USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 967 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 109 MET CE :methyl -177:sc= 0 (180deg=-0.0386) USER MOD Set 1.2: A 144 MET CE :methyl -141:sc= -0.276 (180deg=-0.97) USER MOD Set 2.1: A 60 ASN : amide:sc= -0.131 K(o=-0.038,f=-4.1) USER MOD Set 2.2: A 62 THR OG1 : rot -6:sc= 0.0928 USER MOD Set 3.1: A 5 THR OG1 : rot -153:sc= 0.336 USER MOD Set 3.2: A 8 GLN : amide:sc= 0.365 X(o=0.7,f=0.68) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -78:sc= 1.25 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.386 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 75:sc= 0.663 USER MOD Single : A 36 MET CE :methyl 154:sc= -0.074 (180deg=-1.34!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.0802 K(o=-0.08,f=-1.1) USER MOD Single : A 42 ASN : amide:sc= -0.277 K(o=-0.28,f=-1.5) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.187 K(o=-0.19,f=-1.9!) USER MOD Single : A 70 THR OG1 : rot 82:sc= 0.631 USER MOD Single : A 71 MET CE :methyl -151:sc= -0.81 (180deg=-2.18) USER MOD Single : A 72 MET CE :methyl -143:sc= -0.22 (180deg=-0.436) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -72:sc= 1.02 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 85:sc= 1.02 USER MOD Single : A 111 ASN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 115 LYS NZ :NH3+ -166:sc= -0.0698 (180deg=-0.283) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.949 USER MOD Single : A 124 MET CE :methyl 159:sc= -0.0124 (180deg=-0.138) USER MOD Single : A 135 GLN : amide:sc= -0.0681 K(o=-0.068,f=-1.2!) USER MOD Single : A 137 ASN : amide:sc= 0.266 K(o=0.27,f=-4.8!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.0325 X(o=-0.032,f=-0.19) USER MOD Single : A 145 MET CE :methyl 155:sc= -0.79 (180deg=-1.39) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -11.697 16.025 2.742 1.00 0.00 N ATOM 59 CA THR A 5 -12.213 17.171 2.060 1.00 0.00 C ATOM 60 C THR A 5 -13.454 16.862 1.296 1.00 0.00 C ATOM 61 O THR A 5 -13.761 15.702 1.024 1.00 0.00 O ATOM 62 CB THR A 5 -11.233 17.813 1.123 1.00 0.00 C ATOM 63 OG1 THR A 5 -10.828 16.949 0.072 1.00 0.00 O ATOM 64 CG2 THR A 5 -9.996 18.237 1.932 1.00 0.00 C ATOM 0 HA THR A 5 -12.433 17.876 2.862 1.00 0.00 H new ATOM 0 HB THR A 5 -11.724 18.669 0.661 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.933 17.205 -0.236 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.270 18.707 1.268 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.292 18.946 2.705 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.547 17.359 2.397 1.00 0.00 H new ATOM 72 N GLU A 6 -14.206 17.904 0.898 1.00 0.00 N ATOM 73 CA GLU A 6 -15.511 17.762 0.332 1.00 0.00 C ATOM 74 C GLU A 6 -15.500 17.227 -1.059 1.00 0.00 C ATOM 75 O GLU A 6 -16.283 16.322 -1.345 1.00 0.00 O ATOM 76 CB GLU A 6 -16.342 19.056 0.330 1.00 0.00 C ATOM 77 CG GLU A 6 -16.580 19.602 1.740 1.00 0.00 C ATOM 78 CD GLU A 6 -17.670 20.651 1.908 1.00 0.00 C ATOM 79 OE1 GLU A 6 -18.214 21.155 0.890 1.00 0.00 O ATOM 80 OE2 GLU A 6 -17.946 21.033 3.077 1.00 0.00 O ATOM 0 H GLU A 6 -13.897 18.873 0.972 1.00 0.00 H new ATOM 0 HA GLU A 6 -15.982 17.041 1.000 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -15.831 19.811 -0.267 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -17.302 18.867 -0.150 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -16.818 18.761 2.392 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -15.643 20.028 2.099 1.00 0.00 H new ATOM 87 N GLU A 7 -14.562 17.563 -1.962 1.00 0.00 N ATOM 88 CA GLU A 7 -14.337 16.968 -3.243 1.00 0.00 C ATOM 89 C GLU A 7 -14.017 15.515 -3.149 1.00 0.00 C ATOM 90 O GLU A 7 -14.552 14.758 -3.957 1.00 0.00 O ATOM 91 CB GLU A 7 -13.204 17.738 -3.943 1.00 0.00 C ATOM 92 CG GLU A 7 -11.865 17.756 -3.204 1.00 0.00 C ATOM 93 CD GLU A 7 -10.763 16.885 -3.791 1.00 0.00 C ATOM 94 OE1 GLU A 7 -10.964 16.074 -4.734 1.00 0.00 O ATOM 95 OE2 GLU A 7 -9.630 16.990 -3.250 1.00 0.00 O ATOM 0 H GLU A 7 -13.903 18.319 -1.777 1.00 0.00 H new ATOM 0 HA GLU A 7 -15.256 17.035 -3.826 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.048 17.303 -4.930 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -13.528 18.767 -4.096 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -11.507 18.785 -3.169 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.037 17.443 -2.174 1.00 0.00 H new ATOM 102 N GLN A 8 -13.251 15.108 -2.121 1.00 0.00 N ATOM 103 CA GLN A 8 -12.958 13.737 -1.840 1.00 0.00 C ATOM 104 C GLN A 8 -14.217 12.972 -1.611 1.00 0.00 C ATOM 105 O GLN A 8 -14.517 11.977 -2.268 1.00 0.00 O ATOM 106 CB GLN A 8 -11.889 13.456 -0.771 1.00 0.00 C ATOM 107 CG GLN A 8 -10.475 13.636 -1.329 1.00 0.00 C ATOM 108 CD GLN A 8 -9.509 13.351 -0.188 1.00 0.00 C ATOM 109 OE1 GLN A 8 -9.205 12.202 0.131 1.00 0.00 O ATOM 110 NE2 GLN A 8 -9.234 14.433 0.589 1.00 0.00 N ATOM 0 H GLN A 8 -12.820 15.757 -1.462 1.00 0.00 H new ATOM 0 HA GLN A 8 -12.468 13.373 -2.743 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.035 14.127 0.076 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.006 12.439 -0.396 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -10.299 12.956 -2.162 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -10.336 14.648 -1.709 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.507 15.366 0.280 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.755 14.312 1.481 1.00 0.00 H new ATOM 119 N ILE A 9 -15.072 13.540 -0.742 1.00 0.00 N ATOM 120 CA ILE A 9 -16.356 13.027 -0.378 1.00 0.00 C ATOM 121 C ILE A 9 -17.267 12.741 -1.522 1.00 0.00 C ATOM 122 O ILE A 9 -17.888 11.681 -1.581 1.00 0.00 O ATOM 123 CB ILE A 9 -16.976 13.865 0.701 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.102 13.642 1.947 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.413 13.444 1.052 1.00 0.00 C ATOM 126 CD1 ILE A 9 -16.652 13.969 3.334 1.00 0.00 C ATOM 0 H ILE A 9 -14.852 14.413 -0.263 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.183 12.034 0.037 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.026 14.900 0.363 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.809 12.592 1.954 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.192 14.226 1.813 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -18.800 14.092 1.839 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.044 13.531 0.167 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.415 12.411 1.399 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.895 13.748 4.087 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -16.913 15.026 3.382 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.540 13.367 3.524 1.00 0.00 H new ATOM 138 N ALA A 10 -17.319 13.674 -2.490 1.00 0.00 N ATOM 139 CA ALA A 10 -18.187 13.671 -3.626 1.00 0.00 C ATOM 140 C ALA A 10 -17.796 12.566 -4.547 1.00 0.00 C ATOM 141 O ALA A 10 -18.592 11.892 -5.199 1.00 0.00 O ATOM 142 CB ALA A 10 -18.014 15.038 -4.310 1.00 0.00 C ATOM 0 H ALA A 10 -16.708 14.491 -2.476 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.227 13.513 -3.342 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -18.658 15.089 -5.188 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -18.287 15.831 -3.613 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -16.975 15.164 -4.614 1.00 0.00 H new ATOM 148 N GLU A 11 -16.486 12.410 -4.813 1.00 0.00 N ATOM 149 CA GLU A 11 -15.915 11.295 -5.502 1.00 0.00 C ATOM 150 C GLU A 11 -16.127 9.976 -4.842 1.00 0.00 C ATOM 151 O GLU A 11 -16.499 8.997 -5.487 1.00 0.00 O ATOM 152 CB GLU A 11 -14.430 11.486 -5.857 1.00 0.00 C ATOM 153 CG GLU A 11 -14.182 12.612 -6.864 1.00 0.00 C ATOM 154 CD GLU A 11 -12.772 12.528 -7.431 1.00 0.00 C ATOM 155 OE1 GLU A 11 -12.442 11.424 -7.941 1.00 0.00 O ATOM 156 OE2 GLU A 11 -11.984 13.509 -7.373 1.00 0.00 O ATOM 0 H GLU A 11 -15.789 13.099 -4.532 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.482 11.270 -6.432 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -13.871 11.695 -4.945 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.039 10.553 -6.264 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -14.909 12.549 -7.674 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.327 13.578 -6.380 1.00 0.00 H new ATOM 163 N PHE A 12 -15.954 9.885 -3.512 1.00 0.00 N ATOM 164 CA PHE A 12 -16.314 8.680 -2.830 1.00 0.00 C ATOM 165 C PHE A 12 -17.766 8.350 -2.825 1.00 0.00 C ATOM 166 O PHE A 12 -18.106 7.169 -2.875 1.00 0.00 O ATOM 167 CB PHE A 12 -16.016 8.832 -1.329 1.00 0.00 C ATOM 168 CG PHE A 12 -14.576 9.059 -1.022 1.00 0.00 C ATOM 169 CD1 PHE A 12 -13.543 8.503 -1.739 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.260 9.979 -0.049 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.247 8.734 -1.341 1.00 0.00 C ATOM 172 CE2 PHE A 12 -12.944 10.204 0.281 1.00 0.00 C ATOM 173 CZ PHE A 12 -11.876 9.597 -0.337 1.00 0.00 C ATOM 0 H PHE A 12 -15.575 10.624 -2.920 1.00 0.00 H new ATOM 0 HA PHE A 12 -15.751 7.915 -3.364 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.598 9.665 -0.935 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.352 7.935 -0.809 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -13.747 7.891 -2.605 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.045 10.524 0.455 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.463 8.198 -1.855 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.736 10.903 1.077 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.848 9.780 -0.061 1.00 0.00 H new ATOM 183 N LYS A 13 -18.677 9.333 -2.702 1.00 0.00 N ATOM 184 CA LYS A 13 -20.080 9.060 -2.694 1.00 0.00 C ATOM 185 C LYS A 13 -20.543 8.614 -4.038 1.00 0.00 C ATOM 186 O LYS A 13 -21.292 7.642 -4.129 1.00 0.00 O ATOM 187 CB LYS A 13 -20.962 10.239 -2.249 1.00 0.00 C ATOM 188 CG LYS A 13 -22.488 10.156 -2.313 1.00 0.00 C ATOM 189 CD LYS A 13 -23.151 11.077 -1.287 1.00 0.00 C ATOM 190 CE LYS A 13 -24.673 11.229 -1.265 1.00 0.00 C ATOM 191 NZ LYS A 13 -24.977 12.086 -0.097 1.00 0.00 N ATOM 0 H LYS A 13 -18.440 10.321 -2.608 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.197 8.270 -1.952 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.699 10.461 -1.215 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -20.665 11.101 -2.846 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -22.825 10.425 -3.314 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -22.804 9.128 -2.136 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.845 10.734 -0.299 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -22.728 12.072 -1.424 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -25.034 11.684 -2.188 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -25.161 10.259 -1.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -26.005 12.227 -0.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -24.632 11.627 0.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -24.508 13.007 -0.211 1.00 0.00 H new ATOM 205 N GLU A 14 -20.037 9.184 -5.146 1.00 0.00 N ATOM 206 CA GLU A 14 -20.159 8.530 -6.412 1.00 0.00 C ATOM 207 C GLU A 14 -19.757 7.101 -6.544 1.00 0.00 C ATOM 208 O GLU A 14 -20.492 6.272 -7.078 1.00 0.00 O ATOM 209 CB GLU A 14 -19.460 9.330 -7.524 1.00 0.00 C ATOM 210 CG GLU A 14 -19.789 8.884 -8.951 1.00 0.00 C ATOM 211 CD GLU A 14 -19.343 9.875 -10.017 1.00 0.00 C ATOM 212 OE1 GLU A 14 -19.924 10.985 -10.151 1.00 0.00 O ATOM 213 OE2 GLU A 14 -18.346 9.644 -10.751 1.00 0.00 O ATOM 0 H GLU A 14 -19.552 10.081 -5.168 1.00 0.00 H new ATOM 0 HA GLU A 14 -21.244 8.505 -6.511 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.729 10.381 -7.418 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -18.382 9.260 -7.378 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -19.314 7.921 -9.140 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -20.865 8.731 -9.036 1.00 0.00 H new ATOM 220 N ALA A 15 -18.576 6.765 -5.995 1.00 0.00 N ATOM 221 CA ALA A 15 -17.909 5.504 -6.099 1.00 0.00 C ATOM 222 C ALA A 15 -18.770 4.511 -5.398 1.00 0.00 C ATOM 223 O ALA A 15 -19.001 3.460 -5.994 1.00 0.00 O ATOM 224 CB ALA A 15 -16.533 5.567 -5.414 1.00 0.00 C ATOM 0 H ALA A 15 -18.046 7.431 -5.433 1.00 0.00 H new ATOM 0 HA ALA A 15 -17.751 5.234 -7.143 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.038 4.600 -5.502 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.922 6.332 -5.894 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.662 5.814 -4.360 1.00 0.00 H new ATOM 230 N PHE A 16 -19.374 4.770 -4.225 1.00 0.00 N ATOM 231 CA PHE A 16 -20.308 3.934 -3.538 1.00 0.00 C ATOM 232 C PHE A 16 -21.365 3.279 -4.359 1.00 0.00 C ATOM 233 O PHE A 16 -21.559 2.065 -4.310 1.00 0.00 O ATOM 234 CB PHE A 16 -20.983 4.794 -2.455 1.00 0.00 C ATOM 235 CG PHE A 16 -21.615 3.936 -1.414 1.00 0.00 C ATOM 236 CD1 PHE A 16 -22.896 3.438 -1.452 1.00 0.00 C ATOM 237 CD2 PHE A 16 -20.788 3.476 -0.416 1.00 0.00 C ATOM 238 CE1 PHE A 16 -23.407 2.620 -0.473 1.00 0.00 C ATOM 239 CE2 PHE A 16 -21.319 2.635 0.533 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.625 2.206 0.579 1.00 0.00 C ATOM 0 H PHE A 16 -19.193 5.636 -3.717 1.00 0.00 H new ATOM 0 HA PHE A 16 -19.723 3.100 -3.150 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.245 5.450 -1.993 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.737 5.435 -2.911 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.528 3.701 -2.287 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.749 3.768 -0.379 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -24.436 2.298 -0.531 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.655 2.281 1.308 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.007 1.591 1.380 1.00 0.00 H new ATOM 250 N SER A 17 -21.997 4.134 -5.181 1.00 0.00 N ATOM 251 CA SER A 17 -23.153 3.730 -5.919 1.00 0.00 C ATOM 252 C SER A 17 -22.921 2.832 -7.085 1.00 0.00 C ATOM 253 O SER A 17 -23.801 2.205 -7.673 1.00 0.00 O ATOM 254 CB SER A 17 -24.006 4.914 -6.405 1.00 0.00 C ATOM 255 OG SER A 17 -23.887 5.989 -5.485 1.00 0.00 O ATOM 0 H SER A 17 -21.710 5.101 -5.335 1.00 0.00 H new ATOM 0 HA SER A 17 -23.683 3.148 -5.165 1.00 0.00 H new ATOM 0 HB2 SER A 17 -23.679 5.230 -7.395 1.00 0.00 H new ATOM 0 HB3 SER A 17 -25.049 4.612 -6.496 1.00 0.00 H new ATOM 0 HG SER A 17 -24.428 6.745 -5.794 1.00 0.00 H new ATOM 261 N LEU A 18 -21.682 2.761 -7.605 1.00 0.00 N ATOM 262 CA LEU A 18 -21.083 1.687 -8.335 1.00 0.00 C ATOM 263 C LEU A 18 -21.113 0.352 -7.675 1.00 0.00 C ATOM 264 O LEU A 18 -21.464 -0.667 -8.268 1.00 0.00 O ATOM 265 CB LEU A 18 -19.635 1.931 -8.793 1.00 0.00 C ATOM 266 CG LEU A 18 -19.285 3.168 -9.638 1.00 0.00 C ATOM 267 CD1 LEU A 18 -17.779 3.477 -9.638 1.00 0.00 C ATOM 268 CD2 LEU A 18 -19.771 3.066 -11.094 1.00 0.00 C ATOM 0 H LEU A 18 -21.033 3.541 -7.501 1.00 0.00 H new ATOM 0 HA LEU A 18 -21.746 1.669 -9.200 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -19.015 1.967 -7.897 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.324 1.054 -9.361 1.00 0.00 H new ATOM 0 HG LEU A 18 -19.818 3.986 -9.153 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -17.589 4.359 -10.249 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -17.446 3.664 -8.617 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -17.233 2.627 -10.048 