USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 754 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 128 GLN : amide:sc= -1.49 K(o=-1.5,f=-3.4!) USER MOD Set 1.2: A 131 CYS SG : rot -160:sc= -0.0505 USER MOD Set 2.1: A 74 ASN : amide:sc= -0.387 K(o=-0.32,f=-2.8!) USER MOD Set 2.2: A 76 THR OG1 : rot 180:sc= 0.0627 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.0139 K(o=-0.014,f=-1.3) USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -0.879 K(o=-0.88,f=-2.6!) USER MOD Single : A 23 LYS NZ :NH3+ -160:sc=-0.00235 (180deg=-0.304) USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.181 USER MOD Single : A 66 MET CE :methyl 165:sc= 0 (180deg=-0.273) USER MOD Single : A 67 MET CE :methyl -122:sc= -4.31! (180deg=-7.36!) USER MOD Single : A 70 THR OG1 : rot -63:sc= -0.411 USER MOD Single : A 72 SER OG : rot 180:sc= 0.00558 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -160:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -2.11 K(o=-2.1,f=-3.6) USER MOD Single : A 90 SER OG : rot 150:sc= -0.0611 USER MOD Single : A 93 ASN : amide:sc= -2.92 K(o=-2.9,f=-4.3!) USER MOD Single : A 95 ASN : amide:sc= -0.224 K(o=-0.22,f=-1.8!) USER MOD Single : A 96 TYR OH : rot 180:sc= -0.941 USER MOD Single : A 99 GLN : amide:sc= -0.0186 X(o=-0.019,f=-0.41) USER MOD Single : A 105 SER OG : rot 180:sc= 0.0359 USER MOD Single : A 111 MET CE :methyl 138:sc= -2.72 (180deg=-7.42!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 90:sc= 0.00359 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 3.728 3.634 -6.402 1.00 52.14 N ATOM 70 CA LYS A 4 5.054 4.237 -6.348 1.00 23.22 C ATOM 71 C LYS A 4 5.746 3.911 -5.028 1.00 10.32 C ATOM 72 O LYS A 4 6.065 4.807 -4.246 1.00 43.10 O ATOM 73 CB LYS A 4 4.955 5.754 -6.523 1.00 63.13 C ATOM 74 CG LYS A 4 3.942 6.408 -5.600 1.00 5.23 C ATOM 75 CD LYS A 4 3.685 7.854 -5.989 1.00 43.22 C ATOM 76 CE LYS A 4 2.216 8.094 -6.303 1.00 4.21 C ATOM 77 NZ LYS A 4 1.926 9.537 -6.531 1.00 24.04 N ATOM 0 HA LYS A 4 5.648 3.822 -7.162 1.00 23.22 H new ATOM 0 HB2 LYS A 4 5.935 6.197 -6.345 1.00 63.13 H new ATOM 0 HB3 LYS A 4 4.688 5.975 -7.556 1.00 63.13 H new ATOM 0 HG2 LYS A 4 3.006 5.850 -5.632 1.00 5.23 H new ATOM 0 HG3 LYS A 4 4.304 6.365 -4.573 1.00 5.23 H new ATOM 0 HD2 LYS A 4 3.997 8.511 -5.177 1.00 43.22 H new ATOM 0 HD3 LYS A 4 4.291 8.111 -6.858 1.00 43.22 H new ATOM 0 HE2 LYS A 4 1.936 7.523 -7.188 1.00 4.21 H new ATOM 0 HE3 LYS A 4 1.604 7.726 -5.480 1.00 4.21 H new ATOM 0 HZ1 LYS A 4 0.915 9.659 -6.742 1.00 24.04 H new ATOM 0 HZ2 LYS A 4 2.169 10.079 -5.677 1.00 24.04 H new ATOM 0 HZ3 LYS A 4 2.491 9.882 -7.333 1.00 24.04 H new ATOM 91 N ASP A 5 5.976 2.625 -4.787 1.00 55.20 N ATOM 92 CA ASP A 5 6.632 2.182 -3.563 1.00 20.13 C ATOM 93 C ASP A 5 8.136 2.037 -3.774 1.00 72.12 C ATOM 94 O ASP A 5 8.749 1.078 -3.305 1.00 32.42 O ATOM 95 CB ASP A 5 6.040 0.852 -3.094 1.00 31.20 C ATOM 96 CG ASP A 5 6.115 0.683 -1.589 1.00 71.13 C ATOM 97 OD1 ASP A 5 6.625 1.601 -0.914 1.00 41.13 O ATOM 98 OD2 ASP A 5 5.664 -0.368 -1.087 1.00 22.04 O ATOM 0 H ASP A 5 5.718 1.871 -5.424 1.00 55.20 H new ATOM 0 HA ASP A 5 6.462 2.937 -2.796 1.00 20.13 H new ATOM 0 HB2 ASP A 5 4.999 0.789 -3.412 1.00 31.20 H new ATOM 0 HB3 ASP A 5 6.571 0.031 -3.576 1.00 31.20 H new ATOM 103 N ILE A 6 8.723 2.994 -4.484 1.00 2.30 N ATOM 104 CA ILE A 6 10.155 2.973 -4.757 1.00 72.24 C ATOM 105 C ILE A 6 10.960 3.274 -3.498 1.00 14.33 C ATOM 106 O ILE A 6 10.395 3.553 -2.440 1.00 31.22 O ATOM 107 CB ILE A 6 10.534 3.989 -5.851 1.00 24.31 C ATOM 108 CG1 ILE A 6 10.690 5.386 -5.248 1.00 10.13 C ATOM 109 CG2 ILE A 6 9.487 3.996 -6.954 1.00 72.41 C ATOM 110 CD1 ILE A 6 9.470 5.855 -4.486 1.00 72.23 C ATOM 0 H ILE A 6 8.229 3.794 -4.881 1.00 2.30 H new ATOM 0 HA ILE A 6 10.395 1.969 -5.106 1.00 72.24 H new ATOM 0 HB ILE A 6 11.489 3.693 -6.286 1.00 24.31 H new ATOM 0 HG12 ILE A 6 11.550 5.390 -4.579 1.00 10.13 H new ATOM 0 HG13 ILE A 6 10.905 6.096 -6.047 1.00 10.13 H new ATOM 0 HG21 ILE A 6 9.769 4.719 -7.719 1.00 72.41 H new ATOM 0 HG22 ILE A 6 9.421 3.003 -7.399 1.00 72.41 H new ATOM 0 HG23 ILE A 6 8.519 4.271 -6.535 1.00 72.41 H new ATOM 0 HD11 ILE A 6 9.652 6.853 -4.086 1.00 72.23 H new ATOM 0 HD12 ILE A 6 8.611 5.884 -5.156 1.00 72.23 H new ATOM 0 HD13 ILE A 6 9.267 5.167 -3.665 1.00 72.23 H new ATOM 122 N ARG A 7 12.282 3.218 -3.619 1.00 51.45 N ATOM 123 CA ARG A 7 13.165 3.486 -2.491 1.00 10.12 C ATOM 124 C ARG A 7 13.917 4.799 -2.688 1.00 51.13 C ATOM 125 O ARG A 7 15.142 4.812 -2.814 1.00 75.22 O ATOM 126 CB ARG A 7 14.160 2.338 -2.311 1.00 41.20 C ATOM 127 CG ARG A 7 13.559 1.109 -1.649 1.00 1.34 C ATOM 128 CD ARG A 7 13.419 1.299 -0.146 1.00 73.23 C ATOM 129 NE ARG A 7 13.868 0.125 0.598 1.00 50.22 N ATOM 130 CZ ARG A 7 13.517 -0.127 1.854 1.00 71.42 C ATOM 131 NH1 ARG A 7 12.716 0.707 2.502 1.00 31.23 N ATOM 132 NH2 ARG A 7 13.967 -1.217 2.463 1.00 11.35 N ATOM 0 H ARG A 7 12.765 2.989 -4.488 1.00 51.45 H new ATOM 0 HA ARG A 7 12.551 3.570 -1.594 1.00 10.12 H new ATOM 0 HB2 ARG A 7 14.558 2.057 -3.286 1.00 41.20 H new ATOM 0 HB3 ARG A 7 15.001 2.688 -1.712 1.00 41.20 H new ATOM 0 HG2 ARG A 7 12.581 0.902 -2.083 1.00 1.34 H new ATOM 0 HG3 ARG A 7 14.188 0.242 -1.850 1.00 1.34 H new ATOM 0 HD2 ARG A 7 13.998 2.169 0.165 1.00 73.23 H new ATOM 0 HD3 ARG A 7 12.377 1.506 0.098 1.00 73.23 H new ATOM 0 HE ARG A 7 14.485 -0.537 0.127 1.00 50.22 H new ATOM 0 HH11 ARG A 7 12.368 1.545 2.036 1.00 31.23 H new ATOM 0 HH12 ARG A 7 12.448 0.511 3.466 1.00 31.23 H new ATOM 0 HH21 ARG A 7 14.582 -1.861 1.967 1.00 11.35 H new ATOM 0 HH22 ARG A 7 13.697 -1.410 3.428 1.00 11.35 H new ATOM 146 N ASP A 8 13.176 5.901 -2.715 1.00 15.11 N ATOM 147 CA ASP A 8 13.772 7.219 -2.897 1.00 13.54 C ATOM 148 C ASP A 8 14.533 7.294 -4.216 1.00 45.32 C ATOM 149 O ASP A 8 15.478 8.071 -4.356 1.00 3.20 O ATOM 150 CB ASP A 8 14.710 7.543 -1.733 1.00 13.32 C ATOM 151 CG ASP A 8 14.859 9.035 -1.508 1.00 5.13 C ATOM 152 OD1 ASP A 8 13.983 9.625 -0.842 1.00 43.10 O ATOM 153 OD2 ASP A 8 15.852 9.613 -1.998 1.00 65.31 O ATOM 0 H ASP A 8 12.161 5.908 -2.613 1.00 15.11 H new ATOM 0 HA ASP A 8 12.968 7.954 -2.921 1.00 13.54 H new ATOM 0 HB2 ASP A 8 14.330 7.077 -0.824 1.00 13.32 H new ATOM 0 HB3 ASP A 8 15.690 7.108 -1.928 1.00 13.32 H new ATOM 158 N TYR A 9 14.117 6.481 -5.181 1.00 10.35 N ATOM 159 CA TYR A 9 14.762 6.453 -6.488 1.00 22.42 C ATOM 160 C TYR A 9 16.267 6.242 -6.348 1.00 73.22 C ATOM 161 O TYR A 9 17.055 7.165 -6.546 1.00 50.22 O ATOM 162 CB TYR A 9 14.486 7.753 -7.245 1.00 22.13 C ATOM 163 CG TYR A 9 13.039 8.188 -7.194 1.00 31.43 C ATOM 164 CD1 TYR A 9 12.109 7.682 -8.094 1.00 22.41 C ATOM 165 CD2 TYR A 9 12.601 9.105 -6.246 1.00 63.05 C ATOM 166 CE1 TYR A 9 10.786 8.076 -8.052 1.00 11.33 C ATOM 167 CE2 TYR A 9 11.280 9.504 -6.196 1.00 11.21 C ATOM 168 CZ TYR A 9 10.376 8.987 -7.101 1.00 1.43 C ATOM 169 OH TYR A 9 9.059 9.384 -7.055 1.00 22.35 O ATOM 0 H TYR A 9 13.336 5.833 -5.082 1.00 10.35 H new ATOM 0 HA TYR A 9 14.347 5.618 -7.052 1.00 22.42 H new ATOM 0 HB2 TYR A 9 15.109 8.545 -6.830 1.00 22.13 H new ATOM 0 HB3 TYR A 9 14.782 7.627 -8.286 1.00 22.13 H new ATOM 0 HD1 TYR A 9 12.426 6.968 -8.840 1.00 22.41 H new ATOM 0 HD2 TYR A 9 13.306 9.512 -5.536 1.00 63.05 H new ATOM 0 HE1 TYR A 9 10.077 7.673 -8.760 1.00 11.33 H new ATOM 0 HE2 TYR A 9 10.956 10.217 -5.452 1.00 11.21 H new ATOM 0 HH TYR A 9 8.937 10.028 -6.327 1.00 22.35 H new ATOM 179 N ASN A 10 16.657 5.018 -6.006 1.00 51.12 N ATOM 180 CA ASN A 10 18.067 4.684 -5.840 1.00 13.01 C ATOM 181 C ASN A 10 18.380 3.324 -6.455 1.00 73.53 C ATOM 182 O ASN A 10 19.188 3.219 -7.378 1.00 53.43 O ATOM 183 CB ASN A 10 18.440 4.683 -4.356 1.00 45.22 C ATOM 184 CG ASN A 10 19.916 4.951 -4.132 1.00 1.55 C ATOM 185 OD1 ASN A 10 20.721 4.875 -5.060 1.00 53.11 O ATOM 186 ND2 ASN A 10 20.278 5.268 -2.894 1.00 30.45 N ATOM 0 H ASN A 10 16.017 4.242 -5.839 1.00 51.12 H new ATOM 0 HA ASN A 10 18.658 5.441 -6.356 1.00 13.01 H new ATOM 0 HB2 ASN A 10 17.853 5.440 -3.836 1.00 45.22 H new ATOM 0 HB3 ASN A 10 18.178 3.720 -3.919 1.00 45.22 H new ATOM 0 HD21 ASN A 10 21.257 5.460 -2.682 1.00 30.45 H new ATOM 0 HD22 ASN A 10 19.577 5.320 -2.155 1.00 30.45 H new ATOM 193 N ASP A 11 17.734 2.284 -5.938 1.00 41.03 N ATOM 194 CA ASP A 11 17.942 0.930 -6.438 1.00 33.33 C ATOM 195 C ASP A 11 16.631 0.150 -6.455 1.00 55.13 C ATOM 196 O ASP A 11 16.604 -1.046 -6.166 1.00 41.30 O ATOM 197 CB ASP A 11 18.973 0.198 -5.577 1.00 12.22 C ATOM 198 CG ASP A 11 20.293 0.939 -5.501 1.00 25.31 C ATOM 199 OD1 ASP A 11 20.395 1.890 -4.698 1.00 33.51 O ATOM 200 OD2 ASP A 11 21.226 0.568 -6.245 1.00 74.00 O ATOM 0 H ASP A 11 17.062 2.353 -5.173 1.00 41.03 H new ATOM 0 HA ASP A 11 18.316 1.000 -7.459 1.00 33.33 H new ATOM 0 HB2 ASP A 11 18.575 0.067 -4.571 1.00 12.22 H new ATOM 0 HB3 ASP A 11 19.142 -0.798 -5.985 1.00 12.22 H new ATOM 205 N ALA A 12 15.545 0.836 -6.796 1.00 15.43 N ATOM 206 CA ALA A 12 14.230 0.208 -6.852 1.00 4.31 C ATOM 207 C ALA A 12 14.155 -0.807 -7.987 1.00 24.42 C ATOM 208 O ALA A 12 13.470 -1.824 -7.878 1.00 70.32 O ATOM 209 CB ALA A 12 13.147 1.264 -7.014 1.00 2.41 C ATOM 0 H ALA A 12 15.550 1.827 -7.038 1.00 15.43 H new ATOM 0 HA ALA A 12 14.068 -0.322 -5.914 1.00 4.31 H new ATOM 0 HB1 ALA A 12 12.171 0.781 -7.054 1.00 2.41 H new ATOM 0 HB2 ALA A 12 13.178 1.950 -6.167 1.00 2.41 H new ATOM 0 HB3 ALA A 12 13.315 1.819 -7.937 1.00 2.41 H new ATOM 215 N ASP A 13 14.864 -0.525 -9.075 1.00 35.13 N ATOM 216 CA ASP A 13 14.877 -1.415 -10.230 1.00 44.22 C ATOM 217 C ASP A 13 15.214 -2.843 -9.812 1.00 45.35 C ATOM 218 O ASP A 13 14.644 -3.802 -10.331 1.00 22.23 O ATOM 219 CB ASP A 13 15.887 -0.922 -11.268 1.00 50.10 C ATOM 220 CG ASP A 13 17.318 -1.025 -10.778 1.00 70.12 C ATOM 221 OD1 ASP A 13 17.745 -0.144 -10.003 1.00 1.12 O ATOM 222 OD2 ASP A 13 18.011 -1.988 -11.169 1.00 54.44 O ATOM 0 H ASP A 13 15.437 0.312 -9.181 1.00 35.13 H new ATOM 0 HA ASP A 13 13.881 -1.411 -10.673 1.00 44.22 H new ATOM 0 HB2 ASP A 13 15.777 -1.504 -12.183 1.00 50.10 H new ATOM 0 HB3 ASP A 13 15.667 0.115 -11.521 1.00 50.10 H new ATOM 227 N MET A 14 16.145 -2.975 -8.873 1.00 44.03 N ATOM 228 CA MET A 14 16.558 -4.286 -8.386 1.00 62.12 C ATOM 229 C MET A 14 15.349 -5.114 -7.964 1.00 20.45 C ATOM 230 O MET A 14 15.377 -6.343 -8.020 1.00 32.44 O ATOM 231 CB MET A 14 17.525 -4.136 -7.210 1.00 15.22 C ATOM 232 CG MET A 14 18.933 -3.746 -7.627 1.00 24.14 C ATOM 233 SD MET A 14 20.104 -3.803 -6.256 1.00 60.23 S ATOM 234 CE MET A 14 21.605 -3.262 -7.070 1.00 70.55 C ATOM 0 H MET A 14 16.627 -2.191 -8.434 1.00 44.03 H new ATOM 0 HA MET A 14 17.065 -4.805 -9.199 1.00 62.12 H new ATOM 0 HB2 MET A 14 17.136 -3.383 -6.524 1.00 15.22 H new ATOM 0 HB3 MET A 14 17.565 -5.077 -6.661 1.00 15.22 H new ATOM 0 HG2 MET A 14 19.272 -4.415 -8.418 1.00 24.14 H new ATOM 0 HG3 MET A 14 18.918 -2.740 -8.046 1.00 24.14 H new ATOM 0 HE1 MET A 14 22.423 -3.245 -6.350 1.00 70.55 H new ATOM 0 HE2 MET A 14 21.848 -3.950 -7.880 1.00 70.55 H new ATOM 0 HE3 MET A 14 21.458 -2.261 -7.476 1.00 70.55 H new ATOM 244 N ALA A 15 14.289 -4.433 -7.540 1.00 63.14 N ATOM 245 CA ALA A 15 13.070 -5.106 -7.110 1.00 63.51 C ATOM 246 C ALA A 15 12.564 -6.064 -8.183 1.00 52.04 C ATOM 247 O ALA A 15 11.899 -7.055 -7.881 1.00 11.12 O ATOM 248 CB ALA A 15 11.998 -4.085 -6.763 