1.00 75.23 H new ATOM 0 HG12 ILE A 45 -4.538 3.549 5.782 1.00 75.35 H new ATOM 0 HG13 ILE A 45 -4.487 4.198 4.155 1.00 75.35 H new ATOM 0 HG21 ILE A 45 -3.110 0.870 5.108 1.00 54.34 H new ATOM 0 HG22 ILE A 45 -1.437 1.432 5.338 1.00 54.34 H new ATOM 0 HG23 ILE A 45 -2.694 1.874 6.518 1.00 54.34 H new ATOM 0 HD11 ILE A 45 -6.250 2.515 4.371 1.00 2.23 H new ATOM 0 HD12 ILE A 45 -4.999 1.964 3.232 1.00 2.23 H new ATOM 0 HD13 ILE A 45 -5.051 1.304 4.884 1.00 2.23 H new ATOM 726 N ILE A 46 0.151 3.350 4.146 1.00 62.34 N ATOM 727 CA ILE A 46 1.546 2.897 4.146 1.00 44.51 C ATOM 728 C ILE A 46 2.520 4.045 4.467 1.00 31.40 C ATOM 729 O ILE A 46 3.519 3.841 5.147 1.00 21.21 O ATOM 730 CB ILE A 46 1.937 2.241 2.795 1.00 70.15 C ATOM 731 CG1 ILE A 46 1.711 3.213 1.624 1.00 73.00 C ATOM 732 CG2 ILE A 46 1.148 0.951 2.588 1.00 21.33 C ATOM 733 CD1 ILE A 46 2.015 2.620 0.262 1.00 74.22 C ATOM 0 H ILE A 46 -0.283 3.379 3.223 1.00 62.34 H new ATOM 0 HA ILE A 46 1.625 2.146 4.932 1.00 44.51 H new ATOM 0 HB ILE A 46 2.999 1.998 2.825 1.00 70.15 H new ATOM 0 HG12 ILE A 46 0.674 3.549 1.639 1.00 73.00 H new ATOM 0 HG13 ILE A 46 2.334 4.095 1.772 1.00 73.00 H new ATOM 0 HG21 ILE A 46 1.431 0.500 1.637 1.00 21.33 H new ATOM 0 HG22 ILE A 46 1.368 0.256 3.399 1.00 21.33 H new ATOM 0 HG23 ILE A 46 0.081 1.174 2.580 1.00 21.33 H new ATOM 0 HD11 ILE A 46 1.831 3.368 -0.510 1.00 74.22 H new ATOM 0 HD12 ILE A 46 3.059 2.310 0.225 1.00 74.22 H new ATOM 0 HD13 ILE A 46 1.374 1.756 0.090 1.00 74.22 H new ATOM 745 N LEU A 47 2.196 5.249 3.994 1.00 14.43 N ATOM 746 CA LEU A 47 3.024 6.450 4.211 1.00 71.24 C ATOM 747 C LEU A 47 3.282 6.698 5.705 1.00 4.02 C ATOM 748 O LEU A 47 4.415 6.626 6.181 1.00 61.31 O ATOM 749 CB LEU A 47 2.316 7.672 3.607 1.00 3.41 C ATOM 750 CG LEU A 47 3.086 8.995 3.680 1.00 11.43 C ATOM 751 CD1 LEU A 47 4.319 8.950 2.790 1.00 60.02 C ATOM 752 CD2 LEU A 47 2.185 10.167 3.296 1.00 64.22 C ATOM 0 H LEU A 47 1.353 5.426 3.448 1.00 14.43 H new ATOM 0 HA LEU A 47 3.986 6.289 3.724 1.00 71.24 H new ATOM 0 HB2 LEU A 47 2.095 7.460 2.561 1.00 3.41 H new ATOM 0 HB3 LEU A 47 1.360 7.802 4.115 1.00 3.41 H new ATOM 0 HG LEU A 47 3.414 9.141 4.709 1.00 11.43 H new ATOM 0 HD11 LEU A 47 4.851 9.899 2.857 1.00 60.02 H new ATOM 0 HD12 LEU A 47 4.975 8.143 3.117 1.00 60.02 H new ATOM 0 HD13 LEU A 47 4.016 8.776 1.757 1.00 60.02 H new ATOM 0 HD21 LEU A 47 2.752 11.096 3.355 1.00 64.22 H new ATOM 0 HD22 LEU A 47 1.821 10.028 2.278 1.00 64.22 H new ATOM 0 HD23 LEU A 47 1.338 10.215 3.981 1.00 64.22 H new ATOM 764 N ASN A 48 2.202 6.958 6.443 1.00 41.12 N ATOM 765 CA ASN A 48 2.283 7.241 7.883 1.00 31.22 C ATOM 766 C ASN A 48 2.832 6.039 8.678 1.00 13.45 C ATOM 767 O ASN A 48 3.067 6.135 9.885 1.00 61.55 O ATOM 768 CB ASN A 48 0.895 7.629 8.415 1.00 23.51 C ATOM 769 CG ASN A 48 0.294 8.819 7.682 1.00 43.12 C ATOM 770 OD1 ASN A 48 0.538 9.036 6.499 1.00 1.21 O ATOM 771 ND2 ASN A 48 -0.503 9.598 8.379 1.00 11.10 N ATOM 0 H ASN A 48 1.254 6.979 6.068 1.00 41.12 H new ATOM 0 HA ASN A 48 2.977 8.070 8.019 1.00 31.22 H new ATOM 0 HB2 ASN A 48 0.224 6.775 8.323 1.00 23.51 H new ATOM 0 HB3 ASN A 48 0.970 7.863 9.477 1.00 23.51 H new ATOM 0 HD21 ASN A 48 -0.938 10.409 7.938 1.00 11.10 H new ATOM 0 HD22 ASN A 48 -0.687 9.392 9.361 1.00 11.10 H new ATOM 778 N HIS A 49 3.018 4.907 7.999 1.00 13.01 N ATOM 779 CA HIS A 49 3.564 3.697 8.625 1.00 63.12 C ATOM 780 C HIS A 49 4.999 3.415 8.136 1.00 53.11 C ATOM 781 O HIS A 49 5.779 2.752 8.818 1.00 24.42 O ATOM 782 CB HIS A 49 2.647 2.503 8.313 1.00 71.43 C ATOM 783 CG HIS A 49 2.962 1.256 9.090 1.00 13.10 C ATOM 784 ND1 HIS A 49 2.383 0.964 10.302 1.00 0.22 N ATOM 785 CD2 HIS A 49 3.789 0.218 8.816 1.00 4.11 C ATOM 786 CE1 HIS A 49 2.830 -0.195 10.737 1.00 45.53 C ATOM 787 NE2 HIS A 49 3.684 -0.671 9.856 1.00 61.31 N ATOM 0 H HIS A 49 2.798 4.800 7.009 1.00 13.01 H new ATOM 0 HA HIS A 49 3.607 3.851 9.703 1.00 63.12 H new ATOM 0 HB2 HIS A 49 1.615 2.791 8.515 1.00 71.43 H new ATOM 0 HB3 HIS A 49 2.713 2.279 7.248 1.00 71.43 H new ATOM 0 HD2 HIS A 49 4.414 0.110 7.942 1.00 4.11 H new ATOM 0 HE1 HIS A 49 2.544 -0.675 11.661 1.00 45.53 H new ATOM 0 HE2 HIS A 49 4.186 -1.556 9.934 1.00 61.31 H new ATOM 796 N LEU A 50 5.344 3.930 6.956 1.00 33.34 N ATOM 797 CA LEU A 50 6.652 3.671 6.338 1.00 35.40 C ATOM 798 C LEU A 50 7.737 4.594 6.904 1.00 33.31 C ATOM 799 O LEU A 50 8.719 4.123 7.485 1.00 61.13 O ATOM 800 CB LEU A 50 6.563 3.814 4.806 1.00 35.20 C ATOM 801 CG LEU A 50 6.860 2.534 4.014 1.00 51.51 C ATOM 802 CD1 LEU A 50 8.288 2.063 4.273 1.00 13.04 C ATOM 803 CD2 LEU A 50 5.851 1.439 4.358 1.00 75.13 C ATOM 0 H LEU A 50 4.734 4.533 6.403 1.00 33.34 H new ATOM 0 HA LEU A 50 6.934 2.646 6.578 1.00 35.40 H new ATOM 0 HB2 LEU A 50 5.562 4.159 4.547 1.00 35.20 H new ATOM 0 HB3 LEU A 50 7.260 4.589 4.488 1.00 35.20 H new ATOM 0 HG LEU A 50 6.764 2.757 2.951 1.00 51.51 H new ATOM 0 HD11 LEU A 50 8.480 1.154 3.703 1.00 13.04 H new ATOM 0 HD12 LEU A 50 8.989 2.839 3.966 1.00 13.04 H new ATOM 0 HD13 LEU A 50 8.417 1.859 5.336 1.00 13.04 H new ATOM 0 HD21 LEU A 50 6.080 0.540 3.785 1.00 75.13 H new ATOM 0 HD22 LEU A 50 5.907 1.215 5.423 1.00 75.13 H new ATOM 0 HD23 LEU A 50 4.846 1.780 4.111 1.00 75.13 H new ATOM 815 N GLU A 51 7.569 5.906 6.730 1.00 12.33 N ATOM 816 CA GLU A 51 8.481 6.880 7.346 1.00 62.13 C ATOM 817 C GLU A 51 8.472 6.736 8.879 1.00 64.34 C ATOM 818 O GLU A 51 9.421 7.124 9.565 1.00 71.11 O ATOM 819 CB GLU A 51 8.112 8.312 6.933 1.00 65.40 C ATOM 820 CG GLU A 51 6.731 8.769 7.396 1.00 22.13 C ATOM 821 CD GLU A 51 6.436 10.209 7.000 1.00 2.24 C ATOM 822 OE1 GLU A 51 6.985 11.132 7.643 1.00 2.32 O ATOM 823 OE2 GLU A 51 5.665 10.433 6.044 1.00 13.14 O ATOM 0 H GLU A 51 6.820 6.319 6.175 1.00 12.33 H new ATOM 0 HA GLU A 51 9.490 6.675 6.988 1.00 62.13 H new ATOM 0 HB2 GLU A 51 8.860 8.996 7.333 1.00 65.40 H new ATOM 0 HB3 GLU A 51 8.160 8.387 5.847 1.00 65.40 H new ATOM 0 HG2 GLU A 51 5.972 8.114 6.968 1.00 22.13 H new ATOM 0 HG3 GLU A 51 6.663 8.671 8.479 1.00 22.13 H new ATOM 830 N ASP A 52 7.384 6.170 9.402 1.00 3.35 N ATOM 831 CA ASP A 52 7.282 5.810 10.819 1.00 20.24 C ATOM 832 C ASP A 52 8.222 4.637 11.161 1.00 32.34 C ATOM 833 O ASP A 52 9.095 4.756 12.023 1.00 50.12 O ATOM 834 CB ASP A 52 5.820 5.466 11.149 1.00 32.31 C ATOM 835 CG ASP A 52 5.632 4.849 12.525 1.00 62.24 C ATOM 836 OD1 ASP A 52 6.117 5.432 13.513 1.00 44.35 O ATOM 837 OD2 ASP A 52 4.984 3.788 12.623 1.00 70.33 O ATOM 0 H ASP A 52 6.550 5.948 8.858 1.00 3.35 H new ATOM 0 HA ASP A 52 7.594 6.659 11.428 1.00 20.24 H new ATOM 0 HB2 ASP A 52 5.219 6.373 11.082 1.00 32.31 H new ATOM 0 HB3 ASP A 52 5.440 4.775 10.396 1.00 32.31 H new ATOM 842 N GLU A 53 8.050 3.507 10.474 1.00 54.42 N ATOM 843 CA GLU A 53 8.904 2.331 10.695 1.00 21.20 C ATOM 844 C GLU A 53 9.903 2.132 9.549 1.00 41.14 C ATOM 845 O GLU A 53 10.419 1.027 9.338 1.00 3.33 O ATOM 846 CB GLU A 53 8.052 1.066 10.861 1.00 64.40 C ATOM 847 CG GLU A 53 7.025 1.142 11.985 1.00 64.12 C ATOM 848 CD GLU A 53 6.399 -0.209 12.294 1.00 30.42 C ATOM 849 OE1 GLU A 53 5.896 -0.866 11.358 1.00 60.54 O ATOM 850 OE2 GLU A 53 6.429 -0.631 13.469 1.00 11.24 O ATOM 0 H GLU A 53 7.331 3.378 9.762 1.00 54.42 H new ATOM 0 HA GLU A 53 9.467 2.510 11.611 1.00 21.20 H new ATOM 0 HB2 GLU A 53 7.533 0.867 9.924 1.00 64.40 H new ATOM 0 HB3 GLU A 53 8.713 0.219 11.046 1.00 64.40 H new ATOM 0 HG2 GLU A 53 7.503 1.531 12.884 1.00 64.12 H new ATOM 0 HG3 GLU A 53 6.241 1.848 11.710 1.00 64.12 H new TER 857 GLU A 53 ATOM 858 N MET B 201 -18.331 -13.888 7.857 1.00 53.05 N ATOM 859 CA MET B 201 -18.124 -14.716 6.671 1.00 73.34 C ATOM 860 C MET B 201 -16.816 -15.519 6.782 1.00 52.14 C ATOM 861 O MET B 201 -15.788 -14.998 7.217 1.00 54.52 O ATOM 862 CB MET B 201 -18.138 -13.861 5.393 1.00 52.55 C ATOM 863 CG MET B 201 -17.122 -12.724 5.371 1.00 12.32 C ATOM 864 SD MET B 201 -17.408 -11.501 6.668 1.00 11.32 S ATOM 865 CE MET B 201 -16.263 -10.214 6.176 1.00 5.55 C ATOM 0 HA MET B 201 -18.949 -15.425 6.609 1.00 73.34 H new ATOM 0 HB2 MET B 201 -17.954 -14.510 4.537 1.00 52.55 H new ATOM 0 HB3 MET B 201 -19.135 -13.440 5.265 1.00 52.55 H new ATOM 0 HG2 MET B 201 -16.120 -13.137 5.483 1.00 12.32 H new ATOM 0 HG3 MET B 201 -17.157 -12.231 4.400 1.00 12.32 H new ATOM 0 HE1 MET B 201 -16.322 -9.385 6.882 1.00 5.55 H new ATOM 0 HE2 MET B 201 -15.249 -10.613 6.169 1.00 5.55 H new ATOM 0 HE3 MET B 201 -16.521 -9.860 5.178 1.00 5.55 H new ATOM 875 N VAL B 202 -16.860 -16.788 6.370 1.00 43.43 N ATOM 876 CA VAL B 202 -15.723 -17.717 6.532 1.00 24.21 C ATOM 877 C VAL B 202 -14.488 -17.345 5.680 1.00 74.03 C ATOM 878 O VAL B 202 -13.508 -18.094 5.650 1.00 3.21 O ATOM 879 CB VAL B 202 -16.145 -19.171 6.196 1.00 30.35 C ATOM 880 CG1 VAL B 202 -17.266 -19.640 7.124 1.00 70.22 C ATOM 881 CG2 VAL B 202 -16.562 -19.290 4.728 1.00 52.24 C ATOM 0 H VAL B 202 -17.674 -17.204 5.918 1.00 43.43 H new ATOM 0 HA VAL B 202 -15.433 -17.636 7.580 1.00 24.21 H new ATOM 0 HB VAL B 202 -15.284 -19.820 6.355 1.00 30.35 H new ATOM 0 HG11 VAL B 202 -17.545 -20.662 6.869 1.00 70.22 H new ATOM 0 HG12 VAL B 202 -16.921 -19.605 8.158 1.00 70.22 H new ATOM 0 HG13 VAL B 202 -18.132 -18.988 7.008 1.00 70.22 H new ATOM 0 HG21 VAL B 202 -16.854 -20.318 4.515 1.00 52.24 H new ATOM 0 HG22 VAL B 202 -17.404 -18.626 4.534 1.00 52.24 H new ATOM 0 HG23 VAL B 202 -15.725 -19.010 4.088 1.00 52.24 H new ATOM 891 N GLY B 203 -14.542 -16.201 4.991 1.00 51.01 N ATOM 892 CA GLY B 203 -13.407 -15.731 4.197 1.00 51.13 C ATOM 893 C GLY B 203 -12.892 -16.760 3.193 1.00 55.34 C ATOM 894 O GLY B 203 -11.701 -17.066 3.162 1.00 3.31 O ATOM 0 H GLY B 203 -15.356 -15.587 4.968 1.00 51.01 H new ATOM 0 HA2 GLY B 203 -13.699 -14.828 3.661 1.00 51.13 H new ATOM 0 HA3 GLY B 203 -12.595 -15.454 4.869 1.00 51.13 H new ATOM 898 N ARG B 204 -13.789 -17.292 2.369 1.00 11.21 N ATOM 899 CA ARG B 204 -13.425 -18.326 1.391 1.00 71.15 C ATOM 900 C ARG B 204 -12.540 -17.759 0.259 1.00 52.41 C ATOM 901 O ARG B 204 -12.701 -16.611 -0.156 1.00 54.13 O ATOM 902 CB ARG B 204 -14.702 -18.994 0.840 1.00 63.13 C ATOM 903 CG ARG B 204 -15.761 -18.023 0.310 1.00 63.42 C ATOM 904 CD ARG B 204 -15.500 -17.602 -1.132 1.00 2.41 C ATOM 905 NE ARG B 204 -15.509 -18.746 -2.043 1.00 62.24 N ATOM 906 CZ ARG B 204 -15.523 -18.650 -3.340 1.00 11.50 C ATOM 907 NH1 ARG B 204 -15.541 -17.495 -3.919 1.00 23.32 N ATOM 908 NH2 ARG B 204 -15.537 -19.722 -4.058 1.00 30.32 N ATOM 0 H ARG B 204 -14.774 -17.028 2.355 1.00 11.21 H new ATOM 0 HA ARG B 204 -12.827 -19.085 1.896 1.00 71.15 H new ATOM 0 HB2 ARG B 204 -14.420 -19.675 0.037 1.00 63.13 H new ATOM 0 HB3 ARG B 204 -15.148 -19.599 1.630 1.00 63.13 H new ATOM 0 HG2 ARG B 204 -16.743 -18.491 0.376 1.00 63.42 H new ATOM 0 HG3 ARG B 204 -15.787 -17.137 0.944 1.00 63.42 H new ATOM 0 HD2 ARG B 204 -16.258 -16.884 -1.444 1.00 2.41 H new ATOM 0 HD3 ARG B 204 -14.537 -17.096 -1.194 1.00 2.41 H new ATOM 0 HE ARG B 204 -15.504 -19.681 -1.634 1.00 62.24 H new ATOM 0 HH11 ARG B 204 -15.544 -16.643 -3.358 1.00 23.32 H new ATOM 0 HH12 ARG B 204 -15.552 -17.435 -4.937 1.00 23.32 H new ATOM 0 HH21 ARG B 204 -15.537 -20.637 -3.608 1.00 30.32 H new ATOM 0 HH22 ARG B 204 -15.548 -19.654 -5.076 1.00 30.32 H new ATOM 922 N ARG B 205 -11.600 -18.572 -0.231 1.00 4.43 N ATOM 923 CA ARG B 205 -10.627 -18.116 -1.238 1.00 63.32 C ATOM 924 C ARG B 205 -11.035 -18.545 -2.660 1.00 1.42 C ATOM 925 O ARG B 205 -11.180 -19.738 -2.939 1.00 51.25 O ATOM 926 CB ARG B 205 -9.218 -18.657 -0.923 1.00 51.32 C ATOM 927 CG ARG B 205 -8.618 -18.166 0.400 1.00 10.04 C ATOM 928 CD ARG B 205 -9.284 -18.805 1.616 1.00 41.24 C ATOM 929 NE ARG B 205 -8.703 -18.336 2.870 1.00 72.52 N ATOM 930 CZ ARG B 205 -9.126 -18.689 4.054 1.00 25.21 C ATOM 931 NH1 ARG B 205 -10.137 -19.485 4.191 1.00 74.20 N ATOM 932 NH2 ARG B 205 -8.542 -18.234 5.107 1.00 61.52 N ATOM 0 H ARG B 205 -11.489 -19.546 0.049 1.00 4.43 H new ATOM 0 HA ARG B 205 -10.613 -17.027 -1.197 1.00 63.32 H new ATOM 0 HB2 ARG B 205 -9.259 -19.746 -0.904 1.00 51.32 H new ATOM 0 HB3 ARG B 205 -8.547 -18.377 -1.735 1.00 51.32 H new ATOM 0 HG2 ARG B 205 -7.551 -18.388 0.416 1.00 10.04 H new ATOM 0 HG3 ARG B 205 -8.720 -17.082 0.461 1.00 10.04 H new ATOM 0 HD2 ARG B 205 -10.350 -18.580 1.605 1.00 41.24 H new ATOM 0 HD3 ARG B 205 -9.186 -19.889 1.555 1.00 41.24 H new ATOM 0 HE ARG B 205 -7.915 -17.690 2.818 1.00 72.52 H new ATOM 0 HH11 ARG B 205 -10.617 -19.847 3.367 1.00 74.20 H new ATOM 0 HH12 ARG B 205 -10.454 -19.751 5.123 1.00 74.20 H new ATOM 0 HH21 ARG B 205 -7.750 -17.598 5.016 1.00 61.52 H new ATOM 0 HH22 ARG B 205 -8.872 -18.509 6.032 1.00 61.52 H new ATOM 946 N PRO B 206 -11.221 -17.577 -3.583 1.00 41.44 N ATOM 947 CA PRO B 206 -11.571 -17.869 -4.983 1.00 61.44 C ATOM 948 C PRO B 206 -10.351 -18.249 -5.849 1.00 42.40 C ATOM 949 O PRO B 206 -9.207 -17.944 -5.502 1.00 32.20 O ATOM 950 CB PRO B 206 -12.176 -16.542 -5.452 1.00 41.53 C ATOM 951 CG PRO B 206 -11.438 -15.502 -4.677 1.00 50.13 C ATOM 952 CD PRO B 206 -11.121 -16.121 -3.334 1.00 64.11 C ATOM 0 HA PRO B 206 -12.236 -18.728 -5.071 1.00 61.44 H new ATOM 0 HB2 PRO B 206 -12.047 -16.404 -6.525 1.00 41.53 H new ATOM 0 HB3 PRO B 206 -13.247 -16.501 -5.252 1.00 41.53 H new ATOM 0 HG2 PRO B 206 -10.525 -15.206 -5.194 1.00 50.13 H new ATOM 0 HG3 PRO B 206 -12.043 -14.603 -4.558 1.00 50.13 H new ATOM 0 HD2 PRO B 206 -10.125 -15.842 -2.990 1.00 64.11 H new ATOM 0 HD3 PRO B 206 -11.825 -15.797 -2.568 1.00 64.11 H new ATOM 960 N GLY B 207 -10.610 -18.924 -6.973 1.00 31.53 N ATOM 961 CA GLY B 207 -9.546 -19.292 -7.908 1.00 23.43 C ATOM 962 C GLY B 207 -8.422 -20.106 -7.276 1.00 70.45 C ATOM 963 O GLY B 207 -7.242 -19.853 -7.529 1.00 1.25 O ATOM 0 H GLY B 207 -11.543 -19.225 -7.255 1.00 31.53 H new ATOM 0 HA2 GLY B 207 -9.979 -19.864 -8.729 1.00 23.43 H new ATOM 0 HA3 GLY B 207 -9.125 -18.384 -8.340 1.00 23.43 H new ATOM 967 N GLY B 208 -8.789 -21.075 -6.442 1.00 33.42 N ATOM 968 CA GLY B 208 -7.800 -21.926 -5.786 1.00 72.54 C ATOM 969 C GLY B 208 -6.805 -21.157 -4.916 1.00 21.55 C ATOM 970 O GLY B 208 -5.701 -21.638 -4.660 1.00 44.33 O ATOM 0 H GLY B 208 -9.758 -21.290 -6.205 1.00 33.42 H new ATOM 