USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=22 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 99 GLN : amide:sc= 0.181 K(o=0.59,f=-3.9!) USER MOD Set 1.2: A 122 LYS NZ :NH3+ -178:sc= 0.407 (180deg=0) USER MOD Set 2.1: A 67 MET CE :methyl -150:sc= -6.38! (180deg=-10.3!) USER MOD Set 2.2: A 111 MET CE :methyl -153:sc= -4.25 (180deg=-7.23!) USER MOD Set 3.1: A 66 MET CE :methyl -107:sc= -1.56 (180deg=-4.19!) USER MOD Set 3.2: A 135 THR OG1 : rot 71:sc= -0.726 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 X(o=0,f=0) USER MOD Single : A 14 MET CE :methyl 160:sc=-0.00878 (180deg=-0.412) USER MOD Single : A 20 GLN : amide:sc= -0.0841 K(o=-0.084,f=-2.7!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 150:sc= -0.754 USER MOD Single : A 72 SER OG : rot 43:sc= 0.928 USER MOD Single : A 74 ASN : amide:sc= -1.22 X(o=-1.2,f=-1.1) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 159:sc= -0.0618 (180deg=-0.378) USER MOD Single : A 80 THR OG1 : rot -72:sc= 1.1 USER MOD Single : A 84 THR OG1 : rot 111:sc= 0.702 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.0622 X(o=-0.062,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= -0.127 USER MOD Single : A 93 ASN : amide:sc= -0.732 K(o=-0.73,f=-3.5!) USER MOD Single : A 95 ASN : amide:sc= -0.997 X(o=-1,f=-0.69) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 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 127 SER OG : rot -82:sc= 0.705 USER MOD Single : A 128 GLN : amide:sc= -0.04 K(o=-0.04,f=-0.55) USER MOD Single : A 131 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 4.284 5.537 -7.183 1.00 3.40 N ATOM 70 CA LYS A 4 5.707 5.765 -7.406 1.00 61.10 C ATOM 71 C LYS A 4 6.536 5.188 -6.263 1.00 1.42 C ATOM 72 O LYS A 4 6.992 5.920 -5.384 1.00 23.11 O ATOM 73 CB LYS A 4 5.989 7.262 -7.550 1.00 12.23 C ATOM 74 CG LYS A 4 5.306 8.114 -6.494 1.00 34.22 C ATOM 75 CD LYS A 4 6.060 9.410 -6.249 1.00 53.01 C ATOM 76 CE LYS A 4 6.047 9.793 -4.777 1.00 53.12 C ATOM 77 NZ LYS A 4 5.511 11.167 -4.566 1.00 64.42 N ATOM 0 HA LYS A 4 5.990 5.258 -8.329 1.00 61.10 H new ATOM 0 HB2 LYS A 4 7.065 7.427 -7.498 1.00 12.23 H new ATOM 0 HB3 LYS A 4 5.664 7.591 -8.537 1.00 12.23 H new ATOM 0 HG2 LYS A 4 4.287 8.339 -6.810 1.00 34.22 H new ATOM 0 HG3 LYS A 4 5.234 7.552 -5.563 1.00 34.22 H new ATOM 0 HD2 LYS A 4 7.090 9.303 -6.589 1.00 53.01 H new ATOM 0 HD3 LYS A 4 5.612 10.210 -6.838 1.00 53.01 H new ATOM 0 HE2 LYS A 4 5.441 9.077 -4.221 1.00 53.12 H new ATOM 0 HE3 LYS A 4 7.059 9.733 -4.377 1.00 53.12 H new ATOM 0 HZ1 LYS A 4 5.519 11.390 -3.550 1.00 64.42 H new ATOM 0 HZ2 LYS A 4 6.104 11.853 -5.076 1.00 64.42 H new ATOM 0 HZ3 LYS A 4 4.536 11.218 -4.924 1.00 64.42 H new ATOM 91 N ASP A 5 6.728 3.874 -6.282 1.00 1.03 N ATOM 92 CA ASP A 5 7.505 3.200 -5.248 1.00 33.23 C ATOM 93 C ASP A 5 8.965 3.062 -5.668 1.00 12.33 C ATOM 94 O ASP A 5 9.530 1.969 -5.633 1.00 61.14 O ATOM 95 CB ASP A 5 6.913 1.820 -4.954 1.00 4.20 C ATOM 96 CG ASP A 5 7.236 1.338 -3.553 1.00 40.32 C ATOM 97 OD1 ASP A 5 8.305 1.713 -3.029 1.00 3.31 O ATOM 98 OD2 ASP A 5 6.420 0.586 -2.982 1.00 35.54 O ATOM 0 H ASP A 5 6.356 3.254 -7.002 1.00 1.03 H new ATOM 0 HA ASP A 5 7.462 3.806 -4.343 1.00 33.23 H new ATOM 0 HB2 ASP A 5 5.831 1.857 -5.082 1.00 4.20 H new ATOM 0 HB3 ASP A 5 7.295 1.102 -5.679 1.00 4.20 H new ATOM 103 N ILE A 6 9.569 4.177 -6.064 1.00 55.43 N ATOM 104 CA ILE A 6 10.962 4.181 -6.491 1.00 23.32 C ATOM 105 C ILE A 6 11.891 3.822 -5.336 1.00 44.10 C ATOM 106 O ILE A 6 11.442 3.591 -4.213 1.00 42.23 O ATOM 107 CB ILE A 6 11.374 5.552 -7.059 1.00 71.43 C ATOM 108 CG1 ILE A 6 11.011 6.666 -6.076 1.00 20.15 C ATOM 109 CG2 ILE A 6 10.707 5.789 -8.406 1.00 33.51 C ATOM 110 CD1 ILE A 6 11.904 7.882 -6.184 1.00 54.32 C ATOM 0 H ILE A 6 9.115 5.090 -6.098 1.00 55.43 H new ATOM 0 HA ILE A 6 11.053 3.430 -7.276 1.00 23.32 H new ATOM 0 HB ILE A 6 12.454 5.559 -7.204 1.00 71.43 H new ATOM 0 HG12 ILE A 6 9.978 6.968 -6.247 1.00 20.15 H new ATOM 0 HG13 ILE A 6 11.065 6.275 -5.060 1.00 20.15 H new ATOM 0 HG21 ILE A 6 11.008 6.762 -8.795 1.00 33.51 H new ATOM 0 HG22 ILE A 6 11.011 5.009 -9.105 1.00 33.51 H new ATOM 0 HG23 ILE A 6 9.624 5.766 -8.285 1.00 33.51 H new ATOM 0 HD11 ILE A 6 11.588 8.631 -5.458 1.00 54.32 H new ATOM 0 HD12 ILE A 6 12.936 7.594 -5.984 1.00 54.32 H new ATOM 0 HD13 ILE A 6 11.832 8.298 -7.189 1.00 54.32 H new ATOM 122 N ARG A 7 13.189 3.779 -5.619 1.00 41.13 N ATOM 123 CA ARG A 7 14.182 3.449 -4.604 1.00 42.41 C ATOM 124 C ARG A 7 15.144 4.614 -4.386 1.00 62.33 C ATOM 125 O ARG A 7 16.363 4.441 -4.426 1.00 54.11 O ATOM 126 CB ARG A 7 14.963 2.198 -5.011 1.00 52.31 C ATOM 127 CG ARG A 7 15.589 1.463 -3.838 1.00 24.12 C ATOM 128 CD ARG A 7 14.605 0.499 -3.194 1.00 53.32 C ATOM 129 NE ARG A 7 15.282 -0.601 -2.512 1.00 55.41 N ATOM 130 CZ ARG A 7 14.664 -1.454 -1.703 1.00 25.14 C ATOM 131 NH1 ARG A 7 13.364 -1.335 -1.476 1.00 34.34 N ATOM 132 NH2 ARG A 7 15.349 -2.429 -1.119 1.00 31.35 N ATOM 0 H ARG A 7 13.577 3.969 -6.543 1.00 41.13 H new ATOM 0 HA ARG A 7 13.658 3.253 -3.669 1.00 42.41 H new ATOM 0 HB2 ARG A 7 14.294 1.519 -5.540 1.00 52.31 H new ATOM 0 HB3 ARG A 7 15.748 2.482 -5.712 1.00 52.31 H new ATOM 0 HG2 ARG A 7 16.467 0.914 -4.178 1.00 24.12 H new ATOM 0 HG3 ARG A 7 15.931 2.185 -3.096 1.00 24.12 H new ATOM 0 HD2 ARG A 7 13.983 1.039 -2.481 1.00 53.32 H new ATOM 0 HD3 ARG A 7 13.939 0.097 -3.958 1.00 53.32 H new ATOM 0 HE ARG A 7 16.283 -0.721 -2.665 1.00 55.41 H new ATOM 0 HH11 ARG A 7 12.835 -0.587 -1.923 1.00 34.34 H new ATOM 0 HH12 ARG A 7 12.893 -1.992 -0.854 1.00 34.34 H new ATOM 0 HH21 ARG A 7 16.350 -2.523 -1.291 1.00 31.35 H new ATOM 0 HH22 ARG A 7 14.875 -3.084 -0.498 1.00 31.35 H new ATOM 146 N ASP A 8 14.589 5.798 -4.157 1.00 14.32 N ATOM 147 CA ASP A 8 15.397 6.991 -3.932 1.00 52.22 C ATOM 148 C ASP A 8 16.223 7.329 -5.169 1.00 71.14 C ATOM 149 O ASP A 8 17.276 7.959 -5.072 1.00 40.20 O ATOM 150 CB ASP A 8 16.318 6.790 -2.728 1.00 30.10 C ATOM 151 CG ASP A 8 15.604 6.149 -1.554 1.00 2.42 C ATOM 152 OD1 ASP A 8 14.646 6.761 -1.037 1.00 3.11 O ATOM 153 OD2 ASP A 8 16.004 5.037 -1.151 1.00 61.41 O ATOM 0 H ASP A 8 13.582 5.958 -4.122 1.00 14.32 H new ATOM 0 HA ASP A 8 14.723 7.823 -3.729 1.00 52.22 H new ATOM 0 HB2 ASP A 8 17.163 6.166 -3.020 1.00 30.10 H new ATOM 0 HB3 ASP A 8 16.725 7.753 -2.420 1.00 30.10 H new ATOM 158 N TYR A 9 15.739 6.904 -6.331 1.00 51.53 N ATOM 159 CA TYR A 9 16.434 7.159 -7.588 1.00 22.45 C ATOM 160 C TYR A 9 17.889 6.705 -7.507 1.00 35.23 C ATOM 161 O TYR A 9 18.773 7.480 -7.146 1.00 10.01 O ATOM 162 CB TYR A 9 16.371 8.646 -7.938 1.00 2.34 C ATOM 163 CG TYR A 9 14.971 9.143 -8.221 1.00 24.11 C ATOM 164 CD1 TYR A 9 14.116 8.432 -9.054 1.00 23.31 C ATOM 165 CD2 TYR A 9 14.504 10.323 -7.657 1.00 3.52 C ATOM 166 CE1 TYR A 9 12.837 8.882 -9.316 1.00 72.23 C ATOM 167 CE2 TYR A 9 13.226 10.780 -7.912 1.00 51.34 C ATOM 168 CZ TYR A 9 12.396 10.056 -8.743 1.00 1.22 C ATOM 169 OH TYR A 9 11.122 10.509 -9.001 1.00 65.30 O ATOM 0 H TYR A 9 14.868 6.382 -6.429 1.00 51.53 H new ATOM 0 HA TYR A 9 15.936 6.587 -8.371 1.00 22.45 H new ATOM 0 HB2 TYR A 9 16.793 9.223 -7.115 1.00 2.34 H new ATOM 0 HB3 TYR A 9 16.997 8.832 -8.811 1.00 2.34 H new ATOM 0 HD1 TYR A 9 14.458 7.512 -9.504 1.00 23.31 H new ATOM 0 HD2 TYR A 9 15.152 10.893 -7.008 1.00 3.52 H new ATOM 0 HE1 TYR A 9 12.185 8.317 -9.966 1.00 72.23 H new ATOM 0 HE2 TYR A 9 12.878 11.699 -7.464 1.00 51.34 H new ATOM 0 HH TYR A 9 10.970 11.349 -8.519 1.00 65.30 H new ATOM 179 N ASN A 10 18.127 5.442 -7.846 1.00 43.23 N ATOM 180 CA ASN A 10 19.474 4.883 -7.813 1.00 11.32 C ATOM 181 C ASN A 10 19.539 3.573 -8.592 1.00 53.20 C ATOM 182 O ASN A 10 20.230 3.476 -9.606 1.00 72.22 O ATOM 183 CB ASN A 10 19.917 4.652 -6.367 1.00 13.03 C ATOM 184 CG ASN A 10 21.424 4.553 -6.232 1.00 60.14 C ATOM 185 OD1 ASN A 10 21.984 3.457 -6.186 1.00 15.31 O ATOM 186 ND2 ASN A 10 22.089 5.701 -6.169 1.00 30.40 N ATOM 0 H ASN A 10 17.405 4.787 -8.146 1.00 43.23 H new ATOM 0 HA ASN A 10 20.149 5.598 -8.283 1.00 11.32 H new ATOM 0 HB2 ASN A 10 19.552 5.468 -5.743 1.00 13.03 H new ATOM 0 HB3 ASN A 10 19.461 3.736 -5.992 1.00 13.03 H new ATOM 0 HD21 ASN A 10 23.105 5.698 -6.079 1.00 30.40 H new ATOM 0 HD22 ASN A 10 21.584 6.586 -6.211 1.00 30.40 H new ATOM 193 N ASP A 11 18.814 2.569 -8.111 1.00 50.13 N ATOM 194 CA ASP A 11 18.787 1.265 -8.763 1.00 62.11 C ATOM 195 C ASP A 11 17.496 0.521 -8.438 1.00 15.21 C ATOM 196 O ASP A 11 17.522 -0.638 -8.025 1.00 1.41 O ATOM 197 CB ASP A 11 19.994 0.430 -8.331 1.00 34.02 C ATOM 198 CG ASP A 11 21.277 0.875 -9.004 1.00 11.31 C ATOM 199 OD1 ASP A 11 21.323 0.876 -10.252 1.00 43.11 O ATOM 200 OD2 ASP A 11 22.235 1.224 -8.283 1.00 33.24 O ATOM 0 H ASP A 11 18.237 2.633 -7.272 1.00 50.13 H new ATOM 0 HA ASP A 11 18.832 1.424 -9.840 1.00 62.11 H new ATOM 0 HB2 ASP A 11 20.112 0.499 -7.250 1.00 34.02 H new ATOM 0 HB3 ASP A 11 19.809 -0.618 -8.565 1.00 34.02 H new ATOM 205 N ALA A 12 16.366 1.197 -8.626 1.00 65.53 N ATOM 206 CA ALA A 12 15.065 0.600 -8.354 1.00 32.30 C ATOM 207 C ALA A 12 14.737 -0.489 -9.370 1.00 31.21 C ATOM 208 O ALA A 12 14.191 -1.535 -9.018 1.00 71.24 O ATOM 209 CB ALA A 12 13.983 1.669 -8.356 1.00 51.41 C ATOM 0 H ALA A 12 16.327 2.158 -8.965 1.00 65.53 H new ATOM 0 HA ALA A 12 15.104 0.139 -7.367 1.00 32.30 H new ATOM 0 HB1 ALA A 12 13.016 1.209 -8.151 1.00 51.41 H new ATOM 0 HB2 ALA A 12 14.202 2.410 -7.587 1.00 51.41 H new ATOM 0 HB3 ALA A 12 13.954 2.156 -9.331 1.00 51.41 H new ATOM 215 N ASP A 13 15.072 -0.236 -10.630 1.00 64.41 N ATOM 216 CA ASP A 13 14.814 -1.196 -11.697 1.00 53.24 C ATOM 217 C ASP A 13 15.499 -2.528 -11.409 1.00 11.24 C ATOM 218 O ASP A 13 14.934 -3.593 -11.654 1.00 63.33 O ATOM 219 CB ASP A 13 15.295 -0.641 -13.039 1.00 10.21 C ATOM 220 CG ASP A 13 16.721 -0.130 -12.976 1.00 61.31 C ATOM 221 OD1 ASP A 13 17.651 -0.964 -12.996 1.00 54.24 O ATOM 222 OD2 ASP A 13 16.908 1.103 -12.906 1.00 32.33 O ATOM 0 H ASP A 13 15.523 0.626 -10.938 1.00 64.41 H new ATOM 0 HA ASP A 13 13.738 -1.365 -11.746 1.00 53.24 H new ATOM 0 HB2 ASP A 13 15.225 -1.421 -13.798 1.00 10.21 H new ATOM 0 HB3 ASP A 13 14.635 0.169 -13.352 1.00 10.21 H new ATOM 227 N MET A 14 16.719 -2.459 -10.887 1.00 2.22 N ATOM 228 CA MET A 14 17.481 -3.660 -10.565 1.00 2.33 C ATOM 229 C MET A 14 16.675 -4.590 -9.664 1.00 1.35 C ATOM 230 O MET A 14 16.853 -5.807 -9.694 1.00 3.10 O ATOM 231 CB MET A 14 18.799 -3.286 -9.883 1.00 51.01 C ATOM 232 CG MET A 14 19.686 -4.482 -9.579 1.00 24.01 C ATOM 233 SD MET A 14 21.364 -4.280 -10.209 1.00 31.24 S ATOM 234 CE MET A 14 21.880 -2.807 -9.330 1.00 64.40 C ATOM 0 H MET A 14 17.201 -1.585 -10.678 1.00 2.22 H new ATOM 0 HA MET A 14 17.698 -4.183 -11.496 1.00 2.33 H new ATOM 0 HB2 MET A 14 19.345 -2.592 -10.522 1.00 51.01 H new ATOM 0 HB3 MET A 14 18.581 -2.760 -8.954 1.00 51.01 H new ATOM 0 HG2 MET A 14 19.723 -4.637 -8.501 1.00 24.01 H new ATOM 0 HG3 MET A 14 19.244 -5.378 -10.015 1.00 24.01 H new ATOM 0 HE1 MET A 14 22.968 -2.750 -9.324 1.00 64.40 H new ATOM 0 HE2 MET A 14 21.473 -1.926 -9.826 1.00 64.40 H new ATOM 0 HE3 MET A 14 21.513 -2.848 -8.304 1.00 64.40 H new ATOM 244 N ALA A 15 15.788 -4.008 -8.862 1.00 65.13 N ATOM 245 CA ALA A 15 14.954 -4.785 -7.954 1.00 63.21 C ATOM 246 C ALA A 15 14.101 -5.792 -8.718 1.00 65.42 C ATOM 247 O