1.00 14.23 C ATOM 0 H ALA A 15 14.250 -3.415 -7.485 1.00 63.14 H new ATOM 0 HA ALA A 15 13.302 -5.690 -6.219 1.00 63.51 H new ATOM 0 HB1 ALA A 15 11.093 -4.602 -6.443 1.00 14.23 H new ATOM 0 HB2 ALA A 15 12.354 -3.444 -5.956 1.00 14.23 H new ATOM 0 HB3 ALA A 15 11.778 -3.476 -7.640 1.00 14.23 H new ATOM 254 N ARG A 16 12.882 -5.761 -9.438 1.00 32.13 N ATOM 255 CA ARG A 16 12.457 -6.594 -10.556 1.00 70.41 C ATOM 256 C ARG A 16 13.035 -8.002 -10.436 1.00 13.51 C ATOM 257 O ARG A 16 12.491 -8.957 -10.991 1.00 33.21 O ATOM 258 CB ARG A 16 12.890 -5.965 -11.882 1.00 32.33 C ATOM 259 CG ARG A 16 11.790 -5.938 -12.931 1.00 23.42 C ATOM 260 CD ARG A 16 11.817 -7.188 -13.798 1.00 13.53 C ATOM 261 NE ARG A 16 12.663 -7.018 -14.976 1.00 21.32 N ATOM 262 CZ ARG A 16 13.016 -8.018 -15.777 1.00 12.51 C ATOM 263 NH1 ARG A 16 12.597 -9.251 -15.528 1.00 40.40 N ATOM 264 NH2 ARG A 16 13.789 -7.784 -16.830 1.00 34.01 N ATOM 0 H ARG A 16 13.432 -4.945 -9.705 1.00 32.13 H new ATOM 0 HA ARG A 16 11.369 -6.663 -10.532 1.00 70.41 H new ATOM 0 HB2 ARG A 16 13.229 -4.946 -11.697 1.00 32.33 H new ATOM 0 HB3 ARG A 16 13.743 -6.518 -12.276 1.00 32.33 H new ATOM 0 HG2 ARG A 16 10.820 -5.855 -12.441 1.00 23.42 H new ATOM 0 HG3 ARG A 16 11.906 -5.055 -13.560 1.00 23.42 H new ATOM 0 HD2 ARG A 16 12.180 -8.030 -13.209 1.00 13.53 H new ATOM 0 HD3 ARG A 16 10.803 -7.433 -14.112 1.00 13.53 H new ATOM 0 HE ARG A 16 13.001 -6.081 -15.196 1.00 21.32 H new ATOM 0 HH11 ARG A 16 12.002 -9.434 -14.720 1.00 40.40 H new ATOM 0 HH12 ARG A 16 12.870 -10.017 -16.145 1.00 40.40 H new ATOM 0 HH21 ARG A 16 14.112 -6.836 -17.025 1.00 34.01 H new ATOM 0 HH22 ARG A 16 14.060 -8.552 -17.445 1.00 34.01 H new ATOM 278 N LEU A 17 14.140 -8.121 -9.708 1.00 73.54 N ATOM 279 CA LEU A 17 14.792 -9.412 -9.515 1.00 43.23 C ATOM 280 C LEU A 17 13.795 -10.459 -9.031 1.00 21.34 C ATOM 281 O LEU A 17 13.939 -11.649 -9.317 1.00 2.32 O ATOM 282 CB LEU A 17 15.939 -9.280 -8.512 1.00 23.32 C ATOM 283 CG LEU A 17 17.135 -8.441 -8.965 1.00 33.31 C ATOM 284 CD1 LEU A 17 17.965 -8.005 -7.768 1.00 11.12 C ATOM 285 CD2 LEU A 17 17.989 -9.221 -9.953 1.00 45.04 C ATOM 0 H LEU A 17 14.603 -7.340 -9.242 1.00 73.54 H new ATOM 0 HA LEU A 17 15.193 -9.737 -10.475 1.00 43.23 H new ATOM 0 HB2 LEU A 17 15.544 -8.846 -7.594 1.00 23.32 H new ATOM 0 HB3 LEU A 17 16.295 -10.280 -8.264 1.00 23.32 H new ATOM 0 HG LEU A 17 16.760 -7.548 -9.465 1.00 33.31 H new ATOM 0 HD11 LEU A 17 18.811 -7.409 -8.110 1.00 11.12 H new ATOM 0 HD12 LEU A 17 17.349 -7.408 -7.096 1.00 11.12 H new ATOM 0 HD13 LEU A 17 18.331 -8.885 -7.239 1.00 11.12 H new ATOM 0 HD21 LEU A 17 18.835 -8.609 -10.265 1.00 45.04 H new ATOM 0 HD22 LEU A 17 18.355 -10.131 -9.478 1.00 45.04 H new ATOM 0 HD23 LEU A 17 17.390 -9.482 -10.825 1.00 45.04 H new ATOM 297 N LEU A 18 12.783 -10.010 -8.297 1.00 53.13 N ATOM 298 CA LEU A 18 11.759 -10.908 -7.774 1.00 51.04 C ATOM 299 C LEU A 18 11.059 -11.654 -8.906 1.00 42.21 C ATOM 300 O LEU A 18 10.680 -12.814 -8.755 1.00 75.50 O ATOM 301 CB LEU A 18 10.733 -10.122 -6.955 1.00 63.24 C ATOM 302 CG LEU A 18 11.059 -9.935 -5.473 1.00 62.02 C ATOM 303 CD1 LEU A 18 12.395 -9.228 -5.306 1.00 23.34 C ATOM 304 CD2 LEU A 18 9.951 -9.157 -4.778 1.00 24.33 C ATOM 0 H LEU A 18 12.649 -9.029 -8.050 1.00 53.13 H new ATOM 0 HA LEU A 18 12.247 -11.639 -7.129 1.00 51.04 H new ATOM 0 HB2 LEU A 18 10.614 -9.137 -7.407 1.00 63.24 H new ATOM 0 HB3 LEU A 18 9.771 -10.628 -7.034 1.00 63.24 H new ATOM 0 HG LEU A 18 11.131 -10.919 -5.009 1.00 62.02 H new ATOM 0 HD11 LEU A 18 12.611 -9.103 -4.245 1.00 23.34 H new ATOM 0 HD12 LEU A 18 13.182 -9.823 -5.769 1.00 23.34 H new ATOM 0 HD13 LEU A 18 12.351 -8.250 -5.785 1.00 23.34 H new ATOM 0 HD21 LEU A 18 10.199 -9.033 -3.724 1.00 24.33 H new ATOM 0 HD22 LEU A 18 9.847 -8.177 -5.244 1.00 24.33 H new ATOM 0 HD23 LEU A 18 9.012 -9.703 -4.868 1.00 24.33 H new ATOM 316 N GLU A 19 10.894 -10.979 -10.040 1.00 24.23 N ATOM 317 CA GLU A 19 10.242 -11.580 -11.197 1.00 54.41 C ATOM 318 C GLU A 19 10.914 -12.895 -11.580 1.00 2.05 C ATOM 319 O GLU A 19 10.254 -13.835 -12.020 1.00 62.43 O ATOM 320 CB GLU A 19 10.271 -10.615 -12.384 1.00 61.05 C ATOM 321 CG GLU A 19 9.488 -9.335 -12.148 1.00 54.22 C ATOM 322 CD GLU A 19 8.308 -9.190 -13.090 1.00 63.13 C ATOM 323 OE1 GLU A 19 7.650 -10.212 -13.376 1.00 54.04 O ATOM 324 OE2 GLU A 19 8.044 -8.056 -13.542 1.00 23.34 O ATOM 0 H GLU A 19 11.203 -10.017 -10.181 1.00 24.23 H new ATOM 0 HA GLU A 19 9.206 -11.787 -10.930 1.00 54.41 H new ATOM 0 HB2 GLU A 19 11.307 -10.361 -12.609 1.00 61.05 H new ATOM 0 HB3 GLU A 19 9.869 -11.120 -13.262 1.00 61.05 H new ATOM 0 HG2 GLU A 19 9.130 -9.317 -11.118 1.00 54.22 H new ATOM 0 HG3 GLU A 19 10.152 -8.480 -12.270 1.00 54.22 H new ATOM 331 N GLN A 20 12.231 -12.951 -11.408 1.00 31.33 N ATOM 332 CA GLN A 20 12.993 -14.150 -11.736 1.00 20.30 C ATOM 333 C GLN A 20 12.686 -15.276 -10.754 1.00 23.20 C ATOM 334 O GLN A 20 12.822 -16.454 -11.084 1.00 34.42 O ATOM 335 CB GLN A 20 14.492 -13.845 -11.729 1.00 30.44 C ATOM 336 CG GLN A 20 15.365 -15.084 -11.843 1.00 64.33 C ATOM 337 CD GLN A 20 15.757 -15.649 -10.492 1.00 64.22 C ATOM 338 OE1 GLN A 20 15.786 -14.932 -9.491 1.00 74.53 O ATOM 339 NE2 GLN A 20 16.062 -16.941 -10.456 1.00 65.03 N ATOM 0 H GLN A 20 12.792 -12.181 -11.044 1.00 31.33 H new ATOM 0 HA GLN A 20 12.700 -14.474 -12.735 1.00 20.30 H new ATOM 0 HB2 GLN A 20 14.721 -13.172 -12.555 1.00 30.44 H new ATOM 0 HB3 GLN A 20 14.743 -13.317 -10.809 1.00 30.44 H new ATOM 0 HG2 GLN A 20 14.833 -15.847 -12.411 1.00 64.33 H new ATOM 0 HG3 GLN A 20 16.266 -14.838 -12.405 1.00 64.33 H new ATOM 0 HE21 GLN A 20 16.025 -17.498 -11.310 1.00 65.03 H new ATOM 0 HE22 GLN A 20 16.334 -17.377 -9.575 1.00 65.03 H new ATOM 348 N TRP A 21 12.273 -14.906 -9.547 1.00 43.44 N ATOM 349 CA TRP A 21 11.948 -15.885 -8.517 1.00 32.21 C ATOM 350 C TRP A 21 10.913 -16.884 -9.023 1.00 63.31 C ATOM 351 O TRP A 21 11.002 -18.079 -8.741 1.00 12.43 O ATOM 352 CB TRP A 21 11.425 -15.182 -7.263 1.00 62.20 C ATOM 353 CG TRP A 21 11.609 -15.986 -6.011 1.00 74.14 C ATOM 354 CD1 TRP A 21 10.627 -16.433 -5.173 1.00 43.40 C ATOM 355 CD2 TRP A 21 12.849 -16.437 -5.456 1.00 40.24 C ATOM 356 NE1 TRP A 21 11.183 -17.134 -4.130 1.00 41.31 N ATOM 357 CE2 TRP A 21 12.544 -17.151 -4.281 1.00 64.53 C ATOM 358 CE3 TRP A 21 14.187 -16.308 -5.839 1.00 30.14 C ATOM 359 CZ2 TRP A 21 13.530 -17.733 -3.487 1.00 54.54 C ATOM 360 CZ3 TRP A 21 15.164 -16.885 -5.049 1.00 74.14 C ATOM 361 CH2 TRP A 21 14.831 -17.591 -3.885 1.00 42.33 C ATOM 0 H TRP A 21 12.155 -13.935 -9.258 1.00 43.44 H new ATOM 0 HA TRP A 21 12.859 -16.429 -8.267 1.00 32.21 H new ATOM 0 HB2 TRP A 21 11.937 -14.226 -7.151 1.00 62.20 H new ATOM 0 HB3 TRP A 21 10.365 -14.963 -7.393 1.00 62.20 H new ATOM 0 HD1 TRP A 21 9.570 -16.261 -5.310 1.00 43.40 H new ATOM 0 HE1 TRP A 21 10.666 -17.571 -3.367 1.00 41.31 H new ATOM 0 HE3 TRP A 21 14.453 -15.768 -6.735 1.00 30.14 H new ATOM 0 HZ2 TRP A 21 13.276 -18.277 -2.589 1.00 54.54 H new ATOM 0 HZ3 TRP A 21 16.201 -16.790 -5.334 1.00 74.14 H new ATOM 0 HH2 TRP A 21 15.617 -18.032 -3.290 1.00 42.33 H new ATOM 372 N GLU A 22 9.934 -16.387 -9.772 1.00 73.51 N ATOM 373 CA GLU A 22 8.882 -17.239 -10.316 1.00 44.34 C ATOM 374 C GLU A 22 9.462 -18.269 -11.281 1.00 72.41 C ATOM 375 O GLU A 22 9.503 -19.463 -10.982 1.00 10.02 O ATOM 376 CB GLU A 22 7.828 -16.391 -11.031 1.00 61.03 C ATOM 377 CG GLU A 22 6.644 -16.024 -10.153 1.00 31.33 C ATOM 378 CD GLU A 22 7.052 -15.241 -8.920 1.00 42.45 C ATOM 379 OE1 GLU A 22 8.071 -14.521 -8.986 1.00 70.15 O ATOM 380 OE2 GLU A 22 6.354 -15.347 -7.891 1.00 10.32 O ATOM 0 H GLU A 22 9.847 -15.400 -10.016 1.00 73.51 H new ATOM 0 HA GLU A 22 8.412 -17.767 -9.487 1.00 44.34 H new ATOM 0 HB2 GLU A 22 8.296 -15.477 -11.396 1.00 61.03 H new ATOM 0 HB3 GLU A 22 7.467 -16.935 -11.904 1.00 61.03 H new ATOM 0 HG2 GLU A 22 5.934 -15.435 -10.734 1.00 31.33 H new ATOM 0 HG3 GLU A 22 6.128 -16.934 -9.847 1.00 31.33 H new ATOM 387 N LYS A 23 9.908 -17.800 -12.441 1.00 43.21 N ATOM 388 CA LYS A 23 10.486 -18.678 -13.451 1.00 63.22 C ATOM 389 C LYS A 23 9.455 -19.684 -13.952 1.00 31.42 C ATOM 390 O LYS A 23 9.806 -20.772 -14.410 1.00 43.55 O ATOM 391 CB LYS A 23 11.700 -19.416 -12.881 1.00 35.31 C ATOM 392 CG LYS A 23 12.633 -19.965 -13.946 1.00 24.04 C ATOM 393 CD LYS A 23 13.347 -21.219 -13.469 1.00 32.10 C ATOM 394 CE LYS A 23 12.496 -22.461 -13.687 1.00 22.14 C ATOM 395 NZ LYS A 23 11.877 -22.939 -12.419 1.00 4.40 N ATOM 0 H LYS A 23 9.880 -16.815 -12.705 1.00 43.21 H new ATOM 0 HA LYS A 23 10.805 -18.062 -14.292 1.00 63.22 H new ATOM 0 HB2 LYS A 23 12.258 -18.737 -12.236 1.00 35.31 H new ATOM 0 HB3 LYS A 23 11.354 -20.238 -12.254 1.00 35.31 H new ATOM 0 HG2 LYS A 23 12.064 -20.190 -14.848 1.00 24.04 H new ATOM 0 HG3 LYS A 23 13.368 -19.206 -14.213 1.00 24.04 H new ATOM 0 HD2 LYS A 23 14.292 -21.326 -14.002 1.00 32.10 H new ATOM 0 HD3 LYS A 23 13.587 -21.122 -12.410 1.00 32.10 H new ATOM 0 HE2 LYS A 23 11.713 -22.242 -14.413 1.00 22.14 H new ATOM 0 HE3 LYS A 23 13.112 -23.254 -14.112 1.00 22.14 H new ATOM 0 HZ1 LYS A 23 11.599 -23.936 -12.523 1.00 4.40 H new ATOM 0 HZ2 LYS A 23 12.563 -22.850 -11.643 1.00 4.40 H new ATOM 0 HZ3 LYS A 23 11.036 -22.365 -12.205 1.00 4.40 H new ATOM 409 N ASP A 24 8.182 -19.314 -13.862 1.00 23.52 N ATOM 410 CA ASP A 24 7.100 -20.184 -14.308 1.00 51.11 C ATOM 411 C ASP A 24 7.015 -20.208 -15.831 1.00 64.50 C ATOM 412 O ASP A 24 6.547 -21.182 -16.421 1.00 55.00 O ATOM 413 CB ASP A 24 5.767 -19.719 -13.718 1.00 45.04 C ATOM 414 CG ASP A 24 5.288 -20.615 -12.594 1.00 32.42 C ATOM 415 OD1 ASP A 24 6.139 -21.111 -11.826 1.00 32.14 O ATOM 416 OD2 ASP A 24 4.061 -20.821 -12.481 1.00 43.53 O ATOM 0 H ASP A 24 7.874 -18.418 -13.484 1.00 23.52 H new ATOM 0 HA ASP A 24 7.311 -21.194 -13.958 1.00 51.11 H new ATOM 0 HB2 ASP A 24 5.873 -18.700 -13.346 1.00 45.04 H new ATOM 0 HB3 ASP A 24 5.013 -19.694 -14.505 1.00 45.04 H new ATOM 421 N ASP A 25 7.471 -19.131 -16.461 1.00 63.50 N ATOM 422 CA ASP A 25 7.447 -19.029 -17.916 1.00 24.15 C ATOM 423 C ASP A 25 6.018 -19.106 -18.442 1.00 72.13 C ATOM 424 O ASP A 25 5.743 -19.801 -19.420 1.00 73.43 O ATOM 425 CB ASP A 25 8.295 -20.139 -18.540 1.00 53.32 C ATOM 426 CG ASP A 25 8.871 -19.740 -19.885 1.00 13.13 C ATOM 427 OD1 ASP A 25 9.765 -18.869 -19.912 1.00 12.22 O ATOM 428 OD2 ASP A 25 8.427 -20.298 -20.910 1.00 33.41 O ATOM 0 H ASP A 25 7.862 -18.316 -15.987 1.00 63.50 H new ATOM 0 HA ASP A 25 7.866 -18.062 -18.195 1.00 24.15 H new ATOM 0 HB2 ASP A 25 9.108 -20.396 -17.861 1.00 53.32 H new ATOM 0 HB3 ASP A 25 7.685 -21.034 -18.660 1.00 53.32 H new ATOM 433 N ASP A 26 5.112 -18.389 -17.787 1.00 50.40 N ATOM 434 CA ASP A 26 3.710 -18.375 -18.189 1.00 62.51 C ATOM 435 C ASP A 26 3.552 -17.794 -19.591 1.00 23.24 C ATOM 436 O ASP A 26 2.703 -18.237 -20.364 1.00 51.35 O ATOM 437 CB ASP A 26 2.879 -17.567 -17.192 1.00 20.14 C ATOM 438 CG ASP A 26 1.404 -17.912 -17.253 1.00 61.14 C ATOM 439 OD1 ASP A 26 1.081 -19.090 -17.511 1.00 21.43 O ATOM 440 OD2 ASP A 26 0.573 -17.003 -17.045 1.00 74.54 O ATOM 0 H ASP A 26 5.323 -17.809 -16.975 1.00 50.40 H new ATOM 0 HA ASP A 26 3.351 -19.404 -18.199 1.00 62.51 H new ATOM 0 HB2 ASP A 26 3.250 -17.748 -16.183 1.00 20.14 H new ATOM 0 HB3 ASP A 26 3.009 -16.504 -17.393 1.00 