USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1067 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 138 ASN :FLIP amide:sc= -1.9! C(o=-2.6!,f=-1.4!) USER MOD Set 1.2: A 163 ASN :FLIP amide:sc= 0.549 F(o=-2.6,f=-1.4) USER MOD Set 2.1: A 40 TYR OH : rot 30:sc= -0.766 USER MOD Set 2.2: A 77 MET CE :methyl -157:sc= -1.75 (180deg=-2.7!) USER MOD Set 3.1: A 29 HIS : no HE2:sc= -1.24! C(o=-0.094!,f=-3.8!) USER MOD Set 3.2: A 134 THR OG1 : rot -120:sc= 1.15 USER MOD Set 3.3: A 156 SER OG : rot 180:sc=-0.00183 USER MOD Single : A 8 GLN : amide:sc= -0.423 X(o=-0.42,f=-0.74) USER MOD Single : A 10 TYR OH : rot 180:sc= -0.154 USER MOD Single : A 17 MET CE :methyl 180:sc= -0.517 (180deg=-0.517) USER MOD Single : A 18 LYS NZ :NH3+ -161:sc= 0.183 (180deg=-0.14) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 THR OG1 : rot -88:sc= 1.67 USER MOD Single : A 28 SER OG : rot -52:sc= 0.186 USER MOD Single : A 36 HIS : no HD1:sc= -1.03 X(o=-1,f=-1.5) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.42 X(o=-0.42,f=0) USER MOD Single : A 41 MET CE :methyl -163:sc= -0.114 (180deg=-0.512) USER MOD Single : A 43 ASN :FLIP amide:sc= -1.21 F(o=-2.4!,f=-1.2) USER MOD Single : A 45 ASN : amide:sc= -0.253 X(o=-0.25,f=-0.2!) USER MOD Single : A 51 GLN :FLIP amide:sc= -0.02 F(o=-1.1,f=-0.02) USER MOD Single : A 55 TYR OH : rot 80:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0824 USER MOD Single : A 74 ASN : amide:sc= -0.197 X(o=-0.2,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -133:sc= -1.34 (180deg=-2.48) USER MOD Single : A 81 ASN : amide:sc= 0.119 X(o=0.12,f=0) USER MOD Single : A 82 SER OG : rot -28:sc= 0.19 USER MOD Single : A 85 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -160:sc= 0.134 USER MOD Single : A 93 HIS : no HD1:sc= -0.308 X(o=-0.31,f=-0.079) USER MOD Single : A 94 ASN : amide:sc= -0.0826 X(o=-0.083,f=-0.038) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -0.112 K(o=-0.11,f=-0.97) USER MOD Single : A 129 HIS :FLIP no HE2:sc= -2.04 F(o=-4!,f=-2) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ -163:sc= 1.26 (180deg=0.69) USER MOD Single : A 144 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot -27:sc= -0.361 USER MOD Single : A 161 CYS SG : rot -45:sc= -0.228 USER MOD ----------------------------------------------------------------- ATOM 65 N GLN A 8 2.939 10.405 -2.756 1.00 1.20 N ATOM 66 CA GLN A 8 4.229 10.982 -2.419 1.00 1.13 C ATOM 67 C GLN A 8 4.258 12.464 -2.730 1.00 0.98 C ATOM 68 O GLN A 8 3.828 12.896 -3.800 1.00 0.93 O ATOM 69 CB GLN A 8 5.352 10.264 -3.164 1.00 1.19 C ATOM 70 CG GLN A 8 5.713 8.921 -2.554 1.00 1.42 C ATOM 71 CD GLN A 8 6.066 9.046 -1.083 1.00 1.54 C ATOM 72 OE1 GLN A 8 5.214 8.898 -0.205 1.00 2.00 O ATOM 73 NE2 GLN A 8 7.322 9.355 -0.806 1.00 1.75 N ATOM 0 HA GLN A 8 4.383 10.853 -1.348 1.00 1.13 H new ATOM 0 HB2 GLN A 8 5.054 10.116 -4.202 1.00 1.19 H new ATOM 0 HB3 GLN A 8 6.237 10.900 -3.175 1.00 1.19 H new ATOM 0 HG2 GLN A 8 4.876 8.233 -2.670 1.00 1.42 H new ATOM 0 HG3 GLN A 8 6.556 8.491 -3.095 1.00 1.42 H new ATOM 0 HE21 GLN A 8 7.998 9.469 -1.562 1.00 1.75 H new ATOM 0 HE22 GLN A 8 7.615 9.479 0.163 1.00 1.75 H new ATOM 82 N VAL A 9 4.757 13.236 -1.783 1.00 0.94 N ATOM 83 CA VAL A 9 4.877 14.671 -1.958 1.00 0.81 C ATOM 84 C VAL A 9 6.329 15.037 -2.228 1.00 0.79 C ATOM 85 O VAL A 9 7.242 14.609 -1.518 1.00 0.87 O ATOM 86 CB VAL A 9 4.325 15.446 -0.737 1.00 0.81 C ATOM 87 CG1 VAL A 9 4.870 14.879 0.563 1.00 1.16 C ATOM 88 CG2 VAL A 9 4.642 16.927 -0.847 1.00 1.27 C ATOM 0 H VAL A 9 5.087 12.892 -0.881 1.00 0.94 H new ATOM 0 HA VAL A 9 4.273 14.962 -2.817 1.00 0.81 H new ATOM 0 HB VAL A 9 3.242 15.327 -0.730 1.00 0.81 H new ATOM 0 HG11 VAL A 9 4.465 15.443 1.404 1.00 1.16 H new ATOM 0 HG12 VAL A 9 4.579 13.833 0.654 1.00 1.16 H new ATOM 0 HG13 VAL A 9 5.957 14.954 0.565 1.00 1.16 H new ATOM 0 HG21 VAL A 9 4.244 17.450 0.023 1.00 1.27 H new ATOM 0 HG22 VAL A 9 5.722 17.066 -0.891 1.00 1.27 H new ATOM 0 HG23 VAL A 9 4.188 17.330 -1.752 1.00 1.27 H new ATOM 98 N TYR A 10 6.529 15.809 -3.277 1.00 0.71 N ATOM 99 CA TYR A 10 7.858 16.143 -3.740 1.00 0.71 C ATOM 100 C TYR A 10 8.117 17.629 -3.541 1.00 0.62 C ATOM 101 O TYR A 10 7.195 18.442 -3.601 1.00 0.57 O ATOM 102 CB TYR A 10 7.988 15.762 -5.214 1.00 0.74 C ATOM 103 CG TYR A 10 7.419 14.393 -5.533 1.00 0.83 C ATOM 104 CD1 TYR A 10 7.991 13.232 -5.017 1.00 0.95 C ATOM 105 CD2 TYR A 10 6.312 14.263 -6.360 1.00 0.84 C ATOM 106 CE1 TYR A 10 7.470 11.986 -5.319 1.00 1.04 C ATOM 107 CE2 TYR A 10 5.787 13.023 -6.664 1.00 0.94 C ATOM 108 CZ TYR A 10 6.370 11.888 -6.145 1.00 1.03 C ATOM 109 OH TYR A 10 5.846 10.650 -6.449 1.00 1.14 O ATOM 0 H TYR A 10 5.777 16.221 -3.830 1.00 0.71 H new ATOM 0 HA TYR A 10 8.600 15.588 -3.166 1.00 0.71 H new ATOM 0 HB2 TYR A 10 7.479 16.510 -5.822 1.00 0.74 H new ATOM 0 HB3 TYR A 10 9.041 15.785 -5.496 1.00 0.74 H new ATOM 0 HD1 TYR A 10 8.854 13.306 -4.372 1.00 0.95 H new ATOM 0 HD2 TYR A 10 5.853 15.149 -6.773 1.00 0.84 H new ATOM 0 HE1 TYR A 10 7.923 11.095 -4.910 1.00 1.04 H new ATOM 0 HE2 TYR A 10 4.922 12.943 -7.306 1.00 0.94 H new ATOM 0 HH TYR A 10 5.073 10.759 -7.041 1.00 1.14 H new ATOM 119 N ARG A 11 9.368 17.974 -3.296 1.00 0.66 N ATOM 120 CA ARG A 11 9.744 19.346 -3.025 1.00 0.64 C ATOM 121 C ARG A 11 10.556 19.900 -4.187 1.00 0.56 C ATOM 122 O ARG A 11 11.425 19.217 -4.722 1.00 0.66 O ATOM 123 CB ARG A 11 10.546 19.400 -1.722 1.00 0.85 C ATOM 124 CG ARG A 11 10.910 20.801 -1.266 1.00 0.85 C ATOM 125 CD ARG A 11 11.790 20.767 -0.018 1.00 1.11 C ATOM 126 NE ARG A 11 11.955 19.404 0.502 1.00 1.37 N ATOM 127 CZ ARG A 11 13.095 18.920 1.000 1.00 1.76 C ATOM 128 NH1 ARG A 11 14.153 19.710 1.139 1.00 2.15 N ATOM 129 NH2 ARG A 11 13.165 17.644 1.368 1.00 2.31 N ATOM 0 H ARG A 11 10.146 17.315 -3.280 1.00 0.66 H new ATOM 0 HA ARG A 11 8.850 19.960 -2.914 1.00 0.64 H new ATOM 0 HB2 ARG A 11 9.970 18.913 -0.935 1.00 0.85 H new ATOM 0 HB3 ARG A 11 11.462 18.823 -1.850 1.00 0.85 H new ATOM 0 HG2 ARG A 11 11.432 21.323 -2.068 1.00 0.85 H new ATOM 0 HG3 ARG A 11 10.001 21.366 -1.058 1.00 0.85 H new ATOM 0 HD2 ARG A 11 12.768 21.186 -0.253 1.00 1.11 H new ATOM 0 HD3 ARG A 11 11.349 21.398 0.754 1.00 1.11 H new ATOM 0 HE ARG A 11 11.144 18.785 0.481 1.00 1.37 H new ATOM 0 HH11 ARG A 11 14.097 20.691 0.865 1.00 2.15 H new ATOM 0 HH12 ARG A 11 15.022 19.336 1.520 1.00 2.15 H new ATOM 0 HH21 ARG A 11 12.350 17.039 1.269 1.00 2.31 H new ATOM 0 HH22 ARG A 11 14.034 17.270 1.749 1.00 2.31 H new ATOM 143 N GLY A 12 10.255 21.122 -4.585 1.00 0.46 N ATOM 144 CA GLY A 12 10.972 21.750 -5.673 1.00 0.45 C ATOM 145 C GLY A 12 10.929 23.255 -5.564 1.00 0.44 C ATOM 146 O GLY A 12 10.529 23.793 -4.529 1.00 0.50 O ATOM 0 H GLY A 12 9.521 21.696 -4.171 1.00 0.46 H new ATOM 0 HA2 GLY A 12 12.009 21.413 -5.670 1.00 0.45 H new ATOM 0 HA3 GLY A 12 10.538 21.440 -6.624 1.00 0.45 H new ATOM 150 N PHE A 13 11.337 23.936 -6.617 1.00 0.44 N ATOM 151 CA PHE A 13 11.365 25.390 -6.617 1.00 0.46 C ATOM 152 C PHE A 13 11.033 25.947 -7.996 1.00 0.43 C ATOM 153 O PHE A 13 11.307 25.318 -9.020 1.00 0.45 O ATOM 154 CB PHE A 13 12.726 25.913 -6.132 1.00 0.57 C ATOM 155 CG PHE A 13 13.843 24.911 -6.239 1.00 0.57 C ATOM 156 CD1 PHE A 13 14.584 24.802 -7.404 1.00 0.63 C ATOM 157 CD2 PHE A 13 14.150 24.075 -5.170 1.00 0.58 C ATOM 158 CE1 PHE A 13 15.605 23.881 -7.502 1.00 0.68 C ATOM 159 CE2 PHE A 13 15.169 23.157 -5.265 1.00 0.63 C ATOM 160 CZ PHE A 13 15.900 23.058 -6.431 1.00 0.67 C ATOM 0 H PHE A 13 11.655 23.507 -7.486 1.00 0.44 H new ATOM 0 HA PHE A 13 10.600 25.737 -5.922 1.00 0.46 H new ATOM 0 HB2 PHE A 13 12.990 26.798 -6.710 1.00 0.57 H new ATOM 0 HB3 PHE A 13 12.633 26.227 -5.093 1.00 0.57 H new ATOM 0 HD1 PHE A 13 14.360 25.444 -8.243 1.00 0.63 H new ATOM 0 HD2 PHE A 13 13.581 24.148 -4.255 1.00 0.58 H new ATOM 0 HE1 PHE A 13 16.175 23.802 -8.416 1.00 0.68 H new ATOM 0 HE2 PHE A 13 15.397 22.514 -4.428 1.00 0.63 H new ATOM 0 HZ PHE A 13 16.702 22.338 -6.507 1.00 0.67 H new ATOM 170 N ILE A 14 10.421 27.123 -8.003 1.00 0.42 N ATOM 171 CA ILE A 14 10.016 27.787 -9.237 1.00 0.42 C ATOM 172 C ILE A 14 11.240 28.250 -10.021 1.00 0.48 C ATOM 173 O ILE A 14 12.025 29.054 -9.526 1.00 0.56 O ATOM 174 CB ILE A 14 9.129 29.015 -8.934 1.00 0.43 C ATOM 175 CG1 ILE A 14 7.950 28.630 -8.028 1.00 0.41 C ATOM 176 CG2 ILE A 14 8.619 29.646 -10.226 1.00 0.46 C ATOM 177 CD1 ILE A 14 6.959 27.679 -8.671 1.00 0.38 C ATOM 0 H ILE A 14 10.191 27.644 -7.157 1.00 0.42 H new ATOM 0 HA ILE A 14 9.450 27.067 -9.828 1.00 0.42 H new ATOM 0 HB ILE A 14 9.741 29.748 -8.408 1.00 0.43 H new ATOM 0 HG12 ILE A 14 8.339 28.172 -7.119 1.00 0.41 H new ATOM 0 HG13 ILE A 14 7.425 29.537 -7.728 1.00 0.41 H new ATOM 0 HG21 ILE A 14 7.997 30.509 -9.989 1.00 0.46 H new ATOM 0 HG22 