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -19.492 3.970 -11.635 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.311 2.201 -11.572 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -20.855 2.954 -11.109 1.00 0.00 H new ATOM 280 N PHE A 19 -20.720 0.265 -6.392 1.00 0.00 N ATOM 281 CA PHE A 19 -20.513 -0.988 -5.735 1.00 0.00 C ATOM 282 C PHE A 19 -21.836 -1.625 -5.483 1.00 0.00 C ATOM 283 O PHE A 19 -22.036 -2.811 -5.743 1.00 0.00 O ATOM 284 CB PHE A 19 -19.736 -0.828 -4.417 1.00 0.00 C ATOM 285 CG PHE A 19 -18.279 -0.619 -4.644 1.00 0.00 C ATOM 286 CD1 PHE A 19 -17.877 0.675 -4.879 1.00 0.00 C ATOM 287 CD2 PHE A 19 -17.417 -1.669 -4.856 1.00 0.00 C ATOM 288 CE1 PHE A 19 -16.586 0.859 -5.313 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.088 -1.461 -5.139 1.00 0.00 C ATOM 290 CZ PHE A 19 -15.682 -0.174 -5.402 1.00 0.00 C ATOM 0 H PHE A 19 -20.543 1.077 -5.801 1.00 0.00 H new ATOM 0 HA PHE A 19 -19.908 -1.621 -6.384 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.140 0.017 -3.860 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -19.882 -1.715 -3.801 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.546 1.509 -4.729 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.793 -2.680 -4.799 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.269 1.852 -5.595 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -15.386 -2.281 -5.154 1.00 0.00 H new ATOM 0 HZ PHE A 19 -14.657 0.025 -5.678 1.00 0.00 H new ATOM 300 N ASP A 20 -22.790 -0.819 -4.985 1.00 0.00 N ATOM 301 CA ASP A 20 -24.146 -1.179 -4.708 1.00 0.00 C ATOM 302 C ASP A 20 -24.912 -1.618 -5.909 1.00 0.00 C ATOM 303 O ASP A 20 -25.235 -0.863 -6.824 1.00 0.00 O ATOM 304 CB ASP A 20 -24.853 -0.016 -3.992 1.00 0.00 C ATOM 305 CG ASP A 20 -26.014 -0.441 -3.104 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.356 -1.653 -3.064 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.555 0.444 -2.389 1.00 0.00 O ATOM 0 H ASP A 20 -22.598 0.157 -4.759 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.115 -2.051 -4.055 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.123 0.519 -3.385 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.221 0.686 -4.740 1.00 0.00 H new ATOM 312 N LYS A 21 -25.153 -2.937 -6.016 1.00 0.00 N ATOM 313 CA LYS A 21 -25.831 -3.491 -7.147 1.00 0.00 C ATOM 314 C LYS A 21 -27.315 -3.366 -7.174 1.00 0.00 C ATOM 315 O LYS A 21 -27.887 -2.747 -8.070 1.00 0.00 O ATOM 316 CB LYS A 21 -25.364 -4.956 -7.100 1.00 0.00 C ATOM 317 CG LYS A 21 -25.864 -5.926 -8.171 1.00 0.00 C ATOM 318 CD LYS A 21 -25.636 -5.630 -9.655 1.00 0.00 C ATOM 319 CE LYS A 21 -24.181 -5.444 -10.091 1.00 0.00 C ATOM 320 NZ LYS A 21 -24.010 -4.583 -11.282 1.00 0.00 N ATOM 0 H LYS A 21 -24.876 -3.624 -5.314 1.00 0.00 H new ATOM 0 HA LYS A 21 -25.583 -2.946 -8.058 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -24.275 -4.956 -7.138 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -25.649 -5.362 -6.129 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -25.411 -6.896 -7.963 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.939 -6.038 -8.027 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -26.067 -6.445 -10.237 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -26.189 -4.727 -9.913 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -23.617 -5.015 -9.263 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -23.748 -6.422 -10.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -22.999 -4.507 -11.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -24.519 -5.000 -12.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -24.392 -3.636 -11.084 1.00 0.00 H new ATOM 334 N ASP A 22 -28.035 -3.801 -6.124 1.00 0.00 N ATOM 335 CA ASP A 22 -29.444 -3.563 -6.076 1.00 0.00 C ATOM 336 C ASP A 22 -29.760 -2.154 -5.708 1.00 0.00 C ATOM 337 O ASP A 22 -30.779 -1.625 -6.149 1.00 0.00 O ATOM 338 CB ASP A 22 -30.155 -4.481 -5.067 1.00 0.00 C ATOM 339 CG ASP A 22 -29.557 -4.641 -3.677 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.583 -3.916 -3.337 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.992 -5.549 -2.920 1.00 0.00 O ATOM 0 H ASP A 22 -27.652 -4.306 -5.325 1.00 0.00 H new ATOM 0 HA ASP A 22 -29.804 -3.774 -7.083 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.175 -4.114 -4.948 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.223 -5.473 -5.514 1.00 0.00 H new ATOM 346 N GLY A 23 -28.804 -1.453 -5.073 1.00 0.00 N ATOM 347 CA GLY A 23 -28.851 -0.034 -4.898 1.00 0.00 C ATOM 348 C GLY A 23 -29.764 0.337 -3.781 1.00 0.00 C ATOM 349 O GLY A 23 -30.755 1.016 -4.045 1.00 0.00 O ATOM 0 H GLY A 23 -27.973 -1.886 -4.669 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -27.849 0.344 -4.694 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -29.189 0.439 -5.820 1.00 0.00 H new ATOM 353 N ASP A 24 -29.523 -0.167 -2.557 1.00 0.00 N ATOM 354 CA ASP A 24 -30.346 0.162 -1.435 1.00 0.00 C ATOM 355 C ASP A 24 -29.742 1.285 -0.664 1.00 0.00 C ATOM 356 O ASP A 24 -30.482 2.149 -0.197 1.00 0.00 O ATOM 357 CB ASP A 24 -30.527 -1.110 -0.590 1.00 0.00 C ATOM 358 CG ASP A 24 -29.305 -1.670 0.123 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.454 -2.250 -0.604 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.278 -1.605 1.381 1.00 0.00 O ATOM 0 H ASP A 24 -28.756 -0.804 -2.344 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.329 0.508 -1.756 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.289 -0.906 0.162 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -30.922 -1.890 -1.241 1.00 0.00 H new ATOM 365 N GLY A 25 -28.401 1.365 -0.600 1.00 0.00 N ATOM 366 CA GLY A 25 -27.696 2.101 0.403 1.00 0.00 C ATOM 367 C GLY A 25 -26.679 1.353 1.196 1.00 0.00 C ATOM 368 O GLY A 25 -25.941 1.915 2.004 1.00 0.00 O ATOM 0 H GLY A 25 -27.786 0.902 -1.269 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.199 2.942 -0.080 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.427 2.518 1.096 1.00 0.00 H new ATOM 372 N THR A 26 -26.575 0.042 0.916 1.00 0.00 N ATOM 373 CA THR A 26 -25.538 -0.678 1.587 1.00 0.00 C ATOM 374 C THR A 26 -24.766 -1.541 0.649 1.00 0.00 C ATOM 375 O THR A 26 -25.272 -1.990 -0.379 1.00 0.00 O ATOM 376 CB THR A 26 -26.121 -1.388 2.774 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.963 -2.488 2.463 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.833 -0.531 3.834 1.00 0.00 C ATOM 0 H THR A 26 -27.162 -0.490 0.273 1.00 0.00 H new ATOM 0 HA THR A 26 -24.789 0.012 1.974 1.00 0.00 H new ATOM 0 HB THR A 26 -25.192 -1.743 3.220 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.841 -2.158 2.178 1.00 0.00 H new ATOM 0 HG21 THR A 26 -27.204 -1.174 4.632 1.00 0.00 H new ATOM 0 HG22 THR A 26 -26.131 0.193 4.248 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.669 -0.004 3.374 1.00 0.00 H new ATOM 386 N ILE A 27 -23.465 -1.699 0.952 1.00 0.00 N ATOM 387 CA ILE A 27 -22.578 -2.587 0.268 1.00 0.00 C ATOM 388 C ILE A 27 -22.466 -3.869 1.019 1.00 0.00 C ATOM 389 O ILE A 27 -22.046 -3.922 2.174 1.00 0.00 O ATOM 390 CB ILE A 27 -21.158 -2.139 0.089 1.00 0.00 C ATOM 391 CG1 ILE A 27 -20.976 -0.637 -0.186 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.648 -2.892 -1.151 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.591 -0.186 -0.648 1.00 0.00 C ATOM 0 H ILE A 27 -23.012 -1.185 1.707 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.037 -2.655 -0.718 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.625 -2.341 1.018 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.701 -0.340 -0.944 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.225 -0.092 0.724 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.612 -2.614 -1.345 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.709 -3.966 -0.975 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.261 -2.630 -2.013 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.594 0.892 -0.807 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -18.853 -0.438 0.114 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.337 -0.690 -1.580 1.00 0.00 H new ATOM 405 N THR A 28 -22.787 -4.982 0.337 1.00 0.00 N ATOM 406 CA THR A 28 -22.389 -6.281 0.785 1.00 0.00 C ATOM 407 C THR A 28 -20.967 -6.687 0.604 1.00 0.00 C ATOM 408 O THR A 28 -20.166 -6.026 -0.055 1.00 0.00 O ATOM 409 CB THR A 28 -23.263 -7.454 0.454 1.00 0.00 C ATOM 410 OG1 THR A 28 -23.206 -7.938 -0.880 1.00 0.00 O ATOM 411 CG2 THR A 28 -24.721 -7.013 0.667 1.00 0.00 C ATOM 0 H THR A 28 -23.325 -4.983 -0.529 1.00 0.00 H new ATOM 0 HA THR A 28 -22.539 -6.045 1.839 1.00 0.00 H new ATOM 0 HB THR A 28 -22.904 -8.259 1.095 1.00 0.00 H new ATOM 0 HG1 THR A 28 -23.813 -8.701 -0.977 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.389 -7.842 0.435 1.00 0.00 H new ATOM 0 HG22 THR A 28 -24.862 -6.712 1.705 1.00 0.00 H new ATOM 0 HG23 THR A 28 -24.946 -6.172 0.012 1.00 0.00 H new ATOM 419 N THR A 29 -20.621 -7.899 1.072 1.00 0.00 N ATOM 420 CA THR A 29 -19.469 -8.673 0.725 1.00 0.00 C ATOM 421 C THR A 29 -19.544 -9.095 -0.702 1.00 0.00 C ATOM 422 O THR A 29 -18.529 -8.985 -1.388 1.00 0.00 O ATOM 423 CB THR A 29 -19.300 -9.959 1.477 1.00 0.00 C ATOM 424 OG1 THR A 29 -20.440 -10.806 1.506 1.00 0.00 O ATOM 425 CG2 THR A 29 -18.951 -9.715 2.955 1.00 0.00 C ATOM 0 H THR A 29 -21.203 -8.381 1.757 1.00 0.00 H new ATOM 0 HA THR A 29 -18.641 -8.005 0.963 1.00 0.00 H new ATOM 0 HB THR A 29 -18.500 -10.447 0.920 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.232 -11.617 2.016 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.837 -10.672 3.465 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.018 -9.155 3.021 1.00 0.00 H new ATOM 0 HG23 THR A 29 -19.750 -9.145 3.428 1.00 0.00 H new ATOM 433 N LYS A 30 -20.724 -9.544 -1.166 1.00 0.00 N ATOM 434 CA LYS A 30 -20.802 -10.014 -2.515 1.00 0.00 C ATOM 435 C LYS A 30 -20.578 -8.876 -3.450 1.00 0.00 C ATOM 436 O LYS A 30 -19.868 -8.989 -4.449 1.00 0.00 O ATOM 437 CB LYS A 30 -22.172 -10.647 -2.813 1.00 0.00 C ATOM 438 CG LYS A 30 -22.595 -11.750 -1.842 1.00 0.00 C ATOM 439 CD LYS A 30 -24.032 -12.216 -2.091 1.00 0.00 C ATOM 440 CE LYS A 30 -24.530 -13.243 -1.072 1.00 0.00 C ATOM 441 NZ LYS A 30 -25.924 -13.675 -1.319 1.00 0.00 N ATOM 0 H LYS A 30 -21.593 -9.582 -0.633 1.00 0.00 H new ATOM 0 HA LYS A 30 -20.035 -10.776 -2.651 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -22.929 -9.863 -2.802 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -22.154 -11.058 -3.822 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -21.917 -12.598 -1.940 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -22.505 -11.386 -0.819 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -24.694 -11.350 -2.074 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -24.097 -12.647 -3.090 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -23.876 -14.115 -1.094 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -24.460 -12.817 -0.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -26.205 -14.370 -0.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -26.557 -12.851 -1.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -25.991 -14.108 -2.262 1.00 0.00 H new ATOM 455 N GLU A 31 -21.163 -7.708 -3.132 1.00 0.00 N ATOM 456 CA GLU A 31 -21.008 -6.485 -3.856 1.00 0.00 C ATOM 457 C GLU A 31 -19.644 -5.884 -3.840 1.00 0.00 C ATOM 458 O GLU A 31 -19.215 -5.180 -4.753 1.00 0.00 O ATOM 459 CB GLU A 31 -22.076 -5.487 -3.380 1.00 0.00 C ATOM 460 CG GLU A 31 -23.513 -5.857 -3.753 1.00 0.00 C ATOM 461 CD GLU A 31 -24.602 -5.054 -3.054 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.481 -4.762 -1.835 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.640 -4.661 -3.650 1.00 0.00 O ATOM 0 H GLU A 31 -21.779 -7.612 -2.324 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.150 -6.735 -4.907 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.009 -5.395 -2.296 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.848 -4.506 -3.798 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.632 -5.737 -4.830 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.666 -6.913 -3.531 1.00 0.00 H new ATOM 470 N LEU A 32 -18.885 -6.117 -2.754 1.00 0.00 N ATOM 471 CA LEU A 32 -17.482 -5.845 -2.731 1.00 0.00 C ATOM 472 C LEU A 32 -16.701 -6.810 -3.554 1.00 0.00 C ATOM 473 O LEU A 32 -15.789 -6.458 -4.301 1.00 0.00 O ATOM 474 CB LEU A 32 -16.924 -5.610 -1.317 1.00 0.00 C ATOM 475 CG LEU A 32 -15.471 -5.111 -1.254 1.00 0.00 C ATOM 476 CD1 LEU A 32 -15.472 -3.679 -1.815 1.00 0.00 C ATOM 477 CD2 LEU A 32 -14.851 -5.261 0.145 1.00 0.00 C ATOM 0 H LEU A 32 -19.250 -6.499 -1.881 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.349 -4.882 -3.224 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.561 -4.886 -0.810 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.994 -6.543 -0.758 1.00 0.00 H new ATOM 0 HG LEU A 32 -14.813 -5.728 -1.866 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -14.459 -3.278 -1.792 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -15.834 -3.691 -2.843 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.124 -3.051 -1.208 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -13.825 -4.893 0.130 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.433 -4.685 0.864 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -14.855 -6.312 0.434 1.00 0.00 H new ATOM 489 N GLY A 33 -16.932 -8.127 -3.403 1.00 0.00 N ATOM 490 CA GLY A 33 -16.020 -9.150 -3.812 1.00 0.00 C ATOM 491 C GLY A 33 -16.281 -9.468 -5.244 1.00 0.00 C ATOM 492 O GLY A 33 -15.459 -10.062 -5.940 1.00 0.00 O ATOM 0 H GLY A 33 -17.785 -8.493 -2.981 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -14.991 -8.816 -3.679 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -16.148 -10.040 -3.196 1.00 0.00 H new ATOM 496 N THR A 34 -17.421 -9.092 -5.851 1.00 0.00 N ATOM 497 CA THR A 34 -17.546 -9.134 -7.275 1.00 0.00 C ATOM 498 C THR A 34 -16.643 -8.152 -7.939 1.00 0.00 C ATOM 499 O THR A 34 -16.123 -8.560 -8.976 1.00 0.00 O ATOM 500 CB THR A 34 -18.951 -8.979 -7.776 1.00 0.00 C ATOM 501 OG1 THR A 34 -19.678 -10.031 -7.160 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.067 -9.236 -9.288 1.00 0.00 C ATOM 0 H THR A 34 -18.251 -8.761 -5.360 1.00 0.00 H new ATOM 0 HA THR A 34 -17.236 -10.142 -7.550 1.00 0.00 H new ATOM 0 HB THR A 34 -19.300 -7.969 -7.561 1.00 0.00 H new ATOM 0 HG1 THR A 34 -19.836 -9.811 -6.218 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.104 -9.111 -9.600 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.438 -8.527 -9.827 1.00 0.00 H new ATOM 0 HG23 THR A 34 -18.741 -10.252 -9.510 1.00 0.00 H new ATOM 510 N VAL A 35 -16.329 -6.932 -7.468 1.00 0.00 N ATOM 511 CA VAL A 35 -15.578 -5.963 -8.204 1.00 0.00 C ATOM 512 C VAL A 35 -14.148 -6.376 -8.268 1.00 0.00 C ATOM 513 O VAL A 35 -13.392 -6.082 -9.193 1.00 0.00 O ATOM 514 CB VAL A 35 -15.616 -4.545 -7.716 1.00 0.00 C ATOM 515 CG1 VAL A 35 -15.020 -3.589 -8.764 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.062 -4.144 -7.379 1.00 0.00 C ATOM 0 H VAL A 35 -16.608 -6.609 -6.542 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.076 -5.951 -9.174 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.011 -4.472 -6.812 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.059 -2.567 -8.388 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -13.984 -3.865 -8.960 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -15.595 -3.657 -9.688 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.081 -3.113 -7.025 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.682 -4.233 -8.271 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -17.450 -4.801 -6.601 1.00 0.00 H new ATOM 526 N MET A 36 -13.702 -7.180 -7.286 1.00 0.00 N ATOM 527 CA MET A 36 -12.450 -7.861 -7.171 1.00 0.00 C ATOM 528 C MET A 36 -12.449 -9.086 -8.019 1.00 0.00 C ATOM 529 O MET A 36 -11.622 -9.133 -8.928 1.00 0.00 O ATOM 530 CB MET A 36 -12.159 -8.385 -5.754 1.00 0.00 C ATOM 531 CG MET A 36 -12.012 -7.118 -4.909 1.00 0.00 C ATOM 532 SD MET A 36 -11.670 -7.527 -3.170 1.00 0.00 S ATOM 533 CE MET A 36 -12.065 -5.879 -2.518 1.00 0.00 C ATOM 0 H MET A 36 -14.293 -7.373 -6.478 1.00 0.00 H new ATOM 0 HA MET A 36 -11.708 -7.118 -7.465 1.00 0.00 H new ATOM 0 HB2 MET A 36 -12.969 -9.016 -5.388 1.00 0.00 H new ATOM 0 HB3 MET A 36 -11.251 -8.987 -5.731 1.00 0.00 H new ATOM 0 HG2 MET A 36 -11.204 -6.503 -5.307 1.00 0.00 H new ATOM 0 HG3 MET A 36 -12.925 -6.526 -4.974 1.00 0.00 H new ATOM 0 HE1 MET A 36 -12.379 -5.965 -1.478 1.00 0.00 H new ATOM 0 HE2 MET A 36 -11.182 -5.242 -2.579 1.00 0.00 H new ATOM 0 HE3 MET A 36 -12.871 -5.439 -3.105 1.00 0.00 H new ATOM 543 N ARG A 37 -13.469 -9.960 -8.085 1.00 0.00 N ATOM 544 CA ARG A 37 -13.560 -10.938 -9.124 1.00 0.00 C ATOM 545 C ARG A 37 -13.541 -10.424 -10.522 1.00 0.00 C ATOM 546 O ARG A 37 -12.857 -10.950 -11.399 1.00 0.00 O ATOM 547 CB ARG A 37 -14.849 -11.731 -8.852 1.00 0.00 C ATOM 548 CG ARG A 37 -14.986 -13.097 -9.526 1.00 0.00 C ATOM 549 CD ARG A 37 -14.146 -14.234 -8.942 1.00 0.00 C ATOM 550 NE ARG A 37 -12.763 -14.182 -9.492 1.00 0.00 N ATOM 551 CZ ARG A 37 -12.287 -14.695 -10.664 1.00 0.00 C ATOM 552 NH1 ARG A 37 -13.073 -15.218 -11.649 1.00 0.00 N ATOM 553 NH2 ARG A 37 -10.976 -14.497 -10.988 1.00 0.00 N ATOM 0 H ARG A 37 -14.236 -9.989 -7.413 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.657 -11.547 -9.083 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -14.935 -11.876 -7.775 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.695 -11.116 -9.160 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -16.034 -13.393 -9.487 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -14.725 -12.986 -10.578 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -14.117 -14.154 -7.855 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.604 -15.194 -9.179 1.00 0.00 H new ATOM 0 HE ARG A 37 -12.077 -13.696 -8.914 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -14.086 -15.242 -11.534 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -12.647 -15.584 -12.500 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -10.369 -13.973 -10.358 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -10.604 -14.873 -11.860 1.00 0.00 H new ATOM 567 N SER A 38 -14.230 -9.299 -10.786 1.00 0.00 N ATOM 568 CA SER A 38 -14.381 -8.671 -12.062 1.00 0.00 C ATOM 569 C SER A 38 -13.095 -8.224 -12.669 1.00 0.00 C ATOM 570 O SER A 38 -12.873 -8.235 -13.878 1.00 0.00 O ATOM 571 CB SER A 38 -15.534 -7.655 -12.118 1.00 0.00 C ATOM 572 OG SER A 38 -15.675 -7.375 -13.503 1.00 0.00 O ATOM 0 H SER A 38 -14.719 -8.790 -10.049 1.00 0.00 H new ATOM 0 HA SER A 38 -14.711 -9.459 -12.739 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.451 -8.068 -11.698 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.301 -6.754 -11.550 1.00 0.00 H new ATOM 0 HG SER A 38 -16.399 -6.728 -13.634 1.00 0.00 H new ATOM 578 N LEU A 39 -12.092 -7.916 -11.828 1.00 0.00 N ATOM 579 CA LEU A 39 -10.758 -7.518 -12.153 1.00 0.00 C ATOM 580 C LEU A 39 -9.862 -8.701 -12.291 1.00 0.00 C ATOM 581 O LEU A 39 -8.782 -8.525 -12.852 1.00 0.00 O ATOM 582 CB LEU A 39 -10.169 -6.596 -11.072 1.00 0.00 C ATOM 583 CG LEU A 39 -10.736 -5.166 -11.084 1.00 0.00 C ATOM 584 CD1 LEU A 39 -10.269 -4.406 -9.832 1.00 0.00 C ATOM 585 CD2 LEU A 39 -10.350 -4.377 -12.347 1.00 0.00 C ATOM 0 H LEU A 39 -12.233 -7.950 -10.818 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.816 -6.983 -13.101 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.353 -7.039 -10.093 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.088 -6.547 -11.202 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.822 -5.257 -11.085 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -10.675 -3.394 -9.848 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.621 -4.924 -8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.180 -4.360 -9.819 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.780 -3.376 -12.296 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.264 -4.303 -12.412 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -10.732 -4.892 -13.229 1.00 0.00 H new ATOM 597 N GLY A 40 -10.343 -9.918 -11.980 1.00 0.00 N ATOM 598 CA GLY A 40 -9.625 -11.141 -12.166 1.00 0.00 C ATOM 599 C GLY A 40 -8.925 -11.556 -10.918 1.00 0.00 C ATOM 600 O GLY A 40 -7.925 -12.270 -10.968 1.00 0.00 O ATOM 0 H GLY A 40 -11.272 -10.056 -11.582 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.315 -11.926 -12.476 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.898 -11.019 -12.969 1.00 0.00 H new ATOM 604 N GLN A 41 -9.490 -11.249 -9.737 1.00 0.00 N ATOM 605 CA GLN A 41 -8.936 -11.595 -8.465 1.00 0.00 C ATOM 606 C GLN A 41 -9.791 -12.609 -7.785 1.00 0.00 C ATOM 607 O GLN A 41 -10.914 -12.846 -8.225 1.00 0.00 O ATOM 608 CB GLN A 41 -8.773 -10.391 -7.522 1.00 0.00 C ATOM 609 CG GLN A 41 -7.526 -9.630 -7.975 1.00 0.00 C ATOM 610 CD GLN A 41 -7.665 -8.196 -7.484 1.00 0.00 C ATOM 611 OE1 GLN A 41 -8.552 -7.775 -6.743 1.00 0.00 O ATOM 612 NE2 GLN A 41 -6.734 -7.320 -7.949 1.00 0.00 N ATOM 0 H GLN A 41 -10.370 -10.738 -9.665 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.944 -11.995 -8.674 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.652 -9.748 -7.563 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.668 -10.722 -6.489 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -6.626 -10.090 -7.567 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.433 -9.657 -9.061 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.989 -7.646 -8.565 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -6.781 -6.337 -7.682 1.00 0.00 H new ATOM 621 N ASN A 42 -9.375 -13.338 -6.734 1.00 0.00 N ATOM 622 CA ASN A 42 -10.055 -14.523 -6.311 1.00 0.00 C ATOM 623 C ASN A 42 -10.338 -14.389 -4.854 1.00 0.00 C ATOM 624 O ASN A 42 -9.637 -14.979 -4.033 1.00 0.00 O ATOM 625 CB ASN A 42 -9.226 -15.790 -6.582 1.00 0.00 C ATOM 626 CG ASN A 42 -8.905 -15.799 -8.070 1.00 0.00 C ATOM 627 OD1 ASN A 42 -9.790 -15.945 -8.912 1.00 0.00 O ATOM 628 ND2 ASN A 42 -7.604 -15.528 -8.358 1.00 0.00 N ATOM 0 H ASN A 42 -8.558 -13.103 -6.171 1.00 0.00 H new ATOM 0 HA ASN A 42 -10.980 -14.629 -6.878 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.311 -15.787 -5.990 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -9.784 -16.684 -6.302 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -7.306 -15.432 -9.329 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -6.926 -15.420 -7.603 1.00 0.00 H new ATOM 635 N PRO A 43 -11.395 -13.715 -4.510 1.00 0.00 N ATOM 636 CA PRO A 43 -11.695 -13.539 -3.119 1.00 0.00 C ATOM 637 C PRO A 43 -12.438 -14.702 -2.558 1.00 0.00 C ATOM 638 O PRO A 43 -12.874 -15.586 -3.293 1.00 0.00 O ATOM 639 CB PRO A 43 -12.561 -12.292 -2.954 1.00 0.00 C ATOM 640 CG PRO A 43 -12.863 -11.842 -4.392 1.00 0.00 C ATOM 641 CD PRO A 43 -12.134 -12.791 -5.357 1.00 0.00 C ATOM 0 HA PRO A 43 -10.750 -13.443 -2.584 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -13.477 -12.514 -2.407 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -12.037 -11.516 -2.397 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.937 -11.862 -4.579 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.531 -10.815 -4.546 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.841 -13.322 -5.994 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -11.463 -12.241 -6.016 1.00 0.00 H new ATOM 649 N THR A 44 -12.621 -14.830 -1.232 1.00 0.00 N ATOM 650 CA THR A 44 -13.417 -15.818 -0.572 1.00 0.00 C ATOM 651 C THR A 44 -14.428 -15.170 0.309 1.00 0.00 C ATOM 652 O THR A 44 -14.284 -14.022 0.728 1.00 0.00 O ATOM 653 CB THR A 44 -12.753 -16.943 0.165 1.00 0.00 C ATOM 654 OG1 THR A 44 -11.947 -16.408 1.204 1.00 0.00 O ATOM 655 CG2 THR A 44 -11.890 -17.743 -0.825 1.00 0.00 C ATOM 0 H THR A 44 -12.177 -14.192 -0.571 1.00 0.00 H new ATOM 0 HA THR A 44 -13.857 -16.334 -1.425 1.00 0.00 H new ATOM 0 HB THR A 44 -13.500 -17.604 0.604 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.512 -17.139 1.690 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.402 -18.564 -0.301 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.522 -18.143 -1.618 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.134 -17.089 -1.259 1.00 0.00 H new ATOM 663 N GLU A 45 -15.570 -15.844 0.532 1.00 0.00 N ATOM 664 CA GLU A 45 -16.597 -15.420 1.432 1.00 0.00 C ATOM 665 C GLU A 45 -16.186 -15.150 2.839 1.00 0.00 C ATOM 666 O GLU A 45 -16.454 -14.073 3.369 1.00 0.00 O ATOM 667 CB GLU A 45 -17.825 -16.343 1.350 1.00 0.00 C ATOM 668 CG GLU A 45 -18.439 -16.712 -0.002 1.00 0.00 C ATOM 669 CD GLU A 45 -19.537 -17.744 0.217 1.00 0.00 C ATOM 670 OE1 GLU A 45 -19.303 -18.981 0.194 1.00 0.00 O ATOM 671 OE2 GLU A 45 -20.732 -17.365 0.349 1.00 0.00 O ATOM 0 H GLU A 45 -15.787 -16.724 0.064 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.868 -14.428 1.070 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.558 -17.276 1.846 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.613 -15.881 1.944 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -18.848 -15.824 -0.485 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.673 -17.112 -0.667 1.00 0.00 H new ATOM 678 N ALA A 46 -15.477 -16.071 3.516 1.00 0.00 N ATOM 679 CA ALA A 46 -14.980 -15.929 4.850 1.00 0.00 C ATOM 680 C ALA A 46 -13.953 -14.885 5.122 1.00 0.00 C ATOM 681 O ALA A 46 -14.006 -14.232 6.163 1.00 0.00 O ATOM 682 CB ALA A 46 -14.520 -17.357 5.190 1.00 0.00 C ATOM 0 H ALA A 46 -15.236 -16.973 3.105 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.763 -15.530 5.496 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -14.114 -17.377 6.201 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -15.369 -18.038 5.126 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -13.751 -17.669 4.484 1.00 0.00 H new ATOM 688 N GLU A 47 -13.070 -14.553 4.164 1.00 0.00 N ATOM 689 CA GLU A 47 -12.160 -13.455 4.280 1.00 0.00 C ATOM 690 C GLU A 47 -12.619 -12.106 3.846 1.00 0.00 C ATOM 691 O GLU A 47 -12.204 -11.108 4.433 1.00 0.00 O ATOM 692 CB GLU A 47 -11.004 -13.788 3.322 1.00 0.00 C ATOM 693 CG GLU A 47 -10.216 -15.017 3.778 1.00 0.00 C ATOM 694 CD GLU A 47 -8.888 -15.277 3.082 1.00 0.00 C ATOM 695 OE1 GLU A 47 -8.003 -14.387 2.972 1.00 0.00 O ATOM 696 OE2 GLU A 47 -8.746 -16.432 2.598 1.00 0.00 O ATOM 0 H GLU A 47 -12.986 -15.062 3.284 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.954 -13.371 5.347 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.401 -13.963 2.322 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.333 -12.932 3.253 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.026 -14.922 4.847 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.848 -15.895 3.643 1.00 0.00 H new ATOM 703 N LEU A 48 -13.628 -12.006 2.961 1.00 0.00 N ATOM 704 CA LEU A 48 -14.413 -10.817 2.839 1.00 0.00 C ATOM 705 C LEU A 48 -15.260 -10.480 4.018 1.00 0.00 C ATOM 706 O LEU A 48 -15.267 -9.304 4.379 1.00 0.00 O ATOM 707 CB LEU A 48 -15.402 -11.032 1.681 1.00 0.00 C ATOM 708 CG LEU A 48 -14.817 -10.825 0.274 1.00 0.00 C ATOM 709 CD1 LEU A 48 -15.892 -11.165 -0.772 1.00 0.00 C ATOM 710 CD2 LEU A 48 -14.220 -9.453 -0.080 1.00 0.00 C ATOM 0 H LEU A 48 -13.901 -12.756 2.325 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.694 -10.009 2.705 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.799 -12.045 1.747 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.243 -10.351 1.811 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.956 -11.493 0.268 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.485 -11.021 -1.773 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -16.201 -12.204 -0.652 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -16.754 -10.512 -0.633 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.851 -9.470 -1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -14.989 -8.686 0.016 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -13.397 -9.229 0.598 1.00 0.00 H new ATOM 722 N GLN A 49 -15.872 -11.493 4.657 1.00 0.00 N ATOM 723 CA GLN A 49 -16.543 -11.260 5.898 1.00 0.00 C ATOM 724 C GLN A 49 -15.673 -10.647 6.941 1.00 0.00 C ATOM 725 O GLN A 49 -16.134 -9.776 7.677 1.00 0.00 O ATOM 726 CB GLN A 49 -17.084 -12.575 6.485 1.00 0.00 C ATOM 727 CG GLN A 49 -18.101 -12.344 7.604 1.00 0.00 C ATOM 728 CD GLN A 49 -18.920 -13.597 7.883 1.00 0.00 C ATOM 729 OE1 GLN A 49 -18.988 -14.645 7.242 1.00 0.00 O ATOM 730 NE2 GLN A 49 -19.537 -13.515 9.092 1.00 0.00 N ATOM 0 H GLN A 49 -15.903 -12.456 4.323 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.347 -10.565 5.653 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.549 -13.159 5.691 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.253 -13.166 6.870 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -17.581 -12.039 8.512 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.767 -11.527 7.328 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -19.487 -12.651 9.632 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -20.049 -14.317 9.459 1.00 0.00 H new ATOM 739 N ASP A 50 -14.412 -11.098 7.064 1.00 0.00 N ATOM 740 CA ASP A 50 -13.453 -10.628 8.015 1.00 0.00 C ATOM 741 C ASP A 50 -13.136 -9.177 7.893 1.00 0.00 C ATOM 742 O ASP A 50 -13.050 -8.491 8.911 1.00 0.00 O ATOM 743 CB ASP A 50 -12.239 -11.566 7.896 1.00 0.00 C ATOM 744 CG ASP A 50 -11.254 -11.404 9.045 1.00 0.00 C ATOM 745 OD1 ASP A 50 -11.690 -11.401 10.227 1.00 0.00 O ATOM 746 OD2 ASP A 50 -10.071 -11.153 8.692 1.00 0.00 O ATOM 0 H ASP A 50 -14.041 -11.834 6.464 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.859 -10.671 9.026 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -12.585 -12.599 7.863 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.726 -11.372 6.954 1.00 0.00 H new ATOM 751 N MET A 51 -12.924 -8.676 6.663 1.00 0.00 N ATOM 752 CA MET A 51 -12.729 -7.284 6.399 1.00 0.00 C ATOM 753 C MET A 51 -13.890 -6.391 6.672 1.00 0.00 C ATOM 754 O MET A 51 -13.789 -5.277 7.184 1.00 0.00 O ATOM 755 CB MET A 51 -12.388 -7.275 4.899 1.00 0.00 C ATOM 756 CG MET A 51 -11.791 -6.029 4.241 1.00 0.00 C ATOM 757 SD MET A 51 -12.194 -5.684 2.502 1.00 0.00 S ATOM 758 CE MET A 51 -11.206 -4.161 2.433 1.00 0.00 C ATOM 0 H MET A 51 -12.887 -9.258 5.826 1.00 0.00 H new ATOM 0 HA MET A 51 -11.967 -6.880 7.066 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.692 -8.095 4.723 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.305 -7.514 4.360 1.00 0.00 H new ATOM 0 HG2 MET A 51 -12.098 -5.165 4.830 