20.14 H new ATOM 445 N ILE A 27 4.375 -16.801 -19.910 1.00 13.55 N ATOM 446 CA ILE A 27 4.326 -16.159 -21.218 1.00 31.15 C ATOM 447 C ILE A 27 5.109 -16.960 -22.252 1.00 44.01 C ATOM 448 O ILE A 27 5.743 -17.962 -21.925 1.00 23.45 O ATOM 449 CB ILE A 27 4.886 -14.726 -21.163 1.00 1.41 C ATOM 450 CG1 ILE A 27 6.318 -14.734 -20.622 1.00 75.34 C ATOM 451 CG2 ILE A 27 3.995 -13.841 -20.304 1.00 21.14 C ATOM 452 CD1 ILE A 27 7.333 -14.174 -21.593 1.00 3.41 C ATOM 0 H ILE A 27 5.084 -16.424 -19.281 1.00 13.55 H new ATOM 0 HA ILE A 27 3.277 -16.119 -21.511 1.00 31.15 H new ATOM 0 HB ILE A 27 4.902 -14.320 -22.174 1.00 1.41 H new ATOM 0 HG12 ILE A 27 6.352 -14.155 -19.699 1.00 75.34 H new ATOM 0 HG13 ILE A 27 6.596 -15.757 -20.368 1.00 75.34 H new ATOM 0 HG21 ILE A 27 4.404 -12.831 -20.275 1.00 21.14 H new ATOM 0 HG22 ILE A 27 2.991 -13.814 -20.729 1.00 21.14 H new ATOM 0 HG23 ILE A 27 3.950 -14.243 -19.292 1.00 21.14 H new ATOM 0 HD11 ILE A 27 8.325 -14.211 -21.143 1.00 3.41 H new ATOM 0 HD12 ILE A 27 7.327 -14.767 -22.508 1.00 3.41 H new ATOM 0 HD13 ILE A 27 7.079 -13.140 -21.829 1.00 3.41 H new ATOM 1035 N THR A 64 19.040 4.098 -23.705 1.00 40.52 N ATOM 1036 CA THR A 64 17.731 4.587 -23.290 1.00 70.52 C ATOM 1037 C THR A 64 17.105 3.664 -22.250 1.00 53.44 C ATOM 1038 O THR A 64 17.605 2.568 -21.996 1.00 4.22 O ATOM 1039 CB THR A 64 16.773 4.715 -24.490 1.00 20.43 C ATOM 1040 OG1 THR A 64 15.549 5.332 -24.075 1.00 61.25 O ATOM 1041 CG2 THR A 64 16.479 3.351 -25.096 1.00 23.54 C ATOM 0 HA THR A 64 17.885 5.573 -22.851 1.00 70.52 H new ATOM 0 HB THR A 64 17.254 5.335 -25.247 1.00 20.43 H new ATOM 0 HG1 THR A 64 14.946 5.412 -24.843 1.00 61.25 H new ATOM 0 HG21 THR A 64 15.801 3.467 -25.941 1.00 23.54 H new ATOM 0 HG22 THR A 64 17.409 2.896 -25.437 1.00 23.54 H new ATOM 0 HG23 THR A 64 16.016 2.711 -24.345 1.00 23.54 H new ATOM 1049 N LEU A 65 16.007 4.114 -21.653 1.00 10.04 N ATOM 1050 CA LEU A 65 15.311 3.328 -20.640 1.00 12.13 C ATOM 1051 C LEU A 65 13.856 3.097 -21.035 1.00 13.24 C ATOM 1052 O LEU A 65 13.088 4.045 -21.194 1.00 13.53 O ATOM 1053 CB LEU A 65 15.377 4.033 -19.284 1.00 5.31 C ATOM 1054 CG LEU A 65 14.515 3.434 -18.172 1.00 64.34 C ATOM 1055 CD1 LEU A 65 15.391 2.852 -17.073 1.00 15.41 C ATOM 1056 CD2 LEU A 65 13.570 4.483 -17.606 1.00 3.14 C ATOM 0 H LEU A 65 15.580 5.018 -21.853 1.00 10.04 H new ATOM 0 HA LEU A 65 15.806 2.360 -20.564 1.00 12.13 H new ATOM 0 HB2 LEU A 65 16.414 4.037 -18.950 1.00 5.31 H new ATOM 0 HB3 LEU A 65 15.083 5.073 -19.423 1.00 5.31 H new ATOM 0 HG LEU A 65 13.917 2.628 -18.596 1.00 64.34 H new ATOM 0 HD11 LEU A 65 14.761 2.430 -16.290 1.00 15.41 H new ATOM 0 HD12 LEU A 65 16.025 2.069 -17.489 1.00 15.41 H new ATOM 0 HD13 LEU A 65 16.016 3.639 -16.651 1.00 15.41 H new ATOM 0 HD21 LEU A 65 12.964 4.039 -16.816 1.00 3.14 H new ATOM 0 HD22 LEU A 65 14.149 5.311 -17.197 1.00 3.14 H new ATOM 0 HD23 LEU A 65 12.919 4.851 -18.399 1.00 3.14 H new ATOM 1068 N MET A 66 13.484 1.831 -21.189 1.00 73.31 N ATOM 1069 CA MET A 66 12.119 1.475 -21.562 1.00 3.50 C ATOM 1070 C MET A 66 11.864 -0.012 -21.338 1.00 44.24 C ATOM 1071 O MET A 66 12.502 -0.860 -21.961 1.00 72.51 O ATOM 1072 CB MET A 66 11.858 1.835 -23.026 1.00 12.23 C ATOM 1073 CG MET A 66 10.390 1.765 -23.416 1.00 3.32 C ATOM 1074 SD MET A 66 10.033 2.660 -24.940 1.00 64.43 S ATOM 1075 CE MET A 66 8.952 3.950 -24.330 1.00 53.34 C ATOM 0 H MET A 66 14.108 1.034 -21.061 1.00 73.31 H new ATOM 0 HA MET A 66 11.436 2.041 -20.929 1.00 3.50 H new ATOM 0 HB2 MET A 66 12.228 2.842 -23.216 1.00 12.23 H new ATOM 0 HB3 MET A 66 12.428 1.160 -23.665 1.00 12.23 H new ATOM 0 HG2 MET A 66 10.099 0.721 -23.535 1.00 3.32 H new ATOM 0 HG3 MET A 66 9.783 2.174 -22.608 1.00 3.32 H new ATOM 0 HE1 MET A 66 8.858 4.733 -25.083 1.00 53.34 H new ATOM 0 HE2 MET A 66 7.968 3.531 -24.118 1.00 53.34 H new ATOM 0 HE3 MET A 66 9.370 4.373 -23.417 1.00 53.34 H new ATOM 1085 N MET A 67 10.929 -0.320 -20.446 1.00 2.32 N ATOM 1086 CA MET A 67 10.590 -1.705 -20.141 1.00 63.05 C ATOM 1087 C MET A 67 9.166 -1.811 -19.606 1.00 72.35 C ATOM 1088 O MET A 67 8.720 -0.968 -18.828 1.00 51.12 O ATOM 1089 CB MET A 67 11.575 -2.281 -19.122 1.00 33.21 C ATOM 1090 CG MET A 67 11.625 -3.800 -19.117 1.00 33.41 C ATOM 1091 SD MET A 67 12.923 -4.449 -18.046 1.00 75.13 S ATOM 1092 CE MET A 67 14.372 -3.689 -18.773 1.00 64.11 C ATOM 0 H MET A 67 10.392 0.371 -19.921 1.00 2.32 H new ATOM 0 HA MET A 67 10.656 -2.281 -21.064 1.00 63.05 H new ATOM 0 HB2 MET A 67 12.572 -1.894 -19.333 1.00 33.21 H new ATOM 0 HB3 MET A 67 11.301 -1.931 -18.127 1.00 33.21 H new ATOM 0 HG2 MET A 67 10.661 -4.190 -18.791 1.00 33.41 H new ATOM 0 HG3 MET A 67 11.786 -4.158 -20.134 1.00 33.41 H new ATOM 0 HE1 MET A 67 15.075 -4.464 -19.079 1.00 64.11 H new ATOM 0 HE2 MET A 67 14.077 -3.103 -19.643 1.00 64.11 H new ATOM 0 HE3 MET A 67 14.847 -3.037 -18.040 1.00 64.11 H new ATOM 1102 N PHE A 68 8.456 -2.852 -20.029 1.00 30.42 N ATOM 1103 CA PHE A 68 7.081 -3.068 -19.593 1.00 2.21 C ATOM 1104 C PHE A 68 6.804 -4.553 -19.382 1.00 72.42 C ATOM 1105 O PHE A 68 6.916 -5.355 -20.310 1.00 34.11 O ATOM 1106 CB PHE A 68 6.102 -2.495 -20.620 1.00 63.42 C ATOM 1107 CG PHE A 68 6.477 -1.124 -21.106 1.00 32.32 C ATOM 1108 CD1 PHE A 68 6.384 -0.028 -20.264 1.00 43.41 C ATOM 1109 CD2 PHE A 68 6.922 -0.932 -22.404 1.00 31.22 C ATOM 1110 CE1 PHE A 68 6.727 1.235 -20.709 1.00 5.22 C ATOM 1111 CE2 PHE A 68 7.267 0.328 -22.854 1.00 40.30 C ATOM 1112 CZ PHE A 68 7.171 1.413 -22.005 1.00 14.21 C ATOM 0 H PHE A 68 8.810 -3.559 -20.673 1.00 30.42 H new ATOM 0 HA PHE A 68 6.942 -2.553 -18.643 1.00 2.21 H new ATOM 0 HB2 PHE A 68 6.046 -3.171 -21.473 1.00 63.42 H new ATOM 0 HB3 PHE A 68 5.106 -2.455 -20.178 1.00 63.42 H new ATOM 0 HD1 PHE A 68 6.040 -0.162 -19.249 1.00 43.41 H new ATOM 0 HD2 PHE A 68 7.000 -1.777 -23.072 1.00 31.22 H new ATOM 0 HE1 PHE A 68 6.648 2.082 -20.044 1.00 5.22 H new ATOM 0 HE2 PHE A 68 7.611 0.464 -23.869 1.00 40.30 H new ATOM 0 HZ PHE A 68 7.442 2.399 -22.353 1.00 14.21 H new ATOM 1122 N VAL A 69 6.442 -4.914 -18.155 1.00 0.41 N ATOM 1123 CA VAL A 69 6.148 -6.302 -17.821 1.00 70.10 C ATOM 1124 C VAL A 69 5.032 -6.394 -16.786 1.00 5.01 C ATOM 1125 O VAL A 69 4.863 -5.499 -15.957 1.00 24.01 O ATOM 1126 CB VAL A 69 7.396 -7.026 -17.281 1.00 14.33 C ATOM 1127 CG1 VAL A 69 7.124 -8.514 -17.126 1.00 24.43 C ATOM 1128 CG2 VAL A 69 8.588 -6.785 -18.194 1.00 40.11 C ATOM 0 H VAL A 69 6.345 -4.263 -17.375 1.00 0.41 H new ATOM 0 HA VAL A 69 5.826 -6.788 -18.742 1.00 70.10 H new ATOM 0 HB VAL A 69 7.634 -6.620 -16.298 1.00 14.33 H new ATOM 0 HG11 VAL A 69 8.017 -9.009 -16.744 1.00 24.43 H new ATOM 0 HG12 VAL A 69 6.300 -8.662 -16.428 1.00 24.43 H new ATOM 0 HG13 VAL A 69 6.861 -8.939 -18.095 1.00 24.43 H new ATOM 0 HG21 VAL A 69 9.461 -7.304 -17.797 1.00 40.11 H new ATOM 0 HG22 VAL A 69 8.364 -7.162 -19.192 1.00 40.11 H new ATOM 0 HG23 VAL A 69 8.795 -5.716 -18.248 1.00 40.11 H new ATOM 1138 N THR A 70 4.272 -7.483 -16.839 1.00 31.25 N ATOM 1139 CA THR A 70 3.172 -7.693 -15.906 1.00 55.22 C ATOM 1140 C THR A 70 2.639 -9.118 -15.996 1.00 21.43 C ATOM 1141 O THR A 70 1.587 -9.363 -16.587 1.00 64.11 O ATOM 1142 CB THR A 70 2.017 -6.708 -16.170 1.00 33.12 C ATOM 1143 OG1 THR A 70 0.864 -7.091 -15.411 1.00 51.34 O ATOM 1144 CG2 THR A 70 1.666 -6.669 -17.650 1.00 2.44 C ATOM 0 H THR A 70 4.398 -8.233 -17.518 1.00 31.25 H new ATOM 0 HA THR A 70 3.568 -7.519 -14.906 1.00 55.22 H new ATOM 0 HB THR A 70 2.340 -5.713 -15.863 1.00 33.12 H new ATOM 0 HG1 THR A 70 0.553 -7.971 -15.710 1.00 51.34 H new ATOM 0 HG21 THR A 70 0.848 -5.967 -17.812 1.00 2.44 H new ATOM 0 HG22 THR A 70 2.537 -6.349 -18.222 1.00 2.44 H new ATOM 0 HG23 THR A 70 1.361 -7.663 -17.978 1.00 2.44 H new ATOM 1152 N VAL A 71 3.371 -10.057 -15.404 1.00 44.11 N ATOM 1153 CA VAL A 71 2.971 -11.459 -15.416 1.00 4.14 C ATOM 1154 C VAL A 71 3.918 -12.307 -14.574 1.00 20.31 C ATOM 1155 O VAL A 71 5.043 -11.899 -14.284 1.00 74.01 O ATOM 1156 CB VAL A 71 2.934 -12.020 -16.849 1.00 61.34 C ATOM 1157 CG1 VAL A 71 4.345 -12.244 -17.372 1.00 52.35 C ATOM 1158 CG2 VAL A 71 2.129 -13.310 -16.895 1.00 60.23 C ATOM 0 H VAL A 71 4.244 -9.872 -14.910 1.00 44.11 H new ATOM 0 HA VAL A 71 1.969 -11.506 -14.990 1.00 4.14 H new ATOM 0 HB VAL A 71 2.445 -11.290 -17.494 1.00 61.34 H new ATOM 0 HG11 VAL A 71 4.298 -12.641 -18.386 1.00 52.35 H new ATOM 0 HG12 VAL A 71 4.886 -11.298 -17.377 1.00 52.35 H new ATOM 0 HG13 VAL A 71 4.863 -12.954 -16.728 1.00 52.35 H new ATOM 0 HG21 VAL A 71 2.113 -13.693 -17.915 1.00 60.23 H new ATOM 0 HG22 VAL A 71 2.587 -14.049 -16.237 1.00 60.23 H new ATOM 0 HG23 VAL A 71 1.109 -13.114 -16.565 1.00 60.23 H new ATOM 1168 N SER A 72 3.455 -13.491 -14.184 1.00 43.15 N ATOM 1169 CA SER A 72 4.260 -14.397 -13.373 1.00 14.33 C ATOM 1170 C SER A 72 5.260 -15.158 -14.237 1.00 75.34 C ATOM 1171 O SER A 72 4.946 -15.569 -15.354 1.00 13.12 O ATOM 1172 CB SER A 72 3.359 -15.383 -12.626 1.00 53.43 C ATOM 1173 OG SER A 72 2.440 -16.003 -13.509 1.00 63.21 O ATOM 0 H SER A 72 2.527 -13.845 -14.417 1.00 43.15 H new ATOM 0 HA SER A 72 4.814 -13.801 -12.648 1.00 14.33 H new ATOM 0 HB2 SER A 72 3.971 -16.143 -12.140 1.00 53.43 H new ATOM 0 HB3 SER A 72 2.816 -14.860 -11.839 1.00 53.43 H new ATOM 0 HG SER A 72 1.877 -16.630 -13.008 1.00 63.21 H new ATOM 1179 N GLY A 73 6.467 -15.343 -13.712 1.00 31.02 N ATOM 1180 CA GLY A 73 7.495 -16.054 -14.448 1.00 65.40 C ATOM 1181 C GLY A 73 8.277 -15.146 -15.377 1.00 30.34 C ATOM 1182 O GLY A 73 7.763 -14.710 -16.406 1.00 3.55 O ATOM 0 H GLY A 73 6.751 -15.013 -12.790 1.00 31.02 H new ATOM 0 HA2 GLY A 73 8.181 -16.526 -13.744 1.00 65.40 H new ATOM 0 HA3 GLY A 73 7.035 -16.853 -15.029 1.00 65.40 H new ATOM 1186 N ASN A 74 9.523 -14.860 -15.012 1.00 15.02 N ATOM 1187 CA ASN A 74 10.376 -13.996 -15.819 1.00 52.51 C ATOM 1188 C ASN A 74 11.808 -14.001 -15.293 1.00 41.35 C ATOM 1189 O ASN A 74 12.262 -13.056 -14.648 1.00 2.12 O ATOM 1190 CB ASN A 74 9.829 -12.567 -15.826 1.00 55.24 C ATOM 1191 CG ASN A 74 10.185 -11.818 -17.096 1.00 1.42 C ATOM 1192 OD1 ASN A 74 10.777 -10.739 -17.048 1.00 33.01 O ATOM 1193 ND2 ASN A 74 9.825 -12.388 -18.240 1.00 3.31 N ATOM 0 H ASN A 74 9.964 -15.214 -14.163 1.00 15.02 H new ATOM 0 HA ASN A 74 10.380 -14.382 -16.839 1.00 52.51 H new ATOM 0 HB2 ASN A 74 8.745 -12.595 -15.716 1.00 55.24 H new ATOM 0 HB3 ASN A 74 10.223 -12.026 -14.966 1.00 55.24 H new ATOM 0 HD21 ASN A 74 10.038 -11.931 -19.127 1.00 3.31 H new ATOM 0 HD22 ASN A 74 9.336 -13.283 -18.232 1.00 3.31 H new ATOM 1200 N PRO A 75 12.538 -15.090 -15.576 1.00 41.22 N ATOM 1201 CA PRO A 75 13.930 -15.244 -15.143 1.00 31.34 C ATOM 1202 C PRO A 75 14.874 -14.300 -15.878 1.00 45.03 C ATOM 1203 O PRO A 75 15.575 -14.704 -16.807 1.00 54.04 O ATOM 1204 CB PRO A 75 14.251 -16.700 -15.491 1.00 55.12 C ATOM 1205 CG PRO A 75 13.318 -17.038 -16.603 1.00 11.53 C ATOM 1206 CD PRO A 75 12.061 -16.254 -16.341 1.00 63.14 C ATOM 0 HA PRO A 75 14.057 -15.006 -14.087 1.00 31.34 H new ATOM 0 HB2 PRO A 75 15.291 -16.814 -15.798 1.00 55.12 H new ATOM 0 HB3 PRO A 75 14.098 -17.355 -14.633 1.00 55.12 H new ATOM 0 HG2 PRO A 75 13.749 -16.773 -17.568 1.00 11.53 H new ATOM 0 HG3 PRO A 75 13.112 -18.108 -16.628 1.00 11.53 H new ATOM 0 HD2 PRO A 75 11.574 -15.953 -17.269 1.00 63.14 H new ATOM 