USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1013 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 TYR OH : rot -87:sc= 0.932 USER MOD Set 1.2: A 121 CYS SG : rot 78:sc= 0.901 USER MOD Set 2.1: A 6 GLN : amide:sc= 1.33 K(o=3.1,f=-0.99) USER MOD Set 2.2: A 92 THR OG1 : rot -126:sc= 1.26 USER MOD Set 2.3: A 117 SER OG : rot 180:sc= 0.552 USER MOD Set 3.1: A 29 ASN : amide:sc= 1.04 K(o=2.2,f=-3.2!) USER MOD Set 3.2: A 70 SER OG : rot -69:sc= 1.19 USER MOD Set 4.1: A 47 THR OG1 : rot -71:sc= 1.59 USER MOD Set 4.2: A 86 HIS : no HD1:sc= 0.944 K(o=2.5,f=-2!) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0178 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0137) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -137:sc= 1.02 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= 0.903 K(o=0.9,f=-4.6!) USER MOD Single : A 36 SER OG : rot 180:sc= 0.0087 USER MOD Single : A 39 LYS NZ :NH3+ -141:sc= 1.27 (180deg=0.596) USER MOD Single : A 41 CYS SG : rot -152:sc= -1.67 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 159:sc= 1.08 (180deg=0.806) USER MOD Single : A 46 THR OG1 : rot 120:sc= -0.0223 USER MOD Single : A 53 CYS SG : rot 170:sc= -1.2 USER MOD Single : A 57 ASN : amide:sc= 0.453 K(o=0.45,f=-0.058) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 143:sc= -0.0776 (180deg=-0.583) USER MOD Single : A 74 GLN : amide:sc= 0.192 X(o=0.19,f=-0.068) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot -163:sc= 1.28 USER MOD Single : A 85 LYS NZ :NH3+ -178:sc= 1.04 (180deg=1.04) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0.0962 X(o=0.096,f=0) USER MOD Single : A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 MET CE :methyl -177:sc= 0 (180deg=-0.00705) USER MOD ----------------------------------------------------------------- ATOM 63 N GLN A 6 7.713 27.903 1.224 1.00 0.00 N ATOM 64 CA GLN A 6 6.748 28.272 0.185 1.00 0.00 C ATOM 65 C GLN A 6 6.679 29.768 -0.159 1.00 0.00 C ATOM 66 O GLN A 6 7.089 30.639 0.610 1.00 0.00 O ATOM 67 CB GLN A 6 5.377 27.671 0.524 1.00 0.00 C ATOM 68 CG GLN A 6 4.555 28.489 1.528 1.00 0.00 C ATOM 69 CD GLN A 6 3.525 27.600 2.206 1.00 0.00 C ATOM 70 OE1 GLN A 6 2.414 27.411 1.737 1.00 0.00 O ATOM 71 NE2 GLN A 6 3.896 26.950 3.280 1.00 0.00 N ATOM 0 HA GLN A 6 7.116 27.837 -0.744 1.00 0.00 H new ATOM 0 HB2 GLN A 6 4.803 27.566 -0.396 1.00 0.00 H new ATOM 0 HB3 GLN A 6 5.523 26.668 0.925 1.00 0.00 H new ATOM 0 HG2 GLN A 6 5.214 28.931 2.275 1.00 0.00 H new ATOM 0 HG3 GLN A 6 4.056 29.312 1.017 1.00 0.00 H new ATOM 0 HE21 GLN A 6 4.824 27.105 3.675 1.00 0.00 H new ATOM 0 HE22 GLN A 6 3.258 26.288 3.722 1.00 0.00 H new ATOM 80 N ILE A 7 6.093 30.046 -1.329 1.00 0.00 N ATOM 81 CA ILE A 7 5.888 31.401 -1.868 1.00 0.00 C ATOM 82 C ILE A 7 4.820 32.218 -1.114 1.00 0.00 C ATOM 83 O ILE A 7 4.924 33.441 -1.052 1.00 0.00 O ATOM 84 CB ILE A 7 5.578 31.297 -3.379 1.00 0.00 C ATOM 85 CG1 ILE A 7 5.614 32.692 -4.039 1.00 0.00 C ATOM 86 CG2 ILE A 7 4.229 30.588 -3.640 1.00 0.00 C ATOM 87 CD1 ILE A 7 5.754 32.648 -5.561 1.00 0.00 C ATOM 0 H ILE A 7 5.737 29.316 -1.947 1.00 0.00 H new ATOM 0 HA ILE A 7 6.811 31.961 -1.718 1.00 0.00 H new ATOM 0 HB ILE A 7 6.355 30.683 -3.835 1.00 0.00 H new ATOM 0 HG12 ILE A 7 4.701 33.229 -3.782 1.00 0.00 H new ATOM 0 HG13 ILE A 7 6.446 33.260 -3.623 1.00 0.00 H new ATOM 0 HG21 ILE A 7 4.048 30.535 -4.713 1.00 0.00 H new ATOM 0 HG22 ILE A 7 4.262 29.580 -3.227 1.00 0.00 H new ATOM 0 HG23 ILE A 7 3.425 31.149 -3.164 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.772 33.664 -5.954 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.681 32.140 -5.827 1.00 0.00 H new ATOM 0 HD13 ILE A 7 4.909 32.109 -5.989 1.00 0.00 H new ATOM 99 N LEU A 8 3.802 31.563 -0.535 1.00 0.00 N ATOM 100 CA LEU A 8 2.739 32.251 0.212 1.00 0.00 C ATOM 101 C LEU A 8 3.279 33.010 1.434 1.00 0.00 C ATOM 102 O LEU A 8 4.174 32.541 2.141 1.00 0.00 O ATOM 103 CB LEU A 8 1.647 31.277 0.707 1.00 0.00 C ATOM 104 CG LEU A 8 0.771 30.588 -0.352 1.00 0.00 C ATOM 105 CD1 LEU A 8 -0.374 29.870 0.356 1.00 0.00 C ATOM 106 CD2 LEU A 8 0.137 31.588 -1.310 1.00 0.00 C ATOM 0 H LEU A 8 3.693 30.549 -0.571 1.00 0.00 H new ATOM 0 HA LEU A 8 2.309 32.958 -0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 8 2.133 30.500 1.297 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.989 31.825 1.381 1.00 0.00 H new ATOM 0 HG LEU A 8 1.411 29.908 -0.914 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.005 29.376 -0.382 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.032 29.127 1.042 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.967 30.594 0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.473 31.056 -2.040 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.490 32.281 -0.750 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.920 32.144 -1.827 1.00 0.00 H new ATOM 118 N VAL A 9 2.664 34.160 1.710 1.00 0.00 N ATOM 119 CA VAL A 9 2.856 34.930 2.945 1.00 0.00 C ATOM 120 C VAL A 9 1.960 34.285 4.000 1.00 0.00 C ATOM 121 O VAL A 9 0.787 34.045 3.712 1.00 0.00 O ATOM 122 CB VAL A 9 2.454 36.408 2.762 1.00 0.00 C ATOM 123 CG1 VAL A 9 2.849 37.241 3.988 1.00 0.00 C ATOM 124 CG2 VAL A 9 3.092 37.040 1.521 1.00 0.00 C ATOM 0 H VAL A 9 2.002 34.595 1.067 1.00 0.00 H new ATOM 0 HA VAL A 9 3.907 34.918 3.234 1.00 0.00 H new ATOM 0 HB VAL A 9 1.371 36.411 2.637 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.554 38.279 3.833 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.346 36.849 4.872 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.928 37.188 4.132 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.776 38.080 1.439 1.00 0.00 H new ATOM 0 HG22 VAL A 9 4.178 36.996 1.608 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.777 36.494 0.632 1.00 0.00 H new ATOM 134 N LEU A 10 2.473 34.021 5.204 1.00 0.00 N ATOM 135 CA LEU A 10 1.662 33.569 6.341 1.00 0.00 C ATOM 136 C LEU A 10 1.630 34.662 7.427 1.00 0.00 C ATOM 137 O LEU A 10 2.557 35.467 7.530 1.00 0.00 O ATOM 138 CB LEU A 10 2.069 32.173 6.885 1.00 0.00 C ATOM 139 CG LEU A 10 2.396 31.075 5.841 1.00 0.00 C ATOM 140 CD1 LEU A 10 3.846 31.141 5.364 1.00 0.00 C ATOM 141 CD2 LEU A 10 2.213 29.687 6.451 1.00 0.00 C ATOM 0 H LEU A 10 3.465 34.114 5.420 1.00 0.00 H new ATOM 0 HA LEU A 10 0.644 33.418 5.981 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.942 32.301 7.525 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.260 31.808 7.518 1.00 0.00 H new ATOM 0 HG LEU A 10 1.717 31.248 5.006 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.025 30.352 4.634 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.034 32.111 4.903 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.515 31.008 6.214 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.447 28.928 5.705 1.00 0.00 H new ATOM 0 HD22 LEU A 10 2.881 29.574 7.305 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.181 29.567 6.779 1.00 0.00 H new ATOM 153 N ASP A 11 0.567 34.713 8.226 1.00 0.00 N ATOM 154 CA ASP A 11 0.322 35.768 9.216 1.00 0.00 C ATOM 155 C ASP A 11 -0.427 35.208 10.441 1.00 0.00 C ATOM 156 O ASP A 11 -1.628 34.930 10.333 1.00 0.00 O ATOM 157 CB ASP A 11 -0.517 36.890 8.584 1.00 0.00 C ATOM 158 CG ASP A 11 -0.641 38.119 9.502 1.00 0.00 C ATOM 159 OD1 ASP A 11 0.325 38.439 10.236 1.00 0.00 O ATOM 160 OD2 ASP A 11 -1.704 38.785 9.479 1.00 0.00 O ATOM 0 H ASP A 11 -0.168 34.006 8.205 1.00 0.00 H new ATOM 0 HA ASP A 11 1.286 36.161 9.540 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -0.064 37.190 7.639 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -1.512 36.510 8.354 1.00 0.00 H new ATOM 165 N PRO A 12 0.231 35.037 11.601 1.00 0.00 N ATOM 166 CA PRO A 12 1.662 35.236 11.854 1.00 0.00 C ATOM 167 C PRO A 12 2.585 34.287 11.039 1.00 0.00 C ATOM 168 O PRO A 12 2.260 33.109 10.877 1.00 0.00 O ATOM 169 CB PRO A 12 1.837 35.025 13.364 1.00 0.00 C ATOM 170 CG PRO A 12 0.654 34.134 13.746 1.00 0.00 C ATOM 171 CD PRO A 12 -0.446 34.638 12.821 1.00 0.00 C ATOM 0 HA PRO A 12 1.964 36.232 11.530 1.00 0.00 H new ATOM 0 HB2 PRO A 12 2.789 34.546 13.594 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.817 35.971 13.905 1.00 0.00 H new ATOM 0 HG2 PRO A 12 0.871 33.078 13.582 1.00 0.00 H new ATOM 0 HG3 PRO A 12 0.384 34.245 14.796 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.183 33.859 12.625 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -0.980 35.477 13.266 1.00 0.00 H new ATOM 179 N PRO A 13 3.741 34.768 10.532 1.00 0.00 N ATOM 180 CA PRO A 13 4.652 33.990 9.676 1.00 0.00 C ATOM 181 C PRO A 13 5.534 32.982 10.419 1.00 0.00 C ATOM 182 O PRO A 13 5.901 31.945 9.862 1.00 0.00 O ATOM 183 CB PRO A 13 5.539 35.031 8.984 1.00 0.00 C ATOM 184 CG PRO A 13 5.532 36.227 9.932 1.00 0.00 C ATOM 185 CD PRO A 13 4.128 36.173 10.525 1.00 0.00 C ATOM 0 HA PRO A 13 4.058 33.381 8.994 1.00 0.00 H new ATOM 0 HB2 PRO A 13 6.549 34.652 8.830 1.00 0.00 H new ATOM 0 HB3 PRO A 13 5.146 35.299 8.003 1.00 0.00 H new ATOM 0 HG2 PRO A 13 6.300 36.140 10.700 1.00 0.00 H new ATOM 0 HG3 PRO A 13 5.714 37.163 9.405 1.00 0.00 H new ATOM 0 HD2 PRO A 13 4.116 36.585 11.534 1.00 0.00 H new ATOM 0 HD3 PRO A 13 3.432 36.765 9.931 1.00 0.00 H new ATOM 193 N THR A 14 5.918 33.308 11.653 1.00 0.00 N ATOM 194 CA THR A 14 6.904 32.553 12.445 1.00 0.00 C ATOM 195 C THR A 14 6.285 31.414 13.255 1.00 0.00 C ATOM 196 O THR A 14 6.672 30.259 13.082 1.00 0.00 O ATOM 197 CB THR A 14 7.683 33.482 13.386 1.00 0.00 C ATOM 198 OG1 THR A 14 6.804 34.377 14.041 1.00 0.00 O ATOM 199 CG2 THR A 14 8.708 34.325 12.626 1.00 0.00 C ATOM 0 H THR A 14 5.548 34.121 12.145 1.00 0.00 H new ATOM 0 HA THR A 14 7.583 32.106 11.719 1.00 0.00 H new ATOM 0 HB THR A 14 8.192 32.840 14.105 1.00 0.00 H new ATOM 0 HG1 THR A 14 7.317 34.961 14.638 1.00 0.00 H new ATOM 0 HG21 THR A 14 9.239 34.970 13.326 1.00 0.00 H new ATOM 0 HG22 THR A 14 9.420 33.668 12.125 1.00 0.00 H new ATOM 0 HG23 THR A 14 8.196 34.938 11.884 1.00 0.00 H new ATOM 207 N ASP A 15 5.318 31.728 14.123 1.00 0.00 N ATOM 208 CA ASP A 15 4.683 30.800 15.068 1.00 0.00 C ATOM 209 C ASP A 15 3.190 31.122 15.262 1.00 0.00 C ATOM 210 O ASP A 15 2.778 32.277 15.136 1.00 0.00 O ATOM 211 CB ASP A 15 5.412 30.863 16.418 1.00 0.00 C ATOM 212 CG ASP A 15 6.878 30.407 16.315 1.00 0.00 C ATOM 213 OD1 ASP A 15 7.124 29.218 16.001 1.00 0.00 O ATOM 214 OD2 ASP A 15 7.786 31.236 16.575 1.00 0.00 O ATOM 0 H ASP A 15 4.940 32.673 14.190 1.00 0.00 H new ATOM 0 HA ASP A 15 4.754 29.794 14.655 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.378 31.884 16.799 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.889 30.236 17.140 1.00 0.00 H new ATOM 219 N LEU A 16 2.385 30.126 15.645 1.00 0.00 N ATOM 220 CA LEU A 16 0.973 30.295 16.006 1.00 0.00 C ATOM 221 C LEU A 16 0.888 30.638 17.496 1.00 0.00 C ATOM 222 O LEU A 16 1.422 29.917 18.341 1.00 0.00 O ATOM 223 CB LEU A 16 0.183 28.995 15.740 1.00 0.00 C ATOM 224 CG LEU A 16 -0.436 28.799 14.345 1.00 0.00 C ATOM 225 CD1 LEU A 16 -1.563 29.787 14.055 1.00 0.00 C ATOM 226 CD2 LEU A 16 0.589 28.879 13.221 1.00 0.00 C ATOM 0 H LEU A 16 2.703 29.159 15.714 1.00 0.00 H new ATOM 0 HA LEU A 16 0.542 31.093 15.402 1.00 0.00 H new ATOM 0 HB2 LEU A 16 0.850 28.154 15.931 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.621 28.937 16.473 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.847 27.790 14.371 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.962 29.602 13.058 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.356 29.661 14.792 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.177 30.805 14.108 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.090 28.733 12.263 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.069 29.858 13.235 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.342 28.104 13.360 1.00 0.00 H new ATOM 238 N LYS A 17 0.183 31.722 17.827 1.00 0.00 N ATOM 239 CA LYS A 17 0.007 32.186 19.207 1.00 0.00 C ATOM 240 C LYS A 17 -1.379 31.824 19.719 1.00 0.00 C ATOM 241 O LYS A 17 -2.394 32.099 19.075 1.00 0.00 O ATOM 242 CB LYS A 17 0.308 33.689 19.331 1.00 0.00 C ATOM 243 CG LYS A 17 1.767 34.018 18.975 1.00 0.00 C ATOM 244 CD LYS A 17 2.076 35.501 19.215 1.00 0.00 C ATOM 245 CE LYS A 17 3.542 35.799 18.873 1.00 0.00 C ATOM 246 NZ LYS A 17 3.884 37.225 19.124 1.00 0.00 N ATOM 0 H LYS A 17 -0.287 32.309 17.138 1.00 0.00 H new ATOM 0 HA LYS A 17 0.729 31.673 19.842 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.360 34.247 18.675 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.101 34.017 20.350 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.438 33.402 19.574 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.954 33.769 17.930 1.00 0.00 H new ATOM 0 HD2 LYS A 17 1.419 36.120 18.604 1.00 0.00 H new ATOM 0 HD3 LYS A 17 1.878 35.757 20.256 1.00 0.00 H new ATOM 0 HE2 LYS A 17 4.193 35.158 19.468 1.00 0.00 H new ATOM 0 HE3 LYS A 17 3.728 35.558 17.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.882 37.390 18.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 3.280 37.835 18.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 3.730 37.447 20.128 1.00 0.00 H new ATOM 260 N PHE A 18 -1.405 31.223 20.901 1.00 0.00 N ATOM 261 CA PHE A 18 -2.605 30.845 21.629 1.00 0.00 C ATOM 262 C PHE A 18 -2.613 31.589 22.967 1.00 0.00 C ATOM 263 O PHE A 18 -1.871 31.247 23.890 1.00 0.00 O ATOM 264 CB PHE A 18 -2.613 29.316 21.775 1.00 0.00 C ATOM 265 CG PHE A 18 -2.644 28.598 20.443 1.00 0.00 C ATOM 266 CD1 PHE A 18 -3.878 28.484 19.782 1.00 0.00 C ATOM 267 CD2 PHE A 18 -1.470 28.114 19.823 1.00 0.00 C ATOM 268 CE1 PHE A 18 -3.955 27.893 18.516 1.00 0.00 C ATOM 269 CE2 PHE A 18 -1.553 27.504 18.562 1.00 0.00 C ATOM 270 CZ PHE A 18 -2.787 27.408 17.897 1.00 0.00 C ATOM 0 H PHE A 18 -0.550 30.975 21.400 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.519 31.125 21.104 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.728 29.004 22.330 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.480 29.017 22.364 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.775 28.856 20.255 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.515 28.213 20.317 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.908 27.809 18.015 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -0.662 27.106 18.099 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.839 26.964 16.914 1.00 0.00 H new ATOM 280 N LYS A 19 -3.452 32.624 23.063 1.00 0.00 N ATOM 281 CA LYS A 19 -3.646 33.421 24.282 1.00 0.00 C ATOM 282 C LYS A 19 -5.039 33.166 24.842 1.00 0.00 C ATOM 283 O LYS A 19 -6.033 33.317 24.129 1.00 0.00 O ATOM 284 CB LYS A 19 -3.333 34.899 23.997 1.00 0.00 C ATOM 285 CG LYS A 19 -3.195 35.777 25.255 1.00 0.00 C ATOM 286 CD LYS A 19 -4.525 36.251 25.866 1.00 0.00 C ATOM 287 CE LYS A 19 -4.333 37.412 26.857 1.00 0.00 C ATOM 288 NZ LYS A 19 -4.024 38.705 26.179 1.00 0.00 N ATOM 0 H LYS A 19 -4.027 32.939 22.282 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.948 33.118 25.062 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.407 34.957 23.425 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.123 35.310 23.368 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.644 35.218 26.011 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.595 36.652 25.005 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -5.197 36.566 25.068 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.005 35.416 26.377 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -5.237 37.527 27.454 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -3.525 37.166 27.