ILE A 14 9.466 29.965 -10.834 1.00 0.46 H new ATOM 0 HG23 ILE A 14 8.030 28.915 -10.780 1.00 0.46 H new ATOM 0 HD11 ILE A 14 6.158 27.457 -7.966 1.00 0.38 H new ATOM 0 HD12 ILE A 14 6.539 28.141 -9.564 1.00 0.38 H new ATOM 0 HD13 ILE A 14 7.467 26.755 -8.945 1.00 0.38 H new ATOM 189 N ALA A 15 11.402 27.737 -11.232 1.00 0.49 N ATOM 190 CA ALA A 15 12.517 28.138 -12.083 1.00 0.58 C ATOM 191 C ALA A 15 12.035 28.981 -13.250 1.00 0.65 C ATOM 192 O ALA A 15 12.574 30.051 -13.523 1.00 0.76 O ATOM 193 CB ALA A 15 13.266 26.924 -12.594 1.00 0.59 C ATOM 0 H ALA A 15 10.779 27.045 -11.648 1.00 0.49 H new ATOM 0 HA ALA A 15 13.196 28.740 -11.479 1.00 0.58 H new ATOM 0 HB1 ALA A 15 14.093 27.246 -13.226 1.00 0.59 H new ATOM 0 HB2 ALA A 15 13.655 26.355 -11.750 1.00 0.59 H new ATOM 0 HB3 ALA A 15 12.589 26.296 -13.174 1.00 0.59 H new ATOM 199 N VAL A 16 11.018 28.491 -13.939 1.00 0.66 N ATOM 200 CA VAL A 16 10.455 29.196 -15.075 1.00 0.78 C ATOM 201 C VAL A 16 8.964 29.432 -14.864 1.00 0.69 C ATOM 202 O VAL A 16 8.248 28.563 -14.362 1.00 0.67 O ATOM 203 CB VAL A 16 10.691 28.419 -16.388 1.00 0.94 C ATOM 204 CG1 VAL A 16 10.148 27.013 -16.279 1.00 1.55 C ATOM 205 CG2 VAL A 16 10.064 29.136 -17.569 1.00 1.42 C ATOM 0 H VAL A 16 10.564 27.602 -13.729 1.00 0.66 H new ATOM 0 HA VAL A 16 10.959 30.159 -15.157 1.00 0.78 H new ATOM 0 HB VAL A 16 11.767 28.366 -16.556 1.00 0.94 H new ATOM 0 HG11 VAL A 16 10.324 26.482 -17.214 1.00 1.55 H new ATOM 0 HG12 VAL A 16 10.651 26.491 -15.465 1.00 1.55 H new ATOM 0 HG13 VAL A 16 9.077 27.051 -16.079 1.00 1.55 H new ATOM 0 HG21 VAL A 16 10.246 28.565 -18.480 1.00 1.42 H new ATOM 0 HG22 VAL A 16 8.990 29.230 -17.409 1.00 1.42 H new ATOM 0 HG23 VAL A 16 10.505 30.128 -17.668 1.00 1.42 H new ATOM 215 N MET A 17 8.498 30.606 -15.248 1.00 0.73 N ATOM 216 CA MET A 17 7.115 30.982 -15.024 1.00 0.71 C ATOM 217 C MET A 17 6.490 31.549 -16.295 1.00 0.81 C ATOM 218 O MET A 17 7.003 32.510 -16.865 1.00 0.89 O ATOM 219 CB MET A 17 7.045 32.013 -13.894 1.00 0.74 C ATOM 220 CG MET A 17 5.651 32.570 -13.648 1.00 1.23 C ATOM 221 SD MET A 17 5.619 33.849 -12.377 1.00 1.42 S ATOM 222 CE MET A 17 6.108 32.906 -10.932 1.00 0.90 C ATOM 0 H MET A 17 9.059 31.317 -15.718 1.00 0.73 H new ATOM 0 HA MET A 17 6.551 30.093 -14.742 1.00 0.71 H new ATOM 0 HB2 MET A 17 7.409 31.554 -12.975 1.00 0.74 H new ATOM 0 HB3 MET A 17 7.718 32.838 -14.127 1.00 0.74 H new ATOM 0 HG2 MET A 17 5.260 32.980 -14.579 1.00 1.23 H new ATOM 0 HG3 MET A 17 4.987 31.757 -13.355 1.00 1.23 H new ATOM 0 HE1 MET A 17 6.134 33.562 -10.062 1.00 0.90 H new ATOM 0 HE2 MET A 17 5.390 32.104 -10.761 1.00 0.90 H new ATOM 0 HE3 MET A 17 7.097 32.478 -11.094 1.00 0.90 H new ATOM 232 N LYS A 18 5.410 30.933 -16.752 1.00 0.83 N ATOM 233 CA LYS A 18 4.611 31.503 -17.829 1.00 0.97 C ATOM 234 C LYS A 18 3.311 32.019 -17.247 1.00 1.03 C ATOM 235 O LYS A 18 3.134 32.056 -16.029 1.00 1.01 O ATOM 236 CB LYS A 18 4.281 30.484 -18.934 1.00 1.02 C ATOM 237 CG LYS A 18 5.452 30.061 -19.804 1.00 1.31 C ATOM 238 CD LYS A 18 6.407 29.180 -19.038 1.00 1.39 C ATOM 239 CE LYS A 18 7.502 28.608 -19.925 1.00 1.29 C ATOM 240 NZ LYS A 18 6.961 27.723 -20.992 1.00 2.03 N ATOM 0 H LYS A 18 5.067 30.041 -16.396 1.00 0.83 H new ATOM 0 HA LYS A 18 5.198 32.301 -18.283 1.00 0.97 H new ATOM 0 HB2 LYS A 18 3.857 29.594 -18.469 1.00 1.02 H new ATOM 0 HB3 LYS A 18 3.508 30.908 -19.576 1.00 1.02 H new ATOM 0 HG2 LYS A 18 5.084 29.528 -20.681 1.00 1.31 H new ATOM 0 HG3 LYS A 18 5.978 30.944 -20.166 1.00 1.31 H new ATOM 0 HD2 LYS A 18 6.860 29.755 -18.230 1.00 1.39 H new ATOM 0 HD3 LYS A 18 5.853 28.363 -18.576 1.00 1.39 H new ATOM 0 HE2 LYS A 18 8.060 29.425 -20.382 1.00 1.29 H new ATOM 0 HE3 LYS A 18 8.206 28.045 -19.312 1.00 1.29 H new ATOM 0 HZ1 LYS A 18 7.721 27.115 -21.357 1.00 2.03 H new ATOM 0 HZ2 LYS A 18 6.202 27.130 -20.600 1.00 2.03 H new ATOM 0 HZ3 LYS A 18 6.581 28.305 -21.766 1.00 2.03 H new ATOM 254 N GLU A 19 2.406 32.385 -18.125 1.00 1.21 N ATOM 255 CA GLU A 19 1.104 32.900 -17.721 1.00 1.32 C ATOM 256 C GLU A 19 0.102 31.763 -17.530 1.00 1.18 C ATOM 257 O GLU A 19 -0.916 31.929 -16.860 1.00 1.24 O ATOM 258 CB GLU A 19 0.594 33.891 -18.763 1.00 1.62 C ATOM 259 CG GLU A 19 1.523 35.073 -18.954 1.00 2.11 C ATOM 260 CD GLU A 19 1.110 35.951 -20.112 1.00 2.65 C ATOM 261 OE1 GLU A 19 1.277 35.520 -21.275 1.00 2.89 O ATOM 262 OE2 GLU A 19 0.625 37.075 -19.867 1.00 3.24 O ATOM 0 H GLU A 19 2.543 32.337 -19.135 1.00 1.21 H new ATOM 0 HA GLU A 19 1.215 33.413 -16.766 1.00 1.32 H new ATOM 0 HB2 GLU A 19 0.468 33.377 -19.716 1.00 1.62 H new ATOM 0 HB3 GLU A 19 -0.390 34.253 -18.463 1.00 1.62 H new ATOM 0 HG2 GLU A 19 1.543 35.667 -18.040 1.00 2.11 H new ATOM 0 HG3 GLU A 19 2.537 34.711 -19.120 1.00 2.11 H new ATOM 269 N ASN A 20 0.389 30.613 -18.131 1.00 1.10 N ATOM 270 CA ASN A 20 -0.499 29.459 -18.020 1.00 1.07 C ATOM 271 C ASN A 20 0.135 28.348 -17.185 1.00 0.95 C ATOM 272 O ASN A 20 -0.485 27.810 -16.269 1.00 0.97 O ATOM 273 CB ASN A 20 -0.858 28.908 -19.406 1.00 1.19 C ATOM 274 CG ASN A 20 -1.761 29.836 -20.200 1.00 1.48 C ATOM 275 OD1 ASN A 20 -2.985 29.749 -20.112 1.00 2.03 O ATOM 276 ND2 ASN A 20 -1.165 30.715 -20.996 1.00 1.59 N ATOM 0 H ASN A 20 1.223 30.454 -18.696 1.00 1.10 H new ATOM 0 HA ASN A 20 -1.407 29.800 -17.522 1.00 1.07 H new ATOM 0 HB2 ASN A 20 0.059 28.733 -19.969 1.00 1.19 H new ATOM 0 HB3 ASN A 20 -1.351 27.943 -19.290 1.00 1.19 H new ATOM 0 HD21 ASN A 20 -1.725 31.351 -21.564 1.00 1.59 H new ATOM 0 HD22 ASN A 20 -0.147 30.755 -21.040 1.00 1.59 H new ATOM 283 N PHE A 21 1.379 28.017 -17.493 1.00 0.88 N ATOM 284 CA PHE A 21 2.051 26.904 -16.840 1.00 0.80 C ATOM 285 C PHE A 21 3.525 27.209 -16.626 1.00 0.75 C ATOM 286 O PHE A 21 4.021 28.246 -17.060 1.00 0.79 O ATOM 287 CB PHE A 21 1.893 25.626 -17.672 1.00 0.87 C ATOM 288 CG PHE A 21 2.473 25.718 -19.062 1.00 0.94 C ATOM 289 CD1 PHE A 21 3.798 25.376 -19.304 1.00 0.97 C ATOM 290 CD2 PHE A 21 1.693 26.141 -20.125 1.00 1.14 C ATOM 291 CE1 PHE A 21 4.328 25.457 -20.577 1.00 1.05 C ATOM 292 CE2 PHE A 21 2.218 26.223 -21.399 1.00 1.25 C ATOM 293 CZ PHE A 21 3.536 25.881 -21.627 1.00 1.15 C ATOM 0 H PHE A 21 1.944 28.502 -18.190 1.00 0.88 H new ATOM 0 HA PHE A 21 1.587 26.753 -15.865 1.00 0.80 H new ATOM 0 HB2 PHE A 21 2.372 24.801 -17.145 1.00 0.87 H new ATOM 0 HB3 PHE A 21 0.833 25.384 -17.748 1.00 0.87 H new ATOM 0 HD1 PHE A 21 4.421 25.043 -18.487 1.00 0.97 H new ATOM 0 HD2 PHE A 21 0.661 26.410 -19.955 1.00 1.14 H new ATOM 0 HE1 PHE A 21 5.360 25.189 -20.751 1.00 1.05 H new ATOM 0 HE2 PHE A 21 1.597 26.555 -22.218 1.00 1.25 H new ATOM 0 HZ PHE A 21 3.947 25.945 -22.624 1.00 1.15 H new ATOM 303 N GLY A 22 4.213 26.300 -15.962 1.00 0.71 N ATOM 304 CA GLY A 22 5.627 26.454 -15.730 1.00 0.68 C ATOM 305 C GLY A 22 6.299 25.121 -15.518 1.00 0.66 C ATOM 306 O GLY A 22 5.630 24.088 -15.440 1.00 0.70 O ATOM 0 H GLY A 22 3.810 25.447 -15.575 1.00 0.71 H new ATOM 0 HA2 GLY A 22 6.083 26.962 -16.580 1.00 0.68 H new ATOM 0 HA3 GLY A 22 5.787 27.087 -14.857 1.00 0.68 H new ATOM 310 N PHE A 23 7.613 25.138 -15.435 1.00 0.66 N ATOM 311 CA PHE A 23 8.370 23.931 -15.184 1.00 0.65 C ATOM 312 C PHE A 23 9.039 24.051 -13.829 1.00 0.56 C ATOM 313 O PHE A 23 9.728 25.040 -13.548 1.00 0.59 O ATOM 314 CB PHE A 23 9.416 23.702 -16.280 1.00 0.76 C ATOM 315 CG PHE A 23 8.842 23.686 -17.670 1.00 0.85 C ATOM 316 CD1 PHE A 23 7.881 22.757 -18.032 1.00 0.88 C ATOM 317 CD2 PHE A 23 9.258 24.611 -18.612 1.00 0.98 C ATOM 318 CE1 PHE A 23 7.347 22.755 -19.308 1.00 0.98 C ATOM 319 CE2 PHE A 23 8.734 24.616 -19.884 1.00 1.08 C ATOM 320 CZ PHE A 23 7.774 23.686 -20.236 1.00 1.06 C ATOM 0 H PHE A 23 8.181 25.979 -15.538 1.00 0.66 H new ATOM 0 HA PHE A 23 7.696 23.074 -15.190 1.00 0.65 H new ATOM 0 HB2 PHE A 23 10.172 24.485 -16.218 1.00 0.76 H new ATOM 0 HB3 PHE A 23 9.922 22.755 -16.095 1.00 0.76 H new ATOM 0 HD1 PHE A 23 7.545 22.027 -17.311 1.00 0.88 H new ATOM 0 HD2 PHE A 23 10.007 25.341 -18.344 1.00 0.98 H new ATOM 0 HE1 PHE A 23 6.597 22.027 -19.579 1.00 0.98 H new ATOM 0 HE2 PHE A 23 9.072 25.345 -20.606 1.00 1.08 H new ATOM 0 HZ PHE A 23 7.359 23.687 -21.233 1.00 1.06 H new ATOM 330 N ILE A 24 8.813 23.072 -12.980 1.00 0.54 N ATOM 331 CA ILE A 24 9.352 23.110 -11.635 1.00 0.48 C ATOM 332 C ILE A 24 10.682 22.382 -11.574 1.00 0.54 C ATOM 333 O ILE A 24 10.784 21.224 -11.989 1.00 0.61 O ATOM 334 CB ILE A 24 8.381 22.478 -10.622 1.00 0.42 C ATOM 335 CG1 ILE A 24 7.015 23.166 -10.702 1.00 0.41 C ATOM 336 CG2 ILE A 24 8.945 22.567 -9.209 1.00 0.40 C ATOM 337 CD1 ILE A 24 5.982 22.581 -9.764 1.00 0.41 C ATOM 0 H ILE A 24 8.261 22.241 -13.195 1.00 0.54 H new ATOM 0 HA ILE A 24 9.496 24.158 -11.373 1.00 0.48 H new ATOM 0 HB ILE A 24 8.256 21.424 -10.871 1.00 0.42 H new ATOM 0 HG12 ILE A 