ALA A 15 13.633 -6.779 -8.151 1.00 74.53 O ATOM 248 CB ALA A 15 14.071 -3.862 -7.128 1.00 40.22 C ATOM 0 H ALA A 15 15.629 -3.001 -8.823 1.00 65.13 H new ATOM 0 HA ALA A 15 15.610 -5.339 -7.283 1.00 63.21 H new ATOM 0 HB1 ALA A 15 13.453 -4.456 -6.454 1.00 40.22 H new ATOM 0 HB2 ALA A 15 14.696 -3.185 -6.545 1.00 40.22 H new ATOM 0 HB3 ALA A 15 13.430 -3.282 -7.792 1.00 40.22 H new ATOM 254 N ARG A 16 13.904 -5.536 -10.007 1.00 71.12 N ATOM 255 CA ARG A 16 13.106 -6.420 -10.848 1.00 55.32 C ATOM 256 C ARG A 16 13.643 -7.847 -10.801 1.00 33.11 C ATOM 257 O ARG A 16 12.905 -8.807 -11.026 1.00 31.41 O ATOM 258 CB ARG A 16 13.097 -5.914 -12.292 1.00 70.20 C ATOM 259 CG ARG A 16 12.176 -6.703 -13.208 1.00 72.21 C ATOM 260 CD ARG A 16 12.551 -6.517 -14.670 1.00 55.40 C ATOM 261 NE ARG A 16 11.784 -7.397 -15.548 1.00 41.51 N ATOM 262 CZ ARG A 16 12.166 -7.722 -16.778 1.00 43.31 C ATOM 263 NH1 ARG A 16 13.299 -7.242 -17.272 1.00 63.33 N ATOM 264 NH2 ARG A 16 11.415 -8.528 -17.516 1.00 74.42 N ATOM 0 H ARG A 16 14.286 -4.724 -10.492 1.00 71.12 H new ATOM 0 HA ARG A 16 12.086 -6.422 -10.464 1.00 55.32 H new ATOM 0 HB2 ARG A 16 12.793 -4.867 -12.299 1.00 70.20 H new ATOM 0 HB3 ARG A 16 14.112 -5.954 -12.689 1.00 70.20 H new ATOM 0 HG2 ARG A 16 12.224 -7.761 -12.951 1.00 72.21 H new ATOM 0 HG3 ARG A 16 11.145 -6.384 -13.052 1.00 72.21 H new ATOM 0 HD2 ARG A 16 12.381 -5.480 -14.959 1.00 55.40 H new ATOM 0 HD3 ARG A 16 13.615 -6.714 -14.799 1.00 55.40 H new ATOM 0 HE ARG A 16 10.907 -7.783 -15.198 1.00 41.51 H new ATOM 0 HH11 ARG A 16 13.879 -6.622 -16.707 1.00 63.33 H new ATOM 0 HH12 ARG A 16 13.590 -7.493 -18.217 1.00 63.33 H new ATOM 0 HH21 ARG A 16 10.543 -8.899 -17.139 1.00 74.42 H new ATOM 0 HH22 ARG A 16 11.709 -8.777 -18.460 1.00 74.42 H new ATOM 278 N LEU A 17 14.932 -7.979 -10.508 1.00 34.15 N ATOM 279 CA LEU A 17 15.569 -9.289 -10.431 1.00 34.20 C ATOM 280 C LEU A 17 14.792 -10.219 -9.505 1.00 33.24 C ATOM 281 O LEU A 17 14.808 -11.439 -9.675 1.00 43.03 O ATOM 282 CB LEU A 17 17.010 -9.149 -9.940 1.00 25.24 C ATOM 283 CG LEU A 17 17.194 -9.016 -8.427 1.00 63.15 C ATOM 284 CD1 LEU A 17 17.389 -10.384 -7.791 1.00 14.50 C ATOM 285 CD2 LEU A 17 18.373 -8.106 -8.112 1.00 34.45 C ATOM 0 H LEU A 17 15.557 -7.195 -10.320 1.00 34.15 H new ATOM 0 HA LEU A 17 15.573 -9.723 -11.431 1.00 34.20 H new ATOM 0 HB2 LEU A 17 17.574 -10.018 -10.280 1.00 25.24 H new ATOM 0 HB3 LEU A 17 17.452 -8.275 -10.418 1.00 25.24 H new ATOM 0 HG LEU A 17 16.293 -8.569 -8.008 1.00 63.15 H new ATOM 0 HD11 LEU A 17 17.518 -10.270 -6.715 1.00 14.50 H new ATOM 0 HD12 LEU A 17 16.515 -11.005 -7.988 1.00 14.50 H new ATOM 0 HD13 LEU A 17 18.274 -10.859 -8.214 1.00 14.50 H new ATOM 0 HD21 LEU A 17 18.490 -8.022 -7.031 1.00 34.45 H new ATOM 0 HD22 LEU A 17 19.282 -8.525 -8.544 1.00 34.45 H new ATOM 0 HD23 LEU A 17 18.193 -7.118 -8.535 1.00 34.45 H new ATOM 297 N LEU A 18 14.110 -9.636 -8.525 1.00 42.40 N ATOM 298 CA LEU A 18 13.324 -10.412 -7.572 1.00 41.31 C ATOM 299 C LEU A 18 12.382 -11.369 -8.295 1.00 63.21 C ATOM 300 O LEU A 18 12.138 -12.483 -7.831 1.00 44.54 O ATOM 301 CB LEU A 18 12.522 -9.479 -6.663 1.00 41.31 C ATOM 302 CG LEU A 18 13.173 -9.120 -5.327 1.00 23.42 C ATOM 303 CD1 LEU A 18 14.487 -8.389 -5.552 1.00 44.15 C ATOM 304 CD2 LEU A 18 12.229 -8.277 -4.483 1.00 2.34 C ATOM 0 H LEU A 18 14.086 -8.628 -8.370 1.00 42.40 H new ATOM 0 HA LEU A 18 14.012 -10.999 -6.964 1.00 41.31 H new ATOM 0 HB2 LEU A 18 12.324 -8.556 -7.208 1.00 41.31 H new ATOM 0 HB3 LEU A 18 11.557 -9.943 -6.461 1.00 41.31 H new ATOM 0 HG LEU A 18 13.383 -10.044 -4.788 1.00 23.42 H new ATOM 0 HD11 LEU A 18 14.935 -8.142 -4.590 1.00 44.15 H new ATOM 0 HD12 LEU A 18 15.167 -9.028 -6.116 1.00 44.15 H new ATOM 0 HD13 LEU A 18 14.302 -7.472 -6.112 1.00 44.15 H new ATOM 0 HD21 LEU A 18 12.709 -8.031 -3.536 1.00 2.34 H new ATOM 0 HD22 LEU A 18 11.987 -7.358 -5.016 1.00 2.34 H new ATOM 0 HD23 LEU A 18 11.314 -8.837 -4.291 1.00 2.34 H new ATOM 316 N GLU A 19 11.858 -10.928 -9.434 1.00 61.04 N ATOM 317 CA GLU A 19 10.944 -11.747 -10.222 1.00 23.33 C ATOM 318 C GLU A 19 11.536 -13.131 -10.477 1.00 1.41 C ATOM 319 O GLU A 19 10.807 -14.114 -10.604 1.00 24.12 O ATOM 320 CB GLU A 19 10.628 -11.062 -11.553 1.00 21.40 C ATOM 321 CG GLU A 19 9.153 -11.093 -11.918 1.00 4.31 C ATOM 322 CD GLU A 19 8.770 -9.992 -12.887 1.00 54.42 C ATOM 323 OE1 GLU A 19 9.674 -9.438 -13.546 1.00 25.02 O ATOM 324 OE2 GLU A 19 7.563 -9.684 -12.987 1.00 42.00 O ATOM 0 H GLU A 19 12.050 -10.009 -9.832 1.00 61.04 H new ATOM 0 HA GLU A 19 10.021 -11.864 -9.654 1.00 23.33 H new ATOM 0 HB2 GLU A 19 10.960 -10.025 -11.506 1.00 21.40 H new ATOM 0 HB3 GLU A 19 11.200 -11.545 -12.345 1.00 21.40 H new ATOM 0 HG2 GLU A 19 8.912 -12.060 -12.359 1.00 4.31 H new ATOM 0 HG3 GLU A 19 8.556 -10.998 -11.011 1.00 4.31 H new ATOM 331 N GLN A 20 12.861 -13.196 -10.551 1.00 65.11 N ATOM 332 CA GLN A 20 13.551 -14.458 -10.792 1.00 61.04 C ATOM 333 C GLN A 20 13.104 -15.522 -9.795 1.00 71.04 C ATOM 334 O GLN A 20 13.121 -16.715 -10.097 1.00 71.34 O ATOM 335 CB GLN A 20 15.065 -14.261 -10.702 1.00 23.43 C ATOM 336 CG GLN A 20 15.862 -15.331 -11.431 1.00 4.02 C ATOM 337 CD GLN A 20 16.466 -16.353 -10.488 1.00 45.01 C ATOM 338 OE1 GLN A 20 15.999 -16.529 -9.363 1.00 1.04 O ATOM 339 NE2 GLN A 20 17.512 -17.034 -10.944 1.00 15.14 N ATOM 0 H GLN A 20 13.478 -12.390 -10.448 1.00 65.11 H new ATOM 0 HA GLN A 20 13.295 -14.797 -11.796 1.00 61.04 H new ATOM 0 HB2 GLN A 20 15.321 -13.285 -11.114 1.00 23.43 H new ATOM 0 HB3 GLN A 20 15.360 -14.251 -9.653 1.00 23.43 H new ATOM 0 HG2 GLN A 20 15.213 -15.839 -12.144 1.00 4.02 H new ATOM 0 HG3 GLN A 20 16.658 -14.857 -12.006 1.00 4.02 H new ATOM 0 HE21 GLN A 20 17.866 -16.856 -11.884 1.00 15.14 H new ATOM 0 HE22 GLN A 20 17.961 -17.735 -10.354 1.00 15.14 H new ATOM 348 N TRP A 21 12.705 -15.082 -8.608 1.00 0.13 N ATOM 349 CA TRP A 21 12.254 -15.997 -7.566 1.00 34.42 C ATOM 350 C TRP A 21 10.956 -16.687 -7.972 1.00 31.00 C ATOM 351 O TRP A 21 10.773 -17.879 -7.725 1.00 41.43 O ATOM 352 CB TRP A 21 12.055 -15.246 -6.249 1.00 4.45 C ATOM 353 CG TRP A 21 12.654 -15.949 -5.068 1.00 14.43 C ATOM 354 CD1 TRP A 21 12.278 -17.159 -4.558 1.00 4.44 C ATOM 355 CD2 TRP A 21 13.732 -15.483 -4.249 1.00 13.32 C ATOM 356 NE1 TRP A 21 13.058 -17.473 -3.471 1.00 3.01 N ATOM 357 CE2 TRP A 21 13.958 -16.462 -3.261 1.00 41.45 C ATOM 358 CE3 TRP A 21 14.529 -14.335 -4.255 1.00 23.22 C ATOM 359 CZ2 TRP A 21 14.947 -16.325 -2.291 1.00 42.02 C ATOM 360 CZ3 TRP A 21 15.510 -14.201 -3.291 1.00 4.01 C ATOM 361 CH2 TRP A 21 15.713 -15.191 -2.321 1.00 22.44 C ATOM 0 H TRP A 21 12.684 -14.097 -8.343 1.00 0.13 H new ATOM 0 HA TRP A 21 13.022 -16.758 -7.429 1.00 34.42 H new ATOM 0 HB2 TRP A 21 12.497 -14.253 -6.335 1.00 4.45 H new ATOM 0 HB3 TRP A 21 10.988 -15.106 -6.077 1.00 4.45 H new ATOM 0 HD1 TRP A 21 11.485 -17.778 -4.951 1.00 4.44 H new ATOM 0 HE1 TRP A 21 12.979 -18.322 -2.911 1.00 3.01 H new ATOM 0 HE3 TRP A 21 14.381 -13.567 -4.999 1.00 23.22 H new ATOM 0 HZ2 TRP A 21 15.104 -17.086 -1.541 1.00 42.02 H new ATOM 0 HZ3 TRP A 21 16.131 -13.317 -3.285 1.00 4.01 H new ATOM 0 HH2 TRP A 21 16.489 -15.057 -1.582 1.00 22.44 H new ATOM 372 N GLU A 22 10.058 -15.930 -8.596 1.00 24.23 N ATOM 373 CA GLU A 22 8.777 -16.471 -9.035 1.00 44.20 C ATOM 374 C GLU A 22 8.980 -17.682 -9.941 1.00 52.45 C ATOM 375 O GLU A 22 8.549 -18.790 -9.622 1.00 5.01 O ATOM 376 CB GLU A 22 7.971 -15.398 -9.771 1.00 24.23 C ATOM 377 CG GLU A 22 7.860 -14.089 -9.007 1.00 24.40 C ATOM 378 CD GLU A 22 7.428 -14.289 -7.567 1.00 43.12 C ATOM 379 OE1 GLU A 22 6.608 -15.197 -7.315 1.00 4.31 O ATOM 380 OE2 GLU A 22 7.909 -13.538 -6.693 1.00 43.13 O ATOM 0 H GLU A 22 10.194 -14.942 -8.808 1.00 24.23 H new ATOM 0 HA GLU A 22 8.223 -16.789 -8.152 1.00 44.20 H new ATOM 0 HB2 GLU A 22 8.436 -15.206 -10.738 1.00 24.23 H new ATOM 0 HB3 GLU A 22 6.969 -15.780 -9.969 1.00 24.23 H new ATOM 0 HG2 GLU A 22 8.823 -13.579 -9.026 1.00 24.40 H new ATOM 0 HG3 GLU A 22 7.145 -13.438 -9.510 1.00 24.40 H new ATOM 387 N LYS A 23 9.638 -17.461 -11.075 1.00 34.33 N ATOM 388 CA LYS A 23 9.899 -18.532 -12.029 1.00 30.52 C ATOM 389 C LYS A 23 8.598 -19.186 -12.483 1.00 53.23 C ATOM 390 O LYS A 23 8.591 -20.333 -12.931 1.00 42.41 O ATOM 391 CB LYS A 23 10.820 -19.584 -11.406 1.00 71.34 C ATOM 392 CG LYS A 23 11.841 -20.151 -12.378 1.00 54.32 C ATOM 393 CD LYS A 23 11.997 -21.653 -12.210 1.00 4.33 C ATOM 394 CE LYS A 23 11.387 -22.411 -13.378 1.00 61.33 C ATOM 395 NZ LYS A 23 12.411 -22.784 -14.393 1.00 62.11 N ATOM 0 H LYS A 23 10.000 -16.549 -11.355 1.00 34.33 H new ATOM 0 HA LYS A 23 10.390 -18.097 -12.900 1.00 30.52 H new ATOM 0 HB2 LYS A 23 11.344 -19.140 -10.559 1.00 71.34 H new ATOM 0 HB3 LYS A 23 10.213 -20.400 -11.013 1.00 71.34 H new ATOM 0 HG2 LYS A 23 11.534 -19.928 -13.400 1.00 54.32 H new ATOM 0 HG3 LYS A 23 12.804 -19.664 -12.221 1.00 54.32 H new ATOM 0 HD2 LYS A 23 13.055 -21.903 -12.126 1.00 4.33 H new ATOM 0 HD3 LYS A 23 11.520 -21.968 -11.282 1.00 4.33 H new ATOM 0 HE2 LYS A 23 10.896 -23.312 -13.010 1.00 61.33 H new ATOM 0 HE3 LYS A 23 10.618 -21.798 -13.847 1.00 61.33 H new ATOM 0 HZ1 LYS A 23 11.955 -23.299 -15.173 1.00 62.11 H new ATOM 0 HZ2 LYS A 23 12.862 -21.923 -14.763 1.00 62.11 H new ATOM 0 HZ3 LYS A 23 13.132 -23.390 -13.952 1.00 62.11 H new ATOM 409 N ASP A 24 7.499 -18.449 -12.366 1.00 52.33 N ATOM 410 CA ASP A 24 6.192 -18.956 -12.768 1.00 13.23 C ATOM 411 C ASP A 24 6.135 -19.180 -14.276 1.00 3.33 C ATOM 412 O ASP A 24 5.331 -19.973 -14.766 1.00 2.41 O ATOM 413 CB ASP A 24 5.091 -17.983 -12.343 1.00 11.34 C ATOM 414 CG ASP A 24 4.888 -17.959 -10.840 1.00 53.14 C ATOM 415 OD1 ASP A 24 5.762 -18.478 -10.116 1.00 12.04 O ATOM 416 OD2 ASP A 24 3.854 -17.422 -10.390 1.00 11.04 O ATOM 0 H ASP A 24 7.487 -17.499 -11.996 1.00 52.33 H new ATOM 0 HA ASP A 24 6.033 -19.913 -12.271 1.00 13.23 H new ATOM 0 HB2 ASP A 24 5.343 -16.980 -12.689 1.00 11.34 H new ATOM 0 HB3 ASP A 24 4.156 -18.262 -12.829 1.00 11.34 H new ATOM 421 N ASP A 25 6.993 -18.475 -15.006 1.00 22.45 N ATOM 422 CA ASP A 25 7.041 -18.597 -16.458 1.00 4.01 C ATOM 423 C ASP A 25 5.656 -18.400 -17.066 1.00 22.21 C ATOM 424 O ASP A 25 5.261 -19.122 -17.982 1.00 1.03 O ATOM 425 CB ASP A 25 7.598 -19.964 -16.858 1.00 62.04 C ATOM 426 CG ASP A 25 8.390 -19.911 -18.150 1.00 42.21 C ATOM 427 OD1 ASP A 25 9.228 -18.996 -18.295 1.00 41.14 O ATOM 428 OD2 ASP A 25 8.173 -20.784 -19.015 1.00 72.42 O ATOM 0 H ASP A 25 7.664 -17.813 -14.616 1.00 22.45 H new ATOM 0 HA ASP A 25 7.700 -17.818 -16.842 1.00 4.01 H new ATOM 0 HB2 ASP A 25 8.237 -20.341 -16.059 1.00 62.04 H new ATOM 0 HB3 ASP A 25 6.775 -20.670 -16.968 1.00 62.04 H new ATOM 433 N ASP A 26 4.923 -17.420 -16.550 1.00 2.11 N ATOM 434 CA ASP A 26 3.582 -17.128 -17.042 1.00 13.13 C ATOM 435 C ASP A 26 3.625 -16.658 -18.492 1.00 41.14 C ATOM 436 O ASP A 26 2.851 -17.124 -19.329 1.00 41.42 O ATOM 437 CB ASP A 26 2.915 -16.064 -16.168 1.00 22.33 C ATOM 438 CG ASP A 26 2.048 -16.668 -15.081 1.00 74.40 C ATOM 439 OD1 ASP A 26 1.311 -17.632 -15.378 1.00 11.23 O ATOM 440 OD2 ASP A 26 2.105 -16.177 -13.934 1.00 72.11 O ATOM 0 H ASP A 26 5.235 -16.814 -15.791 1.00 2.11 H new ATOM 0 HA ASP A 26 2.997 -18.046 -16.994 1.00 13.13 H new ATOM 0 HB2 ASP A 26 3.683 -15.440 -15.711 1.00 22.33 H new