0 HD3 PRO A 75 11.335 -16.837 -15.775 1.00 63.14 H new ATOM 1214 N THR A 76 14.890 -13.039 -15.457 1.00 22.10 N ATOM 1215 CA THR A 76 15.748 -12.037 -16.076 1.00 64.02 C ATOM 1216 C THR A 76 16.421 -11.163 -15.024 1.00 12.12 C ATOM 1217 O THR A 76 16.603 -9.963 -15.226 1.00 12.25 O ATOM 1218 CB THR A 76 14.955 -11.138 -17.043 1.00 51.01 C ATOM 1219 OG1 THR A 76 13.695 -11.743 -17.352 1.00 74.43 O ATOM 1220 CG2 THR A 76 15.737 -10.900 -18.326 1.00 22.11 C ATOM 0 H THR A 76 14.318 -12.688 -14.689 1.00 22.10 H new ATOM 0 HA THR A 76 16.510 -12.578 -16.637 1.00 64.02 H new ATOM 0 HB THR A 76 14.787 -10.178 -16.556 1.00 51.01 H new ATOM 0 HG1 THR A 76 13.196 -11.164 -17.966 1.00 74.43 H new ATOM 0 HG21 THR A 76 15.157 -10.263 -18.993 1.00 22.11 H new ATOM 0 HG22 THR A 76 16.683 -10.413 -18.090 1.00 22.11 H new ATOM 0 HG23 THR A 76 15.933 -11.854 -18.815 1.00 22.11 H new ATOM 1228 N GLU A 77 16.788 -11.773 -13.901 1.00 43.03 N ATOM 1229 CA GLU A 77 17.441 -11.048 -12.817 1.00 60.33 C ATOM 1230 C GLU A 77 18.633 -10.249 -13.337 1.00 74.21 C ATOM 1231 O GLU A 77 18.848 -9.104 -12.940 1.00 11.11 O ATOM 1232 CB GLU A 77 17.901 -12.020 -11.728 1.00 74.15 C ATOM 1233 CG GLU A 77 18.622 -13.243 -12.269 1.00 73.43 C ATOM 1234 CD GLU A 77 19.176 -14.128 -11.169 1.00 52.23 C ATOM 1235 OE1 GLU A 77 19.954 -13.619 -10.335 1.00 52.22 O ATOM 1236 OE2 GLU A 77 18.832 -15.328 -11.142 1.00 43.14 O ATOM 0 H GLU A 77 16.644 -12.766 -13.718 1.00 43.03 H new ATOM 0 HA GLU A 77 16.717 -10.353 -12.392 1.00 60.33 H new ATOM 0 HB2 GLU A 77 18.562 -11.494 -11.039 1.00 74.15 H new ATOM 0 HB3 GLU A 77 17.034 -12.345 -11.153 1.00 74.15 H new ATOM 0 HG2 GLU A 77 17.934 -13.823 -12.885 1.00 73.43 H new ATOM 0 HG3 GLU A 77 19.437 -12.922 -12.917 1.00 73.43 H new ATOM 1243 N LYS A 78 19.405 -10.862 -14.228 1.00 11.10 N ATOM 1244 CA LYS A 78 20.575 -10.210 -14.804 1.00 52.22 C ATOM 1245 C LYS A 78 20.191 -8.891 -15.467 1.00 41.23 C ATOM 1246 O LYS A 78 20.841 -7.868 -15.255 1.00 51.42 O ATOM 1247 CB LYS A 78 21.246 -11.130 -15.826 1.00 72.41 C ATOM 1248 CG LYS A 78 20.295 -11.655 -16.889 1.00 4.43 C ATOM 1249 CD LYS A 78 20.949 -12.731 -17.739 1.00 34.43 C ATOM 1250 CE LYS A 78 19.915 -13.672 -18.338 1.00 35.20 C ATOM 1251 NZ LYS A 78 20.549 -14.851 -18.990 1.00 20.21 N ATOM 0 H LYS A 78 19.241 -11.810 -14.567 1.00 11.10 H new ATOM 0 HA LYS A 78 21.277 -10.000 -13.997 1.00 52.22 H new ATOM 0 HB2 LYS A 78 22.058 -10.589 -16.312 1.00 72.41 H new ATOM 0 HB3 LYS A 78 21.695 -11.974 -15.303 1.00 72.41 H new ATOM 0 HG2 LYS A 78 19.402 -12.059 -16.412 1.00 4.43 H new ATOM 0 HG3 LYS A 78 19.971 -10.833 -17.527 1.00 4.43 H new ATOM 0 HD2 LYS A 78 21.525 -12.265 -18.538 1.00 34.43 H new ATOM 0 HD3 LYS A 78 21.652 -13.300 -17.130 1.00 34.43 H new ATOM 0 HE2 LYS A 78 19.236 -14.011 -17.555 1.00 35.20 H new ATOM 0 HE3 LYS A 78 19.314 -13.132 -19.070 1.00 35.20 H new ATOM 0 HZ1 LYS A 78 19.811 -15.468 -19.386 1.00 20.21 H new ATOM 0 HZ2 LYS A 78 21.177 -14.529 -19.754 1.00 20.21 H new ATOM 0 HZ3 LYS A 78 21.102 -15.381 -18.287 1.00 20.21 H new ATOM 1265 N GLU A 79 19.131 -8.923 -16.269 1.00 42.11 N ATOM 1266 CA GLU A 79 18.662 -7.729 -16.962 1.00 12.21 C ATOM 1267 C GLU A 79 18.239 -6.653 -15.966 1.00 2.31 C ATOM 1268 O GLU A 79 18.408 -5.458 -16.215 1.00 30.41 O ATOM 1269 CB GLU A 79 17.490 -8.074 -17.884 1.00 24.23 C ATOM 1270 CG GLU A 79 17.915 -8.725 -19.190 1.00 31.05 C ATOM 1271 CD GLU A 79 16.932 -8.468 -20.316 1.00 24.23 C ATOM 1272 OE1 GLU A 79 15.836 -7.939 -20.036 1.00 71.55 O ATOM 1273 OE2 GLU A 79 17.259 -8.796 -21.475 1.00 45.13 O ATOM 0 H GLU A 79 18.581 -9.762 -16.455 1.00 42.11 H new ATOM 0 HA GLU A 79 19.485 -7.342 -17.562 1.00 12.21 H new ATOM 0 HB2 GLU A 79 16.810 -8.744 -17.358 1.00 24.23 H new ATOM 0 HB3 GLU A 79 16.933 -7.164 -18.106 1.00 24.23 H new ATOM 0 HG2 GLU A 79 18.897 -8.349 -19.477 1.00 31.05 H new ATOM 0 HG3 GLU A 79 18.017 -9.800 -19.040 1.00 31.05 H new ATOM 1280 N THR A 80 17.688 -7.084 -14.836 1.00 32.23 N ATOM 1281 CA THR A 80 17.239 -6.160 -13.802 1.00 41.44 C ATOM 1282 C THR A 80 18.340 -5.172 -13.433 1.00 12.30 C ATOM 1283 O THR A 80 18.146 -3.959 -13.504 1.00 2.32 O ATOM 1284 CB THR A 80 16.791 -6.909 -12.534 1.00 32.32 C ATOM 1285 OG1 THR A 80 15.866 -7.947 -12.879 1.00 4.02 O ATOM 1286 CG2 THR A 80 16.143 -5.955 -11.542 1.00 30.22 C ATOM 0 H THR A 80 17.542 -8.069 -14.613 1.00 32.23 H new ATOM 0 HA THR A 80 16.388 -5.616 -14.212 1.00 41.44 H new ATOM 0 HB THR A 80 17.673 -7.349 -12.068 1.00 32.32 H new ATOM 0 HG1 THR A 80 15.351 -8.203 -12.086 1.00 4.02 H new ATOM 0 HG21 THR A 80 15.835 -6.507 -10.654 1.00 30.22 H new ATOM 0 HG22 THR A 80 16.859 -5.183 -11.259 1.00 30.22 H new ATOM 0 HG23 THR A 80 15.271 -5.490 -12.001 1.00 30.22 H new ATOM 1294 N GLU A 81 19.495 -5.699 -13.039 1.00 73.53 N ATOM 1295 CA GLU A 81 20.626 -4.862 -12.659 1.00 21.13 C ATOM 1296 C GLU A 81 20.964 -3.868 -13.766 1.00 63.22 C ATOM 1297 O GLU A 81 21.289 -2.712 -13.498 1.00 65.20 O ATOM 1298 CB GLU A 81 21.848 -5.729 -12.345 1.00 52.54 C ATOM 1299 CG GLU A 81 21.552 -6.878 -11.397 1.00 74.21 C ATOM 1300 CD GLU A 81 22.811 -7.521 -10.849 1.00 34.14 C ATOM 1301 OE1 GLU A 81 23.451 -8.296 -11.589 1.00 62.23 O ATOM 1302 OE2 GLU A 81 23.155 -7.250 -9.679 1.00 41.35 O ATOM 0 H GLU A 81 19.672 -6.702 -12.975 1.00 73.53 H new ATOM 0 HA GLU A 81 20.347 -4.303 -11.766 1.00 21.13 H new ATOM 0 HB2 GLU A 81 22.247 -6.131 -13.276 1.00 52.54 H new ATOM 0 HB3 GLU A 81 22.626 -5.102 -11.910 1.00 52.54 H new ATOM 0 HG2 GLU A 81 20.945 -6.513 -10.569 1.00 74.21 H new ATOM 0 HG3 GLU A 81 20.961 -7.631 -11.918 1.00 74.21 H new ATOM 1309 N GLU A 82 20.885 -4.329 -15.011 1.00 3.42 N ATOM 1310 CA GLU A 82 21.184 -3.480 -16.159 1.00 23.43 C ATOM 1311 C GLU A 82 20.275 -2.255 -16.181 1.00 42.03 C ATOM 1312 O GLU A 82 20.595 -1.244 -16.807 1.00 53.30 O ATOM 1313 CB GLU A 82 21.026 -4.270 -17.460 1.00 23.45 C ATOM 1314 CG GLU A 82 22.272 -4.267 -18.329 1.00 24.01 C ATOM 1315 CD GLU A 82 22.092 -3.467 -19.604 1.00 40.41 C ATOM 1316 OE1 GLU A 82 22.173 -2.222 -19.541 1.00 34.24 O ATOM 1317 OE2 GLU A 82 21.870 -4.086 -20.666 1.00 5.40 O ATOM 0 H GLU A 82 20.617 -5.284 -15.250 1.00 3.42 H new ATOM 0 HA GLU A 82 22.217 -3.143 -16.070 1.00 23.43 H new ATOM 0 HB2 GLU A 82 20.763 -5.300 -17.220 1.00 23.45 H new ATOM 0 HB3 GLU A 82 20.195 -3.854 -18.029 1.00 23.45 H new ATOM 0 HG2 GLU A 82 23.106 -3.855 -17.761 1.00 24.01 H new ATOM 0 HG3 GLU A 82 22.536 -5.294 -18.583 1.00 24.01 H new ATOM 1324 N ILE A 83 19.142 -2.354 -15.495 1.00 53.02 N ATOM 1325 CA ILE A 83 18.187 -1.254 -15.436 1.00 33.41 C ATOM 1326 C ILE A 83 18.773 -0.056 -14.698 1.00 4.13 C ATOM 1327 O ILE A 83 18.572 1.092 -15.095 1.00 14.33 O ATOM 1328 CB ILE A 83 16.880 -1.681 -14.742 1.00 55.31 C ATOM 1329 CG1 ILE A 83 16.276 -2.897 -15.447 1.00 32.21 C ATOM 1330 CG2 ILE A 83 15.889 -0.526 -14.724 1.00 33.42 C ATOM 1331 CD1 ILE A 83 15.059 -3.459 -14.746 1.00 73.21 C ATOM 0 H ILE A 83 18.863 -3.184 -14.972 1.00 53.02 H new ATOM 0 HA ILE A 83 17.967 -0.971 -16.465 1.00 33.41 H new ATOM 0 HB ILE A 83 17.106 -1.957 -13.712 1.00 55.31 H new ATOM 0 HG12 ILE A 83 16.003 -2.618 -16.465 1.00 32.21 H new ATOM 0 HG13 ILE A 83 17.034 -3.677 -15.523 1.00 32.21 H new ATOM 0 HG21 ILE A 83 14.970 -0.843 -14.230 1.00 33.42 H new ATOM 0 HG22 ILE A 83 16.321 0.315 -14.182 1.00 33.42 H new ATOM 0 HG23 ILE A 83 15.665 -0.222 -15.747 1.00 33.42 H new ATOM 0 HD11 ILE A 83 14.684 -4.319 -15.301 1.00 73.21 H new ATOM 0 HD12 ILE A 83 15.331 -3.769 -13.737 1.00 73.21 H new ATOM 0 HD13 ILE A 83 14.284 -2.695 -14.694 1.00 73.21 H new ATOM 1343 N THR A 84 19.503 -0.330 -13.621 1.00 22.32 N ATOM 1344 CA THR A 84 20.121 0.724 -12.827 1.00 15.42 C ATOM 1345 C THR A 84 20.898 1.694 -13.710 1.00 31.22 C ATOM 1346 O THR A 84 20.971 2.888 -13.422 1.00 2.41 O ATOM 1347 CB THR A 84 21.070 0.143 -11.762 1.00 50.50 C ATOM 1348 OG1 THR A 84 21.322 1.120 -10.746 1.00 4.13 O ATOM 1349 CG2 THR A 84 22.385 -0.294 -12.390 1.00 53.21 C ATOM 0 H THR A 84 19.681 -1.274 -13.279 1.00 22.32 H new ATOM 0 HA THR A 84 19.313 1.259 -12.329 1.00 15.42 H new ATOM 0 HB THR A 84 20.591 -0.729 -11.316 1.00 50.50 H new ATOM 0 HG1 THR A 84 21.925 0.743 -10.072 1.00 4.13 H new ATOM 0 HG21 THR A 84 23.039 -0.701 -11.619 1.00 53.21 H new ATOM 0 HG22 THR A 84 22.192 -1.058 -13.143 1.00 53.21 H new ATOM 0 HG23 THR A 84 22.867 0.564 -12.859 1.00 53.21 H new ATOM 1357 N SER A 85 21.477 1.172 -14.787 1.00 14.22 N ATOM 1358 CA SER A 85 22.252 1.992 -15.711 1.00 33.12 C ATOM 1359 C SER A 85 21.341 2.920 -16.508 1.00 51.34 C ATOM 1360 O SER A 85 21.500 4.141 -16.479 1.00 10.42 O ATOM 1361 CB SER A 85 23.054 1.104 -16.664 1.00 21.24 C ATOM 1362 OG SER A 85 24.329 0.799 -16.125 1.00 11.01 O ATOM 0 H SER A 85 21.424 0.186 -15.041 1.00 14.22 H new ATOM 0 HA SER A 85 22.942 2.602 -15.127 1.00 33.12 H new ATOM 0 HB2 SER A 85 22.506 0.181 -16.854 1.00 21.24 H new ATOM 0 HB3 SER A 85 23.172 1.608 -17.623 1.00 21.24 H new ATOM 0 HG SER A 85 24.821 0.229 -16.752 1.00 11.01 H new ATOM 1368 N LEU A 86 20.386 2.333 -17.221 1.00 61.11 N ATOM 1369 CA LEU A 86 19.448 3.106 -18.028 1.00 22.11 C ATOM 1370 C LEU A 86 18.772 4.187 -17.191 1.00 20.12 C ATOM 1371 O LEU A 86 18.425 5.253 -17.699 1.00 74.22 O ATOM 1372 CB LEU A 86 18.392 2.184 -18.641 1.00 43.50 C ATOM 1373 CG LEU A 86 18.914 0.896 -19.278 1.00 42.23 C ATOM 1374 CD1 LEU A 86 17.774 0.114 -19.912 1.00 41.42 C ATOM 1375 CD2 LEU A 86 19.988 1.209 -20.311 1.00 33.24 C ATOM 0 H LEU A 86 20.241 1.324 -17.257 1.00 61.11 H new ATOM 0 HA LEU A 86 20.008 3.590 -18.828 1.00 22.11 H new ATOM 0 HB2 LEU A 86 17.676 1.917 -17.863 1.00 43.50 H new ATOM 0 HB3 LEU A 86 17.845 2.745 -19.399 1.00 43.50 H new ATOM 0 HG LEU A 86 19.359 0.281 -18.496 1.00 42.23 H new ATOM 0 HD11 LEU A 86 18.165 -0.800 -20.360 1.00 41.42 H new ATOM 0 HD12 LEU A 86 17.039 -0.142 -19.148 1.00 41.42 H new ATOM 0 HD13 LEU A 86 17.300 0.722 -20.682 1.00 41.42 H new ATOM 0 HD21 LEU A 86 20.348 0.281 -20.754 1.00 33.24 H new ATOM 0 HD22 LEU A 86 19.569 1.845 -21.091 1.00 33.24 H new ATOM 0 HD23 LEU A 86 20.817 1.726 -19.828 1.00 33.24 H new ATOM 1387 N TRP A 87 18.591 3.905 -15.906 1.00 13.33 N ATOM 1388 CA TRP A 87 17.958 4.855 -14.997 1.00 70.12 C ATOM 1389 C TRP A 87 18.685 6.195 -15.018 1.00 55.23 C ATOM 1390 O TRP A 87 18.057 7.252 -14.950 1.00 20.41 O ATOM 1391 CB TRP A 87 17.937 4.294 -13.574 1.00 50.43 C ATOM 1392 CG TRP A 87 16.805 4.821 -12.745 1.00 72.21 C ATOM 1393 CD1 TRP A 87 15.934 5.817 -13.085 1.00 22.33 C ATOM 1394 CD2 TRP A 87 16.423 4.380 -11.438 1.00 32.33 C ATOM 1395 NE1 TRP A 87 15.034 6.021 -12.067 1.00 51.30 N ATOM 1396 CE2 TRP A 87 15.312 5.152 -11.046 1.00 33.23 C ATOM 1397 CE3 TRP A 87 16.910 3.407 -10.561 1.00 34.41 C ATOM 1398 CZ2 TRP A 87 14.683 4.980 -9.815 1.00 60.03 C ATOM 1399 CZ3 TRP A 87 16.285 3.238 -9.340 1.00 72.50 C ATOM 1400 CH2 TRP A 87 15.181 4.020 -8.977 1.00 12.24 C ATOM 0 H TRP A 87 18.873 3.027 -15.470 1.00 13.33 H new ATOM 0 HA TRP A 87 16.933 5.014 -15.332 1.00 70.12 H new ATOM 0 HB2 TRP A 87 17.869 3.207 -13.620 1.00 50.43 H new ATOM 0 HB3 TRP A 87 18.880 4.533 -13.083 1.00 50.43 H new ATOM 0 HD1 TRP A 87 15.950 6.363 -14.016 1.00 22.33 H new ATOM 0 HE1 TRP A 87 14.281 6.709 -12.071 1.00 51.30 H new ATOM 0 HE3 TRP A 87 17.760 2.798 -10.833 