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.706 -6.100 4.321 1.00 0.00 H new ATOM 0 HE1 MET A 51 -11.278 -3.725 1.437 1.00 0.00 H new ATOM 0 HE2 MET A 51 -11.582 -3.450 3.168 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.164 -4.393 2.653 1.00 0.00 H new ATOM 768 N ILE A 52 -15.096 -6.855 6.301 1.00 0.00 N ATOM 769 CA ILE A 52 -16.348 -6.234 6.606 1.00 0.00 C ATOM 770 C ILE A 52 -16.616 -6.082 8.064 1.00 0.00 C ATOM 771 O ILE A 52 -17.049 -5.021 8.510 1.00 0.00 O ATOM 772 CB ILE A 52 -17.416 -6.823 5.734 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.383 -6.223 4.318 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.834 -6.686 6.314 1.00 0.00 C ATOM 775 CD1 ILE A 52 -16.079 -5.726 3.695 1.00 0.00 C ATOM 0 H ILE A 52 -15.203 -7.712 5.758 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.323 -5.178 6.339 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.186 -7.888 5.687 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.790 -6.977 3.644 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -18.078 -5.383 4.313 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.553 -7.135 5.628 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.884 -7.195 7.276 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -19.071 -5.631 6.449 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -16.277 -5.342 2.694 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -15.661 -4.931 4.312 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -15.368 -6.550 3.633 1.00 0.00 H new ATOM 787 N ASN A 53 -16.319 -7.104 8.887 1.00 0.00 N ATOM 788 CA ASN A 53 -16.334 -7.175 10.315 1.00 0.00 C ATOM 789 C ASN A 53 -15.572 -6.096 11.003 1.00 0.00 C ATOM 790 O ASN A 53 -15.940 -5.524 12.028 1.00 0.00 O ATOM 791 CB ASN A 53 -15.811 -8.437 11.022 1.00 0.00 C ATOM 792 CG ASN A 53 -16.884 -9.515 10.966 1.00 0.00 C ATOM 793 OD1 ASN A 53 -18.086 -9.258 10.923 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.417 -10.790 10.898 1.00 0.00 N ATOM 0 H ASN A 53 -16.030 -7.999 8.492 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.418 -7.117 10.412 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.899 -8.788 10.540 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.558 -8.211 12.058 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.070 -11.568 10.808 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.413 -10.968 10.936 1.00 0.00 H new ATOM 801 N GLU A 54 -14.421 -5.755 10.395 1.00 0.00 N ATOM 802 CA GLU A 54 -13.535 -4.750 10.893 1.00 0.00 C ATOM 803 C GLU A 54 -14.087 -3.368 10.805 1.00 0.00 C ATOM 804 O GLU A 54 -13.950 -2.605 11.759 1.00 0.00 O ATOM 805 CB GLU A 54 -12.162 -4.954 10.230 1.00 0.00 C ATOM 806 CG GLU A 54 -11.037 -4.176 10.915 1.00 0.00 C ATOM 807 CD GLU A 54 -10.611 -4.394 12.360 1.00 0.00 C ATOM 808 OE1 GLU A 54 -10.231 -5.540 12.721 1.00 0.00 O ATOM 809 OE2 GLU A 54 -10.635 -3.430 13.171 1.00 0.00 O ATOM 0 H GLU A 54 -14.098 -6.192 9.532 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.410 -4.867 11.969 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.917 -6.016 10.238 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.222 -4.648 9.185 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.145 -4.331 10.308 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.300 -3.122 10.831 1.00 0.00 H new ATOM 816 N VAL A 55 -14.706 -3.009 9.666 1.00 0.00 N ATOM 817 CA VAL A 55 -15.240 -1.699 9.457 1.00 0.00 C ATOM 818 C VAL A 55 -16.699 -1.475 9.664 1.00 0.00 C ATOM 819 O VAL A 55 -17.205 -0.360 9.552 1.00 0.00 O ATOM 820 CB VAL A 55 -14.962 -1.193 8.073 1.00 0.00 C ATOM 821 CG1 VAL A 55 -13.431 -1.173 7.935 1.00 0.00 C ATOM 822 CG2 VAL A 55 -15.562 -2.040 6.938 1.00 0.00 C ATOM 0 H VAL A 55 -14.838 -3.640 8.876 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.717 -1.166 10.251 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.432 -0.215 7.967 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -13.160 -0.812 6.943 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -13.006 -0.512 8.691 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -13.040 -2.181 8.074 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.307 -1.594 5.977 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.159 -3.052 6.987 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.646 -2.076 7.045 1.00 0.00 H new ATOM 832 N ASP A 56 -17.432 -2.551 10.001 1.00 0.00 N ATOM 833 CA ASP A 56 -18.828 -2.490 10.303 1.00 0.00 C ATOM 834 C ASP A 56 -18.920 -2.117 11.743 1.00 0.00 C ATOM 835 O ASP A 56 -18.520 -2.854 12.642 1.00 0.00 O ATOM 836 CB ASP A 56 -19.602 -3.744 9.863 1.00 0.00 C ATOM 837 CG ASP A 56 -21.080 -3.797 10.221 1.00 0.00 C ATOM 838 OD1 ASP A 56 -21.729 -2.773 9.878 1.00 0.00 O ATOM 839 OD2 ASP A 56 -21.623 -4.837 10.680 1.00 0.00 O ATOM 0 H ASP A 56 -17.042 -3.491 10.065 1.00 0.00 H new ATOM 0 HA ASP A 56 -19.343 -1.729 9.716 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -19.511 -3.838 8.781 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -19.115 -4.615 10.301 1.00 0.00 H new ATOM 844 N ALA A 57 -19.331 -0.844 11.882 1.00 0.00 N ATOM 845 CA ALA A 57 -19.434 -0.125 13.114 1.00 0.00 C ATOM 846 C ALA A 57 -20.771 -0.382 13.720 1.00 0.00 C ATOM 847 O ALA A 57 -20.867 -0.835 14.859 1.00 0.00 O ATOM 848 CB ALA A 57 -19.033 1.310 12.730 1.00 0.00 C ATOM 0 H ALA A 57 -19.610 -0.280 11.079 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.778 -0.424 13.932 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -19.079 1.949 13.612 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.017 1.310 12.334 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.718 1.689 11.971 1.00 0.00 H new ATOM 854 N ASP A 58 -21.842 -0.124 12.949 1.00 0.00 N ATOM 855 CA ASP A 58 -23.206 -0.094 13.377 1.00 0.00 C ATOM 856 C ASP A 58 -23.831 -1.432 13.577 1.00 0.00 C ATOM 857 O ASP A 58 -24.925 -1.627 14.104 1.00 0.00 O ATOM 858 CB ASP A 58 -24.027 0.790 12.422 1.00 0.00 C ATOM 859 CG ASP A 58 -23.890 0.372 10.965 1.00 0.00 C ATOM 860 OD1 ASP A 58 -24.065 -0.846 10.694 1.00 0.00 O ATOM 861 OD2 ASP A 58 -23.491 1.182 10.087 1.00 0.00 O ATOM 0 H ASP A 58 -21.746 0.078 11.954 1.00 0.00 H new ATOM 0 HA ASP A 58 -23.207 0.343 14.375 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -25.078 0.749 12.710 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.707 1.827 12.529 1.00 0.00 H new ATOM 866 N GLY A 59 -23.159 -2.529 13.185 1.00 0.00 N ATOM 867 CA GLY A 59 -23.445 -3.913 13.404 1.00 0.00 C ATOM 868 C GLY A 59 -24.288 -4.574 12.369 1.00 0.00 C ATOM 869 O GLY A 59 -24.590 -5.756 12.530 1.00 0.00 O ATOM 0 H GLY A 59 -22.301 -2.426 12.642 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -22.501 -4.453 13.475 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -23.943 -4.013 14.369 1.00 0.00 H new ATOM 873 N ASN A 60 -24.824 -3.913 11.327 1.00 0.00 N ATOM 874 CA ASN A 60 -25.686 -4.486 10.340 1.00 0.00 C ATOM 875 C ASN A 60 -25.230 -5.523 9.373 1.00 0.00 C ATOM 876 O ASN A 60 -26.028 -6.179 8.705 1.00 0.00 O ATOM 877 CB ASN A 60 -26.445 -3.366 9.609 1.00 0.00 C ATOM 878 CG ASN A 60 -25.652 -2.385 8.758 1.00 0.00 C ATOM 879 OD1 ASN A 60 -24.476 -2.671 8.542 1.00 0.00 O ATOM 880 ND2 ASN A 60 -26.275 -1.274 8.280 1.00 0.00 N ATOM 0 H ASN A 60 -24.645 -2.922 11.165 1.00 0.00 H new ATOM 0 HA ASN A 60 -26.297 -5.123 10.979 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -27.190 -3.835 8.966 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.988 -2.790 10.358 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.761 -0.611 7.699 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -27.256 -1.104 8.502 1.00 0.00 H new ATOM 887 N GLY A 61 -23.895 -5.673 9.305 1.00 0.00 N ATOM 888 CA GLY A 61 -23.251 -6.657 8.491 1.00 0.00 C ATOM 889 C GLY A 61 -22.800 -6.211 7.143 1.00 0.00 C ATOM 890 O GLY A 61 -22.221 -6.947 6.346 1.00 0.00 O ATOM 0 H GLY A 61 -23.244 -5.092 9.833 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -22.384 -7.035 9.033 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -23.936 -7.495 8.362 1.00 0.00 H new ATOM 894 N THR A 62 -23.063 -4.919 6.878 1.00 0.00 N ATOM 895 CA THR A 62 -22.849 -4.311 5.601 1.00 0.00 C ATOM 896 C THR A 62 -22.072 -3.047 5.742 1.00 0.00 C ATOM 897 O THR A 62 -21.925 -2.405 6.780 1.00 0.00 O ATOM 898 CB THR A 62 -24.086 -3.931 4.843 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.994 -3.013 5.435 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.822 -5.243 4.525 1.00 0.00 C ATOM 0 H THR A 62 -23.437 -4.276 7.576 1.00 0.00 H new ATOM 0 HA THR A 62 -22.327 -5.090 5.046 1.00 0.00 H new ATOM 0 HB THR A 62 -23.731 -3.373 3.976 1.00 0.00 H new ATOM 0 HG1 THR A 62 -24.707 -2.814 6.351 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.735 -5.023 3.971 1.00 0.00 H new ATOM 0 HG22 THR A 62 -24.178 -5.885 3.924 1.00 0.00 H new ATOM 0 HG23 THR A 62 -25.076 -5.752 5.455 1.00 0.00 H new ATOM 908 N ILE A 63 -21.496 -2.512 4.650 1.00 0.00 N ATOM 909 CA ILE A 63 -20.728 -1.306 4.641 1.00 0.00 C ATOM 910 C ILE A 63 -21.539 -0.116 4.259 1.00 0.00 C ATOM 911 O ILE A 63 -21.939 0.065 3.109 1.00 0.00 O ATOM 912 CB ILE A 63 -19.539 -1.490 3.745 1.00 0.00 C ATOM 913 CG1 ILE A 63 -19.086 -2.938 3.497 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.329 -0.745 4.335 1.00 0.00 C ATOM 915 CD1 ILE A 63 -17.827 -3.083 2.643 1.00 0.00 C ATOM 0 H ILE A 63 -21.570 -2.942 3.728 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.382 -1.106 5.655 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.877 -1.098 2.786 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -18.911 -3.418 4.460 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -19.899 -3.480 3.014 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.466 -0.879 3.683 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -18.560 0.317 4.417 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.103 -1.144 5.324 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -17.588 -4.140 2.524 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.999 -2.638 1.663 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.995 -2.575 3.132 1.00 0.00 H new ATOM 927 N ASP A 64 -21.942 0.782 5.176 1.00 0.00 N ATOM 928 CA ASP A 64 -22.787 1.897 4.881 1.00 0.00 C ATOM 929 C ASP A 64 -21.840 2.978 4.487 1.00 0.00 C ATOM 930 O ASP A 64 -20.631 2.797 4.626 1.00 0.00 O ATOM 931 CB ASP A 64 -23.691 2.274 6.067 1.00 0.00 C ATOM 932 CG ASP A 64 -24.568 1.125 6.544 1.00 0.00 C ATOM 933 OD1 ASP A 64 -24.005 0.045 6.866 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.801 1.336 6.701 1.00 0.00 O ATOM 0 H ASP A 64 -21.670 0.730 6.158 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.500 1.684 4.085 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -23.069 2.615 6.895 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.326 3.112 5.779 1.00 0.00 H new ATOM 939 N PHE A 65 -22.319 4.167 4.081 1.00 0.00 N ATOM 940 CA PHE A 65 -21.456 5.234 3.678 1.00 0.00 C ATOM 941 C PHE A 65 -20.429 5.707 4.647 1.00 0.00 C ATOM 942 O PHE A 65 -19.300 5.767 4.162 1.00 0.00 O ATOM 943 CB PHE A 65 -22.269 6.244 2.851 1.00 0.00 C ATOM 944 CG PHE A 65 -21.535 7.315 2.122 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.539 6.991 1.230 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.754 8.631 2.454 1.00 0.00 C ATOM 947 CE1 PHE A 65 -19.800 8.032 0.721 1.00 0.00 C ATOM 948 CE2 PHE A 65 -20.930 9.664 2.072 1.00 0.00 C ATOM 949 CZ PHE A 65 -19.985 9.332 1.130 1.00 0.00 C ATOM 0 H PHE A 65 -23.313 4.391 4.032 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.697 4.842 3.001 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.850 5.683 2.119 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.980 6.726 3.521 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.347 5.968 0.943 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.624 8.867 3.049 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.048 7.822 -0.026 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.019 10.660 2.481 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.373 10.111 0.701 1.00 0.00 H new ATOM 959 N PRO A 66 -20.689 6.123 5.851 1.00 0.00 N ATOM 960 CA PRO A 66 -19.706 6.616 6.771 1.00 0.00 C ATOM 961 C PRO A 66 -18.641 5.649 7.160 1.00 0.00 C ATOM 962 O PRO A 66 -17.540 6.019 7.565 1.00 0.00 O ATOM 963 CB PRO A 66 -20.443 7.158 7.994 1.00 0.00 C ATOM 964 CG PRO A 66 -21.942 6.904 7.768 1.00 0.00 C ATOM 965 CD PRO A 66 -22.020 6.525 6.281 1.00 0.00 C ATOM 0 HA PRO A 66 -19.150 7.399 6.255 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -20.101 6.661 8.902 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -20.248 8.223 8.121 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -22.314 6.103 8.407 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.537 7.790 7.988 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.731 5.712 6.131 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.373 7.370 5.690 1.00 0.00 H new ATOM 973 N GLU A 67 -18.842 4.321 7.087 1.00 0.00 N ATOM 974 CA GLU A 67 -17.887 3.262 7.191 1.00 0.00 C ATOM 975 C GLU A 67 -17.163 3.085 5.901 1.00 0.00 C ATOM 976 O GLU A 67 -15.973 2.773 5.918 1.00 0.00 O ATOM 977 CB GLU A 67 -18.559 1.933 7.575 1.00 0.00 C ATOM 978 CG GLU A 67 -19.625 2.096 8.661 1.00 0.00 C ATOM 979 CD GLU A 67 -20.379 0.774 8.676 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.894 0.272 7.641 1.00 0.00 O ATOM 981 OE2 GLU A 67 -20.713 0.330 9.807 1.00 0.00 O ATOM 0 H GLU A 67 -19.781 3.952 6.938 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.182 3.538 7.975 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -19.015 1.493 6.688 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.798 1.234 7.922 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -19.172 2.303 9.631 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -20.292 2.928 8.437 1.00 0.00 H new ATOM 988 N PHE A 68 -17.873 3.329 4.786 1.00 0.00 N ATOM 989 CA PHE A 68 -17.145 3.232 3.559 1.00 0.00 C ATOM 990 C PHE A 68 -16.166 4.331 3.331 1.00 0.00 C ATOM 991 O PHE A 68 -15.031 4.084 2.925 1.00 0.00 O ATOM 992 CB PHE A 68 -18.107 3.300 2.361 1.00 0.00 C ATOM 993 CG PHE A 68 -17.449 3.270 1.025 1.00 0.00 C ATOM 994 CD1 PHE A 68 -17.126 2.046 0.488 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.245 4.455 0.358 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.386 2.017 -0.670 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.689 4.360 -0.896 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.324 3.152 -1.444 1.00 0.00 C ATOM 0 H PHE A 68 -18.862 3.572 4.726 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.613 2.284 3.642 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.804 2.464 2.425 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.697 4.213 2.439 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.446 1.131 0.964 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.507 5.407 0.795 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.863 1.120 -0.966 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.534 5.262 -1.469 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.993 3.096 -2.470 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.493 5.564 3.756 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.625 