ATOM 0 HB3 ASP A 26 2.306 -15.413 -16.795 1.00 22.33 H new ATOM 445 N ILE A 27 4.534 -15.733 -18.782 1.00 53.32 N ATOM 446 CA ILE A 27 4.677 -15.200 -20.131 1.00 64.24 C ATOM 447 C ILE A 27 6.101 -14.713 -20.381 1.00 74.14 C ATOM 448 O ILE A 27 6.374 -13.514 -20.333 1.00 73.24 O ATOM 449 CB ILE A 27 3.697 -14.040 -20.386 1.00 4.42 C ATOM 450 CG1 ILE A 27 3.739 -13.044 -19.225 1.00 4.12 C ATOM 451 CG2 ILE A 27 2.286 -14.572 -20.583 1.00 50.15 C ATOM 452 CD1 ILE A 27 3.410 -11.625 -19.633 1.00 71.22 C ATOM 0 H ILE A 27 5.182 -15.337 -18.101 1.00 53.32 H new ATOM 0 HA ILE A 27 4.448 -16.015 -20.818 1.00 64.24 H new ATOM 0 HB ILE A 27 3.999 -13.522 -21.296 1.00 4.42 H new ATOM 0 HG12 ILE A 27 3.036 -13.365 -18.456 1.00 4.12 H new ATOM 0 HG13 ILE A 27 4.732 -13.063 -18.776 1.00 4.12 H new ATOM 0 HG21 ILE A 27 1.605 -13.740 -20.762 1.00 50.15 H new ATOM 0 HG22 ILE A 27 2.268 -15.247 -21.439 1.00 50.15 H new ATOM 0 HG23 ILE A 27 1.972 -15.111 -19.689 1.00 50.15 H new ATOM 0 HD11 ILE A 27 3.459 -10.975 -18.760 1.00 71.22 H new ATOM 0 HD12 ILE A 27 4.128 -11.285 -20.379 1.00 71.22 H new ATOM 0 HD13 ILE A 27 2.405 -11.591 -20.054 1.00 71.22 H new ATOM 1035 N THR A 64 18.407 4.007 -25.145 1.00 51.31 N ATOM 1036 CA THR A 64 17.001 4.295 -24.892 1.00 33.30 C ATOM 1037 C THR A 64 16.450 3.410 -23.779 1.00 45.30 C ATOM 1038 O THR A 64 16.822 2.242 -23.659 1.00 4.10 O ATOM 1039 CB THR A 64 16.149 4.094 -26.160 1.00 3.21 C ATOM 1040 OG1 THR A 64 14.814 4.559 -25.932 1.00 43.31 O ATOM 1041 CG2 THR A 64 16.119 2.628 -26.565 1.00 51.21 C ATOM 0 HA THR A 64 16.943 5.339 -24.585 1.00 33.30 H new ATOM 0 HB THR A 64 16.600 4.669 -26.969 1.00 3.21 H new ATOM 0 HG1 THR A 64 14.279 4.429 -26.743 1.00 43.31 H new ATOM 0 HG21 THR A 64 15.512 2.511 -27.462 1.00 51.21 H new ATOM 0 HG22 THR A 64 17.134 2.285 -26.766 1.00 51.21 H new ATOM 0 HG23 THR A 64 15.690 2.036 -25.757 1.00 51.21 H new ATOM 1049 N LEU A 65 15.562 3.973 -22.967 1.00 44.11 N ATOM 1050 CA LEU A 65 14.959 3.235 -21.863 1.00 23.50 C ATOM 1051 C LEU A 65 13.459 3.064 -22.077 1.00 13.41 C ATOM 1052 O LEU A 65 12.720 4.044 -22.166 1.00 54.22 O ATOM 1053 CB LEU A 65 15.219 3.956 -20.539 1.00 73.32 C ATOM 1054 CG LEU A 65 14.356 3.517 -19.355 1.00 70.15 C ATOM 1055 CD1 LEU A 65 15.230 3.129 -18.173 1.00 32.41 C ATOM 1056 CD2 LEU A 65 13.386 4.622 -18.964 1.00 12.01 C ATOM 0 H LEU A 65 15.244 4.938 -23.052 1.00 44.11 H new ATOM 0 HA LEU A 65 15.416 2.246 -21.827 1.00 23.50 H new ATOM 0 HB2 LEU A 65 16.266 3.816 -20.271 1.00 73.32 H new ATOM 0 HB3 LEU A 65 15.070 5.025 -20.695 1.00 73.32 H new ATOM 0 HG LEU A 65 13.778 2.643 -19.655 1.00 70.15 H new ATOM 0 HD11 LEU A 65 14.599 2.819 -17.340 1.00 32.41 H new ATOM 0 HD12 LEU A 65 15.884 2.305 -18.459 1.00 32.41 H new ATOM 0 HD13 LEU A 65 15.835 3.984 -17.872 1.00 32.41 H new ATOM 0 HD21 LEU A 65 12.780 4.292 -18.120 1.00 12.01 H new ATOM 0 HD22 LEU A 65 13.945 5.514 -18.683 1.00 12.01 H new ATOM 0 HD23 LEU A 65 12.737 4.852 -19.809 1.00 12.01 H new ATOM 1068 N MET A 66 13.016 1.814 -22.156 1.00 74.12 N ATOM 1069 CA MET A 66 11.602 1.516 -22.356 1.00 62.31 C ATOM 1070 C MET A 66 11.310 0.047 -22.065 1.00 40.03 C ATOM 1071 O MET A 66 11.793 -0.842 -22.766 1.00 3.21 O ATOM 1072 CB MET A 66 11.184 1.857 -23.788 1.00 4.14 C ATOM 1073 CG MET A 66 9.787 1.376 -24.144 1.00 41.10 C ATOM 1074 SD MET A 66 9.096 2.242 -25.567 1.00 23.03 S ATOM 1075 CE MET A 66 8.976 0.904 -26.751 1.00 54.14 C ATOM 0 H MET A 66 13.615 0.991 -22.085 1.00 74.12 H new ATOM 0 HA MET A 66 11.026 2.128 -21.662 1.00 62.31 H new ATOM 0 HB2 MET A 66 11.233 2.937 -23.925 1.00 4.14 H new ATOM 0 HB3 MET A 66 11.899 1.415 -24.482 1.00 4.14 H new ATOM 0 HG2 MET A 66 9.818 0.307 -24.354 1.00 41.10 H new ATOM 0 HG3 MET A 66 9.130 1.514 -23.285 1.00 41.10 H new ATOM 0 HE1 MET A 66 9.746 1.023 -27.513 1.00 54.14 H new ATOM 0 HE2 MET A 66 9.116 -0.048 -26.239 1.00 54.14 H new ATOM 0 HE3 MET A 66 7.993 0.922 -27.222 1.00 54.14 H new ATOM 1085 N MET A 67 10.517 -0.200 -21.028 1.00 11.22 N ATOM 1086 CA MET A 67 10.160 -1.561 -20.646 1.00 24.31 C ATOM 1087 C MET A 67 8.826 -1.587 -19.907 1.00 2.00 C ATOM 1088 O MET A 67 8.502 -0.665 -19.158 1.00 42.12 O ATOM 1089 CB MET A 67 11.255 -2.171 -19.768 1.00 11.44 C ATOM 1090 CG MET A 67 11.091 -3.665 -19.542 1.00 44.00 C ATOM 1091 SD MET A 67 12.590 -4.439 -18.906 1.00 23.50 S ATOM 1092 CE MET A 67 13.736 -4.108 -20.242 1.00 40.32 C ATOM 0 H MET A 67 10.109 0.525 -20.437 1.00 11.22 H new ATOM 0 HA MET A 67 10.062 -2.153 -21.556 1.00 24.31 H new ATOM 0 HB2 MET A 67 12.225 -1.986 -20.230 1.00 11.44 H new ATOM 0 HB3 MET A 67 11.260 -1.664 -18.803 1.00 11.44 H new ATOM 0 HG2 MET A 67 10.273 -3.835 -18.841 1.00 44.00 H new ATOM 0 HG3 MET A 67 10.811 -4.142 -20.481 1.00 44.00 H new ATOM 0 HE1 MET A 67 14.479 -4.904 -20.290 1.00 40.32 H new ATOM 0 HE2 MET A 67 13.192 -4.062 -21.185 1.00 40.32 H new ATOM 0 HE3 MET A 67 14.236 -3.156 -20.065 1.00 40.32 H new ATOM 1102 N PHE A 68 8.056 -2.648 -20.122 1.00 72.14 N ATOM 1103 CA PHE A 68 6.756 -2.793 -19.478 1.00 11.34 C ATOM 1104 C PHE A 68 6.487 -4.251 -19.117 1.00 1.34 C ATOM 1105 O PHE A 68 6.451 -5.121 -19.987 1.00 20.15 O ATOM 1106 CB PHE A 68 5.648 -2.270 -20.394 1.00 15.33 C ATOM 1107 CG PHE A 68 5.989 -0.971 -21.066 1.00 13.40 C ATOM 1108 CD1 PHE A 68 6.003 0.214 -20.347 1.00 25.31 C ATOM 1109 CD2 PHE A 68 6.295 -0.934 -22.417 1.00 0.23 C ATOM 1110 CE1 PHE A 68 6.316 1.410 -20.963 1.00 43.54 C ATOM 1111 CE2 PHE A 68 6.609 0.260 -23.039 1.00 21.04 C ATOM 1112 CZ PHE A 68 6.621 1.434 -22.311 1.00 33.55 C ATOM 0 H PHE A 68 8.310 -3.421 -20.738 1.00 72.14 H new ATOM 0 HA PHE A 68 6.766 -2.206 -18.560 1.00 11.34 H new ATOM 0 HB2 PHE A 68 5.434 -3.019 -21.156 1.00 15.33 H new ATOM 0 HB3 PHE A 68 4.737 -2.140 -19.811 1.00 15.33 H new ATOM 0 HD1 PHE A 68 5.767 0.202 -19.293 1.00 25.31 H new ATOM 0 HD2 PHE A 68 6.288 -1.849 -22.991 1.00 0.23 H new ATOM 0 HE1 PHE A 68 6.322 2.326 -20.391 1.00 43.54 H new ATOM 0 HE2 PHE A 68 6.845 0.275 -24.093 1.00 21.04 H new ATOM 0 HZ PHE A 68 6.868 2.368 -22.794 1.00 33.55 H new ATOM 1122 N VAL A 69 6.299 -4.510 -17.826 1.00 43.33 N ATOM 1123 CA VAL A 69 6.033 -5.861 -17.349 1.00 23.43 C ATOM 1124 C VAL A 69 5.047 -5.849 -16.186 1.00 73.35 C ATOM 1125 O VAL A 69 4.980 -4.885 -15.423 1.00 63.11 O ATOM 1126 CB VAL A 69 7.329 -6.564 -16.901 1.00 11.52 C ATOM 1127 CG1 VAL A 69 7.066 -8.032 -16.606 1.00 32.33 C ATOM 1128 CG2 VAL A 69 8.411 -6.409 -17.959 1.00 21.24 C ATOM 0 H VAL A 69 6.326 -3.801 -17.093 1.00 43.33 H new ATOM 0 HA VAL A 69 5.600 -6.412 -18.184 1.00 23.43 H new ATOM 0 HB VAL A 69 7.680 -6.092 -15.983 1.00 11.52 H new ATOM 0 HG11 VAL A 69 7.993 -8.512 -16.291 1.00 32.33 H new ATOM 0 HG12 VAL A 69 6.325 -8.116 -15.811 1.00 32.33 H new ATOM 0 HG13 VAL A 69 6.691 -8.522 -17.504 1.00 32.33 H new ATOM 0 HG21 VAL A 69 9.319 -6.911 -17.627 1.00 21.24 H new ATOM 0 HG22 VAL A 69 8.072 -6.854 -18.894 1.00 21.24 H new ATOM 0 HG23 VAL A 69 8.618 -5.350 -18.115 1.00 21.24 H new ATOM 1138 N THR A 70 4.280 -6.928 -16.057 1.00 4.15 N ATOM 1139 CA THR A 70 3.296 -7.042 -14.988 1.00 2.13 C ATOM 1140 C THR A 70 2.759 -8.465 -14.884 1.00 42.23 C ATOM 1141 O THR A 70 1.658 -8.759 -15.350 1.00 1.02 O ATOM 1142 CB THR A 70 2.117 -6.075 -15.204 1.00 40.23 C ATOM 1143 OG1 THR A 70 1.058 -6.381 -14.290 1.00 41.13 O ATOM 1144 CG2 THR A 70 1.602 -6.161 -16.633 1.00 34.31 C ATOM 0 H THR A 70 4.322 -7.735 -16.680 1.00 4.15 H new ATOM 0 HA THR A 70 3.806 -6.780 -14.061 1.00 2.13 H new ATOM 0 HB THR A 70 2.470 -5.060 -15.022 1.00 40.23 H new ATOM 0 HG1 THR A 70 0.563 -5.562 -14.077 1.00 41.13 H new ATOM 0 HG21 THR A 70 0.770 -5.469 -16.762 1.00 34.31 H new ATOM 0 HG22 THR A 70 2.402 -5.898 -17.325 1.00 34.31 H new ATOM 0 HG23 THR A 70 1.264 -7.177 -16.838 1.00 34.31 H new ATOM 1152 N VAL A 71 3.543 -9.345 -14.270 1.00 64.34 N ATOM 1153 CA VAL A 71 3.145 -10.738 -14.104 1.00 64.01 C ATOM 1154 C VAL A 71 4.169 -11.507 -13.276 1.00 40.13 C ATOM 1155 O VAL A 71 5.291 -11.044 -13.071 1.00 12.41 O ATOM 1156 CB VAL A 71 2.971 -11.438 -15.465 1.00 25.31 C ATOM 1157 CG1 VAL A 71 4.324 -11.827 -16.042 1.00 50.35 C ATOM 1158 CG2 VAL A 71 2.072 -12.657 -15.325 1.00 63.31 C ATOM 0 H VAL A 71 4.457 -9.118 -13.879 1.00 64.34 H new ATOM 0 HA VAL A 71 2.189 -10.734 -13.581 1.00 64.01 H new ATOM 0 HB VAL A 71 2.495 -10.741 -16.155 1.00 25.31 H new ATOM 0 HG11 VAL A 71 4.181 -12.320 -17.003 1.00 50.35 H new ATOM 0 HG12 VAL A 71 4.932 -10.933 -16.180 1.00 50.35 H new ATOM 0 HG13 VAL A 71 4.830 -12.507 -15.357 1.00 50.35 H new ATOM 0 HG21 VAL A 71 1.960 -13.140 -16.296 1.00 63.31 H new ATOM 0 HG22 VAL A 71 2.518 -13.359 -14.620 1.00 63.31 H new ATOM 0 HG23 VAL A 71 1.093 -12.347 -14.958 1.00 63.31 H new ATOM 1168 N SER A 72 3.775 -12.685 -12.804 1.00 31.14 N ATOM 1169 CA SER A 72 4.657 -13.518 -11.995 1.00 21.03 C ATOM 1170 C SER A 72 5.525 -14.408 -12.879 1.00 23.11 C ATOM 1171 O SER A 72 5.048 -14.990 -13.852 1.00 21.20 O ATOM 1172 CB SER A 72 3.838 -14.380 -11.032 1.00 3.23 C ATOM 1173 OG SER A 72 2.745 -14.989 -11.696 1.00 54.51 O ATOM 0 H SER A 72 2.851 -13.084 -12.968 1.00 31.14 H new ATOM 0 HA SER A 72 5.309 -12.861 -11.419 1.00 21.03 H new ATOM 0 HB2 SER A 72 4.476 -15.148 -10.595 1.00 3.23 H new ATOM 0 HB3 SER A 72 3.471 -13.765 -10.210 1.00 3.23 H new ATOM 0 HG SER A 72 3.040 -15.331 -12.566 1.00 54.51 H new ATOM 1179 N GLY A 73 6.805 -14.508 -12.532 1.00 60.31 N ATOM 1180 CA GLY A 73 7.721 -15.328 -13.303 1.00 74.55 C ATOM 1181 C GLY A 73 8.425 -14.544 -14.392 1.00 45.40 C ATOM 1182 O GLY A 73 7.810 -14.156 -15.384 1.00 42.02 O ATOM 0 H GLY A 73 7.224 -14.036 -11.731 1.00 60.31 H new ATOM 0 HA2 GLY A 73 8.464 -15.763 -12.635 1.00 74.55 H new ATOM 0 HA3 GLY A 73 7.172 -16.156 -13.752 1.00 74.55 H new ATOM 1186 N ASN A 74 9.720 -14.307 -14.205 1.00 60.44 N ATOM 1187 CA ASN A 74 10.509 -13.561 -15.179 1.00 31.21 C ATOM 1188 C ASN A 74 11.987 -13.569 -14.802 1.00 63.41 C ATOM 1189 O ASN A 74 12.542 -12.571 -14.342 1.00 72.12 O ATOM 1190 CB ASN A 74 10.004 -12.120 -15.278 1.00 64.23 C ATOM 1191 CG ASN A 74 9.078 -11.912 -16.460 1.00 75.45 C ATOM 1192 OD1 ASN A 74 7.940 -11.469 -16.301 1.00 43.33 O ATOM 1193 ND2 ASN A 74 9.561 -12.233 -17.655 1.00 22.42 N ATOM 0 H ASN A 74 10.245 -14.621 -13.388 1.00 60.44 H new ATOM 0 HA ASN A 74 10.397 -14.046 -16.149 1.00 31.21 H new ATOM 0 HB2 ASN A 74 9.480 -11.858 -14.359 1.00 64.23 H new ATOM 0 HB3 ASN A 74 10.855 -11.445 -15.364 1.00 64.23 H new ATOM 0 HD21 ASN A 74 8.983 -12.116 -18.487 1.00 22.42 H new ATOM 0 HD22 ASN A 74 10.510 -12.597 -17.741 1.00 22.42 H new ATOM 1200 N PRO A 75 12.642 -14.723 -15.002 1.00 4.24 N ATOM 1201 CA PRO A 75 14.065 -14.889 -14.691 1.00 22.03 C ATOM 1202 C PRO A 75 14.962 -14.102 -15.640 1.00 71.04 C ATOM 1203 O PRO A 75 15.285 -14.566 -16.735 1.00 33.05 O ATOM 1204 CB PRO A 75 14.293 -16.393 -14.864 1.00 13.14 C ATOM 1205 CG PRO A 75 13.236 -16.828 -15.820 1.00 25.34 C ATOM 1206 CD PRO A 75 12.044 -15.953 -15.547 1.00 25.24 C ATOM 0 HA PRO A 75 14.310 -14.518 -13.696 1.00 22.03 H new ATOM 0 HB2 PRO A 75 15.289 -16.600 -15.254 1.00 13.14 H new ATOM 0 HB3 PRO A 75 14.207 -16.919 -13.913 1.00 13.14 H new ATOM 0 HG2 PRO A 75 13.573 -16.718 -16.851 1.00 25.34 H new ATOM 0 HG3 PRO A 75 12.989 -17.880 -15.676 1.00 25.34 H new ATOM 0 HD2 PRO A 75 