1.00 34.41 H new ATOM 0 HZ2 TRP A 87 13.833 5.583 -9.532 1.00 60.03 H new ATOM 0 HZ3 TRP A 87 16.654 2.490 -8.654 1.00 72.50 H new ATOM 0 HH2 TRP A 87 14.714 3.862 -8.016 1.00 12.24 H new ATOM 1411 N GLN A 88 20.009 6.144 -15.113 1.00 62.14 N ATOM 1412 CA GLN A 88 20.820 7.356 -15.143 1.00 31.42 C ATOM 1413 C GLN A 88 20.313 8.324 -16.207 1.00 21.14 C ATOM 1414 O GLN A 88 20.231 9.529 -15.974 1.00 54.24 O ATOM 1415 CB GLN A 88 22.285 7.008 -15.410 1.00 24.44 C ATOM 1416 CG GLN A 88 23.006 6.439 -14.198 1.00 31.30 C ATOM 1417 CD GLN A 88 23.520 5.032 -14.432 1.00 72.20 C ATOM 1418 OE1 GLN A 88 23.921 4.682 -15.542 1.00 72.44 O ATOM 1419 NE2 GLN A 88 23.511 4.216 -13.384 1.00 73.03 N ATOM 0 H GLN A 88 20.543 5.277 -15.171 1.00 62.14 H new ATOM 0 HA GLN A 88 20.741 7.840 -14.170 1.00 31.42 H new ATOM 0 HB2 GLN A 88 22.336 6.286 -16.225 1.00 24.44 H new ATOM 0 HB3 GLN A 88 22.807 7.904 -15.746 1.00 24.44 H new ATOM 0 HG2 GLN A 88 23.842 7.089 -13.939 1.00 31.30 H new ATOM 0 HG3 GLN A 88 22.328 6.437 -13.345 1.00 31.30 H new ATOM 0 HE21 GLN A 88 23.170 4.548 -12.482 1.00 73.03 H new ATOM 0 HE22 GLN A 88 23.845 3.257 -13.481 1.00 73.03 H new ATOM 1428 N GLY A 89 19.975 7.788 -17.375 1.00 71.44 N ATOM 1429 CA GLY A 89 19.481 8.619 -18.458 1.00 31.33 C ATOM 1430 C GLY A 89 18.186 9.322 -18.104 1.00 12.33 C ATOM 1431 O GLY A 89 18.077 10.541 -18.236 1.00 43.32 O ATOM 0 H GLY A 89 20.034 6.793 -17.591 1.00 71.44 H new ATOM 0 HA2 GLY A 89 20.236 9.362 -18.715 1.00 31.33 H new ATOM 0 HA3 GLY A 89 19.326 8.002 -19.343 1.00 31.33 H new ATOM 1435 N SER A 90 17.200 8.553 -17.654 1.00 31.34 N ATOM 1436 CA SER A 90 15.903 9.109 -17.285 1.00 4.13 C ATOM 1437 C SER A 90 16.068 10.262 -16.299 1.00 54.34 C ATOM 1438 O SER A 90 15.253 11.186 -16.265 1.00 63.11 O ATOM 1439 CB SER A 90 15.014 8.024 -16.674 1.00 43.10 C ATOM 1440 OG SER A 90 13.958 8.595 -15.921 1.00 72.52 O ATOM 0 H SER A 90 17.274 7.543 -17.536 1.00 31.34 H new ATOM 0 HA SER A 90 15.428 9.491 -18.189 1.00 4.13 H new ATOM 0 HB2 SER A 90 14.603 7.398 -17.466 1.00 43.10 H new ATOM 0 HB3 SER A 90 15.613 7.376 -16.034 1.00 43.10 H new ATOM 0 HG SER A 90 13.179 8.001 -15.947 1.00 72.52 H new ATOM 1446 N LEU A 91 17.126 10.202 -15.499 1.00 61.11 N ATOM 1447 CA LEU A 91 17.399 11.241 -14.512 1.00 21.42 C ATOM 1448 C LEU A 91 17.348 12.625 -15.150 1.00 12.22 C ATOM 1449 O LEU A 91 16.574 13.486 -14.729 1.00 25.11 O ATOM 1450 CB LEU A 91 18.768 11.013 -13.869 1.00 2.33 C ATOM 1451 CG LEU A 91 18.984 11.663 -12.501 1.00 74.03 C ATOM 1452 CD1 LEU A 91 20.237 11.112 -11.840 1.00 22.31 C ATOM 1453 CD2 LEU A 91 19.072 13.176 -12.638 1.00 13.04 C ATOM 0 H LEU A 91 17.809 9.445 -15.514 1.00 61.11 H new ATOM 0 HA LEU A 91 16.629 11.188 -13.742 1.00 21.42 H new ATOM 0 HB2 LEU A 91 18.925 9.939 -13.768 1.00 2.33 H new ATOM 0 HB3 LEU A 91 19.534 11.384 -14.550 1.00 2.33 H new ATOM 0 HG LEU A 91 18.130 11.424 -11.868 1.00 74.03 H new ATOM 0 HD11 LEU A 91 20.374 11.586 -10.868 1.00 22.31 H new ATOM 0 HD12 LEU A 91 20.135 10.035 -11.707 1.00 22.31 H new ATOM 0 HD13 LEU A 91 21.102 11.319 -12.470 1.00 22.31 H new ATOM 0 HD21 LEU A 91 19.226 13.622 -11.655 1.00 13.04 H new ATOM 0 HD22 LEU A 91 19.908 13.434 -13.288 1.00 13.04 H new ATOM 0 HD23 LEU A 91 18.146 13.557 -13.068 1.00 13.04 H new ATOM 1465 N PHE A 92 18.175 12.832 -16.169 1.00 10.41 N ATOM 1466 CA PHE A 92 18.223 14.112 -16.866 1.00 42.24 C ATOM 1467 C PHE A 92 16.857 14.468 -17.446 1.00 21.32 C ATOM 1468 O PHE A 92 16.473 15.636 -17.487 1.00 24.25 O ATOM 1469 CB PHE A 92 19.268 14.069 -17.983 1.00 51.25 C ATOM 1470 CG PHE A 92 19.302 15.316 -18.820 1.00 45.12 C ATOM 1471 CD1 PHE A 92 19.821 16.495 -18.309 1.00 40.04 C ATOM 1472 CD2 PHE A 92 18.816 15.309 -20.118 1.00 12.35 C ATOM 1473 CE1 PHE A 92 19.855 17.644 -19.077 1.00 14.12 C ATOM 1474 CE2 PHE A 92 18.847 16.455 -20.890 1.00 2.13 C ATOM 1475 CZ PHE A 92 19.366 17.624 -20.368 1.00 40.24 C ATOM 0 H PHE A 92 18.821 12.130 -16.531 1.00 10.41 H new ATOM 0 HA PHE A 92 18.503 14.880 -16.145 1.00 42.24 H new ATOM 0 HB2 PHE A 92 20.252 13.909 -17.543 1.00 51.25 H new ATOM 0 HB3 PHE A 92 19.064 13.214 -18.627 1.00 51.25 H new ATOM 0 HD1 PHE A 92 20.203 16.516 -17.299 1.00 40.04 H new ATOM 0 HD2 PHE A 92 18.409 14.398 -20.531 1.00 12.35 H new ATOM 0 HE1 PHE A 92 20.264 18.556 -18.668 1.00 14.12 H new ATOM 0 HE2 PHE A 92 18.466 16.437 -21.900 1.00 2.13 H new ATOM 0 HZ PHE A 92 19.389 18.521 -20.969 1.00 40.24 H new ATOM 1485 N ASN A 93 16.128 13.451 -17.893 1.00 70.54 N ATOM 1486 CA ASN A 93 14.805 13.655 -18.472 1.00 31.21 C ATOM 1487 C ASN A 93 13.926 14.485 -17.541 1.00 23.32 C ATOM 1488 O ASN A 93 13.313 15.466 -17.960 1.00 62.21 O ATOM 1489 CB ASN A 93 14.136 12.308 -18.757 1.00 4.35 C ATOM 1490 CG ASN A 93 13.137 12.388 -19.895 1.00 24.14 C ATOM 1491 OD1 ASN A 93 13.390 11.891 -20.993 1.00 15.34 O ATOM 1492 ND2 ASN A 93 11.996 13.015 -19.637 1.00 13.23 N ATOM 0 H ASN A 93 16.431 12.477 -17.866 1.00 70.54 H new ATOM 0 HA ASN A 93 14.926 14.198 -19.409 1.00 31.21 H new ATOM 0 HB2 ASN A 93 14.900 11.570 -18.999 1.00 4.35 H new ATOM 0 HB3 ASN A 93 13.630 11.959 -17.857 1.00 4.35 H new ATOM 0 HD21 ASN A 93 11.285 13.100 -20.364 1.00 13.23 H new ATOM 0 HD22 ASN A 93 11.830 13.412 -18.712 1.00 13.23 H new ATOM 1499 N ALA A 94 13.871 14.084 -16.275 1.00 21.31 N ATOM 1500 CA ALA A 94 13.070 14.791 -15.284 1.00 3.34 C ATOM 1501 C ALA A 94 13.613 14.565 -13.877 1.00 11.14 C ATOM 1502 O ALA A 94 14.262 15.439 -13.304 1.00 12.24 O ATOM 1503 CB ALA A 94 11.616 14.351 -15.368 1.00 23.11 C ATOM 0 H ALA A 94 14.372 13.273 -15.912 1.00 21.31 H new ATOM 0 HA ALA A 94 13.128 15.858 -15.501 1.00 3.34 H new ATOM 0 HB1 ALA A 94 11.030 14.887 -14.622 1.00 23.11 H new ATOM 0 HB2 ALA A 94 11.226 14.570 -16.362 1.00 23.11 H new ATOM 0 HB3 ALA A 94 11.549 13.279 -15.180 1.00 23.11 H new ATOM 1509 N ASN A 95 13.342 13.387 -13.325 1.00 72.52 N ATOM 1510 CA ASN A 95 13.802 13.046 -11.984 1.00 2.32 C ATOM 1511 C ASN A 95 13.356 11.640 -11.596 1.00 31.11 C ATOM 1512 O ASN A 95 12.572 11.461 -10.664 1.00 15.11 O ATOM 1513 CB ASN A 95 13.272 14.060 -10.968 1.00 2.12 C ATOM 1514 CG ASN A 95 11.801 14.366 -11.170 1.00 33.22 C ATOM 1515 OD1 ASN A 95 11.023 13.497 -11.566 1.00 45.20 O ATOM 1516 ND2 ASN A 95 11.411 15.606 -10.898 1.00 25.03 N ATOM 0 H ASN A 95 12.806 12.652 -13.786 1.00 72.52 H new ATOM 0 HA ASN A 95 14.892 13.075 -11.983 1.00 2.32 H new ATOM 0 HB2 ASN A 95 13.425 13.674 -9.960 1.00 2.12 H new ATOM 0 HB3 ASN A 95 13.846 14.983 -11.047 1.00 2.12 H new ATOM 0 HD21 ASN A 95 10.433 15.870 -11.015 1.00 25.03 H new ATOM 0 HD22 ASN A 95 12.090 16.294 -10.572 1.00 25.03 H new ATOM 1523 N TYR A 96 13.861 10.645 -12.317 1.00 3.13 N ATOM 1524 CA TYR A 96 13.514 9.255 -12.050 1.00 33.54 C ATOM 1525 C TYR A 96 12.019 9.020 -12.243 1.00 72.32 C ATOM 1526 O TYR A 96 11.211 9.332 -11.368 1.00 4.12 O ATOM 1527 CB TYR A 96 13.922 8.869 -10.627 1.00 12.13 C ATOM 1528 CG TYR A 96 15.311 9.331 -10.249 1.00 40.30 C ATOM 1529 CD1 TYR A 96 16.433 8.816 -10.887 1.00 10.50 C ATOM 1530 CD2 TYR A 96 15.502 10.282 -9.254 1.00 31.21 C ATOM 1531 CE1 TYR A 96 17.704 9.235 -10.545 1.00 3.11 C ATOM 1532 CE2 TYR A 96 16.769 10.707 -8.906 1.00 43.43 C ATOM 1533 CZ TYR A 96 17.867 10.181 -9.554 1.00 42.14 C ATOM 1534 OH TYR A 96 19.131 10.601 -9.210 1.00 45.40 O ATOM 0 H TYR A 96 14.512 10.776 -13.091 1.00 3.13 H new ATOM 0 HA TYR A 96 14.057 8.630 -12.759 1.00 33.54 H new ATOM 0 HB2 TYR A 96 13.204 9.292 -9.925 1.00 12.13 H new ATOM 0 HB3 TYR A 96 13.868 7.785 -10.524 1.00 12.13 H new ATOM 0 HD1 TYR A 96 16.309 8.076 -11.663 1.00 10.50 H new ATOM 0 HD2 TYR A 96 14.645 10.696 -8.744 1.00 31.21 H new ATOM 0 HE1 TYR A 96 18.565 8.824 -11.051 1.00 3.11 H new ATOM 0 HE2 TYR A 96 16.899 11.447 -8.131 1.00 43.43 H new ATOM 0 HH TYR A 96 19.071 11.270 -8.497 1.00 45.40 H new ATOM 1544 N ASP A 97 11.658 8.467 -13.396 1.00 30.21 N ATOM 1545 CA ASP A 97 10.261 8.187 -13.706 1.00 14.53 C ATOM 1546 C ASP A 97 10.033 6.690 -13.888 1.00 43.15 C ATOM 1547 O ASP A 97 9.768 6.222 -14.996 1.00 43.40 O ATOM 1548 CB ASP A 97 9.836 8.938 -14.969 1.00 2.32 C ATOM 1549 CG ASP A 97 9.489 10.388 -14.692 1.00 25.04 C ATOM 1550 OD1 ASP A 97 8.460 10.635 -14.029 1.00 43.24 O ATOM 1551 OD2 ASP A 97 10.247 11.275 -15.138 1.00 11.33 O ATOM 0 H ASP A 97 12.314 8.204 -14.131 1.00 30.21 H new ATOM 0 HA ASP A 97 9.654 8.529 -12.868 1.00 14.53 H new ATOM 0 HB2 ASP A 97 10.641 8.894 -15.702 1.00 2.32 H new ATOM 0 HB3 ASP A 97 8.974 8.439 -15.412 1.00 2.32 H new ATOM 1556 N VAL A 98 10.140 5.943 -12.794 1.00 72.45 N ATOM 1557 CA VAL A 98 9.946 4.498 -12.834 1.00 11.13 C ATOM 1558 C VAL A 98 8.971 4.045 -11.753 1.00 21.23 C ATOM 1559 O VAL A 98 8.974 4.572 -10.641 1.00 13.41 O ATOM 1560 CB VAL A 98 11.279 3.748 -12.655 1.00 21.23 C ATOM 1561 CG1 VAL A 98 12.141 3.886 -13.900 1.00 62.23 C ATOM 1562 CG2 VAL A 98 12.017 4.259 -11.426 1.00 72.14 C ATOM 0 H VAL A 98 10.360 6.314 -11.870 1.00 72.45 H new ATOM 0 HA VAL A 98 9.533 4.260 -13.814 1.00 11.13 H new ATOM 0 HB VAL A 98 11.063 2.690 -12.507 1.00 21.23 H new ATOM 0 HG11 VAL A 98 13.079 3.350 -13.755 1.00 62.23 H new ATOM 0 HG12 VAL A 98 11.613 3.468 -14.757 1.00 62.23 H new ATOM 0 HG13 VAL A 98 12.351 4.940 -14.082 1.00 62.23 H new ATOM 0 HG21 VAL A 98 12.957 3.718 -11.315 1.00 72.14 H new ATOM 0 HG22 VAL A 98 12.222 5.323 -11.541 1.00 72.14 H new ATOM 0 HG23 VAL A 98 11.401 4.102 -10.540 1.00 72.14 H new ATOM 1572 N GLN A 99 8.139 3.064 -12.087 1.00 63.33 N ATOM 1573 CA GLN A 99 7.158 2.540 -11.144 1.00 65.53 C ATOM 1574 C GLN A 99 7.224 1.017 -11.081 1.00 1.13 C ATOM 1575 O GLN A 99 7.343 0.348 -12.107 1.00 63.11 O ATOM 1576 CB GLN A 99 5.750 2.985 -11.541 1.00 12.02 C ATOM 1577 CG GLN A 99 5.536 4.487 -11.442 1.00 22.24 C ATOM 1578 CD GLN A 99 4.746 5.042 -12.610 1.00 15.23 C ATOM 1579 OE1 GLN A 99 3.543 4.808 -12.728 1.00 35.44 O ATOM 1580 NE2 GLN A 99 5.419 5.784 -13.481 1.00 72.15 N ATOM 0 H GLN A 99 8.125 2.616 -13.003 1.00 63.33 H new ATOM 0 HA GLN A 99 7.392 2.937 -10.156 1.00 65.53 H new ATOM 0 HB2 GLN A 99 5.552 2.665 -12.564 1.00 12.02 H new ATOM 0 HB3 GLN A 99 5.025 2.480 -10.903 1.00 12.02 H new ATOM 0 HG2 GLN A 99 5.013 4.715 -10.513 1.00 22.24 H new ATOM 0 HG3 GLN A 99 6.504 4.986 -11.393 1.00 22.24 H new ATOM 0 HE21 GLN A 99 6.416 5.953 -13.345 1.00 72.15 H new ATOM 0 HE22 GLN A 99 4.939 6.186 -14.287 1.00 72.15 H new ATOM 1589 N ARG A 100 7.146 0.477 -9.869 1.00 72.41 N ATOM 1590 CA ARG A 100 7.198 -0.967 -9.672 1.00 10.03 C ATOM 1591 C ARG A 100 6.047 -1.437 -8.787 1.00 52.31 C ATOM 1592 O ARG A 100 5.658 -0.752 -7.841 1.00 10.14 O ATOM 1593 CB ARG A 100 8.534 -1.369 -9.045 1.00 21.52 C ATOM 1594 CG ARG A 100 8.712 -2.872 -8.903 1.00 22.30 C ATOM 1595 CD ARG A 100 8.921 -3.274 -7.451 1.00 51.03 C ATOM 1596 NE ARG A 100 7.702 -3.123 -6.661 1.00 3.52 N ATOM 1597 CZ ARG A 100 7.693 -3.026 -5.336 1.00 31.51 C ATOM 1598 NH1 ARG A 100 8.831 -3.066 -4.657 1.00 40.50 N ATOM 1599 NH2 ARG A 100 6.543 -2.891 -4.688 1.00 2.55 N ATOM 0 H ARG A 100 7.047 1.017 -9.009 1.00 72.41 H new ATOM 0 HA ARG A 100 7.103 -1.445 -10.647 1.00 10.03 H new ATOM 0 HB2 ARG A 100 9.346 -0.971 -9.654 1.00 21.52 H new ATOM 0 HB3 ARG A 100 8.618 -0.907 -8.061 1.00 21.52 H new ATOM 0 HG2 ARG A 100 7.835 -3.382 -9.300 1.00 22.30 H new ATOM 0 