6.662 4.052 1.00 0.00 C ATOM 1010 C LEU A 69 -14.440 6.368 4.907 1.00 0.00 C ATOM 1011 O LEU A 69 -13.314 6.732 4.573 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.499 7.757 4.687 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.429 8.587 3.786 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -18.206 9.730 4.460 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.630 9.168 2.607 1.00 0.00 C ATOM 0 H LEU A 69 -17.470 5.816 3.908 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.167 6.967 3.111 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.117 7.283 5.450 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.834 8.451 5.201 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.189 7.873 3.470 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -18.824 10.237 3.719 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.842 9.323 5.246 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.503 10.441 4.894 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.293 9.755 1.972 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -15.833 9.807 2.987 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.197 8.355 2.025 1.00 0.00 H new ATOM 1027 N THR A 70 -14.582 5.642 6.030 1.00 0.00 N ATOM 1028 CA THR A 70 -13.525 5.072 6.806 1.00 0.00 C ATOM 1029 C THR A 70 -12.603 4.136 6.103 1.00 0.00 C ATOM 1030 O THR A 70 -11.392 4.200 6.308 1.00 0.00 O ATOM 1031 CB THR A 70 -14.169 4.478 8.024 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.943 5.405 8.771 1.00 0.00 O ATOM 1033 CG2 THR A 70 -13.111 3.920 8.990 1.00 0.00 C ATOM 0 H THR A 70 -15.501 5.440 6.423 1.00 0.00 H new ATOM 0 HA THR A 70 -12.826 5.867 7.064 1.00 0.00 H new ATOM 0 HB THR A 70 -14.821 3.697 7.634 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.830 5.493 8.364 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.604 3.495 9.864 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.532 3.145 8.488 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.445 4.724 9.304 1.00 0.00 H new ATOM 1041 N MET A 71 -13.054 3.237 5.210 1.00 0.00 N ATOM 1042 CA MET A 71 -12.283 2.389 4.355 1.00 0.00 C ATOM 1043 C MET A 71 -11.523 3.132 3.311 1.00 0.00 C ATOM 1044 O MET A 71 -10.326 2.878 3.184 1.00 0.00 O ATOM 1045 CB MET A 71 -13.122 1.250 3.752 1.00 0.00 C ATOM 1046 CG MET A 71 -12.306 0.174 3.032 1.00 0.00 C ATOM 1047 SD MET A 71 -13.297 -1.082 2.168 1.00 0.00 S ATOM 1048 CE MET A 71 -14.249 -1.669 3.599 1.00 0.00 C ATOM 0 H MET A 71 -14.055 3.092 5.076 1.00 0.00 H new ATOM 0 HA MET A 71 -11.534 1.931 5.000 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.698 0.779 4.548 1.00 0.00 H new ATOM 0 HB3 MET A 71 -13.838 1.676 3.049 1.00 0.00 H new ATOM 0 HG2 MET A 71 -11.649 0.658 2.310 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.666 -0.325 3.760 1.00 0.00 H new ATOM 0 HE1 MET A 71 -14.519 -2.715 3.452 1.00 0.00 H new ATOM 0 HE2 MET A 71 -13.645 -1.573 4.502 1.00 0.00 H new ATOM 0 HE3 MET A 71 -15.155 -1.072 3.703 1.00 0.00 H new ATOM 1058 N MET A 72 -12.124 4.155 2.676 1.00 0.00 N ATOM 1059 CA MET A 72 -11.486 5.024 1.736 1.00 0.00 C ATOM 1060 C MET A 72 -10.588 6.064 2.312 1.00 0.00 C ATOM 1061 O MET A 72 -9.706 6.648 1.684 1.00 0.00 O ATOM 1062 CB MET A 72 -12.507 5.743 0.838 1.00 0.00 C ATOM 1063 CG MET A 72 -13.413 4.834 0.006 1.00 0.00 C ATOM 1064 SD MET A 72 -12.651 3.920 -1.369 1.00 0.00 S ATOM 1065 CE MET A 72 -12.669 2.304 -0.540 1.00 0.00 C ATOM 0 H MET A 72 -13.106 4.387 2.827 1.00 0.00 H new ATOM 0 HA MET A 72 -10.860 4.335 1.168 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.135 6.375 1.466 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.966 6.404 0.161 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.871 4.109 0.679 1.00 0.00 H new ATOM 0 HG3 MET A 72 -14.219 5.444 -0.402 1.00 0.00 H new ATOM 0 HE1 MET A 72 -11.766 1.752 -0.799 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.708 2.449 0.540 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.544 1.740 -0.862 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.558 6.233 3.646 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.548 6.989 4.318 1.00 0.00 C ATOM 1077 C ALA A 73 -8.176 6.410 4.356 1.00 0.00 C ATOM 1078 O ALA A 73 -7.170 7.082 4.578 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.010 7.251 5.762 1.00 0.00 C ATOM 0 H ALA A 73 -11.255 5.833 4.274 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.444 7.894 3.720 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.249 7.827 6.288 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.945 7.811 5.749 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.163 6.301 6.273 1.00 0.00 H new ATOM 1234 N GLU A 83 3.123 12.327 -4.216 1.00 0.00 N ATOM 1235 CA GLU A 83 4.169 12.873 -3.408 1.00 0.00 C ATOM 1236 C GLU A 83 4.328 12.137 -2.123 1.00 0.00 C ATOM 1237 O GLU A 83 5.402 12.266 -1.537 1.00 0.00 O ATOM 1238 CB GLU A 83 4.112 14.401 -3.238 1.00 0.00 C ATOM 1239 CG GLU A 83 3.092 14.869 -2.197 1.00 0.00 C ATOM 1240 CD GLU A 83 3.170 16.379 -2.024 1.00 0.00 C ATOM 1241 OE1 GLU A 83 3.613 17.089 -2.966 1.00 0.00 O ATOM 1242 OE2 GLU A 83 2.670 16.805 -0.949 1.00 0.00 O ATOM 0 HA GLU A 83 5.086 12.711 -3.974 1.00 0.00 H new ATOM 0 HB2 GLU A 83 5.100 14.763 -2.953 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.871 14.855 -4.199 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.087 14.583 -2.508 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.283 14.376 -1.244 1.00 0.00 H new ATOM 1249 N GLU A 84 3.228 11.546 -1.624 1.00 0.00 N ATOM 1250 CA GLU A 84 3.362 10.742 -0.449 1.00 0.00 C ATOM 1251 C GLU A 84 3.953 9.412 -0.772 1.00 0.00 C ATOM 1252 O GLU A 84 4.791 8.916 -0.021 1.00 0.00 O ATOM 1253 CB GLU A 84 2.027 10.642 0.307 1.00 0.00 C ATOM 1254 CG GLU A 84 2.074 9.827 1.601 1.00 0.00 C ATOM 1255 CD GLU A 84 0.968 9.926 2.642 1.00 0.00 C ATOM 1256 OE1 GLU A 84 -0.200 9.674 2.241 1.00 0.00 O ATOM 1257 OE2 GLU A 84 1.238 10.213 3.839 1.00 0.00 O ATOM 0 H GLU A 84 2.287 11.618 -2.011 1.00 0.00 H new ATOM 0 HA GLU A 84 4.062 11.231 0.228 1.00 0.00 H new ATOM 0 HB2 GLU A 84 1.684 11.650 0.543 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.284 10.199 -0.356 1.00 0.00 H new ATOM 0 HG2 GLU A 84 2.145 8.778 1.313 1.00 0.00 H new ATOM 0 HG3 GLU A 84 3.007 10.084 2.104 1.00 0.00 H new ATOM 1264 N ILE A 85 3.657 8.807 -1.936 1.00 0.00 N ATOM 1265 CA ILE A 85 4.309 7.584 -2.288 1.00 0.00 C ATOM 1266 C ILE A 85 5.657 7.738 -2.903 1.00 0.00 C ATOM 1267 O ILE A 85 6.461 6.807 -2.945 1.00 0.00 O ATOM 1268 CB ILE A 85 3.469 6.678 -3.139 1.00 0.00 C ATOM 1269 CG1 ILE A 85 3.015 7.159 -4.527 1.00 0.00 C ATOM 1270 CG2 ILE A 85 2.139 6.494 -2.388 1.00 0.00 C ATOM 1271 CD1 ILE A 85 2.476 6.049 -5.427 1.00 0.00 C ATOM 0 H ILE A 85 2.983 9.154 -2.619 1.00 0.00 H new ATOM 0 HA ILE A 85 4.456 7.114 -1.316 1.00 0.00 H new ATOM 0 HB ILE A 85 4.117 5.817 -3.304 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.242 7.918 -4.402 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.856 7.640 -5.026 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.484 5.840 -2.963 1.00 0.00 H new ATOM 0 HG22 ILE A 85 2.331 6.048 -1.412 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.659 7.463 -2.256 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.178 6.471 -6.387 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.252 5.300 -5.586 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.613 5.582 -4.952 1.00 0.00 H new ATOM 1283 N ARG A 86 6.114 8.917 -3.359 1.00 0.00 N ATOM 1284 CA ARG A 86 7.494 9.181 -3.630 1.00 0.00 C ATOM 1285 C ARG A 86 8.267 9.361 -2.369 1.00 0.00 C ATOM 1286 O ARG A 86 9.303 8.703 -2.279 1.00 0.00 O ATOM 1287 CB ARG A 86 7.813 10.397 -4.516 1.00 0.00 C ATOM 1288 CG ARG A 86 8.996 10.210 -5.468 1.00 0.00 C ATOM 1289 CD ARG A 86 9.182 11.357 -6.463 1.00 0.00 C ATOM 1290 NE ARG A 86 10.171 10.867 -7.464 1.00 0.00 N ATOM 1291 CZ ARG A 86 9.896 10.801 -8.799 1.00 0.00 C ATOM 1292 NH1 ARG A 86 8.889 11.473 -9.430 1.00 0.00 N ATOM 1293 NH2 ARG A 86 10.732 10.071 -9.593 1.00 0.00 N ATOM 0 H ARG A 86 5.504 9.713 -3.545 1.00 0.00 H new ATOM 0 HA ARG A 86 7.785 8.293 -4.191 1.00 0.00 H new ATOM 0 HB2 ARG A 86 6.928 10.642 -5.104 1.00 0.00 H new ATOM 0 HB3 ARG A 86 8.015 11.253 -3.873 1.00 0.00 H new ATOM 0 HG2 ARG A 86 9.908 10.101 -4.881 1.00 0.00 H new ATOM 0 HG3 ARG A 86 8.860 9.281 -6.022 1.00 0.00 H new ATOM 0 HD2 ARG A 86 8.238 11.618 -6.941 1.00 0.00 H new ATOM 0 HD3 ARG A 86 9.544 12.255 -5.962 1.00 0.00 H new ATOM 0 HE ARG A 86 11.090 10.569 -7.138 1.00 0.00 H new ATOM 0 HH11 ARG A 86 8.270 12.084 -8.896 1.00 0.00 H new ATOM 0 HH12 ARG A 86 8.755 11.365 -10.435 1.00 0.00 H new ATOM 0 HH21 ARG A 86 11.536 9.594 -9.185 1.00 0.00 H new ATOM 0 HH22 ARG A 86 10.553 10.002 -10.595 1.00 0.00 H new ATOM 1307 N GLU A 87 7.822 10.211 -1.427 1.00 0.00 N ATOM 1308 CA GLU A 87 8.375 10.198 -0.109 1.00 0.00 C ATOM 1309 C GLU A 87 8.457 8.857 0.535 1.00 0.00 C ATOM 1310 O GLU A 87 9.540 8.569 1.041 1.00 0.00 O ATOM 1311 CB GLU A 87 7.744 11.360 0.676 1.00 0.00 C ATOM 1312 CG GLU A 87 8.131 11.456 2.154 1.00 0.00 C ATOM 1313 CD GLU A 87 9.145 12.550 2.456 1.00 0.00 C ATOM 1314 OE1 GLU A 87 10.292 12.623 1.938 1.00 0.00 O ATOM 1315 OE2 GLU A 87 8.850 13.416 3.322 1.00 0.00 O ATOM 0 H GLU A 87 7.086 10.901 -1.576 1.00 0.00 H new ATOM 0 HA GLU A 87 9.447 10.393 -0.139 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.018 12.295 0.187 1.00 0.00 H new ATOM 0 HB3 GLU A 87 6.660 11.272 0.609 1.00 0.00 H new ATOM 0 HG2 GLU A 87 7.232 11.634 2.744 1.00 0.00 H new ATOM 0 HG3 GLU A 87 8.538 10.498 2.476 1.00 0.00 H new ATOM 1322 N ALA A 88 7.418 8.003 0.512 1.00 0.00 N ATOM 1323 CA ALA A 88 7.450 6.681 1.056 1.00 0.00 C ATOM 1324 C ALA A 88 8.361 5.725 0.366 1.00 0.00 C ATOM 1325 O ALA A 88 9.006 4.885 0.992 1.00 0.00 O ATOM 1326 CB ALA A 88 6.044 6.092 0.856 1.00 0.00 C ATOM 0 H ALA A 88 6.518 8.244 0.097 1.00 0.00 H new ATOM 0 HA ALA A 88 7.794 6.787 2.085 1.00 0.00 H new ATOM 0 HB1 ALA A 88 6.014 5.078 1.256 1.00 0.00 H new ATOM 0 HB2 ALA A 88 5.313 6.710 1.378 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.807 6.069 -0.208 1.00 0.00 H new ATOM 1332 N PHE A 89 8.537 5.825 -0.964 1.00 0.00 N ATOM 1333 CA PHE A 89 9.502 5.044 -1.674 1.00 0.00 C ATOM 1334 C PHE A 89 10.904 5.175 -1.188 1.00 0.00 C ATOM 1335 O PHE A 89 11.649 4.212 -1.018 1.00 0.00 O ATOM 1336 CB PHE A 89 9.500 5.563 -3.122 1.00 0.00 C ATOM 1337 CG PHE A 89 10.191 4.696 -4.117 1.00 0.00 C ATOM 1338 CD1 PHE A 89 9.760 3.428 -4.430 1.00 0.00 C ATOM 1339 CD2 PHE A 89 11.376 5.131 -4.663 1.00 0.00 C ATOM 1340 CE1 PHE A 89 10.493 2.634 -5.281 1.00 0.00 C ATOM 1341 CE2 PHE A 89 12.198 4.322 -5.411 1.00 0.00 C ATOM 1342 CZ PHE A 89 11.728 3.063 -5.707 1.00 0.00 C ATOM 0 H PHE A 89 8.000 6.459 -1.556 1.00 0.00 H new ATOM 0 HA PHE A 89 9.217 4.000 -1.546 1.00 0.00 H new ATOM 0 HB2 PHE A 89 8.466 5.697 -3.440 1.00 0.00 H new ATOM 0 HB3 PHE A 89 9.968 6.547 -3.137 1.00 0.00 H new ATOM 0 HD1 PHE A 89 8.840 3.053 -4.005 1.00 0.00 H new ATOM 0 HD2 PHE A 89 11.675 6.155 -4.496 1.00 0.00 H new ATOM 0 HE1 PHE A 89 10.102 1.683 -5.611 1.00 0.00 H new ATOM 0 HE2 PHE A 89 13.167 4.658 -5.750 1.00 0.00 H new ATOM 0 HZ PHE A 89 12.345 2.395 -6.289 1.00 0.00 H new ATOM 1352 N ARG A 90 11.229 6.444 -0.881 1.00 0.00 N ATOM 1353 CA ARG A 90 12.527 6.868 -0.455 1.00 0.00 C ATOM 1354 C ARG A 90 12.712 6.584 0.996 1.00 0.00 C ATOM 1355 O ARG A 90 13.798 6.284 1.488 1.00 0.00 O ATOM 1356 CB ARG A 90 12.774 8.331 -0.861 1.00 0.00 C ATOM 1357 CG ARG A 90 14.111 8.926 -0.414 1.00 0.00 C ATOM 1358 CD ARG A 90 14.271 10.330 -1.002 1.00 0.00 C ATOM 1359 NE ARG A 90 13.274 11.238 -0.367 1.00 0.00 N ATOM 1360 CZ ARG A 90 12.892 12.436 -0.898 1.00 0.00 C ATOM 1361 NH1 ARG A 90 13.402 12.962 -2.050 1.00 0.00 N ATOM 1362 NH2 ARG A 90 11.953 13.242 -0.323 1.00 0.00 N ATOM 0 H ARG A 90 10.556 7.209 -0.932 1.00 0.00 H new ATOM 0 HA ARG A 90 13.299 6.293 -0.966 1.00 0.00 H new ATOM 0 HB2 ARG A 90 12.710 8.404 -1.947 1.00 0.00 H new ATOM 0 HB3 ARG A 90 11.970 8.943 -0.452 1.00 0.00 H new ATOM 0 HG2 ARG A 90 14.155 8.969 0.674 1.00 0.00 H new ATOM 0 HG3 ARG A 90 14.932 8.288 -0.741 1.00 0.00 H new ATOM 0 HD2 ARG A 90 15.282 10.699 -0.827 1.00 0.00 H new ATOM 0 HD3 ARG A 90 14.124 10.305 -2.082 1.00 0.00 H new ATOM 0 HE ARG A 90 12.853 10.947 0.515 1.00 0.00 H new ATOM 0 HH11 ARG A 90 14.115 12.452 -2.571 1.00 0.00 H new ATOM 0 HH12 ARG A 90 13.070 13.865 -2.389 1.00 0.00 H new ATOM 0 HH21 ARG A 90 11.500 12.958 0.546 1.00 0.00 H new ATOM 0 HH22 ARG A 90 11.704 14.128 -0.762 1.00 0.00 H new ATOM 1376 N VAL A 91 11.592 6.682 1.734 1.00 0.00 N ATOM 1377 CA VAL A 91 11.522 6.262 3.099 1.00 0.00 C ATOM 1378 C VAL A 91 11.862 4.818 3.240 1.00 0.00 C ATOM 1379 O VAL A 91 12.785 4.526 3.998 1.00 0.00 O ATOM 1380 CB VAL A 91 10.256 6.645 3.807 1.00 0.00 C ATOM 1381 CG1 VAL A 91 10.208 5.949 5.178 1.00 0.00 C ATOM 1382 CG2 VAL A 91 10.337 8.168 4.000 1.00 0.00 C ATOM 0 H VAL A 91 10.716 7.061 1.375 1.00 0.00 H new ATOM 0 HA VAL A 91 12.289 6.831 3.624 1.00 0.00 H new ATOM 0 HB VAL A 91 9.367 6.354 3.247 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.289 6.226 5.695 1.00 0.00 H new ATOM 0 HG12 VAL A 91 10.235 4.868 5.039 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.066 6.259 5.774 1.00 0.00 H new ATOM 0 HG21 VAL A 91 9.441 8.518 4.513 1.00 0.00 H new ATOM 0 HG22 VAL A 91 11.216 8.413 4.596 1.00 0.00 H new ATOM 0 HG23 VAL A 91 10.411 8.655 3.027 1.00 0.00 H new ATOM 1392 N PHE A 92 11.239 3.900 2.479 1.00 0.00 N ATOM 1393 CA PHE A 92 11.429 2.484 2.547 1.00 0.00 C ATOM 1394 C PHE A 92 12.675 1.971 1.911 1.00 0.00 C ATOM 1395 O PHE A 92 13.128 0.925 2.373 1.00 0.00 O ATOM 1396 CB PHE A 92 10.274 1.869 1.739 1.00 0.00 C ATOM 1397 CG PHE A 92 8.892 2.035 2.269 1.00 0.00 C ATOM 1398 CD1 PHE A 92 8.598 2.156 3.606 1.00 0.00 C ATOM 1399 CD2 PHE A 92 7.815 2.091 1.415 1.00 0.00 C ATOM 1400 CE1 PHE A 92 7.315 2.420 4.022 1.00 0.00 C ATOM 1401 CE2 PHE A 92 6.500 2.147 1.810 1.00 0.00 C ATOM 1402 CZ PHE A 92 6.260 2.398 3.140 1.00 0.00 C ATOM 0 H PHE A 92 10.557 4.166 1.769 1.00 0.00 H new ATOM 0 HA PHE A 92 11.479 2.224 3.604 1.00 0.00 H new ATOM 0 HB2 PHE A 92 10.302 2.296 0.736 1.00 0.00 H new ATOM 0 HB3 PHE A 92 10.468 0.801 1.637 1.00 0.00 H new ATOM 0 HD1 PHE A 92 9.384 2.042 4.338 1.00 0.00 H new ATOM 0 HD2 PHE A 92 8.018 2.091 0.354 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.132 2.649 5.061 1.00 0.00 H new ATOM 0 HE2 PHE A 92 5.692 2.001 1.108 1.00 0.00 H new ATOM 0 HZ PHE A 92 5.253 2.576 3.489 1.00 0.00 H new ATOM 1412 N ASP A 93 13.365 2.626 0.960 1.00 0.00 N ATOM 1413 CA ASP A 93 14.711 2.283 0.619 1.00 0.00 C ATOM 1414 C ASP A 93 15.714 2.782 1.601 1.00 0.00 C ATOM 1415 O ASP A 93 15.828 3.988 1.816 1.00 0.00 O ATOM 1416 CB ASP A 93 14.953 2.774 -0.818 1.00 0.00 C ATOM 1417 CG ASP A 93 16.027 1.869 -1.405 1.00 0.00 C ATOM 1418 OD1 ASP A 93 16.965 1.466 -0.666 1.00 0.00 O ATOM 1419 OD2 ASP A 93 16.088 1.564 -2.626 1.00 0.00 O ATOM 0 H ASP A 93 12.984 3.404 0.421 1.00 0.00 H new ATOM 0 HA ASP A 93 14.845 1.202 0.664 1.00 0.00 H new ATOM 0 HB2 ASP A 93 14.037 2.722 -1.406 1.00 0.00 H new ATOM 0 HB3 ASP A 93 15.276 3.815 -0.824 1.00 0.00 H new ATOM 1424 N LYS A 94 16.436 1.816 2.196 1.00 0.00 N ATOM 1425 CA LYS A 94 17.481 2.068 3.139 1.00 0.00 C ATOM 1426 C LYS A 94 18.812 2.392 2.554 1.00 0.00 C ATOM 1427 O LYS A 94 19.311 3.490 2.796 1.00 0.00 O ATOM 1428 CB LYS A 94 17.530 1.039 4.281 1.00 0.00 C ATOM 1429 CG LYS A 94 16.118 0.949 4.863 1.00 0.00 C ATOM 1430 CD LYS A 94 16.184 0.439 6.304 1.00 0.00 C ATOM 1431 CE LYS A 94 16.234 1.628 7.266 1.00 0.00 C ATOM 1432 NZ LYS A 94 16.187 1.179 8.675 1.00 0.00 N ATOM 0 H LYS A 94 16.287 0.824 2.014 1.00 0.00 H new ATOM 0 HA LYS A 94 17.189 3.010 3.604 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.857 0.067 3.911 1.00 0.00 H new ATOM 0 HB3 LYS A 94 18.244 1.345 5.046 1.00 0.00 H new ATOM 0 HG2 LYS A 94 15.640 1.928 4.835 1.00 0.00 H new ATOM 0 HG3 LYS A 94 15.507 0.279 4.258 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.315 -0.182 6.521 1.00 0.00 H new ATOM 0 HD3 LYS A 94 17.065 -0.188 6.439 1.00 0.00 H new ATOM 0 HE2 LYS A 94 17.146 2.200 7.094 1.00 0.00 H new ATOM 0 HE3 LYS A 94 15.396 2.296 7.