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -4.005 39.470 26.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -3.096 38.640 25.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -4.755 38.907 25.467 1.00 0.00 H new ATOM 302 N GLY A 20 -5.112 32.766 26.107 1.00 0.00 N ATOM 303 CA GLY A 20 -6.346 32.322 26.738 1.00 0.00 C ATOM 304 C GLY A 20 -6.054 31.482 27.979 1.00 0.00 C ATOM 305 O GLY A 20 -4.897 31.191 28.278 1.00 0.00 O ATOM 0 H GLY A 20 -4.304 32.741 26.729 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -6.949 33.187 27.014 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -6.932 31.738 26.028 1.00 0.00 H new ATOM 309 N PRO A 21 -7.091 31.112 28.742 1.00 0.00 N ATOM 310 CA PRO A 21 -6.903 30.484 30.054 1.00 0.00 C ATOM 311 C PRO A 21 -6.556 28.997 30.067 1.00 0.00 C ATOM 312 O PRO A 21 -6.085 28.409 31.041 1.00 0.00 O ATOM 313 CB PRO A 21 -8.249 30.688 30.724 1.00 0.00 C ATOM 314 CG PRO A 21 -9.275 30.767 29.593 1.00 0.00 C ATOM 315 CD PRO A 21 -8.486 31.468 28.500 1.00 0.00 C ATOM 0 HA PRO A 21 -6.039 30.935 30.542 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.477 29.864 31.401 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -8.254 31.601 31.320 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -9.616 29.780 29.281 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -10.160 31.332 29.884 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.809 31.142 27.511 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -8.629 32.548 28.542 1.00 0.00 H new ATOM 323 N PHE A 22 -6.924 28.433 28.939 1.00 0.00 N ATOM 324 CA PHE A 22 -6.938 27.040 28.510 1.00 0.00 C ATOM 325 C PHE A 22 -7.945 26.169 29.273 1.00 0.00 C ATOM 326 O PHE A 22 -7.888 24.945 29.237 1.00 0.00 O ATOM 327 CB PHE A 22 -5.503 26.520 28.459 1.00 0.00 C ATOM 328 CG PHE A 22 -4.531 27.429 27.722 1.00 0.00 C ATOM 329 CD1 PHE A 22 -4.705 27.698 26.351 1.00 0.00 C ATOM 330 CD2 PHE A 22 -3.471 28.040 28.416 1.00 0.00 C ATOM 331 CE1 PHE A 22 -3.760 28.485 25.661 1.00 0.00 C ATOM 332 CE2 PHE A 22 -2.546 28.850 27.736 1.00 0.00 C ATOM 333 CZ PHE A 22 -2.675 29.048 26.350 1.00 0.00 C ATOM 0 H PHE A 22 -7.273 29.026 28.186 1.00 0.00 H new ATOM 0 HA PHE A 22 -7.330 26.976 27.495 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -5.145 26.376 29.478 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -5.501 25.541 27.979 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.562 27.301 25.828 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -3.367 27.885 29.480 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.872 28.655 24.600 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -1.738 29.320 28.277 1.00 0.00 H new ATOM 0 HZ PHE A 22 -1.940 29.633 25.816 1.00 0.00 H new ATOM 343 N THR A 23 -8.921 26.821 29.906 1.00 0.00 N ATOM 344 CA THR A 23 -10.115 26.216 30.525 1.00 0.00 C ATOM 345 C THR A 23 -11.254 26.014 29.512 1.00 0.00 C ATOM 346 O THR A 23 -12.183 25.249 29.756 1.00 0.00 O ATOM 347 CB THR A 23 -10.584 27.087 31.697 1.00 0.00 C ATOM 348 OG1 THR A 23 -10.939 28.370 31.232 1.00 0.00 O ATOM 349 CG2 THR A 23 -9.447 27.282 32.700 1.00 0.00 C ATOM 0 H THR A 23 -8.905 27.836 30.009 1.00 0.00 H new ATOM 0 HA THR A 23 -9.838 25.228 30.892 1.00 0.00 H new ATOM 0 HB THR A 23 -11.433 26.587 32.163 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.239 28.920 31.986 1.00 0.00 H new ATOM 0 HG21 THR A 23 -9.794 27.902 33.527 1.00 0.00 H new ATOM 0 HG22 THR A 23 -9.129 26.312 33.082 1.00 0.00 H new ATOM 0 HG23 THR A 23 -8.607 27.771 32.207 1.00 0.00 H new ATOM 357 N ASP A 24 -11.156 26.657 28.345 1.00 0.00 N ATOM 358 CA ASP A 24 -12.004 26.449 27.163 1.00 0.00 C ATOM 359 C ASP A 24 -11.160 26.555 25.872 1.00 0.00 C ATOM 360 O ASP A 24 -9.961 26.851 25.916 1.00 0.00 O ATOM 361 CB ASP A 24 -13.158 27.469 27.167 1.00 0.00 C ATOM 362 CG ASP A 24 -14.463 26.931 26.543 1.00 0.00 C ATOM 363 OD1 ASP A 24 -14.410 26.052 25.650 1.00 0.00 O ATOM 364 OD2 ASP A 24 -15.554 27.404 26.943 1.00 0.00 O ATOM 0 H ASP A 24 -10.447 27.374 28.189 1.00 0.00 H new ATOM 0 HA ASP A 24 -12.433 25.447 27.195 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.356 27.776 28.194 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.846 28.360 26.622 1.00 0.00 H new ATOM 369 N VAL A 25 -11.782 26.312 24.716 1.00 0.00 N ATOM 370 CA VAL A 25 -11.156 26.367 23.385 1.00 0.00 C ATOM 371 C VAL A 25 -10.605 27.765 23.064 1.00 0.00 C ATOM 372 O VAL A 25 -11.288 28.774 23.268 1.00 0.00 O ATOM 373 CB VAL A 25 -12.170 25.935 22.304 1.00 0.00 C ATOM 374 CG1 VAL A 25 -11.637 26.093 20.875 1.00 0.00 C ATOM 375 CG2 VAL A 25 -12.570 24.464 22.474 1.00 0.00 C ATOM 0 H VAL A 25 -12.770 26.062 24.675 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.313 25.676 23.391 1.00 0.00 H new ATOM 0 HB VAL A 25 -13.025 26.597 22.443 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.399 25.772 20.165 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.389 27.139 20.693 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.744 25.481 20.750 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.285 24.189 21.698 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.684 23.834 22.391 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.026 24.322 23.454 1.00 0.00 H new ATOM 385 N VAL A 26 -9.394 27.817 22.498 1.00 0.00 N ATOM 386 CA VAL A 26 -8.785 29.029 21.924 1.00 0.00 C ATOM 387 C VAL A 26 -8.969 29.020 20.411 1.00 0.00 C ATOM 388 O VAL A 26 -8.564 28.062 19.752 1.00 0.00 O ATOM 389 CB VAL A 26 -7.280 29.142 22.232 1.00 0.00 C ATOM 390 CG1 VAL A 26 -6.697 30.480 21.756 1.00 0.00 C ATOM 391 CG2 VAL A 26 -7.000 29.039 23.724 1.00 0.00 C ATOM 0 H VAL A 26 -8.792 26.997 22.423 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.286 29.883 22.380 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.812 28.314 21.699 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.634 30.518 21.993 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.832 30.573 20.678 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.210 31.300 22.258 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.928 29.123 23.900 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.518 29.843 24.248 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.354 28.077 24.095 1.00 0.00 H new ATOM 401 N THR A 27 -9.509 30.099 19.852 1.00 0.00 N ATOM 402 CA THR A 27 -9.567 30.307 18.395 1.00 0.00 C ATOM 403 C THR A 27 -8.431 31.238 17.965 1.00 0.00 C ATOM 404 O THR A 27 -8.322 32.358 18.468 1.00 0.00 O ATOM 405 CB THR A 27 -10.934 30.843 17.943 1.00 0.00 C ATOM 406 OG1 THR A 27 -11.957 29.977 18.391 1.00 0.00 O ATOM 407 CG2 THR A 27 -11.046 30.905 16.418 1.00 0.00 C ATOM 0 H THR A 27 -9.922 30.860 20.392 1.00 0.00 H new ATOM 0 HA THR A 27 -9.439 29.342 17.905 1.00 0.00 H new ATOM 0 HB THR A 27 -11.035 31.844 18.362 1.00 0.00 H new ATOM 0 HG1 THR A 27 -12.828 30.322 18.103 1.00 0.00 H new ATOM 0 HG21 THR A 27 -12.028 31.289 16.141 1.00 0.00 H new ATOM 0 HG22 THR A 27 -10.273 31.564 16.023 1.00 0.00 H new ATOM 0 HG23 THR A 27 -10.917 29.905 16.003 1.00 0.00 H new ATOM 415 N THR A 28 -7.609 30.789 17.015 1.00 0.00 N ATOM 416 CA THR A 28 -6.473 31.534 16.449 1.00 0.00 C ATOM 417 C THR A 28 -6.590 31.453 14.934 1.00 0.00 C ATOM 418 O THR A 28 -6.623 30.352 14.387 1.00 0.00 O ATOM 419 CB THR A 28 -5.130 30.952 16.943 1.00 0.00 C ATOM 420 OG1 THR A 28 -4.967 31.253 18.311 1.00 0.00 O ATOM 421 CG2 THR A 28 -3.899 31.520 16.233 1.00 0.00 C ATOM 0 H THR A 28 -7.716 29.863 16.601 1.00 0.00 H new ATOM 0 HA THR A 28 -6.496 32.575 16.773 1.00 0.00 H new ATOM 0 HB THR A 28 -5.186 29.883 16.736 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.043 31.535 18.476 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.999 31.058 16.640 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.965 31.309 15.166 1.00 0.00 H new ATOM 0 HG23 THR A 28 -3.855 32.598 16.387 1.00 0.00 H new ATOM 429 N ASN A 29 -6.677 32.593 14.245 1.00 0.00 N ATOM 430 CA ASN A 29 -6.803 32.610 12.787 1.00 0.00 C ATOM 431 C ASN A 29 -5.465 32.954 12.114 1.00 0.00 C ATOM 432 O ASN A 29 -4.770 33.883 12.530 1.00 0.00 O ATOM 433 CB ASN A 29 -7.969 33.506 12.333 1.00 0.00 C ATOM 434 CG ASN A 29 -9.251 33.282 13.108 1.00 0.00 C ATOM 435 OD1 ASN A 29 -9.864 32.227 13.038 1.00 0.00 O ATOM 436 ND2 ASN A 29 -9.700 34.251 13.864 1.00 0.00 N ATOM 0 H ASN A 29 -6.662 33.518 14.675 1.00 0.00 H new ATOM 0 HA ASN A 29 -7.055 31.603 12.453 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -7.673 34.550 12.433 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -8.160 33.329 11.275 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -10.562 34.126 14.395 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -9.188 35.131 13.922 1.00 0.00 H new ATOM 443 N LEU A 30 -5.122 32.205 11.063 1.00 0.00 N ATOM 444 CA LEU A 30 -3.906 32.357 10.267 1.00 0.00 C ATOM 445 C LEU A 30 -4.286 32.931 8.896 1.00 0.00 C ATOM 446 O LEU A 30 -5.080 32.323 8.179 1.00 0.00 O ATOM 447 CB LEU A 30 -3.227 30.974 10.164 1.00 0.00 C ATOM 448 CG LEU A 30 -1.827 31.001 9.522 1.00 0.00 C ATOM 449 CD1 LEU A 30 -0.763 31.510 10.489 1.00 0.00 C ATOM 450 CD2 LEU A 30 -1.400 29.599 9.095 1.00 0.00 C ATOM 0 H LEU A 30 -5.712 31.442 10.731 1.00 0.00 H new ATOM 0 HA LEU A 30 -3.199 33.048 10.726 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -3.147 30.546 11.163 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.867 30.310 9.583 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.903 31.670 8.665 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.208 31.512 9.994 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.012 32.524 10.803 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.724 30.859 11.362 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.409 29.642 8.644 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -1.374 28.945 9.967 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -2.112 29.207 8.369 1.00 0.00 H new ATOM 462 N LYS A 31 -3.740 34.089 8.521 1.00 0.00 N ATOM 463 CA LYS A 31 -3.971 34.719 7.210 1.00 0.00 C ATOM 464 C LYS A 31 -2.900 34.281 6.213 1.00 0.00 C ATOM 465 O LYS A 31 -1.718 34.504 6.455 1.00 0.00 O ATOM 466 CB LYS A 31 -4.035 36.251 7.363 1.00 0.00 C ATOM 467 CG LYS A 31 -5.499 36.657 7.302 1.00 0.00 C ATOM 468 CD LYS A 31 -5.737 38.154 7.479 1.00 0.00 C ATOM 469 CE LYS A 31 -7.251 38.327 7.350 1.00 0.00 C ATOM 470 NZ LYS A 31 -7.674 39.741 7.536 1.00 0.00 N ATOM 0 H LYS A 31 -3.116 34.626 9.123 1.00 0.00 H new ATOM 0 HA LYS A 31 -4.932 34.390 6.814 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.591 36.560 8.309 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.469 36.739 6.570 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.912 36.345 6.343 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -6.047 36.119 8.075 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.381 38.499 8.450 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.207 38.731 6.721 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.572 37.980 6.368 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.751 37.700 8.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -8.707 39.810 7.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -7.392 40.066 8.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.219 40.337 6.815 1.00 0.00 H new ATOM 484 N LEU A 32 -3.302 33.663 5.101 1.00 0.00 N ATOM 485 CA LEU A 32 -2.408 33.265 4.013 1.00 0.00 C ATOM 486 C LEU A 32 -2.669 34.116 2.774 1.00 0.00 C ATOM 487 O LEU A 32 -3.780 34.075 2.248 1.00 0.00 O ATOM 488 CB LEU A 32 -2.568 31.770 3.668 1.00 0.00 C ATOM 489 CG LEU A 32 -2.257 30.718 4.747 1.00 0.00 C ATOM 490 CD1 LEU A 32 -1.154 31.132 5.703 1.00 0.00 C ATOM 491 CD2 LEU A 32 -3.489 30.355 5.567 1.00 0.00 C ATOM 0 H LEU A 32 -4.278 33.421 4.928 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.384 33.426 4.351 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.597 31.615 3.345 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.929 31.560 2.810 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.914 29.850 4.183 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.991 30.341 6.435 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.234 31.305 5.144 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.443 32.048 6.218 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -3.221 29.610 6.316 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.871 31.247 6.064 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.257 29.949 4.909 1.00 0.00 H new ATOM 503 N ARG A 33 -1.668 34.858 2.286 1.00 0.00 N ATOM 504 CA ARG A 33 -1.764 35.691 1.070 1.00 0.00 C ATOM 505 C ARG A 33 -0.830 35.187 -0.022 1.00 0.00 C ATOM 506 O ARG A 33 0.283 34.753 0.265 1.00 0.00 O ATOM 507 CB ARG A 33 -1.536 37.181 1.411 1.00 0.00 C ATOM 508 CG ARG A 33 -1.867 38.092 0.216 1.00 0.00 C ATOM 509 CD ARG A 33 -1.867 39.584 0.557 1.00 0.00 C ATOM 510 NE ARG A 33 -2.476 40.346 -0.552 1.00 0.00 N ATOM 511 CZ ARG A 33 -2.408 41.642 -0.786 1.00 0.00 C ATOM 512 NH1 ARG A 33 -1.740 42.460 -0.023 1.00 0.00 N ATOM 513 NH2 ARG A 33 -3.034 42.127 -1.819 1.00 0.00 N ATOM 0 H ARG A 33 -0.750 34.901 2.729 1.00 0.00 H new ATOM 0 HA ARG A 33 -2.774 35.606 0.670 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -2.156 37.459 2.264 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -0.498 37.332 1.708 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -1.143 37.911 -0.578 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -2.846 37.819 -0.177 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -2.423 39.757 1.479 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.847 39.928 0.731 1.00 0.00 H new ATOM 0 HE ARG A 33 -3.018 39.800 -1.222 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.242 42.104 0.793 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.715 43.456 -0.242 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.565 41.507 -2.431 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.993 43.127 -2.017 1.00 0.00 H new ATOM 527 N ASN A 34 -1.251 35.296 -1.281 1.00 0.00 N ATOM 528 CA ASN A 34 -0.454 34.874 -2.434 1.00 0.00 C ATOM 529 C ASN A 34 0.149 36.095 -3.153 1.00 0.00 C ATOM 530 O ASN A 34 -0.598 36.877 -3.742 1.00 0.00 O ATOM 531 CB ASN A 34 -1.369 34.033 -3.343 1.00 0.00 C ATOM 532 CG ASN A 34 -0.678 33.500 -4.587 1.00 0.00 C ATOM 533 OD1 ASN A 34 0.519 33.637 -4.786 1.00 0.00 O ATOM 534 ND2 ASN A 34 -1.432 32.876 -5.456 1.00 0.00 N ATOM 0 H ASN A 34 -2.161 35.682 -1.532 1.00 0.00 H new ATOM 0 HA ASN A 34 0.396 34.265 -2.127 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -1.762 33.193 -2.770 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -2.222 34.640 -3.645 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.021 32.498 -6.310 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -2.431 32.767 -5.280 1.00 0.00 H new