0 HA2 GLY B 208 -8.318 -22.659 -5.168 1.00 72.54 H new ATOM 0 HA3 GLY B 208 -7.251 -22.481 -6.546 1.00 72.54 H new ATOM 974 N GLY B 209 -7.184 -19.956 -4.483 1.00 3.03 N ATOM 975 CA GLY B 209 -6.335 -19.168 -3.594 1.00 52.34 C ATOM 976 C GLY B 209 -5.263 -18.351 -4.318 1.00 52.45 C ATOM 977 O GLY B 209 -4.692 -17.424 -3.743 1.00 32.24 O ATOM 0 H GLY B 209 -8.067 -19.510 -4.732 1.00 3.03 H new ATOM 0 HA2 GLY B 209 -6.963 -18.491 -3.015 1.00 52.34 H new ATOM 0 HA3 GLY B 209 -5.849 -19.838 -2.885 1.00 52.34 H new ATOM 981 N LEU B 210 -4.988 -18.690 -5.579 1.00 74.10 N ATOM 982 CA LEU B 210 -3.964 -17.987 -6.363 1.00 64.32 C ATOM 983 C LEU B 210 -4.355 -16.517 -6.591 1.00 13.10 C ATOM 984 O LEU B 210 -3.540 -15.604 -6.418 1.00 0.44 O ATOM 985 CB LEU B 210 -3.749 -18.689 -7.711 1.00 62.01 C ATOM 986 CG LEU B 210 -3.366 -20.176 -7.627 1.00 12.34 C ATOM 987 CD1 LEU B 210 -3.179 -20.765 -9.023 1.00 43.31 C ATOM 988 CD2 LEU B 210 -2.104 -20.365 -6.789 1.00 31.12 C ATOM 0 H LEU B 210 -5.457 -19.444 -6.080 1.00 74.10 H new ATOM 0 HA LEU B 210 -3.033 -18.010 -5.797 1.00 64.32 H new ATOM 0 HB2 LEU B 210 -4.663 -18.599 -8.298 1.00 62.01 H new ATOM 0 HB3 LEU B 210 -2.967 -18.160 -8.256 1.00 62.01 H new ATOM 0 HG LEU B 210 -4.181 -20.709 -7.138 1.00 12.34 H new ATOM 0 HD11 LEU B 210 -2.908 -21.818 -8.941 1.00 43.31 H new ATOM 0 HD12 LEU B 210 -4.109 -20.672 -9.585 1.00 43.31 H new ATOM 0 HD13 LEU B 210 -2.386 -20.226 -9.542 1.00 43.31 H new ATOM 0 HD21 LEU B 210 -1.853 -21.425 -6.744 1.00 31.12 H new ATOM 0 HD22 LEU B 210 -1.280 -19.816 -7.244 1.00 31.12 H new ATOM 0 HD23 LEU B 210 -2.277 -19.990 -5.780 1.00 31.12 H new ATOM 1000 N LYS B 211 -5.606 -16.299 -6.986 1.00 34.02 N ATOM 1001 CA LYS B 211 -6.151 -14.945 -7.152 1.00 44.44 C ATOM 1002 C LYS B 211 -7.093 -14.588 -5.989 1.00 21.14 C ATOM 1003 O LYS B 211 -8.164 -14.009 -6.185 1.00 73.51 O ATOM 1004 CB LYS B 211 -6.875 -14.824 -8.506 1.00 40.21 C ATOM 1005 CG LYS B 211 -7.981 -15.854 -8.723 1.00 50.52 C ATOM 1006 CD LYS B 211 -8.641 -15.694 -10.094 1.00 62.05 C ATOM 1007 CE LYS B 211 -9.697 -16.763 -10.347 1.00 33.31 C ATOM 1008 NZ LYS B 211 -10.346 -16.596 -11.673 1.00 24.43 N ATOM 0 H LYS B 211 -6.269 -17.044 -7.199 1.00 34.02 H new ATOM 0 HA LYS B 211 -5.324 -14.235 -7.140 1.00 44.44 H new ATOM 0 HB2 LYS B 211 -7.304 -13.825 -8.587 1.00 40.21 H new ATOM 0 HB3 LYS B 211 -6.142 -14.922 -9.307 1.00 40.21 H new ATOM 0 HG2 LYS B 211 -7.566 -16.858 -8.634 1.00 50.52 H new ATOM 0 HG3 LYS B 211 -8.734 -15.750 -7.942 1.00 50.52 H new ATOM 0 HD2 LYS B 211 -9.100 -14.708 -10.163 1.00 62.05 H new ATOM 0 HD3 LYS B 211 -7.879 -15.746 -10.872 1.00 62.05 H new ATOM 0 HE2 LYS B 211 -9.237 -17.749 -10.290 1.00 33.31 H new ATOM 0 HE3 LYS B 211 -10.454 -16.719 -9.564 1.00 33.31 H new ATOM 0 HZ1 LYS B 211 -11.058 -17.342 -11.807 1.00 24.43 H new ATOM 0 HZ2 LYS B 211 -10.807 -15.665 -11.719 1.00 24.43 H new ATOM 0 HZ3 LYS B 211 -9.628 -16.664 -12.422 1.00 24.43 H new ATOM 1022 N ASP B 212 -6.661 -14.921 -4.770 1.00 34.24 N ATOM 1023 CA ASP B 212 -7.421 -14.617 -3.550 1.00 30.41 C ATOM 1024 C ASP B 212 -7.600 -13.102 -3.363 1.00 53.31 C ATOM 1025 O ASP B 212 -8.533 -12.643 -2.704 1.00 21.13 O ATOM 1026 CB ASP B 212 -6.698 -15.211 -2.327 1.00 53.33 C ATOM 1027 CG ASP B 212 -5.334 -14.572 -2.066 1.00 33.53 C ATOM 1028 OD1 ASP B 212 -4.642 -14.201 -3.041 1.00 62.20 O ATOM 1029 OD2 ASP B 212 -4.940 -14.446 -0.884 1.00 20.14 O ATOM 0 H ASP B 212 -5.780 -15.406 -4.599 1.00 34.24 H new ATOM 0 HA ASP B 212 -8.410 -15.064 -3.647 1.00 30.41 H new ATOM 0 HB2 ASP B 212 -7.326 -15.085 -1.445 1.00 53.33 H new ATOM 0 HB3 ASP B 212 -6.568 -16.283 -2.475 1.00 53.33 H new ATOM 1034 N THR B 213 -6.692 -12.339 -3.957 1.00 22.02 N ATOM 1035 CA THR B 213 -6.657 -10.885 -3.796 1.00 31.14 C ATOM 1036 C THR B 213 -6.591 -10.152 -5.149 1.00 31.51 C ATOM 1037 O THR B 213 -5.900 -10.584 -6.072 1.00 22.34 O ATOM 1038 CB THR B 213 -5.447 -10.470 -2.925 1.00 71.54 C ATOM 1039 OG1 THR B 213 -4.249 -11.106 -3.399 1.00 62.11 O ATOM 1040 CG2 THR B 213 -5.663 -10.845 -1.466 1.00 15.52 C ATOM 0 H THR B 213 -5.959 -12.706 -4.564 1.00 22.02 H new ATOM 0 HA THR B 213 -7.585 -10.596 -3.303 1.00 31.14 H new ATOM 0 HB THR B 213 -5.345 -9.387 -3.000 1.00 71.54 H new ATOM 0 HG1 THR B 213 -4.301 -12.070 -3.228 1.00 62.11 H new ATOM 0 HG21 THR B 213 -4.796 -10.541 -0.880 1.00 15.52 H new ATOM 0 HG22 THR B 213 -6.552 -10.340 -1.088 1.00 15.52 H new ATOM 0 HG23 THR B 213 -5.796 -11.924 -1.383 1.00 15.52 H new ATOM 1048 N LYS B 214 -7.320 -9.038 -5.250 1.00 33.50 N ATOM 1049 CA LYS B 214 -7.386 -8.241 -6.486 1.00 22.05 C ATOM 1050 C LYS B 214 -6.259 -7.192 -6.548 1.00 25.42 C ATOM 1051 O LYS B 214 -5.896 -6.599 -5.532 1.00 44.15 O ATOM 1052 CB LYS B 214 -8.751 -7.544 -6.581 1.00 41.53 C ATOM 1053 CG LYS B 214 -9.930 -8.503 -6.746 1.00 45.33 C ATOM 1054 CD LYS B 214 -9.930 -9.189 -8.113 1.00 70.30 C ATOM 1055 CE LYS B 214 -10.088 -8.188 -9.252 1.00 72.21 C ATOM 1056 NZ LYS B 214 -10.232 -8.860 -10.570 1.00 63.04 N ATOM 0 H LYS B 214 -7.879 -8.661 -4.485 1.00 33.50 H new ATOM 0 HA LYS B 214 -7.257 -8.919 -7.329 1.00 22.05 H new ATOM 0 HB2 LYS B 214 -8.905 -6.946 -5.683 1.00 41.53 H new ATOM 0 HB3 LYS B 214 -8.737 -6.854 -7.424 1.00 41.53 H new ATOM 0 HG2 LYS B 214 -9.893 -9.259 -5.962 1.00 45.33 H new ATOM 0 HG3 LYS B 214 -10.863 -7.955 -6.617 1.00 45.33 H new ATOM 0 HD2 LYS B 214 -8.999 -9.741 -8.242 1.00 70.30 H new ATOM 0 HD3 LYS B 214 -10.741 -9.916 -8.154 1.00 70.30 H new ATOM 0 HE2 LYS B 214 -10.962 -7.563 -9.067 1.00 72.21 H new ATOM 0 HE3 LYS B 214 -9.222 -7.526 -9.275 1.00 72.21 H new ATOM 0 HZ1 LYS B 214 -10.337 -8.143 -11.316 1.00 63.04 H new ATOM 0 HZ2 LYS B 214 -9.387 -9.436 -10.760 1.00 63.04 H new ATOM 0 HZ3 LYS B 214 -11.073 -9.472 -10.558 1.00 63.04 H new ATOM 1070 N PRO B 215 -5.696 -6.947 -7.751 1.00 61.42 N ATOM 1071 CA PRO B 215 -4.585 -5.995 -7.937 1.00 13.10 C ATOM 1072 C PRO B 215 -5.017 -4.511 -7.905 1.00 31.22 C ATOM 1073 O PRO B 215 -5.885 -4.082 -8.669 1.00 11.11 O ATOM 1074 CB PRO B 215 -4.047 -6.370 -9.323 1.00 55.31 C ATOM 1075 CG PRO B 215 -5.235 -6.900 -10.056 1.00 54.01 C ATOM 1076 CD PRO B 215 -6.089 -7.590 -9.024 1.00 74.11 C ATOM 0 HA PRO B 215 -3.857 -6.070 -7.129 1.00 13.10 H new ATOM 0 HB2 PRO B 215 -3.621 -5.504 -9.831 1.00 55.31 H new ATOM 0 HB3 PRO B 215 -3.258 -7.119 -9.253 1.00 55.31 H new ATOM 0 HG2 PRO B 215 -5.785 -6.094 -10.541 1.00 54.01 H new ATOM 0 HG3 PRO B 215 -4.932 -7.595 -10.839 1.00 54.01 H new ATOM 0 HD2 PRO B 215 -7.151 -7.455 -9.229 1.00 74.11 H new ATOM 0 HD3 PRO B 215 -5.902 -8.664 -9.004 1.00 74.11 H new ATOM 1084 N VAL B 216 -4.402 -3.740 -7.008 1.00 15.25 N ATOM 1085 CA VAL B 216 -4.602 -2.288 -6.928 1.00 54.43 C ATOM 1086 C VAL B 216 -3.250 -1.555 -7.045 1.00 51.41 C ATOM 1087 O VAL B 216 -2.311 -1.852 -6.303 1.00 70.34 O ATOM 1088 CB VAL B 216 -5.285 -1.888 -5.591 1.00 33.34 C ATOM 1089 CG1 VAL B 216 -5.509 -0.377 -5.513 1.00 22.20 C ATOM 1090 CG2 VAL B 216 -6.604 -2.641 -5.408 1.00 54.23 C ATOM 0 H VAL B 216 -3.749 -4.103 -6.314 1.00 15.25 H new ATOM 0 HA VAL