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 16.222 2.006 9.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 15.305 0.654 8.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 17.000 0.561 8.870 1.00 0.00 H new ATOM 1446 N ASP A 95 19.310 1.490 1.689 1.00 0.00 N ATOM 1447 CA ASP A 95 20.535 1.515 0.952 1.00 0.00 C ATOM 1448 C ASP A 95 20.594 2.546 -0.122 1.00 0.00 C ATOM 1449 O ASP A 95 21.636 3.065 -0.519 1.00 0.00 O ATOM 1450 CB ASP A 95 20.706 0.100 0.373 1.00 0.00 C ATOM 1451 CG ASP A 95 19.589 -0.264 -0.595 1.00 0.00 C ATOM 1452 OD1 ASP A 95 19.675 0.133 -1.787 1.00 0.00 O ATOM 1453 OD2 ASP A 95 18.611 -0.972 -0.233 1.00 0.00 O ATOM 0 H ASP A 95 18.785 0.640 1.484 1.00 0.00 H new ATOM 0 HA ASP A 95 21.347 1.797 1.622 1.00 0.00 H new ATOM 0 HB2 ASP A 95 21.665 0.033 -0.140 1.00 0.00 H new ATOM 0 HB3 ASP A 95 20.729 -0.624 1.188 1.00 0.00 H new ATOM 1458 N GLY A 96 19.408 2.952 -0.609 1.00 0.00 N ATOM 1459 CA GLY A 96 19.281 4.215 -1.269 1.00 0.00 C ATOM 1460 C GLY A 96 19.531 4.166 -2.737 1.00 0.00 C ATOM 1461 O GLY A 96 19.656 5.140 -3.477 1.00 0.00 O ATOM 0 H GLY A 96 18.545 2.412 -0.547 1.00 0.00 H new ATOM 0 HA2 GLY A 96 18.277 4.603 -1.096 1.00 0.00 H new ATOM 0 HA3 GLY A 96 19.978 4.920 -0.817 1.00 0.00 H new ATOM 1465 N ASN A 97 19.664 2.986 -3.367 1.00 0.00 N ATOM 1466 CA ASN A 97 19.991 2.869 -4.754 1.00 0.00 C ATOM 1467 C ASN A 97 18.892 3.222 -5.696 1.00 0.00 C ATOM 1468 O ASN A 97 19.138 3.429 -6.883 1.00 0.00 O ATOM 1469 CB ASN A 97 20.625 1.484 -4.968 1.00 0.00 C ATOM 1470 CG ASN A 97 19.623 0.343 -5.064 1.00 0.00 C ATOM 1471 OD1 ASN A 97 18.601 0.391 -4.381 1.00 0.00 O ATOM 1472 ND2 ASN A 97 19.919 -0.737 -5.836 1.00 0.00 N ATOM 0 H ASN A 97 19.541 2.088 -2.899 1.00 0.00 H new ATOM 0 HA ASN A 97 20.721 3.635 -5.016 1.00 0.00 H new ATOM 0 HB2 ASN A 97 21.220 1.507 -5.881 1.00 0.00 H new ATOM 0 HB3 ASN A 97 21.311 1.281 -4.146 1.00 0.00 H new ATOM 0 HD21 ASN A 97 19.286 -1.536 -5.859 1.00 0.00 H new ATOM 0 HD22 ASN A 97 20.774 -0.748 -6.392 1.00 0.00 H new ATOM 1479 N GLY A 98 17.656 3.340 -5.180 1.00 0.00 N ATOM 1480 CA GLY A 98 16.613 3.825 -6.031 1.00 0.00 C ATOM 1481 C GLY A 98 15.632 2.732 -6.278 1.00 0.00 C ATOM 1482 O GLY A 98 14.700 2.829 -7.075 1.00 0.00 O ATOM 0 H GLY A 98 17.385 3.113 -4.223 1.00 0.00 H new ATOM 0 HA2 GLY A 98 16.116 4.677 -5.567 1.00 0.00 H new ATOM 0 HA3 GLY A 98 17.031 4.174 -6.975 1.00 0.00 H new ATOM 1486 N TYR A 99 15.699 1.579 -5.588 1.00 0.00 N ATOM 1487 CA TYR A 99 14.928 0.454 -6.016 1.00 0.00 C ATOM 1488 C TYR A 99 14.586 -0.467 -4.896 1.00 0.00 C ATOM 1489 O TYR A 99 15.485 -0.915 -4.185 1.00 0.00 O ATOM 1490 CB TYR A 99 15.717 -0.378 -7.041 1.00 0.00 C ATOM 1491 CG TYR A 99 16.067 0.350 -8.292 1.00 0.00 C ATOM 1492 CD1 TYR A 99 17.276 1.000 -8.369 1.00 0.00 C ATOM 1493 CD2 TYR A 99 15.217 0.080 -9.339 1.00 0.00 C ATOM 1494 CE1 TYR A 99 17.629 1.431 -9.626 1.00 0.00 C ATOM 1495 CE2 TYR A 99 15.633 0.558 -10.559 1.00 0.00 C ATOM 1496 CZ TYR A 99 16.822 1.229 -10.721 1.00 0.00 C ATOM 1497 OH TYR A 99 17.134 1.880 -11.933 1.00 0.00 O ATOM 0 H TYR A 99 16.270 1.427 -4.757 1.00 0.00 H new ATOM 0 HA TYR A 99 14.014 0.867 -6.443 1.00 0.00 H new ATOM 0 HB2 TYR A 99 16.636 -0.731 -6.573 1.00 0.00 H new ATOM 0 HB3 TYR A 99 15.132 -1.260 -7.301 1.00 0.00 H new ATOM 0 HD1 TYR A 99 17.903 1.160 -7.505 1.00 0.00 H new ATOM 0 HD2 TYR A 99 14.294 -0.466 -9.212 1.00 0.00 H new ATOM 0 HE1 TYR A 99 18.570 1.945 -9.758 1.00 0.00 H new ATOM 0 HE2 TYR A 99 15.003 0.401 -11.422 1.00 0.00 H new ATOM 0 HH TYR A 99 16.473 1.637 -12.614 1.00 0.00 H new ATOM 1507 N ILE A 100 13.305 -0.820 -4.691 1.00 0.00 N ATOM 1508 CA ILE A 100 12.860 -1.687 -3.645 1.00 0.00 C ATOM 1509 C ILE A 100 13.065 -3.084 -4.122 1.00 0.00 C ATOM 1510 O ILE A 100 12.240 -3.454 -4.956 1.00 0.00 O ATOM 1511 CB ILE A 100 11.413 -1.535 -3.279 1.00 0.00 C ATOM 1512 CG1 ILE A 100 11.068 -0.100 -2.850 1.00 0.00 C ATOM 1513 CG2 ILE A 100 11.189 -2.460 -2.071 1.00 0.00 C ATOM 1514 CD1 ILE A 100 9.583 0.048 -2.520 1.00 0.00 C ATOM 0 H ILE A 100 12.544 -0.485 -5.282 1.00 0.00 H new ATOM 0 HA ILE A 100 13.430 -1.433 -2.752 1.00 0.00 H new ATOM 0 HB ILE A 100 10.790 -1.777 -4.140 1.00 0.00 H new ATOM 0 HG12 ILE A 100 11.664 0.173 -1.979 1.00 0.00 H new ATOM 0 HG13 ILE A 100 11.335 0.593 -3.648 1.00 0.00 H new ATOM 0 HG21 ILE A 100 10.149 -2.397 -1.752 1.00 0.00 H new ATOM 0 HG22 ILE A 100 11.421 -3.487 -2.352 1.00 0.00 H new ATOM 0 HG23 ILE A 100 11.839 -2.152 -1.252 1.00 0.00 H new ATOM 0 HD11 ILE A 100 9.377 1.076 -2.221 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.988 -0.200 -3.399 1.00 0.00 H new ATOM 0 HD13 ILE A 100 9.323 -0.626 -1.704 1.00 0.00 H new ATOM 1526 N SER A 101 14.111 -3.863 -3.793 1.00 0.00 N ATOM 1527 CA SER A 101 14.412 -5.195 -4.219 1.00 0.00 C ATOM 1528 C SER A 101 13.374 -5.980 -3.494 1.00 0.00 C ATOM 1529 O SER A 101 12.956 -5.650 -2.385 1.00 0.00 O ATOM 1530 CB SER A 101 15.875 -5.551 -3.905 1.00 0.00 C ATOM 1531 OG SER A 101 16.197 -5.421 -2.528 1.00 0.00 O ATOM 0 H SER A 101 14.826 -3.516 -3.154 1.00 0.00 H new ATOM 0 HA SER A 101 14.364 -5.382 -5.292 1.00 0.00 H new ATOM 0 HB2 SER A 101 16.069 -6.576 -4.222 1.00 0.00 H new ATOM 0 HB3 SER A 101 16.533 -4.906 -4.488 1.00 0.00 H new ATOM 0 HG SER A 101 16.243 -4.471 -2.291 1.00 0.00 H new ATOM 1537 N ALA A 102 12.992 -7.133 -4.072 1.00 0.00 N ATOM 1538 CA ALA A 102 12.211 -8.168 -3.467 1.00 0.00 C ATOM 1539 C ALA A 102 12.619 -8.479 -2.068 1.00 0.00 C ATOM 1540 O ALA A 102 11.658 -8.781 -1.362 1.00 0.00 O ATOM 1541 CB ALA A 102 12.291 -9.447 -4.317 1.00 0.00 C ATOM 0 H ALA A 102 13.249 -7.357 -5.033 1.00 0.00 H new ATOM 0 HA ALA A 102 11.187 -7.796 -3.424 1.00 0.00 H new ATOM 0 HB1 ALA A 102 11.694 -10.231 -3.851 1.00 0.00 H new ATOM 0 HB2 ALA A 102 11.907 -9.244 -5.317 1.00 0.00 H new ATOM 0 HB3 ALA A 102 13.329 -9.773 -4.386 1.00 0.00 H new ATOM 1547 N ALA A 103 13.890 -8.375 -1.640 1.00 0.00 N ATOM 1548 CA ALA A 103 14.318 -8.506 -0.281 1.00 0.00 C ATOM 1549 C ALA A 103 13.931 -7.420 0.663 1.00 0.00 C ATOM 1550 O ALA A 103 13.461 -7.713 1.762 1.00 0.00 O ATOM 1551 CB ALA A 103 15.850 -8.628 -0.230 1.00 0.00 C ATOM 0 H ALA A 103 14.663 -8.189 -2.279 1.00 0.00 H new ATOM 0 HA ALA A 103 13.792 -9.398 0.060 1.00 0.00 H new ATOM 0 HB1 ALA A 103 16.173 -8.728 0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 103 16.164 -9.506 -0.794 1.00 0.00 H new ATOM 0 HB3 ALA A 103 16.301 -7.737 -0.666 1.00 0.00 H new ATOM 1557 N GLU A 104 14.004 -6.155 0.214 1.00 0.00 N ATOM 1558 CA GLU A 104 13.516 -5.071 1.009 1.00 0.00 C ATOM 1559 C GLU A 104 12.028 -5.107 1.054 1.00 0.00 C ATOM 1560 O GLU A 104 11.494 -4.871 2.136 1.00 0.00 O ATOM 1561 CB GLU A 104 13.829 -3.682 0.427 1.00 0.00 C ATOM 1562 CG GLU A 104 15.329 -3.492 0.187 1.00 0.00 C ATOM 1563 CD GLU A 104 15.630 -2.385 -0.812 1.00 0.00 C ATOM 1564 OE1 GLU A 104 15.653 -1.167 -0.487 1.00 0.00 O ATOM 1565 OE2 GLU A 104 16.005 -2.682 -1.978 1.00 0.00 O ATOM 0 H GLU A 104 14.396 -5.884 -0.688 1.00 0.00 H new ATOM 0 HA GLU A 104 14.002 -5.200 1.976 1.00 0.00 H new ATOM 0 HB2 GLU A 104 13.291 -3.552 -0.512 1.00 0.00 H new ATOM 0 HB3 GLU A 104 13.470 -2.912 1.110 1.00 0.00 H new ATOM 0 HG2 GLU A 104 15.818 -3.263 1.134 1.00 0.00 H new ATOM 0 HG3 GLU A 104 15.756 -4.427 -0.174 1.00 0.00 H new ATOM 1572 N LEU A 105 11.335 -5.459 -0.044 1.00 0.00 N ATOM 1573 CA LEU A 105 9.908 -5.534 -0.105 1.00 0.00 C ATOM 1574 C LEU A 105 9.192 -6.459 0.818 1.00 0.00 C ATOM 1575 O LEU A 105 8.029 -6.379 1.209 1.00 0.00 O ATOM 1576 CB LEU A 105 9.488 -5.771 -1.565 1.00 0.00 C ATOM 1577 CG LEU A 105 8.083 -5.324 -2.001 1.00 0.00 C ATOM 1578 CD1 LEU A 105 8.133 -5.053 -3.514 1.00 0.00 C ATOM 1579 CD2 LEU A 105 6.957 -6.338 -1.736 1.00 0.00 C ATOM 0 H LEU A 105 11.788 -5.701 -0.925 1.00 0.00 H new ATOM 0 HA LEU A 105 9.582 -4.568 0.279 1.00 0.00 H new ATOM 0 HB2 LEU A 105 10.211 -5.266 -2.205 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.575 -6.839 -1.767 1.00 0.00 H new ATOM 0 HG LEU A 105 7.840 -4.446 -1.402 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.150 -4.733 -3.859 1.00 0.00 H new ATOM 0 HD12 LEU A 105 8.863 -4.270 -3.719 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.422 -5.964 -4.038 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.008 -5.926 -2.080 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.167 -7.263 -2.273 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.897 -6.544 -0.667 1.00 0.00 H new ATOM 1591 N ARG A 106 9.847 -7.532 1.298 1.00 0.00 N ATOM 1592 CA ARG A 106 9.277 -8.415 2.267 1.00 0.00 C ATOM 1593 C ARG A 106 9.314 -7.813 3.629 1.00 0.00 C ATOM 1594 O ARG A 106 8.336 -7.571 4.336 1.00 0.00 O ATOM 1595 CB ARG A 106 9.996 -9.760 2.468 1.00 0.00 C ATOM 1596 CG ARG A 106 10.645 -10.287 1.186 1.00 0.00 C ATOM 1597 CD ARG A 106 11.413 -11.552 1.571 1.00 0.00 C ATOM 1598 NE ARG A 106 10.523 -12.747 1.598 1.00 0.00 N ATOM 1599 CZ ARG A 106 9.777 -13.272 0.582 1.00 0.00 C ATOM 1600 NH1 ARG A 106 10.132 -12.992 -0.706 1.00 0.00 N ATOM 1601 NH2 ARG A 106 8.683 -14.054 0.812 1.00 0.00 N ATOM 0 H ARG A 106 10.790 -7.791 1.007 1.00 0.00 H new ATOM 0 HA ARG A 106 8.281 -8.580 1.856 1.00 0.00 H new ATOM 0 HB2 ARG A 106 10.761 -9.646 3.236 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.282 -10.496 2.837 1.00 0.00 H new ATOM 0 HG2 ARG A 106 9.889 -10.507 0.432 1.00 0.00 H new ATOM 0 HG3 ARG A 106 11.316 -9.542 0.757 1.00 0.00 H new ATOM 0 HD2 ARG A 106 12.223 -11.717 0.861 1.00 0.00 H new ATOM 0 HD3 ARG A 106 11.871 -11.416 2.551 1.00 0.00 H new ATOM 0 HE ARG A 106 10.463 -13.236 2.491 1.00 0.00 H new ATOM 0 HH11 ARG A 106 10.941 -12.401 -0.895 1.00 0.00 H new ATOM 0 HH12 ARG A 106 9.588 -13.374 -1.480 1.00 0.00 H new ATOM 0 HH21 ARG A 106 8.398 -14.264 1.769 1.00 0.00 H new ATOM 0 HH22 ARG A 106 8.150 -14.429 0.027 1.00 0.00 H new ATOM 1615 N HIS A 107 10.497 -7.325 4.042 1.00 0.00 N ATOM 1616 CA HIS A 107 10.713 -6.633 5.274 1.00 0.00 C ATOM 1617 C HIS A 107 9.903 -5.393 5.438 1.00 0.00 C ATOM 1618 O HIS A 107 9.349 -5.127 6.503 1.00 0.00 O ATOM 1619 CB HIS A 107 12.210 -6.384 5.525 1.00 0.00 C ATOM 1620 CG HIS A 107 12.594 -5.840 6.869 1.00 0.00 C ATOM 1621 ND1 HIS A 107 12.426 -6.628 7.989 1.00 0.00 N ATOM 1622 CD2 HIS A 107 12.773 -4.568 7.317 1.00 0.00 C ATOM 1623 CE1 HIS A 107 12.610 -5.800 9.052 1.00 0.00 C ATOM 1624 NE2 HIS A 107 12.806 -4.545 8.696 1.00 0.00 N ATOM 0 H HIS A 107 11.347 -7.418 3.487 1.00 0.00 H new ATOM 0 HA HIS A 107 10.346 -7.305 6.050 1.00 0.00 H new ATOM 0 HB2 HIS A 107 12.739 -7.325 5.377 1.00 0.00 H new ATOM 0 HB3 HIS A 107 12.571 -5.692 4.764 1.00 0.00 H new ATOM 0 HD2 HIS A 107 12.875 -3.700 6.683 1.00 0.00 H new ATOM 0 HE1 HIS A 107 12.597 -6.134 10.079 1.00 0.00 H new ATOM 0 HE2 HIS A 107 12.950 -3.739 9.304 1.00 0.00 H new ATOM 1632 N VAL A 108 9.754 -4.588 4.371 1.00 0.00 N ATOM 1633 CA VAL A 108 9.025 -3.358 4.386 1.00 0.00 C ATOM 1634 C VAL A 108 7.553 -3.535 4.533 1.00 0.00 C ATOM 1635 O VAL A 108 7.041 -2.908 5.458 1.00 0.00 O ATOM 1636 CB VAL A 108 9.463 -2.413 3.306 1.00 0.00 C ATOM 1637 CG1 VAL A 108 8.598 -1.143 3.236 1.00 0.00 C ATOM 1638 CG2 VAL A 108 10.960 -2.078 3.413 1.00 0.00 C ATOM 0 H VAL A 108 10.158 -4.803 3.460 1.00 0.00 H new ATOM 0 HA VAL A 108 9.297 -2.847 5.310 1.00 0.00 H new ATOM 0 HB VAL A 108 9.312 -2.938 2.363 1.00 0.00 H new ATOM 0 HG11 VAL A 108 8.963 -0.498 2.437 1.00 0.00 H new ATOM 0 HG12 VAL A 108 7.563 -1.419 3.036 1.00 0.00 H new ATOM 0 HG13 VAL A 108 8.655 -0.611 4.186 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.237 -1.391 2.613 1.00 0.00 H new ATOM 0 HG22 VAL A 108 11.160 -1.612 4.378 1.00 0.00 H new ATOM 0 HG23 VAL A 108 11.545 -2.993 3.324 1.00 0.00 H new ATOM 1648 N MET A 109 6.883 -4.362 3.710 1.00 0.00 N ATOM 1649 CA MET A 109 5.483 -4.634 3.608 1.00 0.00 C ATOM 1650 C MET A 109 4.997 -5.567 4.663 1.00 0.00 C ATOM 1651 O MET A 109 3.810 -5.537 4.984 1.00 0.00 O ATOM 1652 CB MET A 109 5.005 -4.975 2.186 1.00 0.00 C ATOM 1653 CG MET A 109 5.004 -3.824 1.178 1.00 0.00 C ATOM 1654 SD MET A 109 6.584 -2.975 0.883 1.00 0.00 S ATOM 1655 CE MET A 109 5.760 -1.502 0.213 1.00 0.00 C ATOM 0 H MET A 109 7.400 -4.913 3.024 1.00 0.00 H new ATOM 0 HA MET A 109 4.989 -3.685 3.817 1.00 0.00 H new ATOM 0 HB2 MET A 109 5.637 -5.772 1.795 1.00 0.00 H new ATOM 0 HB3 MET A 109 3.993 -5.374 2.252 1.00 0.00 H new ATOM 0 HG2 MET A 109 4.645 -4.211 0.224 1.00 0.00 H new ATOM 0 HG3 MET A 109 4.280 -3.082 1.514 1.00 0.00 H new ATOM 0 HE1 MET A 109 6.510 -0.785 -0.121 1.00 0.00 H new ATOM 0 HE2 MET A 109 5.132 -1.789 -0.630 1.00 0.00 H new ATOM 0 HE3 MET A 109 5.142 -1.047 0.987 1.00 0.00 H new ATOM 1665 N THR A 110 5.902 -6.412 5.187 1.00 0.00 N ATOM 1666 CA THR A 110 5.637 -7.097 6.414 1.00 0.00 C ATOM 1667 C THR A 110 5.448 -6.160 7.557 1.00 0.00 C ATOM 1668 O THR A 110 4.460 -6.303 8.276 1.00 0.00 O ATOM 1669 CB THR A 110 6.681 -8.113 6.774 1.00 0.00 C ATOM 1670 OG1 THR A 110 6.695 -9.149 5.802 1.00 0.00 O ATOM 1671 CG2 THR A 110 6.248 -8.825 8.067 1.00 0.00 C ATOM 0 H THR A 110 6.808 -6.620 4.767 1.00 0.00 H new ATOM 0 HA THR A 110 4.704 -7.630 6.230 1.00 0.00 H new ATOM 0 HB THR A 110 7.640 -7.602 6.857 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.258 -8.881 5.046 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.997 -9.567 8.342 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.150 -8.094 8.870 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.290 -9.319 7.907 1.00 0.00 H new ATOM 1679 N ASN A 111 6.381 -5.203 7.710 1.00 0.00 N ATOM 1680 CA ASN A 111 6.426 -4.560 8.987 1.00 0.00 C ATOM 1681 C ASN A 111 5.802 -3.216 8.837 1.00 0.00 C ATOM 1682 O ASN A 111 6.174 -2.210 9.439 1.00 0.00 O ATOM 1683 CB ASN A 111 7.852 -4.443 9.550 1.00 0.00 C ATOM 1684 CG ASN A 111 8.375 -5.824 9.918 1.00 0.00 C ATOM 1685 OD1 ASN A 111 8.102 -6.475 10.926 1.00 0.00 O ATOM 1686 ND2 ASN A 111 9.102 -6.468 8.966 1.00 0.00 N ATOM 0 H ASN A 111 7.056 -4.892 7.011 1.00 0.00 H new ATOM 0 HA ASN A 111 5.878 -5.168 9.707 1.00 0.00 H new ATOM 0 HB2 ASN A 111 8.507 -3.980 8.812 1.00 0.00 