24 7.138 24.225 -10.477 1.00 0.41 H new ATOM 0 HG13 ILE A 24 6.644 23.098 -11.725 1.00 0.41 H new ATOM 0 HG21 ILE A 24 8.243 22.115 -8.508 1.00 0.40 H new ATOM 0 HG22 ILE A 24 9.896 22.037 -9.163 1.00 0.40 H new ATOM 0 HG23 ILE A 24 9.099 23.613 -8.944 1.00 0.40 H new ATOM 0 HD11 ILE A 24 5.041 23.120 -9.877 1.00 0.41 H new ATOM 0 HD12 ILE A 24 5.829 21.528 -10.002 1.00 0.41 H new ATOM 0 HD13 ILE A 24 6.331 22.673 -8.735 1.00 0.41 H new ATOM 349 N GLU A 25 11.697 23.075 -11.081 1.00 0.58 N ATOM 350 CA GLU A 25 12.984 22.462 -10.830 1.00 0.67 C ATOM 351 C GLU A 25 12.866 21.525 -9.648 1.00 0.64 C ATOM 352 O GLU A 25 12.488 21.937 -8.543 1.00 0.63 O ATOM 353 CB GLU A 25 14.050 23.527 -10.566 1.00 0.78 C ATOM 354 CG GLU A 25 14.737 24.036 -11.818 1.00 0.95 C ATOM 355 CD GLU A 25 15.735 23.042 -12.372 1.00 1.60 C ATOM 356 OE1 GLU A 25 16.952 23.284 -12.222 1.00 2.07 O ATOM 357 OE2 GLU A 25 15.309 22.017 -12.937 1.00 2.30 O ATOM 0 H GLU A 25 11.650 24.067 -10.847 1.00 0.58 H new ATOM 0 HA GLU A 25 13.289 21.897 -11.711 1.00 0.67 H new ATOM 0 HB2 GLU A 25 13.588 24.369 -10.050 1.00 0.78 H new ATOM 0 HB3 GLU A 25 14.802 23.115 -9.893 1.00 0.78 H new ATOM 0 HG2 GLU A 25 13.987 24.255 -12.578 1.00 0.95 H new ATOM 0 HG3 GLU A 25 15.247 24.973 -11.594 1.00 0.95 H new ATOM 364 N THR A 26 13.149 20.262 -9.899 1.00 0.68 N ATOM 365 CA THR A 26 13.083 19.245 -8.875 1.00 0.69 C ATOM 366 C THR A 26 14.154 19.488 -7.818 1.00 0.71 C ATOM 367 O THR A 26 15.130 20.198 -8.067 1.00 0.82 O ATOM 368 CB THR A 26 13.243 17.851 -9.502 1.00 0.79 C ATOM 369 OG1 THR A 26 14.031 17.954 -10.693 1.00 0.84 O ATOM 370 CG2 THR A 26 11.891 17.231 -9.835 1.00 0.87 C ATOM 0 H THR A 26 13.430 19.915 -10.816 1.00 0.68 H new ATOM 0 HA THR A 26 12.108 19.295 -8.391 1.00 0.69 H new ATOM 0 HB THR A 26 13.740 17.206 -8.778 1.00 0.79 H new ATOM 0 HG1 THR A 26 13.447 18.145 -11.456 1.00 0.84 H new ATOM 0 HG21 THR A 26 12.041 16.246 -10.277 1.00 0.87 H new ATOM 0 HG22 THR A 26 11.301 17.134 -8.924 1.00 0.87 H new ATOM 0 HG23 THR A 26 11.363 17.869 -10.543 1.00 0.87 H new ATOM 378 N LEU A 27 13.968 18.899 -6.647 1.00 0.68 N ATOM 379 CA LEU A 27 14.818 19.178 -5.500 1.00 0.74 C ATOM 380 C LEU A 27 16.288 18.923 -5.806 1.00 0.89 C ATOM 381 O LEU A 27 17.149 19.737 -5.478 1.00 1.00 O ATOM 382 CB LEU A 27 14.406 18.321 -4.310 1.00 0.74 C ATOM 383 CG LEU A 27 14.930 18.817 -2.967 1.00 0.80 C ATOM 384 CD1 LEU A 27 14.188 20.072 -2.557 1.00 1.48 C ATOM 385 CD2 LEU A 27 14.803 17.731 -1.914 1.00 1.58 C ATOM 0 H LEU A 27 13.230 18.219 -6.465 1.00 0.68 H new ATOM 0 HA LEU A 27 14.692 20.234 -5.261 1.00 0.74 H new ATOM 0 HB2 LEU A 27 13.318 18.277 -4.268 1.00 0.74 H new ATOM 0 HB3 LEU A 27 14.760 17.303 -4.471 1.00 0.74 H new ATOM 0 HG LEU A 27 15.988 19.062 -3.063 1.00 0.80 H new ATOM 0 HD11 LEU A 27 14.567 20.421 -1.597 1.00 1.48 H new ATOM 0 HD12 LEU A 27 14.338 20.846 -3.310 1.00 1.48 H new ATOM 0 HD13 LEU A 27 13.124 19.853 -2.469 1.00 1.48 H new ATOM 0 HD21 LEU A 27 15.182 18.102 -0.961 1.00 1.58 H new ATOM 0 HD22 LEU A 27 13.755 17.452 -1.804 1.00 1.58 H new ATOM 0 HD23 LEU A 27 15.381 16.859 -2.219 1.00 1.58 H new ATOM 397 N SER A 28 16.576 17.789 -6.423 1.00 0.97 N ATOM 398 CA SER A 28 17.943 17.436 -6.752 1.00 1.16 C ATOM 399 C SER A 28 18.215 17.755 -8.221 1.00 1.12 C ATOM 400 O SER A 28 19.238 17.345 -8.782 1.00 1.25 O ATOM 401 CB SER A 28 18.188 15.949 -6.468 1.00 1.34 C ATOM 402 OG SER A 28 19.569 15.629 -6.521 1.00 2.04 O ATOM 0 H SER A 28 15.880 17.099 -6.705 1.00 0.97 H new ATOM 0 HA SER A 28 18.625 18.019 -6.133 1.00 1.16 H new ATOM 0 HB2 SER A 28 17.792 15.696 -5.484 1.00 1.34 H new ATOM 0 HB3 SER A 28 17.645 15.345 -7.195 1.00 1.34 H new ATOM 0 HG SER A 28 19.948 15.955 -7.364 1.00 2.04 H new ATOM 408 N HIS A 29 17.295 18.517 -8.823 1.00 1.00 N ATOM 409 CA HIS A 29 17.346 18.848 -10.247 1.00 1.01 C ATOM 410 C HIS A 29 17.267 17.568 -11.073 1.00 1.02 C ATOM 411 O HIS A 29 17.875 17.445 -12.142 1.00 1.13 O ATOM 412 CB HIS A 29 18.611 19.646 -10.574 1.00 1.17 C ATOM 413 CG HIS A 29 18.735 20.921 -9.790 1.00 1.75 C ATOM 414 ND1 HIS A 29 18.238 22.135 -10.205 1.00 2.53 N ATOM 415 CD2 HIS A 29 19.312 21.149 -8.582 1.00 2.06 C ATOM 416 CE1 HIS A 29 18.522 23.039 -9.261 1.00 3.29 C ATOM 417 NE2 HIS A 29 19.170 22.495 -8.255 1.00 3.03 N ATOM 0 H HIS A 29 16.495 18.920 -8.335 1.00 1.00 H new ATOM 0 HA HIS A 29 16.492 19.476 -10.499 1.00 1.01 H new ATOM 0 HB2 HIS A 29 19.484 19.023 -10.380 1.00 1.17 H new ATOM 0 HB3 HIS A 29 18.618 19.881 -11.638 1.00 1.17 H new ATOM 0 HD1 HIS A 29 17.741 22.314 -11.078 1.00 2.53 H new ATOM 0 HD2 HIS A 29 19.803 20.405 -7.972 1.00 2.06 H new ATOM 0 HE1 HIS A 29 18.253 24.083 -9.318 1.00 3.29 H new ATOM 425 N ASP A 30 16.480 16.632 -10.550 1.00 1.05 N ATOM 426 CA ASP A 30 16.266 15.316 -11.144 1.00 1.17 C ATOM 427 C ASP A 30 15.786 15.430 -12.589 1.00 1.15 C ATOM 428 O ASP A 30 16.424 14.926 -13.514 1.00 1.31 O ATOM 429 CB ASP A 30 15.202 14.545 -10.341 1.00 1.31 C ATOM 430 CG ASP A 30 15.402 14.607 -8.836 1.00 2.12 C ATOM 431 OD1 ASP A 30 15.322 15.715 -8.265 1.00 2.89 O ATOM 432 OD2 ASP A 30 15.668 13.549 -8.218 1.00 2.47 O ATOM 0 H ASP A 30 15.962 16.770 -9.682 1.00 1.05 H new ATOM 0 HA ASP A 30 17.219 14.788 -11.124 1.00 1.17 H new ATOM 0 HB2 ASP A 30 14.217 14.945 -10.584 1.00 1.31 H new ATOM 0 HB3 ASP A 30 15.209 13.502 -10.656 1.00 1.31 H new ATOM 437 N GLU A 31 14.661 16.107 -12.765 1.00 1.06 N ATOM 438 CA GLU A 31 13.992 16.190 -14.059 1.00 1.19 C ATOM 439 C GLU A 31 13.068 17.403 -14.085 1.00 1.07 C ATOM 440 O GLU A 31 12.954 18.116 -13.085 1.00 0.94 O ATOM 441 CB GLU A 31 13.191 14.907 -14.313 1.00 1.37 C ATOM 442 CG GLU A 31 12.126 14.635 -13.257 1.00 1.33 C ATOM 443 CD GLU A 31 11.594 13.217 -13.304 1.00 1.49 C ATOM 444 OE1 GLU A 31 11.010 12.833 -14.339 1.00 1.80 O ATOM 445 OE2 GLU A 31 11.738 12.483 -12.305 1.00 1.65 O ATOM 0 H GLU A 31 14.186 16.614 -12.018 1.00 1.06 H new ATOM 0 HA GLU A 31 14.739 16.299 -14.845 1.00 1.19 H new ATOM 0 HB2 GLU A 31 12.713 14.974 -15.290 1.00 1.37 H new ATOM 0 HB3 GLU A 31 13.878 14.061 -14.351 1.00 1.37 H new ATOM 0 HG2 GLU A 31 12.544 14.828 -12.269 1.00 1.33 H new ATOM 0 HG3 GLU A 31 11.299 15.332 -13.395 1.00 1.33 H new ATOM 452 N GLU A 32 12.401 17.632 -15.208 1.00 1.20 N ATOM 453 CA GLU A 32 11.495 18.762 -15.326 1.00 1.14 C ATOM 454 C GLU A 32 10.044 18.301 -15.219 1.00 1.04 C ATOM 455 O GLU A 32 9.633 17.329 -15.861 1.00 1.17 O ATOM 456 CB GLU A 32 11.724 19.532 -16.641 1.00 1.41 C ATOM 457 CG GLU A 32 11.429 18.737 -17.913 1.00 1.85 C ATOM 458 CD GLU A 32 12.508 17.728 -18.261 1.00 2.71 C ATOM 459 OE1 GLU A 32 12.485 16.615 -17.699 1.00 3.37 O ATOM 460 OE2 GLU A 32 13.390 18.050 -19.086 1.00 3.06 O ATOM 0 H GLU A 32 12.471 17.053 -16.045 1.00 1.20 H new ATOM 0 HA GLU A 32 11.705 19.443 -14.501 1.00 1.14 H new ATOM 0 HB2 GLU A 32 11.099 20.425 -16.635 1.00 1.41 H new ATOM 0 HB3 GLU A 32 12.760 19.868 -16.672 1.00 1.41 H new ATOM 0 HG2 GLU A 32 10.480 18.215 -17.794 1.00 1.85 H new ATOM 0 HG3 GLU A 32 11.309 19.430 -18.746 1.00 1.85 H new ATOM 467 N VAL A 33 9.281 18.985 -14.383 1.00 0.87 N ATOM 468 CA VAL A 33 7.877 18.656 -14.183 1.00 0.80 C ATOM 469 C VAL A 33 6.988 19.735 -14.780 1.00 0.75 C ATOM 470 O VAL A 33 7.185 20.925 -14.526 1.00 0.71 O ATOM 471 CB VAL A 33 7.534 18.510 -12.685 1.00 0.71 C ATOM 472 CG1 VAL A 33 6.085 18.089 -12.499 1.00 0.78 C ATOM 473 CG2 VAL A 33 8.460 17.516 -12.006 1.00 0.76 C ATOM 0 H VAL A 33 9.611 19.775 -13.829 1.00 0.87 H new ATOM 0 HA VAL A 33 7.699 17.703 -14.682 1.00 0.80 H new ATOM 0 HB VAL A 33 7.675 19.485 -12.218 1.00 0.71 H new ATOM 0 HG11 VAL A 33 5.868 17.993 -11.435 1.00 0.78 H new ATOM 0 HG12 VAL A 33 5.429 18.841 -12.937 1.00 0.78 H new ATOM 0 HG13 VAL A 33 5.918 17.131 -12.991 1.00 0.78 H new ATOM 0 HG21 VAL A 33 8.195 17.433 -10.952 1.00 0.76 H new ATOM 0 HG22 VAL A 33 8.360 16.541 -12.483 1.00 0.76 H new ATOM 0 HG23 VAL A 33 9.491 17.859 -12.095 1.00 0.76 H new ATOM 483 N PHE A 34 6.025 19.311 -15.577 1.00 0.83 N ATOM 484 CA PHE A 34 5.040 20.218 -16.128 1.00 0.82 C ATOM 485 C PHE A 34 3.945 20.504 -15.102 1.00 0.75 C ATOM 486 O PHE A 34 3.175 19.621 -14.720 1.00 0.78 O ATOM 487 CB PHE A 34 4.442 19.639 -17.418 1.00 0.94 C ATOM 488 CG PHE A 34 3.076 20.175 -17.745 1.00 0.95 C ATOM 489 CD1 PHE A 34 1.959 19.364 -17.611 1.00 1.02 C ATOM 490 CD2 PHE A 34 2.900 21.489 -18.155 1.00 0.93 C ATOM 491 CE1 PHE A 34 0.697 19.853 -17.875 1.00 1.06 C ATOM 492 CE2 PHE A 34 1.639 21.979 -18.428 1.00 0.97 C ATOM 493 CZ PHE A 34 0.536 21.158 -18.284 1.00 1.04 C ATOM 0 H PHE A 34 5.905 18.338 -15.858 1.00 0.83 H new ATOM 0 HA PHE A 34 5.531 21.160 -16.372 1.00 0.82 H new ATOM 0 HB2 PHE A 34 5.115 19.854 -18.248 1.00 0.94 H new ATOM 0 HB3 PHE A 34 4.385 18.554 -17.326 1.00 0.94 H new