B 216 -5.251 -1.998 -7.754 1.00 54.43 H new ATOM 0 HB VAL B 216 -4.615 -2.169 -4.778 1.00 33.34 H new ATOM 0 HG11 VAL B 216 -5.988 -0.129 -4.566 1.00 22.20 H new ATOM 0 HG12 VAL B 216 -4.550 0.137 -5.580 1.00 22.20 H new ATOM 0 HG13 VAL B 216 -6.148 -0.061 -6.337 1.00 22.20 H new ATOM 0 HG21 VAL B 216 -7.064 -2.345 -4.465 1.00 54.23 H new ATOM 0 HG22 VAL B 216 -7.277 -2.402 -6.231 1.00 54.23 H new ATOM 0 HG23 VAL B 216 -6.412 -3.714 -5.397 1.00 54.23 H new ATOM 1100 N VAL B 217 -3.151 -0.604 -7.974 1.00 1.42 N ATOM 1101 CA VAL B 217 -1.889 0.112 -8.205 1.00 61.15 C ATOM 1102 C VAL B 217 -1.727 1.318 -7.257 1.00 32.43 C ATOM 1103 O VAL B 217 -2.359 2.365 -7.426 1.00 52.40 O ATOM 1104 CB VAL B 217 -1.746 0.565 -9.687 1.00 22.14 C ATOM 1105 CG1 VAL B 217 -2.929 1.426 -10.132 1.00 72.13 C ATOM 1106 CG2 VAL B 217 -0.418 1.294 -9.906 1.00 32.03 C ATOM 0 H VAL B 217 -3.920 -0.311 -8.576 1.00 1.42 H new ATOM 0 HA VAL B 217 -1.089 -0.596 -7.987 1.00 61.15 H new ATOM 0 HB VAL B 217 -1.749 -0.331 -10.308 1.00 22.14 H new ATOM 0 HG11 VAL B 217 -2.792 1.722 -11.172 1.00 72.13 H new ATOM 0 HG12 VAL B 217 -3.852 0.854 -10.036 1.00 72.13 H new ATOM 0 HG13 VAL B 217 -2.987 2.316 -9.506 1.00 72.13 H new ATOM 0 HG21 VAL B 217 -0.339 1.602 -10.949 1.00 32.03 H new ATOM 0 HG22 VAL B 217 -0.376 2.174 -9.264 1.00 32.03 H new ATOM 0 HG23 VAL B 217 0.408 0.626 -9.661 1.00 32.03 H new ATOM 1116 N VAL B 218 -0.878 1.150 -6.250 1.00 4.22 N ATOM 1117 CA VAL B 218 -0.616 2.199 -5.258 1.00 63.40 C ATOM 1118 C VAL B 218 0.707 2.923 -5.571 1.00 65.43 C ATOM 1119 O VAL B 218 1.519 2.435 -6.355 1.00 23.30 O ATOM 1120 CB VAL B 218 -0.562 1.597 -3.827 1.00 12.42 C ATOM 1121 CG1 VAL B 218 -0.497 2.691 -2.760 1.00 60.50 C ATOM 1122 CG2 VAL B 218 -1.758 0.675 -3.588 1.00 33.10 C ATOM 0 H VAL B 218 -0.352 0.290 -6.094 1.00 4.22 H new ATOM 0 HA VAL B 218 -1.432 2.920 -5.306 1.00 63.40 H new ATOM 0 HB VAL B 218 0.351 1.008 -3.748 1.00 12.42 H new ATOM 0 HG11 VAL B 218 -0.460 2.233 -1.771 1.00 60.50 H new ATOM 0 HG12 VAL B 218 0.397 3.296 -2.913 1.00 60.50 H new ATOM 0 HG13 VAL B 218 -1.381 3.324 -2.834 1.00 60.50 H new ATOM 0 HG21 VAL B 218 -1.704 0.262 -2.581 1.00 33.10 H new ATOM 0 HG22 VAL B 218 -2.682 1.242 -3.698 1.00 33.10 H new ATOM 0 HG23 VAL B 218 -1.742 -0.138 -4.314 1.00 33.10 H new ATOM 1132 N ARG B 219 0.913 4.096 -4.975 1.00 53.30 N ATOM 1133 CA ARG B 219 2.141 4.874 -5.195 1.00 32.50 C ATOM 1134 C ARG B 219 2.723 5.422 -3.879 1.00 5.33 C ATOM 1135 O ARG B 219 2.010 6.018 -3.073 1.00 72.21 O ATOM 1136 CB ARG B 219 1.865 6.029 -6.168 1.00 11.30 C ATOM 1137 CG ARG B 219 1.717 5.590 -7.623 1.00 64.42 C ATOM 1138 CD ARG B 219 1.354 6.752 -8.540 1.00 61.11 C ATOM 1139 NE ARG B 219 -0.026 7.197 -8.345 1.00 64.14 N ATOM 1140 CZ ARG B 219 -0.441 8.419 -8.540 1.00 42.25 C ATOM 1141 NH1 ARG B 219 0.390 9.359 -8.856 1.00 74.34 N ATOM 1142 NH2 ARG B 219 -1.693 8.703 -8.409 1.00 20.24 N ATOM 0 H ARG B 219 0.249 4.532 -4.336 1.00 53.30 H new ATOM 0 HA ARG B 219 2.882 4.201 -5.626 1.00 32.50 H new ATOM 0 HB2 ARG B 219 0.954 6.542 -5.859 1.00 11.30 H new ATOM 0 HB3 ARG B 219 2.677 6.752 -6.098 1.00 11.30 H new ATOM 0 HG2 ARG B 219 2.650 5.140 -7.962 1.00 64.42 H new ATOM 0 HG3 ARG B 219 0.948 4.821 -7.692 1.00 64.42 H new ATOM 0 HD2 ARG B 219 2.032 7.585 -8.355 1.00 61.11 H new ATOM 0 HD3 ARG B 219 1.494 6.451 -9.578 1.00 61.11 H new ATOM 0 HE ARG B 219 -0.710 6.506 -8.036 1.00 64.14 H new ATOM 0 HH11 ARG B 219 1.383 9.149 -8.956 1.00 74.34 H new ATOM 0 HH12 ARG B 219 0.052 10.310 -9.006 1.00 74.34 H new ATOM 0 HH21 ARG B 219 -2.358 7.973 -8.153 1.00 20.24 H new ATOM 0 HH22 ARG B 219 -2.018 9.658 -8.561 1.00 20.24 H new ATOM 1156 N LEU B 220 4.030 5.230 -3.688 1.00 12.12 N ATOM 1157 CA LEU B 220 4.730 5.701 -2.481 1.00 11.22 C ATOM 1158 C LEU B 220 6.119 6.268 -2.846 1.00 42.41 C ATOM 1159 O LEU B 220 6.634 6.004 -3.929 1.00 5.53 O ATOM 1160 CB LEU B 220 4.864 4.546 -1.473 1.00 33.13 C ATOM 1161 CG LEU B 220 5.435 4.924 -0.094 1.00 33.14 C ATOM 1162 CD1 LEU B 220 4.504 5.897 0.628 1.00 21.20 C ATOM 1163 CD2 LEU B 220 5.678 3.674 0.750 1.00 14.34 C ATOM 0 H LEU B 220 4.632 4.749 -4.356 1.00 12.12 H new ATOM 0 HA LEU B 220 4.148 6.502 -2.025 1.00 11.22 H new ATOM 0 HB2 LEU B 220 3.880 4.099 -1.328 1.00 33.13 H new ATOM 0 HB3 LEU B 220 5.501 3.778 -1.911 1.00 33.13 H new ATOM 0 HG LEU B 220 6.393 5.422 -0.245 1.00 33.14 H new ATOM 0 HD11 LEU B 220 4.926 6.151 1.600 1.00 21.20 H new ATOM 0 HD12 LEU B 220 4.392 6.803 0.033 1.00 21.20 H new ATOM 0 HD13 LEU B 220 3.528 5.432 0.767 1.00 21.20 H new ATOM 0 HD21 LEU B 220 6.082 3.963 1.720 1.00 14.34 H new ATOM 0 HD22 LEU B 220 4.737 3.142 0.892 1.00 14.34 H new ATOM 0 HD23 LEU B 220 6.389 3.024 0.241 1.00 14.34 H new ATOM 1175 N TYR B 221 6.723 7.041 -1.945 1.00 45.25 N ATOM 1176 CA TYR B 221 8.006 7.697 -2.228 1.00 4.12 C ATOM 1177 C TYR B 221 9.179 6.694 -2.262 1.00 23.33 C ATOM 1178 O TYR B 221 9.240 5.762 -1.455 1.00 14.03 O ATOM 1179 CB TYR B 221 8.264 8.798 -1.192 1.00 14.11 C ATOM 1180 CG TYR B 221 7.209 9.891 -1.203 1.00 70.11 C ATOM 1181 CD1 TYR B 221 7.339 11.006 -2.028 1.00 54.42 C ATOM 1182 CD2 TYR B 221 6.077 9.806 -0.397 1.00 2.34 C ATOM 1183 CE1 TYR B 221 6.378 11.999 -2.046 1.00 53.35 C ATOM 1184 CE2 TYR B 221 5.112 10.795 -0.412 1.00 13.44 C ATOM 1185 CZ TYR B 221 5.268 11.889 -1.239 1.00 61.42 C ATOM 1186 OH TYR B 221 4.306 12.876 -1.255 1.00 11.13 O ATOM 0 H TYR B 221 6.349 7.230 -1.015 1.00 45.25 H new ATOM 0 HA TYR B 221 7.942 8.141 -3.221 1.00 4.12 H new ATOM 0 HB2 TYR B 221 8.304 8.351 -0.199 1.00 14.11 H new ATOM 0 HB3 TYR B 221 9.241 9.243 -1.381 1.00 14.11 H new ATOM 0 HD1 TYR B 221 8.206 11.096 -2.665 1.00 54.42 H new ATOM 0 HD2 TYR B 221 5.951 8.952 0.252 1.00 2.34 H new ATOM 0 HE1 TYR B 221 6.497 12.858 -2.690 1.00 53.35 H new ATOM 0 HE2 TYR B 221 4.240 10.712 0.220 1.00 13.44 H new ATOM 0 HH TYR B 221 3.589 12.644 -0.629 1.00 11.13 H new ATOM 1196 N PRO B 222 10.145 6.891 -3.194 1.00 23.20 N ATOM 1197 CA PRO B 222 11.281 5.961 -3.395 1.00 34.42 C ATOM 1198 C PRO B 222 12.133 5.750 -2.132 1.00 40.10 C ATOM 1199 O PRO B 222 12.680 4.669 -1.919 1.00 65.32 O ATOM 1200 CB PRO B 222 12.113 6.633 -4.508 1.00 51.23 C ATOM 1201 CG PRO B 222 11.658 8.056 -4.532 1.00 12.25 C ATOM 1202 CD PRO B 222 10.209 8.033 -4.128 1.00 20.33 C ATOM 0 HA PRO B 222 10.929 4.961 -3.650 1.00 34.42 H new ATOM 0 HB2 PRO B 222 13.180 6.564 -4.298 1.00 51.23 H new ATOM 0 HB3 PRO B 222 11.946 6.150 -5.471 1.00 51.23 H new ATOM 0 HG2 PRO B 222 12.245 8.665 -3.845 1.00 12.25 H new ATOM 0 HG3 PRO B 222 11.780 8.488 -5.525 1.00 12.25 H new ATOM 0 HD2 PRO B 222 9.909 8.965 -3.648 1.00 20.33 H new ATOM 0 HD3 PRO B 222 9.552 7.890 -4.986 1.00 20.33 H new ATOM 1210 N ASP B 223 12.235 6.788 -1.302 1.00 12.03 N ATOM 1211 CA ASP B 223 12.992 6.718 -0.045 1.00 50.42 C ATOM 1212 C ASP B 223 12.466 5.588 0.861 1.00 22.15 C ATOM 1213 O ASP B 223 13.223 4.732 1.327 1.00 30.03 O ATOM 1214 CB ASP B 223 12.901 8.069 0.680 1.00 23.32 C ATOM 1215 CG ASP B 223 13.656 8.082 1.997 1.00 2.32 C ATOM 1216 OD1 ASP B 223 14.906 