ATOM 541 N PRO A 35 1.490 36.249 -3.148 1.00 0.00 N ATOM 542 CA PRO A 35 2.158 37.365 -3.813 1.00 0.00 C ATOM 543 C PRO A 35 2.305 37.172 -5.335 1.00 0.00 C ATOM 544 O PRO A 35 2.459 38.142 -6.081 1.00 0.00 O ATOM 545 CB PRO A 35 3.530 37.434 -3.153 1.00 0.00 C ATOM 546 CG PRO A 35 3.834 36.008 -2.725 1.00 0.00 C ATOM 547 CD PRO A 35 2.457 35.436 -2.410 1.00 0.00 C ATOM 0 HA PRO A 35 1.575 38.279 -3.705 1.00 0.00 H new ATOM 0 HB2 PRO A 35 4.283 37.807 -3.847 1.00 0.00 H new ATOM 0 HB3 PRO A 35 3.523 38.110 -2.298 1.00 0.00 H new ATOM 0 HG2 PRO A 35 4.331 35.448 -3.517 1.00 0.00 H new ATOM 0 HG3 PRO A 35 4.490 35.980 -1.855 1.00 0.00 H new ATOM 0 HD2 PRO A 35 2.394 34.390 -2.710 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.257 35.473 -1.339 1.00 0.00 H new ATOM 555 N SER A 36 2.291 35.912 -5.784 1.00 0.00 N ATOM 556 CA SER A 36 2.456 35.490 -7.183 1.00 0.00 C ATOM 557 C SER A 36 1.292 35.905 -8.101 1.00 0.00 C ATOM 558 O SER A 36 0.246 36.386 -7.659 1.00 0.00 O ATOM 559 CB SER A 36 2.627 33.965 -7.241 1.00 0.00 C ATOM 560 OG SER A 36 3.323 33.575 -8.413 1.00 0.00 O ATOM 0 H SER A 36 2.158 35.121 -5.154 1.00 0.00 H new ATOM 0 HA SER A 36 3.344 36.002 -7.555 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.171 33.623 -6.360 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.649 33.485 -7.218 1.00 0.00 H new ATOM 0 HG SER A 36 3.421 32.600 -8.426 1.00 0.00 H new ATOM 566 N ASP A 37 1.472 35.658 -9.399 1.00 0.00 N ATOM 567 CA ASP A 37 0.536 35.927 -10.500 1.00 0.00 C ATOM 568 C ASP A 37 -0.173 34.653 -11.026 1.00 0.00 C ATOM 569 O ASP A 37 -0.691 34.633 -12.146 1.00 0.00 O ATOM 570 CB ASP A 37 1.251 36.727 -11.605 1.00 0.00 C ATOM 571 CG ASP A 37 2.268 35.895 -12.411 1.00 0.00 C ATOM 572 OD1 ASP A 37 3.240 35.372 -11.815 1.00 0.00 O ATOM 573 OD2 ASP A 37 2.126 35.799 -13.655 1.00 0.00 O ATOM 0 H ASP A 37 2.336 35.234 -9.736 1.00 0.00 H new ATOM 0 HA ASP A 37 -0.277 36.540 -10.111 1.00 0.00 H new ATOM 0 HB2 ASP A 37 0.505 37.134 -12.288 1.00 0.00 H new ATOM 0 HB3 ASP A 37 1.765 37.575 -11.153 1.00 0.00 H new ATOM 578 N ARG A 38 -0.202 33.589 -10.208 1.00 0.00 N ATOM 579 CA ARG A 38 -0.824 32.279 -10.486 1.00 0.00 C ATOM 580 C ARG A 38 -1.592 31.818 -9.249 1.00 0.00 C ATOM 581 O ARG A 38 -1.228 32.200 -8.138 1.00 0.00 O ATOM 582 CB ARG A 38 0.254 31.235 -10.843 1.00 0.00 C ATOM 583 CG ARG A 38 1.137 31.629 -12.037 1.00 0.00 C ATOM 584 CD ARG A 38 2.183 30.540 -12.309 1.00 0.00 C ATOM 585 NE ARG A 38 3.083 30.918 -13.417 1.00 0.00 N ATOM 586 CZ ARG A 38 4.139 31.715 -13.355 1.00 0.00 C ATOM 587 NH1 ARG A 38 4.518 32.284 -12.246 1.00 0.00 N ATOM 588 NH2 ARG A 38 4.844 31.954 -14.425 1.00 0.00 N ATOM 0 H ARG A 38 0.230 33.618 -9.285 1.00 0.00 H new ATOM 0 HA ARG A 38 -1.505 32.380 -11.331 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.890 31.073 -9.973 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -0.234 30.285 -11.063 1.00 0.00 H new ATOM 0 HG2 ARG A 38 0.518 31.777 -12.922 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.634 32.577 -11.833 1.00 0.00 H new ATOM 0 HD2 ARG A 38 2.769 30.364 -11.407 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.680 29.604 -12.551 1.00 0.00 H new ATOM 0 HE ARG A 38 2.867 30.521 -14.332 1.00 0.00 H new ATOM 0 HH11 ARG A 38 3.996 32.122 -11.385 1.00 0.00 H new ATOM 0 HH12 ARG A 38 5.337 32.892 -12.239 1.00 0.00 H new ATOM 0 HH21 ARG A 38 4.583 31.527 -15.314 1.00 0.00 H new ATOM 0 HH22 ARG A 38 5.657 32.568 -14.374 1.00 0.00 H new ATOM 602 N LYS A 39 -2.621 30.983 -9.418 1.00 0.00 N ATOM 603 CA LYS A 39 -3.365 30.383 -8.289 1.00 0.00 C ATOM 604 C LYS A 39 -2.690 29.104 -7.782 1.00 0.00 C ATOM 605 O LYS A 39 -2.025 28.390 -8.531 1.00 0.00 O ATOM 606 CB LYS A 39 -4.883 30.281 -8.553 1.00 0.00 C ATOM 607 CG LYS A 39 -5.383 29.493 -9.777 1.00 0.00 C ATOM 608 CD LYS A 39 -5.228 30.157 -11.159 1.00 0.00 C ATOM 609 CE LYS A 39 -5.686 31.625 -11.270 1.00 0.00 C ATOM 610 NZ LYS A 39 -7.131 31.814 -10.941 1.00 0.00 N ATOM 0 H LYS A 39 -2.967 30.700 -10.335 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.310 31.073 -7.447 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.340 29.837 -7.669 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.270 31.297 -8.637 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.857 28.539 -9.801 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.440 29.271 -9.626 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.178 30.104 -11.448 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.788 29.569 -11.885 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -5.084 32.239 -10.600 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -5.500 31.982 -12.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.546 32.515 -11.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -7.632 30.908 -11.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.223 32.151 -9.961 1.00 0.00 H new ATOM 624 N VAL A 40 -2.826 28.833 -6.487 1.00 0.00 N ATOM 625 CA VAL A 40 -2.076 27.785 -5.765 1.00 0.00 C ATOM 626 C VAL A 40 -2.978 27.059 -4.767 1.00 0.00 C ATOM 627 O VAL A 40 -3.749 27.686 -4.048 1.00 0.00 O ATOM 628 CB VAL A 40 -0.822 28.422 -5.118 1.00 0.00 C ATOM 629 CG1 VAL A 40 -1.162 29.544 -4.140 1.00 0.00 C ATOM 630 CG2 VAL A 40 0.096 27.439 -4.387 1.00 0.00 C ATOM 0 H VAL A 40 -3.474 29.343 -5.887 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.733 27.016 -6.458 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.287 28.816 -5.983 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.243 29.951 -3.719 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -1.701 30.333 -4.664 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.785 29.150 -3.337 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.946 27.978 -3.968 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.458 26.953 -3.584 1.00 0.00 H new ATOM 0 HG23 VAL A 40 0.454 26.686 -5.088 1.00 0.00 H new ATOM 640 N CYS A 41 -2.897 25.730 -4.731 1.00 0.00 N ATOM 641 CA CYS A 41 -3.659 24.890 -3.807 1.00 0.00 C ATOM 642 C CYS A 41 -2.895 24.736 -2.489 1.00 0.00 C ATOM 643 O CYS A 41 -1.685 24.511 -2.513 1.00 0.00 O ATOM 644 CB CYS A 41 -3.943 23.540 -4.477 1.00 0.00 C ATOM 645 SG CYS A 41 -5.093 23.811 -5.851 1.00 0.00 S ATOM 0 H CYS A 41 -2.290 25.197 -5.354 1.00 0.00 H new ATOM 0 HA CYS A 41 -4.615 25.356 -3.569 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -3.017 23.095 -4.840 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -4.371 22.842 -3.757 1.00 0.00 H new ATOM 0 HG CYS A 41 -5.793 22.734 -6.050 1.00 0.00 H new ATOM 651 N PHE A 42 -3.594 24.848 -1.356 1.00 0.00 N ATOM 652 CA PHE A 42 -3.018 24.699 -0.010 1.00 0.00 C ATOM 653 C PHE A 42 -3.643 23.571 0.820 1.00 0.00 C ATOM 654 O PHE A 42 -4.820 23.242 0.673 1.00 0.00 O ATOM 655 CB PHE A 42 -3.029 26.042 0.750 1.00 0.00 C ATOM 656 CG PHE A 42 -4.343 26.461 1.384 1.00 0.00 C ATOM 657 CD1 PHE A 42 -5.259 27.232 0.650 1.00 0.00 C ATOM 658 CD2 PHE A 42 -4.622 26.139 2.729 1.00 0.00 C ATOM 659 CE1 PHE A 42 -6.440 27.700 1.255 1.00 0.00 C ATOM 660 CE2 PHE A 42 -5.813 26.585 3.331 1.00 0.00 C ATOM 661 CZ PHE A 42 -6.720 27.367 2.592 1.00 0.00 C ATOM 0 H PHE A 42 -4.594 25.048 -1.345 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.982 24.396 -0.163 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.274 25.994 1.534 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -2.721 26.826 0.058 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -5.056 27.467 -0.384 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -3.919 25.548 3.298 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -7.130 28.313 0.694 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.030 26.328 4.357 1.00 0.00 H new ATOM 0 HZ PHE A 42 -7.634 27.712 3.053 1.00 0.00 H new ATOM 671 N LYS A 43 -2.845 23.013 1.736 1.00 0.00 N ATOM 672 CA LYS A 43 -3.240 22.035 2.764 1.00 0.00 C ATOM 673 C LYS A 43 -2.619 22.364 4.128 1.00 0.00 C ATOM 674 O LYS A 43 -1.507 22.884 4.177 1.00 0.00 O ATOM 675 CB LYS A 43 -2.817 20.623 2.310 1.00 0.00 C ATOM 676 CG LYS A 43 -3.809 19.934 1.364 1.00 0.00 C ATOM 677 CD LYS A 43 -3.202 18.620 0.840 1.00 0.00 C ATOM 678 CE LYS A 43 -4.192 17.787 0.009 1.00 0.00 C ATOM 679 NZ LYS A 43 -5.136 17.002 0.857 1.00 0.00 N ATOM 0 H LYS A 43 -1.852 23.241 1.786 1.00 0.00 H new ATOM 0 HA LYS A 43 -4.323 22.077 2.882 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -1.849 20.690 1.814 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -2.681 19.997 3.192 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -4.743 19.731 1.887 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -4.048 20.593 0.530 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -2.328 18.848 0.231 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.855 18.025 1.685 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -4.761 18.450 -0.643 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -3.636 17.106 -0.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -5.781 16.459 0.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -4.598 16.348 1.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.688 17.651 1.454 1.00 0.00 H new ATOM 693 N VAL A 44 -3.300 22.030 5.230 1.00 0.00 N ATOM 694 CA VAL A 44 -2.842 22.254 6.617 1.00 0.00 C ATOM 695 C VAL A 44 -2.791 20.934 7.394 1.00 0.00 C ATOM 696 O VAL A 44 -3.754 20.166 7.375 1.00 0.00 O ATOM 697 CB VAL A 44 -3.727 23.287 7.356 1.00 0.00 C ATOM 698 CG1 VAL A 44 -3.037 23.728 8.647 1.00 0.00 C ATOM 699 CG2 VAL A 44 -3.975 24.535 6.496 1.00 0.00 C ATOM 0 H VAL A 44 -4.215 21.582 5.186 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.834 22.665 6.563 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.682 22.806 7.570 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.663 24.455 9.164 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.880 22.862 9.290 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.075 24.182 8.409 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.600 25.238 7.047 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.022 25.007 6.256 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.479 24.247 5.574 1.00 0.00 H new ATOM 709 N LYS A 45 -1.686 20.686 8.109 1.00 0.00 N ATOM 710 CA LYS A 45 -1.471 19.505 8.969 1.00 0.00 C ATOM 711 C LYS A 45 -1.018 19.919 10.375 1.00 0.00 C ATOM 712 O LYS A 45 -0.436 20.987 10.560 1.00 0.00 O ATOM 713 CB LYS A 45 -0.473 18.530 8.308 1.00 0.00 C ATOM 714 CG LYS A 45 -0.903 18.085 6.897 1.00 0.00 C ATOM 715 CD LYS A 45 -0.004 16.971 6.336 1.00 0.00 C ATOM 716 CE LYS A 45 -0.425 15.555 6.770 1.00 0.00 C ATOM 717 NZ LYS A 45 -1.437 14.957 5.848 1.00 0.00 N ATOM 0 H LYS A 45 -0.888 21.321 8.108 1.00 0.00 H new ATOM 0 HA LYS A 45 -2.421 18.982 9.081 1.00 0.00 H new ATOM 0 HB2 LYS A 45 0.506 19.007 8.249 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -0.361 17.650 8.941 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -1.935 17.735 6.928 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -0.877 18.943 6.225 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -0.012 17.025 5.247 1.00 0.00 H new ATOM 0 HD3 LYS A 45 1.022 17.149 6.657 1.00 0.00 H new ATOM 0 HE2 LYS A 45 0.454 14.912 6.807 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -0.834 15.593 7.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -1.430 13.922 5.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -2.381 15.322 6.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -1.205 15.210 4.866 1.00 0.00 H new ATOM 731 N THR A 46 -1.280 19.067 11.365 1.00 0.00 N ATOM 732 CA THR A 46 -1.015 19.336 12.796 1.00 0.00 C ATOM 733 C THR A 46 -0.205 18.213 13.443 1.00 0.00 C ATOM 734 O THR A 46 -0.200 17.086 12.962 1.00 0.00 O ATOM 735 CB THR A 46 -2.324 19.591 13.566 1.00 0.00 C ATOM 736 OG1 THR A 46 -2.009 19.906 14.898 1.00 0.00 O ATOM 737 CG2 THR A 46 -3.263 18.385 13.627 1.00 0.00 C ATOM 0 H THR A 46 -1.691 18.148 11.201 1.00 0.00 H new ATOM 0 HA THR A 46 -0.412 20.243 12.849 1.00 0.00 H new ATOM 0 HB THR A 46 -2.830 20.393 13.029 1.00 0.00 H new ATOM 0 HG1 THR A 46 -2.346 20.801 15.111 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.160 18.650 14.187 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.541 18.089 12.616 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.758 17.556 14.122 1.00 0.00 H new ATOM 745 N THR A 47 0.459 18.504 14.558 1.00 0.00 N ATOM 746 CA THR A 47 1.154 17.500 15.384 1.00 0.00 C ATOM 747 C THR A 47 0.245 16.771 16.375 1.00 0.00 C ATOM 748 O THR A 47 0.674 15.794 16.991 1.00 0.00 O ATOM 749 CB THR A 47 2.327 18.126 16.138 1.00 0.00 C ATOM 750 OG1 THR A 47 1.976 19.360 16.727 1.00 0.00 O ATOM 751 CG2 THR A 47 3.496 18.385 15.199 1.00 0.00 C ATOM 0 H THR A 47 0.535 19.453 14.925 1.00 0.00 H new ATOM 0 HA THR A 47 1.517 16.753 14.678 1.00 0.00 H new ATOM 0 HB THR A 47 2.605 17.414 16.915 1.00 0.00 H new ATOM 0 HG1 THR A 47 1.865 20.037 16.027 1.00 0.00 H new ATOM 0 HG21 THR A 47 4.319 18.831 15.757 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.824 17.444 14.758 1.00 0.00 H new ATOM 0 HG23 THR A 47 3.183 19.067 14.408 1.00 0.00 H new ATOM 759 N ALA A 48 -1.003 17.227 16.553 1.00 0.00 N ATOM 760 CA ALA A 48 -1.930 16.630 17.523 1.00 0.00 C ATOM 761 C ALA A 48 -3.413 16.867 17.161 1.00 0.00 C ATOM 762 O ALA A 48 -3.983 17.885 17.555 1.00 0.00 O ATOM 763 CB ALA A 48 -1.569 17.192 18.909 1.00 0.00 C ATOM 0 H ALA A 48 -1.395 18.013 16.034 1.00 0.00 H new ATOM 0 HA ALA A 48 -1.820 15.546 17.516 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.239 16.770 19.658 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -0.540 16.928 19.152 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -1.673 18.277 18.900 1.00 0.00 H new ATOM 769 N PRO A 49 -4.109 15.920 16.499 1.00 0.00 N ATOM 770 CA PRO A 49 -5.515 16.102 16.108 1.00 0.00 C ATOM 771 C PRO A 49 -6.463 16.102 17.324 1.00 0.00 C ATOM 772 O PRO A 49 -7.531 16.708 17.288 1.00 0.00 O ATOM 773 CB PRO A 49 -5.794 14.963 15.121 1.00 0.00 C ATOM 774 CG PRO A 49 -4.868 13.842 15.591 1.00 0.00 C ATOM 775 CD PRO A 49 -3.643 14.587 16.126 1.00 0.00 C ATOM 0 HA PRO A 49 -5.693 17.074 15.648 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.840 14.657 15.148 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -5.575 15.259 14.095 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -5.336 13.233 16.364 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -4.604 13.171 14.774 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -3.217 14.069 16.985 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -2.861 14.645 15.369 1.00 0.00 H new ATOM 783 N ARG A 50 -6.020 15.507 18.446 1.00 0.00 N ATOM 784 CA ARG A 50 -6.663 15.570 19.777 1.00 0.00 C ATOM 785 C ARG A 50 -6.435 16.881 20.559 1.00 0.00 C ATOM 786 O ARG A 50 -6.982 17.046 21.644 1.00 0.00 O ATOM 787 CB ARG A 50 -6.390 14.259 20.554 1.00 0.00 C ATOM 788 CG ARG A 50 -4.914 13.844 20.711 1.00 0.00 C ATOM 789 CD ARG A 50 -4.082 14.854 21.507 1.00 0.00 C ATOM 790 NE ARG A 50 -4.565 15.001 22.899 1.00 0.00 N ATOM 791 CZ ARG A 50 -4.149 14.343 23.970 1.00 0.00 C ATOM 792 NH1 ARG A 50 -3.245 13.408 23.905 1.00 0.00 N ATOM 793 NH2 ARG A 50 -4.644 14.617 25.142 1.00 0.00 N ATOM 0 H ARG A 50 -5.169 14.945 18.454 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.740 15.627 19.622 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -6.824 14.356 21.549 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.920 13.449 20.053 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -4.867 12.874 21.207 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -4.472 13.718 19.723 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -3.040 14.536 21.517 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -4.115 15.823 21.008 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.303 15.688 23.050 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -2.831 13.160 23.006 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -2.950 12.924 24.753 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.356 15.341 25.238 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.320 14.107 25.964 1.00 0.00 H new ATOM 807 N ARG A 51 -5.628 17.808 20.013 1.00 0.00 N ATOM 808 CA ARG A 51 -5.405 19.184 20.520 1.00 0.00 C ATOM 809 C ARG A 51 -5.903 20.259 19.556 1.00 0.00 C ATOM 810 O ARG A 51 -6.313 21.315 20.019 1.00 0.00 O ATOM 811 CB ARG A 51 -3.905 19.410 20.799 1.00 0.00 C ATOM 812 CG ARG A 51 -3.383 18.649 22.032 1.00 0.00 C ATOM 813 CD ARG A 51 -3.080 19.591 23.203 1.00 0.00 C ATOM 814 NE ARG A 51 -1.844 20.376 22.980 1.00 0.00 N ATOM 815 CZ ARG A 51 -1.466 21.448 23.655 1.00 0.00 C ATOM 816 NH1 ARG A 51 -2.259 22.033 24.500 1.00 0.00 N ATOM 817 NH2 ARG A 51 -0.277 21.951 23.507 1.00 0.00 N ATOM 0 H ARG A 51 -5.088 17.615 19.170 1.00 0.00 H new ATOM 0 HA ARG A 51 -5.982 19.274 21.441 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.332 19.103 19.924 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -3.727 20.476 20.939 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.123 17.911 22.342 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.479 18.101 21.764 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -3.920 20.271 23.348 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -2.979 19.009 24.119 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.225 20.059 22.234 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -3.198 21.667 24.656 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -1.943 22.859 25.008 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.383 21.518 22.861 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.004 22.779 24.037 1.00 0.00 H new ATOM 831 N TYR A 52 -5.891 20.005 18.246 1.00 0.00 N ATOM 832 CA TYR A 52 -6.137 21.021 17.216 1.00 0.00 C ATOM 833 C TYR A 52 -7.222 20.640 16.205 1.00 0.00 C ATOM 834 O TYR A 52 -7.193 19.565 15.605 1.00 0.00 O ATOM 835 CB TYR A 52 -4.825 21.297 16.481 1.00 0.00 C ATOM 836 CG TYR A 52 -3.745 21.847 17.385 1.00 0.00 C ATOM 837 CD1 TYR A 52 -3.821 23.179 17.835 1.00 0.00 C ATOM 838 CD2 TYR A 52 -2.693 21.016 17.810 1.00 0.00 C ATOM 839 CE1 TYR A 52 -2.831 23.683 18.696 1.00 0.00 C ATOM 840 CE2 TYR A 52 -1.723 21.506 18.702 1.00 0.00 C ATOM 841 CZ TYR A 52 -1.801 22.837 19.152 1.00 0.00 C ATOM 842 OH TYR A 52 -0.889 23.304 20.035 1.00 0.00 O ATOM 0 H TYR A 52 -5.708 19.077 17.864 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.507 21.909 17.729 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -4.471 20.374 16.022 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -5.010 22.005 15.673 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.638 23.812 17.520 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -2.630 20.000 17.450 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -2.860 24.717 19.007 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -0.923 20.865 19.040 1.00 0.00 H new ATOM 0 HH TYR A 52 -0.154 23.734 19.550 1.00 0.00 H new ATOM 852 N CYS A 53 -8.133 21.585 15.964 1.00 0.00 N ATOM 853 CA CYS A 53 -9.144 21.548 14.906 1.00 0.00 C ATOM 854 C CYS A 53 -8.859 22.666 13.881 1.00 0.00 C ATOM 855 O CYS A 53 -8.516 23.778 14.273 1.00 0.00 O ATOM 856 CB CYS A 53 -10.521 21.660 15.580 1.00 0.00 C ATOM 857 SG CYS A 53 -10.782 20.239 16.675 1.00 0.00 S ATOM 0 H CYS A 53 -8.188 22.434 16.526 1.00 0.00 H new ATOM 0 HA CYS A 53 -9.121 20.615 14.342 1.00 0.00 H new ATOM 0 HB2 CYS A 53 -10.583 22.587 16.150 1.00 0.00 H new ATOM 0 HB3 CYS A 53 -11.305 21.697 14.824 1.00 0.00 H new ATOM 0 HG CYS A 53 -11.842 20.440 17.401 1.00 0.00 H new ATOM 863 N VAL A 54 -8.973 22.380 12.584 1.00 0.00 N ATOM 864 CA VAL A 54 -8.551 23.228 11.444 1.00 0.00 C ATOM 865 C VAL A 54 -9.712 23.277 10.449 1.00 0.00 C ATOM 866 O VAL A 54 -9.847 22.381 9.617 1.00 0.00 O ATOM 867 CB VAL A 54 -7.273 22.654 10.823 1.00 0.00 C ATOM 868 CG1 VAL A 54 -6.749 23.629 9.765 1.00 0.00 C ATOM 869 CG2 VAL A 54 -6.149 22.516 11.862 1.00 0.00 C ATOM 0 H VAL A 54 -9.385 21.501 12.271 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.318 24.244 11.762 1.00 0.00 H new ATOM 0 HB VAL A 54 -7.527 21.678 10.410 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.839 23.227 9.319 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.504 23.765 8.990 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.530 24.589 10.232 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.260 22.106 11.384 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.917 23.496 12.280 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -6.472 21.848 12.661 1.00 0.00 H new ATOM 879 N ARG A 55 -10.554 24.320 10.505 1.00 0.00 N ATOM 880 CA ARG A 55 -11.840 24.340 9.768 1.00 0.00 C ATOM 881 C ARG A 55 -11.815 23.996 8.282 1.00 0.00 C ATOM 882 O ARG A 55 -12.404 22.985 7.906 1.00 0.00 O ATOM 883 CB ARG A 55 -12.697 25.576 10.103 1.00 0.00 C ATOM 884 CG ARG A 55 -14.197 25.282 9.929 1.00 0.00 C ATOM 885 CD ARG A 55 -15.075 26.478 10.326 1.00 0.00 C ATOM 886 NE ARG A 55 -14.977 26.801 11.767 1.00 0.00 N ATOM 887 CZ ARG A 55 -15.655 26.259 12.765 1.00 0.00 C ATOM 888 NH1 ARG A 55 -16.499 25.283 12.582 1.00 0.00 N ATOM 889 NH2 ARG A 55 -15.491 26.690 13.982 1.00 0.00 N ATOM 0 H ARG A 55 -10.373 25.163 11.051 1.00 0.00 H new ATOM 0 HA ARG A 55 -12.349 23.465 10.171 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.502 25.888 11.129 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.410 26.406 9.457 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.395 25.018 8.890 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.468 24.418 10.535 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.782 27.350 9.741 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -16.113 26.261 10.076 1.00 0.00 H new ATOM 0 HE ARG A 55 -14.307 27.528 12.020 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.654 24.912 11.645 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -17.004 24.890 13.376 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.837 27.450 14.170 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -16.017 26.268 14.748 1.00 0.00 H new ATOM 903 N PRO A 56 -11.124 24.773 7.441 1.00 0.00 N ATOM 904 CA PRO A 56 -10.955 24.411 6.041 1.00 0.00 C ATOM 905 C PRO A 56 -10.106 23.146 5.824 1.00 0.00 C ATOM 906 O PRO A 56 -10.442 22.316 4.984 1.00 0.00 O ATOM 907 CB PRO A 56 -10.235 25.607 5.405 1.00 0.00 C ATOM 908 CG PRO A 56 -9.577 26.284 6.608 1.00 0.00 C ATOM 909 CD PRO A 56 -10.595 26.098 7.698 1.00 0.00 C ATOM 0 HA PRO A 56 -11.929 24.189 5.604 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -9.499 25.290 4.666 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -10.931 26.274 4.896 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -8.624 25.819 6.862 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -9.377 27.338 6.418 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -10.142 26.165 8.687 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -11.375 26.858 7.653 1.00 0.00 H new ATOM 917 N ASN A 57 -8.976 23.055 6.551 1.00 0.00 N ATOM 918 CA ASN A 57 -7.839 22.110 6.442 1.00 0.00 C ATOM 919 C ASN A 57 -7.205 21.964 5.038 1.00 0.00 C ATOM 920 O ASN A 57 -6.113 21.412 4.903 1.00 0.00 O ATOM 921 CB ASN A 57 -8.088 20.786 7.186 1.00 0.00 C ATOM 922 CG ASN A 57 -9.363 20.059 6.806 1.00 0.00 C ATOM 923 OD1 ASN A 57 -9.414 19.287 5.857 1.00 0.00 O ATOM 924 ND2 ASN A 57 -10.424 20.287 7.546 1.00 0.00 N ATOM 0 H ASN A 57 -8.816 23.713 7.314 1.00 0.00 H new ATOM 0 HA ASN A 57 -7.033 22.603 6.986 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.243 20.122 7.005 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -8.110 20.989 8.257 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -11.305 19.818 7.333 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -10.367 20.933 8.334 1.00 0.00 H new ATOM 931 N SER A 58 -7.820 22.556 4.020 1.00 0.00 N ATOM 932 CA SER A 58 -7.319 22.689 2.648 1.00 0.00 C ATOM 933 C SER A 58 -8.098 23.757 1.870 1.00 0.00 C ATOM 934 O SER A 58 -9.179 24.186 2.286 1.00 0.00 O ATOM 935 CB SER A 58 -7.399 21.347 1.901 1.00 0.00 C ATOM 936 OG SER A 58 -8.742 20.909 1.757 1.00 0.00 O ATOM 0 H SER A 58 -8.739 22.984 4.133 1.00 0.00 H new ATOM 0 HA SER A 58 -6.276 22.998 2.714 1.00 0.00 H new ATOM 0 HB2 SER A 58 -6.942 21.450 0.917 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.826 20.594 2.442 1.00 0.00 H new ATOM 0 HG SER A 58 -8.758 20.055 1.277 1.00 0.00 H new ATOM 942 N GLY A 59 -7.553 24.187 0.730 1.00 0.00 N ATOM 943 CA GLY A 59 -8.223 25.131 -0.172 1.00 0.00 C ATOM 944 C GLY A 59 -7.356 25.576 -1.346 1.00 0.00 C ATOM 945 O GLY A 59 -6.362 24.933 -1.678 1.00 0.00 O ATOM 0 H GLY A 59 -6.633 23.891 0.404 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -9.132 24.669 -0.557 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -8.528 26.009 0.397 1.00 0.00 H new ATOM 949 N ILE A 60 -7.729 26.683 -1.990 1.00 0.00 N ATOM 950 CA ILE A 60 -6.973 27.322 -3.082 1.00 0.00 C ATOM 951 C ILE A 60 -6.903 28.843 -2.842 1.00 0.00 C ATOM 952 O ILE A 60 -7.891 29.434 -2.402 1.00 0.00 O ATOM 953 CB ILE A 60 -7.604 26.990 -4.456 1.00 0.00 C ATOM 954 CG1 ILE A 60 -8.021 25.503 -4.605 1.00 0.00 C ATOM 955 CG2 ILE A 60 -6.683 27.433 -5.611 1.00 0.00 C ATOM 956 CD1 ILE A 60 -8.576 25.107 -5.983 1.00 0.00 C ATOM 0 H ILE A 60 -8.591 27.179 -1.763 1.00 0.00 H new ATOM 0 HA ILE A 60 -5.957 26.929 -3.092 1.00 0.00 H new ATOM 0 HB ILE A 60 -8.529 27.564 -4.510 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.155 24.877 -4.388 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -8.775 25.278 -3.850 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.151 27.188 -6.564 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.519 28.509 -5.554 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.727 26.916 -5.533 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -8.837 24.049 -5.980 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -9.465 25.699 -6.201 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -7.820 25.292 -6.747 1.00 0.00 H new ATOM 968 N ILE A 61 -5.766 29.483 -3.149 1.00 0.00 N ATOM 969 CA ILE A 61 -5.585 30.945 -3.076 1.00 0.00 C ATOM 970 C ILE A 61 -5.286 31.525 -4.462 1.00 0.00 C ATOM 971 O ILE A 61 -4.424 31.031 -5.189 1.00 0.00 O ATOM 972 CB ILE A 61 -4.513 31.356 -2.041 1.00 0.00 C ATOM 973 CG1 ILE A 61 -4.723 30.564 -0.735 1.00 0.00 C ATOM 974 CG2 ILE A 61 -4.570 32.881 -1.808 1.00 0.00 C ATOM 975 CD1 ILE A 61 -3.973 31.092 0.484 1.00 0.00 C ATOM 0 H ILE A 61 -4.928 28.992 -3.461 1.00 0.00 H new ATOM 0 HA ILE A 61 -6.526 31.371 -2.726 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.519 31.117 -2.418 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.789 30.551 -0.506 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.421 29.531 -0.905 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.813 33.166 -1.078 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -4.381 33.400 -2.748 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.556 33.155 -1.434 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.191 30.462 1.346 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.901 31.078 0.286 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.290 32.114 0.692 1.00 0.00 H new ATOM 987 N ASP A 62 -5.983 32.606 -4.806 1.00 0.00 N ATOM 988 CA ASP A 62 -5.848 33.326 -6.081 1.00 0.00 C ATOM 989 C ASP A 62 -4.748 34.409 -6.041 1.00 0.00 C ATOM 990 O ASP A 62 -4.400 34.890 -4.959 1.00 0.00 O ATOM 991 CB ASP A 62 -7.219 33.894 -6.486 1.00 0.00 C ATOM 992 CG ASP A 62 -8.095 32.824 -7.158 1.00 0.00 C ATOM 993 OD1 ASP A 62 -7.756 32.398 -8.289 1.00 0.00 O ATOM 994 OD2 ASP A 62 -9.128 32.423 -6.569 1.00 0.00 O ATOM 0 H ASP A 62 -6.681 33.022 -4.189 1.00 0.00 H new ATOM 0 HA ASP A 62 -5.520 32.621 -6.845 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -7.729 34.282 -5.604 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.080 34.733 -7.168 1.00 0.00 H new ATOM 999 N PRO A 63 -4.163 34.802 -7.190 1.00 0.00 N ATOM 1000 CA PRO A 63 -3.078 35.785 -7.240 1.00 0.00 C ATOM 1001 C PRO A 63 -3.474 37.140 -6.630 1.00 0.00 C ATOM 1002 O PRO A 63 -4.485 37.742 -7.007 1.00 0.00 O ATOM 1003 CB PRO A 63 -2.705 35.905 -8.719 1.00 0.00 C ATOM 1004 CG PRO A 63 -3.946 35.433 -9.469 1.00 0.00 C ATOM 1005 CD PRO A 63 -4.489 34.353 -8.538 1.00 0.00 C ATOM 0 HA PRO A 63 -2.230 35.461 -6.637 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -2.450 36.932 -8.981 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -1.838 35.290 -8.960 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -4.663 36.240 -9.619 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -3.701 35.037 -10.454 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.565 34.232 -8.662 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -4.033 33.386 -8.751 1.00 0.00 H new ATOM 1013 N GLY A 64 -2.671 37.618 -5.674 1.00 0.00 N ATOM 1014 CA GLY A 64 -2.915 38.839 -4.894 1.00 0.00 C ATOM 1015 C GLY A 64 -3.930 38.701 -3.757 1.00 0.00 C ATOM 1016 O GLY A 64 -4.055 39.630 -2.953 1.00 0.00 O ATOM 0 H GLY A 64 -1.803 37.151 -5.412 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -1.968 39.176 -4.473 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.259 39.620 -5.572 1.00 0.00 H new ATOM 1020 N SER A 65 -4.621 37.563 -3.647 1.00 0.00 N ATOM 1021 CA SER A 65 -5.718 37.351 -2.693 1.00 0.00 C ATOM 1022 C SER A 65 -5.275 36.638 -1.409 1.00 0.00 C ATOM 1023 O SER A 65 -4.188 36.058 -1.343 1.00 0.00 O ATOM 1024 CB SER A 65 -6.875 36.596 -3.368 1.00 0.00 C ATOM 1025 OG SER A 65 -7.377 37.328 -4.474 1.00 0.00 O ATOM 0 H SER A 65 -4.432 36.747 -4.229 1.00 0.00 H new ATOM 0 HA SER A 65 -6.062 38.339 -2.387 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.531 35.617 -3.700 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.674 36.425 -2.646 1.00 0.00 H new ATOM 0 HG SER A 65 -8.111 36.830 -4.890 1.00 0.00 H new ATOM 1031 N THR A 66 -6.138 36.675 -0.386 1.00 0.00 N ATOM 1032 CA THR A 66 -5.885 36.139 0.967 1.00 0.00 C ATOM 1033 C THR A 66 -7.006 35.191 1.416 1.00 0.00 C ATOM 1034 O THR A 66 -8.182 35.454 1.154 1.00 0.00 O ATOM 1035 CB THR A 66 -5.733 37.272 2.007 1.00 0.00 C ATOM 1036 OG1 THR A 66 -4.896 38.296 1.517 1.00 0.00 O ATOM 1037 CG2 THR A 66 -5.122 36.824 3.341 1.00 0.00 C ATOM 0 H THR A 66 -7.065 37.092 -0.475 1.00 0.00 H new ATOM 0 HA THR A 66 -4.950 35.582 0.909 1.00 0.00 H new ATOM 0 HB THR A 66 -6.754 37.614 2.179 1.00 0.00 H new ATOM 0 HG1 THR