ATOM 0 HD1 PHE A 34 2.079 18.338 -17.296 1.00 1.02 H new ATOM 0 HD2 PHE A 34 3.759 22.135 -18.262 1.00 0.93 H new ATOM 0 HE1 PHE A 34 -0.165 19.213 -17.761 1.00 1.06 H new ATOM 0 HE2 PHE A 34 1.514 23.001 -18.753 1.00 0.97 H new ATOM 0 HZ PHE A 34 -0.452 21.540 -18.492 1.00 1.04 H new ATOM 503 N PHE A 35 3.890 21.740 -14.648 1.00 0.68 N ATOM 504 CA PHE A 35 2.846 22.166 -13.742 1.00 0.65 C ATOM 505 C PHE A 35 2.072 23.335 -14.345 1.00 0.66 C ATOM 506 O PHE A 35 2.660 24.289 -14.852 1.00 0.67 O ATOM 507 CB PHE A 35 3.432 22.540 -12.377 1.00 0.62 C ATOM 508 CG PHE A 35 2.486 23.325 -11.518 1.00 0.80 C ATOM 509 CD1 PHE A 35 2.777 24.630 -11.159 1.00 1.17 C ATOM 510 CD2 PHE A 35 1.299 22.762 -11.083 1.00 1.23 C ATOM 511 CE1 PHE A 35 1.901 25.358 -10.381 1.00 1.72 C ATOM 512 CE2 PHE A 35 0.420 23.481 -10.305 1.00 1.76 C ATOM 513 CZ PHE A 35 0.721 24.779 -9.953 1.00 1.96 C ATOM 0 H PHE A 35 4.560 22.469 -14.894 1.00 0.68 H new ATOM 0 HA PHE A 35 2.154 21.337 -13.591 1.00 0.65 H new ATOM 0 HB2 PHE A 35 3.718 21.629 -11.851 1.00 0.62 H new ATOM 0 HB3 PHE A 35 4.342 23.121 -12.527 1.00 0.62 H new ATOM 0 HD1 PHE A 35 3.699 25.083 -11.492 1.00 1.17 H new ATOM 0 HD2 PHE A 35 1.059 21.745 -11.357 1.00 1.23 H new ATOM 0 HE1 PHE A 35 2.136 26.376 -10.107 1.00 1.72 H new ATOM 0 HE2 PHE A 35 -0.503 23.029 -9.972 1.00 1.76 H new ATOM 0 HZ PHE A 35 0.034 25.345 -9.342 1.00 1.96 H new ATOM 523 N HIS A 36 0.750 23.247 -14.301 1.00 0.72 N ATOM 524 CA HIS A 36 -0.099 24.290 -14.848 1.00 0.74 C ATOM 525 C HIS A 36 -0.642 25.144 -13.706 1.00 0.70 C ATOM 526 O HIS A 36 -1.273 24.621 -12.788 1.00 0.74 O ATOM 527 CB HIS A 36 -1.245 23.667 -15.650 1.00 0.84 C ATOM 528 CG HIS A 36 -1.755 24.528 -16.765 1.00 0.94 C ATOM 529 ND1 HIS A 36 -1.446 24.327 -18.094 1.00 1.06 N ATOM 530 CD2 HIS A 36 -2.571 25.607 -16.733 1.00 1.15 C ATOM 531 CE1 HIS A 36 -2.072 25.267 -18.809 1.00 1.12 C ATOM 532 NE2 HIS A 36 -2.766 26.072 -18.031 1.00 1.18 N ATOM 0 H HIS A 36 0.244 22.462 -13.891 1.00 0.72 H new ATOM 0 HA HIS A 36 0.482 24.922 -15.520 1.00 0.74 H new ATOM 0 HB2 HIS A 36 -0.908 22.717 -16.065 1.00 0.84 H new ATOM 0 HB3 HIS A 36 -2.069 23.445 -14.972 1.00 0.84 H new ATOM 0 HD2 HIS A 36 -3.003 26.039 -15.842 1.00 1.15 H new ATOM 0 HE1 HIS A 36 -2.016 25.355 -19.884 1.00 1.12 H new ATOM 0 HE2 HIS A 36 -3.330 26.871 -18.320 1.00 1.18 H new ATOM 540 N PHE A 37 -0.408 26.453 -13.776 1.00 0.68 N ATOM 541 CA PHE A 37 -0.733 27.366 -12.677 1.00 0.67 C ATOM 542 C PHE A 37 -2.227 27.415 -12.383 1.00 0.73 C ATOM 543 O PHE A 37 -2.640 27.851 -11.310 1.00 0.75 O ATOM 544 CB PHE A 37 -0.232 28.776 -12.982 1.00 0.71 C ATOM 545 CG PHE A 37 1.248 28.947 -12.781 1.00 0.68 C ATOM 546 CD1 PHE A 37 2.115 28.989 -13.862 1.00 0.73 C ATOM 547 CD2 PHE A 37 1.771 29.064 -11.503 1.00 0.69 C ATOM 548 CE1 PHE A 37 3.477 29.142 -13.670 1.00 0.74 C ATOM 549 CE2 PHE A 37 3.130 29.217 -11.305 1.00 0.72 C ATOM 550 CZ PHE A 37 3.984 29.257 -12.389 1.00 0.73 C ATOM 0 H PHE A 37 0.008 26.910 -14.588 1.00 0.68 H new ATOM 0 HA PHE A 37 -0.229 26.977 -11.792 1.00 0.67 H new ATOM 0 HB2 PHE A 37 -0.481 29.026 -14.013 1.00 0.71 H new ATOM 0 HB3 PHE A 37 -0.761 29.486 -12.346 1.00 0.71 H new ATOM 0 HD1 PHE A 37 1.723 28.901 -14.865 1.00 0.73 H new ATOM 0 HD2 PHE A 37 1.108 29.035 -10.651 1.00 0.69 H new ATOM 0 HE1 PHE A 37 4.143 29.172 -14.520 1.00 0.74 H new ATOM 0 HE2 PHE A 37 3.524 29.305 -10.303 1.00 0.72 H new ATOM 0 HZ PHE A 37 5.046 29.378 -12.237 1.00 0.73 H new ATOM 560 N SER A 38 -3.032 26.978 -13.338 1.00 0.80 N ATOM 561 CA SER A 38 -4.476 26.879 -13.140 1.00 0.90 C ATOM 562 C SER A 38 -4.799 25.938 -11.964 1.00 0.92 C ATOM 563 O SER A 38 -5.853 26.046 -11.336 1.00 1.07 O ATOM 564 CB SER A 38 -5.145 26.384 -14.431 1.00 0.98 C ATOM 565 OG SER A 38 -6.555 26.466 -14.349 1.00 1.63 O ATOM 0 H SER A 38 -2.713 26.685 -14.261 1.00 0.80 H new ATOM 0 HA SER A 38 -4.868 27.867 -12.897 1.00 0.90 H new ATOM 0 HB2 SER A 38 -4.794 26.978 -15.275 1.00 0.98 H new ATOM 0 HB3 SER A 38 -4.850 25.352 -14.622 1.00 0.98 H new ATOM 0 HG SER A 38 -6.951 26.145 -15.186 1.00 1.63 H new ATOM 571 N ASN A 39 -3.871 25.039 -11.652 1.00 0.82 N ATOM 572 CA ASN A 39 -4.060 24.084 -10.565 1.00 0.87 C ATOM 573 C ASN A 39 -3.204 24.469 -9.362 1.00 0.80 C ATOM 574 O ASN A 39 -2.911 23.640 -8.498 1.00 0.87 O ATOM 575 CB ASN A 39 -3.699 22.670 -11.032 1.00 0.92 C ATOM 576 CG ASN A 39 -4.578 22.190 -12.172 1.00 1.28 C ATOM 577 OD1 ASN A 39 -5.642 21.618 -11.953 1.00 2.07 O ATOM 578 ND2 ASN A 39 -4.134 22.414 -13.401 1.00 1.54 N ATOM 0 H ASN A 39 -2.978 24.952 -12.138 1.00 0.82 H new ATOM 0 HA ASN A 39 -5.109 24.102 -10.269 1.00 0.87 H new ATOM 0 HB2 ASN A 39 -2.656 22.651 -11.349 1.00 0.92 H new ATOM 0 HB3 ASN A 39 -3.789 21.980 -10.193 1.00 0.92 H new ATOM 0 HD21 ASN A 39 -4.682 22.108 -14.205 1.00 1.54 H new ATOM 0 HD22 ASN A 39 -3.245 22.893 -13.543 1.00 1.54 H new ATOM 585 N TYR A 40 -2.806 25.734 -9.310 1.00 0.72 N ATOM 586 CA TYR A 40 -1.987 26.233 -8.214 1.00 0.66 C ATOM 587 C TYR A 40 -2.867 26.664 -7.050 1.00 0.73 C ATOM 588 O TYR A 40 -3.938 27.239 -7.251 1.00 0.87 O ATOM 589 CB TYR A 40 -1.124 27.414 -8.682 1.00 0.65 C ATOM 590 CG TYR A 40 -0.190 27.948 -7.620 1.00 0.59 C ATOM 591 CD1 TYR A 40 0.881 27.187 -7.164 1.00 0.55 C ATOM 592 CD2 TYR A 40 -0.377 29.209 -7.070 1.00 0.75 C ATOM 593 CE1 TYR A 40 1.731 27.666 -6.191 1.00 0.64 C ATOM 594 CE2 TYR A 40 0.475 29.694 -6.094 1.00 0.81 C ATOM 595 CZ TYR A 40 1.526 28.917 -5.661 1.00 0.74 C ATOM 596 OH TYR A 40 2.375 29.389 -4.695 1.00 0.91 O ATOM 0 H TYR A 40 -3.038 26.433 -10.015 1.00 0.72 H new ATOM 0 HA TYR A 40 -1.331 25.428 -7.883 1.00 0.66 H new ATOM 0 HB2 TYR A 40 -0.536 27.102 -9.546 1.00 0.65 H new ATOM 0 HB3 TYR A 40 -1.778 28.220 -9.015 1.00 0.65 H new ATOM 0 HD1 TYR A 40 1.049 26.204 -7.579 1.00 0.55 H new ATOM 0 HD2 TYR A 40 -1.200 29.820 -7.409 1.00 0.75 H new ATOM 0 HE1 TYR A 40 2.556 27.060 -5.846 1.00 0.64 H new ATOM 0 HE2 TYR A 40 0.317 30.676 -5.674 1.00 0.81 H new ATOM 0 HH TYR A 40 3.266 29.003 -4.826 1.00 0.91 H new ATOM 606 N MET A 41 -2.419 26.381 -5.835 1.00 0.69 N ATOM 607 CA MET A 41 -3.163 26.763 -4.647 1.00 0.79 C ATOM 608 C MET A 41 -2.418 27.850 -3.879 1.00 0.77 C ATOM 609 O MET A 41 -1.592 27.565 -3.011 1.00 0.77 O ATOM 610 CB MET A 41 -3.402 25.542 -3.760 1.00 0.87 C ATOM 611 CG MET A 41 -4.250 25.827 -2.526 1.00 1.35 C ATOM 612 SD MET A 41 -4.401 24.399 -1.431 1.00 1.73 S ATOM 613 CE MET A 41 -5.194 23.216 -2.519 1.00 1.39 C ATOM 0 H MET A 41 -1.545 25.889 -5.648 1.00 0.69 H new ATOM 0 HA MET A 41 -4.130 27.163 -4.952 1.00 0.79 H new ATOM 0 HB2 MET A 41 -3.889 24.766 -4.351 1.00 0.87 H new ATOM 0 HB3 MET A 41 -2.439 25.143 -3.442 1.00 0.87 H new ATOM 0 HG2 MET A 41 -3.810 26.657 -1.973 1.00 1.35 H new ATOM 0 HG3 MET A 41 -5.244 26.144 -2.840 1.00 1.35 H new ATOM 0 HE1 MET A 41 -5.624 22.408 -1.927 1.00 1.39 H new ATOM 0 HE2 MET A 41 -5.984 23.713 -3.083 1.00 1.39 H new ATOM 0 HE3 MET A 41 -4.457 22.807 -3.210 1.00 1.39 H new ATOM 623 N GLY A 42 -2.699 29.097 -4.226 1.00 0.87 N ATOM 624 CA GLY A 42 -2.058 30.218 -3.570 1.00 0.91 C ATOM 625 C GLY A 42 -2.032 31.449 -4.450 1.00 0.92 C ATOM 626 O GLY A 42 -2.689 31.485 -5.489 1.00 1.05 O ATOM 0 H GLY A 42 -3.364 29.354 -4.955 1.00 0.87 H new ATOM 0 HA2 GLY A 42 -2.585 30.446 -2.643 1.00 0.91 H new ATOM 0 HA3 GLY A 42 -1.038 29.945 -3.298 1.00 0.91 H new ATOM 630 N ASN A 43 -1.274 32.452 -4.035 1.00 0.89 N ATOM 631 CA ASN A 43 -1.165 33.704 -4.776 1.00 0.91 C ATOM 632 C ASN A 43 0.103 33.718 -5.637 1.00 0.83 C ATOM 633 O ASN A 43 1.210 33.931 -5.143 1.00 0.83 O ATOM 634 CB ASN A 43 -1.197 34.895 -3.801 1.00 1.02 C ATOM 635 CG ASN A 43 -0.212 34.754 -2.647 1.00 1.48 C ATOM 636 OD1 ASN A 43 0.923 35.430 -2.746 1.00 2.14 O flip ATOM 637 ND2 ASN A 43 -0.486 34.074 -1.657 1.00 2.03 N flip ATOM 0 H ASN A 43 -0.719 32.424 -3.180 1.00 0.89 H new ATOM 0 HA ASN A 43 -2.017 33.792 -5.450 1.00 0.91 H new ATOM 0 HB2 ASN A 43 -0.975 35.811 -4.349 1.00 1.02 H new ATOM 0 HB3 ASN A 43 -2.205 35.000 -3.399 1.00 1.02 H new ATOM 0 HD21 ASN A 43 -1.370 33.567 -1.616 1.00 2.03 H new ATOM 0 HD22 ASN A 43 0.171 34.018 -0.879 1.00 2.03 H new ATOM 644 N PRO A 44 -0.047 33.493 -6.954 1.00 0.84 N ATOM 645 CA PRO A 44 1.091 33.343 -7.870 1.00 0.82 C ATOM 646 C PRO A 44 1.741 34.668 -8.255 1.00 0.88 C ATOM 647 O PRO A 44 2.878 34.694 -8.723 1.00 0.91 O ATOM 648 CB PRO A 44 0.460 32.686 -9.091 1.00 0.92 C ATOM 649 CG PRO A 44 -0.949 33.174 -9.099 1.00 1.01 C ATOM 650 CD PRO A 44 -1.342 33.360 -7.658 1.00 0.93 C ATOM 0 HA PRO A 44 1.899 32.771 -7.414 1.00 0.82 H new ATOM 0 HB2 PRO A 44 0.982 32.967 -10.006 1.00 0.92 H new ATOM 0 HB3 PRO A 44 0.502 31.599 -9.022 1.00 0.92 H new ATOM 0 HG2 PRO A 44 -1.032 34.112 -9.648 1.00 1.01 H new ATOM 0 HG3 PRO A 44 -1.606 32.457 -9.591 1.00 1.01 H new ATOM 0 HD2 PRO A 44 -1.963 34.246 -7.524 1.00 0.93 H new ATOM 0 HD3 PRO A 44 -1.914 32.510 -7.286 1.00 0.93 H new ATOM 658 N ASN A 45 1.024 35.762 -8.048 1.00 0.94 N ATOM 659 CA ASN A 45 1.527 37.090 -8.406 1.00 1.05 C ATOM 660 C ASN A 45 2.753 37.429 -7.568 1.00 1.04 C ATOM 661 O ASN A 45 3.622 38.189 -7.984 1.00 1.15 O ATOM 662 CB ASN A 45 0.427 38.140 -8.193 1.00 1.15 C ATOM 663 CG ASN A 45 0.714 39.493 -8.842 1.00 1.43 C ATOM 664 OD1 ASN A 45 1.855 39.934 -8.948 1.00 2.08 O ATOM 665 ND2 ASN A 45 -0.341 40.168 -9.279 1.00 1.88 N ATOM 0 H ASN A 45 0.092 35.762 -7.634 1.00 0.94 H new ATOM 0 HA ASN A 45 1.814 37.090 -9.457 1.00 1.05 H new ATOM 0 HB2 ASN A 45 -0.511 37.752 -8.590 1.00 1.15 H new ATOM 0 HB3 ASN A 45 0.284 38.287 -7.122 1.00 1.15 H new ATOM 0 HD21 ASN A 45 -0.217 41.080 -9.718 1.00 1.88 H new ATOM 0 HD22 ASN A 45 -1.276 39.775 -9.176 1.00 1.88 H new ATOM 672 N TRP A 46 2.836 36.821 -6.396 1.00 0.98 N ATOM 673 CA TRP A 46 3.916 37.117 -5.472 1.00 1.04 C ATOM 674 C TRP A 46 4.929 35.982 -5.419 1.00 0.96 C ATOM 675 O TRP A 46 5.672 35.837 -4.448 1.00 1.02 O ATOM 676 CB TRP A 46 3.354 37.419 -4.087 1.00 1.10 C ATOM 677 CG TRP A 46 2.691 38.756 -4.034 1.00 1.28 C ATOM 678 CD1 TRP A 46 1.391 39.044 -4.332 1.00 1.30 C ATOM 679 CD2 TRP A 46 3.310 39.996 -3.689 1.00 1.56 C ATOM 680 NE1 TRP A 46 1.161 40.390 -4.186 1.00 1.52 N ATOM 681 CE2 TRP A 46 2.324 40.997 -3.789 1.00 1.67 C ATOM 682 CE3 TRP A 46 4.598 40.355 -3.294 1.00 1.80 C ATOM 683 CZ2 TRP A 46 2.596 42.335 -3.513 1.00 1.97 C ATOM 684 CZ3 TRP A 46 4.869 41.682 -3.026 1.00 2.13 C ATOM 685 CH2 TRP A 46 3.870 42.658 -3.132 1.00 2.18 C ATOM 0 H TRP A 46 2.171 36.123 -6.064 1.00 0.98 H new ATOM 0 HA TRP A 46 4.442 38.001 -5.833 1.00 1.04 H new ATOM 0 HB2 TRP A 46 2.636 36.647 -3.810 1.00 1.10 H new ATOM 0 HB3 TRP A 46 4.159 37.384 -3.353 1.00 1.10 H new ATOM 0 HD1 TRP A 46 0.651 38.319 -4.638 1.00 1.30 H new ATOM 0 HE1 TRP A 46 0.271 40.861 -4.347 1.00 1.52 H new ATOM 0 HE3 TRP A 46 5.371 39.607 -3.199 1.00 1.80 H new ATOM 0 HZ2 TRP A 46 1.829 43.090 -3.597 1.00 1.97 H new ATOM 0 HZ3 TRP A 46 5.866 41.972 -2.730 1.00 2.13 H new ATOM 0 HH2 TRP A 46 4.110 43.687 -2.908 1.00 2.18 H new ATOM 696 N LEU A 47 4.969 35.198 -6.484 1.00 0.85 N ATOM 697 CA LEU A 47 5.977 34.162 -6.634 1.00 0.78 C ATOM 698 C LEU A 47 7.197 34.732 -7.335 1.00 0.82 C ATOM 699 O LEU A 47 7.088 35.680 -8.113 1.00 0.92 O ATOM 700 CB LEU A 47 5.433 32.973 -7.432 1.00 0.68 C ATOM 701 CG LEU A 47 4.603 31.971 -6.637 1.00 0.62 C ATOM 702 CD1 LEU A 47 3.970 30.952 -7.567 1.00 0.57 C ATOM 703 CD2 LEU A 47 5.475 31.272 -5.604 1.00 0.66 C ATOM 0 H LEU A 47 4.311 35.260 -7.261 1.00 0.85 H new ATOM 0 HA LEU A 47 6.254 33.809 -5.640 1.00 0.78 H new ATOM 0 HB2 LEU A 47 4.822 33.356 -8.250 1.00 0.68 H new ATOM 0 HB3 LEU A 47 6.274 32.445 -7.882 1.00 0.68 H new ATOM 0 HG LEU A 47 3.808 32.509 -6.120 1.00 0.62 H new ATOM 0 HD11 LEU A 47 3.381 30.244 -6.984 1.00 0.57 H new ATOM 0 HD12 LEU A 47 3.322 31.463 -8.280 1.00 0.57 H new ATOM 0 HD13 LEU A 47 4.752 30.417 -8.106 1.00 0.57 H new ATOM 0 HD21 LEU A 47 4.872 30.559 -5.042 1.00 0.66 H new ATOM 0 HD22 LEU A 47 6.285 30.745 -6.108 1.00 0.66 H new ATOM 0 HD23 LEU A 47 5.893 32.011 -4.921 1.00 0.66 H new ATOM 715 N GLU A 48 8.354 34.159 -7.055 1.00 0.81 N ATOM 716 CA GLU A 48 9.583 34.558 -7.715 1.00 0.89 C ATOM 717 C GLU A 48 10.428 33.328 -7.996 1.00 0.71 C ATOM 718 O GLU A 48 10.252 32.290 -7.357 1.00 0.62 O ATOM 719 CB GLU A 48 10.371 35.573 -6.876 1.00 1.15 C ATOM 720 CG GLU A 48 10.640 35.125 -5.449 1.00 1.48 C ATOM 721 CD GLU A 48 11.664 36.004 -4.748 1.00 1.86 C ATOM 722 OE1 GLU A 48 12.875 35.691 -4.821 1.00 2.35 O ATOM 723 OE2 GLU A 48 11.268 37.015 -4.125 1.00 2.13 O ATOM 0 H GLU A 48 8.468 33.411 -6.371 1.00 0.81 H new ATOM 0 HA GLU A 48 9.326 35.046 -8.655 1.00 0.89 H new ATOM 0 HB2 GLU A 48 11.323 35.773 -7.368 1.00 1.15 H new ATOM 0 HB3 GLU A 48 9.820 36.513 -6.852 1.00 1.15 H new ATOM 0 HG2 GLU A 48 9.707 35.138 -4.885 1.00 1.48 H new ATOM 0 HG3 GLU A 48 10.994 34.094 -5.455 1.00 1.48 H new ATOM 730 N LEU A 49 11.325 33.439 -8.959 1.00 0.75 N ATOM 731 CA LEU A 49 12.159 32.320 -9.356 1.00 0.67 C ATOM 732 C LEU A 49 13.146 31.983 -8.244 1.00 0.67 C ATOM 733 O LEU A 49 13.983 32.806 -7.874 1.00 0.73 O ATOM 734 CB LEU A 49 12.910 32.641 -10.658 1.00 0.76 C ATOM 735 CG LEU A 49 12.049 33.077 -11.858 1.00 0.85 C ATOM 736 CD1 LEU A 49 10.795 32.220 -11.986 1.00 1.40 C ATOM 737 CD2 LEU A 49 11.695 34.558 -11.780 1.00 1.11 C ATOM 0 H LEU A 49 11.495 34.298 -9.483 1.00 0.75 H new ATOM 0 HA LEU A 49 11.520 31.455 -9.534 1.00 0.67 H new ATOM 0 HB2 LEU A 49 13.631 33.432 -10.450 1.00 0.76 H new ATOM 0 HB3 LEU A 49 13.480 31.759 -10.950 1.00 0.76 H new ATOM 0 HG LEU A 49 12.646 32.925 -12.757 1.00 0.85 H new ATOM 0 HD11 LEU A 49 10.211 32.555 -12.843 1.00 1.40 H new ATOM 0 HD12 LEU A 49 11.080 31.177 -12.127 1.00 1.40 H new ATOM 0 HD13 LEU A 49 10.196 32.314 -11.080 1.00 1.40 H new ATOM 0 HD21 LEU A 49 11.087 34.833 -12.642 1.00 1.11 H new ATOM 0 HD22 LEU A 49 11.135 34.751 -10.865 1.00 1.11 H new ATOM 0 HD23 LEU A 49 12.610 35.151 -11.777 1.00 1.11 H new ATOM 749 N GLY A 50 13.037 30.770 -7.716 1.00 0.66 N ATOM 750 CA GLY A 50 13.875 30.354 -6.609 1.00 0.72 C ATOM 751 C GLY A 50 13.068 30.029 -5.367 1.00 0.69 C ATOM 752 O GLY A 50 13.614 29.565 -4.366 1.00 0.75 O ATOM 0 H GLY A 50 12.377 30.062 -8.039 1.00 0.66 H new ATOM 0 HA2 GLY A 50 14.454 29.478 -6.903 1.00 0.72 H new ATOM 0 HA3 GLY A 50 14.589 31.145 -6.379 1.00 0.72 H new ATOM 756 N GLN A 51 11.764 30.275 -5.433 1.00 0.62 N ATOM 757 CA GLN A 51 10.872 30.016 -4.305 1.00 0.60 C ATOM 758 C GLN A 51 10.582 28.524 -4.170 1.00 0.56 C ATOM 759 O GLN A 51 10.114 27.886 -5.116 1.00 0.53 O ATOM 760 CB GLN A 51 9.563 30.800 -4.479 1.00 0.59 C ATOM 761 CG GLN A 51 8.501 30.529 -3.417 1.00 0.60 C ATOM 762 CD GLN A 51 8.971 30.827 -2.001 1.00 0.70 C ATOM 763 OE1 GLN A 51 9.395 29.797 -1.281 1.00 1.06 O flip ATOM 764 NE2 GLN A 51 8.912 31.964 -1.542 1.00 0.87 N flip ATOM 0 H GLN A 51 11.299 30.655 -6.258 1.00 0.62 H new ATOM 0 HA GLN A 51 11.367 30.348 -3.392 1.00 0.60 H new ATOM 0 HB2 GLN A 51 9.793 31.866 -4.478 1.00 0.59 H new ATOM 0 HB3 GLN A 51 9.144 30.566 -5.458 1.00 0.59 H new ATOM 0 HG2 GLN A 51 7.619 31.132 -3.634 1.00 0.60 H new ATOM 0 HG3 GLN A 51 8.195 29.485 -3.478 1.00 0.60 H new ATOM 0 HE21 GLN A 51 8.581 32.733 -2.125 1.00 0.87 H new ATOM 0 HE22 GLN A 51 9.194 32.140 -0.578 1.00 0.87 H new ATOM 773 N GLU A 52 10.890 27.980 -2.994 1.00 0.57 N ATOM 774 CA GLU A 52 10.584 26.588 -2.671 1.00 0.55 C ATOM 775 C GLU A 52 9.073 26.359 -2.650 1.00 0.50 C ATOM 776 O GLU A 52 8.319 27.182 -2.121 1.00 0.55 O ATOM 777 CB GLU A 52 11.141 26.218 -1.295 1.00 0.63 C ATOM 778 CG GLU A 52 12.609 26.538 -1.083 1.00 1.15 C ATOM 779 CD GLU A 52 12.977 26.506 0.389 1.00 1.94 C ATOM 780 OE1 GLU A 52 13.406 25.432 0.875 1.00 2.44 O ATOM 781 OE2 GLU A 52 12.862 27.552 1.065 1.00 2.51 O ATOM 0 H GLU A 52 11.356 28.488 -2.242 1.00 0.57 H new ATOM 0 HA GLU A 52 11.044 25.966 -3.439 1.00 0.55 H new ATOM 0 HB2 GLU A 52 10.559 26.738 -0.534 1.00 0.63 H new ATOM 0 HB3 GLU A 52 10.992 25.150 -1.136 1.00 0.63 H new ATOM 0 HG2 GLU A 52 13.222 25.820 -1.628 1.00 1.15 H new ATOM 0 HG3 GLU A 52 12.831 27.523 -1.494 1.00 1.15 H new ATOM 788 N VAL A 53 8.647 25.246 -3.222 1.00 0.43 N ATOM 789 CA VAL A 53 7.251 24.829 -3.183 1.00 0.40 C ATOM 790 C VAL A 53 7.176 23.306 -3.047 1.00 0.41 C ATOM 791 O VAL A 53 8.061 22.590 -3.524 1.00 0.44 O ATOM 792 CB VAL A 53 6.467 25.282 -4.448 1.00 0.37 C ATOM 793 CG1 VAL A 53 6.326 26.802 -4.511 1.00 0.41 C ATOM 794 CG2 VAL A 53 7.138 24.771 -5.716 1.00 0.37 C ATOM 0 H VAL A 53 9.257 24.604 -3.727 1.00 0.43 H new ATOM 0 HA VAL A 53 6.786 25.308 -2.321 1.00 0.40 H new ATOM 0 HB VAL A 53 5.468 24.851 -4.377 1.00 0.37 H new ATOM 0 HG11 VAL A 53 5.773 27.079 -5.408 1.00 0.41 H new ATOM 0 HG12 VAL A 53 5.789 27.154 -3.630 1.00 0.41 H new ATOM 0 HG13 VAL A 53 7.315 27.258 -4.539 1.00 0.41 H new ATOM 0 HG21 VAL A 53 6.571 25.101 -6.586 1.00 0.37 H new ATOM 0 HG22 VAL A 53 8.153 25.164 -5.774 1.00 0.37 H new ATOM 0 HG23 VAL A 53 7.171 23.682 -5.696 1.00 0.37 H new ATOM 804 N GLU A 54 6.144 22.811 -2.379 1.00 0.47 N ATOM 805 CA GLU A 54 5.944 21.374 -2.252 1.00 0.54 C ATOM 806 C GLU A 54 4.674 20.986 -2.990 1.00 0.52 C ATOM 807 O GLU A 54 3.712 21.759 -3.024 1.00 0.54 O ATOM 808 CB GLU A 54 5.870 20.937 -0.780 1.00 0.72 C ATOM 809 CG GLU A 54 4.606 21.376 -0.052 1.00 0.81 C ATOM 810 CD GLU A 54 4.528 20.839 1.367 1.00 1.05 C ATOM 811 OE1 GLU A 54 4.404 21.648 2.308 1.00 1.49 O ATOM 812 OE2 GLU A 54 4.608 19.606 1.547 1.00 1.30 O ATOM 0 H GLU A 54 5.434 23.380 -1.918 1.00 0.47 H new ATOM 0 HA GLU A 54 6.799 