11.475 -15.755 -16.455 1.00 25.24 H new ATOM 0 HD3 PRO A 75 11.360 -16.416 -14.836 1.00 25.24 H new ATOM 1214 N THR A 76 15.363 -12.908 -15.215 1.00 55.34 N ATOM 1215 CA THR A 76 16.221 -12.056 -16.028 1.00 45.21 C ATOM 1216 C THR A 76 17.014 -11.086 -15.160 1.00 2.24 C ATOM 1217 O THR A 76 17.010 -9.879 -15.399 1.00 52.11 O ATOM 1218 CB THR A 76 15.404 -11.254 -17.059 1.00 24.12 C ATOM 1219 OG1 THR A 76 14.201 -10.766 -16.457 1.00 14.43 O ATOM 1220 CG2 THR A 76 15.061 -12.115 -18.265 1.00 31.20 C ATOM 0 H THR A 76 15.107 -12.509 -14.312 1.00 55.34 H new ATOM 0 HA THR A 76 16.911 -12.715 -16.556 1.00 45.21 H new ATOM 0 HB THR A 76 16.009 -10.412 -17.394 1.00 24.12 H new ATOM 0 HG1 THR A 76 13.688 -10.256 -17.118 1.00 14.43 H new ATOM 0 HG21 THR A 76 14.484 -11.527 -18.979 1.00 31.20 H new ATOM 0 HG22 THR A 76 15.980 -12.461 -18.738 1.00 31.20 H new ATOM 0 HG23 THR A 76 14.473 -12.974 -17.943 1.00 31.20 H new ATOM 1228 N GLU A 77 17.694 -11.622 -14.151 1.00 2.12 N ATOM 1229 CA GLU A 77 18.492 -10.802 -13.247 1.00 12.42 C ATOM 1230 C GLU A 77 19.555 -10.022 -14.015 1.00 25.33 C ATOM 1231 O GLU A 77 19.916 -8.906 -13.640 1.00 21.42 O ATOM 1232 CB GLU A 77 19.155 -11.676 -12.180 1.00 51.13 C ATOM 1233 CG GLU A 77 20.328 -12.488 -12.702 1.00 45.33 C ATOM 1234 CD GLU A 77 19.915 -13.506 -13.746 1.00 73.45 C ATOM 1235 OE1 GLU A 77 19.098 -14.393 -13.418 1.00 64.05 O ATOM 1236 OE2 GLU A 77 20.407 -13.418 -14.891 1.00 13.44 O ATOM 0 H GLU A 77 17.708 -12.620 -13.939 1.00 2.12 H new ATOM 0 HA GLU A 77 17.826 -10.090 -12.760 1.00 12.42 H new ATOM 0 HB2 GLU A 77 19.498 -11.041 -11.364 1.00 51.13 H new ATOM 0 HB3 GLU A 77 18.410 -12.355 -11.764 1.00 51.13 H new ATOM 0 HG2 GLU A 77 21.069 -11.814 -13.131 1.00 45.33 H new ATOM 0 HG3 GLU A 77 20.808 -13.002 -11.869 1.00 45.33 H new ATOM 1243 N LYS A 78 20.055 -10.619 -15.092 1.00 12.40 N ATOM 1244 CA LYS A 78 21.077 -9.982 -15.915 1.00 33.42 C ATOM 1245 C LYS A 78 20.497 -8.799 -16.684 1.00 22.41 C ATOM 1246 O LYS A 78 21.157 -7.775 -16.853 1.00 1.34 O ATOM 1247 CB LYS A 78 21.677 -10.995 -16.892 1.00 61.24 C ATOM 1248 CG LYS A 78 23.194 -10.951 -16.959 1.00 52.20 C ATOM 1249 CD LYS A 78 23.825 -11.653 -15.768 1.00 41.24 C ATOM 1250 CE LYS A 78 23.825 -13.163 -15.948 1.00 20.24 C ATOM 1251 NZ LYS A 78 24.733 -13.591 -17.047 1.00 64.33 N ATOM 0 H LYS A 78 19.769 -11.543 -15.415 1.00 12.40 H new ATOM 0 HA LYS A 78 21.862 -9.613 -15.255 1.00 33.42 H new ATOM 0 HB2 LYS A 78 21.364 -11.998 -16.601 1.00 61.24 H new ATOM 0 HB3 LYS A 78 21.272 -10.811 -17.887 1.00 61.24 H new ATOM 0 HG2 LYS A 78 23.532 -11.423 -17.882 1.00 52.20 H new ATOM 0 HG3 LYS A 78 23.528 -9.914 -16.990 1.00 52.20 H new ATOM 0 HD2 LYS A 78 24.848 -11.301 -15.637 1.00 41.24 H new ATOM 0 HD3 LYS A 78 23.280 -11.394 -14.860 1.00 41.24 H new ATOM 0 HE2 LYS A 78 24.132 -13.640 -15.017 1.00 20.24 H new ATOM 0 HE3 LYS A 78 22.812 -13.503 -16.161 1.00 20.24 H new ATOM 0 HZ1 LYS A 78 24.985 -14.592 -16.919 1.00 64.33 H new ATOM 0 HZ2 LYS A 78 24.253 -13.469 -17.961 1.00 64.33 H new ATOM 0 HZ3 LYS A 78 25.596 -13.012 -17.029 1.00 64.33 H new ATOM 1265 N GLU A 79 19.260 -8.949 -17.146 1.00 52.14 N ATOM 1266 CA GLU A 79 18.593 -7.892 -17.897 1.00 13.51 C ATOM 1267 C GLU A 79 18.282 -6.699 -16.997 1.00 51.22 C ATOM 1268 O GLU A 79 18.404 -5.545 -17.411 1.00 31.22 O ATOM 1269 CB GLU A 79 17.302 -8.419 -18.527 1.00 31.23 C ATOM 1270 CG GLU A 79 16.955 -7.757 -19.850 1.00 23.03 C ATOM 1271 CD GLU A 79 17.951 -8.085 -20.945 1.00 24.11 C ATOM 1272 OE1 GLU A 79 18.501 -9.206 -20.932 1.00 31.25 O ATOM 1273 OE2 GLU A 79 18.181 -7.220 -21.816 1.00 11.22 O ATOM 0 H GLU A 79 18.700 -9.791 -17.014 1.00 52.14 H new ATOM 0 HA GLU A 79 19.267 -7.563 -18.688 1.00 13.51 H new ATOM 0 HB2 GLU A 79 17.396 -9.494 -18.682 1.00 31.23 H new ATOM 0 HB3 GLU A 79 16.479 -8.268 -17.828 1.00 31.23 H new ATOM 0 HG2 GLU A 79 15.960 -8.076 -20.162 1.00 23.03 H new ATOM 0 HG3 GLU A 79 16.915 -6.677 -19.712 1.00 23.03 H new ATOM 1280 N THR A 80 17.879 -6.985 -15.763 1.00 54.11 N ATOM 1281 CA THR A 80 17.548 -5.938 -14.805 1.00 4.23 C ATOM 1282 C THR A 80 18.707 -4.962 -14.636 1.00 50.41 C ATOM 1283 O THR A 80 18.510 -3.747 -14.628 1.00 43.01 O ATOM 1284 CB THR A 80 17.186 -6.529 -13.429 1.00 53.14 C ATOM 1285 OG1 THR A 80 18.364 -7.023 -12.782 1.00 52.04 O ATOM 1286 CG2 THR A 80 16.171 -7.653 -13.574 1.00 62.11 C ATOM 0 H THR A 80 17.774 -7.934 -15.404 1.00 54.11 H new ATOM 0 HA THR A 80 16.683 -5.407 -15.203 1.00 4.23 H new ATOM 0 HB THR A 80 16.745 -5.738 -12.823 1.00 53.14 H new ATOM 0 HG1 THR A 80 18.660 -7.846 -13.225 1.00 52.04 H new ATOM 0 HG21 THR A 80 15.930 -8.055 -12.590 1.00 62.11 H new ATOM 0 HG22 THR A 80 15.264 -7.267 -14.040 1.00 62.11 H new ATOM 0 HG23 THR A 80 16.590 -8.444 -14.196 1.00 62.11 H new ATOM 1294 N GLU A 81 19.915 -5.501 -14.502 1.00 53.13 N ATOM 1295 CA GLU A 81 21.105 -4.675 -14.334 1.00 32.43 C ATOM 1296 C GLU A 81 21.276 -3.721 -15.512 1.00 64.10 C ATOM 1297 O GLU A 81 21.504 -2.526 -15.327 1.00 53.03 O ATOM 1298 CB GLU A 81 22.348 -5.556 -14.192 1.00 32.43 C ATOM 1299 CG GLU A 81 23.493 -4.879 -13.458 1.00 62.21 C ATOM 1300 CD GLU A 81 24.636 -4.503 -14.381 1.00 70.31 C ATOM 1301 OE1 GLU A 81 24.400 -3.727 -15.330 1.00 41.15 O ATOM 1302 OE2 GLU A 81 25.765 -4.985 -14.155 1.00 24.33 O ATOM 0 H GLU A 81 20.095 -6.505 -14.507 1.00 53.13 H new ATOM 0 HA GLU A 81 20.981 -4.085 -13.426 1.00 32.43 H new ATOM 0 HB2 GLU A 81 22.077 -6.469 -13.662 1.00 32.43 H new ATOM 0 HB3 GLU A 81 22.688 -5.852 -15.184 1.00 32.43 H new ATOM 0 HG2 GLU A 81 23.122 -3.982 -12.962 1.00 62.21 H new ATOM 0 HG3 GLU A 81 23.864 -5.545 -12.679 1.00 62.21 H new ATOM 1309 N GLU A 82 21.166 -4.259 -16.723 1.00 22.13 N ATOM 1310 CA GLU A 82 21.311 -3.456 -17.931 1.00 14.40 C ATOM 1311 C GLU A 82 20.397 -2.234 -17.884 1.00 61.15 C ATOM 1312 O GLU A 82 20.692 -1.203 -18.489 1.00 14.51 O ATOM 1313 CB GLU A 82 20.994 -4.296 -19.170 1.00 0.02 C ATOM 1314 CG GLU A 82 21.864 -3.963 -20.370 1.00 42.40 C ATOM 1315 CD GLU A 82 22.657 -5.157 -20.866 1.00 11.45 C ATOM 1316 OE1 GLU A 82 23.645 -5.531 -20.201 1.00 3.45 O ATOM 1317 OE2 GLU A 82 22.288 -5.717 -21.919 1.00 32.11 O ATOM 0 H GLU A 82 20.977 -5.247 -16.893 1.00 22.13 H new ATOM 0 HA GLU A 82 22.344 -3.114 -17.988 1.00 14.40 H new ATOM 0 HB2 GLU A 82 21.117 -5.351 -18.924 1.00 0.02 H new ATOM 0 HB3 GLU A 82 19.948 -4.151 -19.439 1.00 0.02 H new ATOM 0 HG2 GLU A 82 21.235 -3.589 -21.178 1.00 42.40 H new ATOM 0 HG3 GLU A 82 22.552 -3.160 -20.104 1.00 42.40 H new ATOM 1324 N ILE A 83 19.288 -2.359 -17.164 1.00 31.42 N ATOM 1325 CA ILE A 83 18.332 -1.266 -17.038 1.00 33.41 C ATOM 1326 C ILE A 83 18.995 -0.020 -16.462 1.00 53.45 C ATOM 1327 O ILE A 83 18.717 1.100 -16.893 1.00 10.41 O ATOM 1328 CB ILE A 83 17.141 -1.660 -16.144 1.00 22.13 C ATOM 1329 CG1 ILE A 83 16.522 -2.972 -16.630 1.00 22.33 C ATOM 1330 CG2 ILE A 83 16.100 -0.551 -16.129 1.00 3.31 C ATOM 1331 CD1 ILE A 83 16.057 -2.925 -18.068 1.00 51.42 C ATOM 0 H ILE A 83 19.029 -3.206 -16.659 1.00 31.42 H new ATOM 0 HA ILE A 83 17.966 -1.049 -18.042 1.00 33.41 H new ATOM 0 HB ILE A 83 17.503 -1.806 -15.126 1.00 22.13 H new ATOM 0 HG12 ILE A 83 17.254 -3.772 -16.519 1.00 22.33 H new ATOM 0 HG13 ILE A 83 15.675 -3.223 -15.991 1.00 22.33 H new ATOM 0 HG21 ILE A 83 15.265 -0.845 -15.493 1.00 3.31 H new ATOM 0 HG22 ILE A 83 16.548 0.363 -15.740 1.00 3.31 H new ATOM 0 HG23 ILE A 83 15.740 -0.376 -17.143 1.00 3.31 H new ATOM 0 HD11 ILE A 83 15.629 -3.889 -18.344 1.00 51.42 H new ATOM 0 HD12 ILE A 83 15.302 -2.147 -18.181 1.00 51.42 H new ATOM 0 HD13 ILE A 83 16.904 -2.705 -18.717 1.00 51.42 H new ATOM 1343 N THR A 84 19.875 -0.221 -15.487 1.00 2.22 N ATOM 1344 CA THR A 84 20.579 0.886 -14.852 1.00 41.43 C ATOM 1345 C THR A 84 21.200 1.812 -15.893 1.00 35.14 C ATOM 1346 O THR A 84 21.276 3.024 -15.692 1.00 22.00 O ATOM 1347 CB THR A 84 21.685 0.381 -13.907 1.00 21.22 C ATOM 1348 OG1 THR A 84 22.080 1.426 -13.011 1.00 52.24 O ATOM 1349 CG2 THR A 84 22.893 -0.101 -14.696 1.00 2.10 C ATOM 0 H THR A 84 20.118 -1.141 -15.119 1.00 2.22 H new ATOM 0 HA THR A 84 19.840 1.439 -14.272 1.00 41.43 H new ATOM 0 HB THR A 84 21.287 -0.457 -13.334 1.00 21.22 H new ATOM 0 HG1 THR A 84 21.789 1.205 -12.102 1.00 52.24 H new ATOM 0 HG21 THR A 84 23.661 -0.453 -14.007 1.00 2.10 H new ATOM 0 HG22 THR A 84 22.595 -0.917 -15.355 1.00 2.10 H new ATOM 0 HG23 THR A 84 23.290 0.721 -15.292 1.00 2.10 H new ATOM 1357 N SER A 85 21.641 1.233 -17.005 1.00 13.11 N ATOM 1358 CA SER A 85 22.258 2.007 -18.076 1.00 75.52 C ATOM 1359 C SER A 85 21.217 2.852 -18.804 1.00 41.13 C ATOM 1360 O SER A 85 21.337 4.076 -18.881 1.00 22.44 O ATOM 1361 CB SER A 85 22.959 1.076 -19.067 1.00 70.32 C ATOM 1362 OG SER A 85 23.789 0.146 -18.393 1.00 60.43 O ATOM 0 H SER A 85 21.583 0.231 -17.188 1.00 13.11 H new ATOM 0 HA SER A 85 22.996 2.674 -17.631 1.00 75.52 H new ATOM 0 HB2 SER A 85 22.215 0.542 -19.658 1.00 70.32 H new ATOM 0 HB3 SER A 85 23.557 1.664 -19.763 1.00 70.32 H new ATOM 0 HG SER A 85 24.224 -0.439 -19.048 1.00 60.43 H new ATOM 1368 N LEU A 86 20.196 2.191 -19.338 1.00 52.42 N ATOM 1369 CA LEU A 86 19.133 2.881 -20.061 1.00 35.20 C ATOM 1370 C LEU A 86 18.570 4.032 -19.234 1.00 14.11 C ATOM 1371 O LEU A 86 18.117 5.038 -19.780 1.00 44.40 O ATOM 1372 CB LEU A 86 18.014 1.901 -20.419 1.00 61.34 C ATOM 1373 CG LEU A 86 18.458 0.566 -21.020 1.00 12.31 C ATOM 1374 CD1 LEU A 86 17.250 -0.266 -21.422 1.00 22.13 C ATOM 1375 CD2 LEU A 86 19.371 0.797 -22.215 1.00 73.34 C ATOM 0 H LEU A 86 20.082 1.179 -19.284 1.00 52.42 H new ATOM 0 HA LEU A 86 19.557 3.290 -20.978 1.00 35.20 H new ATOM 0 HB2 LEU A 86 17.435 1.697 -19.518 1.00 61.34 H new ATOM 0 HB3 LEU A 86 17.343 2.389 -21.125 1.00 61.34 H new ATOM 0 HG LEU A 86 19.016 0.016 -20.263 1.00 12.31 H new ATOM 0 HD11 LEU A 86 17.585 -1.212 -21.848 1.00 22.13 H new ATOM 0 HD12 LEU A 86 16.634 -0.461 -20.544 1.00 22.13 H new ATOM 0 HD13 LEU A 86 16.664 0.278 -22.163 1.00 22.13 H new ATOM 0 HD21 LEU A 86 19.677 -0.163 -22.630 1.00 73.34 H new ATOM 0 HD22 LEU A 86 18.838 1.367 -22.975 1.00 73.34 H new ATOM 0 HD23 LEU A 86 20.253 1.353 -21.897 1.00 73.34 H new ATOM 1387 N TRP A 87 18.603 3.878 -17.915 1.00 73.43 N ATOM 1388 CA TRP A 87 18.098 4.906 -17.013 1.00 34.14 C ATOM 1389 C TRP A 87 18.755 6.252 -17.298 1.00 75.34 C ATOM 1390 O TRP A 87 18.111 7.297 -17.211 1.00 33.22 O ATOM 1391 CB TRP A 87 18.345 4.503 -15.558 1.00 34.50 C ATOM 1392 CG TRP A 87 17.378 5.125 -14.597 1.00 11.24 C ATOM 1393 CD1 TRP A 87 16.506 6.144 -14.855 1.00 70.05 C ATOM 1394 CD2 TRP A 87 17.187 4.771 -13.223 1.00 21.53 C ATOM 1395 NE1 TRP A 87 15.785 6.444 -13.725 1.00 74.01 N ATOM 1396 CE2 TRP A 87 16.183 5.615 -12.710 1.00 50.00 C ATOM 1397 CE3 TRP A 87 17.765 3.821 -12.376 1.00 61.43 C ATOM 1398 CZ2 TRP A 87 15.748 5.537 -11.390 1.00 34.02 C ATOM 1399 CZ3 TRP A 87 17.332 3.745 -11.066 1.00 61.32 C ATOM 1400 CH2 TRP A 87 16.331 4.598 -10.583 1.00 71.14 C ATOM 0 H TRP A 87 18.974 3.051 -17.447 1.00 73.43 H new ATOM 0 HA TRP A 87 17.025 5.004 -17.179 1.00 34.14 H new ATOM 0 HB2 TRP A 87 18.283 3.418 -15.474 1.00 34.50 H new ATOM 0 HB3 TRP A 87 19.359 4.787 -15.277 1.00 34.50 H new ATOM 0 HD1 TRP A 87 16.399 6.641 -15.808 1.00 70.05 H new ATOM 0 HE1 TRP A 87 15.069 7.167 -13.653 1.00 74.01 H new ATOM 0 