A 66 -4.815 39.003 2.191 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.050 37.679 4.014 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.754 36.059 3.792 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.127 36.415 3.166 1.00 0.00 H new ATOM 1045 N VAL A 67 -6.655 34.123 2.140 1.00 0.00 N ATOM 1046 CA VAL A 67 -7.590 33.216 2.840 1.00 0.00 C ATOM 1047 C VAL A 67 -7.243 33.186 4.331 1.00 0.00 C ATOM 1048 O VAL A 67 -6.070 33.162 4.694 1.00 0.00 O ATOM 1049 CB VAL A 67 -7.577 31.798 2.223 1.00 0.00 C ATOM 1050 CG1 VAL A 67 -8.507 30.823 2.963 1.00 0.00 C ATOM 1051 CG2 VAL A 67 -8.032 31.842 0.757 1.00 0.00 C ATOM 0 H VAL A 67 -5.680 33.851 2.263 1.00 0.00 H new ATOM 0 HA VAL A 67 -8.605 33.594 2.721 1.00 0.00 H new ATOM 0 HB VAL A 67 -6.549 31.446 2.307 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -8.459 29.843 2.488 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -8.192 30.738 4.003 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.531 31.196 2.923 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -8.016 30.835 0.341 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.045 32.241 0.702 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -7.359 32.481 0.186 1.00 0.00 H new ATOM 1061 N THR A 68 -8.252 33.178 5.206 1.00 0.00 N ATOM 1062 CA THR A 68 -8.084 33.091 6.662 1.00 0.00 C ATOM 1063 C THR A 68 -8.505 31.704 7.150 1.00 0.00 C ATOM 1064 O THR A 68 -9.643 31.279 6.954 1.00 0.00 O ATOM 1065 CB THR A 68 -8.868 34.203 7.371 1.00 0.00 C ATOM 1066 OG1 THR A 68 -8.553 35.467 6.831 1.00 0.00 O ATOM 1067 CG2 THR A 68 -8.526 34.247 8.845 1.00 0.00 C ATOM 0 H THR A 68 -9.229 33.233 4.918 1.00 0.00 H new ATOM 0 HA THR A 68 -7.032 33.234 6.908 1.00 0.00 H new ATOM 0 HB THR A 68 -9.926 33.982 7.229 1.00 0.00 H new ATOM 0 HG1 THR A 68 -9.066 36.159 7.298 1.00 0.00 H new ATOM 0 HG21 THR A 68 -9.094 35.043 9.327 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.778 33.292 9.306 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.460 34.438 8.966 1.00 0.00 H new ATOM 1075 N VAL A 69 -7.572 31.004 7.793 1.00 0.00 N ATOM 1076 CA VAL A 69 -7.725 29.638 8.321 1.00 0.00 C ATOM 1077 C VAL A 69 -7.905 29.692 9.837 1.00 0.00 C ATOM 1078 O VAL A 69 -7.015 30.149 10.547 1.00 0.00 O ATOM 1079 CB VAL A 69 -6.495 28.789 7.933 1.00 0.00 C ATOM 1080 CG1 VAL A 69 -6.513 27.396 8.574 1.00 0.00 C ATOM 1081 CG2 VAL A 69 -6.403 28.612 6.412 1.00 0.00 C ATOM 0 H VAL A 69 -6.643 31.386 7.971 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.610 29.171 7.889 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.630 29.337 8.306 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.625 26.843 8.267 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.522 27.495 9.659 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.405 26.859 8.252 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.528 28.010 6.168 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.300 28.111 6.049 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.316 29.589 5.937 1.00 0.00 H new ATOM 1091 N SER A 70 -9.038 29.209 10.348 1.00 0.00 N ATOM 1092 CA SER A 70 -9.308 29.125 11.793 1.00 0.00 C ATOM 1093 C SER A 70 -8.742 27.839 12.392 1.00 0.00 C ATOM 1094 O SER A 70 -9.062 26.738 11.941 1.00 0.00 O ATOM 1095 CB SER A 70 -10.812 29.220 12.080 1.00 0.00 C ATOM 1096 OG SER A 70 -11.326 30.456 11.620 1.00 0.00 O ATOM 0 H SER A 70 -9.803 28.861 9.770 1.00 0.00 H new ATOM 0 HA SER A 70 -8.809 29.972 12.264 1.00 0.00 H new ATOM 0 HB2 SER A 70 -11.334 28.397 11.591 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.991 29.120 13.151 1.00 0.00 H new ATOM 0 HG SER A 70 -10.970 31.184 12.172 1.00 0.00 H new ATOM 1102 N VAL A 71 -7.934 27.998 13.441 1.00 0.00 N ATOM 1103 CA VAL A 71 -7.441 26.926 14.310 1.00 0.00 C ATOM 1104 C VAL A 71 -8.175 27.021 15.641 1.00 0.00 C ATOM 1105 O VAL A 71 -8.209 28.090 16.248 1.00 0.00 O ATOM 1106 CB VAL A 71 -5.917 27.017 14.531 1.00 0.00 C ATOM 1107 CG1 VAL A 71 -5.431 25.885 15.445 1.00 0.00 C ATOM 1108 CG2 VAL A 71 -5.155 26.929 13.203 1.00 0.00 C ATOM 0 H VAL A 71 -7.590 28.916 13.721 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.632 25.965 13.832 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.720 27.982 14.998 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.354 25.969 15.587 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.931 25.957 16.411 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.663 24.923 14.988 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.084 26.996 13.393 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.379 25.979 12.718 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.460 27.749 12.553 1.00 0.00 H new ATOM 1118 N MET A 72 -8.728 25.907 16.111 1.00 0.00 N ATOM 1119 CA MET A 72 -9.394 25.788 17.405 1.00 0.00 C ATOM 1120 C MET A 72 -8.608 24.805 18.283 1.00 0.00 C ATOM 1121 O MET A 72 -8.659 23.589 18.087 1.00 0.00 O ATOM 1122 CB MET A 72 -10.868 25.403 17.215 1.00 0.00 C ATOM 1123 CG MET A 72 -11.707 26.511 16.556 1.00 0.00 C ATOM 1124 SD MET A 72 -11.602 26.656 14.743 1.00 0.00 S ATOM 1125 CE MET A 72 -12.245 25.036 14.227 1.00 0.00 C ATOM 0 H MET A 72 -8.725 25.033 15.585 1.00 0.00 H new ATOM 0 HA MET A 72 -9.404 26.747 17.923 1.00 0.00 H new ATOM 0 HB2 MET A 72 -10.925 24.502 16.604 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.300 25.158 18.185 1.00 0.00 H new ATOM 0 HG2 MET A 72 -12.751 26.350 16.824 1.00 0.00 H new ATOM 0 HG3 MET A 72 -11.410 27.465 16.990 1.00 0.00 H new ATOM 0 HE1 MET A 72 -12.842 25.153 13.322 1.00 0.00 H new ATOM 0 HE2 MET A 72 -11.413 24.361 14.028 1.00 0.00 H new ATOM 0 HE3 MET A 72 -12.866 24.622 15.021 1.00 0.00 H new ATOM 1135 N LEU A 73 -7.879 25.348 19.254 1.00 0.00 N ATOM 1136 CA LEU A 73 -6.978 24.639 20.165 1.00 0.00 C ATOM 1137 C LEU A 73 -7.742 24.301 21.446 1.00 0.00 C ATOM 1138 O LEU A 73 -8.331 25.169 22.087 1.00 0.00 O ATOM 1139 CB LEU A 73 -5.733 25.513 20.368 1.00 0.00 C ATOM 1140 CG LEU A 73 -4.676 25.107 21.416 1.00 0.00 C ATOM 1141 CD1 LEU A 73 -4.903 25.785 22.767 1.00 0.00 C ATOM 1142 CD2 LEU A 73 -4.467 23.611 21.656 1.00 0.00 C ATOM 0 H LEU A 73 -7.901 26.351 19.439 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.630 23.686 19.767 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -5.226 25.586 19.406 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.077 26.515 20.624 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.762 25.463 20.942 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -4.132 25.465 23.468 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -4.855 26.867 22.644 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -5.883 25.507 23.154 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -3.698 23.468 22.415 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -5.401 23.163 21.997 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -4.153 23.134 20.728 1.00 0.00 H new ATOM 1154 N GLN A 74 -7.781 23.013 21.770 1.00 0.00 N ATOM 1155 CA GLN A 74 -8.627 22.451 22.827 1.00 0.00 C ATOM 1156 C GLN A 74 -8.074 22.748 24.242 1.00 0.00 C ATOM 1157 O GLN A 74 -6.853 22.838 24.412 1.00 0.00 O ATOM 1158 CB GLN A 74 -8.823 20.940 22.583 1.00 0.00 C ATOM 1159 CG GLN A 74 -9.423 20.575 21.210 1.00 0.00 C ATOM 1160 CD GLN A 74 -10.713 21.322 20.879 1.00 0.00 C ATOM 1161 OE1 GLN A 74 -11.760 21.091 21.468 1.00 0.00 O ATOM 1162 NE2 GLN A 74 -10.692 22.254 19.944 1.00 0.00 N ATOM 0 H GLN A 74 -7.213 22.311 21.296 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.601 22.938 22.785 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.859 20.442 22.685 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -9.471 20.542 23.364 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.685 20.784 20.435 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -9.619 19.503 21.184 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -9.826 22.457 19.445 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -11.542 22.771 19.720 1.00 0.00 H new ATOM 1171 N PRO A 75 -8.941 22.899 25.265 1.00 0.00 N ATOM 1172 CA PRO A 75 -8.524 23.236 26.629 1.00 0.00 C ATOM 1173 C PRO A 75 -7.598 22.183 27.261 1.00 0.00 C ATOM 1174 O PRO A 75 -7.745 20.982 27.013 1.00 0.00 O ATOM 1175 CB PRO A 75 -9.817 23.416 27.428 1.00 0.00 C ATOM 1176 CG PRO A 75 -10.881 22.667 26.634 1.00 0.00 C ATOM 1177 CD PRO A 75 -10.394 22.797 25.195 1.00 0.00 C ATOM 0 HA PRO A 75 -7.923 24.145 26.626 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -9.718 23.011 28.435 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -10.072 24.470 27.533 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -10.954 21.624 26.942 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -11.869 23.109 26.767 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -10.696 21.933 24.602 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -10.823 23.677 24.717 1.00 0.00 H new ATOM 1185 N PHE A 76 -6.643 22.637 28.083 1.00 0.00 N ATOM 1186 CA PHE A 76 -5.628 21.783 28.714 1.00 0.00 C ATOM 1187 C PHE A 76 -5.036 22.367 30.013 1.00 0.00 C ATOM 1188 O PHE A 76 -5.217 23.540 30.348 1.00 0.00 O ATOM 1189 CB PHE A 76 -4.505 21.464 27.711 1.00 0.00 C ATOM 1190 CG PHE A 76 -3.538 22.596 27.403 1.00 0.00 C ATOM 1191 CD1 PHE A 76 -3.921 23.661 26.564 1.00 0.00 C ATOM 1192 CD2 PHE A 76 -2.226 22.557 27.918 1.00 0.00 C ATOM 1193 CE1 PHE A 76 -2.998 24.670 26.240 1.00 0.00 C ATOM 1194 CE2 PHE A 76 -1.305 23.566 27.589 1.00 0.00 C ATOM 1195 CZ PHE A 76 -1.690 24.623 26.747 1.00 0.00 C ATOM 0 H PHE A 76 -6.552 23.622 28.332 1.00 0.00 H new ATOM 0 HA PHE A 76 -6.142 20.867 29.005 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.933 20.620 28.095 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.962 21.140 26.776 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -4.925 23.702 26.169 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.928 21.748 28.568 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -3.297 25.485 25.598 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -0.300 23.529 27.984 1.00 0.00 H new ATOM 0 HZ PHE A 76 -0.982 25.397 26.491 1.00 0.00 H new ATOM 1205 N ASP A 77 -4.298 21.526 30.742 1.00 0.00 N ATOM 1206 CA ASP A 77 -3.633 21.878 32.001 1.00 0.00 C ATOM 1207 C ASP A 77 -2.258 22.531 31.747 1.00 0.00 C ATOM 1208 O ASP A 77 -1.206 21.888 31.833 1.00 0.00 O ATOM 1209 CB ASP A 77 -3.563 20.637 32.904 1.00 0.00 C ATOM 1210 CG ASP A 77 -2.953 20.950 34.282 1.00 0.00 C ATOM 1211 OD1 ASP A 77 -3.302 21.997 34.881 1.00 0.00 O ATOM 1212 OD2 ASP A 77 -2.154 20.127 34.791 1.00 0.00 O ATOM 0 H ASP A 77 -4.142 20.556 30.467 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.217 22.633 32.527 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -4.566 20.230 33.037 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -2.969 19.866 32.413 1.00 0.00 H new ATOM 1217 N TYR A 78 -2.280 23.819 31.394 1.00 0.00 N ATOM 1218 CA TYR A 78 -1.091 24.641 31.140 1.00 0.00 C ATOM 1219 C TYR A 78 -0.174 24.770 32.376 1.00 0.00 C ATOM 1220 O TYR A 78 -0.646 24.860 33.515 1.00 0.00 O ATOM 1221 CB TYR A 78 -1.552 26.022 30.647 1.00 0.00 C ATOM 1222 CG TYR A 78 -0.461 27.074 30.551 1.00 0.00 C ATOM 1223 CD1 TYR A 78 0.318 27.187 29.383 1.00 0.00 C ATOM 1224 CD2 TYR A 78 -0.222 27.938 31.640 1.00 0.00 C ATOM 1225 CE1 TYR A 78 1.315 28.179 29.294 1.00 0.00 C ATOM 1226 CE2 TYR A 78 0.778 28.925 31.556 1.00 0.00 C ATOM 1227 CZ TYR A 78 1.536 29.059 30.376 1.00 0.00 C ATOM 1228 OH TYR A 78 2.469 30.045 30.272 1.00 0.00 O ATOM 0 H TYR A 78 -3.151 24.335 31.273 1.00 0.00 H new ATOM 0 HA TYR A 78 -0.488 24.148 30.378 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -2.009 25.905 29.664 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.329 26.388 31.318 1.00 0.00 H new ATOM 0 HD1 TYR A 78 0.151 26.513 28.556 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.809 27.842 32.542 1.00 0.00 H new ATOM 0 HE1 TYR A 78 1.911 28.266 28.397 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.964 29.579 32.395 1.00 0.00 H new ATOM 0 HH TYR A 78 2.494 30.561 31.105 1.00 0.00 H new ATOM 1238 N ASP A 79 1.141 24.825 32.140 1.00 0.00 N ATOM 1239 CA ASP A 79 2.168 25.099 33.153 1.00 0.00 C ATOM 1240 C ASP A 79 3.066 26.285 32.719 1.00 0.00 C ATOM 1241 O ASP A 79 3.600 26.250 31.603 1.00 0.00 O ATOM 1242 CB ASP A 79 3.008 23.834 33.395 1.00 0.00 C ATOM 1243 CG ASP A 79 3.795 23.932 34.707 1.00 0.00 C ATOM 1244 OD1 ASP A 79 4.707 24.783 34.785 1.00 0.00 O ATOM 1245 OD2 ASP A 79 3.491 23.177 35.662 1.00 0.00 O ATOM 0 H ASP A 79 1.533 24.676 31.210 1.00 0.00 H new ATOM 0 HA ASP A 79 1.679 25.379 34.086 1.00 0.00 H new ATOM 0 HB2 ASP A 79 2.356 22.961 33.424 1.00 0.00 H new ATOM 0 HB3 ASP A 79 3.698 23.688 32.564 1.00 0.00 H new ATOM 1250 N PRO A 80 3.283 27.317 33.563 1.00 0.00 N ATOM 1251 CA PRO A 80 4.102 28.479 33.208 1.00 0.00 C ATOM 1252 C PRO A 80 5.611 28.178 33.170 1.00 0.00 C ATOM 1253 O PRO A 80 6.382 28.970 32.620 1.00 0.00 O ATOM 1254 CB PRO A 80 3.758 29.541 34.257 1.00 0.00 C ATOM 1255 CG PRO A 80 3.415 28.713 35.494 1.00 0.00 C ATOM 1256 CD PRO A 80 2.737 27.477 34.902 1.00 0.00 C ATOM 0 HA PRO A 80 3.881 28.811 32.194 1.00 0.00 H new ATOM 0 HB2 PRO A 80 4.598 30.211 34.441 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.918 30.161 33.942 1.00 0.00 H new ATOM 0 HG2 PRO A 80 4.306 28.451 36.064 1.00 0.00 H new ATOM 0 HG3 PRO A 80 2.752 29.253 36.170 1.00 0.00 H new ATOM 0 HD2 PRO A 80 2.935 26.595 35.511 1.00 0.00 H new ATOM 0 HD3 PRO A 80 1.655 27.605 34.869 1.00 0.00 H new ATOM 1264 N ASN A 81 6.044 27.046 33.737 1.00 0.00 N ATOM 1265 CA ASN A 81 7.435 26.582 33.726 1.00 0.00 C ATOM 1266 C ASN A 81 7.735 25.672 32.519 1.00 0.00 C ATOM 1267 O ASN A 81 8.872 25.629 32.044 1.00 0.00 O ATOM 1268 CB ASN A 81 7.763 25.836 35.037 1.00 0.00 C ATOM 1269 CG ASN A 81 7.291 26.538 36.300 1.00 0.00 C ATOM 1270 OD1 ASN A 81 7.996 27.335 36.906 1.00 0.00 O ATOM 1271 ND2 ASN A 81 6.086 26.250 36.733 1.00 0.00 N ATOM 0 H ASN A 81 5.418 26.410 34.230 1.00 0.00 H new ATOM 0 HA ASN A 81 8.067 27.466 33.640 1.00 0.00 H new ATOM 0 HB2 ASN A 81 7.312 24.845 34.998 1.00 0.00 H new ATOM 0 HB3 ASN A 81 8.842 25.693 35.098 1.00 0.00 H new ATOM 0 HD21 ASN A 81 5.730 26.691 37.581 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.506 25.585 36.222 1.00 0.00 H new ATOM 1278 N GLU A 82 6.737 24.931 32.018 1.00 0.00 N ATOM 1279 CA GLU A 82 6.907 23.988 30.905 1.00 0.00 C ATOM 1280 C GLU A 82 7.075 24.705 29.547 1.00 0.00 C ATOM 1281 O GLU A 82 6.247 25.537 29.161 1.00 0.00 O ATOM 1282 CB GLU A 82 5.718 23.011 30.879 1.00 0.00 C ATOM 1283 CG GLU A 82 5.972 21.812 29.965 1.00 0.00 C ATOM 1284 CD GLU A 82 4.728 20.921 29.799 1.00 0.00 C ATOM 1285 OE1 GLU A 82 4.236 20.355 30.805 1.00 0.00 O ATOM 1286 OE2 GLU A 82 4.261 20.744 28.645 1.00 0.00 O ATOM 0 H GLU A 82 5.783 24.970 32.376 1.00 0.00 H new ATOM 0 HA GLU A 82 7.829 23.430 31.068 1.00 0.00 H new ATOM 0 HB2 GLU A 82 5.519 22.658 31.891 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.825 23.538 30.543 1.00 0.00 H new ATOM 0 HG2 GLU A 82 6.293 22.168 28.986 1.00 0.00 H new ATOM 0 HG3 GLU A 82 6.789 21.216 30.372 1.00 0.00 H new ATOM 1293 N LYS A 83 8.130 24.353 28.793 1.00 0.00 N ATOM 1294 CA LYS A 83 8.351 24.839 27.416 1.00 0.00 C ATOM 1295 C LYS A 83 7.466 24.117 26.387 1.00 0.00 C ATOM 1296 O LYS A 83 7.187 22.925 26.523 1.00 0.00 O ATOM 1297 CB LYS A 83 9.851 24.839 27.046 1.00 0.00 C ATOM 1298 CG LYS A 83 10.493 23.496 26.643 1.00 0.00 C ATOM 1299 CD LYS A 83 10.519 22.433 27.755 1.00 0.00 C ATOM 1300 CE LYS A 83 11.430 21.243 27.408 1.00 0.00 C ATOM 1301 NZ LYS A 83 10.912 20.425 26.276 1.00 0.00 N ATOM 0 H LYS A 83 8.859 23.720 29.122 1.00 0.00 H new ATOM 0 HA LYS A 83 8.031 25.880 27.385 1.00 0.00 H new ATOM 0 HB2 LYS A 83 9.993 25.538 26.222 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.406 25.233 27.897 1.00 0.00 H new ATOM 0 HG2 LYS A 83 9.951 23.093 25.787 1.00 0.00 H new ATOM 0 HG3 LYS A 83 11.515 23.682 26.314 1.00 0.00 H new ATOM 0 HD2 LYS A 83 10.861 22.891 28.683 1.00 0.00 H new ATOM 0 HD3 LYS A 83 9.506 22.072 27.932 1.00 0.00 H new ATOM 0 HE2 LYS A 83 12.423 21.614 27.156 1.00 0.00 H new ATOM 0 HE3 LYS A 83 11.540 20.608 28.