20.862 -2.693 1.00 0.54 H new ATOM 0 HB2 GLU A 54 5.942 19.850 -0.733 1.00 0.72 H new ATOM 0 HB3 GLU A 54 6.735 21.337 -0.252 1.00 0.72 H new ATOM 0 HG2 GLU A 54 4.567 22.465 -0.026 1.00 0.81 H new ATOM 0 HG3 GLU A 54 3.734 21.039 -0.612 1.00 0.81 H new ATOM 819 N TYR A 55 4.670 19.816 -3.605 1.00 0.54 N ATOM 820 CA TYR A 55 3.542 19.416 -4.423 1.00 0.58 C ATOM 821 C TYR A 55 3.533 17.918 -4.685 1.00 0.64 C ATOM 822 O TYR A 55 4.540 17.233 -4.493 1.00 0.66 O ATOM 823 CB TYR A 55 3.557 20.191 -5.744 1.00 0.55 C ATOM 824 CG TYR A 55 4.758 19.938 -6.636 1.00 0.52 C ATOM 825 CD1 TYR A 55 6.059 20.175 -6.202 1.00 0.54 C ATOM 826 CD2 TYR A 55 4.577 19.486 -7.928 1.00 0.63 C ATOM 827 CE1 TYR A 55 7.141 19.960 -7.036 1.00 0.56 C ATOM 828 CE2 TYR A 55 5.649 19.266 -8.770 1.00 0.65 C ATOM 829 CZ TYR A 55 6.930 19.505 -8.321 1.00 0.57 C ATOM 830 OH TYR A 55 8.002 19.289 -9.158 1.00 0.63 O ATOM 0 H TYR A 55 5.427 19.134 -3.554 1.00 0.54 H new ATOM 0 HA TYR A 55 2.630 19.653 -3.874 1.00 0.58 H new ATOM 0 HB2 TYR A 55 2.654 19.942 -6.301 1.00 0.55 H new ATOM 0 HB3 TYR A 55 3.510 21.257 -5.520 1.00 0.55 H new ATOM 0 HD1 TYR A 55 6.226 20.533 -5.197 1.00 0.54 H new ATOM 0 HD2 TYR A 55 3.576 19.301 -8.288 1.00 0.63 H new ATOM 0 HE1 TYR A 55 8.145 20.147 -6.684 1.00 0.56 H new ATOM 0 HE2 TYR A 55 5.484 18.908 -9.776 1.00 0.65 H new ATOM 0 HH TYR A 55 8.414 18.426 -8.945 1.00 0.63 H new ATOM 840 N THR A 56 2.389 17.419 -5.129 1.00 0.72 N ATOM 841 CA THR A 56 2.225 16.006 -5.416 1.00 0.82 C ATOM 842 C THR A 56 1.832 15.819 -6.881 1.00 0.85 C ATOM 843 O THR A 56 1.240 16.711 -7.488 1.00 0.85 O ATOM 844 CB THR A 56 1.150 15.371 -4.502 1.00 0.88 C ATOM 845 OG1 THR A 56 -0.137 15.933 -4.786 1.00 0.84 O ATOM 846 CG2 THR A 56 1.471 15.602 -3.035 1.00 0.94 C ATOM 0 H THR A 56 1.554 17.980 -5.299 1.00 0.72 H new ATOM 0 HA THR A 56 3.175 15.507 -5.223 1.00 0.82 H new ATOM 0 HB THR A 56 1.141 14.299 -4.700 1.00 0.88 H new ATOM 0 HG1 THR A 56 -0.809 15.523 -4.203 1.00 0.84 H new ATOM 0 HG21 THR A 56 0.698 15.145 -2.417 1.00 0.94 H new ATOM 0 HG22 THR A 56 2.436 15.155 -2.799 1.00 0.94 H new ATOM 0 HG23 THR A 56 1.509 16.673 -2.835 1.00 0.94 H new ATOM 854 N LEU A 57 2.156 14.669 -7.447 1.00 0.96 N ATOM 855 CA LEU A 57 1.836 14.401 -8.843 1.00 1.03 C ATOM 856 C LEU A 57 0.459 13.762 -8.970 1.00 1.12 C ATOM 857 O LEU A 57 -0.050 13.168 -8.018 1.00 1.19 O ATOM 858 CB LEU A 57 2.896 13.495 -9.477 1.00 1.09 C ATOM 859 CG LEU A 57 4.274 14.132 -9.677 1.00 1.04 C ATOM 860 CD1 LEU A 57 5.262 13.103 -10.219 1.00 1.13 C ATOM 861 CD2 LEU A 57 4.177 15.329 -10.614 1.00 1.03 C ATOM 0 H LEU A 57 2.637 13.909 -6.967 1.00 0.96 H new ATOM 0 HA LEU A 57 1.827 15.353 -9.374 1.00 1.03 H new ATOM 0 HB2 LEU A 57 3.012 12.609 -8.853 1.00 1.09 H new ATOM 0 HB3 LEU A 57 2.527 13.157 -10.445 1.00 1.09 H new ATOM 0 HG LEU A 57 4.638 14.482 -8.711 1.00 1.04 H new ATOM 0 HD11 LEU A 57 6.237 13.571 -10.356 1.00 1.13 H new ATOM 0 HD12 LEU A 57 5.352 12.278 -9.513 1.00 1.13 H new ATOM 0 HD13 LEU A 57 4.904 12.724 -11.176 1.00 1.13 H new ATOM 0 HD21 LEU A 57 5.165 15.770 -10.745 1.00 1.03 H new ATOM 0 HD22 LEU A 57 3.794 15.004 -11.581 1.00 1.03 H new ATOM 0 HD23 LEU A 57 3.502 16.071 -10.187 1.00 1.03 H new ATOM 873 N ALA A 58 -0.139 13.904 -10.139 1.00 1.17 N ATOM 874 CA ALA A 58 -1.405 13.294 -10.432 1.00 1.30 C ATOM 875 C ALA A 58 -1.299 12.554 -11.750 1.00 1.40 C ATOM 876 O ALA A 58 -0.218 12.473 -12.333 1.00 2.04 O ATOM 877 CB ALA A 58 -2.499 14.344 -10.497 1.00 1.33 C ATOM 0 H ALA A 58 0.249 14.449 -10.909 1.00 1.17 H new ATOM 0 HA ALA A 58 -1.663 12.591 -9.640 1.00 1.30 H new ATOM 0 HB1 ALA A 58 -3.452 13.864 -10.720 1.00 1.33 H new ATOM 0 HB2 ALA A 58 -2.567 14.858 -9.538 1.00 1.33 H new ATOM 0 HB3 ALA A 58 -2.265 15.066 -11.280 1.00 1.33 H new ATOM 1026 N LEU A 70 2.847 14.396 -17.003 1.00 1.49 N ATOM 1027 CA LEU A 70 1.697 14.533 -16.125 1.00 1.50 C ATOM 1028 C LEU A 70 1.679 15.903 -15.463 1.00 1.25 C ATOM 1029 O LEU A 70 2.724 16.413 -15.056 1.00 1.15 O ATOM 1030 CB LEU A 70 1.731 13.450 -15.046 1.00 1.71 C ATOM 1031 CG LEU A 70 1.985 12.026 -15.547 1.00 1.88 C ATOM 1032 CD1 LEU A 70 2.028 11.055 -14.381 1.00 2.30 C ATOM 1033 CD2 LEU A 70 0.928 11.597 -16.540 1.00 2.29 C ATOM 0 HA LEU A 70 0.796 14.423 -16.728 1.00 1.50 H new ATOM 0 HB2 LEU A 70 2.506 13.706 -14.324 1.00 1.71 H new ATOM 0 HB3 LEU A 70 0.781 13.464 -14.512 1.00 1.71 H new ATOM 0 HG LEU A 70 2.950 12.018 -16.053 1.00 1.88 H new ATOM 0 HD11 LEU A 70 2.209 10.047 -14.754 1.00 2.30 H new ATOM 0 HD12 LEU A 70 2.830 11.340 -13.700 1.00 2.30 H new ATOM 0 HD13 LEU A 70 1.076 11.080 -13.851 1.00 2.30 H new ATOM 0 HD21 LEU A 70 1.136 10.582 -16.877 1.00 2.29 H new ATOM 0 HD22 LEU A 70 -0.052 11.628 -16.064 1.00 2.29 H new ATOM 0 HD23 LEU A 70 0.937 12.272 -17.396 1.00 2.29 H new ATOM 1045 N PRO A 71 0.493 16.526 -15.369 1.00 1.22 N ATOM 1046 CA PRO A 71 0.318 17.776 -14.632 1.00 1.05 C ATOM 1047 C PRO A 71 0.445 17.549 -13.124 1.00 0.97 C ATOM 1048 O PRO A 71 0.183 16.450 -12.623 1.00 1.14 O ATOM 1049 CB PRO A 71 -1.104 18.211 -14.992 1.00 1.18 C ATOM 1050 CG PRO A 71 -1.804 16.946 -15.341 1.00 1.38 C ATOM 1051 CD PRO A 71 -0.764 16.061 -15.973 1.00 1.43 C ATOM 0 HA PRO A 71 1.071 18.522 -14.887 1.00 1.05 H new ATOM 0 HB2 PRO A 71 -1.589 18.715 -14.156 1.00 1.18 H new ATOM 0 HB3 PRO A 71 -1.105 18.909 -15.829 1.00 1.18 H new ATOM 0 HG2 PRO A 71 -2.229 16.477 -14.454 1.00 1.38 H new ATOM 0 HG3 PRO A 71 -2.629 17.133 -16.029 1.00 1.38 H new ATOM 0 HD2 PRO A 71 -0.948 15.008 -15.758 1.00 1.43 H new ATOM 0 HD3 PRO A 71 -0.752 16.167 -17.058 1.00 1.43 H new ATOM 1059 N ALA A 72 0.849 18.579 -12.407 1.00 0.80 N ATOM 1060 CA ALA A 72 1.056 18.465 -10.975 1.00 0.74 C ATOM 1061 C ALA A 72 -0.055 19.163 -10.199 1.00 0.72 C ATOM 1062 O ALA A 72 -0.598 20.171 -10.655 1.00 0.82 O ATOM 1063 CB ALA A 72 2.411 19.041 -10.611 1.00 0.70 C ATOM 0 H ALA A 72 1.041 19.504 -12.791 1.00 0.80 H new ATOM 0 HA ALA A 72 1.031 17.410 -10.701 1.00 0.74 H new ATOM 0 HB1 ALA A 72 2.566 18.955 -9.535 1.00 0.70 H new ATOM 0 HB2 ALA A 72 3.193 18.491 -11.135 1.00 0.70 H new ATOM 0 HB3 ALA A 72 2.450 20.091 -10.900 1.00 0.70 H new ATOM 1069 N GLU A 73 -0.386 18.629 -9.028 1.00 0.74 N ATOM 1070 CA GLU A 73 -1.456 19.188 -8.210 1.00 0.77 C ATOM 1071 C GLU A 73 -0.959 19.468 -6.795 1.00 0.69 C ATOM 1072 O GLU A 73 0.174 19.120 -6.445 1.00 0.71 O ATOM 1073 CB GLU A 73 -2.649 18.229 -8.126 1.00 0.94 C ATOM 1074 CG GLU A 73 -3.138 17.688 -9.462 1.00 1.28 C ATOM 1075 CD GLU A 73 -4.533 17.099 -9.357 1.00 1.84 C ATOM 1076 OE1 GLU A 73 -4.865 16.527 -8.302 1.00 2.30 O ATOM 1077 OE2 GLU A 73 -5.295 17.184 -10.344 1.00 2.28 O ATOM 0 H GLU A 73 0.071 17.811 -8.625 1.00 0.74 H new ATOM 0 HA GLU A 73 -1.773 20.117 -8.684 1.00 0.77 H new ATOM 0 HB2 GLU A 73 -2.375 17.388 -7.489 1.00 0.94 H new ATOM 0 HB3 GLU A 73 -3.475 18.744 -7.636 1.00 0.94 H new ATOM 0 HG2 GLU A 73 -3.137 18.490 -10.201 1.00 1.28 H new ATOM 0 HG3 GLU A 73 -2.447 16.924 -9.819 1.00 1.28 H new ATOM 1084 N ASN A 74 -1.819 20.093 -5.989 1.00 0.68 N ATOM 1085 CA ASN A 74 -1.561 20.292 -4.557 1.00 0.69 C ATOM 1086 C ASN A 74 -0.282 21.079 -4.306 1.00 0.59 C ATOM 1087 O ASN A 74 0.399 20.865 -3.306 1.00 0.66 O ATOM 1088 CB ASN A 74 -1.492 18.938 -3.836 1.00 0.81 C ATOM 1089 CG ASN A 74 -2.846 18.258 -3.734 1.00 1.39 C ATOM 1090 OD1 ASN A 74 -3.588 18.477 -2.779 1.00 1.81 O ATOM 1091 ND2 ASN A 74 -3.166 17.414 -4.704 1.00 2.01 N ATOM 0 H ASN A 74 -2.710 20.475 -6.306 1.00 0.68 H new ATOM 0 HA ASN A 74 -2.390 20.877 -4.159 1.00 0.69 H new ATOM 0 HB2 ASN A 74 -0.800 18.283 -4.367 1.00 0.81 H new ATOM 0 HB3 ASN A 74 -1.087 19.085 -2.835 1.00 0.81 H new ATOM 0 HD21 ASN A 74 -4.057 16.918 -4.675 1.00 2.01 H new ATOM 0 HD22 ASN A 74 -2.522 17.260 -5.480 1.00 2.01 H new ATOM 1098 N VAL A 75 0.016 22.016 -5.193 1.00 0.66 N ATOM 1099 CA VAL A 75 1.227 22.814 -5.072 1.00 0.58 C ATOM 1100 C VAL A 75 1.055 23.908 -4.024 1.00 0.59 C ATOM 1101 O VAL A 75 0.170 24.760 -4.135 1.00 0.64 O ATOM 1102 CB VAL A 75 1.616 23.449 -6.423 1.00 0.56 C ATOM 1103 CG1 VAL A 75 2.945 24.186 -6.312 1.00 0.72 C ATOM 1104 CG2 VAL A 75 1.682 22.385 -7.506 1.00 0.80 C ATOM 0 H VAL A 75 -0.562 22.242 -6.002 1.00 0.66 H new ATOM 0 HA VAL A 75 2.027 22.143 -4.758 1.00 0.58 H new ATOM 0 HB VAL A 75 0.850 24.175 -6.696 1.00 0.56 H new ATOM 0 HG11 VAL A 75 3.199 24.626 -7.277 1.00 0.72 H new ATOM 0 HG12 VAL A 75 2.862 24.975 -5.564 1.00 0.72 H new ATOM 0 HG13 VAL A 75 3.726 23.486 -6.016 1.00 0.72 H new ATOM 0 HG21 VAL A 75 1.958 22.847 -8.454 1.00 0.80 H new ATOM 0 HG22 VAL A 75 2.428 21.637 -7.237 1.00 0.80 H new ATOM 0 HG23 VAL A 75 0.708 21.906 -7.605 1.00 0.80 H new ATOM 1114 N ARG A 76 1.897 23.860 -2.999 1.00 0.58 N ATOM 1115 CA ARG A 76 1.876 24.842 -1.924 1.00 0.62 