8.083 1.967 1.00 71.32 O ATOM 1217 OD2 ASP B 223 13.005 8.070 3.065 1.00 52.54 O ATOM 0 H ASP B 223 11.801 7.694 -1.476 1.00 12.03 H new ATOM 0 HA ASP B 223 14.034 6.497 -0.277 1.00 50.42 H new ATOM 0 HB2 ASP B 223 13.296 8.851 0.032 1.00 23.32 H new ATOM 0 HB3 ASP B 223 11.854 8.307 0.865 1.00 23.32 H new ATOM 1222 N GLU B 224 11.155 5.589 1.076 1.00 12.40 N ATOM 1223 CA GLU B 224 10.495 4.608 1.938 1.00 30.10 C ATOM 1224 C GLU B 224 10.473 3.210 1.295 1.00 23.22 C ATOM 1225 O GLU B 224 10.808 2.216 1.941 1.00 75.45 O ATOM 1226 CB GLU B 224 9.070 5.092 2.231 1.00 11.45 C ATOM 1227 CG GLU B 224 9.032 6.473 2.879 1.00 22.21 C ATOM 1228 CD GLU B 224 7.634 7.065 2.942 1.00 33.10 C ATOM 1229 OE1 GLU B 224 7.209 7.690 1.947 1.00 30.21 O ATOM 1230 OE2 GLU B 224 6.969 6.929 3.988 1.00 64.32 O ATOM 0 H GLU B 224 10.518 6.268 0.659 1.00 12.40 H new ATOM 0 HA GLU B 224 11.057 4.519 2.868 1.00 30.10 H new ATOM 0 HB2 GLU B 224 8.502 5.117 1.301 1.00 11.45 H new ATOM 0 HB3 GLU B 224 8.576 4.375 2.887 1.00 11.45 H new ATOM 0 HG2 GLU B 224 9.437 6.405 3.889 1.00 22.21 H new ATOM 0 HG3 GLU B 224 9.681 7.148 2.320 1.00 22.21 H new ATOM 1237 N ILE B 225 10.091 3.144 0.018 1.00 64.42 N ATOM 1238 CA ILE B 225 10.015 1.864 -0.708 1.00 64.03 C ATOM 1239 C ILE B 225 11.363 1.120 -0.707 1.00 30.12 C ATOM 1240 O ILE B 225 11.416 -0.084 -0.434 1.00 4.04 O ATOM 1241 CB ILE B 225 9.541 2.065 -2.171 1.00 61.02 C ATOM 1242 CG1 ILE B 225 8.135 2.687 -2.196 1.00 52.21 C ATOM 1243 CG2 ILE B 225 9.562 0.737 -2.936 1.00 64.12 C ATOM 1244 CD1 ILE B 225 7.590 2.909 -3.590 1.00 41.01 C ATOM 0 H ILE B 225 9.829 3.958 -0.538 1.00 64.42 H new ATOM 0 HA ILE B 225 9.282 1.256 -0.177 1.00 64.03 H new ATOM 0 HB ILE B 225 10.230 2.750 -2.666 1.00 61.02 H new ATOM 0 HG12 ILE B 225 7.451 2.039 -1.648 1.00 52.21 H new ATOM 0 HG13 ILE B 225 8.161 3.641 -1.670 1.00 52.21 H new ATOM 0 HG21 ILE B 225 9.226 0.901 -3.960 1.00 64.12 H new ATOM 0 HG22 ILE B 225 10.577 0.339 -2.947 1.00 64.12 H new ATOM 0 HG23 ILE B 225 8.898 0.024 -2.446 1.00 64.12 H new ATOM 0 HD11 ILE B 225 6.595 3.350 -3.526 1.00 41.01 H new ATOM 0 HD12 ILE B 225 8.251 3.582 -4.136 1.00 41.01 H new ATOM 0 HD13 ILE B 225 7.531 1.955 -4.114 1.00 41.01 H new ATOM 1256 N GLU B 226 12.448 1.838 -1.010 1.00 71.20 N ATOM 1257 CA GLU B 226 13.793 1.249 -1.015 1.00 40.52 C ATOM 1258 C GLU B 226 14.141 0.640 0.353 1.00 15.02 C ATOM 1259 O GLU B 226 14.420 -0.556 0.459 1.00 1.04 O ATOM 1260 CB GLU B 226 14.839 2.307 -1.399 1.00 51.21 C ATOM 1261 CG GLU B 226 16.277 1.790 -1.372 1.00 25.02 C ATOM 1262 CD GLU B 226 17.291 2.837 -1.802 1.00 4.41 C ATOM 1263 OE1 GLU B 226 17.581 2.926 -3.015 1.00 71.03 O ATOM 1264 OE2 GLU B 226 17.799 3.579 -0.935 1.00 42.41 O ATOM 0 H GLU B 226 12.423 2.828 -1.255 1.00 71.20 H new ATOM 0 HA GLU B 226 13.803 0.450 -1.756 1.00 40.52 H new ATOM 0 HB2 GLU B 226 14.615 2.680 -2.399 1.00 51.21 H new ATOM 0 HB3 GLU B 226 14.754 3.153 -0.717 1.00 51.21 H new ATOM 0 HG2 GLU B 226 16.517 1.452 -0.364 1.00 25.02 H new ATOM 0 HG3 GLU B 226 16.358 0.923 -2.027 1.00 25.02 H new ATOM 1271 N ALA B 227 14.109 1.471 1.394 1.00 4.42 N ATOM 1272 CA ALA B 227 14.406 1.026 2.761 1.00 51.33 C ATOM 1273 C ALA B 227 13.500 -0.141 3.192 1.00 61.22 C ATOM 1274 O ALA B 227 13.932 -1.048 3.905 1.00 12.51 O ATOM 1275 CB ALA B 227 14.263 2.194 3.728 1.00 44.24 C ATOM 0 H ALA B 227 13.879 2.462 1.319 1.00 4.42 H new ATOM 0 HA ALA B 227 15.434 0.664 2.780 1.00 51.33 H new ATOM 0 HB1 ALA B 227 14.485 1.857 4.741 1.00 44.24 H new ATOM 0 HB2 ALA B 227 14.959 2.985 3.448 1.00 44.24 H new ATOM 0 HB3 ALA B 227 13.243 2.577 3.688 1.00 44.24 H new ATOM 1281 N LEU B 228 12.251 -0.112 2.737 1.00 73.12 N ATOM 1282 CA LEU B 228 11.269 -1.147 3.074 1.00 0.44 C ATOM 1283 C LEU B 228 11.700 -2.531 2.556 1.00 52.35 C ATOM 1284 O LEU B 228 11.882 -3.471 3.331 1.00 12.41 O ATOM 1285 CB LEU B 228 9.901 -0.775 2.483 1.00 75.54 C ATOM 1286 CG LEU B 228 8.728 -1.647 2.947 1.00 73.24 C ATOM 1287 CD1 LEU B 228 8.504 -1.488 4.448 1.00 52.21 C ATOM 1288 CD2 LEU B 228 7.462 -1.306 2.168 1.00 14.10 C ATOM 0 H LEU B 228 11.889 0.622 2.128 1.00 73.12 H new ATOM 0 HA LEU B 228 11.201 -1.203 4.160 1.00 0.44 H new ATOM 0 HB2 LEU B 228 9.684 0.262 2.737 1.00 75.54 H new ATOM 0 HB3 LEU B 228 9.966 -0.830 1.396 1.00 75.54 H new ATOM 0 HG LEU B 228 8.975 -2.690 2.749 1.00 73.24 H new ATOM 0 HD11 LEU B 228 7.668 -2.114 4.759 1.00 52.21 H new ATOM 0 HD12 LEU B 228 9.403 -1.791 4.984 1.00 52.21 H new ATOM 0 HD13 LEU B 228 8.281 -0.445 4.674 1.00 52.21 H new ATOM 0 HD21 LEU B 228 6.642 -1.936 2.513 1.00 14.10 H new ATOM 0 HD22 LEU B 228 7.207 -0.258 2.329 1.00 14.10 H new ATOM 0 HD23 LEU B 228 7.631 -1.480 1.105 1.00 14.10 H new ATOM 1300 N LYS B 229 11.879 -2.650 1.240 1.00 52.32 N ATOM 1301 CA LYS B 229 12.272 -3.930 0.632 1.00 61.25 C ATOM 1302 C LYS B 229 13.761 -4.240 0.861 1.00 31.24 C ATOM 1303 O LYS B 229 14.233 -5.333 0.551 1.00 45.21 O ATOM 1304 CB LYS B 229 11.947 -3.940 -0.870 1.00 33.40 C ATOM 1305 CG LYS B 229 12.700 -2.893 -1.685 1.00 12.55 C ATOM 1306 CD LYS B 229 12.269 -2.901 -3.151 1.00 1.21 C ATOM 1307 CE LYS B 229 12.618 -4.214 -3.855 1.00 13.13 C ATOM 1308 NZ LYS B 229 14.085 -4.374 -4.058 1.00 1.20 N ATOM 0 H LYS B 229 11.760 -1.885 0.576 1.00 52.32 H new ATOM 0 HA LYS B 229 11.694 -4.713 1.123 1.00 61.25 H new ATOM 0 HB2 LYS B 229 12.174 -4.928 -1.272 1.00 33.40 H new ATOM 0 HB3 LYS B 229 10.876 -3.782 -0.999 1.00 33.40 H new ATOM 0 HG2 LYS B 229 12.524 -1.905 -1.259 1.00 12.55 H new ATOM 0 HG3 LYS B 229 13.771 -3.082 -1.620 1.00 12.55 H new ATOM 0 HD2 LYS B 229 11.194 -2.734 -3.211 1.00 1.21 H new ATOM 0 HD3 LYS B 229 12.750 -2.073 -3.673 1.00 1.21 H new ATOM 0 HE2 LYS B 229 12.242 -5.051 -3.266 1.00 13.13 H new ATOM 0 HE3 LYS B 229 12.114 -4.251 -4.821 1.00 13.13 H new ATOM 0 HZ1 LYS B 229 14.269 -5.253 -4.583 1.00 1.20 H new ATOM 0 HZ2 LYS B 229 14.451 -3.564 -4.599 1.00 1.20 H new ATOM 0 HZ3 LYS B 229 14.561 -4.417 -3.134 1.00 1.20 H new ATOM 1322 N SER B 230 14.494 -3.280 1.417 1.00 3.31 N ATOM 1323 CA SER B 230 15.923 -3.466 1.717 1.00 65.41 C ATOM 1324 C SER B 230 16.136 -4.303 2.990 1.00 42.44 C ATOM 1325 O SER B 230 17.265 -4.678 3.311 1.00 52.12 O ATOM 1326 CB SER B 230 16.617 -2.104 1.877 1.00 41.43 C ATOM 1327 OG SER B 230 18.008 -2.246 2.120 1.00 31.33 O ATOM 0 H SER B 230 14.128 -2.363 1.672 1.00 3.31 H new ATOM 0 HA SER B 230 16.362 -4.006 0.878 1.00 65.41 H new ATOM 0 HB2 SER B 230 16.464 -1.510 0.976 1.00 41.43 H new ATOM 0 HB3 SER B 230 16.158 -1.557 2.701 1.00 41.43 H new ATOM 0 HG SER B 230 18.174 -3.091 2.587 1.00 31.33 H new ATOM 1333 N ARG B 231 15.053 -4.590 3.719 1.00 30.24 N ATOM 1334 CA ARG B 231 15.147 -5.357 4.974 1.00 73.03 C ATOM 1335 C ARG B 231 14.400 -6.707 4.898 1.00 1.55 C ATOM 1336 O ARG B 231 14.580 -7.570 5.758 1.00 40.31 O ATOM 1337 CB ARG B 231 14.586 -4.521 6.137 1.00 2.53 C ATOM 1338 CG ARG B 231 13.070 -4.350 6.100 1.00 51.24 C ATOM 1339 CD ARG B 231 12.567 -3.416 7.196 1.00 60.10 C ATOM 1340 NE ARG B 231 11.106 -3.421 7.283 1.00 33.44 N ATOM 1341 CZ ARG B 231 10.384 -2.412 7.693 1.00 12.23 C ATOM 1342 NH1 ARG B 231 10.944 -1.285 8.022 1.00 52.12 N ATOM 1343 NH2 ARG B 231 9.096 -2.532 7.759 1.00 15.30 N ATOM 0 H ARG B 231 14.106 -4.307 3.468 1.00 30.24 H new ATOM 0 HA ARG B 231 16.201 -5.577 5.141 1.00 73.03 H new ATOM 0 HB2 ARG B 231 14.866 -4.993 7.079 1.00 2.53 H new ATOM 0 HB3 ARG B 231 15.053 -3.536 6.123 1.00 2.53 H new ATOM 0 HG2 ARG B 231 12.774 -3.958 5.127 1.00 51.24 H new ATOM 0 HG3 ARG B 231 12.594 -5.324 6.209 1.00 51.24 H new ATOM 0 HD2 ARG B 231 12.990 -3.718 8.154 1.00 60.10 H new ATOM 0 HD3 ARG B 231 12.916 -2.402 6.999 1.00 60.10 H new ATOM 0 HE ARG B 231 10.617 -4.272 7.004 1.00 33.44 H new ATOM 0 HH11 ARG B 231 11.957 -1.182 7.961 1.00 52.12 H new ATOM 0 HH12 ARG B 231 10.370 -0.504 8.341 1.00 52.12 H new ATOM 0 HH21 ARG B 231 8.651 -3.410 7.492 1.00 15.30 H new ATOM 0 HH22 ARG B 231 8.526 -1.748 8.078 1.00 15.30 H new ATOM 1357 N VAL B 232 13.568 -6.885 3.872 1.00 12.15 N ATOM 1358 CA VAL B 232 12.724 -8.085 3.759 1.00 45.24 C ATOM 1359 C VAL B 232 13.486 -9.282 3.150 1.00 72.03 C ATOM 1360 O VAL B 232 14.387 -9.104 2.327 1.00 42.24 O ATOM 1361 CB VAL B 232 11.455 -7.804 2.914 1.00 14.13 C ATOM 1362 CG1 VAL B 232 10.624 -6.676 3.529 1.00 54.34 C ATOM 1363 CG2 VAL B 232 11.822 -7.481 1.467 1.00 33.43 C ATOM 0 H VAL B 232 13.457 -6.219 3.107 1.00 12.15 H new ATOM 0 HA VAL B 232 12.431 -8.346 4.776 1.00 45.24 H new ATOM 0 HB VAL B 232 10.847 -8.709 2.914 1.00 14.13 H new ATOM 0 HG11 VAL B 232 9.740 -6.500 2.916 1.00 54.34 H new ATOM 0 HG12 VAL B 232 10.317 -6.958 4.536 1.00 54.34 H new ATOM 0 HG13 VAL B 232 11.222 -5.766 3.573 1.00 54.34 H new ATOM 0 HG21 VAL B 232 10.914 -7.288 0.896 1.00 33.43 H new ATOM 0 HG22 VAL B 232 12.461 -6.598 1.442 1.00 33.43 H new ATOM 0 HG23 VAL B 232 12.353 -8.326 1.029 1.00 33.43 H new ATOM 1373 N PRO B 233 13.142 -10.520 3.567 1.00 13.30 N ATOM 1374 CA PRO B 233 13.762 -11.746 3.032 1.00 23.02 C ATOM 1375 C PRO B 233 13.116 -12.248 1.719 1.00 71.42 C ATOM 1376 O PRO B 233 12.335 -11.537 1.080 1.00 24.12 O ATOM 1377 CB PRO B 233 13.525 -12.739 4.172 1.00 4.54 C ATOM 1378 CG PRO B 233 12.209 -12.332 4.747 1.00 53.11 C ATOM 1379 CD PRO B 233 12.141 -10.828 4.614 1.00 1.13 C ATOM 0 HA PRO B 233 14.807 -11.597 2.759 1.00 23.02 H new ATOM 0 HB2 PRO B 233 13.499 -13.766 3.807 1.00 4.54 H new ATOM 0 HB3 PRO B 233 14.318 -12.686 4.917 1.00 4.54 H new ATOM 0 HG2 PRO B 233 11.386 -12.808 4.213 1.00 53.11 H new ATOM 0 HG3 PRO B 233 12.129 -12.635 5.791 1.00 53.11 H new ATOM 0 HD2 PRO B 233 11.144 -10.497 4.324 1.00 1.13 H new ATOM 0 HD3 PRO B 233 12.380 -10.332 5.555 1.00 1.13 H new ATOM 1387 N ALA B 234 13.442 -13.486 1.328 1.00 73.40 N ATOM 1388 CA ALA B 234 12.943 -14.071 0.073 1.00 22.21 C ATOM 1389 C ALA B 234 11.447 -14.433 0.140 1.00 61.33 C ATOM 1390 O ALA B 234 10.668 -14.052 -0.738 1.00 41.54 O ATOM 1391 CB ALA B 234 13.770 -15.300 -0.294 1.00 34.41 C ATOM 0 H ALA B 234 14.051 -14.105 1.863 1.00 73.40 H new ATOM 0 HA ALA B 234 13.049 -13.312 -0.702 1.00 22.21 H new ATOM 0 HB1 ALA B 234 13.394 -15.727 -1.224 1.00 34.41 H new ATOM 0 HB2 ALA B 234 14.813 -15.011 -0.423 1.00 34.41 H new ATOM 0 HB3 ALA B 234 13.694 -16.041 0.502 1.00 34.41 H new ATOM 1397 N ASN B 235 11.051 -15.158 1.191 1.00 71.12 N ATOM 1398 CA ASN B 235 9.647 -15.577 1.374 1.00 72.33 C ATOM 1399 C ASN B 235 8.690 -14.375 1.491 1.00 60.30 C ATOM 1400 O ASN B 235 7.467 -14.544 1.478 1.00 72.51 O ATOM 1401 CB ASN B 235 9.509 -16.465 2.623 1.00 71.40 C ATOM 1402 CG ASN B 235 10.041 -17.870 2.407 1.00 1.20 C ATOM 1403 OD1 ASN B 235 9.303 -18.772 2.025 1.00 73.53 O ATOM 1404 ND2 ASN B 235 11.315 -18.076 2.665 1.00 53.41 N ATOM 0 H ASN B 235 11.679 -15.470 1.932 1.00 71.12 H new ATOM 0 HA ASN B 235 9.368 -16.143 0.485 1.00 72.33 H new ATOM 0 HB2 ASN B 235 10.043 -16.003 3.453 1.00 71.40 H new ATOM 0 HB3 ASN B 235 8.459 -16.519 2.911 1.00 71.40 H new ATOM 0 HD21 ASN B 235 11.715 -19.007 2.549 1.00 53.41 H new ATOM 0 HD22 ASN B 235 11.903 -17.305 2.981 1.00 53.41 H new ATOM 1411 N THR B 236 9.247 -13.174 1.621 1.00 61.42 N ATOM 1412 CA THR B 236 8.451 -11.945 1.706 1.00 41.22 C ATOM 1413 C THR B 236 8.623 -11.082 0.446 1.00 22.51 C ATOM 1414 O THR B 236 9.619 -10.376 0.298 1.00 30.13 O ATOM 1415 CB THR B 236 8.847 -11.107 2.946 1.00 65.42 C ATOM 1416 OG1 THR B 236 8.742 -11.905 4.136 1.00 64.52 O ATOM 1417 CG2 THR B 236 7.966 -9.870 3.085 1.00 51.12 C ATOM 0 H THR B 236 10.254 -13.022 1.670 1.00 61.42 H new ATOM 0 HA THR B 236 7.408 -12.249 1.794 1.00 41.22 H new ATOM 0 HB THR B 236 9.879 -10.782 2.811 1.00 65.42 H new ATOM 0 HG1 THR B 236 8.996 -11.367 4.914 1.00 64.52 H new ATOM 0 HG21 THR B 236 8.270 -9.304 3.965 1.00 51.12 H new ATOM 0 HG22 THR B 236 8.072 -9.246 2.198 1.00 51.12 H new ATOM 0 HG23 THR B 236 6.925 -10.175 3.192 1.00 51.12 H new ATOM 1425 N SER B 237 7.655 -11.153 -0.465 1.00 32.24 N ATOM 1426 CA SER B 237 7.698 -10.367 -1.710 1.00 53.40 C ATOM 1427 C SER B 237 7.123 -8.955 -1.511 1.00 65.10 C ATOM 1428 O SER B 237 6.440 -8.688 -0.523 1.00 24.34 O ATOM 1429 CB SER B 237 6.942 -11.099 -2.826 1.00 21.13 C ATOM 1430 OG SER B 237 7.566 -12.340 -3.135 1.00 25.05 O ATOM 0 H SER B 237 6.829 -11.744 -0.371 1.00 32.24 H new ATOM 0 HA SER B 237 8.744 -10.259 -1.998 1.00 53.40 H new ATOM 0 HB2 SER B 237 5.911 -11.273 -2.518 1.00 21.13 H new ATOM 0 HB3 SER B 237 6.907 -10.473 -3.718 1.00 21.13 H new ATOM 0 HG SER B 237 7.065 -12.789 -3.848 1.00 25.05 H new ATOM 1436 N MET B 238 7.398 -8.060 -2.466 1.00 13.14 N ATOM 1437 CA MET B 238 7.028 -6.639 -2.341 1.00 41.12 C ATOM 1438 C MET B 238 5.524 -6.441 -2.078 1.00 73.32 C ATOM 1439 O MET B 238 5.123 -6.006 -0.994 1.00 64.21 O ATOM 1440 CB MET B 238 7.440 -5.857 -3.598 1.00 72.11 C ATOM 1441 CG MET B 238 8.931 -5.917 -3.914 1.00 42.23 C ATOM 1442 SD MET B 238 9.398 -4.818 -5.270 1.00 74.45 S ATOM 1443 CE MET B 238 8.292 -5.373 -6.568 1.00 54.12 C ATOM 0 H MET B 238 7.876 -8.291 -3.337 1.00 13.14 H new ATOM 0 HA MET B 238 7.568 -6.253 -1.477 1.00 41.12 H new ATOM 0 HB2 MET B 238 6.884 -6.245 -4.451 1.00 72.11 H new ATOM 0 HB3 MET B 238 7.148 -4.814 -3.475 1.00 72.11 H new ATOM 0 HG2 MET B 238 9.499 -5.650 -3.023 1.00 42.23 H new ATOM 0 HG3 MET B 238 9.203 -6.941 -4.171 1.00 42.23 H new ATOM 0 HE1 MET B 238 8.644 -5.000 -7.530 1.00 54.12 H new ATOM 0 HE2 MET B 238 8.271 -6.463 -6.587 1.00 54.12 H new ATOM 0 HE3 MET B 238 7.288 -4.994 -6.377 1.00 54.12 H new ATOM 1453 N SER B 239 4.690 -6.764 -3.066 1.00 60.45 N ATOM 1454 CA SER B 239 3.242 -6.520 -2.959 1.00 24.10 C ATOM 1455 C SER B 239 2.598 -7.365 -1.850 1.00 14.11 C ATOM 1456 O SER B 239 1.610 -6.951 -1.238 1.00 11.24 O ATOM 1457 CB SER B 239 2.541 -6.785 -4.298 1.00 42.44 C ATOM 1458 OG SER B 239 2.696 -8.131 -4.718 1.00 41.05 O ATOM 0 H SER B 239 4.983 -7.192 -3.944 1.00 60.45 H new ATOM 0 HA SER B 239 3.115 -5.470 -2.695 1.00 24.10 H new ATOM 0 HB2 SER B 239 1.480 -6.554 -4.205 1.00 42.44 H new ATOM 0 HB3 SER B 239 2.947 -6.118 -5.059 1.00 42.44 H new ATOM 0 HG SER B 239 2.235 -8.262 -5.573 1.00 41.05 H new ATOM 1464 N ALA B 240 3.156 -8.547 -1.596 