HG3 ARG A 100 9.566 -3.196 -9.498 1.00 22.30 H new ATOM 0 HD2 ARG A 100 9.256 -4.310 -7.406 1.00 51.03 H new ATOM 0 HD3 ARG A 100 9.713 -2.664 -7.016 1.00 51.03 H new ATOM 0 HE ARG A 100 6.809 -3.090 -7.153 1.00 3.52 H new ATOM 0 HH11 ARG A 100 9.717 -3.171 -5.152 1.00 40.50 H new ATOM 0 HH12 ARG A 100 8.821 -2.991 -3.640 1.00 40.50 H new ATOM 0 HH21 ARG A 100 5.665 -2.862 -5.207 1.00 2.55 H new ATOM 0 HH22 ARG A 100 6.537 -2.817 -3.671 1.00 2.55 H new ATOM 1613 N PHE A 101 5.505 -2.609 -9.102 1.00 44.43 N ATOM 1614 CA PHE A 101 4.398 -3.169 -8.337 1.00 73.54 C ATOM 1615 C PHE A 101 4.443 -4.695 -8.354 1.00 12.44 C ATOM 1616 O PHE A 101 4.579 -5.311 -9.411 1.00 11.20 O ATOM 1617 CB PHE A 101 3.062 -2.681 -8.902 1.00 32.45 C ATOM 1618 CG PHE A 101 1.934 -2.743 -7.911 1.00 64.20 C ATOM 1619 CD1 PHE A 101 1.842 -1.814 -6.888 1.00 10.33 C ATOM 1620 CD2 PHE A 101 0.967 -3.731 -8.003 1.00 23.20 C ATOM 1621 CE1 PHE A 101 0.806 -1.867 -5.975 1.00 34.43 C ATOM 1622 CE2 PHE A 101 -0.072 -3.790 -7.093 1.00 45.33 C ATOM 1623 CZ PHE A 101 -0.152 -2.857 -6.077 1.00 62.52 C ATOM 0 H PHE A 101 5.815 -3.189 -9.882 1.00 44.43 H new ATOM 0 HA PHE A 101 4.494 -2.831 -7.305 1.00 73.54 H new ATOM 0 HB2 PHE A 101 3.176 -1.653 -9.247 1.00 32.45 H new ATOM 0 HB3 PHE A 101 2.803 -3.283 -9.773 1.00 32.45 H new ATOM 0 HD1 PHE A 101 2.589 -1.039 -6.803 1.00 10.33 H new ATOM 0 HD2 PHE A 101 1.026 -4.463 -8.795 1.00 23.20 H new ATOM 0 HE1 PHE A 101 0.745 -1.135 -5.183 1.00 34.43 H new ATOM 0 HE2 PHE A 101 -0.820 -4.564 -7.176 1.00 45.33 H new ATOM 0 HZ PHE A 101 -0.962 -2.902 -5.364 1.00 62.52 H new ATOM 1633 N ILE A 102 4.328 -5.296 -7.174 1.00 61.45 N ATOM 1634 CA ILE A 102 4.355 -6.749 -7.053 1.00 1.42 C ATOM 1635 C ILE A 102 3.180 -7.253 -6.223 1.00 15.34 C ATOM 1636 O ILE A 102 3.000 -6.851 -5.073 1.00 21.23 O ATOM 1637 CB ILE A 102 5.668 -7.236 -6.412 1.00 0.54 C ATOM 1638 CG1 ILE A 102 5.988 -6.411 -5.163 1.00 52.21 C ATOM 1639 CG2 ILE A 102 6.809 -7.153 -7.414 1.00 65.20 C ATOM 1640 CD1 ILE A 102 7.269 -6.828 -4.475 1.00 73.10 C ATOM 0 H ILE A 102 4.215 -4.800 -6.290 1.00 61.45 H new ATOM 0 HA ILE A 102 4.282 -7.151 -8.063 1.00 1.42 H new ATOM 0 HB ILE A 102 5.546 -8.278 -6.115 1.00 0.54 H new ATOM 0 HG12 ILE A 102 6.060 -5.359 -5.441 1.00 52.21 H new ATOM 0 HG13 ILE A 102 5.161 -6.499 -4.458 1.00 52.21 H new ATOM 0 HG21 ILE A 102 7.730 -7.501 -6.946 1.00 65.20 H new ATOM 0 HG22 ILE A 102 6.582 -7.779 -8.277 1.00 65.20 H new ATOM 0 HG23 ILE A 102 6.934 -6.120 -7.738 1.00 65.20 H new ATOM 0 HD11 ILE A 102 7.432 -6.201 -3.599 1.00 73.10 H new ATOM 0 HD12 ILE A 102 7.193 -7.871 -4.166 1.00 73.10 H new ATOM 0 HD13 ILE A 102 8.106 -6.714 -5.164 1.00 73.10 H new ATOM 1652 N VAL A 103 2.381 -8.137 -6.813 1.00 3.23 N ATOM 1653 CA VAL A 103 1.224 -8.699 -6.127 1.00 51.10 C ATOM 1654 C VAL A 103 0.923 -10.109 -6.622 1.00 24.31 C ATOM 1655 O VAL A 103 1.020 -10.394 -7.815 1.00 14.50 O ATOM 1656 CB VAL A 103 -0.026 -7.821 -6.323 1.00 51.43 C ATOM 1657 CG1 VAL A 103 0.073 -6.556 -5.484 1.00 53.22 C ATOM 1658 CG2 VAL A 103 -0.212 -7.481 -7.794 1.00 74.24 C ATOM 0 H VAL A 103 2.514 -8.479 -7.765 1.00 3.23 H new ATOM 0 HA VAL A 103 1.472 -8.734 -5.066 1.00 51.10 H new ATOM 0 HB VAL A 103 -0.899 -8.382 -5.990 1.00 51.43 H new ATOM 0 HG11 VAL A 103 -0.819 -5.948 -5.635 1.00 53.22 H new ATOM 0 HG12 VAL A 103 0.155 -6.824 -4.431 1.00 53.22 H new ATOM 0 HG13 VAL A 103 0.954 -5.988 -5.784 1.00 53.22 H new ATOM 0 HG21 VAL A 103 -1.100 -6.860 -7.915 1.00 74.24 H new ATOM 0 HG22 VAL A 103 0.662 -6.939 -8.155 1.00 74.24 H new ATOM 0 HG23 VAL A 103 -0.331 -8.400 -8.368 1.00 74.24 H new ATOM 1668 N GLY A 104 0.558 -10.990 -5.696 1.00 20.54 N ATOM 1669 CA GLY A 104 0.248 -12.361 -6.057 1.00 64.41 C ATOM 1670 C GLY A 104 1.478 -13.142 -6.479 1.00 54.40 C ATOM 1671 O GLY A 104 2.550 -12.988 -5.894 1.00 52.54 O ATOM 0 H GLY A 104 0.471 -10.779 -4.702 1.00 20.54 H new ATOM 0 HA2 GLY A 104 -0.222 -12.859 -5.209 1.00 64.41 H new ATOM 0 HA3 GLY A 104 -0.477 -12.364 -6.871 1.00 64.41 H new ATOM 1675 N SER A 105 1.322 -13.983 -7.496 1.00 43.02 N ATOM 1676 CA SER A 105 2.427 -14.795 -7.992 1.00 44.44 C ATOM 1677 C SER A 105 3.042 -14.170 -9.242 1.00 32.44 C ATOM 1678 O SER A 105 3.936 -14.746 -9.861 1.00 24.40 O ATOM 1679 CB SER A 105 1.947 -16.214 -8.301 1.00 41.02 C ATOM 1680 OG SER A 105 0.534 -16.265 -8.397 1.00 2.33 O ATOM 0 H SER A 105 0.442 -14.120 -7.993 1.00 43.02 H new ATOM 0 HA SER A 105 3.190 -14.839 -7.215 1.00 44.44 H new ATOM 0 HB2 SER A 105 2.391 -16.556 -9.236 1.00 41.02 H new ATOM 0 HB3 SER A 105 2.286 -16.894 -7.520 1.00 41.02 H new ATOM 0 HG SER A 105 0.253 -17.182 -8.597 1.00 2.33 H new ATOM 1686 N ASP A 106 2.555 -12.989 -9.606 1.00 32.34 N ATOM 1687 CA ASP A 106 3.056 -12.285 -10.780 1.00 55.22 C ATOM 1688 C ASP A 106 3.531 -10.883 -10.411 1.00 53.14 C ATOM 1689 O ASP A 106 2.959 -10.234 -9.535 1.00 43.32 O ATOM 1690 CB ASP A 106 1.969 -12.203 -11.854 1.00 1.34 C ATOM 1691 CG ASP A 106 0.725 -11.487 -11.365 1.00 3.21 C ATOM 1692 OD1 ASP A 106 0.795 -10.259 -11.144 1.00 71.40 O ATOM 1693 OD2 ASP A 106 -0.318 -12.154 -11.204 1.00 40.42 O ATOM 0 H ASP A 106 1.814 -12.499 -9.105 1.00 32.34 H new ATOM 0 HA ASP A 106 3.904 -12.844 -11.175 1.00 55.22 H new ATOM 0 HB2 ASP A 106 2.364 -11.684 -12.727 1.00 1.34 H new ATOM 0 HB3 ASP A 106 1.703 -13.210 -12.175 1.00 1.34 H new ATOM 1698 N ARG A 107 4.580 -10.423 -11.085 1.00 71.00 N ATOM 1699 CA ARG A 107 5.133 -9.099 -10.826 1.00 64.25 C ATOM 1700 C ARG A 107 5.183 -8.271 -12.107 1.00 60.12 C ATOM 1701 O ARG A 107 5.434 -8.799 -13.190 1.00 61.00 O ATOM 1702 CB ARG A 107 6.536 -9.218 -10.228 1.00 43.53 C ATOM 1703 CG ARG A 107 6.574 -9.971 -8.909 1.00 2.23 C ATOM 1704 CD ARG A 107 6.674 -11.472 -9.127 1.00 32.40 C ATOM 1705 NE ARG A 107 7.104 -12.174 -7.920 1.00 51.43 N ATOM 1706 CZ ARG A 107 6.320 -12.370 -6.866 1.00 22.41 C ATOM 1707 NH1 ARG A 107 5.073 -11.921 -6.870 1.00 73.40 N ATOM 1708 NH2 ARG A 107 6.784 -13.018 -5.805 1.00 10.14 N ATOM 0 H ARG A 107 5.064 -10.947 -11.814 1.00 71.00 H new ATOM 0 HA ARG A 107 4.482 -8.594 -10.112 1.00 64.25 H new ATOM 0 HB2 ARG A 107 7.185 -9.723 -10.944 1.00 43.53 H new ATOM 0 HB3 ARG A 107 6.944 -8.218 -10.078 1.00 43.53 H new ATOM 0 HG2 ARG A 107 7.425 -9.631 -8.319 1.00 2.23 H new ATOM 0 HG3 ARG A 107 5.676 -9.745 -8.334 1.00 2.23 H new ATOM 0 HD2 ARG A 107 5.705 -11.857 -9.444 1.00 32.40 H new ATOM 0 HD3 ARG A 107 7.378 -11.675 -9.934 1.00 32.40 H new ATOM 0 HE ARG A 107 8.058 -12.533 -7.885 1.00 51.43 H new ATOM 0 HH11 ARG A 107 4.713 -11.423 -7.684 1.00 73.40 H new ATOM 0 HH12 ARG A 107 4.474 -12.073 -6.059 1.00 73.40 H new ATOM 0 HH21 ARG A 107 7.743 -13.366 -5.799 1.00 10.14 H new ATOM 0 HH22 ARG A 107 6.182 -13.168 -4.996 1.00 10.14 H new ATOM 1722 N ALA A 108 4.941 -6.971 -11.975 1.00 4.03 N ATOM 1723 CA ALA A 108 4.960 -6.070 -13.120 1.00 50.03 C ATOM 1724 C ALA A 108 6.010 -4.978 -12.943 1.00 73.11 C ATOM 1725 O ALA A 108 6.251 -4.511 -11.830 1.00 13.05 O ATOM 1726 CB ALA A 108 3.585 -5.454 -13.329 1.00 53.45 C ATOM 0 H ALA A 108 4.729 -6.518 -11.086 1.00 4.03 H new ATOM 0 HA ALA A 108 5.224 -6.651 -14.004 1.00 50.03 H new ATOM 0 HB1 ALA A 108 3.614 -4.783 -14.188 1.00 53.45 H new ATOM 0 HB2 ALA A 108 2.856 -6.244 -13.510 1.00 53.45 H new ATOM 0 HB3 ALA A 108 3.299 -4.893 -12.439 1.00 53.45 H new ATOM 1732 N ILE A 109 6.631 -4.577 -14.047 1.00 2.43 N ATOM 1733 CA ILE A 109 7.655 -3.539 -14.012 1.00 73.50 C ATOM 1734 C ILE A 109 7.390 -2.470 -15.066 1.00 73.14 C ATOM 1735 O ILE A 109 6.986 -2.776 -16.189 1.00 20.04 O ATOM 1736 CB ILE A 109 9.060 -4.128 -14.236 1.00 3.11 C ATOM 1737 CG1 ILE A 109 10.130 -3.072 -13.950 1.00 64.24 C ATOM 1738 CG2 ILE A 109 9.194 -4.655 -15.657 1.00 12.50 C ATOM 1739 CD1 ILE A 109 10.287 -2.753 -12.480 1.00 51.32 C ATOM 0 H ILE A 109 6.444 -4.954 -14.976 1.00 2.43 H new ATOM 0 HA ILE A 109 7.613 -3.087 -13.021 1.00 73.50 H new ATOM 0 HB ILE A 109 9.203 -4.960 -13.547 1.00 3.11 H new ATOM 0 HG12 ILE A 109 11.086 -3.420 -14.342 1.00 64.24 H new ATOM 0 HG13 ILE A 109 9.879 -2.157 -14.487 1.00 64.24 H new ATOM 0 HG21 ILE A 109 10.193 -5.068 -15.799 1.00 12.50 H new ATOM 0 HG22 ILE A 109 8.451 -5.434 -15.828 1.00 12.50 H new ATOM 0 HG23 ILE A 109 9.034 -3.841 -16.364 1.00 12.50 H new ATOM 0 HD11 ILE A 109 11.062 -1.997 -12.352 1.00 51.32 H new ATOM 0 HD12 ILE A 109 9.343 -2.375 -12.087 1.00 51.32 H new ATOM 0 HD13 ILE A 109 10.569 -3.657 -11.940 1.00 51.32 H new ATOM 1751 N PHE A 110 7.621 -1.214 -14.699 1.00 21.33 N ATOM 1752 CA PHE A 110 7.408 -0.098 -15.613 1.00 63.40 C ATOM 1753 C PHE A 110 8.459 0.987 -15.400 1.00 42.21 C ATOM 1754 O PHE A 110 8.625 1.496 -14.292 1.00 3.20 O ATOM 1755 CB PHE A 110 6.008 0.487 -15.420 1.00 32.21 C ATOM 1756 CG PHE A 110 5.596 1.430 -16.514 1.00 3.21 C ATOM 1757 CD1 PHE A 110 6.173 2.686 -16.617 1.00 62.34 C ATOM 1758 CD2 PHE A 110 4.633 1.061 -17.439 1.00 0.31 C ATOM 1759 CE1 PHE A 110 5.796 3.556 -17.623 1.00 33.14 C ATOM 1760 CE2 PHE A 110 4.252 1.927 -18.447 1.00 13.23 C ATOM 1761 CZ PHE A 110 4.835 3.176 -18.539 1.00 73.31 C ATOM 0 H PHE A 110 7.956 -0.943 -13.774 1.00 21.33 H new ATOM 0 HA PHE A 110 7.500 -0.473 -16.632 1.00 63.40 H new ATOM 0 HB2 PHE A 110 5.287 -0.328 -15.364 1.00 32.21 H new ATOM 0 HB3 PHE A 110 5.971 1.012 -14.466 1.00 32.21 H new ATOM 0 HD1 PHE A 110 6.925 2.988 -15.904 1.00 62.34 H new ATOM 0 HD2 PHE A 110 4.175 0.085 -17.372 1.00 0.31 H new ATOM 0 HE1 PHE A 110 6.253 4.532 -17.692 1.00 33.14 H new ATOM 0 HE2 PHE A 110 3.500 1.627 -19.162 1.00 13.23 H new ATOM 0 HZ PHE A 110 4.540 3.854 -19.326 1.00 73.31 H new ATOM 1771 N MET A 111 9.166 1.336 -16.470 1.00 24.20 N ATOM 1772 CA MET A 111 10.201 2.361 -16.401 1.00 10.32 C ATOM 1773 C MET A 111 10.214 3.207 -17.670 1.00 54.31 C ATOM 1774 O MET A 111 10.199 2.677 -18.782 1.00 12.12 O ATOM 1775 CB MET A 111 11.573 1.718 -16.189 1.00 11.31 C ATOM 1776 CG MET A 111 11.996 0.801 -17.324 1.00 60.34 C ATOM 1777 SD MET A 111 13.221 -0.419 -16.812 1.00 72.30 S ATOM 1778 CE MET A 111 12.228 -1.474 -15.759 1.00 31.04 C ATOM 0 H MET A 111 9.041 0.924 -17.395 1.00 24.20 H new ATOM 0 HA MET A 111 9.978 3.011 -15.555 1.00 10.32 H new ATOM 0 HB2 MET A 111 12.319 2.504 -16.071 1.00 11.31 H new ATOM 0 HB3 MET A 111 11.559 1.149 -15.259 1.00 11.31 H new ATOM 0 HG2 MET A 111 11.119 0.287 -17.716 1.00 60.34 H new ATOM 0 HG3 MET A 111 12.404 1.401 -18.137 1.00 60.34 H new ATOM 0 HE1 MET A 111 12.475 -2.518 -15.953 1.00 31.04 H new ATOM 0 HE2 MET A 111 12.433 -1.241 -14.714 1.00 31.04 H new ATOM 0 HE3 MET A 111 11.172 -1.306 -15.968 1.00 31.04 H new ATOM 1788 N LEU A 112 10.241 4.524 -17.498 1.00 14.14 N ATOM 1789 CA LEU A 112 10.255 5.444 -18.630 1.00 31.02 C ATOM 1790 C LEU A 112 10.992 6.732 -18.276 1.00 62.50 C ATOM 1791 O LEU A 112 11.003 7.155 -17.120 1.00 71.20 O ATOM 1792 CB LEU A 112 8.825 5.766 -19.069 1.00 24.40 C ATOM 1793 CG LEU A 112 8.511 5.539 -20.548 1.00 54.11 C ATOM 1794 CD1 LEU A 112 7.192 4.797 -20.706 1.00 3.52 C ATOM 1795 CD2 LEU A 112 8.471 6.865 -21.294 1.00 64.11 C ATOM 0 H LEU A 112 10.254 4.979 -16.585 1.00 14.14 H new ATOM 0 HA LEU A 112 10.781 4.960 -19.453 1.00 31.02 H new ATOM 0 HB2 LEU A 112 8.139 5.162 -18.475 1.00 24.40 H new ATOM 0 HB3 LEU A 112 8.619 6.809 -18.830 1.00 24.40 H new ATOM 0 HG LEU A 112 9.303 