HE3 TRP A 87 18.536 3.158 -12.739 1.00 61.43 H new ATOM 0 HZ2 TRP A 87 14.977 6.195 -11.016 1.00 34.02 H new ATOM 0 HZ3 TRP A 87 17.773 3.015 -10.403 1.00 61.32 H new ATOM 0 HH2 TRP A 87 16.013 4.513 -9.554 1.00 71.14 H new ATOM 1411 N GLN A 88 20.038 6.218 -17.640 1.00 65.04 N ATOM 1412 CA GLN A 88 20.781 7.437 -17.939 1.00 23.35 C ATOM 1413 C GLN A 88 20.047 8.282 -18.974 1.00 1.32 C ATOM 1414 O GLN A 88 19.952 9.502 -18.840 1.00 23.40 O ATOM 1415 CB GLN A 88 22.184 7.094 -18.445 1.00 35.45 C ATOM 1416 CG GLN A 88 23.105 8.298 -18.547 1.00 2.25 C ATOM 1417 CD GLN A 88 24.218 8.270 -17.518 1.00 3.13 C ATOM 1418 OE1 GLN A 88 25.388 8.467 -17.847 1.00 4.03 O ATOM 1419 NE2 GLN A 88 23.859 8.025 -16.263 1.00 61.41 N ATOM 0 H GLN A 88 20.585 5.361 -17.717 1.00 65.04 H new ATOM 0 HA GLN A 88 20.866 8.015 -17.019 1.00 23.35 H new ATOM 0 HB2 GLN A 88 22.633 6.359 -17.776 1.00 35.45 H new ATOM 0 HB3 GLN A 88 22.103 6.625 -19.426 1.00 35.45 H new ATOM 0 HG2 GLN A 88 23.540 8.335 -19.546 1.00 2.25 H new ATOM 0 HG3 GLN A 88 22.521 9.209 -18.420 1.00 2.25 H new ATOM 0 HE21 GLN A 88 22.877 7.867 -16.035 1.00 61.41 H new ATOM 0 HE22 GLN A 88 24.565 7.994 -15.527 1.00 61.41 H new ATOM 1428 N GLY A 89 19.529 7.626 -20.007 1.00 72.34 N ATOM 1429 CA GLY A 89 18.810 8.333 -21.051 1.00 1.31 C ATOM 1430 C GLY A 89 17.555 9.009 -20.535 1.00 21.32 C ATOM 1431 O GLY A 89 17.289 10.167 -20.855 1.00 3.35 O ATOM 0 H GLY A 89 19.594 6.617 -20.140 1.00 72.34 H new ATOM 0 HA2 GLY A 89 19.465 9.082 -21.496 1.00 1.31 H new ATOM 0 HA3 GLY A 89 18.543 7.632 -21.842 1.00 1.31 H new ATOM 1435 N SER A 90 16.780 8.283 -19.735 1.00 62.34 N ATOM 1436 CA SER A 90 15.543 8.817 -19.178 1.00 70.04 C ATOM 1437 C SER A 90 15.782 10.177 -18.529 1.00 62.23 C ATOM 1438 O SER A 90 15.015 11.119 -18.733 1.00 63.13 O ATOM 1439 CB SER A 90 14.959 7.845 -18.152 1.00 24.45 C ATOM 1440 OG SER A 90 15.151 8.322 -16.831 1.00 73.10 O ATOM 0 H SER A 90 16.987 7.323 -19.458 1.00 62.34 H new ATOM 0 HA SER A 90 14.831 8.943 -19.994 1.00 70.04 H new ATOM 0 HB2 SER A 90 13.894 7.708 -18.341 1.00 24.45 H new ATOM 0 HB3 SER A 90 15.431 6.869 -18.262 1.00 24.45 H new ATOM 0 HG SER A 90 14.768 7.684 -16.194 1.00 73.10 H new ATOM 1446 N LEU A 91 16.851 10.271 -17.746 1.00 41.53 N ATOM 1447 CA LEU A 91 17.193 11.516 -17.066 1.00 24.31 C ATOM 1448 C LEU A 91 17.189 12.689 -18.041 1.00 33.40 C ATOM 1449 O LEU A 91 16.695 13.771 -17.724 1.00 72.02 O ATOM 1450 CB LEU A 91 18.566 11.396 -16.401 1.00 71.32 C ATOM 1451 CG LEU A 91 18.935 12.507 -15.418 1.00 50.10 C ATOM 1452 CD1 LEU A 91 18.070 12.424 -14.170 1.00 3.33 C ATOM 1453 CD2 LEU A 91 20.410 12.428 -15.053 1.00 43.34 C ATOM 0 H LEU A 91 17.495 9.501 -17.566 1.00 41.53 H new ATOM 0 HA LEU A 91 16.439 11.702 -16.301 1.00 24.31 H new ATOM 0 HB2 LEU A 91 18.610 10.443 -15.874 1.00 71.32 H new ATOM 0 HB3 LEU A 91 19.325 11.363 -17.183 1.00 71.32 H new ATOM 0 HG LEU A 91 18.751 13.468 -15.899 1.00 50.10 H new ATOM 0 HD11 LEU A 91 18.347 13.223 -13.482 1.00 3.33 H new ATOM 0 HD12 LEU A 91 17.021 12.531 -14.447 1.00 3.33 H new ATOM 0 HD13 LEU A 91 18.221 11.459 -13.686 1.00 3.33 H new ATOM 0 HD21 LEU A 91 20.655 13.226 -14.353 1.00 43.34 H new ATOM 0 HD22 LEU A 91 20.619 11.463 -14.591 1.00 43.34 H new ATOM 0 HD23 LEU A 91 21.014 12.538 -15.954 1.00 43.34 H new ATOM 1465 N PHE A 92 17.740 12.466 -19.229 1.00 61.43 N ATOM 1466 CA PHE A 92 17.799 13.504 -20.252 1.00 34.41 C ATOM 1467 C PHE A 92 16.423 14.125 -20.475 1.00 41.31 C ATOM 1468 O PHE A 92 16.249 15.336 -20.345 1.00 41.11 O ATOM 1469 CB PHE A 92 18.329 12.926 -21.566 1.00 32.33 C ATOM 1470 CG PHE A 92 18.489 13.952 -22.651 1.00 21.14 C ATOM 1471 CD1 PHE A 92 19.133 15.152 -22.397 1.00 43.24 C ATOM 1472 CD2 PHE A 92 17.995 13.717 -23.924 1.00 22.54 C ATOM 1473 CE1 PHE A 92 19.283 16.099 -23.394 1.00 31.44 C ATOM 1474 CE2 PHE A 92 18.142 14.659 -24.924 1.00 22.12 C ATOM 1475 CZ PHE A 92 18.786 15.852 -24.658 1.00 73.12 C ATOM 0 H PHE A 92 18.152 11.576 -19.508 1.00 61.43 H new ATOM 0 HA PHE A 92 18.479 14.283 -19.906 1.00 34.41 H new ATOM 0 HB2 PHE A 92 19.292 12.450 -21.382 1.00 32.33 H new ATOM 0 HB3 PHE A 92 17.649 12.147 -21.911 1.00 32.33 H new ATOM 0 HD1 PHE A 92 19.522 15.350 -21.409 1.00 43.24 H new ATOM 0 HD2 PHE A 92 17.489 12.787 -24.137 1.00 22.54 H new ATOM 0 HE1 PHE A 92 19.788 17.030 -23.184 1.00 31.44 H new ATOM 0 HE2 PHE A 92 17.754 14.463 -25.913 1.00 22.12 H new ATOM 0 HZ PHE A 92 18.900 16.590 -25.438 1.00 73.12 H new ATOM 1485 N ASN A 93 15.449 13.286 -20.813 1.00 11.45 N ATOM 1486 CA ASN A 93 14.089 13.753 -21.055 1.00 74.23 C ATOM 1487 C ASN A 93 13.423 14.189 -19.754 1.00 13.22 C ATOM 1488 O ASN A 93 13.006 15.338 -19.613 1.00 53.40 O ATOM 1489 CB ASN A 93 13.261 12.651 -21.720 1.00 54.45 C ATOM 1490 CG ASN A 93 11.884 13.133 -22.134 1.00 54.43 C ATOM 1491 OD1 ASN A 93 11.166 13.748 -21.345 1.00 51.24 O ATOM 1492 ND2 ASN A 93 11.508 12.855 -23.377 1.00 45.14 N ATOM 0 H ASN A 93 15.576 12.280 -20.925 1.00 11.45 H new ATOM 0 HA ASN A 93 14.140 14.614 -21.722 1.00 74.23 H new ATOM 0 HB2 ASN A 93 13.792 12.280 -22.597 1.00 54.45 H new ATOM 0 HB3 ASN A 93 13.158 11.812 -21.032 1.00 54.45 H new ATOM 0 HD21 ASN A 93 10.592 13.154 -23.712 1.00 45.14 H new ATOM 0 HD22 ASN A 93 12.135 12.343 -23.997 1.00 45.14 H new ATOM 1499 N ALA A 94 13.327 13.264 -18.805 1.00 24.41 N ATOM 1500 CA ALA A 94 12.715 13.553 -17.514 1.00 61.12 C ATOM 1501 C ALA A 94 13.579 13.037 -16.369 1.00 4.14 C ATOM 1502 O ALA A 94 14.179 11.967 -16.464 1.00 74.01 O ATOM 1503 CB ALA A 94 11.322 12.945 -17.443 1.00 23.35 C ATOM 0 H ALA A 94 13.666 12.307 -18.906 1.00 24.41 H new ATOM 0 HA ALA A 94 12.633 14.635 -17.412 1.00 61.12 H new ATOM 0 HB1 ALA A 94 10.876 13.168 -16.474 1.00 23.35 H new ATOM 0 HB2 ALA A 94 10.701 13.366 -18.234 1.00 23.35 H new ATOM 0 HB3 ALA A 94 11.390 11.865 -17.571 1.00 23.35 H new ATOM 1509 N ASN A 95 13.639 13.806 -15.286 1.00 64.11 N ATOM 1510 CA ASN A 95 14.432 13.426 -14.122 1.00 40.52 C ATOM 1511 C ASN A 95 13.916 12.127 -13.513 1.00 34.33 C ATOM 1512 O ASN A 95 13.045 12.140 -12.642 1.00 60.11 O ATOM 1513 CB ASN A 95 14.403 14.541 -13.074 1.00 63.03 C ATOM 1514 CG ASN A 95 13.009 15.098 -12.860 1.00 60.34 C ATOM 1515 OD1 ASN A 95 12.245 14.589 -12.040 1.00 54.03 O ATOM 1516 ND2 ASN A 95 12.672 16.148 -13.600 1.00 34.13 N ATOM 0 H ASN A 95 13.148 14.695 -15.190 1.00 64.11 H new ATOM 0 HA ASN A 95 15.460 13.270 -14.449 1.00 40.52 H new ATOM 0 HB2 ASN A 95 14.787 14.157 -12.129 1.00 63.03 H new ATOM 0 HB3 ASN A 95 15.069 15.346 -13.385 1.00 63.03 H new ATOM 0 HD21 ASN A 95 11.747 16.566 -13.501 1.00 34.13 H new ATOM 0 HD22 ASN A 95 13.338 16.537 -14.267 1.00 34.13 H new ATOM 1523 N TYR A 96 14.459 11.006 -13.975 1.00 54.25 N ATOM 1524 CA TYR A 96 14.052 9.697 -13.478 1.00 11.54 C ATOM 1525 C TYR A 96 12.532 9.563 -13.476 1.00 2.30 C ATOM 1526 O TYR A 96 11.875 9.838 -12.472 1.00 55.22 O ATOM 1527 CB TYR A 96 14.596 9.474 -12.066 1.00 23.03 C ATOM 1528 CG TYR A 96 16.078 9.746 -11.938 1.00 1.11 C ATOM 1529 CD1 TYR A 96 16.972 9.302 -12.905 1.00 54.00 C ATOM 1530 CD2 TYR A 96 16.585 10.446 -10.850 1.00 52.11 C ATOM 1531 CE1 TYR A 96 18.326 9.548 -12.792 1.00 65.33 C ATOM 1532 CE2 TYR A 96 17.938 10.698 -10.730 1.00 32.41 C ATOM 1533 CZ TYR A 96 18.805 10.246 -11.703 1.00 55.23 C ATOM 1534 OH TYR A 96 20.153 10.493 -11.586 1.00 42.44 O ATOM 0 H TYR A 96 15.183 10.978 -14.693 1.00 54.25 H new ATOM 0 HA TYR A 96 14.464 8.939 -14.144 1.00 11.54 H new ATOM 0 HB2 TYR A 96 14.056 10.118 -11.372 1.00 23.03 H new ATOM 0 HB3 TYR A 96 14.397 8.445 -11.767 1.00 23.03 H new ATOM 0 HD1 TYR A 96 16.601 8.755 -13.759 1.00 54.00 H new ATOM 0 HD2 TYR A 96 15.910 10.799 -10.085 1.00 52.11 H new ATOM 0 HE1 TYR A 96 19.007 9.196 -13.553 1.00 65.33 H new ATOM 0 HE2 TYR A 96 18.315 11.246 -9.879 1.00 32.41 H new ATOM 0 HH TYR A 96 20.323 10.997 -10.763 1.00 42.44 H new ATOM 1544 N ASP A 97 11.981 9.138 -14.608 1.00 4.34 N ATOM 1545 CA ASP A 97 10.539 8.965 -14.738 1.00 43.22 C ATOM 1546 C ASP A 97 10.176 7.487 -14.836 1.00 21.23 C ATOM 1547 O ASP A 97 9.671 7.027 -15.860 1.00 13.02 O ATOM 1548 CB ASP A 97 10.024 9.712 -15.970 1.00 31.05 C ATOM 1549 CG ASP A 97 8.614 10.236 -15.781 1.00 32.13 C ATOM 1550 OD1 ASP A 97 7.723 9.432 -15.435 1.00 71.51 O ATOM 1551 OD2 ASP A 97 8.401 11.450 -15.978 1.00 3.43 O ATOM 0 H ASP A 97 12.511 8.907 -15.448 1.00 4.34 H new ATOM 0 HA ASP A 97 10.066 9.379 -13.847 1.00 43.22 H new ATOM 0 HB2 ASP A 97 10.691 10.545 -16.192 1.00 31.05 H new ATOM 0 HB3 ASP A 97 10.048 9.046 -16.832 1.00 31.05 H new ATOM 1556 N VAL A 98 10.438 6.746 -13.763 1.00 40.33 N ATOM 1557 CA VAL A 98 10.139 5.320 -13.728 1.00 31.34 C ATOM 1558 C VAL A 98 9.353 4.954 -12.474 1.00 13.24 C ATOM 1559 O VAL A 98 9.563 5.532 -11.408 1.00 1.04 O ATOM 1560 CB VAL A 98 11.426 4.475 -13.778 1.00 32.02 C ATOM 1561 CG1 VAL A 98 12.271 4.860 -14.982 1.00 42.42 C ATOM 1562 CG2 VAL A 98 12.217 4.633 -12.488 1.00 40.02 C ATOM 0 H VAL A 98 10.857 7.110 -12.907 1.00 40.33 H new ATOM 0 HA VAL A 98 9.535 5.102 -14.609 1.00 31.34 H new ATOM 0 HB VAL A 98 11.148 3.426 -13.880 1.00 32.02 H new ATOM 0 HG11 VAL A 98 13.176 4.253 -15.001 1.00 42.42 H new ATOM 0 HG12 VAL A 98 11.701 4.690 -15.896 1.00 42.42 H new ATOM 0 HG13 VAL A 98 12.542 5.913 -14.914 1.00 42.42 H new ATOM 0 HG21 VAL A 98 13.123 4.029 -12.540 1.00 40.02 H new ATOM 0 HG22 VAL A 98 12.486 5.680 -12.352 1.00 40.02 H new ATOM 0 HG23 VAL A 98 11.609 4.303 -11.646 1.00 40.02 H new ATOM 1572 N GLN A 99 8.447 3.991 -12.609 1.00 51.14 N ATOM 1573 CA GLN A 99 7.629 3.549 -11.486 1.00 72.35 C ATOM 1574 C GLN A 99 7.665 2.030 -11.352 1.00 32.12 C ATOM 1575 O GLN A 99 7.599 1.307 -12.346 1.00 51.23 O ATOM 1576 CB GLN A 99 6.185 4.023 -11.662 1.00 22.12 C ATOM 1577 CG GLN A 99 6.045 5.535 -11.728 1.00 4.20 C ATOM 1578 CD GLN A 99 5.890 6.045 -13.147 1.00 42.41 C ATOM 1579 OE1 GLN A 99 4.855 5.842 -13.783 1.00 23.24 O ATOM 1580 NE2 GLN A 99 6.921 6.713 -13.652 1.00 54.43 N ATOM 0 H GLN A 99 8.261 3.502 -13.485 1.00 51.14 H new ATOM 0 HA GLN A 99 8.039 3.986 -10.576 1.00 72.35 H new ATOM 0 HB2 GLN A 99 5.777 3.589 -12.575 1.00 22.12 H new ATOM 0 HB3 GLN A 99 5.584 3.647 -10.834 1.00 22.12 H new ATOM 0 HG2 GLN A 99 5.181 5.842 -11.139 1.00 4.20 H new ATOM 0 HG3 GLN A 99 6.921 5.997 -11.273 1.00 4.20 H new ATOM 0 HE21 GLN A 99 7.759 6.858 -13.090 1.00 54.43 H new ATOM 0 HE22 GLN A 99 6.874 7.081 -14.602 1.00 54.43 H new ATOM 1589 N ARG A 100 7.770 1.553 -10.116 1.00 21.31 N ATOM 1590 CA ARG A 100 7.817 0.120 -9.852 1.00 34.34 C ATOM 1591 C ARG A 100 6.811 -0.267 -8.771 1.00 0.41 C ATOM 1592 O ARG A 100 6.633 0.453 -7.788 1.00 11.10 O ATOM 1593 CB ARG A 100 9.225 -0.296 -9.425 1.00 24.34 C ATOM 1594 CG ARG A 100 9.410 -1.801 -9.317 1.00 72.24 C ATOM 1595 CD ARG A 100 10.139 -2.183 -8.039 1.00 33.53 C ATOM 1596 NE ARG A 100 9.321 -1.949 -6.852 1.00 31.54 N ATOM 1597 CZ ARG A 100 9.763 -2.115 -5.610 1.00 44.21 C ATOM 1598 NH1 ARG A 100 11.010 -2.513 -5.394 1.00 54.44 N ATOM 1599 NH2 ARG A 100 8.959 -1.882 -4.581 1.00 53.41 N ATOM 0 H ARG A 100 7.824 2.138 -9.282 1.00 21.31 H new ATOM 0 HA ARG A 100 7.555 -0.402 -10.772 1.00 34.34 H new ATOM 0 HB2 ARG A 100 9.944 0.099 -10.142 1.00 24.34 H new ATOM 0 HB3 ARG A 100 9.452 0.159 -8.461 1.00 24.34 H new ATOM 0 HG2 ARG A 100 8.437 -2.291 -9.342 1.00 72.24 H new ATOM 0 HG3 ARG A 100 9.971 -2.162 -10.179 1.00 72.24 H new ATOM 0 HD2 ARG A 100 10.421 -3.235 -8.083 1.00 33.53 H new ATOM 0 HD3 ARG A 100 11.062 -1.608 -7.962 1.00 33.53 H new ATOM 0 HE ARG A 100 8.357 -1.641 -6.984 1.00 31.54 H new ATOM 0 HH11 ARG A 100 11.632 -2.692 -6.182 1.00 54.44 H new ATOM 0 HH12 ARG A 100 11.347 -2.640 -4.440 1.00 54.44 H new ATOM 0 HH21 ARG A 100 8.000 -1.575 -4.743 1.00 53.41 H new ATOM 0 HH22 ARG A 100 9.300 -2.010 -3.628 1.00 53.41 H new ATOM 1613 N PHE A 101 6.156 -1.407 -8.960 1.00 73.12 N ATOM 1614 CA PHE A 101 5.167 -1.889 -8.003 1.00 12.33 C ATOM 1615 C PHE A 101 5.109 -3.413 -8.001 1.00 74.43 C ATOM 1616 O PHE A 101 5.122 -4.046 -9.057 1.00 60.55 O ATOM 1617 CB PHE A 101 3.787 -1.315 -8.330 1.00 52.34 C ATOM 1618 CG PHE A 101 2.809 -1.419 -7.195 1.00 22.11 C ATOM 1619 CD1 PHE A 101 3.168 -1.026 -5.916 1.00 2.42 C ATOM 1620 CD2 PHE A 101 1.531 -1.910 -7.407 1.00 20.32 C ATOM 1621 CE1 PHE A 101 2.271 -1.121 -4.869 1.00 74.52 C ATOM 1622 CE2 PHE A 101 0.629 -2.008 -6.364 1.00 70.10 C ATOM 1623 CZ PHE A 101 0.999 -1.612 -5.094 1.00 21.12 C ATOM 0 H PHE A 101 6.292 -2.015 -9.768 1.00 73.12 H new ATOM 0 HA PHE A 101 5.466 -1.553 -7.010 1.00 12.33 H new ATOM 0 HB2 PHE A 101 3.896 -0.267 -8.610 1.00 52.34 H new ATOM 0 HB3 PHE A 101 3.382 -1.837 -9.197 1.00 52.34 H new ATOM 0 HD1 PHE A 101 4.161 -0.641 -5.735 1.00 2.42 H new ATOM 0 HD2 PHE A 101 1.236 -2.220 -8.399 1.00 20.32 H new ATOM 0 HE1 PHE A 101 2.564 -0.812 -3.876 1.00 74.52 H new ATOM 0 HE2 PHE A 101 -0.364 -2.394 -6.542 1.00 70.10 H new ATOM 0 HZ PHE A 101 0.295 -1.686 -4.278 1.00 21.12 H new ATOM 1633 N ILE A 102 5.045 -3.996 -6.809 1.00 14.12 N ATOM 1634 CA ILE A 102 4.984 -5.446 -6.670 1.00 11.44 C ATOM 1635 C ILE A 102 3.844 -5.862 -5.746 1.00 51.15 C ATOM 1636 O ILE A 102 3.612 -5.240 -4.709 1.00 73.45 O ATOM 1637 CB ILE A 102 6.306 -6.014 -6.122 1.00 64.44 C ATOM 1638 CG1 ILE A 102 6.509 -5.584 -4.668 1.00 41.02 C ATOM 1639 CG2 ILE A 102 7.475 -5.559 -6.983 1.00 43.11 C ATOM 1640 CD1 ILE A 102 7.800 -6.089 -4.063 1.00 2.31 C ATOM 0 H ILE A 102 5.034 -3.487 -5.925 1.00 14.12 H new ATOM 0 HA ILE A 102 4.808 -5.852 -7.666 1.00 11.44 H new ATOM 0 HB ILE A 102 6.257 -7.102 -6.155 1.00 64.44 H new ATOM 0 HG12 ILE A 102 6.493 -4.495 -4.614 1.00 41.02 H new ATOM 0 HG13 ILE A 102 5.672 -5.945 -4.071 1.00 41.02 H new ATOM 0 HG21 ILE A 102 8.403 -5.969 -6.583 1.00 43.11 H new ATOM 0 HG22 ILE A 102 7.333 -5.912 -8.005 1.00 43.11 H new ATOM 0 HG23 ILE A 102 7.528 -4.470 -6.979 1.00 43.11 H new ATOM 0 HD11 ILE A 102 7.877 -5.746 -3.031 1.00 2.31 H new ATOM 0 HD12 ILE A 102 7.810 -7.179 -4.085 1.00 2.31 H new ATOM 0 HD13 ILE A 102 8.645 -5.707 -4.636 1.00 2.31 H new ATOM 1652 N VAL A 103 3.135 -6.919 -6.130 1.00 25.53 N ATOM 1653 CA VAL A 103 2.021 -7.422 -5.335 1.00 51.22 C ATOM 1654 C VAL A 103 1.853 -8.926 -5.514 1.00 33.41 C ATOM 1655 O VAL A 103 1.805 -9.427 -6.636 1.00 71.45 O ATOM 1656 CB VAL A 103 0.702 -6.721 -5.712 1.00 3.42 C ATOM 1657 CG1 VAL A 103 -0.453 -7.284 -4.899 1.00 13.33 C ATOM 1658 CG2 VAL A 103 0.823 -5.217 -5.512 1.00 72.32 C ATOM 0 H VAL A 103 3.312 -7.443 -6.987 1.00 25.53 H new ATOM 0 HA VAL A 103 2.254 -7.207 -4.292 1.00 51.22 H new ATOM 0 HB VAL A 103 0.498 -6.909 -6.766 1.00 3.42 H new ATOM 0 HG11 VAL A 103 -1.376 -6.777 -5.179 1.00 13.33 H new ATOM 0 HG12 VAL A 103 -0.551 -8.351 -5.097 1.00 13.33 H new ATOM 0 HG13 VAL A 103 -0.261 -7.128 -3.837 1.00 13.33 H new ATOM 0 HG21 VAL A 103 -0.117 -4.737 -5.783 1.00 72.32 H new ATOM 0 HG22 VAL A 103 1.050 -5.006 -4.467 1.00 72.32 H new ATOM 0 HG23 VAL A 103 1.623 -4.829 -6.143 1.00 72.32 H new ATOM 1668 N GLY A 104 1.763 -9.643 -4.398 1.00 31.25 N ATOM 1669 CA GLY A 104 1.601 -11.084 -4.452 1.00 75.33 C ATOM 1670 C GLY A 104 2.837 -11.788 -4.976 1.00 52.43 C ATOM 1671 O GLY A 104 3.942 -11.567 -4.481 1.00 12.32 O ATOM 0 H GLY A 104 1.799 -9.251 -3.457 1.00 31.25 H new ATOM 0 HA2 GLY A 104 1.369 -11.458 -3.455 1.00 75.33 H new ATOM 0 HA3 GLY A 104 0.751 -11.327 -5.089 1.00 75.33 H new ATOM 1675 N SER A 105 2.651 -12.638 -5.980 1.00 70.44 N ATOM 1676 CA SER A 105 3.760 -13.381 -6.568 1.00 53.14 C ATOM 1677 C SER A 105 4.152 -12.792 -7.920 1.00 75.33 C ATOM 1678 O SER A 105 5.020 -13.323 -8.613 1.00 32.42 O ATOM 1679 CB SER A 105 3.385 -14.855 -6.731 1.00 33.33 C ATOM 1680 OG SER A 105 2.404 -15.240 -5.782 1.00 45.43 O ATOM 0 H SER A 105 1.743 -12.830 -6.404 1.00 70.44 H new ATOM 0 HA SER A 105 4.614 -13.303 -5.895 1.00 53.14 H new ATOM 0 HB2 SER A 105 3.008 -15.028 -7.739 1.00 33.33 H new ATOM 0 HB3 SER A 105 4.274 -15.475 -6.612 1.00 33.33 H new ATOM 0 HG SER A 105 2.180 -16.186 -5.908 1.00 45.43 H new ATOM 1686 N ASP A 106 3.505 -11.692 -8.289 1.00 32.01 N ATOM 1687 CA ASP A 106 3.785 -11.029 -9.557 1.00 62.13 C ATOM 1688 C ASP A 106 4.160 -9.567 -9.335 1.00 75.01 C ATOM 1689 O ASP A 106 3.541 -8.873 -8.528 1.00 74.30 O ATOM 1690 CB ASP A 106 2.573 -11.123 -10.485 1.00 52.20 C ATOM 1691 CG ASP A 106 1.289 -10.687 -9.806 1.00 43.22 C ATOM 1692 OD1 ASP A 106 0.982 -9.477 -9.841 1.00 33.22 O ATOM 1693 OD2 ASP A 106 0.593 -11.555 -9.240 1.00 33.14 O ATOM 0 H ASP A 106 2.783 -11.241 -7.728 1.00 32.01 H new ATOM 0 HA ASP A 106 4.630 -11.535 -10.024 1.00 62.13 H new ATOM 0 HB2 ASP A 106 2.744 -10.503 -11.365 1.00 52.20 H new ATOM 0 HB3 ASP A 106 2.465 -12.150 -10.834 1.00 52.20 H new ATOM 1698 N ARG A 107 5.177 -9.106 -10.056 1.00 14.14 N ATOM 1699 CA ARG A 107 5.635 -7.727 -9.935 1.00 71.14 C ATOM 1700 C ARG A 107 5.638 -7.035 -11.295 1.00 40.31 C ATOM 1701 O ARG A 107 5.884 -7.665 -12.323 1.00 45.10 O ATOM 1702 CB ARG A 107 7.038 -7.685 -9.326 1.00 54.33 C ATOM 1703 CG ARG A 107 8.007 -8.670 -9.960 1.00 14.52 C ATOM 1704 CD ARG A 107 9.410 -8.511 -9.396 1.00 41.12 C ATOM 1705 NE ARG A 107 9.406 -8.405 -7.940 1.00 2.53 N ATOM 1706 CZ ARG A 107 9.125 -9.419 -7.130 1.00 11.15 C ATOM 1707 NH1 ARG A 107 8.827 -10.609 -7.631 1.00 73.42 N ATOM 1708 NH2 ARG A 107 9.142 -9.244 -5.814 1.00 41.43 N ATOM 0 H ARG A 107 5.699 -9.667 -10.729 1.00 14.14 H new ATOM 0 HA ARG A 107 4.945 -7.197 -9.278 1.00 71.14 H new ATOM 0 HB2 ARG A 107 7.439 -6.677 -9.428 1.00 54.33 H new ATOM 0 HB3 ARG A 107 6.968 -7.893 -8.258 1.00 54.33 H new ATOM 0 HG2 ARG A 107 7.658 -9.688 -9.788 1.00 14.52 H new ATOM 0 HG3 ARG A 107 8.028 -8.518 -11.039 1.00 14.52 H new ATOM 0 HD2 ARG A 107 10.020 -9.363 -9.696 1.00 41.12 H new ATOM 0 HD3 ARG A 107 9.874 -7.622 -9.823 1.00 41.12 H new ATOM 0 HE ARG A 107 9.631 -7.502 -7.522 1.00 2.53 H new ATOM 0 HH11 ARG A 107 8.813 -10.748 -8.641 1.00 73.42 H new ATOM 0 HH12 ARG A 107 8.612 -11.386 -7.006 1.00 73.42 H new ATOM 0 HH21 ARG A 107 9.371 -8.330 -5.424 1.00 41.43 H new ATOM 0 HH22 ARG A 107 8.926 -10.024 -5.193 1.00 41.43 H new ATOM 1722 N ALA A 108 5.362 -5.735 -11.292 1.00 40.31 N ATOM 1723 CA ALA A 108 5.334 -4.957 -12.524 1.00 45.34 C ATOM 1724 C ALA A 108 6.357 -3.826 -12.483 1.00 23.40 C ATOM 1725 O ALA A 108 6.608 -3.242 -11.428 1.00 70.15 O ATOM 1726 CB ALA A 108 3.939 -4.400 -12.766 1.00 2.11 C ATOM 0 H ALA A 108 5.155 -5.199 -10.450 1.00 40.31 H new ATOM 0 HA ALA A 108 5.597 -5.620 -13.348 1.00 45.34 H new ATOM 0 HB1 ALA A 108 3.933 -3.821 -13.690 1.00 2.11 H new ATOM 0 HB2 ALA A 108 3.228 -5.222 -12.849 1.00 2.11 H new ATOM 0 HB3 ALA A 108 3.654 -3.757 -11.933 1.00 2.11 H new ATOM 1732 N ILE A 109 6.945 -3.524 -13.636 1.00 21.33 N ATOM 1733 CA ILE A 109 7.940 -2.464 -13.730 1.00 44.40 C ATOM 1734 C ILE A 109 7.616 -1.505 -14.871 1.00 62.52 C ATOM 1735 O ILE A 109 7.120 -1.917 -15.920 1.00 32.31 O ATOM 1736 CB ILE A 109 9.355 -3.036 -13.941 1.00 54.21 C ATOM 1737 CG1 ILE A 109 10.398 -1.919 -13.860 1.00 75.11 C ATOM 1738 CG2 ILE A 109 9.441 -3.753 -15.280 1.00 44.11 C ATOM 1739 CD1 ILE A 109 10.739 -1.313 -15.203 1.00 52.51 C ATOM 0 H ILE A 109 6.749 -3.999 -14.517 1.00 21.33 H new ATOM 0 HA ILE A 109 7.914 -1.922 -12.785 1.00 44.40 H new ATOM 0 HB ILE A 109 9.562 -3.757 -13.150 1.00 54.21 H new ATOM 0 HG12 ILE A 109 10.028 -1.135 -13.200 1.00 75.11 H new ATOM 0 HG13 ILE A 109 11.307 -2.314 -13.407 1.00 75.11 H new ATOM 0 HG21 ILE A 109 10.446 -4.152 -15.415 1.00 44.11 H new ATOM 0 HG22 ILE A 109 8.720 -4.570 -15.302 1.00 44.11 H new ATOM 0 HG23 ILE A 109 9.218 -3.051 -16.084 1.00 44.11 H new ATOM 0 HD11 ILE A 109 11.484 -0.529 -15.070 1.00 52.51 H new ATOM 0 HD12 ILE A 109 11.139 -2.085 -15.860 1.00 52.51 H new ATOM 0 HD13 ILE A 109 9.840 -0.888 -15.649 1.00 52.51 H new ATOM 1751 N PHE A 110 7.902 -0.225 -14.661 1.00 10.15 N ATOM 1752 CA PHE A 110 7.642 0.793 -15.672 1.00 32.11 C ATOM 1753 C PHE A 110 8.797 1.787 -15.753 1.00 33.10 C ATOM 1754 O PHE A 110 9.142 2.435 -14.766 1.00 12.34 O ATOM 1755 CB PHE A 110 6.339 1.532 -15.359 1.00 21.10 C ATOM 1756 CG PHE A 110 6.103 2.729 -16.236 1.00 22.54 C ATOM 1757 CD1 PHE A 110 6.601 3.972 -15.882 1.00 1.14 C ATOM 1758 CD2 PHE A 110 5.384 2.610 -17.414 1.00 21.31 C ATOM 1759 CE1 PHE A 110 6.385 5.075 -16.686 1.00 73.11 C ATOM 1760 CE2 PHE A 110 5.165 3.709 -18.223 1.00 32.12 C ATOM 1761 CZ PHE A 110 5.667 4.943 -17.859 1.00 32.13 C ATOM 0 H PHE A 110 8.314 0.133 -13.799 1.00 10.15 H new ATOM 0 HA PHE A 110 7.546 0.295 -16.637 1.00 32.11 H new ATOM 0 HB2 PHE A 110 5.503 0.841 -15.469 1.00 21.10 H new ATOM 0 HB3 PHE A 110 6.353 1.852 -14.317 1.00 21.10 H new ATOM 0 HD1 PHE A 110 7.165 4.080 -14.967 1.00 1.14 H new ATOM 0 HD2 PHE A 110 4.990 1.647 -17.704 1.00 21.31 H new ATOM 0 HE1 PHE A 110 6.777 6.039 -16.398 1.00 73.11 H new ATOM 0 HE2 PHE A 110 4.602 3.603 -19.139 1.00 32.12 H new ATOM 0 HZ PHE A 110 5.499 5.803 -18.490 1.00 32.13 H new ATOM 1771 N MET A 111 9.390 1.900 -16.937 1.00 22.13 N ATOM 1772 CA MET A 111 10.506 2.815 -17.147 1.00 70.15 C ATOM 1773 C MET A 111 10.347 3.572 -18.462 1.00 2.30 C ATOM 1774 O MET A 111 10.227 2.967 -19.528 1.00 44.32 O ATOM 1775 CB MET A 111 11.830 2.048 -17.144 1.00 12.21 C ATOM 1776 CG MET A 111 11.939 1.019 -18.257 1.00 70.11 C ATOM 1777 SD MET A 111 13.390 -0.038 -18.086 1.00 33.20 S ATOM 1778 CE MET A 111 14.041 0.008 -19.754 1.00 34.30 C ATOM 0 H MET A 111 9.117 1.370 -17.765 1.00 22.13 H new ATOM 0 HA MET A 111 10.511 3.537 -16.330 1.00 70.15 H new ATOM 0 HB2 MET A 111 12.652 2.758 -17.235 1.00 12.21 H new ATOM 0 HB3 MET A 111 11.947 1.546 -16.184 1.00 12.21 H new ATOM 0 HG2 MET A 111 11.042 0.400 -18.263 1.00 70.11 H new ATOM 0 HG3 MET A 111 11.979 1.532 -19.218 1.00 70.11 H new ATOM 0 HE1 MET A 111 14.601 -0.906 -19.951 1.00 34.30 H new ATOM 0 HE2 MET A 111 13.218 0.089 -20.464 1.00 34.30 H new ATOM 0 HE3 MET A 111 14.701 0.869 -19.863 1.00 34.30 H new ATOM 1788 N LEU A 112 10.347 4.898 -18.379 1.00 54.13 N ATOM 1789 CA LEU A 112 10.202 5.739 -19.563 1.00 22.51 C ATOM 1790 C LEU A 112 10.918 7.072 -19.374 1.00 52.34 C ATOM 1791 O LEU A 112 11.039 7.570 -18.255 1.00 51.20 O ATOM 1792 CB LEU A 112 8.722 5.979 -19.864 1.00 51.12 C ATOM 1793 CG LEU A 112 8.315 5.899 -21.336 1.00 32.11 C ATOM 1794 CD1 LEU A 112 7.714 4.538 -21.650 1.00 60.51 C ATOM 1795 CD2 LEU A 112 7.333 7.009 -21.679 1.00 14.41 C ATOM 0 H LEU A 112 10.446 5.414 -17.505 1.00 54.13 H new ATOM 0 HA LEU A 112 10.657 5.220 -20.406 1.00 22.51 H new ATOM 0 HB2 LEU A 112 8.135 5.250 -19.305 1.00 51.12 H new ATOM 0 HB3 LEU A 112 8.450 6.964 -19.486 1.00 51.12 H new ATOM 0 HG LEU