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 11.566 19.639 26.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 9.976 20.045 26.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 10.832 21.019 25.426 1.00 0.00 H new ATOM 1315 N SER A 84 7.048 24.832 25.341 1.00 0.00 N ATOM 1316 CA SER A 84 6.198 24.282 24.270 1.00 0.00 C ATOM 1317 C SER A 84 6.937 23.260 23.392 1.00 0.00 C ATOM 1318 O SER A 84 8.160 23.336 23.228 1.00 0.00 O ATOM 1319 CB SER A 84 5.628 25.415 23.408 1.00 0.00 C ATOM 1320 OG SER A 84 4.733 24.877 22.459 1.00 0.00 O ATOM 0 H SER A 84 7.288 25.814 25.207 1.00 0.00 H new ATOM 0 HA SER A 84 5.380 23.749 24.755 1.00 0.00 H new ATOM 0 HB2 SER A 84 5.115 26.142 24.037 1.00 0.00 H new ATOM 0 HB3 SER A 84 6.436 25.944 22.903 1.00 0.00 H new ATOM 0 HG SER A 84 4.573 25.535 21.750 1.00 0.00 H new ATOM 1326 N LYS A 85 6.181 22.332 22.785 1.00 0.00 N ATOM 1327 CA LYS A 85 6.674 21.319 21.828 1.00 0.00 C ATOM 1328 C LYS A 85 5.889 21.232 20.508 1.00 0.00 C ATOM 1329 O LYS A 85 6.488 20.916 19.480 1.00 0.00 O ATOM 1330 CB LYS A 85 6.781 19.944 22.521 1.00 0.00 C ATOM 1331 CG LYS A 85 5.474 19.391 23.128 1.00 0.00 C ATOM 1332 CD LYS A 85 5.398 19.560 24.656 1.00 0.00 C ATOM 1333 CE LYS A 85 4.069 18.988 25.172 1.00 0.00 C ATOM 1334 NZ LYS A 85 4.061 18.827 26.652 1.00 0.00 N ATOM 0 H LYS A 85 5.177 22.260 22.949 1.00 0.00 H new ATOM 0 HA LYS A 85 7.665 21.654 21.523 1.00 0.00 H new ATOM 0 HB2 LYS A 85 7.156 19.222 21.796 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.525 20.016 23.314 1.00 0.00 H new ATOM 0 HG2 LYS A 85 4.625 19.898 22.670 1.00 0.00 H new ATOM 0 HG3 LYS A 85 5.385 18.333 22.881 1.00 0.00 H new ATOM 0 HD2 LYS A 85 6.235 19.048 25.131 1.00 0.00 H new ATOM 0 HD3 LYS A 85 5.479 20.614 24.920 1.00 0.00 H new ATOM 0 HE2 LYS A 85 3.253 19.647 24.876 1.00 0.00 H new ATOM 0 HE3 LYS A 85 3.885 18.022 24.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 3.158 18.407 26.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 4.844 18.205 26.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 4.176 19.757 27.103 1.00 0.00 H new ATOM 1348 N HIS A 86 4.581 21.519 20.511 1.00 0.00 N ATOM 1349 CA HIS A 86 3.683 21.310 19.361 1.00 0.00 C ATOM 1350 C HIS A 86 3.994 22.215 18.158 1.00 0.00 C ATOM 1351 O HIS A 86 4.406 23.366 18.312 1.00 0.00 O ATOM 1352 CB HIS A 86 2.217 21.463 19.804 1.00 0.00 C ATOM 1353 CG HIS A 86 1.756 20.342 20.698 1.00 0.00 C ATOM 1354 ND1 HIS A 86 1.776 20.353 22.095 1.00 0.00 N ATOM 1355 CD2 HIS A 86 1.324 19.123 20.272 1.00 0.00 C ATOM 1356 CE1 HIS A 86 1.381 19.126 22.477 1.00 0.00 C ATOM 1357 NE2 HIS A 86 1.088 18.374 21.403 1.00 0.00 N ATOM 0 H HIS A 86 4.106 21.910 21.325 1.00 0.00 H new ATOM 0 HA HIS A 86 3.856 20.292 19.011 1.00 0.00 H new ATOM 0 HB2 HIS A 86 2.098 22.411 20.328 1.00 0.00 H new ATOM 0 HB3 HIS A 86 1.578 21.504 18.922 1.00 0.00 H new ATOM 0 HD2 HIS A 86 1.192 18.806 19.248 1.00 0.00 H new ATOM 0 HE1 HIS A 86 1.309 18.792 23.502 1.00 0.00 H new ATOM 0 HE2 HIS A 86 0.749 17.412 21.422 1.00 0.00 H new ATOM 1365 N LYS A 87 3.750 21.678 16.954 1.00 0.00 N ATOM 1366 CA LYS A 87 3.940 22.345 15.652 1.00 0.00 C ATOM 1367 C LYS A 87 2.733 22.221 14.708 1.00 0.00 C ATOM 1368 O LYS A 87 1.922 21.300 14.823 1.00 0.00 O ATOM 1369 CB LYS A 87 5.225 21.837 14.961 1.00 0.00 C ATOM 1370 CG LYS A 87 6.512 22.289 15.666 1.00 0.00 C ATOM 1371 CD LYS A 87 7.757 21.824 14.894 1.00 0.00 C ATOM 1372 CE LYS A 87 9.029 22.422 15.514 1.00 0.00 C ATOM 1373 NZ LYS A 87 10.261 21.877 14.881 1.00 0.00 N ATOM 0 H LYS A 87 3.399 20.725 16.854 1.00 0.00 H new ATOM 0 HA LYS A 87 4.041 23.408 15.872 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.203 20.748 14.923 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.240 22.191 13.930 1.00 0.00 H new ATOM 0 HG2 LYS A 87 6.520 23.375 15.755 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.537 21.886 16.679 1.00 0.00 H new ATOM 0 HD2 LYS A 87 7.815 20.736 14.908 1.00 0.00 H new ATOM 0 HD3 LYS A 87 7.678 22.125 13.849 1.00 0.00 H new ATOM 0 HE2 LYS A 87 9.012 23.506 15.403 1.00 0.00 H new ATOM 0 HE3 LYS A 87 9.046 22.211 16.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 11.098 22.304 15.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 10.290 20.845 15.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.257 22.100 13.865 1.00 0.00 H new ATOM 1387 N PHE A 88 2.688 23.130 13.738 1.00 0.00 N ATOM 1388 CA PHE A 88 1.806 23.170 12.567 1.00 0.00 C ATOM 1389 C PHE A 88 2.631 23.149 11.278 1.00 0.00 C ATOM 1390 O PHE A 88 3.781 23.592 11.266 1.00 0.00 O ATOM 1391 CB PHE A 88 0.943 24.441 12.599 1.00 0.00 C ATOM 1392 CG PHE A 88 -0.363 24.239 13.317 1.00 0.00 C ATOM 1393 CD1 PHE A 88 -1.430 23.607 12.649 1.00 0.00 C ATOM 1394 CD2 PHE A 88 -0.509 24.659 14.649 1.00 0.00 C ATOM 1395 CE1 PHE A 88 -2.645 23.395 13.318 1.00 0.00 C ATOM 1396 CE2 PHE A 88 -1.723 24.443 15.317 1.00 0.00 C ATOM 1397 CZ PHE A 88 -2.787 23.815 14.649 1.00 0.00 C ATOM 0 H PHE A 88 3.322 23.929 13.749 1.00 0.00 H new ATOM 0 HA PHE A 88 1.160 22.292 12.593 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.500 25.241 13.086 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.745 24.766 11.578 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -1.313 23.286 11.624 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.310 25.146 15.157 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -3.467 22.911 12.811 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -1.840 24.759 16.343 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.722 23.654 15.164 1.00 0.00 H new ATOM 1407 N MET A 89 2.027 22.682 10.184 1.00 0.00 N ATOM 1408 CA MET A 89 2.630 22.715 8.849 1.00 0.00 C ATOM 1409 C MET A 89 1.583 23.061 7.781 1.00 0.00 C ATOM 1410 O MET A 89 0.455 22.567 7.822 1.00 0.00 O ATOM 1411 CB MET A 89 3.358 21.381 8.599 1.00 0.00 C ATOM 1412 CG MET A 89 4.117 21.328 7.267 1.00 0.00 C ATOM 1413 SD MET A 89 3.114 20.856 5.830 1.00 0.00 S ATOM 1414 CE MET A 89 3.127 19.055 6.017 1.00 0.00 C ATOM 0 H MET A 89 1.096 22.266 10.199 1.00 0.00 H new ATOM 0 HA MET A 89 3.374 23.509 8.785 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.060 21.203 9.414 1.00 0.00 H new ATOM 0 HB3 MET A 89 2.630 20.571 8.624 1.00 0.00 H new ATOM 0 HG2 MET A 89 4.557 22.307 7.078 1.00 0.00 H new ATOM 0 HG3 MET A 89 4.941 20.621 7.364 1.00 0.00 H new ATOM 0 HE1 MET A 89 2.552 18.601 5.210 1.00 0.00 H new ATOM 0 HE2 MET A 89 4.154 18.693 5.979 1.00 0.00 H new ATOM 0 HE3 MET A 89 2.683 18.785 6.975 1.00 0.00 H new ATOM 1424 N VAL A 90 1.957 23.908 6.819 1.00 0.00 N ATOM 1425 CA VAL A 90 1.142 24.276 5.646 1.00 0.00 C ATOM 1426 C VAL A 90 1.889 23.874 4.377 1.00 0.00 C ATOM 1427 O VAL A 90 2.986 24.383 4.141 1.00 0.00 O ATOM 1428 CB VAL A 90 0.810 25.785 5.636 1.00 0.00 C ATOM 1429 CG1 VAL A 90 -0.075 26.162 4.440 1.00 0.00 C ATOM 1430 CG2 VAL A 90 0.075 26.218 6.912 1.00 0.00 C ATOM 0 H VAL A 90 2.864 24.375 6.830 1.00 0.00 H new ATOM 0 HA VAL A 90 0.192 23.743 5.695 1.00 0.00 H new ATOM 0 HB VAL A 90 1.770 26.297 5.569 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.287 27.231 4.467 1.00 0.00 H new ATOM 0 HG12 VAL A 90 0.443 25.918 3.513 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.011 25.605 4.490 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.139 27.286 6.864 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.860 25.664 6.999 1.00 0.00 H new ATOM 0 HG23 VAL A 90 0.701 26.012 7.780 1.00 0.00 H new ATOM 1440 N GLN A 91 1.304 22.999 3.553 1.00 0.00 N ATOM 1441 CA GLN A 91 1.858 22.529 2.278 1.00 0.00 C ATOM 1442 C GLN A 91 1.110 23.171 1.101 1.00 0.00 C ATOM 1443 O GLN A 91 -0.109 23.330 1.160 1.00 0.00 O ATOM 1444 CB GLN A 91 1.775 20.993 2.221 1.00 0.00 C ATOM 1445 CG GLN A 91 2.610 20.383 1.085 1.00 0.00 C ATOM 1446 CD GLN A 91 2.427 18.870 1.010 1.00 0.00 C ATOM 1447 OE1 GLN A 91 3.115 18.093 1.658 1.00 0.00 O ATOM 1448 NE2 GLN A 91 1.475 18.399 0.230 1.00 0.00 N ATOM 0 H GLN A 91 0.397 22.582 3.763 1.00 0.00 H new ATOM 0 HA GLN A 91 2.905 22.825 2.204 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.113 20.582 3.172 1.00 0.00 H new ATOM 0 HB3 GLN A 91 0.733 20.696 2.097 1.00 0.00 H new ATOM 0 HG2 GLN A 91 2.320 20.834 0.136 1.00 0.00 H new ATOM 0 HG3 GLN A 91 3.663 20.616 1.240 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.897 19.040 -0.313 1.00 0.00 H new ATOM 0 HE22 GLN A 91 1.316 17.393 0.170 1.00 0.00 H new ATOM 1457 N THR A 92 1.804 23.509 0.016 1.00 0.00 N ATOM 1458 CA THR A 92 1.228 24.148 -1.178 1.00 0.00 C ATOM 1459 C THR A 92 1.816 23.642 -2.494 1.00 0.00 C ATOM 1460 O THR A 92 2.960 23.183 -2.549 1.00 0.00 O ATOM 1461 CB THR A 92 1.352 25.679 -1.133 1.00 0.00 C ATOM 1462 OG1 THR A 92 2.585 26.103 -0.613 1.00 0.00 O ATOM 1463 CG2 THR A 92 0.252 26.298 -0.281 1.00 0.00 C ATOM 0 H THR A 92 2.807 23.344 -0.065 1.00 0.00 H new ATOM 0 HA THR A 92 0.176 23.865 -1.152 1.00 0.00 H new ATOM 0 HB THR A 92 1.265 26.010 -2.168 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.431 26.727 0.127 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.367 27.382 -0.269 1.00 0.00 H new ATOM 0 HG22 THR A 92 -0.721 26.041 -0.700 1.00 0.00 H new ATOM 0 HG23 THR A 92 0.321 25.915 0.737 1.00 0.00 H new ATOM 1471 N ILE A 93 1.019 23.734 -3.565 1.00 0.00 N ATOM 1472 CA ILE A 93 1.438 23.435 -4.947 1.00 0.00 C ATOM 1473 C ILE A 93 0.655 24.274 -5.971 1.00 0.00 C ATOM 1474 O ILE A 93 -0.535 24.543 -5.781 1.00 0.00 O ATOM 1475 CB ILE A 93 1.324 21.912 -5.195 1.00 0.00 C ATOM 1476 CG1 ILE A 93 2.265 21.411 -6.315 1.00 0.00 C ATOM 1477 CG2 ILE A 93 -0.133 21.442 -5.338 1.00 0.00 C ATOM 1478 CD1 ILE A 93 1.639 21.198 -7.693 1.00 0.00 C ATOM 0 H ILE A 93 0.043 24.024 -3.498 1.00 0.00 H new ATOM 0 HA ILE A 93 2.482 23.719 -5.081 1.00 0.00 H new ATOM 0 HB ILE A 93 1.689 21.424 -4.291 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.081 22.126 -6.419 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.706 20.468 -5.992 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -0.153 20.366 -5.510 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.681 21.673 -4.425 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.599 21.953 -6.180 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.401 20.847 -8.389 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.844 20.456 -7.621 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.225 22.139 -8.054 1.00 0.00 H new ATOM 1490 N PHE A 94 1.302 24.735 -7.045 1.00 0.00 N ATOM 1491 CA PHE A 94 0.664 25.594 -8.053 1.00 0.00 C ATOM 1492 C PHE A 94 -0.444 24.856 -8.817 1.00 0.00 C ATOM 1493 O PHE A 94 -0.235 23.761 -9.343 1.00 0.00 O ATOM 1494 CB PHE A 94 1.699 26.162 -9.030 1.00 0.00 C ATOM 1495 CG PHE A 94 2.446 27.364 -8.493 1.00 0.00 C ATOM 1496 CD1 PHE A 94 1.779 28.599 -8.370 1.00 0.00 C ATOM 1497 CD2 PHE A 94 3.804 27.260 -8.135 1.00 0.00 C ATOM 1498 CE1 PHE A 94 2.469 29.731 -7.903 1.00 0.00 C ATOM 1499 CE2 PHE A 94 4.495 28.395 -7.676 1.00 0.00 C ATOM 1500 CZ PHE A 94 3.830 29.628 -7.572 1.00 0.00 C ATOM 0 H PHE A 94 2.281 24.525 -7.242 1.00 0.00 H new ATOM 0 HA PHE A 94 0.202 26.423 -7.517 1.00 0.00 H new ATOM 0 HB2 PHE A 94 2.417 25.381 -9.280 1.00 0.00 H new ATOM 0 HB3 PHE A 94 1.197 26.441 -9.956 1.00 0.00 H new ATOM 0 HD1 PHE A 94 0.735 28.676 -8.635 1.00 0.00 H new ATOM 0 HD2 PHE A 94 4.313 26.311 -8.213 1.00 0.00 H new ATOM 0 HE1 PHE A 94 1.955 30.675 -7.799 1.00 0.00 H new ATOM 0 HE2 PHE A 94 5.537 28.319 -7.403 1.00 0.00 H new ATOM 0 HZ PHE A 94 4.368 30.502 -7.236 1.00 0.00 H new ATOM 1510 N ALA A 95 -1.617 25.485 -8.919 1.00 0.00 N ATOM 1511 CA ALA A 95 -2.724 24.935 -9.702 1.00 0.00 C ATOM 1512 C ALA A 95 -2.534 25.196 -11.217 1.00 0.00 C ATOM 1513 O ALA A 95 -2.061 26.276 -11.595 1.00 0.00 O ATOM 1514 CB ALA A 95 -4.045 25.494 -9.170 1.00 0.00 C ATOM 0 H ALA A 95 -1.824 26.376 -8.468 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.743 23.851 -9.589 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.873 25.087 -9.751 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.164 25.214 -8.123 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.041 26.581 -9.256 1.00 0.00 H new ATOM 1520 N PRO A 96 -2.910 24.247 -12.096 1.00 0.00 N ATOM 1521 CA PRO A 96 -2.845 24.426 -13.548 1.00 0.00 C ATOM 1522 C PRO A 96 -3.945 25.387 -14.057 1.00 0.00 C ATOM 1523 O PRO A 96 -4.940 25.613 -13.358 1.00 0.00 O ATOM 1524 CB PRO A 96 -2.984 23.010 -14.120 1.00 0.00 C ATOM 1525 CG PRO A 96 -3.891 22.323 -13.104 1.00 0.00 C ATOM 1526 CD PRO A 96 -3.451 22.931 -11.773 1.00 0.00 C ATOM 0 HA PRO A 96 -1.913 24.893 -13.867 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -3.426 23.018 -15.116 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -2.019 22.511 -14.203 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -4.944 22.519 -13.307 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -3.760 21.241 -13.115 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -4.291 23.012 -11.084 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -2.700 22.308 -11.288 1.00 0.00 H new ATOM 1599 N MET A 102 -9.605 19.968 -7.266 1.00 0.00 N ATOM 1600 CA MET A 102 -8.602 20.249 -6.233 1.00 0.00 C ATOM 1601 C MET A 102 -7.914 18.994 -5.683 1.00 0.00 C ATOM 1602 O MET A 102 -6.917 19.127 -4.983 1.00 0.00 O ATOM 1603 CB MET A 102 -9.201 21.080 -5.089 1.00 0.00 C ATOM 1604 CG MET A 102 -10.259 20.345 -4.256 1.00 0.00 C ATOM 1605 SD MET A 102 -10.917 21.342 -2.891 1.00 0.00 S ATOM 1606 CE MET A 102 -12.065 20.135 -2.169 1.00 0.00 C ATOM 0 HA MET A 102 -7.826 20.831 -6.729 1.00 0.00 H new ATOM 0 HB2 MET A 102 -8.395 21.400 -4.429 1.00 0.00 H new ATOM 0 HB3 MET A 102 -9.648 21.982 -5.507 1.00 0.00 H new ATOM 0 HG2 MET A 102 -11.080 20.046 -4.907 1.00 0.00 H new ATOM 0 HG3 MET A 102 -9.823 19.431 -3.852 1.00 0.00 H new ATOM 0 HE1 MET A 102 -12.565 20.579 -1.308 1.00 0.00 H new ATOM 0 HE2 MET A 102 -12.808 19.849 -2.913 1.00 0.00 H new ATOM 0 HE3 MET A 102 -11.512 19.251 -1.851 1.00 0.00 H new ATOM 1616 N GLU A 103 -8.408 17.786 -5.977 1.00 0.00 N ATOM 1617 CA GLU A 103 -7.716 16.536 -5.632 1.00 0.00 C ATOM 1618 C GLU A 103 -6.661 16.174 -6.689 1.00 0.00 C ATOM 1619 O GLU A 103 -5.558 15.750 -6.345 1.00 0.00 O ATOM 1620 CB GLU A 103 -8.738 15.404 -5.438 1.00 0.00 C ATOM 1621 CG GLU A 103 -8.096 14.143 -4.843 1.00 0.00 C ATOM 1622 CD GLU A 103 -9.152 13.051 -4.595 1.00 0.00 C ATOM 1623 OE1 GLU A 103 -9.810 13.068 -3.523 1.00 0.00 O ATOM 1624 OE2 GLU A 103 -9.323 12.157 -5.458 1.00 0.00 O ATOM 0 H GLU A 103 -9.296 17.646 -6.459 1.00 0.00 H new ATOM 0 HA GLU A 103 -7.185 16.680 -4.691 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -9.538 15.747 -4.782 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.195 15.160 -6.397 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -7.330 13.766 -5.521 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -7.598 14.392 -3.906 1.00 0.00 H new ATOM 1631 N ALA A 104 -6.962 16.387 -7.975 1.00 0.00 N ATOM 1632 CA ALA A 104 -6.122 15.939 -9.085 1.00 0.00 C ATOM 1633 C ALA A 104 -4.757 16.635 -9.101 1.00 0.00 C ATOM 1634 O ALA A 104 -3.749 15.996 -9.407 1.00 0.00 O ATOM 1635 CB ALA A 104 -6.860 16.177 -10.405 1.00 0.00 C ATOM 0 H ALA A 104 -7.803 16.880 -8.274 1.00 0.00 H new ATOM 0 HA ALA A 104 -5.929 14.874 -8.953 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -6.237 15.844 -11.235 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -7.795 15.616 -10.405 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -7.074 17.240 -10.515 1.00 0.00 H new ATOM 1641 N VAL A 105 -4.705 17.915 -8.700 1.00 0.00 N ATOM 1642 CA VAL A 105 -3.444 18.663 -8.628 1.00 0.00 C ATOM 1643 C VAL A 105 -2.435 18.001 -7.679 1.00 0.00 C ATOM 1644 O VAL A 105 -1.249 17.959 -7.980 1.00 0.00 O ATOM 1645 CB VAL A 105 -3.672 20.141 -8.279 1.00 0.00 C ATOM 1646 CG1 VAL A 105 -4.139 20.346 -6.840 1.00 0.00 C ATOM 1647 CG2 VAL A 105 -2.399 20.959 -8.509 1.00 0.00 C ATOM 0 H VAL A 105 -5.525 18.453 -8.420 1.00 0.00 H new ATOM 0 HA VAL A 105 -3.005 18.636 -9.625 1.00 0.00 H new ATOM 0 HB VAL A 105 -4.464 20.486 -8.943 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -4.283 21.410 -6.652 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.081 19.819 -6.684 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -3.387 19.955 -6.154 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -2.586 22.002 -8.255 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.598 20.570 -7.880 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -2.105 20.888 -9.556 1.00 0.00 H new ATOM 1657 N TRP A 106 -2.889 17.402 -6.572 1.00 0.00 N ATOM 1658 CA TRP A 106 -2.027 16.691 -5.621 1.00 0.00 C ATOM 1659 C TRP A 106 -1.559 15.323 -6.135 1.00 0.00 C ATOM 1660 O TRP A 106 -0.498 14.844 -5.729 1.00 0.00 O ATOM 1661 CB TRP A 106 -2.783 16.531 -4.304 1.00 0.00 C ATOM 1662 CG TRP A 106 -3.151 17.822 -3.635 1.00 0.00 C ATOM 1663 CD1 TRP A 106 -4.407 18.293 -3.480 1.00 0.00 C ATOM 1664 CD2 TRP A 106 -2.277 18.843 -3.061 1.00 0.00 C ATOM 1665 NE1 TRP A 106 -4.376 19.530 -2.869 1.00 0.00 N ATOM 1666 CE2 TRP A 106 -3.088 19.908 -2.566 1.00 0.00 C ATOM 1667 CE3 TRP A 106 -0.879 18.988 -2.924 1.00 0.00 C ATOM 1668 CZ2 TRP A 106 -2.551 21.031 -1.922 1.00 0.00 C ATOM 1669 CZ3 TRP A 106 -0.325 20.131 -2.314 1.00 0.00 C ATOM 1670 CH2 TRP A 106 -1.158 21.133 -1.784 1.00 0.00 C ATOM 0 H TRP A 106 -3.874 17.397 -6.309 1.00 0.00 H new ATOM 0 HA TRP A 106 -1.124 17.285 -5.481 1.00 0.00 H new ATOM 0 HB2 TRP A 106 -3.693 15.961 -4.490 1.00 0.00 H new ATOM 0 HB3 TRP A 106 -2.172 15.943 -3.619 1.00 0.00 H new ATOM 0 HD1 TRP A 106 -5.304 17.777 -3.789 1.00 0.00 H new ATOM 0 HE1 TRP A 106 -5.203 20.093 -2.668 1.00 0.00 H new ATOM 0 HE3 TRP A 106 -0.225 18.211 -3.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 -3.199 21.805 -1.538 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 0.748 20.239 -2.253 1.00 0.00 H new ATOM 0 HH2 TRP A 106 -0.726 21.980 -1.271 1.00 0.00 H new ATOM 1681 N LYS A 107 -2.323 14.703 -7.045 1.00 0.00 N ATOM 1682 CA LYS A 107 -1.960 13.436 -7.700 1.00 0.00 C ATOM 1683 C LYS A 107 -0.939 13.630 -8.828 1.00 0.00 C ATOM 1684 O LYS A 107 -0.097 12.759 -9.049 1.00 0.00 O ATOM 1685 CB LYS A 107 -3.233 12.730 -8.203 1.00 0.00 C ATOM 1686 CG LYS A 107 -4.308 12.485 -7.126 1.00 0.00 C ATOM 1687 CD LYS A 107 -3.832 11.634 -5.940 1.00 0.00 C ATOM 1688 CE LYS A 107 -4.929 11.582 -4.870 1.00 0.00 C ATOM 1689 NZ LYS A 107 -4.563 10.668 -3.752 1.00 0.00 N ATOM 0 H LYS A 107 -3.223 15.072 -7.352 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.471 12.802 -6.960 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -3.670 13.328 -9.003 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.951 11.772 -8.639 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.656 13.448 -6.751 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -5.164 11.995 -7.589 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -3.591 10.626 -6.277 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.920 12.057 -5.519 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -5.104 12.584 -4.479 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -5.863 11.249 -5.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -5.328 10.658 -3.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -4.420 9.707 -4.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -3.685 11.001 -3.305 1.00 0.00 H new ATOM 1703 N GLU A 108 -0.969 14.783 -9.500 1.00 0.00 N ATOM 1704 CA GLU A 108 0.006 15.164 -10.539 1.00 0.00 C ATOM 1705 C GLU A 108 1.252 15.897 -10.004 1.00 0.00 C ATOM 1706 O GLU A 108 2.291 15.938 -10.666 1.00 0.00 O ATOM 1707 CB GLU A 108 -0.698 16.001 -11.610 1.00 0.00 C ATOM 1708 CG GLU A 108 -1.055 17.429 -11.214 1.00 0.00 C ATOM 1709 CD GLU A 108 -1.765 18.165 -12.367 1.00 0.00 C ATOM 1710 OE1 GLU A 108 -1.068 18.675 -13.280 1.00 0.00 O ATOM 1711 OE2 GLU A 108 -3.018 18.243 -12.372 1.00 0.00 O ATOM 0 H GLU A 108 -1.682 15.494 -9.339 1.00 0.00 H new ATOM 0 HA GLU A 108 0.386 14.236 -10.966 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.059 16.039 -12.492 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.613 15.486 -11.902 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.700 17.415 -10.336 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.150 17.969 -10.936 1.00 0.00 H new ATOM 1718 N ALA A 109 1.132 16.481 -8.810 1.00 0.00 N ATOM 1719 CA ALA A 109 2.139 17.277 -8.117 1.00 0.00 C ATOM 1720 C ALA A 109 3.465 16.523 -8.007 1.00 0.00 C ATOM 1721 O ALA A 109 3.517 15.391 -7.511 1.00 0.00 O ATOM 1722 CB ALA A 109 1.655 17.636 -6.705 1.00 0.00 C ATOM 0 H ALA A 109 0.271 16.403 -8.269 1.00 0.00 H new ATOM 0 HA ALA A 109 2.295 18.185 -8.700 1.00 0.00 H new ATOM 0 HB1 ALA A 109 2.416 18.230 -6.199 1.00 0.00 H new ATOM 0 HB2 ALA A 109 0.731 18.211 -6.772 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.473 16.722 -6.139 1.00 0.00 H new ATOM 1728 N LYS A 110 4.544 17.188 -8.429 1.00 0.00 N ATOM 1729 CA LYS A 110 5.897 16.648 -8.328 1.00 0.00 C ATOM 1730 C LYS A 110 6.603 17.133 -7.057 1.00 0.00 C ATOM 1731 O LYS A 110 6.348 18.251 -6.612 1.00 0.00 O ATOM 1732 CB LYS A 110 6.688 16.999 -9.602 1.00 0.00 C ATOM 1733 CG LYS A 110 6.228 16.162 -10.804 1.00 0.00 C ATOM 1734 CD LYS A 110 7.072 16.476 -12.045 1.00 0.00 C ATOM 1735 CE LYS A 110 6.659 15.547 -13.194 1.00 0.00 C ATOM 1736 NZ LYS A 110 7.450 15.811 -14.426 1.00 0.00 N ATOM 0 H LYS A 110 4.501 18.116 -8.850 1.00 0.00 H new ATOM 0 HA LYS A 110 5.840 15.562 -8.248 1.00 0.00 H new ATOM 0 HB2 LYS A 110 6.564 18.058 -9.827 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.751 16.832 -9.428 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.306 15.101 -10.565 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.178 16.365 -11.013 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.934 17.517 -12.338 1.00 0.00 H new ATOM 0 HD3 LYS A 110 8.131 16.345 -11.820 1.00 0.00 H new ATOM 0 HE2 LYS A 110 6.795 14.509 -12.890 1.00 0.00 H new ATOM 0 HE3 LYS A 110 5.598 15.681 -13.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.143 15.165 -15.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.301 16.794 -14.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.460 15.659 -14.229 1.00 0.00 H new ATOM 1750 N PRO A 111 7.559 16.357 -6.518 1.00 0.00 N ATOM 1751 CA PRO A 111 8.342 16.726 -5.330 1.00 0.00 C ATOM 1752 C PRO A 111 9.192 17.999 -5.516 1.00 0.00 C ATOM 1753 O PRO A 111 9.588 18.622 -4.532 1.00 0.00 O ATOM 1754 CB PRO A 111 9.194 15.489 -5.016 1.00 0.00 C ATOM 1755 CG PRO A 111 9.295 14.754 -6.353 1.00 0.00 C ATOM 1756 CD PRO A 111 7.963 15.052 -7.019 1.00 0.00 C ATOM 0 HA PRO A 111 7.685 16.991 -4.501 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.178 15.768 -4.640 1.00 0.00 H new ATOM 0 HB3 PRO A 111 8.726 14.866 -4.253 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.132 15.117 -6.949 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.444 13.683 -6.213 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.061 15.062 -8.105 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.223 14.291 -6.773 1.00 0.00 H new ATOM 1764 N ASP A 112 9.429 18.421 -6.765 1.00 0.00 N ATOM 1765 CA ASP A 112 10.092 19.689 -7.101 1.00 0.00 C ATOM 1766 C ASP A 112 9.137 20.898 -7.198 1.00 0.00 C ATOM 1767 O ASP A 112 9.582 22.045 -7.115 1.00 0.00 O ATOM 1768 CB ASP A 112 10.874 19.525 -8.412 1.00 0.00 C ATOM 1769 CG ASP A 112 12.003 18.491 -8.297 1.00 0.00 C ATOM 1770 OD1 ASP A 112 13.055 18.814 -7.692 1.00 0.00 O ATOM 1771 OD2 ASP A 112 11.858 17.365 -8.829 1.00 0.00 O ATOM 0 H ASP A 112 9.160 17.880 -7.587 1.00 0.00 H new ATOM 0 HA ASP A 112 10.766 19.913 -6.274 1.00 0.00 H new ATOM 0 HB2 ASP A 112 10.189 19.224 -9.205 1.00 0.00 H new ATOM 0 HB3 ASP A 112 11.295 20.487 -8.703 1.00 0.00 H new ATOM 1776 N GLU A 113 7.829 20.661 -7.345 1.00 0.00 N ATOM 1777 CA GLU A 113 6.785 21.699 -7.370 1.00 0.00 C ATOM 1778 C GLU A 113 6.102 21.876 -6.001 1.00 0.00 C ATOM 1779 O GLU A 113 5.466 22.904 -5.753 1.00 0.00 O ATOM 1780 CB GLU A 113 5.730 21.350 -8.437 1.00 0.00 C ATOM 1781 CG GLU A 113 6.281 21.253 -9.868 1.00 0.00 C ATOM 1782 CD GLU A 113 6.939 22.563 -10.349 1.00 0.00 C ATOM 1783 OE1 GLU A 113 6.290 23.637 -10.290 1.00 0.00 O ATOM 1784 OE2 GLU A 113 8.103 22.524 -10.820 1.00 0.00 O ATOM 0 H GLU A 113 7.454 19.718 -7.453 1.00 0.00 H new ATOM 0 HA GLU A 113 7.270 22.644 -7.617 1.00 0.00 H new ATOM 0 HB2 GLU A 113 5.266 20.399 -8.174 1.00 0.00 H new ATOM 0 HB3 GLU A 113 4.944 22.105 -8.414 1.00 0.00 H new ATOM 0 HG2 GLU A 113 7.012 20.446 -9.916 1.00 0.00 H new ATOM 0 HG3 GLU A 113 5.470 20.989 -10.547 1.00 0.00 H new ATOM 1791 N LEU A 114 6.237 20.888 -5.109 1.00 0.00 N ATOM 1792 CA LEU A 114 5.651 20.887 -3.770 1.00 0.00 C ATOM 1793 C LEU A 114 6.492 21.754 -2.824 1.00 0.00 C ATOM 1794 O LEU A 114 7.726 21.693 -2.822 1.00 0.00 O ATOM 1795 CB LEU A 114 5.526 19.440 -3.248 1.00 0.00 C ATOM 1796 CG LEU A 114 4.375 18.656 -3.898 1.00 0.00 C ATOM 1797 CD1 LEU A 114 4.582 17.145 -3.791 1.00 0.00 C ATOM 1798 CD2 LEU A 114 3.057 18.986 -3.198 1.00 0.00 C ATOM 0 H LEU A 114 6.773 20.044 -5.308 1.00 0.00 H new ATOM 0 HA LEU A 114 4.650 21.316 -3.815 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.463 18.914 -3.430 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.377 19.462 -2.168 1.00 0.00 H new ATOM 0 HG LEU A 114 4.351 18.946 -4.949 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.746 16.629 -4.263 1.00 0.00 H new ATOM 0 HD12 LEU A 114 5.509 16.868 -4.293 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.639 16.859 -2.741 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.247 18.426 -3.665 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.126 18.714 -2.145 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.857 20.054 -3.284 1.00 0.00 H new ATOM 1810 N MET A 115 5.810 22.555 -2.005 1.00 0.00 N ATOM 1811 CA MET A 115 6.420 23.444 -1.017 1.00 0.00 C ATOM 1812 C MET A 115 5.733 23.285 0.342 1.00 0.00 C ATOM 1813 O MET A 115 4.545 22.965 0.396 1.00 0.00 O ATOM 1814 CB MET A 115 6.306 24.908 -1.469 1.00 0.00 C ATOM 1815 CG MET A 115 6.947 25.205 -2.826 1.00 0.00 C ATOM 1816 SD MET A 115 6.656 26.903 -3.396 1.00 0.00 S ATOM 1817 CE MET A 115 7.402 26.796 -5.045 1.00 0.00 C ATOM 0 H MET A 115 4.791 22.604 -2.011 1.00 0.00 H new ATOM 0 HA MET A 115 7.472 23.174 -0.925 1.00 0.00 H new ATOM 0 HB2 MET A 115 5.252 25.181 -1.512 1.00 0.00 H new ATOM 0 HB3 MET A 115 6.769 25.545 -0.715 1.00 0.00 H new ATOM 0 HG2 MET A 115 8.021 25.030 -2.760 1.00 0.00 H new ATOM 0 HG3 MET A 115 6.555 24.508 -3.566 1.00 0.00 H new ATOM 0 HE1 MET A 115 7.314 27.759 -5.547 1.00 0.00 H new ATOM 0 HE2 MET A 115 8.455 26.530 -4.951 1.00 0.00 H new ATOM 0 HE3 MET A 115 6.886 26.034 -5.629 1.00 0.00 H new ATOM 1827 N ASP A 116 6.438 23.543 1.441 1.00 0.00 N ATOM 1828 CA ASP A 116 5.841 23.578 2.781 1.00 0.00 C ATOM 1829 C ASP A 116 6.544 24.542 3.750 1.00 0.00 C ATOM 1830 O ASP A 116 7.723 24.860 3.585 1.00 0.00 O ATOM 1831 CB ASP A 116 5.744 22.177 3.400 1.00 0.00 C ATOM 1832 CG ASP A 116 7.091 21.648 3.923 1.00 0.00 C ATOM 1833 OD1 ASP A 116 7.826 20.982 3.157 1.00 0.00 O ATOM 1834 OD2 ASP A 116 7.398 21.863 5.122 1.00 0.00 O ATOM 0 H ASP A 116 7.440 23.734 1.431 1.00 0.00 H new ATOM 0 HA ASP A 116 4.834 23.967 2.629 1.00 0.00 H new ATOM 0 HB2 ASP A 116 5.027 22.199 4.221 1.00 0.00 H new ATOM 0 HB3 ASP A 116 5.354 21.484 2.654 1.00 0.00 H new ATOM 1839 N SER A 117 5.813 24.977 4.781 1.00 0.00 N ATOM 1840 CA SER A 117 6.325 25.803 5.884 1.00 0.00 C ATOM 1841 C SER A 117 5.812 25.289 7.225 1.00 0.00 C ATOM 1842 O SER A 117 4.648 24.898 7.333 1.00 0.00 O ATOM 1843 CB SER A 117 5.932 27.278 5.719 1.00 0.00 C ATOM 1844 OG SER A 117 6.442 27.777 4.498 1.00 0.00 O ATOM 0 H SER A 117 4.821 24.759 4.876 1.00 0.00 H new ATOM 0 HA SER A 117 7.412 25.732 5.859 1.00 0.00 H new ATOM 0 HB2 SER A 117 4.847 27.379 5.738 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.322 27.863 6.552 1.00 0.00 H new ATOM 0 HG SER A 117 6.187 28.718 4.397 1.00 0.00 H new ATOM 1850 N LYS A 118 6.673 25.326 8.247 1.00 0.00 N ATOM 1851 CA LYS A 118 6.418 24.842 9.617 1.00 0.00 C ATOM 1852 C LYS A 118 6.469 25.972 10.651 1.00 0.00 C ATOM 1853 O LYS A 118 7.233 26.924 10.500 1.00 0.00 O ATOM 1854 CB LYS A 118 7.349 23.662 9.975 1.00 0.00 C ATOM 1855 CG LYS A 118 8.818 24.003 10.310 1.00 0.00 C ATOM 1856 CD LYS A 118 9.548 24.763 9.193 1.00 0.00 C ATOM 1857 CE LYS A 118 11.054 24.887 9.447 1.00 0.00 C ATOM 1858 NZ LYS A 118 11.770 25.325 8.216 1.00 0.00 N ATOM 0 H LYS A 118 7.612 25.711 8.142 1.00 0.00 H new ATOM 0 HA LYS A 118 5.397 24.461 9.645 1.00 0.00 H new ATOM 0 HB2 LYS A 118 6.920 23.139 10.830 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.346 22.963 9.139 1.00 0.00 H new ATOM 0 HG2 LYS A 118 8.844 24.601 11.221 1.00 0.00 H new ATOM 0 HG3 LYS A 118 9.357 23.079 10.520 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.385 24.251 8.245 1.00 0.00 H new ATOM 0 HD3 LYS A 118 9.117 25.759 9.096 1.00 0.00 H new ATOM 0 HE2 LYS A 118 11.233 25.602 10.250 1.00 0.00 H new ATOM 0 HE3 LYS A 118 11.450 23.928 9.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 12.788 25.401 8.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 11.616 24.629 7.