H new ATOM 0 HB3 ASN A 111 7.854 -3.797 10.428 1.00 0.00 H new ATOM 0 HD21 ASN A 111 9.389 -7.436 9.111 1.00 0.00 H new ATOM 0 HD22 ASN A 111 9.361 -5.983 8.107 1.00 0.00 H new ATOM 1693 N LEU A 112 4.691 -3.066 8.093 1.00 0.00 N ATOM 1694 CA LEU A 112 3.883 -1.917 7.823 1.00 0.00 C ATOM 1695 C LEU A 112 2.651 -1.841 8.657 1.00 0.00 C ATOM 1696 O LEU A 112 2.374 -0.867 9.354 1.00 0.00 O ATOM 1697 CB LEU A 112 3.671 -1.608 6.331 1.00 0.00 C ATOM 1698 CG LEU A 112 3.544 -0.103 6.039 1.00 0.00 C ATOM 1699 CD1 LEU A 112 3.853 0.228 4.569 1.00 0.00 C ATOM 1700 CD2 LEU A 112 2.164 0.489 6.373 1.00 0.00 C ATOM 0 H LEU A 112 4.307 -3.879 7.611 1.00 0.00 H new ATOM 0 HA LEU A 112 4.492 -1.078 8.160 1.00 0.00 H new ATOM 0 HB2 LEU A 112 4.506 -2.014 5.760 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.771 -2.116 5.985 1.00 0.00 H new ATOM 0 HG LEU A 112 4.282 0.352 6.699 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.751 1.301 4.409 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.872 -0.079 4.333 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.155 -0.304 3.922 1.00 0.00 H new ATOM 0 HD21 LEU A 112 2.158 1.553 6.138 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.399 -0.017 5.784 1.00 0.00 H new ATOM 0 HD23 LEU A 112 1.956 0.350 7.434 1.00 0.00 H new ATOM 1712 N GLY A 113 1.741 -2.832 8.656 1.00 0.00 N ATOM 1713 CA GLY A 113 0.518 -2.707 9.387 1.00 0.00 C ATOM 1714 C GLY A 113 -0.200 -4.010 9.309 1.00 0.00 C ATOM 1715 O GLY A 113 -0.104 -4.819 10.231 1.00 0.00 O ATOM 0 H GLY A 113 1.850 -3.713 8.153 1.00 0.00 H new ATOM 0 HA2 GLY A 113 0.720 -2.445 10.426 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -0.095 -1.908 8.970 1.00 0.00 H new ATOM 1719 N GLU A 114 -1.005 -4.262 8.262 1.00 0.00 N ATOM 1720 CA GLU A 114 -1.673 -5.509 8.053 1.00 0.00 C ATOM 1721 C GLU A 114 -0.780 -6.662 7.748 1.00 0.00 C ATOM 1722 O GLU A 114 0.250 -6.499 7.094 1.00 0.00 O ATOM 1723 CB GLU A 114 -2.817 -5.449 7.028 1.00 0.00 C ATOM 1724 CG GLU A 114 -3.882 -4.444 7.471 1.00 0.00 C ATOM 1725 CD GLU A 114 -4.352 -4.817 8.870 1.00 0.00 C ATOM 1726 OE1 GLU A 114 -4.764 -5.961 9.200 1.00 0.00 O ATOM 1727 OE2 GLU A 114 -4.206 -3.904 9.726 1.00 0.00 O ATOM 0 H GLU A 114 -1.198 -3.573 7.535 1.00 0.00 H new ATOM 0 HA GLU A 114 -2.109 -5.695 9.035 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -2.424 -5.165 6.052 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -3.265 -6.436 6.916 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -3.473 -3.434 7.466 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -4.721 -4.452 6.776 1.00 0.00 H new ATOM 1734 N LYS A 115 -1.044 -7.861 8.298 1.00 0.00 N ATOM 1735 CA LYS A 115 -0.058 -8.897 8.307 1.00 0.00 C ATOM 1736 C LYS A 115 -0.056 -9.625 7.007 1.00 0.00 C ATOM 1737 O LYS A 115 -1.122 -10.120 6.644 1.00 0.00 O ATOM 1738 CB LYS A 115 -0.406 -9.903 9.417 1.00 0.00 C ATOM 1739 CG LYS A 115 -0.252 -9.307 10.818 1.00 0.00 C ATOM 1740 CD LYS A 115 -0.678 -10.255 11.941 1.00 0.00 C ATOM 1741 CE LYS A 115 -2.181 -10.427 12.166 1.00 0.00 C ATOM 1742 NZ LYS A 115 -2.863 -9.125 12.348 1.00 0.00 N ATOM 0 H LYS A 115 -1.932 -8.112 8.733 1.00 0.00 H new ATOM 0 HA LYS A 115 0.921 -8.449 8.475 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -1.432 -10.247 9.283 1.00 0.00 H new ATOM 0 HB3 LYS A 115 0.238 -10.778 9.325 1.00 0.00 H new ATOM 0 HG2 LYS A 115 0.789 -9.023 10.970 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -0.844 -8.394 10.882 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.251 -11.237 11.737 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.234 -9.901 12.871 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -2.618 -10.950 11.316 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -2.348 -11.051 13.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -3.818 -9.283 12.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.319 -8.538 13.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.932 -8.638 11.432 1.00 0.00 H new ATOM 1756 N LEU A 116 1.061 -9.731 6.265 1.00 0.00 N ATOM 1757 CA LEU A 116 1.124 -10.464 5.039 1.00 0.00 C ATOM 1758 C LEU A 116 1.902 -11.718 5.240 1.00 0.00 C ATOM 1759 O LEU A 116 2.796 -11.735 6.085 1.00 0.00 O ATOM 1760 CB LEU A 116 1.879 -9.643 3.980 1.00 0.00 C ATOM 1761 CG LEU A 116 1.484 -8.157 3.955 1.00 0.00 C ATOM 1762 CD1 LEU A 116 2.283 -7.454 2.845 1.00 0.00 C ATOM 1763 CD2 LEU A 116 -0.001 -7.833 3.716 1.00 0.00 C ATOM 0 H LEU A 116 1.945 -9.294 6.525 1.00 0.00 H new ATOM 0 HA LEU A 116 0.104 -10.679 4.719 1.00 0.00 H new ATOM 0 HB2 LEU A 116 2.950 -9.722 4.167 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.694 -10.076 2.997 1.00 0.00 H new ATOM 0 HG LEU A 116 1.705 -7.807 4.963 1.00 0.00 H new ATOM 0 HD11 LEU A 116 2.013 -6.398 2.815 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.350 -7.550 3.048 1.00 0.00 H new ATOM 0 HD13 LEU A 116 2.053 -7.914 1.884 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -0.143 -6.752 3.722 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.310 -8.234 2.751 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -0.603 -8.283 4.506 1.00 0.00 H new ATOM 1775 N THR A 117 1.717 -12.740 4.385 1.00 0.00 N ATOM 1776 CA THR A 117 2.587 -13.875 4.353 1.00 0.00 C ATOM 1777 C THR A 117 3.679 -13.595 3.379 1.00 0.00 C ATOM 1778 O THR A 117 3.708 -12.626 2.622 1.00 0.00 O ATOM 1779 CB THR A 117 1.752 -15.104 4.147 1.00 0.00 C ATOM 1780 OG1 THR A 117 1.145 -15.035 2.866 1.00 0.00 O ATOM 1781 CG2 THR A 117 0.631 -15.316 5.178 1.00 0.00 C ATOM 0 H THR A 117 0.955 -12.780 3.708 1.00 0.00 H new ATOM 0 HA THR A 117 3.112 -14.072 5.288 1.00 0.00 H new ATOM 0 HB THR A 117 2.441 -15.942 4.256 1.00 0.00 H new ATOM 0 HG1 THR A 117 0.598 -15.835 2.720 1.00 0.00 H new ATOM 0 HG21 THR A 117 0.087 -16.230 4.941 1.00 0.00 H new ATOM 0 HG22 THR A 117 1.064 -15.400 6.175 1.00 0.00 H new ATOM 0 HG23 THR A 117 -0.054 -14.468 5.150 1.00 0.00 H new ATOM 1789 N ASP A 118 4.732 -14.423 3.501 1.00 0.00 N ATOM 1790 CA ASP A 118 5.629 -14.616 2.404 1.00 0.00 C ATOM 1791 C ASP A 118 4.970 -14.893 1.097 1.00 0.00 C ATOM 1792 O ASP A 118 5.418 -14.449 0.041 1.00 0.00 O ATOM 1793 CB ASP A 118 6.659 -15.697 2.772 1.00 0.00 C ATOM 1794 CG ASP A 118 7.631 -15.133 3.799 1.00 0.00 C ATOM 1795 OD1 ASP A 118 8.513 -14.293 3.476 1.00 0.00 O ATOM 1796 OD2 ASP A 118 7.436 -15.467 4.998 1.00 0.00 O ATOM 0 H ASP A 118 4.960 -14.951 4.344 1.00 0.00 H new ATOM 0 HA ASP A 118 6.134 -13.664 2.241 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.154 -16.575 3.175 1.00 0.00 H new ATOM 0 HB3 ASP A 118 7.199 -16.020 1.882 1.00 0.00 H new ATOM 1801 N GLU A 119 3.856 -15.645 1.042 1.00 0.00 N ATOM 1802 CA GLU A 119 3.137 -15.870 -0.173 1.00 0.00 C ATOM 1803 C GLU A 119 2.264 -14.750 -0.625 1.00 0.00 C ATOM 1804 O GLU A 119 2.237 -14.504 -1.830 1.00 0.00 O ATOM 1805 CB GLU A 119 2.238 -17.109 -0.020 1.00 0.00 C ATOM 1806 CG GLU A 119 1.855 -17.802 -1.329 1.00 0.00 C ATOM 1807 CD GLU A 119 2.952 -18.410 -2.192 1.00 0.00 C ATOM 1808 OE1 GLU A 119 4.169 -18.243 -1.912 1.00 0.00 O ATOM 1809 OE2 GLU A 119 2.559 -19.066 -3.193 1.00 0.00 O ATOM 0 H GLU A 119 3.448 -16.105 1.856 1.00 0.00 H new ATOM 0 HA GLU A 119 3.915 -15.991 -0.927 1.00 0.00 H new ATOM 0 HB2 GLU A 119 2.747 -17.831 0.619 1.00 0.00 H new ATOM 0 HB3 GLU A 119 1.325 -16.814 0.497 1.00 0.00 H new ATOM 0 HG2 GLU A 119 1.149 -18.596 -1.086 1.00 0.00 H new ATOM 0 HG3 GLU A 119 1.320 -17.076 -1.941 1.00 0.00 H new ATOM 1816 N GLU A 120 1.719 -13.969 0.324 1.00 0.00 N ATOM 1817 CA GLU A 120 1.244 -12.654 0.023 1.00 0.00 C ATOM 1818 C GLU A 120 2.282 -11.780 -0.591 1.00 0.00 C ATOM 1819 O GLU A 120 1.905 -11.041 -1.499 1.00 0.00 O ATOM 1820 CB GLU A 120 0.447 -12.014 1.173 1.00 0.00 C ATOM 1821 CG GLU A 120 -0.570 -10.943 0.776 1.00 0.00 C ATOM 1822 CD GLU A 120 -1.583 -10.668 1.879 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -1.383 -11.245 2.981 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -2.549 -9.872 1.735 1.00 0.00 O ATOM 0 H GLU A 120 1.607 -14.247 1.299 1.00 0.00 H new ATOM 0 HA GLU A 120 0.503 -12.775 -0.768 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.080 -12.805 1.707 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.154 -11.572 1.875 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -0.045 -10.020 0.530 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.095 -11.260 -0.125 1.00 0.00 H new ATOM 1831 N VAL A 121 3.526 -11.763 -0.078 1.00 0.00 N ATOM 1832 CA VAL A 121 4.566 -10.905 -0.554 1.00 0.00 C ATOM 1833 C VAL A 121 4.933 -11.297 -1.944 1.00 0.00 C ATOM 1834 O VAL A 121 4.855 -10.431 -2.814 1.00 0.00 O ATOM 1835 CB VAL A 121 5.716 -11.009 0.403 1.00 0.00 C ATOM 1836 CG1 VAL A 121 7.020 -10.428 -0.169 1.00 0.00 C ATOM 1837 CG2 VAL A 121 5.355 -10.247 1.689 1.00 0.00 C ATOM 0 H VAL A 121 3.817 -12.365 0.692 1.00 0.00 H new ATOM 0 HA VAL A 121 4.247 -9.864 -0.597 1.00 0.00 H new ATOM 0 HB VAL A 121 5.889 -12.067 0.598 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.818 -10.531 0.567 1.00 0.00 H new ATOM 0 HG12 VAL A 121 7.292 -10.968 -1.076 1.00 0.00 H new ATOM 0 HG13 VAL A 121 6.876 -9.373 -0.404 1.00 0.00 H new ATOM 0 HG21 VAL A 121 6.182 -10.313 2.396 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.165 -9.201 1.451 1.00 0.00 H new ATOM 0 HG23 VAL A 121 4.462 -10.686 2.134 1.00 0.00 H new ATOM 1847 N ASP A 122 5.327 -12.559 -2.190 1.00 0.00 N ATOM 1848 CA ASP A 122 5.810 -13.012 -3.458 1.00 0.00 C ATOM 1849 C ASP A 122 4.839 -12.993 -4.588 1.00 0.00 C ATOM 1850 O ASP A 122 5.203 -12.503 -5.657 1.00 0.00 O ATOM 1851 CB ASP A 122 6.350 -14.450 -3.380 1.00 0.00 C ATOM 1852 CG ASP A 122 7.783 -14.387 -2.872 1.00 0.00 C ATOM 1853 OD1 ASP A 122 8.664 -13.964 -3.668 1.00 0.00 O ATOM 1854 OD2 ASP A 122 8.017 -14.734 -1.684 1.00 0.00 O ATOM 0 H ASP A 122 5.309 -13.291 -1.480 1.00 0.00 H new ATOM 0 HA ASP A 122 6.585 -12.277 -3.675 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.735 -15.052 -2.712 1.00 0.00 H new ATOM 0 HB3 ASP A 122 6.314 -14.924 -4.361 1.00 0.00 H new ATOM 1859 N GLU A 123 3.578 -13.410 -4.378 1.00 0.00 N ATOM 1860 CA GLU A 123 2.478 -13.195 -5.267 1.00 0.00 C ATOM 1861 C GLU A 123 2.215 -11.745 -5.489 1.00 0.00 C ATOM 1862 O GLU A 123 1.889 -11.320 -6.596 1.00 0.00 O ATOM 1863 CB GLU A 123 1.183 -13.951 -4.926 1.00 0.00 C ATOM 1864 CG GLU A 123 1.420 -15.457 -4.800 1.00 0.00 C ATOM 1865 CD GLU A 123 0.095 -16.192 -4.950 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -0.783 -16.093 -4.052 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -0.068 -17.045 -5.863 1.00 0.00 O ATOM 0 H GLU A 123 3.311 -13.927 -3.540 1.00 0.00 H new ATOM 0 HA GLU A 123 2.815 -13.641 -6.203 1.00 0.00 H new ATOM 0 HB2 GLU A 123 0.774 -13.568 -3.991 1.00 0.00 H new ATOM 0 HB3 GLU A 123 0.438 -13.764 -5.700 1.00 0.00 H new ATOM 0 HG2 GLU A 123 2.122 -15.791 -5.564 1.00 0.00 H new ATOM 0 HG3 GLU A 123 1.868 -15.686 -3.833 1.00 0.00 H new ATOM 1874 N MET A 124 2.406 -10.845 -4.508 1.00 0.00 N ATOM 1875 CA MET A 124 2.366 -9.477 -4.922 1.00 0.00 C ATOM 1876 C MET A 124 3.453 -9.052 -5.848 1.00 0.00 C ATOM 1877 O MET A 124 3.168 -8.641 -6.971 1.00 0.00 O ATOM 1878 CB MET A 124 2.368 -8.467 -3.762 1.00 0.00 C ATOM 1879 CG MET A 124 2.410 -6.959 -4.023 1.00 0.00 C ATOM 1880 SD MET A 124 1.903 -6.071 -2.520 1.00 0.00 S ATOM 1881 CE MET A 124 2.928 -6.710 -1.164 1.00 0.00 C ATOM 0 H MET A 124 2.573 -11.034 -3.520 1.00 0.00 H new ATOM 0 HA MET A 124 1.414 -9.458 -5.452 1.00 0.00 H new ATOM 0 HB2 MET A 124 1.475 -8.662 -3.168 1.00 0.00 H new ATOM 0 HB3 MET A 124 3.227 -8.705 -3.134 1.00 0.00 H new ATOM 0 HG2 MET A 124 3.416 -6.657 -4.315 1.00 0.00 H new ATOM 0 HG3 MET A 124 1.748 -6.703 -4.850 1.00 0.00 H new ATOM 0 HE1 MET A 124 2.943 -5.988 -0.348 1.00 0.00 H new ATOM 0 HE2 MET A 124 2.513 -7.652 -0.807 1.00 0.00 H new ATOM 0 HE3 MET A 124 3.944 -6.874 -1.522 1.00 0.00 H new ATOM 1891 N ILE A 125 4.721 -9.274 -5.456 1.00 0.00 N ATOM 1892 CA ILE A 125 5.916 -8.961 -6.175 1.00 0.00 C ATOM 1893 C ILE A 125 5.885 -9.457 -7.580 1.00 0.00 C ATOM 1894 O ILE A 125 6.134 -8.745 -8.552 1.00 0.00 O ATOM 1895 CB ILE A 125 7.148 -9.489 -5.501 1.00 0.00 C ATOM 1896 CG1 ILE A 125 7.391 -8.980 -4.070 1.00 0.00 C ATOM 1897 CG2 ILE A 125 8.448 -9.177 -6.261 1.00 0.00 C ATOM 1898 CD1 ILE A 125 8.472 -9.631 -3.208 1.00 0.00 C ATOM 0 H ILE A 125 4.925 -9.711 -4.557 1.00 0.00 H new ATOM 0 HA ILE A 125 5.959 -7.872 -6.186 1.00 0.00 H new ATOM 0 HB ILE A 125 6.928 -10.557 -5.485 1.00 0.00 H new ATOM 0 HG12 ILE A 125 7.625 -7.917 -4.138 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.448 -9.065 -3.530 1.00 0.00 H new ATOM 0 HG21 ILE A 125 9.297 -9.589 -5.715 1.00 0.00 H new ATOM 0 HG22 ILE A 125 8.405 -9.623 -7.255 1.00 0.00 H new ATOM 0 HG23 ILE A 125 8.565 -8.097 -6.353 1.00 0.00 H new ATOM 0 HD11 ILE A 125 8.502 -9.145 -2.233 1.00 0.00 H new ATOM 0 HD12 ILE A 125 8.246 -10.689 -3.079 1.00 0.00 H new ATOM 0 HD13 ILE A 125 9.440 -9.524 -3.696 1.00 0.00 H new ATOM 1910 N ARG A 126 5.549 -10.747 -7.758 1.00 0.00 N ATOM 1911 CA ARG A 126 5.398 -11.413 -9.015 1.00 0.00 C ATOM 1912 C ARG A 126 4.538 -10.659 -9.970 1.00 0.00 C ATOM 1913 O ARG A 126 4.785 -10.615 -11.174 1.00 0.00 O ATOM 1914 CB ARG A 126 4.862 -12.823 -8.716 1.00 0.00 C ATOM 1915 CG ARG A 126 5.000 -13.734 -9.938 1.00 0.00 C ATOM 1916 CD ARG A 126 4.841 -15.225 -9.636 1.00 0.00 C ATOM 1917 NE ARG A 126 3.402 -15.387 -9.288 1.00 0.00 N ATOM 1918 CZ ARG A 126 2.906 -16.263 -8.366 1.00 0.00 C ATOM 1919 NH1 ARG A 126 3.653 -16.814 -7.365 1.00 0.00 N ATOM 1920 NH2 ARG A 126 1.574 -16.534 -8.246 1.00 0.00 N ATOM 0 H ARG A 126 5.371 -11.367 -6.968 1.00 0.00 H new ATOM 0 HA ARG A 126 6.361 -11.477 -9.522 1.00 0.00 H new ATOM 0 HB2 ARG A 126 5.407 -13.252 -7.875 1.00 0.00 H new ATOM 0 HB3 ARG A 126 3.815 -12.762 -8.420 1.00 0.00 H new ATOM 0 HG2 ARG A 126 4.254 -13.444 -10.678 1.00 0.00 H new ATOM 0 HG3 ARG A 126 5.978 -13.570 -10.390 1.00 0.00 H new ATOM 0 HD2 ARG A 126 5.111 -15.835 -10.498 1.00 0.00 H new ATOM 0 HD3 ARG A 126 5.485 -15.533 -8.813 1.00 0.00 H new ATOM 0 HE ARG A 126 2.732 -14.795 -9.779 1.00 0.00 H new ATOM 0 HH11 ARG A 126 4.641 -16.576 -7.276 1.00 0.00 H new ATOM 0 HH12 ARG A 126 3.223 -17.463 -6.706 1.00 0.00 H new ATOM 0 HH21 ARG A 126 0.903 -16.074 -8.861 1.00 0.00 H new ATOM 0 HH22 ARG A 126 1.250 -17.197 -7.542 1.00 0.00 H new ATOM 1934 N GLU A 127 3.499 -9.944 -9.502 1.00 0.00 N ATOM 1935 CA GLU A 127 2.619 -9.120 -10.271 1.00 0.00 C ATOM 1936 C GLU A 127 3.202 -7.764 -10.474 1.00 0.00 C ATOM 1937 O GLU A 127 3.109 -7.206 -11.566 1.00 0.00 O ATOM 1938 CB GLU A 127 1.177 -9.214 -9.745 1.00 0.00 C ATOM 1939 CG GLU A 127 0.234 -8.177 -10.358 1.00 0.00 C ATOM 1940 CD GLU A 127 -1.218 -8.357 -9.939 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -1.501 -8.275 -8.714 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -2.085 -8.511 -10.840 1.00 0.00 O ATOM 0 H GLU A 127 3.257 -9.943 -8.511 1.00 0.00 H new ATOM 0 HA GLU A 127 2.524 -9.494 -11.290 1.00 0.00 H new ATOM 0 HB2 GLU A 127 0.789 -10.212 -9.949 1.00 0.00 H new ATOM 0 HB3 GLU A 127 1.185 -9.091 -8.662 1.00 0.00 H new ATOM 0 HG2 GLU A 127 0.566 -7.180 -10.070 1.00 0.00 H new