C ATOM 1116 C ARG A 76 3.248 25.489 -1.770 1.00 0.55 C ATOM 1117 O ARG A 76 4.268 24.855 -2.031 1.00 0.52 O ATOM 1118 CB ARG A 76 1.476 24.177 -0.602 1.00 0.73 C ATOM 1119 CG ARG A 76 0.056 23.629 -0.580 1.00 1.28 C ATOM 1120 CD ARG A 76 -0.973 24.726 -0.790 1.00 1.58 C ATOM 1121 NE ARG A 76 -0.753 25.869 0.096 1.00 2.10 N ATOM 1122 CZ ARG A 76 -1.653 26.344 0.953 1.00 2.75 C ATOM 1123 NH1 ARG A 76 -2.835 25.752 1.097 1.00 3.11 N ATOM 1124 NH2 ARG A 76 -1.365 27.417 1.673 1.00 3.51 N ATOM 0 H ARG A 76 2.612 23.141 -2.890 1.00 0.58 H new ATOM 0 HA ARG A 76 1.144 25.609 -2.176 1.00 0.62 H new ATOM 0 HB2 ARG A 76 2.170 23.363 -0.394 1.00 0.73 H new ATOM 0 HB3 ARG A 76 1.585 24.903 0.204 1.00 0.73 H new ATOM 0 HG2 ARG A 76 -0.054 22.873 -1.357 1.00 1.28 H new ATOM 0 HG3 ARG A 76 -0.129 23.135 0.374 1.00 1.28 H new ATOM 0 HD2 ARG A 76 -0.938 25.061 -1.827 1.00 1.58 H new ATOM 0 HD3 ARG A 76 -1.971 24.323 -0.619 1.00 1.58 H new ATOM 0 HE ARG A 76 0.154 26.334 0.054 1.00 2.10 H new ATOM 0 HH11 ARG A 76 -3.061 24.923 0.547 1.00 3.11 H new ATOM 0 HH12 ARG A 76 -3.516 26.127 1.758 1.00 3.11 H new ATOM 0 HH21 ARG A 76 -0.459 27.873 1.568 1.00 3.51 H new ATOM 0 HH22 ARG A 76 -2.049 27.788 2.332 1.00 3.51 H new ATOM 1138 N MET A 77 3.272 26.750 -1.352 1.00 0.63 N ATOM 1139 CA MET A 77 4.533 27.436 -1.084 1.00 0.60 C ATOM 1140 C MET A 77 5.194 26.844 0.138 1.00 0.70 C ATOM 1141 O MET A 77 4.521 26.524 1.119 1.00 0.91 O ATOM 1142 CB MET A 77 4.328 28.934 -0.857 1.00 0.72 C ATOM 1143 CG MET A 77 3.890 29.696 -2.088 1.00 0.80 C ATOM 1144 SD MET A 77 3.747 31.467 -1.760 1.00 1.12 S ATOM 1145 CE MET A 77 2.989 32.053 -3.268 1.00 0.86 C ATOM 0 H MET A 77 2.439 27.316 -1.192 1.00 0.63 H new ATOM 0 HA MET A 77 5.167 27.302 -1.961 1.00 0.60 H new ATOM 0 HB2 MET A 77 3.582 29.072 -0.074 1.00 0.72 H new ATOM 0 HB3 MET A 77 5.259 29.365 -0.490 1.00 0.72 H new ATOM 0 HG2 MET A 77 4.607 29.531 -2.892 1.00 0.80 H new ATOM 0 HG3 MET A 77 2.930 29.311 -2.432 1.00 0.80 H new ATOM 0 HE1 MET A 77 3.205 33.114 -3.395 1.00 0.86 H new ATOM 0 HE2 MET A 77 3.389 31.497 -4.116 1.00 0.86 H new ATOM 0 HE3 MET A 77 1.910 31.906 -3.214 1.00 0.86 H new ATOM 1155 N LEU A 78 6.506 26.714 0.090 1.00 0.65 N ATOM 1156 CA LEU A 78 7.230 26.104 1.180 1.00 0.83 C ATOM 1157 C LEU A 78 8.415 26.959 1.611 1.00 0.83 C ATOM 1158 O LEU A 78 9.538 26.732 1.179 1.00 0.93 O ATOM 1159 CB LEU A 78 7.718 24.716 0.775 1.00 0.99 C ATOM 1160 CG LEU A 78 8.302 23.890 1.913 1.00 1.05 C ATOM 1161 CD1 LEU A 78 7.225 23.591 2.943 1.00 1.49 C ATOM 1162 CD2 LEU A 78 8.910 22.606 1.375 1.00 1.67 C ATOM 0 H LEU A 78 7.087 27.022 -0.690 1.00 0.65 H new ATOM 0 HA LEU A 78 6.547 26.019 2.025 1.00 0.83 H new ATOM 0 HB2 LEU A 78 6.885 24.167 0.336 1.00 0.99 H new ATOM 0 HB3 LEU A 78 8.474 24.824 -0.003 1.00 0.99 H new ATOM 0 HG LEU A 78 9.094 24.461 2.398 1.00 1.05 H new ATOM 0 HD11 LEU A 78 7.651 23.000 3.754 1.00 1.49 H new ATOM 0 HD12 LEU A 78 6.834 24.527 3.343 1.00 1.49 H new ATOM 0 HD13 LEU A 78 6.416 23.032 2.472 1.00 1.49 H new ATOM 0 HD21 LEU A 78 9.324 22.026 2.200 1.00 1.67 H new ATOM 0 HD22 LEU A 78 8.140 22.022 0.871 1.00 1.67 H new ATOM 0 HD23 LEU A 78 9.703 22.848 0.668 1.00 1.67 H new ATOM 1174 N PRO A 79 8.188 27.975 2.452 1.00 1.15 N ATOM 1175 CA PRO A 79 9.279 28.718 3.057 1.00 1.27 C ATOM 1176 C PRO A 79 9.879 27.929 4.211 1.00 1.13 C ATOM 1177 O PRO A 79 9.200 27.655 5.201 1.00 1.59 O ATOM 1178 CB PRO A 79 8.617 30.004 3.577 1.00 1.97 C ATOM 1179 CG PRO A 79 7.180 29.934 3.154 1.00 2.15 C ATOM 1180 CD PRO A 79 6.882 28.488 2.869 1.00 1.65 C ATOM 0 HA PRO A 79 10.090 28.917 2.357 1.00 1.27 H new ATOM 0 HB2 PRO A 79 8.701 30.074 4.662 1.00 1.97 H new ATOM 0 HB3 PRO A 79 9.103 30.887 3.162 1.00 1.97 H new ATOM 0 HG2 PRO A 79 6.527 30.316 3.939 1.00 2.15 H new ATOM 0 HG3 PRO A 79 7.007 30.546 2.269 1.00 2.15 H new ATOM 0 HD2 PRO A 79 6.504 27.970 3.750 1.00 1.65 H new ATOM 0 HD3 PRO A 79 6.132 28.374 2.086 1.00 1.65 H new ATOM 1188 N LYS A 80 11.142 27.553 4.082 1.00 1.09 N ATOM 1189 CA LYS A 80 11.805 26.773 5.102 1.00 1.37 C ATOM 1190 C LYS A 80 13.310 26.760 4.886 1.00 1.18 C ATOM 1191 O LYS A 80 14.081 26.526 5.818 1.00 1.19 O ATOM 1192 CB LYS A 80 11.253 25.342 5.120 1.00 1.96 C ATOM 1193 CG LYS A 80 11.938 24.461 6.137 1.00 2.65 C ATOM 1194 CD LYS A 80 11.376 23.038 6.186 1.00 3.44 C ATOM 1195 CE LYS A 80 9.967 22.971 6.767 1.00 4.04 C ATOM 1196 NZ LYS A 80 8.911 23.111 5.727 1.00 4.61 N ATOM 0 H LYS A 80 11.725 27.779 3.276 1.00 1.09 H new ATOM 0 HA LYS A 80 11.607 27.237 6.068 1.00 1.37 H new ATOM 0 HB2 LYS A 80 10.185 25.373 5.334 1.00 1.96 H new ATOM 0 HB3 LYS A 80 11.367 24.901 4.130 1.00 1.96 H new ATOM 0 HG2 LYS A 80 13.003 24.415 5.909 1.00 2.65 H new ATOM 0 HG3 LYS A 80 11.843 24.915 7.123 1.00 2.65 H new ATOM 0 HD2 LYS A 80 11.367 22.622 5.178 1.00 3.44 H new ATOM 0 HD3 LYS A 80 12.039 22.412 6.783 1.00 3.44 H new ATOM 0 HE2 LYS A 80 9.837 22.021 7.286 1.00 4.04 H new ATOM 0 HE3 LYS A 80 9.847 23.759 7.510 1.00 4.04 H new ATOM 0 HZ1 LYS A 80 8.198 23.797 6.047 1.00 4.61 H new ATOM 0 HZ2 LYS A 80 9.339 23.445 4.840 1.00 4.61 H new ATOM 0 HZ3 LYS A 80 8.457 22.189 5.566 1.00 4.61 H new ATOM 1210 N ASN A 81 13.709 27.037 3.656 1.00 1.26 N ATOM 1211 CA ASN A 81 15.113 26.974 3.252 1.00 1.35 C ATOM 1212 C ASN A 81 15.619 25.556 3.486 1.00 1.23 C ATOM 1213 O ASN A 81 16.740 25.335 3.948 1.00 1.43 O ATOM 1214 CB ASN A 81 15.957 27.994 4.027 1.00 1.57 C ATOM 1215 CG ASN A 81 17.214 28.401 3.277 1.00 2.26 C ATOM 1216 OD1 ASN A 81 17.212 29.381 2.525 1.00 2.84 O ATOM 1217 ND2 ASN A 81 18.290 27.653 3.463 1.00 2.81 N ATOM 0 H ASN A 81 13.074 27.312 2.907 1.00 1.26 H new ATOM 0 HA ASN A 81 15.201 27.226 2.195 1.00 1.35 H new ATOM 0 HB2 ASN A 81 15.355 28.880 4.228 1.00 1.57 H new ATOM 0 HB3 ASN A 81 16.235 27.572 4.993 1.00 1.57 H new ATOM 0 HD21 ASN A 81 19.158 27.878 2.977 1.00 2.81 H new ATOM 0 HD22 ASN A 81 18.251 26.851 4.093 1.00 2.81 H new ATOM 1224 N SER A 82 14.765 24.602 3.146 1.00 1.01 N ATOM 1225 CA SER A 82 15.018 23.195 3.413 1.00 1.03 C ATOM 1226 C SER A 82 15.789 22.553 2.265 1.00 0.96 C ATOM 1227 O SER A 82 16.183 21.388 2.344 1.00 1.12 O ATOM 1228 CB SER A 82 13.688 22.466 3.624 1.00 1.08 C ATOM 1229 OG SER A 82 13.883 21.150 4.109 1.00 1.70 O ATOM 0 H SER A 82 13.877 24.782 2.677 1.00 1.01 H new ATOM 0 HA SER A 82 15.624 23.116 4.315 1.00 1.03 H new ATOM 0 HB2 SER A 82 13.074 23.026 4.329 1.00 1.08 H new ATOM 0 HB3 SER A 82 13.140 22.429 2.683 1.00 1.08 H new ATOM 0 HG SER A 82 14.754 20.817 3.809 1.00 1.70 H new ATOM 1235 N ILE A 83 15.990 23.308 1.192 1.00 0.83 N ATOM 1236 CA ILE A 83 16.760 22.816 0.062 1.00 0.77 C ATOM 1237 C ILE A 83 18.194 22.549 0.509 1.00 0.76 C ATOM 1238 O ILE A 83 18.890 23.462 0.961 1.00 0.78 O ATOM 1239 CB ILE A 83 16.770 23.810 -1.122 1.00 0.76 C ATOM 1240 CG1 ILE A 83 15.354 24.304 -1.450 1.00 0.92 C ATOM 1241 CG2 ILE A 83 17.401 23.172 -2.353 1.00 0.79 C ATOM 1242 CD1 ILE A 83 14.323 23.207 -1.596 1.00 0.69 C ATOM 0 H ILE A 83 15.632 24.257 1.083 1.00 0.83 H new ATOM 0 HA ILE A 83 16.286 21.898 -0.285 1.00 0.77 H new ATOM 0 HB ILE A 83 17.369 24.671 -0.824 1.00 0.76 H new ATOM 0 HG12 ILE A 83 15.030 24.987 -0.664 1.00 0.92 H new ATOM 0 HG13 ILE A 83 15.389 24.878 -2.376 1.00 0.92 H new ATOM 0 HG21 ILE A 83 17.399 23.887 -3.175 1.00 0.79 H new ATOM 0 HG22 ILE A 83 18.427 22.882 -2.127 1.00 0.79 H new ATOM 0 HG23 ILE A 83 16.829 22.289 -2.639 1.00 0.79 H new ATOM 0 HD11 ILE A 83 13.353 23.648 -1.827 1.00 0.69 H new ATOM 0 HD12 ILE A 83 14.618 22.535 -2.402 1.00 0.69 H new ATOM 0 HD13 ILE A 83 14.254 22.646 -0.664 1.00 0.69 H new ATOM 1254 N PRO A 84 18.652 21.294 0.391 1.00 0.82 N ATOM 1255 CA PRO A 84 19.950 20.878 0.926 1.00 0.89 C ATOM 1256 C PRO A 84 21.104 21.541 0.203 1.00 0.83 C ATOM 1257 O PRO A 84 20.962 22.006 -0.929 1.00 0.82 O ATOM 1258 CB PRO A 84 19.974 19.378 0.664 1.00 1.03 C ATOM 1259 CG PRO A 84 19.099 19.217 -0.526 1.00 1.03 C ATOM 1260 CD PRO A 84 17.979 20.194 -0.323 1.00 0.91 C ATOM 0 HA PRO A 84 20.062 21.150 1.975 1.00 0.89 H new ATOM 0 HB2 PRO A 84 20.985 19.021 0.469 1.00 1.03 H new ATOM 0 HB3 PRO A 84 19.597 18.816 1.518 1.00 1.03 H new ATOM 0 HG2 PRO A 84 19.643 19.427 -1.447 1.00 1.03 H new ATOM 0 HG3 PRO A 84 18.723 18.197 -0.604 1.00 1.03 H new ATOM 0 HD2 PRO A 84 17.550 20.525 -1.269 1.00 0.91 H new ATOM 0 HD3 PRO A 84 17.166 19.765 0.263 1.00 0.91 H new ATOM 1268 N GLN A 85 22.246 21.579 0.855 1.00 0.88 N ATOM 1269 CA GLN A 85 23.421 22.146 0.239 1.00 0.88 C ATOM 1270 C GLN A 85 24.302 21.044 -0.341 1.00 0.77 C ATOM 1271 O GLN A 85 24.441 19.975 0.262 1.00 0.74 O ATOM 1272 CB GLN A 85 24.194 23.004 1.247 1.00 1.06 C ATOM 1273 CG GLN A 85 24.646 22.247 2.483 1.00 1.73 C ATOM 1274 CD GLN A 85 25.323 23.138 3.506 1.00 2.21 C ATOM 