A 112 9.208 6.029 -21.947 1.00 32.11 H new ATOM 0 HD11 LEU A 112 7.430 4.499 -22.702 1.00 60.51 H new ATOM 0 HD12 LEU A 112 8.448 3.760 -21.443 1.00 60.51 H new ATOM 0 HD13 LEU A 112 6.832 4.378 -21.030 1.00 60.51 H new ATOM 0 HD21 LEU A 112 7.055 6.936 -22.730 1.00 14.41 H new ATOM 0 HD22 LEU A 112 6.441 6.910 -21.060 1.00 14.41 H new ATOM 0 HD23 LEU A 112 7.798 7.977 -21.493 1.00 14.41 H new ATOM 1807 N ARG A 113 11.388 7.647 -20.477 1.00 22.52 N ATOM 1808 CA ARG A 113 12.091 8.923 -20.433 1.00 12.20 C ATOM 1809 C ARG A 113 11.109 10.079 -20.263 1.00 32.31 C ATOM 1810 O ARG A 113 11.440 11.105 -19.669 1.00 55.45 O ATOM 1811 CB ARG A 113 12.912 9.122 -21.708 1.00 62.42 C ATOM 1812 CG ARG A 113 13.730 7.902 -22.102 1.00 10.33 C ATOM 1813 CD ARG A 113 13.060 7.119 -23.220 1.00 13.14 C ATOM 1814 NE ARG A 113 13.516 7.549 -24.539 1.00 32.22 N ATOM 1815 CZ ARG A 113 12.874 7.265 -25.667 1.00 24.43 C ATOM 1816 NH1 ARG A 113 11.755 6.555 -25.636 1.00 20.21 N ATOM 1817 NH2 ARG A 113 13.352 7.691 -26.829 1.00 3.33 N ATOM 0 H ARG A 113 11.294 7.249 -21.411 1.00 22.52 H new ATOM 0 HA ARG A 113 12.763 8.909 -19.575 1.00 12.20 H new ATOM 0 HB2 ARG A 113 12.240 9.378 -22.527 1.00 62.42 H new ATOM 0 HB3 ARG A 113 13.583 9.970 -21.569 1.00 62.42 H new ATOM 0 HG2 ARG A 113 14.724 8.217 -22.422 1.00 10.33 H new ATOM 0 HG3 ARG A 113 13.864 7.257 -21.234 1.00 10.33 H new ATOM 0 HD2 ARG A 113 13.268 6.057 -23.093 1.00 13.14 H new ATOM 0 HD3 ARG A 113 11.979 7.243 -23.152 1.00 13.14 H new ATOM 0 HE ARG A 113 14.374 8.097 -24.597 1.00 32.22 H new ATOM 0 HH11 ARG A 113 11.385 6.225 -24.745 1.00 20.21 H new ATOM 0 HH12 ARG A 113 11.264 6.338 -26.504 1.00 20.21 H new ATOM 0 HH21 ARG A 113 14.213 8.237 -26.857 1.00 3.33 H new ATOM 0 HH22 ARG A 113 12.858 7.472 -27.694 1.00 3.33 H new ATOM 1831 N ASP A 114 9.901 9.904 -20.788 1.00 20.32 N ATOM 1832 CA ASP A 114 8.870 10.931 -20.694 1.00 4.12 C ATOM 1833 C ASP A 114 8.037 10.751 -19.428 1.00 44.25 C ATOM 1834 O ASP A 114 8.044 11.604 -18.542 1.00 5.01 O ATOM 1835 CB ASP A 114 7.965 10.889 -21.926 1.00 12.43 C ATOM 1836 CG ASP A 114 8.746 10.707 -23.212 1.00 54.03 C ATOM 1837 OD1 ASP A 114 9.108 9.554 -23.528 1.00 11.54 O ATOM 1838 OD2 ASP A 114 8.995 11.717 -23.904 1.00 22.04 O ATOM 0 H ASP A 114 9.612 9.060 -21.283 1.00 20.32 H new ATOM 0 HA ASP A 114 9.362 11.902 -20.648 1.00 4.12 H new ATOM 0 HB2 ASP A 114 7.250 10.073 -21.820 1.00 12.43 H new ATOM 0 HB3 ASP A 114 7.389 11.813 -21.982 1.00 12.43 H new ATOM 1843 N GLY A 115 7.319 9.635 -19.353 1.00 20.25 N ATOM 1844 CA GLY A 115 6.490 9.364 -18.193 1.00 32.22 C ATOM 1845 C GLY A 115 5.010 9.487 -18.497 1.00 31.13 C ATOM 1846 O GLY A 115 4.352 8.499 -18.823 1.00 41.03 O ATOM 0 H GLY A 115 7.296 8.914 -20.074 1.00 20.25 H new ATOM 0 HA2 GLY A 115 6.700 8.359 -17.827 1.00 32.22 H new ATOM 0 HA3 GLY A 115 6.752 10.056 -17.393 1.00 32.22 H new ATOM 1850 N SER A 116 4.484 10.703 -18.388 1.00 21.23 N ATOM 1851 CA SER A 116 3.071 10.951 -18.648 1.00 32.40 C ATOM 1852 C SER A 116 2.659 10.380 -20.002 1.00 25.43 C ATOM 1853 O SER A 116 1.525 9.938 -20.183 1.00 34.33 O ATOM 1854 CB SER A 116 2.778 12.452 -18.605 1.00 20.54 C ATOM 1855 OG SER A 116 1.788 12.806 -19.555 1.00 21.33 O ATOM 0 H SER A 116 5.015 11.532 -18.121 1.00 21.23 H new ATOM 0 HA SER A 116 2.492 10.452 -17.871 1.00 32.40 H new ATOM 0 HB2 SER A 116 2.444 12.732 -17.606 1.00 20.54 H new ATOM 0 HB3 SER A 116 3.693 13.010 -18.804 1.00 20.54 H new ATOM 0 HG SER A 116 1.618 13.770 -19.506 1.00 21.33 H new ATOM 1861 N TYR A 117 3.590 10.393 -20.949 1.00 61.43 N ATOM 1862 CA TYR A 117 3.325 9.879 -22.288 1.00 21.21 C ATOM 1863 C TYR A 117 2.862 8.426 -22.232 1.00 55.41 C ATOM 1864 O TYR A 117 1.754 8.100 -22.657 1.00 14.03 O ATOM 1865 CB TYR A 117 4.578 9.993 -23.158 1.00 30.20 C ATOM 1866 CG TYR A 117 4.298 9.881 -24.640 1.00 4.13 C ATOM 1867 CD1 TYR A 117 4.197 8.640 -25.256 1.00 35.33 C ATOM 1868 CD2 TYR A 117 4.137 11.017 -25.424 1.00 30.41 C ATOM 1869 CE1 TYR A 117 3.942 8.533 -26.609 1.00 71.33 C ATOM 1870 CE2 TYR A 117 3.881 10.919 -26.778 1.00 14.02 C ATOM 1871 CZ TYR A 117 3.784 9.675 -27.366 1.00 2.11 C ATOM 1872 OH TYR A 117 3.530 9.574 -28.715 1.00 24.25 O ATOM 0 H TYR A 117 4.535 10.754 -20.815 1.00 61.43 H new ATOM 0 HA TYR A 117 2.529 10.479 -22.729 1.00 21.21 H new ATOM 0 HB2 TYR A 117 5.062 10.949 -22.959 1.00 30.20 H new ATOM 0 HB3 TYR A 117 5.283 9.213 -22.870 1.00 30.20 H new ATOM 0 HD1 TYR A 117 4.320 7.743 -24.667 1.00 35.33 H new ATOM 0 HD2 TYR A 117 4.213 11.993 -24.967 1.00 30.41 H new ATOM 0 HE1 TYR A 117 3.867 7.560 -27.072 1.00 71.33 H new ATOM 0 HE2 TYR A 117 3.757 11.812 -27.373 1.00 14.02 H new ATOM 0 HH TYR A 117 3.444 10.471 -29.100 1.00 24.25 H new ATOM 1882 N ALA A 118 3.718 7.558 -21.704 1.00 45.51 N ATOM 1883 CA ALA A 118 3.397 6.141 -21.589 1.00 43.44 C ATOM 1884 C ALA A 118 2.332 5.904 -20.524 1.00 3.30 C ATOM 1885 O ALA A 118 1.552 4.956 -20.613 1.00 43.21 O ATOM 1886 CB ALA A 118 4.651 5.340 -21.272 1.00 62.04 C ATOM 0 H ALA A 118 4.640 7.812 -21.349 1.00 45.51 H new ATOM 0 HA ALA A 118 2.997 5.805 -22.546 1.00 43.44 H new ATOM 0 HB1 ALA A 118 4.396 4.283 -21.189 1.00 62.04 H new ATOM 0 HB2 ALA A 118 5.381 5.476 -22.070 1.00 62.04 H new ATOM 0 HB3 ALA A 118 5.075 5.686 -20.330 1.00 62.04 H new ATOM 1892 N TRP A 119 2.306 6.771 -19.518 1.00 22.53 N ATOM 1893 CA TRP A 119 1.337 6.654 -18.434 1.00 55.23 C ATOM 1894 C TRP A 119 -0.076 6.491 -18.984 1.00 14.14 C ATOM 1895 O TRP A 119 -0.921 5.845 -18.365 1.00 30.14 O ATOM 1896 CB TRP A 119 1.405 7.883 -17.527 1.00 4.35 C ATOM 1897 CG TRP A 119 0.479 7.806 -16.351 1.00 24.24 C ATOM 1898 CD1 TRP A 119 -0.878 7.956 -16.365 1.00 1.11 C ATOM 1899 CD2 TRP A 119 0.844 7.561 -14.988 1.00 14.13 C ATOM 1900 NE1 TRP A 119 -1.379 7.820 -15.093 1.00 35.41 N ATOM 1901 CE2 TRP A 119 -0.344 7.576 -14.230 1.00 61.11 C ATOM 1902 CE3 TRP A 119 2.057 7.329 -14.334 1.00 34.10 C ATOM 1903 CZ2 TRP A 119 -0.351 7.369 -12.853 1.00 63.33 C ATOM 1904 CZ3 TRP A 119 2.048 7.124 -12.967 1.00 62.34 C ATOM 1905 CH2 TRP A 119 0.851 7.144 -12.239 1.00 63.11 C ATOM 0 H TRP A 119 2.944 7.562 -19.430 1.00 22.53 H new ATOM 0 HA TRP A 119 1.586 5.767 -17.851 1.00 55.23 H new ATOM 0 HB2 TRP A 119 2.427 8.005 -17.168 1.00 4.35 H new ATOM 0 HB3 TRP A 119 1.165 8.771 -18.112 1.00 4.35 H new ATOM 0 HD1 TRP A 119 -1.470 8.153 -17.246 1.00 1.11 H new ATOM 0 HE1 TRP A 119 -2.363 7.890 -14.833 1.00 35.41 H new ATOM 0 HE3 TRP A 119 2.985 7.310 -14.887 1.00 34.10 H new ATOM 0 HZ2 TRP A 119 -1.272 7.385 -12.290 1.00 63.33 H new ATOM 0 HZ3 TRP A 119 2.980 6.945 -12.451 1.00 62.34 H new ATOM 0 HH2 TRP A 119 0.878 6.979 -11.172 1.00 63.11 H new ATOM 1916 N GLU A 120 -0.326 7.081 -20.149 1.00 23.33 N ATOM 1917 CA GLU A 120 -1.638 7.000 -20.780 1.00 22.04 C ATOM 1918 C GLU A 120 -2.010 5.550 -21.077 1.00 52.32 C ATOM 1919 O GLU A 120 -3.013 5.041 -20.576 1.00 22.31 O ATOM 1920 CB GLU A 120 -1.658 7.819 -22.072 1.00 72.20 C ATOM 1921 CG GLU A 120 -2.857 8.745 -22.187 1.00 74.32 C ATOM 1922 CD GLU A 120 -3.153 9.141 -23.621 1.00 31.23 C ATOM 1923 OE1 GLU A 120 -2.216 9.123 -24.446 1.00 22.41 O ATOM 1924 OE2 GLU A 120 -4.321 9.469 -23.917 1.00 62.14 O ATOM 0 H GLU A 120 0.362 7.620 -20.674 1.00 23.33 H new ATOM 0 HA GLU A 120 -2.373 7.410 -20.087 1.00 22.04 H new ATOM 0 HB2 GLU A 120 -0.745 8.412 -22.131 1.00 72.20 H new ATOM 0 HB3 GLU A 120 -1.652 7.139 -22.924 1.00 72.20 H new ATOM 0 HG2 GLU A 120 -3.732 8.254 -21.761 1.00 74.32 H new ATOM 0 HG3 GLU A 120 -2.676 9.643 -21.596 1.00 74.32 H new ATOM 1931 N ILE A 121 -1.196 4.893 -21.896 1.00 72.21 N ATOM 1932 CA ILE A 121 -1.439 3.503 -22.260 1.00 73.51 C ATOM 1933 C ILE A 121 -1.192 2.573 -21.077 1.00 3.11 C ATOM 1934 O ILE A 121 -1.816 1.519 -20.960 1.00 34.43 O ATOM 1935 CB ILE A 121 -0.548 3.065 -23.438 1.00 32.24 C ATOM 1936 CG1 ILE A 121 -0.720 4.022 -24.619 1.00 73.30 C ATOM 1937 CG2 ILE A 121 -0.880 1.639 -23.851 1.00 61.22 C ATOM 1938 CD1 ILE A 121 0.227 3.743 -25.765 1.00 50.20 C ATOM 0 H ILE A 121 -0.363 5.301 -22.320 1.00 72.21 H new ATOM 0 HA ILE A 121 -2.484 3.434 -22.561 1.00 73.51 H new ATOM 0 HB ILE A 121 0.494 3.096 -23.118 1.00 32.24 H new ATOM 0 HG12 ILE A 121 -1.746 3.958 -24.982 1.00 73.30 H new ATOM 0 HG13 ILE A 121 -0.568 5.044 -24.273 1.00 73.30 H new ATOM 0 HG21 ILE A 121 -0.242 1.344 -24.684 1.00 61.22 H new ATOM 0 HG22 ILE A 121 -0.711 0.968 -23.009 1.00 61.22 H new ATOM 0 HG23 ILE A 121 -1.925 1.582 -24.156 1.00 61.22 H new ATOM 0 HD11 ILE A 121 0.049 4.459 -26.567 1.00 50.20 H new ATOM 0 HD12 ILE A 121 1.256 3.836 -25.418 1.00 50.20 H new ATOM 0 HD13 ILE A 121 0.060 2.732 -26.138 1.00 50.20 H new ATOM 1950 N LYS A 122 -0.277 2.972 -20.200 1.00 22.13 N ATOM 1951 CA LYS A 122 0.053 2.177 -19.022 1.00 54.43 C ATOM 1952 C LYS A 122 -1.207 1.803 -18.248 1.00 55.43 C ATOM 1953 O LYS A 122 -1.287 0.727 -17.656 1.00 70.01 O ATOM 1954 CB LYS A 122 1.012 2.949 -18.113 1.00 62.33 C ATOM 1955 CG LYS A 122 1.226 2.294 -16.760 1.00 24.23 C ATOM 1956 CD LYS A 122 2.252 3.049 -15.931 1.00 65.52 C ATOM 1957 CE LYS A 122 1.745 3.313 -14.522 1.00 24.12 C ATOM 1958 NZ LYS A 122 2.862 3.556 -13.567 1.00 40.52 N ATOM 0 H LYS A 122 0.250 3.842 -20.282 1.00 22.13 H new ATOM 0 HA LYS A 122 0.538 1.260 -19.357 1.00 54.43 H new ATOM 0 HB2 LYS A 122 1.974 3.049 -18.615 1.00 62.33 H new ATOM 0 HB3 LYS A 122 0.625 3.957 -17.962 1.00 62.33 H new ATOM 0 HG2 LYS A 122 0.280 2.253 -16.221 1.00 24.23 H new ATOM 0 HG3 LYS A 122 1.557 1.265 -16.901 1.00 24.23 H new ATOM 0 HD2 LYS A 122 3.177 2.475 -15.884 1.00 65.52 H new ATOM 0 HD3 LYS A 122 2.489 3.996 -16.417 1.00 65.52 H new ATOM 0 HE2 LYS A 122 1.081 4.177 -14.531 1.00 24.12 H new ATOM 0 HE3 LYS A 122 1.156 2.461 -14.182 1.00 24.12 H new ATOM 0 HZ1 LYS A 122 2.477 3.698 -12.611 1.00 40.52 H new ATOM 0 HZ2 LYS A 122 3.501 2.736 -13.564 1.00 40.52 H new ATOM 0 HZ3 LYS A 122 3.389 4.404 -13.858 1.00 40.52 H new ATOM 1972 N ASP A 123 -2.190 2.698 -18.259 1.00 22.43 N ATOM 1973 CA ASP A 123 -3.447 2.460 -17.560 1.00 14.14 C ATOM 1974 C ASP A 123 -4.042 1.112 -17.954 1.00 72.12 C ATOM 1975 O ASP A 123 -4.236 0.236 -17.111 1.00 13.44 O ATOM 1976 CB ASP A 123 -4.444 3.580 -17.864 1.00 21.23 C ATOM 1977 CG ASP A 123 -5.803 3.331 -17.239 1.00 4.13 C ATOM 1978 OD1 ASP A 123 -5.849 2.984 -16.040 1.00 73.44 O ATOM 1979 OD2 ASP A 123 -6.819 3.483 -17.948 1.00 53.23 O ATOM 0 H ASP A 123 -2.140 3.594 -18.744 1.00 22.43 H new ATOM 0 HA ASP A 123 -3.242 2.447 -16.490 1.00 14.14 H new ATOM 0 HB2 ASP A 123 -4.046 4.526 -17.497 1.00 21.23 H new ATOM 0 HB3 ASP A 123 -4.557 3.679 -18.944 1.00 21.23 H new ATOM 1984 N PHE A 124 -4.331 0.952 -19.242 1.00 4.24 N ATOM 1985 CA PHE A 124 -4.905 -0.289 -19.748 1.00 55.40 C ATOM 1986 C PHE A 124 -3.878 -1.417 -19.717 1.00 12.51 C ATOM 1987 O PHE A 124 -4.216 -2.573 -19.460 1.00 53.13 O ATOM 1988 CB PHE A 124 -5.420 -0.092 -21.175 1.00 52.34 C ATOM 1989 CG PHE A 124 -6.912 -0.218 -21.297 1.00 41.15 C ATOM 1990 CD1 PHE A 124 -7.743 0.819 -20.905 1.00 4.13 C ATOM 1991 CD2 PHE A 124 -7.483 -1.374 -21.805 1.00 14.25 C ATOM 1992 CE1 PHE A 124 -9.116 0.706 -21.016 1.00 3.40 C ATOM 1993 CE2 PHE A 124 -8.856 -1.492 -21.919 1.00 23.04 C ATOM 1994 CZ PHE A 124 -9.673 -0.451 -21.523 1.00 21.23 C ATOM 0 H PHE A 124 -4.177 1.666 -19.954 1.00 4.24 H new ATOM 0 HA