4.926 -20.978 1.00 54.11 H new ATOM 0 HD11 LEU A 112 6.985 4.644 -21.765 1.00 3.52 H new ATOM 0 HD12 LEU A 112 7.256 3.831 -20.206 1.00 3.52 H new ATOM 0 HD13 LEU A 112 6.389 5.384 -20.260 1.00 3.52 H new ATOM 0 HD21 LEU A 112 8.246 6.684 -22.345 1.00 64.11 H new ATOM 0 HD22 LEU A 112 7.699 7.502 -20.862 1.00 64.11 H new ATOM 0 HD23 LEU A 112 9.439 7.359 -21.210 1.00 64.11 H new ATOM 1807 N ARG A 113 11.606 7.351 -19.279 1.00 73.33 N ATOM 1808 CA ARG A 113 12.345 8.591 -19.074 1.00 75.32 C ATOM 1809 C ARG A 113 11.391 9.761 -18.853 1.00 41.41 C ATOM 1810 O ARG A 113 11.720 10.719 -18.152 1.00 73.32 O ATOM 1811 CB ARG A 113 13.249 8.875 -20.275 1.00 54.21 C ATOM 1812 CG ARG A 113 12.497 8.984 -21.591 1.00 75.34 C ATOM 1813 CD ARG A 113 12.952 7.924 -22.582 1.00 44.35 C ATOM 1814 NE ARG A 113 12.949 8.422 -23.956 1.00 23.34 N ATOM 1815 CZ ARG A 113 13.917 9.174 -24.467 1.00 4.12 C ATOM 1816 NH1 ARG A 113 14.961 9.514 -23.723 1.00 32.54 N ATOM 1817 NH2 ARG A 113 13.843 9.588 -25.725 1.00 41.03 N ATOM 0 H ARG A 113 11.606 7.014 -20.242 1.00 73.33 H new ATOM 0 HA ARG A 113 12.962 8.475 -18.183 1.00 75.32 H new ATOM 0 HB2 ARG A 113 13.792 9.803 -20.099 1.00 54.21 H new ATOM 0 HB3 ARG A 113 13.992 8.081 -20.355 1.00 54.21 H new ATOM 0 HG2 ARG A 113 11.427 8.879 -21.410 1.00 75.34 H new ATOM 0 HG3 ARG A 113 12.652 9.974 -22.019 1.00 75.34 H new ATOM 0 HD2 ARG A 113 13.956 7.590 -22.320 1.00 44.35 H new ATOM 0 HD3 ARG A 113 12.298 7.055 -22.510 1.00 44.35 H new ATOM 0 HE ARG A 113 12.160 8.179 -24.555 1.00 23.34 H new ATOM 0 HH11 ARG A 113 15.022 9.198 -22.755 1.00 32.54 H new ATOM 0 HH12 ARG A 113 15.703 10.092 -24.119 1.00 32.54 H new ATOM 0 HH21 ARG A 113 13.042 9.329 -26.301 1.00 41.03 H new ATOM 0 HH22 ARG A 113 14.587 10.166 -26.116 1.00 41.03 H new ATOM 1831 N ASP A 114 10.210 9.678 -19.456 1.00 22.33 N ATOM 1832 CA ASP A 114 9.209 10.729 -19.325 1.00 14.54 C ATOM 1833 C ASP A 114 8.444 10.591 -18.012 1.00 10.02 C ATOM 1834 O ASP A 114 8.566 11.429 -17.119 1.00 71.13 O ATOM 1835 CB ASP A 114 8.235 10.686 -20.503 1.00 71.13 C ATOM 1836 CG ASP A 114 8.700 11.534 -21.670 1.00 43.43 C ATOM 1837 OD1 ASP A 114 9.928 11.663 -21.857 1.00 41.03 O ATOM 1838 OD2 ASP A 114 7.837 12.071 -22.396 1.00 73.51 O ATOM 0 H ASP A 114 9.923 8.893 -20.041 1.00 22.33 H new ATOM 0 HA ASP A 114 9.725 11.689 -19.325 1.00 14.54 H new ATOM 0 HB2 ASP A 114 8.114 9.654 -20.833 1.00 71.13 H new ATOM 0 HB3 ASP A 114 7.255 11.032 -20.174 1.00 71.13 H new ATOM 1843 N GLY A 115 7.654 9.527 -17.902 1.00 50.11 N ATOM 1844 CA GLY A 115 6.880 9.299 -16.696 1.00 1.02 C ATOM 1845 C GLY A 115 5.461 9.819 -16.811 1.00 32.44 C ATOM 1846 O GLY A 115 4.535 9.058 -17.092 1.00 32.10 O ATOM 0 H GLY A 115 7.536 8.819 -18.627 1.00 50.11 H new ATOM 0 HA2 GLY A 115 6.856 8.231 -16.480 1.00 1.02 H new ATOM 0 HA3 GLY A 115 7.374 9.783 -15.854 1.00 1.02 H new ATOM 1850 N SER A 116 5.288 11.118 -16.591 1.00 3.13 N ATOM 1851 CA SER A 116 3.970 11.738 -16.666 1.00 25.24 C ATOM 1852 C SER A 116 3.283 11.394 -17.983 1.00 53.23 C ATOM 1853 O SER A 116 2.207 10.795 -17.997 1.00 41.14 O ATOM 1854 CB SER A 116 4.089 13.256 -16.520 1.00 15.24 C ATOM 1855 OG SER A 116 3.454 13.705 -15.335 1.00 2.42 O ATOM 0 H SER A 116 6.044 11.762 -16.359 1.00 3.13 H new ATOM 0 HA SER A 116 3.364 11.348 -15.848 1.00 25.24 H new ATOM 0 HB2 SER A 116 5.141 13.542 -16.504 1.00 15.24 H new ATOM 0 HB3 SER A 116 3.640 13.744 -17.385 1.00 15.24 H new ATOM 0 HG SER A 116 3.545 14.678 -15.264 1.00 2.42 H new ATOM 1861 N TYR A 117 3.911 11.778 -19.089 1.00 21.12 N ATOM 1862 CA TYR A 117 3.360 11.513 -20.412 1.00 53.45 C ATOM 1863 C TYR A 117 3.189 10.015 -20.642 1.00 33.21 C ATOM 1864 O TYR A 117 2.280 9.584 -21.350 1.00 75.23 O ATOM 1865 CB TYR A 117 4.266 12.106 -21.493 1.00 73.11 C ATOM 1866 CG TYR A 117 3.530 12.486 -22.758 1.00 62.24 C ATOM 1867 CD1 TYR A 117 2.708 13.605 -22.798 1.00 43.24 C ATOM 1868 CD2 TYR A 117 3.658 11.726 -23.914 1.00 63.54 C ATOM 1869 CE1 TYR A 117 2.034 13.955 -23.952 1.00 50.31 C ATOM 1870 CE2 TYR A 117 2.989 12.069 -25.073 1.00 70.01 C ATOM 1871 CZ TYR A 117 2.178 13.184 -25.087 1.00 14.42 C ATOM 1872 OH TYR A 117 1.509 13.531 -26.238 1.00 73.44 O ATOM 0 H TYR A 117 4.802 12.274 -19.095 1.00 21.12 H new ATOM 0 HA TYR A 117 2.379 11.985 -20.470 1.00 53.45 H new ATOM 0 HB2 TYR A 117 4.764 12.989 -21.093 1.00 73.11 H new ATOM 0 HB3 TYR A 117 5.045 11.384 -21.739 1.00 73.11 H new ATOM 0 HD1 TYR A 117 2.594 14.212 -21.912 1.00 43.24 H new ATOM 0 HD2 TYR A 117 4.292 10.852 -23.906 1.00 63.54 H new ATOM 0 HE1 TYR A 117 1.398 14.828 -23.966 1.00 50.31 H new ATOM 0 HE2 TYR A 117 3.101 11.467 -25.963 1.00 70.01 H new ATOM 0 HH TYR A 117 1.719 12.886 -26.945 1.00 73.44 H new ATOM 1882 N ALA A 118 4.070 9.226 -20.036 1.00 62.22 N ATOM 1883 CA ALA A 118 4.017 7.775 -20.171 1.00 55.52 C ATOM 1884 C ALA A 118 2.808 7.200 -19.440 1.00 3.42 C ATOM 1885 O ALA A 118 2.264 6.170 -19.836 1.00 72.02 O ATOM 1886 CB ALA A 118 5.300 7.149 -19.648 1.00 23.24 C ATOM 0 H ALA A 118 4.829 9.567 -19.447 1.00 62.22 H new ATOM 0 HA ALA A 118 3.916 7.536 -21.230 1.00 55.52 H new ATOM 0 HB1 ALA A 118 5.246 6.066 -19.755 1.00 23.24 H new ATOM 0 HB2 ALA A 118 6.148 7.528 -20.218 1.00 23.24 H new ATOM 0 HB3 ALA A 118 5.426 7.404 -18.596 1.00 23.24 H new ATOM 1892 N TRP A 119 2.395 7.872 -18.371 1.00 62.12 N ATOM 1893 CA TRP A 119 1.251 7.426 -17.584 1.00 0.21 C ATOM 1894 C TRP A 119 0.039 7.180 -18.476 1.00 23.01 C ATOM 1895 O TRP A 119 -0.799 6.330 -18.177 1.00 50.23 O ATOM 1896 CB TRP A 119 0.909 8.462 -16.512 1.00 53.31 C ATOM 1897 CG TRP A 119 -0.148 8.000 -15.555 1.00 23.12 C ATOM 1898 CD1 TRP A 119 -1.499 8.035 -15.747 1.00 34.35 C ATOM 1899 CD2 TRP A 119 0.061 7.435 -14.256 1.00 11.33 C ATOM 1900 NE1 TRP A 119 -2.144 7.526 -14.645 1.00 22.32 N ATOM 1901 CE2 TRP A 119 -1.209 7.150 -13.717 1.00 0.13 C ATOM 1902 CE3 TRP A 119 1.196 7.141 -13.496 1.00 64.24 C ATOM 1903 CZ2 TRP A 119 -1.372 6.587 -12.454 1.00 22.21 C ATOM 1904 CZ3 TRP A 119 1.033 6.582 -12.243 1.00 41.01 C ATOM 1905 CH2 TRP A 119 -0.243 6.309 -11.732 1.00 62.02 C ATOM 0 H TRP A 119 2.835 8.727 -18.030 1.00 62.12 H new ATOM 0 HA TRP A 119 1.518 6.487 -17.100 1.00 0.21 H new ATOM 0 HB2 TRP A 119 1.812 8.708 -15.954 1.00 53.31 H new ATOM 0 HB3 TRP A 119 0.574 9.379 -16.997 1.00 53.31 H new ATOM 0 HD1 TRP A 119 -1.989 8.408 -16.634 1.00 34.35 H new ATOM 0 HE1 TRP A 119 -3.155 7.442 -14.536 1.00 22.32 H new ATOM 0 HE3 TRP A 119 2.184 7.347 -13.881 1.00 64.24 H new ATOM 0 HZ2 TRP A 119 -2.355 6.377 -12.058 1.00 22.21 H new ATOM 0 HZ3 TRP A 119 1.904 6.352 -11.647 1.00 41.01 H new ATOM 0 HH2 TRP A 119 -0.337 5.871 -10.749 1.00 62.02 H new ATOM 1916 N GLU A 120 -0.046 7.929 -19.571 1.00 70.52 N ATOM 1917 CA GLU A 120 -1.157 7.790 -20.506 1.00 1.14 C ATOM 1918 C GLU A 120 -1.187 6.390 -21.111 1.00 72.23 C ATOM 1919 O GLU A 120 -2.177 5.669 -20.984 1.00 71.51 O ATOM 1920 CB GLU A 120 -1.051 8.836 -21.617 1.00 41.31 C ATOM 1921 CG GLU A 120 -2.397 9.299 -22.148 1.00 13.12 C ATOM 1922 CD GLU A 120 -2.268 10.193 -23.366 1.00 73.31 C ATOM 1923 OE1 GLU A 120 -1.836 9.693 -24.426 1.00 5.44 O ATOM 1924 OE2 GLU A 120 -2.601 11.392 -23.259 1.00 63.24 O ATOM 0 H GLU A 120 0.640 8.637 -19.832 1.00 70.52 H new ATOM 0 HA GLU A 120 -2.084 7.948 -19.955 1.00 1.14 H new ATOM 0 HB2 GLU A 120 -0.502 9.699 -21.240 1.00 41.31 H new ATOM 0 HB3 GLU A 120 -0.468 8.422 -22.440 1.00 41.31 H new ATOM 0 HG2 GLU A 120 -3.001 8.429 -22.403 1.00 13.12 H new ATOM 0 HG3 GLU A 120 -2.928 9.836 -21.362 1.00 13.12 H new ATOM 1931 N ILE A 121 -0.097 6.013 -21.770 1.00 43.13 N ATOM 1932 CA ILE A 121 0.002 4.700 -22.395 1.00 62.12 C ATOM 1933 C ILE A 121 0.102 3.598 -21.346 1.00 32.11 C ATOM 1934 O ILE A 121 -0.341 2.471 -21.569 1.00 24.21 O ATOM 1935 CB ILE A 121 1.221 4.613 -23.332 1.00 64.32 C ATOM 1936 CG1 ILE A 121 1.206 5.769 -24.334 1.00 12.20 C ATOM 1937 CG2 ILE A 121 1.237 3.276 -24.058 1.00 73.14 C ATOM 1938 CD1 ILE A 121 -0.013 5.776 -25.230 1.00 63.23 C ATOM 0 H ILE A 121 0.730 6.598 -21.885 1.00 43.13 H new ATOM 0 HA ILE A 121 -0.907 4.560 -22.980 1.00 62.12 H new ATOM 0 HB ILE A 121 2.128 4.689 -22.732 1.00 64.32 H new ATOM 0 HG12 ILE A 121 1.252 6.712 -23.789 1.00 12.20 H new ATOM 0 HG13 ILE A 121 2.102 5.714 -24.953 1.00 12.20 H new ATOM 0 HG21 ILE A 121 2.104 3.230 -24.716 1.00 73.14 H new ATOM 0 HG22 ILE A 121 1.291 2.467 -23.329 1.00 73.14 H new ATOM 0 HG23 ILE A 121 0.327 3.172 -24.649 1.00 73.14 H new ATOM 0 HD11 ILE A 121 0.043 6.622 -25.914 1.00 63.23 H new ATOM 0 HD12 ILE A 121 -0.050 4.849 -25.802 1.00 63.23 H new ATOM 0 HD13 ILE A 121 -0.912 5.862 -24.620 1.00 63.23 H new ATOM 1950 N LYS A 122 0.684 3.931 -20.199 1.00 45.32 N ATOM 1951 CA LYS A 122 0.840 2.972 -19.112 1.00 42.03 C ATOM 1952 C LYS A 122 -0.491 2.305 -18.781 1.00 22.15 C ATOM 1953 O LYS A 122 -0.528 1.153 -18.348 1.00 23.03 O ATOM 1954 CB LYS A 122 1.399 3.666 -17.868 1.00 50.21 C ATOM 1955 CG LYS A 122 1.422 2.779 -16.635 1.00 41.04 C ATOM 1956 CD LYS A 122 0.281 3.111 -15.688 1.00 64.11 C ATOM 1957 CE LYS A 122 0.126 2.050 -14.610 1.00 31.43 C ATOM 1958 NZ LYS A 122 1.134 2.209 -13.525 1.00 52.01 N ATOM 0 H LYS A 122 1.056 4.859 -19.998 1.00 45.32 H new ATOM 0 HA LYS A 122 1.541 2.203 -19.436 1.00 42.03 H new ATOM 0 HB2 LYS A 122 2.412 4.008 -18.078 1.00 50.21 H new ATOM 0 HB3 LYS A 122 0.800 4.552 -17.657 1.00 50.21 H new ATOM 0 HG2 LYS A 122 1.354 1.734 -16.936 1.00 41.04 H new ATOM 0 HG3 LYS A 122 2.373 2.900 -16.117 1.00 41.04 H new ATOM 0 HD2 LYS A 122 0.463 4.080 -15.223 1.00 64.11 H new ATOM 0 HD3 LYS A 122 -0.648 3.197 -16.252 1.00 64.11 H new ATOM 0 HE2 LYS A 122 -0.876 2.107 -14.186 1.00 31.43 H new ATOM 0 HE3 LYS A 122 0.227 1.061 -15.057 1.00 31.43 H new ATOM 0 HZ1 LYS A 122 0.995 1.467 -12.810 1.00 52.01 H new ATOM 0 HZ2 LYS A 122 2.091 2.129 -13.925 1.00 52.01 H new ATOM 0 HZ3 LYS A 122 1.022 3.143 -13.081 1.00 52.01 H new ATOM 1972 N ASP A 123 -1.581 3.035 -18.987 1.00 50.24 N ATOM 1973 CA ASP A 123 -2.915 2.513 -18.713 1.00 24.04 C ATOM 1974 C ASP A 123 -3.178 1.245 -19.519 1.00 34.14 C ATOM 1975 O ASP A 123 -3.587 0.221 -18.970 1.00 1.55 O ATOM 1976 CB ASP A 123 -3.975 3.567 -19.035 1.00 42.13 C ATOM 1977 CG ASP A 123 -4.004 4.690 -18.017 1.00 22.31 C ATOM 1978 OD1 ASP A 123 -3.121 4.712 -17.134 1.00 51.31 O ATOM 1979 OD2 ASP A 123 -4.910 5.545 -18.102 1.00 42.41 O ATOM 0 H ASP A 123 -1.567 3.991 -19.343 1.00 50.24 H new ATOM 0 HA ASP A 123 -2.971 2.266 -17.653 1.00 24.04 H new ATOM 0 HB2 ASP A 123 -3.781 3.982 -20.024 1.00 42.13 H new ATOM 0 HB3 ASP A 123 -4.955 3.092 -19.075 1.00 42.13 H new ATOM 1984 N PHE A 124 -2.943 1.320 -20.824 1.00 51.34 N ATOM 1985 CA PHE A 124 -3.157 0.179 -21.707 1.00 11.31 C ATOM 1986 C PHE A 124 -2.119 -0.909 -21.450 1.00 70.21 C ATOM 1987 O PHE A 124 -2.446 -2.096 -21.400 1.00 11.33 O ATOM 1988 CB PHE A 124 -3.098 0.621 -23.170 1.00 42.45 C ATOM 1989 CG PHE A 124 -4.269 0.154 -23.986 1.00 15.02 C ATOM 1990 CD1 PHE A 124 -5.531 0.688 -23.779 1.00 51.33 C ATOM 1991 CD2 PHE A 124 -4.109 -0.819 -24.959 1.00 52.00 C ATOM 1992 CE1 PHE A 124 -6.611 0.259 -24.528 1.00 10.43 C ATOM 1993 CE2 PHE A 124 -5.185 -1.252 -25.711 1.00 14.41 C ATOM 1994 CZ PHE A 124 -6.438 -0.711 -25.495 1.00 43.25 C ATOM 0 H PHE A 124 -2.604 2.159 -21.294 1.00 51.34 H new ATOM 