1.00 21.55 N ATOM 1465 CA ALA B 240 2.685 -9.409 -0.509 1.00 20.03 C ATOM 1466 C ALA B 240 2.954 -8.769 0.862 1.00 2.41 C ATOM 1467 O ALA B 240 2.117 -8.828 1.768 1.00 15.43 O ATOM 1468 CB ALA B 240 3.352 -10.778 -0.595 1.00 45.31 C ATOM 0 H ALA B 240 3.936 -8.932 -2.128 1.00 21.55 H new ATOM 0 HA ALA B 240 1.607 -9.533 -0.617 1.00 20.03 H new ATOM 0 HB1 ALA B 240 2.994 -11.409 0.218 1.00 45.31 H new ATOM 0 HB2 ALA B 240 3.107 -11.243 -1.550 1.00 45.31 H new ATOM 0 HB3 ALA B 240 4.433 -10.662 -0.515 1.00 45.31 H new ATOM 1474 N TYR B 241 4.127 -8.153 1.004 1.00 44.11 N ATOM 1475 CA TYR B 241 4.493 -7.462 2.240 1.00 25.03 C ATOM 1476 C TYR B 241 3.589 -6.244 2.470 1.00 34.43 C ATOM 1477 O TYR B 241 3.105 -6.022 3.578 1.00 70.31 O ATOM 1478 CB TYR B 241 5.967 -7.038 2.199 1.00 73.23 C ATOM 1479 CG TYR B 241 6.493 -6.487 3.516 1.00 0.42 C ATOM 1480 CD1 TYR B 241 6.424 -7.239 4.687 1.00 30.24 C ATOM 1481 CD2 TYR B 241 7.062 -5.221 3.588 1.00 34.11 C ATOM 1482 CE1 TYR B 241 6.906 -6.742 5.884 1.00 32.03 C ATOM 1483 CE2 TYR B 241 7.545 -4.723 4.781 1.00 5.54 C ATOM 1484 CZ TYR B 241 7.466 -5.484 5.924 1.00 22.24 C ATOM 1485 OH TYR B 241 7.956 -4.983 7.111 1.00 32.41 O ATOM 0 H TYR B 241 4.841 -8.118 0.277 1.00 44.11 H new ATOM 0 HA TYR B 241 4.353 -8.151 3.073 1.00 25.03 H new ATOM 0 HB2 TYR B 241 6.573 -7.897 1.909 1.00 73.23 H new ATOM 0 HB3 TYR B 241 6.095 -6.282 1.424 1.00 73.23 H new ATOM 0 HD1 TYR B 241 5.987 -8.226 4.659 1.00 30.24 H new ATOM 0 HD2 TYR B 241 7.127 -4.617 2.695 1.00 34.11 H new ATOM 0 HE1 TYR B 241 6.844 -7.337 6.783 1.00 32.03 H new ATOM 0 HE2 TYR B 241 7.984 -3.737 4.817 1.00 5.54 H new ATOM 0 HH TYR B 241 8.274 -5.721 7.671 1.00 32.41 H new ATOM 1495 N ILE B 242 3.352 -5.466 1.414 1.00 54.04 N ATOM 1496 CA ILE B 242 2.434 -4.324 1.493 1.00 62.10 C ATOM 1497 C ILE B 242 1.025 -4.781 1.909 1.00 53.23 C ATOM 1498 O ILE B 242 0.373 -4.144 2.739 1.00 52.35 O ATOM 1499 CB ILE B 242 2.344 -3.559 0.145 1.00 52.24 C ATOM 1500 CG1 ILE B 242 3.734 -3.078 -0.309 1.00 33.00 C ATOM 1501 CG2 ILE B 242 1.379 -2.376 0.265 1.00 0.24 C ATOM 1502 CD1 ILE B 242 4.375 -2.075 0.630 1.00 44.24 C ATOM 0 H ILE B 242 3.779 -5.602 0.498 1.00 54.04 H new ATOM 0 HA ILE B 242 2.837 -3.649 2.248 1.00 62.10 H new ATOM 0 HB ILE B 242 1.961 -4.245 -0.610 1.00 52.24 H new ATOM 0 HG12 ILE B 242 4.392 -3.941 -0.407 1.00 33.00 H new ATOM 0 HG13 ILE B 242 3.647 -2.630 -1.299 1.00 33.00 H new ATOM 0 HG21 ILE B 242 1.327 -1.850 -0.688 1.00 0.24 H new ATOM 0 HG22 ILE B 242 0.387 -2.741 0.532 1.00 0.24 H new ATOM 0 HG23 ILE B 242 1.734 -1.693 1.037 1.00 0.24 H new ATOM 0 HD11 ILE B 242 5.351 -1.785 0.241 1.00 44.24 H new ATOM 0 HD12 ILE B 242 3.739 -1.193 0.709 1.00 44.24 H new ATOM 0 HD13 ILE B 242 4.496 -2.525 1.615 1.00 44.24 H new ATOM 1514 N ARG B 243 0.570 -5.899 1.337 1.00 54.11 N ATOM 1515 CA ARG B 243 -0.743 -6.463 1.668 1.00 33.23 C ATOM 1516 C ARG B 243 -0.876 -6.744 3.172 1.00 33.05 C ATOM 1517 O ARG B 243 -1.848 -6.334 3.804 1.00 20.42 O ATOM 1518 CB ARG B 243 -0.995 -7.757 0.875 1.00 74.31 C ATOM 1519 CG ARG B 243 -2.351 -8.401 1.170 1.00 11.45 C ATOM 1520 CD ARG B 243 -2.593 -9.653 0.331 1.00 21.20 C ATOM 1521 NE ARG B 243 -1.668 -10.736 0.656 1.00 73.54 N ATOM 1522 CZ ARG B 243 -1.853 -11.984 0.315 1.00 2.23 C ATOM 1523 NH1 ARG B 243 -2.905 -12.340 -0.354 1.00 21.14 N ATOM 1524 NH2 ARG B 243 -0.986 -12.878 0.659 1.00 53.43 N ATOM 0 H ARG B 243 1.092 -6.433 0.642 1.00 54.11 H new ATOM 0 HA ARG B 243 -1.492 -5.720 1.391 1.00 33.23 H new ATOM 0 HB2 ARG B 243 -0.930 -7.539 -0.191 1.00 74.31 H new ATOM 0 HB3 ARG B 243 -0.205 -8.473 1.103 1.00 74.31 H new ATOM 0 HG2 ARG B 243 -2.406 -8.659 2.228 1.00 11.45 H new ATOM 0 HG3 ARG B 243 -3.144 -7.678 0.977 1.00 11.45 H new ATOM 0 HD2 ARG B 243 -3.616 -9.996 0.484 1.00 21.20 H new ATOM 0 HD3 ARG B 243 -2.496 -9.402 -0.725 1.00 21.20 H new ATOM 0 HE ARG B 243 -0.825 -10.504 1.182 1.00 73.54 H new ATOM 0 HH11 ARG B 243 -3.600 -11.643 -0.620 1.00 21.14 H new ATOM 0 HH12 ARG B 243 -3.037 -13.317 -0.614 1.00 21.14 H new ATOM 0 HH21 ARG B 243 -0.161 -12.609 1.195 1.00 53.43 H new ATOM 0 HH22 ARG B 243 -1.127 -13.853 0.395 1.00 53.43 H new ATOM 1538 N ARG B 244 0.106 -7.440 3.744 1.00 42.15 N ATOM 1539 CA ARG B 244 0.059 -7.799 5.169 1.00 21.01 C ATOM 1540 C ARG B 244 0.179 -6.556 6.077 1.00 74.41 C ATOM 1541 O ARG B 244 -0.162 -6.609 7.259 1.00 14.13 O ATOM 1542 CB ARG B 244 1.151 -8.824 5.515 1.00 71.53 C ATOM 1543 CG ARG B 244 2.571 -8.267 5.499 1.00 11.22 C ATOM 1544 CD ARG B 244 3.601 -9.320 5.900 1.00 44.34 C ATOM 1545 NE ARG B 244 3.254 -9.975 7.159 1.00 20.15 N ATOM 1546 CZ ARG B 244 3.522 -9.495 8.344 1.00 62.31 C ATOM 1547 NH1 ARG B 244 4.176 -8.384 8.481 1.00 23.31 N ATOM 1548 NH2 ARG B 244 3.144 -10.137 9.396 1.00 43.03 N ATOM 0 H ARG B 244 0.938 -7.766 3.252 1.00 42.15 H new ATOM 0 HA ARG B 244 -0.915 -8.253 5.354 1.00 21.01 H new ATOM 0 HB2 ARG B 244 0.946 -9.234 6.504 1.00 71.53 H new ATOM 0 HB3 ARG B 244 1.091 -9.652 4.808 1.00 71.53 H new ATOM 0 HG2 ARG B 244 2.803 -7.894 4.502 1.00 11.22 H new ATOM 0 HG3 ARG B 244 2.636 -7.418 6.180 1.00 11.22 H new ATOM 0 HD2 ARG B 244 3.680 -10.069 5.112 1.00 44.34 H new ATOM 0 HD3 ARG B 244 4.581 -8.851 5.993 1.00 44.34 H new ATOM 0 HE ARG B 244 2.768 -10.870 7.109 1.00 20.15 H new ATOM 0 HH11 ARG B 244 4.489 -7.872 7.657 1.00 23.31 H new ATOM 0 HH12 ARG B 244 4.377 -8.022 9.413 1.00 23.31 H new ATOM 0 HH21 ARG B 244 2.637 -11.017 9.302 1.00 43.03 H new ATOM 0 HH22 ARG B 244 3.352 -9.765 10.323 1.00 43.03 H new ATOM 1562 N ILE B 245 0.672 -5.447 5.524 1.00 64.43 N ATOM 1563 CA ILE B 245 0.736 -4.177 6.262 1.00 11.43 C ATOM 1564 C ILE B 245 -0.628 -3.461 6.258 1.00 75.14 C ATOM 1565 O ILE B 245 -1.160 -3.112 7.313 1.00 40.31 O ATOM 1566 CB ILE B 245 1.815 -3.227 5.675 1.00 33.54 C ATOM 1567 CG1 ILE B 245 3.218 -3.845 5.821 1.00 71.33 C ATOM 1568 CG2 ILE B 245 1.755 -1.851 6.346 1.00 44.41 C ATOM 1569 CD1 ILE B 245 4.328 -2.992 5.233 1.00 25.43 C ATOM 0 H ILE B 245 1.033 -5.398 4.571 1.00 64.43 H new ATOM 0 HA ILE B 245 1.008 -4.424 7.288 1.00 11.43 H new ATOM 0 HB ILE B 245 1.609 -3.093 4.613 1.00 33.54 H new ATOM 0 HG12 ILE B 245 3.423 -4.012 6.878 1.00 71.33 H new ATOM 0 HG13 ILE B 245 3.227 -4.821 5.336 1.00 71.33 H new ATOM 0 HG21 ILE B 245 2.520 -1.204 5.918 1.00 44.41 H new ATOM 0 HG22 ILE B 245 0.772 -1.409 6.182 1.00 44.41 H new ATOM 0 HG23 ILE B 245 1.930 -1.960 7.416 1.00 44.41 H new ATOM 0 HD11 ILE B 245 5.286 -3.493 5.374 1.00 25.43 H new ATOM 0 HD12 ILE B 245 4.149 -2.845 4.168 1.00 25.43 H new ATOM 0 HD13 ILE B 245 4.348 -2.024 5.734 1.00 25.43 H new ATOM 1581 N ILE B 246 -1.193 -3.245 5.066 1.00 62.32 N ATOM 1582 CA ILE B 246 -2.499 -2.582 4.943 1.00 71.52 C ATOM 1583 C ILE B 246 -3.615 -3.422 5.584 1.00 3.34 C ATOM 1584 O ILE B 246 -4.570 -2.877 6.143 1.00 63.12 O ATOM 1585 CB ILE B 246 -2.857 -2.278 3.462 1.00 40.44 C ATOM 1586 CG1 ILE B 246 -2.955 -3.577 2.639 1.00 43.01 C ATOM 1587 CG2 ILE B 246 -1.826 -1.328 2.852 1.00 72.00 C ATOM 1588 CD1 ILE B 246 -3.320 -3.357 1.185 1.00 43.23 C ATOM 0 H ILE