PHE A 124 -5.739 -0.564 -19.102 1.00 55.40 H new ATOM 0 HB2 PHE A 124 -5.116 0.893 -21.529 1.00 52.34 H new ATOM 0 HB3 PHE A 124 -4.947 -0.825 -21.828 1.00 52.34 H new ATOM 0 HD1 PHE A 124 -7.313 1.727 -20.508 1.00 4.13 H new ATOM 0 HD2 PHE A 124 -6.849 -2.191 -22.115 1.00 14.25 H new ATOM 0 HE1 PHE A 124 -9.752 1.522 -20.706 1.00 3.40 H new ATOM 0 HE2 PHE A 124 -9.289 -2.398 -22.317 1.00 23.04 H new ATOM 0 HZ PHE A 124 -10.746 -0.542 -21.610 1.00 21.23 H new ATOM 2004 N LEU A 125 -2.623 -1.072 -19.980 1.00 65.23 N ATOM 2005 CA LEU A 125 -1.544 -2.055 -19.983 1.00 53.23 C ATOM 2006 C LEU A 125 -1.504 -2.823 -18.666 1.00 43.21 C ATOM 2007 O LEU A 125 -1.652 -4.045 -18.643 1.00 14.42 O ATOM 2008 CB LEU A 125 -0.200 -1.366 -20.227 1.00 14.23 C ATOM 2009 CG LEU A 125 0.932 -2.262 -20.729 1.00 2.04 C ATOM 2010 CD1 LEU A 125 0.599 -2.825 -22.101 1.00 60.14 C ATOM 2011 CD2 LEU A 125 2.244 -1.491 -20.770 1.00 73.22 C ATOM 0 H LEU A 125 -2.327 -0.120 -20.194 1.00 65.23 H new ATOM 0 HA LEU A 125 -1.733 -2.763 -20.790 1.00 53.23 H new ATOM 0 HB2 LEU A 125 -0.351 -0.565 -20.951 1.00 14.23 H new ATOM 0 HB3 LEU A 125 0.120 -0.898 -19.296 1.00 14.23 H new ATOM 0 HG LEU A 125 1.045 -3.095 -20.035 1.00 2.04 H new ATOM 0 HD11 LEU A 125 1.417 -3.460 -22.442 1.00 60.14 H new ATOM 0 HD12 LEU A 125 -0.317 -3.413 -22.040 1.00 60.14 H new ATOM 0 HD13 LEU A 125 0.458 -2.006 -22.806 1.00 60.14 H new ATOM 0 HD21 LEU A 125 3.039 -2.144 -21.130 1.00 73.22 H new ATOM 0 HD22 LEU A 125 2.144 -0.638 -21.441 1.00 73.22 H new ATOM 0 HD23 LEU A 125 2.490 -1.138 -19.769 1.00 73.22 H new ATOM 2023 N VAL A 126 -1.304 -2.098 -17.570 1.00 45.31 N ATOM 2024 CA VAL A 126 -1.247 -2.710 -16.248 1.00 40.11 C ATOM 2025 C VAL A 126 -2.588 -3.329 -15.871 1.00 53.32 C ATOM 2026 O VAL A 126 -2.645 -4.309 -15.128 1.00 43.34 O ATOM 2027 CB VAL A 126 -0.847 -1.684 -15.171 1.00 65.12 C ATOM 2028 CG1 VAL A 126 -1.941 -0.643 -14.992 1.00 30.23 C ATOM 2029 CG2 VAL A 126 -0.544 -2.384 -13.855 1.00 35.50 C ATOM 0 H VAL A 126 -1.179 -1.086 -17.572 1.00 45.31 H new ATOM 0 HA VAL A 126 -0.489 -3.492 -16.294 1.00 40.11 H new ATOM 0 HB VAL A 126 0.057 -1.172 -15.500 1.00 65.12 H new ATOM 0 HG11 VAL A 126 -1.640 0.073 -14.227 1.00 30.23 H new ATOM 0 HG12 VAL A 126 -2.104 -0.120 -15.935 1.00 30.23 H new ATOM 0 HG13 VAL A 126 -2.864 -1.135 -14.686 1.00 30.23 H new ATOM 0 HG21 VAL A 126 -0.263 -1.644 -13.106 1.00 35.50 H new ATOM 0 HG22 VAL A 126 -1.429 -2.924 -13.518 1.00 35.50 H new ATOM 0 HG23 VAL A 126 0.277 -3.086 -13.997 1.00 35.50 H new ATOM 2039 N SER A 127 -3.667 -2.750 -16.389 1.00 11.12 N ATOM 2040 CA SER A 127 -5.010 -3.242 -16.104 1.00 62.41 C ATOM 2041 C SER A 127 -5.107 -4.741 -16.374 1.00 55.23 C ATOM 2042 O SER A 127 -5.860 -5.453 -15.711 1.00 31.41 O ATOM 2043 CB SER A 127 -6.041 -2.492 -16.949 1.00 70.01 C ATOM 2044 OG SER A 127 -6.517 -3.302 -18.010 1.00 52.42 O ATOM 0 H SER A 127 -3.637 -1.940 -17.008 1.00 11.12 H new ATOM 0 HA SER A 127 -5.219 -3.066 -15.049 1.00 62.41 H new ATOM 0 HB2 SER A 127 -6.876 -2.183 -16.320 1.00 70.01 H new ATOM 0 HB3 SER A 127 -5.593 -1.584 -17.353 1.00 70.01 H new ATOM 0 HG SER A 127 -5.884 -3.268 -18.757 1.00 52.42 H new ATOM 2050 N GLN A 128 -4.341 -5.210 -17.353 1.00 63.31 N ATOM 2051 CA GLN A 128 -4.341 -6.624 -17.712 1.00 51.41 C ATOM 2052 C GLN A 128 -3.686 -7.463 -16.620 1.00 42.32 C ATOM 2053 O GLN A 128 -4.119 -8.580 -16.339 1.00 23.35 O ATOM 2054 CB GLN A 128 -3.612 -6.834 -19.040 1.00 72.33 C ATOM 2055 CG GLN A 128 -4.437 -7.584 -20.075 1.00 3.35 C ATOM 2056 CD GLN A 128 -5.110 -6.657 -21.067 1.00 51.42 C ATOM 2057 OE1 GLN A 128 -5.380 -5.494 -20.764 1.00 34.21 O ATOM 2058 NE2 GLN A 128 -5.385 -7.167 -22.262 1.00 2.00 N ATOM 0 H GLN A 128 -3.713 -4.633 -17.912 1.00 63.31 H new ATOM 0 HA GLN A 128 -5.377 -6.946 -17.819 1.00 51.41 H new ATOM 0 HB2 GLN A 128 -3.329 -5.863 -19.447 1.00 72.33 H new ATOM 0 HB3 GLN A 128 -2.689 -7.384 -18.855 1.00 72.33 H new ATOM 0 HG2 GLN A 128 -3.793 -8.280 -20.613 1.00 3.35 H new ATOM 0 HG3 GLN A 128 -5.196 -8.179 -19.567 1.00 3.35 H new ATOM 0 HE21 GLN A 128 -5.144 -8.136 -22.471 1.00 2.00 H new ATOM 0 HE22 GLN A 128 -5.837 -6.590 -22.971 1.00 2.00 H new ATOM 2067 N ASP A 129 -2.640 -6.917 -16.009 1.00 71.01 N ATOM 2068 CA ASP A 129 -1.925 -7.615 -14.947 1.00 60.21 C ATOM 2069 C ASP A 129 -1.278 -8.891 -15.476 1.00 23.42 C ATOM 2070 O ASP A 129 -1.189 -9.894 -14.767 1.00 12.13 O ATOM 2071 CB ASP A 129 -2.876 -7.950 -13.797 1.00 11.50 C ATOM 2072 CG ASP A 129 -2.142 -8.224 -12.499 1.00 45.34 C ATOM 2073 OD1 ASP A 129 -0.894 -8.267 -12.522 1.00 41.41 O ATOM 2074 OD2 ASP A 129 -2.814 -8.396 -11.461 1.00 74.23 O ATOM 0 H ASP A 129 -2.269 -5.993 -16.231 1.00 71.01 H new ATOM 0 HA ASP A 129 -1.139 -6.956 -14.578 1.00 60.21 H new ATOM 0 HB2 ASP A 129 -3.570 -7.122 -13.651 1.00 11.50 H new ATOM 0 HB3 ASP A 129 -3.472 -8.822 -14.065 1.00 11.50 H new ATOM 2079 N ARG A 130 -0.828 -8.847 -16.726 1.00 0.14 N ATOM 2080 CA ARG A 130 -0.191 -10.000 -17.350 1.00 32.21 C ATOM 2081 C ARG A 130 0.330 -9.647 -18.740 1.00 30.21 C ATOM 2082 O ARG A 130 -0.300 -9.966 -19.749 1.00 63.03 O ATOM 2083 CB ARG A 130 -1.178 -11.165 -17.444 1.00 62.52 C ATOM 2084 CG ARG A 130 -0.596 -12.404 -18.105 1.00 22.40 C ATOM 2085 CD ARG A 130 -1.541 -12.973 -19.152 1.00 65.11 C ATOM 2086 NE ARG A 130 -1.699 -14.419 -19.019 1.00 12.24 N ATOM 2087 CZ ARG A 130 -2.472 -15.150 -19.814 1.00 43.15 C ATOM 2088 NH1 ARG A 130 -3.152 -14.574 -20.796 1.00 1.52 N ATOM 2089 NH2 ARG A 130 -2.564 -16.461 -19.630 1.00 14.43 N ATOM 0 H ARG A 130 -0.893 -8.025 -17.326 1.00 0.14 H new ATOM 0 HA ARG A 130 0.654 -10.298 -16.729 1.00 32.21 H new ATOM 0 HB2 ARG A 130 -1.518 -11.424 -16.441 1.00 62.52 H new ATOM 0 HB3 ARG A 130 -2.055 -10.843 -18.005 1.00 62.52 H new ATOM 0 HG2 ARG A 130 0.358 -12.155 -18.571 1.00 22.40 H new ATOM 0 HG3 ARG A 130 -0.393 -13.161 -17.347 1.00 22.40 H new ATOM 0 HD2 ARG A 130 -2.515 -12.492 -19.061 1.00 65.11 H new ATOM 0 HD3 ARG A 130 -1.162 -12.740 -20.147 1.00 65.11 H new ATOM 0 HE ARG A 130 -1.188 -14.893 -18.275 1.00 12.24 H new ATOM 0 HH11 ARG A 130 -3.082 -13.567 -20.942 1.00 1.52 H new ATOM 0 HH12 ARG A 130 -3.745 -15.138 -21.405 1.00 1.52 H new ATOM 0 HH21 ARG A 130 -2.041 -16.908 -18.877 1.00 14.43 H new ATOM 0 HH22 ARG A 130 -3.158 -17.021 -20.241 1.00 14.43 H new ATOM 2103 N CYS A 131 1.482 -8.988 -18.784 1.00 41.50 N ATOM 2104 CA CYS A 131 2.087 -8.590 -20.050 1.00 44.22 C ATOM 2105 C CYS A 131 3.608 -8.546 -19.936 1.00 33.30 C ATOM 2106 O CYS A 131 4.152 -8.086 -18.933 1.00 32.13 O ATOM 2107 CB CYS A 131 1.557 -7.223 -20.486 1.00 2.03 C ATOM 2108 SG CYS A 131 0.911 -7.185 -22.174 1.00 65.51 S ATOM 0 H CYS A 131 2.016 -8.718 -17.958 1.00 41.50 H new ATOM 0 HA CYS A 131 1.818 -9.332 -20.801 1.00 44.22 H new ATOM 0 HB2 CYS A 131 0.768 -6.916 -19.800 1.00 2.03 H new ATOM 0 HB3 CYS A 131 2.359 -6.490 -20.399 1.00 2.03 H new ATOM 0 HG CYS A 131 0.485 -5.988 -22.449 1.00 65.51 H new ATOM 2114 N ALA A 132 4.288 -9.030 -20.970 1.00 74.23 N ATOM 2115 CA ALA A 132 5.745 -9.046 -20.986 1.00 61.33 C ATOM 2116 C ALA A 132 6.290 -8.228 -22.152 1.00 24.31 C ATOM 2117 O ALA A 132 6.151 -8.615 -23.312 1.00 12.03 O ATOM 2118 CB ALA A 132 6.256 -10.478 -21.059 1.00 3.55 C ATOM 0 H ALA A 132 3.853 -9.416 -21.808 1.00 74.23 H new ATOM 0 HA ALA A 132 6.099 -8.592 -20.061 1.00 61.33 H new ATOM 0 HB1 ALA A 132 7.346 -10.475 -21.070 1.00 3.55 H new ATOM 0 HB2 ALA A 132 5.904 -11.035 -20.191 1.00 3.55 H new ATOM 0 HB3 ALA A 132 5.885 -10.951 -21.968 1.00 3.55 H new ATOM 2124 N GLU A 133 6.911 -7.096 -21.835 1.00 51.03 N ATOM 2125 CA GLU A 133 7.475 -6.223 -22.858 1.00 64.31 C ATOM 2126 C GLU A 133 8.890 -5.790 -22.483 1.00 53.23 C ATOM 2127 O GLU A 133 9.199 -5.589 -21.309 1.00 32.14 O ATOM 2128 CB GLU A 133 6.588 -4.992 -23.056 1.00 24.31 C ATOM 2129 CG GLU A 133 5.118 -5.325 -23.242 1.00 33.31 C ATOM 2130 CD GLU A 133 4.478 -4.536 -24.368 1.00 5.44 C ATOM 2131 OE1 GLU A 133 4.076 -3.378 -24.125 1.00 74.52 O ATOM 2132 OE2 GLU A 133 4.381 -5.074 -25.490 1.00 12.01 O ATOM 0 H GLU A 133 7.036 -6.762 -20.879 1.00 51.03 H new ATOM 0 HA GLU A 133 7.520 -6.782 -23.792 1.00 64.31 H new ATOM 0 HB2 GLU A 133 6.697 -4.334 -22.194 1.00 24.31 H new ATOM 0 HB3 GLU A 133 6.939 -4.438 -23.926 1.00 24.31 H new ATOM 0 HG2 GLU A 133 5.014 -6.391 -23.446 1.00 33.31 H new ATOM 0 HG3 GLU A 133 4.584 -5.124 -22.313 1.00 33.31 H new ATOM 2139 N VAL A 134 9.745 -5.648 -23.491 1.00 4.14 N ATOM 2140 CA VAL A 134 11.127 -5.238 -23.268 1.00 52.12 C ATOM 2141 C VAL A 134 11.668 -4.460 -24.462 1.00 41.22 C ATOM 2142 O VAL A 134 11.540 -4.891 -25.609 1.00 2.22 O ATOM 2143 CB VAL A 134 12.037 -6.452 -23.005 1.00 62.23 C ATOM 2144 CG1 VAL A 134 11.935 -7.453 -24.146 1.00 30.30 C ATOM 2145 CG2 VAL A 134 13.477 -6.004 -22.805 1.00 62.54 C ATOM 0 H VAL A 134 9.505 -5.811 -24.469 1.00 4.14 H new ATOM 0 HA VAL A 134 11.129 -4.595 -22.388 1.00 52.12 H new ATOM 0 HB VAL A 134 11.703 -6.944 -22.091 1.00 62.23 H new ATOM 0 HG11 VAL A 134 12.585 -8.304 -23.943 1.00 30.30 H new ATOM 0 HG12 VAL A 134 10.905 -7.797 -24.237 1.00 30.30 H new ATOM 0 HG13 VAL A 134 12.242 -6.976 -25.077 1.00 30.30 H new ATOM 0 HG21 VAL A 134 14.107 -6.874 -22.620 1.00 62.54 H new ATOM 0 HG22 VAL A 134 13.825 -5.488 -23.700 1.00 62.54 H new ATOM 0 HG23 VAL A 134 13.533 -5.328 -21.952 1.00 62.54 H new ATOM 2155 N THR A 135 12.275 -3.309 -24.186 1.00 73.43 N ATOM 2156 CA THR A 135 12.836 -2.470 -25.237 1.00 55.32 C ATOM 2157 C THR A 135 14.137 -1.817 -24.784 1.00 74.31 C ATOM 2158 O THR A 135 14.160 -1.067 -23.807 1.00 72.42 O ATOM 2159 CB THR A 135 11.846 -1.370 -25.666 1.00 75.42 C ATOM 2160 OG1 THR A 135 10.524 -1.702 -25.226 1.00 0.05 O ATOM 2161 CG2 THR A 135 11.853 -1.195 -27.177 1.00 74.54 C ATOM 0 H THR A 135 12.390 -2.937 -23.243 1.00 73.43 H new ATOM 0 HA THR A 135 13.036 -3.121 -26.088 1.00 55.32 H new ATOM 0 HB THR A 135 12.157 -0.432 -25.206 1.00 75.42 H new ATOM 0 HG1 THR A 135 10.470 -1.606 -24.252 1.00 0.05 H new ATOM 0 HG21 THR A 135 11.146 -0.413 -27.456 1.00 74.54 H new ATOM 0 HG22 THR A 135 12.853 -0.914 -27.506 1.00 74.54 H new ATOM 0 HG23 THR A 135 11.564 -2.132 -27.653 1.00 74.54 H new ATOM 2169 N LEU A 136 15.218 -2.106 -25.499 1.00 61.34 N ATOM 2170 CA LEU A 136 16.525 -1.546 -25.171 1.00 74.40 C ATOM 2171 C LEU A 136 17.381 -1.390 -26.424 1.00 35.21 C ATOM 2172 O LEU A 136 17.590 -2.348 -27.167 1.00 22.43 O ATOM 2173 CB LEU A 136 17.243 -2.438 -24.157 1.00 0.14 C ATOM 2174 CG LEU A 136 17.401 -3.908 -24.548 1.00 42.41 C ATOM 2175 CD1 LEU A 136 18.868 -4.308 -24.537 1.00 22.11 C ATOM 2176 CD2 LEU A 136 16.596 -4.798 -23.613 1.00 21.20 C ATOM 0 H LEU A 136 15.216 -2.725 -26.310 1.00 61.34 H new ATOM 0 HA LEU A 136 16.371 -0.559 -24.734 1.00 74.40 H new ATOM 0 HB2 LEU A 136 18.234 -2.023 -23.976 1.00 0.14 H new ATOM 0 HB3 LEU A 136 16.700 -2.390 -23.213 1.00 0.14 H new ATOM 0 HG LEU A 136 17.018 -4.038 -25.560 1.00 42.41 H new ATOM 0 HD11 LEU A 136 18.961 -5.357 -24.818 1.00 22.11 H new ATOM 0 HD12 LEU A 136 19.418 -3.692 -25.248 1.00 22.11 H new ATOM 0 HD13 LEU A 136 19.277 -4.162 -23.537 1.00 22.11 H new ATOM 0 HD21 LEU A 136 16.720 -5.840 -23.906 1.00 21.20 H new ATOM 0 HD22 LEU A 136 16.948 -4.664 -22.590 1.00 21.20 H new ATOM 0 HD23 LEU A 136 15.542 -4.528 -23.672 1.00 21.20 H new