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 11.406 26.251 7.914 1.00 0.00 H new ATOM 1872 N LEU A 119 5.641 25.861 11.688 1.00 0.00 N ATOM 1873 CA LEU A 119 5.468 26.863 12.746 1.00 0.00 C ATOM 1874 C LEU A 119 5.271 26.158 14.101 1.00 0.00 C ATOM 1875 O LEU A 119 4.674 25.083 14.123 1.00 0.00 O ATOM 1876 CB LEU A 119 4.238 27.747 12.422 1.00 0.00 C ATOM 1877 CG LEU A 119 4.359 28.649 11.170 1.00 0.00 C ATOM 1878 CD1 LEU A 119 3.798 27.994 9.902 1.00 0.00 C ATOM 1879 CD2 LEU A 119 3.555 29.939 11.336 1.00 0.00 C ATOM 0 H LEU A 119 5.049 25.042 11.822 1.00 0.00 H new ATOM 0 HA LEU A 119 6.356 27.492 12.802 1.00 0.00 H new ATOM 0 HB2 LEU A 119 3.372 27.097 12.294 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.035 28.382 13.284 1.00 0.00 H new ATOM 0 HG LEU A 119 5.429 28.832 11.070 1.00 0.00 H new ATOM 0 HD11 LEU A 119 3.912 28.676 9.059 1.00 0.00 H new ATOM 0 HD12 LEU A 119 4.341 27.071 9.698 1.00 0.00 H new ATOM 0 HD13 LEU A 119 2.741 27.769 10.046 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.660 30.551 10.440 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.503 29.695 11.488 1.00 0.00 H new ATOM 0 HD23 LEU A 119 3.927 30.491 12.199 1.00 0.00 H new ATOM 1891 N ARG A 120 5.708 26.730 15.234 1.00 0.00 N ATOM 1892 CA ARG A 120 5.395 26.186 16.580 1.00 0.00 C ATOM 1893 C ARG A 120 4.136 26.826 17.173 1.00 0.00 C ATOM 1894 O ARG A 120 3.698 27.879 16.716 1.00 0.00 O ATOM 1895 CB ARG A 120 6.579 26.320 17.557 1.00 0.00 C ATOM 1896 CG ARG A 120 7.942 25.884 16.987 1.00 0.00 C ATOM 1897 CD ARG A 120 8.802 25.143 18.020 1.00 0.00 C ATOM 1898 NE ARG A 120 9.015 25.939 19.249 1.00 0.00 N ATOM 1899 CZ ARG A 120 9.146 25.473 20.480 1.00 0.00 C ATOM 1900 NH1 ARG A 120 9.176 24.197 20.738 1.00 0.00 N ATOM 1901 NH2 ARG A 120 9.245 26.286 21.491 1.00 0.00 N ATOM 0 H ARG A 120 6.282 27.573 15.252 1.00 0.00 H new ATOM 0 HA ARG A 120 5.203 25.122 16.440 1.00 0.00 H new ATOM 0 HB2 ARG A 120 6.651 27.359 17.877 1.00 0.00 H new ATOM 0 HB3 ARG A 120 6.367 25.726 18.446 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.781 25.239 16.123 1.00 0.00 H new ATOM 0 HG3 ARG A 120 8.482 26.762 16.633 1.00 0.00 H new ATOM 0 HD2 ARG A 120 8.322 24.200 18.280 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.767 24.898 17.577 1.00 0.00 H new ATOM 0 HE ARG A 120 9.066 26.951 19.135 1.00 0.00 H new ATOM 0 HH11 ARG A 120 9.097 23.521 19.978 1.00 0.00 H new ATOM 0 HH12 ARG A 120 9.278 23.873 21.700 1.00 0.00 H new ATOM 0 HH21 ARG A 120 9.222 27.294 21.339 1.00 0.00 H new ATOM 0 HH22 ARG A 120 9.346 25.915 22.436 1.00 0.00 H new ATOM 1915 N CYS A 121 3.573 26.210 18.210 1.00 0.00 N ATOM 1916 CA CYS A 121 2.492 26.747 19.025 1.00 0.00 C ATOM 1917 C CYS A 121 3.058 27.445 20.275 1.00 0.00 C ATOM 1918 O CYS A 121 3.911 26.888 20.968 1.00 0.00 O ATOM 1919 CB CYS A 121 1.555 25.589 19.398 1.00 0.00 C ATOM 1920 SG CYS A 121 1.016 24.716 17.893 1.00 0.00 S ATOM 0 H CYS A 121 3.872 25.284 18.516 1.00 0.00 H new ATOM 0 HA CYS A 121 1.931 27.498 18.469 1.00 0.00 H new ATOM 0 HB2 CYS A 121 2.067 24.897 20.067 1.00 0.00 H new ATOM 0 HB3 CYS A 121 0.688 25.971 19.937 1.00 0.00 H new ATOM 0 HG CYS A 121 1.970 23.936 17.479 1.00 0.00 H new ATOM 1926 N VAL A 122 2.566 28.644 20.583 1.00 0.00 N ATOM 1927 CA VAL A 122 2.933 29.446 21.766 1.00 0.00 C ATOM 1928 C VAL A 122 1.727 29.570 22.690 1.00 0.00 C ATOM 1929 O VAL A 122 0.630 29.821 22.203 1.00 0.00 O ATOM 1930 CB VAL A 122 3.404 30.852 21.352 1.00 0.00 C ATOM 1931 CG1 VAL A 122 3.777 31.708 22.566 1.00 0.00 C ATOM 1932 CG2 VAL A 122 4.608 30.777 20.412 1.00 0.00 C ATOM 0 H VAL A 122 1.873 29.108 19.997 1.00 0.00 H new ATOM 0 HA VAL A 122 3.750 28.944 22.283 1.00 0.00 H new ATOM 0 HB VAL A 122 2.566 31.319 20.835 1.00 0.00 H new ATOM 0 HG11 VAL A 122 4.104 32.692 22.231 1.00 0.00 H new ATOM 0 HG12 VAL A 122 2.908 31.816 23.216 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.584 31.226 23.117 1.00 0.00 H new ATOM 0 HG21 VAL A 122 4.918 31.785 20.137 1.00 0.00 H new ATOM 0 HG22 VAL A 122 5.431 30.269 20.915 1.00 0.00 H new ATOM 0 HG23 VAL A 122 4.334 30.224 19.514 1.00 0.00 H new ATOM 1942 N PHE A 123 1.931 29.460 24.004 1.00 0.00 N ATOM 1943 CA PHE A 123 0.851 29.470 24.998 1.00 0.00 C ATOM 1944 C PHE A 123 1.021 30.607 26.019 1.00 0.00 C ATOM 1945 O PHE A 123 2.048 30.691 26.700 1.00 0.00 O ATOM 1946 CB PHE A 123 0.785 28.089 25.664 1.00 0.00 C ATOM 1947 CG PHE A 123 0.630 26.949 24.675 1.00 0.00 C ATOM 1948 CD1 PHE A 123 -0.540 26.837 23.903 1.00 0.00 C ATOM 1949 CD2 PHE A 123 1.684 26.035 24.486 1.00 0.00 C ATOM 1950 CE1 PHE A 123 -0.649 25.828 22.930 1.00 0.00 C ATOM 1951 CE2 PHE A 123 1.571 25.019 23.525 1.00 0.00 C ATOM 1952 CZ PHE A 123 0.413 24.928 22.738 1.00 0.00 C ATOM 0 H PHE A 123 2.860 29.360 24.414 1.00 0.00 H new ATOM 0 HA PHE A 123 -0.099 29.668 24.501 1.00 0.00 H new ATOM 0 HB2 PHE A 123 1.692 27.932 26.248 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -0.052 28.070 26.362 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -1.356 27.527 24.058 1.00 0.00 H new ATOM 0 HD2 PHE A 123 2.581 26.116 25.082 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -1.545 25.745 22.333 1.00 0.00 H new ATOM 0 HE2 PHE A 123 2.373 24.309 23.391 1.00 0.00 H new ATOM 0 HZ PHE A 123 0.337 24.162 21.980 1.00 0.00 H new ATOM 1962 N GLU A 124 0.018 31.485 26.126 1.00 0.00 N ATOM 1963 CA GLU A 124 0.041 32.703 26.954 1.00 0.00 C ATOM 1964 C GLU A 124 -1.240 32.866 27.798 1.00 0.00 C ATOM 1965 O GLU A 124 -2.353 32.736 27.288 1.00 0.00 O ATOM 1966 CB GLU A 124 0.233 33.947 26.066 1.00 0.00 C ATOM 1967 CG GLU A 124 1.523 33.926 25.237 1.00 0.00 C ATOM 1968 CD GLU A 124 1.754 35.282 24.544 1.00 0.00 C ATOM 1969 OE1 GLU A 124 2.371 36.184 25.163 1.00 0.00 O ATOM 1970 OE2 GLU A 124 1.333 35.454 23.374 1.00 0.00 O ATOM 0 H GLU A 124 -0.862 31.367 25.624 1.00 0.00 H new ATOM 0 HA GLU A 124 0.880 32.603 27.642 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.619 34.035 25.392 1.00 0.00 H new ATOM 0 HB3 GLU A 124 0.233 34.835 26.697 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.371 33.694 25.882 1.00 0.00 H new ATOM 0 HG3 GLU A 124 1.466 33.136 24.488 1.00 0.00 H new ATOM 1977 N MET A 125 -1.090 33.212 29.083 1.00 0.00 N ATOM 1978 CA MET A 125 -2.209 33.358 30.030 1.00 0.00 C ATOM 1979 C MET A 125 -2.793 34.789 30.059 1.00 0.00 C ATOM 1980 O MET A 125 -2.058 35.758 29.827 1.00 0.00 O ATOM 1981 CB MET A 125 -1.765 32.932 31.439 1.00 0.00 C ATOM 1982 CG MET A 125 -1.517 31.423 31.547 1.00 0.00 C ATOM 1983 SD MET A 125 -2.986 30.368 31.379 1.00 0.00 S ATOM 1984 CE MET A 125 -3.808 30.664 32.969 1.00 0.00 C ATOM 0 H MET A 125 -0.179 33.401 29.501 1.00 0.00 H new ATOM 0 HA MET A 125 -3.008 32.703 29.682 1.00 0.00 H new ATOM 0 HB2 MET A 125 -0.853 33.466 31.706 1.00 0.00 H new ATOM 0 HB3 MET A 125 -2.528 33.224 32.160 1.00 0.00 H new ATOM 0 HG2 MET A 125 -0.797 31.136 30.780 1.00 0.00 H new ATOM 0 HG3 MET A 125 -1.054 31.218 32.512 1.00 0.00 H new ATOM 0 HE1 MET A 125 -4.701 30.043 33.038 1.00 0.00 H new ATOM 0 HE2 MET A 125 -3.127 30.413 33.783 1.00 0.00 H new ATOM 0 HE3 MET A 125 -4.090 31.714 33.043 1.00 0.00 H new ATOM 2301 N GLU B 358 5.466 13.818 15.551 1.00 0.00 N ATOM 2302 CA GLU B 358 4.591 13.077 14.631 1.00 0.00 C ATOM 2303 C GLU B 358 3.403 13.908 14.102 1.00 0.00 C ATOM 2304 O GLU B 358 2.469 14.251 14.829 1.00 0.00 O ATOM 2305 CB GLU B 358 4.207 11.704 15.208 1.00 0.00 C ATOM 2306 CG GLU B 358 3.448 10.861 14.176 1.00 0.00 C ATOM 2307 CD GLU B 358 3.344 9.386 14.616 1.00 0.00 C ATOM 2308 OE1 GLU B 358 2.696 9.091 15.650 1.00 0.00 O ATOM 2309 OE2 GLU B 358 3.913 8.506 13.923 1.00 0.00 O ATOM 0 HA GLU B 358 5.171 12.872 13.731 1.00 0.00 H new ATOM 0 HB2 GLU B 358 5.106 11.175 15.523 1.00 0.00 H new ATOM 0 HB3 GLU B 358 3.589 11.840 16.096 1.00 0.00 H new ATOM 0 HG2 GLU B 358 2.448 11.271 14.035 1.00 0.00 H new ATOM 0 HG3 GLU B 358 3.955 10.919 13.213 1.00 0.00 H new ATOM 2316 N PHE B 359 3.434 14.227 12.802 1.00 0.00 N ATOM 2317 CA PHE B 359 2.354 14.943 12.116 1.00 0.00 C ATOM 2318 C PHE B 359 1.199 14.022 11.691 1.00 0.00 C ATOM 2319 O PHE B 359 1.388 12.849 11.358 1.00 0.00 O ATOM 2320 CB PHE B 359 2.904 15.751 10.932 1.00 0.00 C ATOM 2321 CG PHE B 359 3.384 17.136 11.318 1.00 0.00 C ATOM 2322 CD1 PHE B 359 2.468 18.204 11.335 1.00 0.00 C ATOM 2323 CD2 PHE B 359 4.728 17.363 11.671 1.00 0.00 C ATOM 2324 CE1 PHE B 359 2.902 19.501 11.656 1.00 0.00 C ATOM 2325 CE2 PHE B 359 5.159 18.660 12.005 1.00 0.00 C ATOM 2326 CZ PHE B 359 4.251 19.734 11.974 1.00 0.00 C ATOM 0 H PHE B 359 4.217 13.993 12.192 1.00 0.00 H new ATOM 0 HA PHE B 359 1.927 15.641 12.837 1.00 0.00 H new ATOM 0 HB2 PHE B 359 3.730 15.202 10.479 1.00 0.00 H new ATOM 0 HB3 PHE B 359 2.128 15.842 10.172 1.00 0.00 H new ATOM 0 HD1 PHE B 359 1.429 18.026 11.101 1.00 0.00 H new ATOM 0 HD2 PHE B 359 5.428 16.541 11.685 1.00 0.00 H new ATOM 0 HE1 PHE B 359 2.198 20.320 11.658 1.00 0.00 H new ATOM 0 HE2 PHE B 359 6.188 18.831 12.285 1.00 0.00 H new ATOM 0 HZ PHE B 359 4.590 20.736 12.194 1.00 0.00 H new ATOM 2336 N PHE B 360 -0.003 14.596 11.685 1.00 0.00 N ATOM 2337 CA PHE B 360 -1.292 13.971 11.414 1.00 0.00 C ATOM 2338 C PHE B 360 -2.116 14.863 10.472 1.00 0.00 C ATOM 2339 O PHE B 360 -1.951 16.087 10.442 1.00 0.00 O ATOM 2340 CB PHE B 360 -2.028 13.772 12.750 1.00 0.00 C ATOM 2341 CG PHE B 360 -1.726 12.461 13.455 1.00 0.00 C ATOM 2342 CD1 PHE B 360 -0.515 12.264 14.155 1.00 0.00 C ATOM 2343 CD2 PHE B 360 -2.684 11.429 13.420 1.00 0.00 C ATOM 2344 CE1 PHE B 360 -0.293 11.056 14.840 1.00 0.00 C ATOM 2345 CE2 PHE B 360 -2.448 10.217 14.088 1.00 0.00 C ATOM 2346 CZ PHE B 360 -1.255 10.033 14.809 1.00 0.00 C ATOM 0 H PHE B 360 -0.106 15.591 11.886 1.00 0.00 H new ATOM 0 HA PHE B 360 -1.149 13.005 10.929 1.00 0.00 H new ATOM 0 HB2 PHE B 360 -1.770 14.595 13.417 1.00 0.00 H new ATOM 0 HB3 PHE B 360 -3.101 13.832 12.570 1.00 0.00 H new ATOM 0 HD1 PHE B 360 0.238 13.038 14.164 1.00 0.00 H new ATOM 0 HD2 PHE B 360 -3.606 11.571 12.876 1.00 0.00 H new ATOM 0 HE1 PHE B 360 0.623 10.914 15.394 1.00 0.00 H new ATOM 0 HE2 PHE B 360 -3.183 9.426 14.048 1.00 0.00 H new ATOM 0 HZ PHE B 360 -1.079 9.108 15.337 1.00 0.00 H new ATOM 2356 N ASP B 361 -3.029 14.263 9.708 1.00 0.00 N ATOM 2357 CA ASP B 361 -3.950 15.014 8.852 1.00 0.00 C ATOM 2358 C ASP B 361 -5.021 15.714 9.708 1.00 0.00 C ATOM 2359 O ASP B 361 -5.802 15.060 10.405 1.00 0.00 O ATOM 2360 CB ASP B 361 -4.548 14.087 7.788 1.00 0.00 C ATOM 2361 CG ASP B 361 -5.054 14.903 6.592 1.00 0.00 C ATOM 2362 OD1 ASP B 361 -4.191 15.485 5.890 1.00 0.00 O ATOM 2363 OD2 ASP B 361 -6.283 14.957 6.357 1.00 0.00 O ATOM 0 H ASP B 361 -3.151 13.251 9.664 1.00 0.00 H new ATOM 0 HA ASP B 361 -3.409 15.799 8.324 1.00 0.00 H new ATOM 0 HB2 ASP B 361 -3.796 13.371 7.456 1.00 0.00 H new ATOM 0 HB3 ASP B 361 -5.368 13.512 8.217 1.00 0.00 H new ATOM 2368 N ALA B 362 -5.025 17.051 9.699 1.00 0.00 N ATOM 2369 CA ALA B 362 -5.832 17.845 10.622 1.00 0.00 C ATOM 2370 C ALA B 362 -7.357 17.741 10.353 1.00 0.00 C ATOM 2371 O ALA B 362 -7.789 17.979 9.219 1.00 0.00 O ATOM 2372 CB ALA B 362 -5.359 19.300 10.569 1.00 0.00 C ATOM 0 H ALA B 362 -4.469 17.609 9.052 1.00 0.00 H new ATOM 0 HA ALA B 362 -5.688 17.440 11.623 1.00 0.00 H new ATOM 0 HB1 ALA B 362 -5.955 19.902 11.255 1.00 0.00 H new ATOM 0 HB2 ALA B 362 -4.310 19.352 10.859 1.00 0.00 H new ATOM 0 HB3 ALA B 362 -5.475 19.684 9.555 1.00 0.00 H new ATOM 2378 N PRO B 363 -8.187 17.446 11.376 1.00 0.00 N ATOM 2379 CA PRO B 363 -9.642 17.417 11.245 1.00 0.00 C ATOM 2380 C PRO B 363 -10.238 18.832 11.268 1.00 0.00 C ATOM 2381 O PRO B 363 -9.675 19.742 11.876 1.00 0.00 O ATOM 2382 CB PRO B 363 -10.122 16.586 12.441 1.00 0.00 C ATOM 2383 CG PRO B 363 -9.107 16.933 13.530 1.00 0.00 C ATOM 2384 CD PRO B 363 -7.805 17.091 12.741 1.00 0.00 C ATOM 0 HA PRO B 363 -9.959 16.988 10.294 1.00 0.00 H new ATOM 0 HB2 PRO B 363 -11.137 16.852 12.736 1.00 0.00 H new ATOM 0 HB3 PRO B 363 -10.124 15.519 12.216 1.00 0.00 H new ATOM 0 HG2 PRO B 363 -9.375 17.849 14.056 1.00 0.00 H new ATOM 0 HG3 PRO B 363 -9.033 16.145 14.280 1.00 0.00 H new ATOM 0 HD2 PRO B 363 -7.176 17.865 13.181 1.00 0.00 H new ATOM 0 HD3 PRO B 363 -7.229 16.166 12.754 1.00 0.00 H new ATOM 2392 N GLU B 364 -11.424 19.019 10.683 1.00 0.00 N ATOM 2393 CA GLU B 364 -12.182 20.273 10.830 1.00 0.00 C ATOM 2394 C GLU B 364 -12.682 20.475 12.260 1.00 0.00 C ATOM 2395 O GLU B 364 -12.633 21.594 12.773 1.00 0.00 O ATOM 2396 CB GLU B 364 -13.318 20.381 9.812 1.00 0.00 C ATOM 2397 CG GLU B 364 -14.370 19.264 9.861 1.00 0.00 C ATOM 2398 CD GLU B 364 -15.425 19.464 8.756 1.00 0.00 C ATOM 2399 OE1 GLU B 364 -16.432 20.174 8.994 1.00 0.00 O ATOM 2400 OE2 GLU B 364 -15.259 18.902 7.646 1.00 0.00 O ATOM 0 H GLU B 364 -11.884 18.319 10.101 1.00 0.00 H new ATOM 0 HA GLU B 364 -11.487 21.085 10.617 1.00 0.00 H new ATOM 0 HB2 GLU B 364 -13.823 21.336 9.960 1.00 0.00 H new ATOM 0 HB3 GLU B 364 -12.884 20.401 8.812 1.00 0.00 H new ATOM 0 HG2 GLU B 364 -13.886 18.295 9.738 1.00 0.00 H new ATOM 0 HG3 GLU B 364 -14.855 19.256 10.837 1.00 0.00 H new ATOM 2407 N ILE B 365 -13.115 19.388 12.909 1.00 0.00 N ATOM 2408 CA ILE B 365 -13.415 19.349 14.338 1.00 0.00 C ATOM 2409 C ILE B 365 -13.268 17.926 14.905 1.00 0.00 C ATOM 2410 O ILE B 365 -13.457 16.937 14.194 1.00 0.00 O ATOM 2411 CB ILE B 365 -14.776 20.004 14.661 1.00 0.00 C ATOM 2412 CG1 ILE B 365 -14.741 20.559 16.106 1.00 0.00 C ATOM 2413 CG2 ILE B 365 -15.958 19.050 14.418 1.00 0.00 C ATOM 2414 CD1 ILE B 365 -15.932 21.464 16.443 1.00 0.00 C ATOM 0 H ILE B 365 -13.269 18.494 12.442 1.00 0.00 H new ATOM 0 HA ILE B 365 -12.671 19.957 14.852 1.00 0.00 H new ATOM 0 HB ILE B 365 -14.940 20.835 13.975 1.00 0.00 H new ATOM 0 HG12 ILE B 365 -14.719 19.724 16.807 1.00 0.00 H new ATOM 0 HG13 ILE B 365 -13.817 21.119 16.249 1.00 0.00 H new ATOM 0 HG21 ILE B 365 -16.891 19.558 14.660 1.00 0.00 H new ATOM 0 HG22 ILE B 365 -15.971 18.746 13.371 1.00 0.00 H new ATOM 0 HG23 ILE B 365 -15.850 18.169 15.050 1.00 0.00 H new ATOM 0 HD11 ILE B 365 -15.842 21.816 17.471 1.00 0.00 H new ATOM 0 HD12 ILE B 365 -15.943 22.318 15.766 1.00 0.00 H new ATOM 0 HD13 ILE B 365 -16.859 20.902 16.332 1.00 0.00 H new ATOM 2426 N ILE B 366 -12.922 17.828 16.189 1.00 0.00 N ATOM 2427 CA ILE B 366 -12.660 16.574 16.909 1.00 0.00 C ATOM 2428 C ILE B 366 -13.909 16.148 17.714 1.00 0.00 C ATOM 2429 O ILE B 366 -14.484 16.948 18.455 1.00 0.00 O ATOM 2430 CB ILE B 366 -11.360 16.766 17.734 1.00 0.00 C ATOM 2431 CG1 ILE B 366 -10.563 15.486 18.034 1.00 0.00 C ATOM 2432 CG2 ILE B 366 -11.554 17.637 18.990 1.00 0.00 C ATOM 2433 CD1 ILE B 366 -11.307 14.377 18.761 1.00 0.00 C ATOM 0 H ILE B 366 -12.811 18.650 16.782 1.00 0.00 H new ATOM 0 HA ILE B 366 -12.482 15.735 16.236 1.00 0.00 H new ATOM 0 HB ILE B 366 -10.723 17.325 17.049 1.00 0.00 H new ATOM 0 HG12 ILE B 366 -10.192 15.086 17.090 1.00 0.00 H new ATOM 0 HG13 ILE B 366 -9.691 15.759 18.629 1.00 0.00 H new ATOM 0 HG21 ILE B 366 -10.605 17.729 19.519 1.00 0.00 H new ATOM 0 HG22 ILE B 366 -11.903 18.627 18.696 1.00 0.00 H new ATOM 0 HG23 ILE B 366 -12.291 17.172 19.645 1.00 0.00 H new ATOM 0 HD11 ILE B 366 -10.638 13.530 18.914 1.00 0.00 H new ATOM 0 HD12 ILE B 366 -11.654 14.744 19.727 1.00 0.00 H new ATOM 0 HD13 ILE B 366 -12.163 14.061 18.164 1.00 0.00 H new