B 246 -0.772 -3.517 4.178 1.00 62.32 H new ATOM 0 HA ILE B 246 -2.419 -1.635 5.477 1.00 71.52 H new ATOM 0 HB ILE B 246 -3.833 -1.794 3.439 1.00 40.44 H new ATOM 0 HG12 ILE B 246 -2.000 -4.100 2.688 1.00 43.01 H new ATOM 0 HG13 ILE B 246 -3.699 -4.229 3.096 1.00 43.01 H new ATOM 0 HG21 ILE B 246 -2.089 -1.123 1.814 1.00 72.00 H new ATOM 0 HG22 ILE B 246 -1.814 -0.394 3.414 1.00 72.00 H new ATOM 0 HG23 ILE B 246 -0.839 -1.788 2.892 1.00 72.00 H new ATOM 0 HD11 ILE B 246 -3.369 -4.318 0.673 1.00 43.23 H new ATOM 0 HD12 ILE B 246 -4.290 -2.863 1.124 1.00 43.23 H new ATOM 0 HD13 ILE B 246 -2.564 -2.731 0.711 1.00 43.23 H new ATOM 1600 N LEU B 247 -3.478 -4.746 5.516 1.00 13.33 N ATOM 1601 CA LEU B 247 -4.433 -5.664 6.148 1.00 60.13 C ATOM 1602 C LEU B 247 -4.620 -5.326 7.637 1.00 71.22 C ATOM 1603 O LEU B 247 -5.737 -5.060 8.089 1.00 74.12 O ATOM 1604 CB LEU B 247 -3.955 -7.112 5.989 1.00 1.42 C ATOM 1605 CG LEU B 247 -4.887 -8.190 6.568 1.00 44.43 C ATOM 1606 CD1 LEU B 247 -6.256 -8.150 5.890 1.00 52.23 C ATOM 1607 CD2 LEU B 247 -4.253 -9.572 6.428 1.00 34.04 C ATOM 0 H LEU B 247 -2.712 -5.211 5.028 1.00 13.33 H new ATOM 0 HA LEU B 247 -5.396 -5.550 5.651 1.00 60.13 H new ATOM 0 HB2 LEU B 247 -3.812 -7.313 4.927 1.00 1.42 H new ATOM 0 HB3 LEU B 247 -2.979 -7.207 6.466 1.00 1.42 H new ATOM 0 HG LEU B 247 -5.033 -7.983 7.628 1.00 44.43 H new ATOM 0 HD11 LEU B 247 -6.896 -8.922 6.317 1.00 52.23 H new ATOM 0 HD12 LEU B 247 -6.712 -7.172 6.048 1.00 52.23 H new ATOM 0 HD13 LEU B 247 -6.138 -8.327 4.821 1.00 52.23 H new ATOM 0 HD21 LEU B 247 -4.925 -10.324 6.842 1.00 34.04 H new ATOM 0 HD22 LEU B 247 -4.075 -9.786 5.374 1.00 34.04 H new ATOM 0 HD23 LEU B 247 -3.306 -9.594 6.968 1.00 34.04 H new ATOM 1619 N ASN B 248 -3.510 -5.292 8.381 1.00 3.30 N ATOM 1620 CA ASN B 248 -3.529 -4.952 9.812 1.00 13.32 C ATOM 1621 C ASN B 248 -4.018 -3.513 10.067 1.00 12.41 C ATOM 1622 O ASN B 248 -4.172 -3.100 11.216 1.00 10.30 O ATOM 1623 CB ASN B 248 -2.133 -5.140 10.421 1.00 31.21 C ATOM 1624 CG ASN B 248 -1.702 -6.594 10.474 1.00 73.13 C ATOM 1625 OD1 ASN B 248 -2.088 -7.407 9.641 1.00 34.44 O ATOM 1626 ND2 ASN B 248 -0.900 -6.937 11.463 1.00 40.25 N ATOM 0 H ASN B 248 -2.580 -5.497 8.015 1.00 3.30 H new ATOM 0 HA ASN B 248 -4.236 -5.629 10.291 1.00 13.32 H new ATOM 0 HB2 ASN B 248 -1.408 -4.573 9.837 1.00 31.21 H new ATOM 0 HB3 ASN B 248 -2.124 -4.727 11.430 1.00 31.21 H new ATOM 0 HD21 ASN B 248 -0.583 -7.902 11.551 1.00 40.25 H new ATOM 0 HD22 ASN B 248 -0.597 -6.237 12.140 1.00 40.25 H new ATOM 1633 N HIS B 249 -4.240 -2.748 9.000 1.00 34.24 N ATOM 1634 CA HIS B 249 -4.810 -1.404 9.120 1.00 64.32 C ATOM 1635 C HIS B 249 -6.335 -1.447 8.926 1.00 0.14 C ATOM 1636 O HIS B 249 -7.081 -0.846 9.691 1.00 13.54 O ATOM 1637 CB HIS B 249 -4.166 -0.455 8.100 1.00 34.30 C ATOM 1638 CG HIS B 249 -4.442 0.998 8.358 1.00 63.34 C ATOM 1639 ND1 HIS B 249 -3.623 1.782 9.138 1.00 31.42 N ATOM 1640 CD2 HIS B 249 -5.430 1.820 7.921 1.00 52.23 C ATOM 1641 CE1 HIS B 249 -4.085 3.013 9.170 1.00 1.52 C ATOM 1642 NE2 HIS B 249 -5.178 3.065 8.442 1.00 50.31 N ATOM 0 H HIS B 249 -4.035 -3.034 8.043 1.00 34.24 H new ATOM 0 HA HIS B 249 -4.600 -1.028 10.122 1.00 64.32 H new ATOM 0 HB2 HIS B 249 -3.088 -0.615 8.101 1.00 34.30 H new ATOM 0 HB3 HIS B 249 -4.526 -0.711 7.103 1.00 34.30 H new ATOM 0 HD2 HIS B 249 -6.258 1.546 7.284 1.00 52.23 H new ATOM 0 HE1 HIS B 249 -3.642 3.841 9.704 1.00 1.52 H new ATOM 0 HE2 HIS B 249 -5.748 3.897 8.289 1.00 50.31 H new ATOM 1651 N LEU B 250 -6.795 -2.174 7.907 1.00 71.11 N ATOM 1652 CA LEU B 250 -8.238 -2.311 7.646 1.00 24.32 C ATOM 1653 C LEU B 250 -8.952 -3.048 8.794 1.00 22.45 C ATOM 1654 O LEU B 250 -10.063 -2.679 9.185 1.00 4.53 O ATOM 1655 CB LEU B 250 -8.491 -3.035 6.308 1.00 32.10 C ATOM 1656 CG LEU B 250 -8.395 -2.161 5.040 1.00 12.20 C ATOM 1657 CD1 LEU B 250 -9.448 -1.053 5.071 1.00 65.01 C ATOM 1658 CD2 LEU B 250 -6.994 -1.572 4.878 1.00 11.42 C ATOM 0 H LEU B 250 -6.198 -2.676 7.250 1.00 71.11 H new ATOM 0 HA LEU B 250 -8.652 -1.305 7.581 1.00 24.32 H new ATOM 0 HB2 LEU B 250 -7.775 -3.852 6.218 1.00 32.10 H new ATOM 0 HB3 LEU B 250 -9.484 -3.484 6.342 1.00 32.10 H new ATOM 0 HG LEU B 250 -8.589 -2.798 4.177 1.00 12.20 H new ATOM 0 HD11 LEU B 250 -9.365 -0.447 4.169 1.00 65.01 H new ATOM 0 HD12 LEU B 250 -10.442 -1.497 5.120 1.00 65.01 H new ATOM 0 HD13 LEU B 250 -9.289 -0.424 5.947 1.00 65.01 H new ATOM 0 HD21 LEU B 250 -6.958 -0.961 3.976 1.00 11.42 H new ATOM 0 HD22 LEU B 250 -6.757 -0.954 5.744 1.00 11.42 H new ATOM 0 HD23 LEU B 250 -6.267 -2.380 4.798 1.00 11.42 H new ATOM 1670 N GLU B 251 -8.312 -4.082 9.341 1.00 52.42 N ATOM 1671 CA GLU B 251 -8.882 -4.831 10.472 1.00 51.12 C ATOM 1672 C GLU B 251 -8.635 -4.118 11.817 1.00 4.11 C ATOM 1673 O GLU B 251 -8.897 -4.681 12.883 1.00 32.53 O ATOM 1674 CB GLU B 251 -8.299 -6.255 10.527 1.00 31.20 C ATOM 1675 CG GLU B 251 -6.785 -6.298 10.724 1.00 32.13 C ATOM 1676 CD GLU B 251 -6.255 -7.703 10.973 1.00 12.02 C ATOM 1677 OE1 GLU B 251 -6.121 -8.479 10.004 1.00 33.31 O ATOM 1678 OE2 GLU B 251 -5.979 -8.040 12.146 1.00 72.12 O ATOM 0 H GLU B 251 -7.404 -4.422 9.025 1.00 52.42 H new ATOM 0 HA GLU B 251 -9.959 -4.885 10.310 1.00 51.12 H new ATOM 0 HB2 GLU B 251 -8.777 -6.801 11.340 1.00 31.20 H new ATOM 0 HB3 GLU B 251 -8.550 -6.776 9.603 1.00 31.20 H new ATOM 0 HG2 GLU B 251 -6.298 -5.883 9.841 1.00 32.13 H new ATOM 0 HG3 GLU B 251 -6.516 -5.660 11.566 1.00 32.13 H new ATOM 1685 N ASP B 252 -8.148 -2.876 11.765 1.00 40.15 N ATOM 1686 CA ASP B 252 -7.811 -2.121 12.979 1.00 12.01 C ATOM 1687 C ASP B 252 -8.271 -0.650 12.874 1.00 70.34 C ATOM 1688 O ASP B 252 -9.243 -0.243 13.520 1.00 72.01 O ATOM 1689 CB ASP B 252 -6.297 -2.203 13.221 1.00 15.25 C ATOM 1690 CG ASP B 252 -5.888 -1.684 14.588 1.00 42.15 C ATOM 1691 OD1 ASP B 252 -5.650 -0.469 14.726 1.00 73.40 O ATOM 1692 OD2 ASP B 252 -5.791 -2.498 15.531 1.00 54.43 O ATOM 0 H ASP B 252 -7.977 -2.370 10.896 1.00 40.15 H new ATOM 0 HA ASP B 252 -8.338 -2.563 13.825 1.00 12.01 H new ATOM 0 HB2 ASP B 252 -5.974 -3.239 13.120 1.00 15.25 H new ATOM 0 HB3 ASP B 252 -5.780 -1.631 12.451 1.00 15.25 H new ATOM 1697 N GLU B 253 -7.573 0.136 12.051 1.00 34.14 N ATOM 1698 CA GLU B 253 -7.898 1.558 11.848 1.00 71.34 C ATOM 1699 C GLU B 253 -8.798 1.770 10.605 1.00 14.53 C ATOM 1700 O GLU B 253 -8.277 2.178 9.541 1.00 37.68 O ATOM 1701 CB GLU B 253 -6.604 2.379 11.696 1.00 23.23 C ATOM 1702 CG GLU B 253 -5.691 2.351 12.919 1.00 42.02 C ATOM 1703 CD GLU B 253 -4.420 3.162 12.710 1.00 64.14 C ATOM 1704 OE1 GLU B 253 -4.504 4.411 12.683 1.00 40.12 O ATOM 1705 OE2 GLU B 253 -3.333 2.559 12.551 1.00 52.12 O ATOM 1706 OXT GLU B 253 -10.027 1.540 10.697 1.00 37.68 O ATOM 0 H GLU B 253 -6.772 -0.188 11.509 1.00 34.14 H new ATOM 0 HA GLU B 253 -8.449 1.898 12.725 1.00 71.34 H new ATOM 0 HB2 GLU B 253 -6.050 2.004 10.835 1.00 23.23 H new ATOM 0 HB3 GLU B 253 -6.868 3.414 11.479 1.00 23.23 H new ATOM 0 HG2 GLU B 253 -6.231 2.742 13.782 1.00 42.02 H new ATOM 0 HG3 GLU B 253 -5.427 1.319 13.149 1.00 42.02 H new TER 1713 GLU B 253