0 HA PHE A 124 -4.146 -0.230 -21.498 1.00 11.31 H new ATOM 0 HB2 PHE A 124 -3.048 1.709 -23.211 1.00 42.45 H new ATOM 0 HB3 PHE A 124 -2.179 0.243 -23.618 1.00 42.45 H new ATOM 0 HD1 PHE A 124 -5.672 1.448 -23.024 1.00 51.33 H new ATOM 0 HD2 PHE A 124 -3.132 -1.244 -25.132 1.00 52.00 H new ATOM 0 HE1 PHE A 124 -7.590 0.683 -24.357 1.00 10.43 H new ATOM 0 HE2 PHE A 124 -5.047 -2.012 -26.466 1.00 14.41 H new ATOM 0 HZ PHE A 124 -7.280 -1.046 -26.082 1.00 43.25 H new ATOM 2004 N LEU A 125 -0.866 -0.497 -21.289 1.00 74.21 N ATOM 2005 CA LEU A 125 0.221 -1.436 -21.038 1.00 25.21 C ATOM 2006 C LEU A 125 -0.100 -2.337 -19.850 1.00 33.20 C ATOM 2007 O LEU A 125 -0.163 -3.559 -19.983 1.00 63.53 O ATOM 2008 CB LEU A 125 1.525 -0.679 -20.780 1.00 65.20 C ATOM 2009 CG LEU A 125 2.435 -0.476 -21.993 1.00 14.24 C ATOM 2010 CD1 LEU A 125 3.362 0.709 -21.771 1.00 63.24 C ATOM 2011 CD2 LEU A 125 3.236 -1.738 -22.276 1.00 2.12 C ATOM 0 H LEU A 125 -0.578 0.481 -21.328 1.00 74.21 H new ATOM 0 HA LEU A 125 0.339 -2.061 -21.923 1.00 25.21 H new ATOM 0 HB2 LEU A 125 1.278 0.300 -20.368 1.00 65.20 H new ATOM 0 HB3 LEU A 125 2.087 -1.214 -20.015 1.00 65.20 H new ATOM 0 HG LEU A 125 1.811 -0.265 -22.861 1.00 14.24 H new ATOM 0 HD11 LEU A 125 4.002 0.839 -22.644 1.00 63.24 H new ATOM 0 HD12 LEU A 125 2.769 1.611 -21.618 1.00 63.24 H new ATOM 0 HD13 LEU A 125 3.980 0.528 -20.892 1.00 63.24 H new ATOM 0 HD21 LEU A 125 3.878 -1.575 -23.142 1.00 2.12 H new ATOM 0 HD22 LEU A 125 3.851 -1.981 -21.409 1.00 2.12 H new ATOM 0 HD23 LEU A 125 2.554 -2.564 -22.480 1.00 2.12 H new ATOM 2023 N VAL A 126 -0.306 -1.725 -18.688 1.00 61.10 N ATOM 2024 CA VAL A 126 -0.625 -2.471 -17.477 1.00 22.33 C ATOM 2025 C VAL A 126 -1.971 -3.176 -17.604 1.00 2.13 C ATOM 2026 O VAL A 126 -2.189 -4.232 -17.010 1.00 2.22 O ATOM 2027 CB VAL A 126 -0.654 -1.551 -16.242 1.00 21.11 C ATOM 2028 CG1 VAL A 126 -1.784 -0.540 -16.356 1.00 13.20 C ATOM 2029 CG2 VAL A 126 -0.789 -2.373 -14.969 1.00 1.22 C ATOM 0 H VAL A 126 -0.258 -0.714 -18.560 1.00 61.10 H new ATOM 0 HA VAL A 126 0.161 -3.215 -17.348 1.00 22.33 H new ATOM 0 HB VAL A 126 0.287 -1.004 -16.196 1.00 21.11 H new ATOM 0 HG11 VAL A 126 -1.789 0.101 -15.475 1.00 13.20 H new ATOM 0 HG12 VAL A 126 -1.638 0.070 -17.248 1.00 13.20 H new ATOM 0 HG13 VAL A 126 -2.736 -1.065 -16.428 1.00 13.20 H new ATOM 0 HG21 VAL A 126 -0.808 -1.707 -14.106 1.00 1.22 H new ATOM 0 HG22 VAL A 126 -1.714 -2.948 -15.004 1.00 1.22 H new ATOM 0 HG23 VAL A 126 0.058 -3.053 -14.884 1.00 1.22 H new ATOM 2039 N SER A 127 -2.871 -2.584 -18.383 1.00 20.54 N ATOM 2040 CA SER A 127 -4.198 -3.154 -18.586 1.00 11.35 C ATOM 2041 C SER A 127 -4.103 -4.615 -19.012 1.00 62.42 C ATOM 2042 O SER A 127 -4.986 -5.418 -18.714 1.00 35.31 O ATOM 2043 CB SER A 127 -4.964 -2.352 -19.639 1.00 54.04 C ATOM 2044 OG SER A 127 -6.041 -1.640 -19.055 1.00 75.31 O ATOM 0 H SER A 127 -2.706 -1.711 -18.883 1.00 20.54 H new ATOM 0 HA SER A 127 -4.736 -3.105 -17.639 1.00 11.35 H new ATOM 0 HB2 SER A 127 -4.287 -1.654 -20.132 1.00 54.04 H new ATOM 0 HB3 SER A 127 -5.343 -3.025 -20.408 1.00 54.04 H new ATOM 0 HG SER A 127 -5.733 -0.752 -18.776 1.00 75.31 H new ATOM 2050 N GLN A 128 -3.024 -4.952 -19.712 1.00 10.12 N ATOM 2051 CA GLN A 128 -2.813 -6.316 -20.180 1.00 71.55 C ATOM 2052 C GLN A 128 -2.842 -7.302 -19.017 1.00 63.21 C ATOM 2053 O GLN A 128 -3.571 -8.294 -19.049 1.00 3.23 O ATOM 2054 CB GLN A 128 -1.479 -6.423 -20.922 1.00 74.10 C ATOM 2055 CG GLN A 128 -1.596 -7.065 -22.295 1.00 33.41 C ATOM 2056 CD GLN A 128 -0.573 -6.532 -23.278 1.00 2.22 C ATOM 2057 OE1 GLN A 128 -0.042 -5.435 -23.104 1.00 43.54 O ATOM 2058 NE2 GLN A 128 -0.290 -7.307 -24.318 1.00 31.51 N ATOM 0 H GLN A 128 -2.283 -4.299 -19.967 1.00 10.12 H new ATOM 0 HA GLN A 128 -3.623 -6.567 -20.865 1.00 71.55 H new ATOM 0 HB2 GLN A 128 -1.053 -5.426 -21.032 1.00 74.10 H new ATOM 0 HB3 GLN A 128 -0.782 -7.003 -20.317 1.00 74.10 H new ATOM 0 HG2 GLN A 128 -1.474 -8.144 -22.199 1.00 33.41 H new ATOM 0 HG3 GLN A 128 -2.597 -6.891 -22.689 1.00 33.41 H new ATOM 0 HE21 GLN A 128 -0.754 -8.209 -24.423 1.00 31.51 H new ATOM 0 HE22 GLN A 128 0.392 -7.000 -25.012 1.00 31.51 H new ATOM 2067 N ASP A 129 -2.044 -7.023 -17.992 1.00 72.01 N ATOM 2068 CA ASP A 129 -1.979 -7.885 -16.818 1.00 5.15 C ATOM 2069 C ASP A 129 -1.454 -9.269 -17.188 1.00 4.34 C ATOM 2070 O ASP A 129 -1.704 -10.247 -16.483 1.00 41.04 O ATOM 2071 CB ASP A 129 -3.359 -8.006 -16.170 1.00 3.25 C ATOM 2072 CG ASP A 129 -3.282 -8.453 -14.723 1.00 61.30 C ATOM 2073 OD1 ASP A 129 -3.279 -9.678 -14.481 1.00 23.22 O ATOM 2074 OD2 ASP A 129 -3.226 -7.579 -13.833 1.00 42.42 O ATOM 0 H ASP A 129 -1.433 -6.207 -17.951 1.00 72.01 H new ATOM 0 HA ASP A 129 -1.290 -7.433 -16.104 1.00 5.15 H new ATOM 0 HB2 ASP A 129 -3.868 -7.044 -16.223 1.00 3.25 H new ATOM 0 HB3 ASP A 129 -3.962 -8.717 -16.735 1.00 3.25 H new ATOM 2079 N ARG A 130 -0.726 -9.343 -18.297 1.00 42.41 N ATOM 2080 CA ARG A 130 -0.168 -10.607 -18.762 1.00 3.22 C ATOM 2081 C ARG A 130 0.631 -10.409 -20.047 1.00 54.21 C ATOM 2082 O ARG A 130 0.339 -11.026 -21.072 1.00 55.12 O ATOM 2083 CB ARG A 130 -1.284 -11.627 -18.994 1.00 41.21 C ATOM 2084 CG ARG A 130 -2.444 -11.084 -19.813 1.00 62.41 C ATOM 2085 CD ARG A 130 -2.674 -11.911 -21.068 1.00 61.25 C ATOM 2086 NE ARG A 130 -3.670 -12.959 -20.859 1.00 50.52 N ATOM 2087 CZ ARG A 130 -3.909 -13.931 -21.732 1.00 40.44 C ATOM 2088 NH1 ARG A 130 -3.227 -13.989 -22.868 1.00 1.41 N ATOM 2089 NH2 ARG A 130 -4.832 -14.847 -21.470 1.00 64.53 N ATOM 0 H ARG A 130 -0.509 -8.542 -18.890 1.00 42.41 H new ATOM 0 HA ARG A 130 0.504 -10.984 -17.991 1.00 3.22 H new ATOM 0 HB2 ARG A 130 -0.869 -12.498 -19.501 1.00 41.21 H new ATOM 0 HB3 ARG A 130 -1.659 -11.968 -18.029 1.00 41.21 H new ATOM 0 HG2 ARG A 130 -3.350 -11.082 -19.206 1.00 62.41 H new ATOM 0 HG3 ARG A 130 -2.243 -10.049 -20.090 1.00 62.41 H new ATOM 0 HD2 ARG A 130 -3.000 -11.258 -21.878 1.00 61.25 H new ATOM 0 HD3 ARG A 130 -1.733 -12.363 -21.382 1.00 61.25 H new ATOM 0 HE ARG A 130 -4.212 -12.943 -19.995 1.00 50.52 H new ATOM 0 HH11 ARG A 130 -2.517 -13.286 -23.073 1.00 1.41 H new ATOM 0 HH12 ARG A 130 -3.413 -14.737 -23.537 1.00 1.41 H new ATOM 0 HH21 ARG A 130 -5.359 -14.805 -20.598 1.00 64.53 H new ATOM 0 HH22 ARG A 130 -5.015 -15.593 -22.141 1.00 64.53 H new ATOM 2103 N CYS A 131 1.638 -9.545 -19.985 1.00 14.14 N ATOM 2104 CA CYS A 131 2.477 -9.264 -21.144 1.00 24.42 C ATOM 2105 C CYS A 131 3.891 -8.889 -20.713 1.00 25.23 C ATOM 2106 O CYS A 131 4.083 -8.190 -19.718 1.00 51.14 O ATOM 2107 CB CYS A 131 1.870 -8.137 -21.979 1.00 13.50 C ATOM 2108 SG CYS A 131 2.881 -7.637 -23.392 1.00 72.44 S ATOM 0 H CYS A 131 1.893 -9.027 -19.144 1.00 14.14 H new ATOM 0 HA CYS A 131 2.529 -10.168 -21.751 1.00 24.42 H new ATOM 0 HB2 CYS A 131 0.892 -8.454 -22.340 1.00 13.50 H new ATOM 0 HB3 CYS A 131 1.708 -7.271 -21.337 1.00 13.50 H new ATOM 0 HG CYS A 131 2.528 -6.447 -23.779 1.00 72.44 H new ATOM 2114 N ALA A 132 4.879 -9.360 -21.467 1.00 21.41 N ATOM 2115 CA ALA A 132 6.276 -9.074 -21.163 1.00 74.21 C ATOM 2116 C ALA A 132 6.986 -8.464 -22.367 1.00 74.40 C ATOM 2117 O ALA A 132 7.033 -9.065 -23.440 1.00 40.20 O ATOM 2118 CB ALA A 132 6.988 -10.341 -20.714 1.00 23.15 C ATOM 0 H ALA A 132 4.738 -9.941 -22.293 1.00 21.41 H new ATOM 0 HA ALA A 132 6.304 -8.347 -20.351 1.00 74.21 H new ATOM 0 HB1 ALA A 132 8.030 -10.113 -20.490 1.00 23.15 H new ATOM 0 HB2 ALA A 132 6.503 -10.734 -19.821 1.00 23.15 H new ATOM 0 HB3 ALA A 132 6.942 -11.085 -21.509 1.00 23.15 H new ATOM 2124 N GLU A 133 7.535 -7.268 -22.181 1.00 62.30 N ATOM 2125 CA GLU A 133 8.241 -6.578 -23.254 1.00 1.42 C ATOM 2126 C GLU A 133 9.346 -5.687 -22.693 1.00 21.12 C ATOM 2127 O GLU A 133 9.204 -5.105 -21.617 1.00 71.04 O ATOM 2128 CB GLU A 133 7.264 -5.738 -24.079 1.00 41.14 C ATOM 2129 CG GLU A 133 7.044 -6.268 -25.486 1.00 45.34 C ATOM 2130 CD GLU A 133 5.983 -5.493 -26.242 1.00 52.25 C ATOM 2131 OE1 GLU A 133 5.516 -4.460 -25.717 1.00 72.41 O ATOM 2132 OE2 GLU A 133 5.619 -5.918 -27.359 1.00 32.25 O ATOM 0 H GLU A 133 7.505 -6.757 -21.299 1.00 62.30 H new ATOM 0 HA GLU A 133 8.696 -7.331 -23.898 1.00 1.42 H new ATOM 0 HB2 GLU A 133 6.306 -5.697 -23.561 1.00 41.14 H new ATOM 0 HB3 GLU A 133 7.638 -4.716 -24.139 1.00 41.14 H new ATOM 0 HG2 GLU A 133 7.983 -6.224 -26.038 1.00 45.34 H new ATOM 0 HG3 GLU A 133 6.754 -7.317 -25.434 1.00 45.34 H new ATOM 2139 N VAL A 134 10.448 -5.587 -23.429 1.00 42.53 N ATOM 2140 CA VAL A 134 11.578 -4.767 -23.007 1.00 32.32 C ATOM 2141 C VAL A 134 12.316 -4.188 -24.208 1.00 40.32 C ATOM 2142 O VAL A 134 12.524 -4.870 -25.212 1.00 42.02 O ATOM 2143 CB VAL A 134 12.569 -5.577 -22.151 1.00 25.33 C ATOM 2144 CG1 VAL A 134 13.035 -6.816 -22.901 1.00 2.21 C ATOM 2145 CG2 VAL A 134 13.754 -4.712 -21.746 1.00 74.21 C ATOM 0 H VAL A 134 10.583 -6.064 -24.321 1.00 42.53 H new ATOM 0 HA VAL A 134 11.172 -3.952 -22.407 1.00 32.32 H new ATOM 0 HB VAL A 134 12.058 -5.901 -21.244 1.00 25.33 H new ATOM 0 HG11 VAL A 134 13.735 -7.375 -22.280 1.00 2.21 H new ATOM 0 HG12 VAL A 134 12.176 -7.444 -23.136 1.00 2.21 H new ATOM 0 HG13 VAL A 134 13.529 -6.517 -23.826 1.00 2.21 H new ATOM 0 HG21 VAL A 134 14.444 -5.300 -21.142 1.00 74.21 H new ATOM 0 HG22 VAL A 134 14.267 -4.356 -22.640 1.00 74.21 H new ATOM 0 HG23 VAL A 134 13.401 -3.859 -21.166 1.00 74.21 H new ATOM 2155 N THR A 135 12.711 -2.923 -24.099 1.00 42.04 N ATOM 2156 CA THR A 135 13.426 -2.250 -25.177 1.00 21.23 C ATOM 2157 C THR A 135 14.467 -1.282 -24.625 1.00 72.45 C ATOM 2158 O THR A 135 14.134 -0.343 -23.902 1.00 1.31 O ATOM 2159 CB THR A 135 12.460 -1.479 -26.096 1.00 3.11 C ATOM 2160 OG1 THR A 135 13.199 -0.624 -26.976 1.00 20.22 O ATOM 2161 CG2 THR A 135 11.482 -0.649 -25.278 1.00 75.54 C ATOM 0 H THR A 135 12.548 -2.344 -23.275 1.00 42.04 H new ATOM 0 HA THR A 135 13.926 -3.025 -25.757 1.00 21.23 H new ATOM 0 HB THR A 135 11.895 -2.203 -26.683 1.00 3.11 H new ATOM 0 HG1 THR A 135 12.578 -0.138 -27.558 1.00 20.22 H new ATOM 0 HG21 THR A 135 10.810 -0.113 -25.948 1.00 75.54 H new ATOM 0 HG22 THR A 135 10.901 -1.305 -24.630 1.00 75.54 H new ATOM 0 HG23 THR A 135 12.033 0.067 -24.669 1.00 75.54 H new ATOM 2169 N LEU A 136 15.728 -1.517 -24.972 1.00 13.32 N ATOM 2170 CA LEU A 136 16.819 -0.664 -24.512 1.00 35.21 C ATOM 2171 C LEU A 136 17.948 -0.625 -25.536 1.00 60.03 C ATOM 2172 O LEU A 136 18.258 -1.633 -26.171 1.00 54.41 O ATOM 2173 CB LEU A 136 17.351 -1.164 -23.168 1.00 32.22 C ATOM 2174 CG LEU A 136 17.792 -2.627 -23.123 1.00 65.41 C ATOM 2175 CD1 LEU A 136 19.213 -2.772 -23.646 1.00 60.53 C ATOM 2176 CD2 LEU A 136 17.685 -3.174 -21.707 1.00 4.21 C ATOM 0 H LEU A 136 16.020 -2.290 -25.570 1.00 13.32 H new ATOM 0 HA LEU A 136 16.430 0.347 -24.389 1.00 35.21 H new ATOM 0 HB2 LEU A 136 18.198 -0.541 -22.881 1.00 32.22 H new ATOM 0 HB3 LEU A 136 16.577 -1.016 -22.415 1.00 32.22 H new ATOM 0 HG LEU A 136 17.129 -3.206 -23.765 1.00 65.41 H new ATOM 0 HD11 LEU A 136 19.510 -3.820 -23.607 1.00 60.53 H new ATOM 0 HD12 LEU A 136 19.259 -2.420 -24.677 1.00 60.53 H new ATOM 0 HD13 LEU A 136 19.890 -2.180 -23.030 1.00 60.53 H new ATOM 0 HD21 LEU A 136 18.003 -4.216 -21.695 1.00 4.21 H new ATOM 0 HD22 LEU A 136 18.324 -2.592 -21.043 1.00 4.21 H new ATOM 0 HD23 LEU A 136 16.651 -3.106 -21.368 1.00 4.21 H new