ATOM 0 HG3 GLU A 127 0.300 -8.234 -11.444 1.00 0.00 H new ATOM 1949 N ALA A 128 3.637 -7.202 -9.332 1.00 0.00 N ATOM 1950 CA ALA A 128 4.162 -5.876 -9.227 1.00 0.00 C ATOM 1951 C ALA A 128 5.293 -5.533 -10.135 1.00 0.00 C ATOM 1952 O ALA A 128 5.311 -4.489 -10.784 1.00 0.00 O ATOM 1953 CB ALA A 128 4.437 -5.815 -7.715 1.00 0.00 C ATOM 0 H ALA A 128 3.622 -7.696 -8.440 1.00 0.00 H new ATOM 0 HA ALA A 128 3.487 -5.098 -9.583 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.853 -4.840 -7.460 1.00 0.00 H new ATOM 0 HB2 ALA A 128 3.506 -5.967 -7.169 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.148 -6.595 -7.443 1.00 0.00 H new ATOM 1959 N ASP A 129 6.306 -6.411 -10.252 1.00 0.00 N ATOM 1960 CA ASP A 129 7.477 -6.066 -10.997 1.00 0.00 C ATOM 1961 C ASP A 129 7.171 -6.182 -12.451 1.00 0.00 C ATOM 1962 O ASP A 129 6.804 -7.212 -13.015 1.00 0.00 O ATOM 1963 CB ASP A 129 8.758 -6.897 -10.813 1.00 0.00 C ATOM 1964 CG ASP A 129 10.014 -6.129 -11.199 1.00 0.00 C ATOM 1965 OD1 ASP A 129 10.393 -6.041 -12.397 1.00 0.00 O ATOM 1966 OD2 ASP A 129 10.632 -5.399 -10.378 1.00 0.00 O ATOM 0 H ASP A 129 6.316 -7.344 -9.839 1.00 0.00 H new ATOM 0 HA ASP A 129 7.698 -5.072 -10.609 1.00 0.00 H new ATOM 0 HB2 ASP A 129 8.835 -7.213 -9.773 1.00 0.00 H new ATOM 0 HB3 ASP A 129 8.690 -7.802 -11.417 1.00 0.00 H new ATOM 1971 N ILE A 130 7.226 -5.030 -13.141 1.00 0.00 N ATOM 1972 CA ILE A 130 7.001 -4.854 -14.543 1.00 0.00 C ATOM 1973 C ILE A 130 8.053 -5.485 -15.388 1.00 0.00 C ATOM 1974 O ILE A 130 7.714 -6.254 -16.285 1.00 0.00 O ATOM 1975 CB ILE A 130 6.577 -3.469 -14.935 1.00 0.00 C ATOM 1976 CG1 ILE A 130 5.063 -3.284 -14.736 1.00 0.00 C ATOM 1977 CG2 ILE A 130 6.925 -2.941 -16.337 1.00 0.00 C ATOM 1978 CD1 ILE A 130 4.766 -1.803 -14.505 1.00 0.00 C ATOM 0 H ILE A 130 7.446 -4.148 -12.679 1.00 0.00 H new ATOM 0 HA ILE A 130 6.107 -5.433 -14.776 1.00 0.00 H new ATOM 0 HB ILE A 130 7.193 -2.874 -14.260 1.00 0.00 H new ATOM 0 HG12 ILE A 130 4.522 -3.644 -15.611 1.00 0.00 H new ATOM 0 HG13 ILE A 130 4.721 -3.873 -13.885 1.00 0.00 H new ATOM 0 HG21 ILE A 130 6.543 -1.926 -16.449 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.007 -2.938 -16.466 1.00 0.00 H new ATOM 0 HG23 ILE A 130 6.472 -3.584 -17.091 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.694 -1.665 -14.363 1.00 0.00 H new ATOM 0 HD12 ILE A 130 5.297 -1.460 -13.617 1.00 0.00 H new ATOM 0 HD13 ILE A 130 5.095 -1.227 -15.370 1.00 0.00 H new ATOM 1990 N ASP A 131 9.356 -5.280 -15.125 1.00 0.00 N ATOM 1991 CA ASP A 131 10.357 -6.029 -15.819 1.00 0.00 C ATOM 1992 C ASP A 131 10.366 -7.514 -15.686 1.00 0.00 C ATOM 1993 O ASP A 131 10.650 -8.292 -16.594 1.00 0.00 O ATOM 1994 CB ASP A 131 11.767 -5.757 -15.267 1.00 0.00 C ATOM 1995 CG ASP A 131 12.105 -4.280 -15.414 1.00 0.00 C ATOM 1996 OD1 ASP A 131 12.669 -3.902 -16.476 1.00 0.00 O ATOM 1997 OD2 ASP A 131 11.837 -3.609 -14.382 1.00 0.00 O ATOM 0 H ASP A 131 9.712 -4.609 -14.445 1.00 0.00 H new ATOM 0 HA ASP A 131 10.115 -5.708 -16.832 1.00 0.00 H new ATOM 0 HB2 ASP A 131 11.819 -6.048 -14.218 1.00 0.00 H new ATOM 0 HB3 ASP A 131 12.499 -6.362 -15.802 1.00 0.00 H new ATOM 2002 N GLY A 132 10.137 -7.971 -14.441 1.00 0.00 N ATOM 2003 CA GLY A 132 10.282 -9.341 -14.058 1.00 0.00 C ATOM 2004 C GLY A 132 11.676 -9.496 -13.557 1.00 0.00 C ATOM 2005 O GLY A 132 12.034 -10.652 -13.339 1.00 0.00 O ATOM 0 H GLY A 132 9.841 -7.366 -13.675 1.00 0.00 H new ATOM 0 HA2 GLY A 132 9.561 -9.606 -13.285 1.00 0.00 H new ATOM 0 HA3 GLY A 132 10.099 -10.002 -14.905 1.00 0.00 H new ATOM 2009 N ASP A 133 12.420 -8.416 -13.256 1.00 0.00 N ATOM 2010 CA ASP A 133 13.681 -8.484 -12.585 1.00 0.00 C ATOM 2011 C ASP A 133 13.529 -8.608 -11.108 1.00 0.00 C ATOM 2012 O ASP A 133 14.341 -9.270 -10.464 1.00 0.00 O ATOM 2013 CB ASP A 133 14.695 -7.450 -13.101 1.00 0.00 C ATOM 2014 CG ASP A 133 14.337 -6.013 -12.747 1.00 0.00 C ATOM 2015 OD1 ASP A 133 13.292 -5.703 -12.115 1.00 0.00 O ATOM 2016 OD2 ASP A 133 15.090 -5.077 -13.127 1.00 0.00 O ATOM 0 H ASP A 133 12.134 -7.465 -13.487 1.00 0.00 H new ATOM 0 HA ASP A 133 14.160 -9.424 -12.860 1.00 0.00 H new ATOM 0 HB2 ASP A 133 15.678 -7.682 -12.691 1.00 0.00 H new ATOM 0 HB3 ASP A 133 14.773 -7.540 -14.185 1.00 0.00 H new ATOM 2021 N GLY A 134 12.480 -7.960 -10.571 1.00 0.00 N ATOM 2022 CA GLY A 134 11.973 -8.146 -9.247 1.00 0.00 C ATOM 2023 C GLY A 134 12.429 -7.078 -8.314 1.00 0.00 C ATOM 2024 O GLY A 134 12.134 -7.171 -7.123 1.00 0.00 O ATOM 0 H GLY A 134 11.953 -7.262 -11.096 1.00 0.00 H new ATOM 0 HA2 GLY A 134 10.883 -8.160 -9.276 1.00 0.00 H new ATOM 0 HA3 GLY A 134 12.294 -9.117 -8.870 1.00 0.00 H new ATOM 2028 N GLN A 135 13.195 -6.108 -8.843 1.00 0.00 N ATOM 2029 CA GLN A 135 13.512 -4.972 -8.034 1.00 0.00 C ATOM 2030 C GLN A 135 12.735 -3.783 -8.483 1.00 0.00 C ATOM 2031 O GLN A 135 12.743 -3.375 -9.644 1.00 0.00 O ATOM 2032 CB GLN A 135 15.020 -4.685 -7.943 1.00 0.00 C ATOM 2033 CG GLN A 135 15.718 -4.618 -9.303 1.00 0.00 C ATOM 2034 CD GLN A 135 17.198 -4.567 -8.953 1.00 0.00 C ATOM 2035 OE1 GLN A 135 17.726 -5.181 -8.027 1.00 0.00 O ATOM 2036 NE2 GLN A 135 17.964 -3.705 -9.675 1.00 0.00 N ATOM 0 H GLN A 135 13.580 -6.105 -9.787 1.00 0.00 H new ATOM 0 HA GLN A 135 13.212 -5.213 -7.014 1.00 0.00 H new ATOM 0 HB2 GLN A 135 15.170 -3.740 -7.421 1.00 0.00 H new ATOM 0 HB3 GLN A 135 15.492 -5.461 -7.340 1.00 0.00 H new ATOM 0 HG2 GLN A 135 15.482 -5.488 -9.916 1.00 0.00 H new ATOM 0 HG3 GLN A 135 15.410 -3.737 -9.867 1.00 0.00 H new ATOM 0 HE21 GLN A 135 17.553 -3.182 -10.448 1.00 0.00 H new ATOM 0 HE22 GLN A 135 18.949 -3.581 -9.443 1.00 0.00 H new ATOM 2045 N VAL A 136 11.903 -3.210 -7.595 1.00 0.00 N ATOM 2046 CA VAL A 136 10.854 -2.303 -7.944 1.00 0.00 C ATOM 2047 C VAL A 136 11.365 -0.904 -7.905 1.00 0.00 C ATOM 2048 O VAL A 136 11.898 -0.338 -6.952 1.00 0.00 O ATOM 2049 CB VAL A 136 9.686 -2.478 -7.019 1.00 0.00 C ATOM 2050 CG1 VAL A 136 8.813 -1.268 -6.644 1.00 0.00 C ATOM 2051 CG2 VAL A 136 8.711 -3.535 -7.567 1.00 0.00 C ATOM 0 H VAL A 136 11.964 -3.386 -6.592 1.00 0.00 H new ATOM 0 HA VAL A 136 10.514 -2.518 -8.957 1.00 0.00 H new ATOM 0 HB VAL A 136 10.215 -2.749 -6.106 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.020 -1.587 -5.968 1.00 0.00 H new ATOM 0 HG12 VAL A 136 9.428 -0.515 -6.151 1.00 0.00 H new ATOM 0 HG13 VAL A 136 8.372 -0.844 -7.546 1.00 0.00 H new ATOM 0 HG21 VAL A 136 7.871 -3.646 -6.881 1.00 0.00 H new ATOM 0 HG22 VAL A 136 8.343 -3.219 -8.543 1.00 0.00 H new ATOM 0 HG23 VAL A 136 9.227 -4.490 -7.666 1.00 0.00 H new ATOM 2061 N ASN A 137 11.132 -0.194 -9.023 1.00 0.00 N ATOM 2062 CA ASN A 137 11.403 1.211 -9.022 1.00 0.00 C ATOM 2063 C ASN A 137 10.227 2.011 -8.578 1.00 0.00 C ATOM 2064 O ASN A 137 9.177 1.499 -8.193 1.00 0.00 O ATOM 2065 CB ASN A 137 12.051 1.747 -10.310 1.00 0.00 C ATOM 2066 CG ASN A 137 11.285 1.389 -11.576 1.00 0.00 C ATOM 2067 OD1 ASN A 137 10.195 1.914 -11.797 1.00 0.00 O ATOM 2068 ND2 ASN A 137 11.902 0.626 -12.517 1.00 0.00 N ATOM 0 H ASN A 137 10.770 -0.573 -9.898 1.00 0.00 H new ATOM 0 HA ASN A 137 12.180 1.346 -8.269 1.00 0.00 H new ATOM 0 HB2 ASN A 137 12.133 2.832 -10.240 1.00 0.00 H new ATOM 0 HB3 ASN A 137 13.065 1.355 -10.386 1.00 0.00 H new ATOM 0 HD21 ASN A 137 11.461 0.481 -13.425 1.00 0.00 H new ATOM 0 HD22 ASN A 137 12.806 0.199 -12.315 1.00 0.00 H new ATOM 2075 N TYR A 138 10.327 3.348 -8.680 1.00 0.00 N ATOM 2076 CA TYR A 138 9.260 4.253 -8.384 1.00 0.00 C ATOM 2077 C TYR A 138 8.125 4.022 -9.320 1.00 0.00 C ATOM 2078 O TYR A 138 7.003 3.931 -8.824 1.00 0.00 O ATOM 2079 CB TYR A 138 9.783 5.699 -8.366 1.00 0.00 C ATOM 2080 CG TYR A 138 8.656 6.655 -8.171 1.00 0.00 C ATOM 2081 CD1 TYR A 138 7.950 6.584 -6.993 1.00 0.00 C ATOM 2082 CD2 TYR A 138 8.400 7.633 -9.103 1.00 0.00 C ATOM 2083 CE1 TYR A 138 6.786 7.307 -6.879 1.00 0.00 C ATOM 2084 CE2 TYR A 138 7.209 8.311 -8.995 1.00 0.00 C ATOM 2085 CZ TYR A 138 6.412 8.169 -7.883 1.00 0.00 C ATOM 2086 OH TYR A 138 5.247 8.955 -7.765 1.00 0.00 O ATOM 0 H TYR A 138 11.182 3.816 -8.980 1.00 0.00 H new ATOM 0 HA TYR A 138 8.867 4.068 -7.384 1.00 0.00 H new ATOM 0 HB2 TYR A 138 10.513 5.819 -7.565 1.00 0.00 H new ATOM 0 HB3 TYR A 138 10.297 5.919 -9.302 1.00 0.00 H new ATOM 0 HD1 TYR A 138 8.302 5.973 -6.175 1.00 0.00 H new ATOM 0 HD2 TYR A 138 9.106 7.859 -9.888 1.00 0.00 H new ATOM 0 HE1 TYR A 138 6.166 7.198 -6.002 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.894 8.965 -9.795 1.00 0.00 H new ATOM 0 HH TYR A 138 5.141 9.505 -8.569 1.00 0.00 H new ATOM 2096 N GLU A 139 8.229 3.825 -10.647 1.00 0.00 N ATOM 2097 CA GLU A 139 7.104 3.669 -11.516 1.00 0.00 C ATOM 2098 C GLU A 139 6.458 2.341 -11.317 1.00 0.00 C ATOM 2099 O GLU A 139 5.231 2.267 -11.354 1.00 0.00 O ATOM 2100 CB GLU A 139 7.419 3.955 -12.994 1.00 0.00 C ATOM 2101 CG GLU A 139 7.488 5.460 -13.258 1.00 0.00 C ATOM 2102 CD GLU A 139 7.642 5.741 -14.746 1.00 0.00 C ATOM 2103 OE1 GLU A 139 8.606 5.203 -15.354 1.00 0.00 O ATOM 2104 OE2 GLU A 139 6.802 6.496 -15.305 1.00 0.00 O ATOM 0 H GLU A 139 9.126 3.773 -11.131 1.00 0.00 H new ATOM 0 HA GLU A 139 6.385 4.437 -11.233 1.00 0.00 H new ATOM 0 HB2 GLU A 139 8.368 3.491 -13.264 1.00 0.00 H new ATOM 0 HB3 GLU A 139 6.653 3.506 -13.626 1.00 0.00 H new ATOM 0 HG2 GLU A 139 6.584 5.941 -12.884 1.00 0.00 H new ATOM 0 HG3 GLU A 139 8.328 5.891 -12.713 1.00 0.00 H new ATOM 2111 N GLU A 140 7.262 1.322 -10.963 1.00 0.00 N ATOM 2112 CA GLU A 140 6.747 0.099 -10.432 1.00 0.00 C ATOM 2113 C GLU A 140 6.054 0.123 -9.113 1.00 0.00 C ATOM 2114 O GLU A 140 4.949 -0.380 -8.918 1.00 0.00 O ATOM 2115 CB GLU A 140 7.752 -1.051 -10.615 1.00 0.00 C ATOM 2116 CG GLU A 140 8.444 -1.131 -11.977 1.00 0.00 C ATOM 2117 CD GLU A 140 9.610 -2.105 -11.880 1.00 0.00 C ATOM 2118 OE1 GLU A 140 10.674 -1.772 -11.293 1.00 0.00 O ATOM 2119 OE2 GLU A 140 9.558 -3.248 -12.408 1.00 0.00 O ATOM 0 H GLU A 140 8.278 1.347 -11.046 1.00 0.00 H new ATOM 0 HA GLU A 140 5.877 -0.098 -11.058 1.00 0.00 H new ATOM 0 HB2 GLU A 140 8.519 -0.962 -9.846 1.00 0.00 H new ATOM 0 HB3 GLU A 140 7.232 -1.992 -10.439 1.00 0.00 H new ATOM 0 HG2 GLU A 140 7.739 -1.462 -12.739 1.00 0.00 H new ATOM 0 HG3 GLU A 140 8.800 -0.146 -12.278 1.00 0.00 H new ATOM 2126 N PHE A 141 6.503 0.994 -8.191 1.00 0.00 N ATOM 2127 CA PHE A 141 5.790 1.408 -7.023 1.00 0.00 C ATOM 2128 C PHE A 141 4.523 2.168 -7.221 1.00 0.00 C ATOM 2129 O PHE A 141 3.603 1.994 -6.423 1.00 0.00 O ATOM 2130 CB PHE A 141 6.760 2.204 -6.134 1.00 0.00 C ATOM 2131 CG PHE A 141 6.469 1.994 -4.688 1.00 0.00 C ATOM 2132 CD1 PHE A 141 6.471 0.706 -4.206 1.00 0.00 C ATOM 2133 CD2 PHE A 141 6.067 3.027 -3.873 1.00 0.00 C ATOM 2134 CE1 PHE A 141 6.239 0.508 -2.865 1.00 0.00 C ATOM 2135 CE2 PHE A 141 5.816 2.794 -2.542 1.00 0.00 C ATOM 2136 CZ PHE A 141 5.893 1.528 -2.010 1.00 0.00 C ATOM 0 H PHE A 141 7.420 1.435 -8.267 1.00 0.00 H new ATOM 0 HA PHE A 141 5.441 0.486 -6.558 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.785 1.900 -6.348 1.00 0.00 H new ATOM 0 HB3 PHE A 141 6.686 3.265 -6.371 1.00 0.00 H new ATOM 0 HD1 PHE A 141 6.651 -0.130 -4.865 1.00 0.00 H new ATOM 0 HD2 PHE A 141 5.949 4.021 -4.279 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.333 -0.491 -2.466 1.00 0.00 H new ATOM 0 HE2 PHE A 141 5.553 3.622 -1.901 1.00 0.00 H new ATOM 0 HZ PHE A 141 5.690 1.343 -0.965 1.00 0.00 H new ATOM 2146 N VAL A 142 4.441 3.094 -8.193 1.00 0.00 N ATOM 2147 CA VAL A 142 3.216 3.752 -8.528 1.00 0.00 C ATOM 2148 C VAL A 142 2.111 2.853 -8.967 1.00 0.00 C ATOM 2149 O VAL A 142 0.983 3.011 -8.502 1.00 0.00 O ATOM 2150 CB VAL A 142 3.434 4.712 -9.659 1.00 0.00 C ATOM 2151 CG1 VAL A 142 2.146 5.300 -10.261 1.00 0.00 C ATOM 2152 CG2 VAL A 142 4.283 5.916 -9.216 1.00 0.00 C ATOM 0 H VAL A 142 5.238 3.391 -8.756 1.00 0.00 H new ATOM 0 HA VAL A 142 2.918 4.235 -7.597 1.00 0.00 H new ATOM 0 HB VAL A 142 3.933 4.104 -10.413 1.00 0.00 H new ATOM 0 HG11 VAL A 142 2.402 5.983 -11.071 1.00 0.00 H new ATOM 0 HG12 VAL A 142 1.524 4.493 -10.649 1.00 0.00 H new ATOM 0 HG13 VAL A 142 1.598 5.842 -9.490 1.00 0.00 H new ATOM 0 HG21 VAL A 142 4.423 6.593 -10.059 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.774 6.442 -8.408 1.00 0.00 H new ATOM 0 HG23 VAL A 142 5.255 5.567 -8.866 1.00 0.00 H new ATOM 2162 N GLN A 143 2.327 1.843 -9.828 1.00 0.00 N ATOM 2163 CA GLN A 143 1.326 0.886 -10.184 1.00 0.00 C ATOM 2164 C GLN A 143 1.029 -0.063 -9.075 1.00 0.00 C ATOM 2165 O GLN A 143 -0.109 -0.525 -9.004 1.00 0.00 O ATOM 2166 CB GLN A 143 1.692 0.071 -11.436 1.00 0.00 C ATOM 2167 CG GLN A 143 0.588 -0.782 -12.064 1.00 0.00 C ATOM 2168 CD GLN A 143 1.077 -1.382 -13.374 1.00 0.00 C ATOM 2169 OE1 GLN A 143 1.311 -0.659 -14.341 1.00 0.00 O ATOM 2170 NE2 GLN A 143 1.334 -2.716 -13.421 1.00 0.00 N ATOM 0 H GLN A 143 3.223 1.687 -10.290 1.00 0.00 H new ATOM 0 HA GLN A 143 0.440 1.483 -10.399 1.00 0.00 H new ATOM 0 HB2 GLN A 143 2.056 0.763 -12.195 1.00 0.00 H new ATOM 0 HB3 GLN A 143 2.522 -0.587 -11.180 1.00 0.00 H new ATOM 0 HG2 GLN A 143 0.295 -1.576 -11.377 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -0.298 -0.172 -12.242 1.00 0.00 H new ATOM 0 HE21 GLN A 143 1.135 -3.303 -12.611 1.00 0.00 H new ATOM 0 HE22 GLN A 143 1.726 -3.130 -14.266 1.00 0.00 H new ATOM 2179 N MET A 144 1.957 -0.289 -8.128 1.00 0.00 N ATOM 2180 CA MET A 144 1.757 -1.061 -6.941 1.00 0.00 C ATOM 2181 C MET A 144 1.016 -0.406 -5.827 1.00 0.00 C ATOM 2182 O MET A 144 0.084 -1.016 -5.304 1.00 0.00 O ATOM 2183 CB MET A 144 3.184 -1.444 -6.512 1.00 0.00 C ATOM 2184 CG MET A 144 3.292 -2.498 -5.409 1.00 0.00 C ATOM 2185 SD MET A 144 5.013 -2.976 -5.069 1.00 0.00 S ATOM 2186 CE MET A 144 4.586 -3.531 -3.393 1.00 0.00 C ATOM 0 H MET A 144 2.902 0.089 -8.195 1.00 0.00 H new ATOM 0 HA MET A 144 1.101 -1.902 -7.167 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.720 -1.808 -7.388 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.696 -0.542 -6.177 1.00 0.00 H new ATOM 0 HG2 MET A 144 2.838 -2.112 -4.496 1.00 0.00 H new ATOM 0 HG3 MET A 144 2.723 -3.382 -5.698 1.00 0.00 H new ATOM 0 HE1 MET A 144 5.382 -3.251 -2.703 1.00 0.00 H new ATOM 0 HE2 MET A 144 3.653 -3.061 -3.081 1.00 0.00 H new ATOM 0 HE3 MET A 144 4.466 -4.614 -3.388 1.00 0.00 H new ATOM 2196 N MET A 145 1.298 0.882 -5.562 1.00 0.00 N ATOM 2197 CA MET A 145 0.505 1.600 -4.614 1.00 0.00 C ATOM 2198 C MET A 145 -0.844 2.020 -5.088 1.00 0.00 C ATOM 2199 O MET A 145 -1.845 2.149 -4.386 1.00 0.00 O ATOM 2200 CB MET A 145 1.362 2.784 -4.135 1.00 0.00 C ATOM 2201 CG MET A 145 2.510 2.396 -3.200 1.00 0.00 C ATOM 2202 SD MET A 145 2.185 1.839 -1.500 1.00 0.00 S ATOM 2203 CE MET A 145 1.647 3.446 -0.848 1.00 0.00 C ATOM 0 H MET A 145 2.054 1.415 -5.991 1.00 0.00 H new ATOM 0 HA MET A 145 0.252 0.928 -3.794 1.00 0.00 H new ATOM 0 HB2 MET A 145 1.775 3.294 -5.006 1.00 0.00 H new ATOM 0 HB3 MET A 145 0.718 3.499 -3.623 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.070 1.602 -3.694 1.00 0.00 H new ATOM 0 HG3 MET A 145 3.172 3.259 -3.132 1.00 0.00 H new ATOM 0 HE1 MET A 145 0.994 3.290 0.011 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.518 4.024 -0.541 1.00 0.00 H new ATOM 0 HE3 MET A 145 1.105 3.990 -1.622 1.00 0.00 H new