1275 OE1 GLN A 85 24.879 24.385 3.605 1.00 2.76 O flip ATOM 1276 NE2 GLN A 85 26.232 22.707 4.219 1.00 2.65 N flip ATOM 0 H GLN A 85 22.384 21.227 1.802 1.00 0.88 H new ATOM 0 HA GLN A 85 23.110 22.793 -0.581 1.00 0.88 H new ATOM 0 HB2 GLN A 85 25.068 23.428 0.753 1.00 1.06 H new ATOM 0 HB3 GLN A 85 23.566 23.840 1.555 1.00 1.06 H new ATOM 0 HG2 GLN A 85 23.784 21.765 2.943 1.00 1.73 H new ATOM 0 HG3 GLN A 85 25.334 21.455 2.187 1.00 1.73 H new ATOM 0 HE21 GLN A 85 26.548 21.743 4.115 1.00 2.65 H new ATOM 0 HE22 GLN A 85 26.668 23.315 4.912 1.00 2.65 H new ATOM 1285 N PRO A 86 24.874 21.285 -1.535 1.00 0.81 N ATOM 1286 CA PRO A 86 25.754 20.322 -2.213 1.00 0.79 C ATOM 1287 C PRO A 86 26.864 19.814 -1.302 1.00 0.77 C ATOM 1288 O PRO A 86 27.513 20.600 -0.600 1.00 0.85 O ATOM 1289 CB PRO A 86 26.354 21.138 -3.358 1.00 0.88 C ATOM 1290 CG PRO A 86 25.340 22.191 -3.645 1.00 1.08 C ATOM 1291 CD PRO A 86 24.700 22.520 -2.324 1.00 0.95 C ATOM 0 HA PRO A 86 25.211 19.434 -2.535 1.00 0.79 H new ATOM 0 HB2 PRO A 86 27.310 21.577 -3.073 1.00 0.88 H new ATOM 0 HB3 PRO A 86 26.537 20.516 -4.234 1.00 0.88 H new ATOM 0 HG2 PRO A 86 25.807 23.073 -4.083 1.00 1.08 H new ATOM 0 HG3 PRO A 86 24.599 21.834 -4.360 1.00 1.08 H new ATOM 0 HD2 PRO A 86 25.183 23.372 -1.846 1.00 0.95 H new ATOM 0 HD3 PRO A 86 23.647 22.775 -2.442 1.00 0.95 H new ATOM 1299 N ALA A 87 27.094 18.509 -1.314 1.00 0.84 N ATOM 1300 CA ALA A 87 28.105 17.927 -0.449 1.00 0.93 C ATOM 1301 C ALA A 87 29.429 17.813 -1.190 1.00 0.90 C ATOM 1302 O ALA A 87 29.697 16.821 -1.870 1.00 0.98 O ATOM 1303 CB ALA A 87 27.654 16.563 0.055 1.00 1.10 C ATOM 0 H ALA A 87 26.600 17.841 -1.906 1.00 0.84 H new ATOM 0 HA ALA A 87 28.245 18.580 0.412 1.00 0.93 H new ATOM 0 HB1 ALA A 87 28.424 16.141 0.702 1.00 1.10 H new ATOM 0 HB2 ALA A 87 26.727 16.671 0.618 1.00 1.10 H new ATOM 0 HB3 ALA A 87 27.488 15.898 -0.793 1.00 1.10 H new ATOM 1309 N VAL A 88 30.254 18.848 -1.062 1.00 0.87 N ATOM 1310 CA VAL A 88 31.559 18.885 -1.706 1.00 0.88 C ATOM 1311 C VAL A 88 32.562 19.561 -0.784 1.00 1.02 C ATOM 1312 O VAL A 88 32.262 20.600 -0.195 1.00 1.23 O ATOM 1313 CB VAL A 88 31.528 19.643 -3.054 1.00 0.81 C ATOM 1314 CG1 VAL A 88 32.858 19.496 -3.773 1.00 0.87 C ATOM 1315 CG2 VAL A 88 30.395 19.152 -3.938 1.00 0.94 C ATOM 0 H VAL A 88 30.037 19.679 -0.512 1.00 0.87 H new ATOM 0 HA VAL A 88 31.850 17.854 -1.907 1.00 0.88 H new ATOM 0 HB VAL A 88 31.355 20.698 -2.841 1.00 0.81 H new ATOM 0 HG11 VAL A 88 32.821 20.035 -4.720 1.00 0.87 H new ATOM 0 HG12 VAL A 88 33.654 19.907 -3.153 1.00 0.87 H new ATOM 0 HG13 VAL A 88 33.054 18.441 -3.963 1.00 0.87 H new ATOM 0 HG21 VAL A 88 30.401 19.705 -4.877 1.00 0.94 H new ATOM 0 HG22 VAL A 88 30.527 18.089 -4.141 1.00 0.94 H new ATOM 0 HG23 VAL A 88 29.443 19.309 -3.431 1.00 0.94 H new ATOM 1325 N LEU A 89 33.745 18.980 -0.659 1.00 1.09 N ATOM 1326 CA LEU A 89 34.757 19.520 0.239 1.00 1.27 C ATOM 1327 C LEU A 89 35.564 20.641 -0.415 1.00 1.15 C ATOM 1328 O LEU A 89 35.578 21.768 0.076 1.00 1.29 O ATOM 1329 CB LEU A 89 35.697 18.409 0.697 1.00 1.54 C ATOM 1330 CG LEU A 89 35.036 17.304 1.523 1.00 2.14 C ATOM 1331 CD1 LEU A 89 36.028 16.197 1.818 1.00 2.87 C ATOM 1332 CD2 LEU A 89 34.496 17.872 2.824 1.00 2.45 C ATOM 0 H LEU A 89 34.028 18.140 -1.164 1.00 1.09 H new ATOM 0 HA LEU A 89 34.237 19.942 1.099 1.00 1.27 H new ATOM 0 HB2 LEU A 89 36.159 17.959 -0.182 1.00 1.54 H new ATOM 0 HB3 LEU A 89 36.499 18.852 1.287 1.00 1.54 H new ATOM 0 HG LEU A 89 34.210 16.890 0.945 1.00 2.14 H new ATOM 0 HD11 LEU A 89 35.541 15.419 2.406 1.00 2.87 H new ATOM 0 HD12 LEU A 89 36.388 15.772 0.881 1.00 2.87 H new ATOM 0 HD13 LEU A 89 36.870 16.603 2.379 1.00 2.87 H new ATOM 0 HD21 LEU A 89 34.028 17.075 3.402 1.00 2.45 H new ATOM 0 HD22 LEU A 89 35.314 18.306 3.399 1.00 2.45 H new ATOM 0 HD23 LEU A 89 33.758 18.643 2.605 1.00 2.45 H new ATOM 1344 N GLU A 90 36.237 20.331 -1.519 1.00 1.05 N ATOM 1345 CA GLU A 90 37.096 21.309 -2.179 1.00 1.13 C ATOM 1346 C GLU A 90 36.327 22.094 -3.229 1.00 1.04 C ATOM 1347 O GLU A 90 36.229 23.317 -3.167 1.00 1.34 O ATOM 1348 CB GLU A 90 38.239 20.578 -2.885 1.00 1.30 C ATOM 1349 CG GLU A 90 39.022 19.638 -1.990 1.00 1.98 C ATOM 1350 CD GLU A 90 39.907 20.368 -1.008 1.00 2.31 C ATOM 1351 OE1 GLU A 90 39.556 20.429 0.186 1.00 2.59 O ATOM 1352 OE2 GLU A 90 40.959 20.884 -1.430 1.00 2.84 O ATOM 0 H GLU A 90 36.205 19.418 -1.973 1.00 1.05 H new ATOM 0 HA GLU A 90 37.473 21.994 -1.419 1.00 1.13 H new ATOM 0 HB2 GLU A 90 37.831 20.010 -3.721 1.00 1.30 H new ATOM 0 HB3 GLU A 90 38.923 21.316 -3.305 1.00 1.30 H new ATOM 0 HG2 GLU A 90 38.327 19.002 -1.442 1.00 1.98 H new ATOM 0 HG3 GLU A 90 39.636 18.982 -2.608 1.00 1.98 H new ATOM 1359 N THR A 91 35.746 21.338 -4.150 1.00 0.84 N ATOM 1360 CA THR A 91 35.065 21.849 -5.328 1.00 0.77 C ATOM 1361 C THR A 91 35.203 20.783 -6.400 1.00 0.77 C ATOM 1362 O THR A 91 36.012 19.866 -6.242 1.00 0.95 O ATOM 1363 CB THR A 91 35.655 23.185 -5.849 1.00 0.81 C ATOM 1364 OG1 THR A 91 34.788 23.744 -6.841 1.00 1.42 O ATOM 1365 CG2 THR A 91 37.050 22.995 -6.441 1.00 1.41 C ATOM 0 H THR A 91 35.736 20.320 -4.095 1.00 0.84 H new ATOM 0 HA THR A 91 34.027 22.061 -5.072 1.00 0.77 H new ATOM 0 HB THR A 91 35.738 23.864 -5.000 1.00 0.81 H new ATOM 0 HG1 THR A 91 35.164 24.589 -7.166 1.00 1.42 H new ATOM 0 HG21 THR A 91 37.429 23.954 -6.795 1.00 1.41 H new ATOM 0 HG22 THR A 91 37.719 22.600 -5.676 1.00 1.41 H new ATOM 0 HG23 THR A 91 36.999 22.295 -7.275 1.00 1.41 H new ATOM 1373 N THR A 92 34.426 20.855 -7.457 1.00 0.69 N ATOM 1374 CA THR A 92 34.529 19.838 -8.482 1.00 0.73 C ATOM 1375 C THR A 92 35.222 20.371 -9.732 1.00 0.65 C ATOM 1376 O THR A 92 36.258 19.843 -10.144 1.00 0.69 O ATOM 1377 CB THR A 92 33.158 19.254 -8.851 1.00 0.81 C ATOM 1378 OG1 THR A 92 32.299 19.263 -7.703 1.00 1.30 O ATOM 1379 CG2 THR A 92 33.318 17.825 -9.354 1.00 0.82 C ATOM 0 H THR A 92 33.734 21.584 -7.629 1.00 0.69 H new ATOM 0 HA THR A 92 35.137 19.037 -8.062 1.00 0.73 H new ATOM 0 HB THR A 92 32.716 19.865 -9.638 1.00 0.81 H new ATOM 0 HG1 THR A 92 31.568 18.624 -7.837 1.00 1.30 H new ATOM 0 HG21 THR A 92 32.340 17.419 -9.613 1.00 0.82 H new ATOM 0 HG22 THR A 92 33.959 17.819 -10.236 1.00 0.82 H new ATOM 0 HG23 THR A 92 33.770 17.213 -8.573 1.00 0.82 H new ATOM 1387 N HIS A 93 34.672 21.426 -10.330 1.00 0.59 N ATOM 1388 CA HIS A 93 35.220 21.954 -11.576 1.00 0.54 C ATOM 1389 C HIS A 93 35.180 23.477 -11.581 1.00 0.49 C ATOM 1390 O HIS A 93 34.407 24.093 -10.850 1.00 0.63 O ATOM 1391 CB HIS A 93 34.446 21.430 -12.797 1.00 0.68 C ATOM 1392 CG HIS A 93 34.442 19.936 -12.942 1.00 0.62 C ATOM 1393 ND1 HIS A 93 35.546 19.184 -13.281 1.00 0.98 N ATOM 1394 CD2 HIS A 93 33.423 19.059 -12.800 1.00 0.72 C ATOM 1395 CE1 HIS A 93 35.168 17.901 -13.328 1.00 1.29 C ATOM 1396 NE2 HIS A 93 33.888 17.771 -13.046 1.00 1.10 N ATOM 0 H HIS A 93 33.857 21.927 -9.976 1.00 0.59 H new ATOM 0 HA HIS A 93 36.254 21.614 -11.640 1.00 0.54 H new ATOM 0 HB2 HIS A 93 33.415 21.778 -12.734 1.00 0.68 H new ATOM 0 HB3 HIS A 93 34.876 21.868 -13.698 1.00 0.68 H new ATOM 0 HD2 HIS A 93 32.408 19.317 -12.537 1.00 0.72 H new ATOM 0 HE1 HIS A 93 35.827 17.079 -13.566 1.00 1.29 H new ATOM 0 HE2 HIS A 93 33.349 16.905 -13.014 1.00 1.10 H new ATOM 1404 N ASN A 94 36.020 24.070 -12.411 1.00 0.45 N ATOM 1405 CA ASN A 94 36.047 25.516 -12.581 1.00 0.48 C ATOM 1406 C ASN A 94 36.250 25.848 -14.051 1.00 0.51 C ATOM 1407 O ASN A 94 37.185 25.364 -14.679 1.00 0.78 O ATOM 1408 CB ASN A 94 37.153 26.153 -11.718 1.00 0.57 C ATOM 1409 CG ASN A 94 38.546 25.612 -12.011 1.00 0.67 C ATOM 1410 OD1 ASN A 94 38.974 24.618 -11.422 1.00 1.36 O ATOM 1411 ND2 ASN A 94 39.272 26.272 -12.903 1.00 1.19 N ATOM 0 H ASN A 94 36.699 23.569 -12.984 1.00 0.45 H new ATOM 0 HA ASN A 94 35.094 25.929 -12.249 1.00 0.48 H new ATOM 0 HB2 ASN A 94 37.151 27.231 -11.878 1.00 0.57 H new ATOM 0 HB3 ASN A 94 36.922 25.986 -10.666 1.00 0.57 H new ATOM 0 HD21 ASN A 94 40.218 25.961 -13.121 1.00 1.19 H new ATOM 0 HD22 ASN A 94 38.884 27.091 -13.371 1.00 1.19 H new ATOM 1418 N GLY A 95 35.363 26.660 -14.608 1.00 0.45 N ATOM 1419 CA GLY A 95 35.443 26.958 -16.022 1.00 0.49 C ATOM 1420 C GLY A 95 34.904 28.330 -16.352 1.00 0.47 C ATOM 1421 O GLY A 95 35.123 29.285 -15.606 1.00 0.53 O ATOM 0 H GLY A 95 34.596 27.114 -14.111 1.00 0.45 H new ATOM 0 HA2 GLY A 95 36.481 26.891 -16.347 1.00 0.49 H new ATOM 0 HA3 GLY A 95 34.885 26.207 -16.581 1.00 0.49 H new ATOM 1425 N VAL A 96 34.196 28.429 -17.465 1.00 0.47 N ATOM 1426 CA VAL A 96 33.675 29.703 -17.918 1.00 0.48 C ATOM 1427 C VAL A 96 32.253 29.539 -18.454 1.00 0.45 C ATOM 1428 O VAL A 96 31.874 28.457 -18.908 1.00 0.43 O ATOM 1429 CB VAL A 96 34.594 30.322 -19.002 1.00 0.55 C ATOM 1430 CG1 VAL A 96 34.565 29.520 -20.292 1.00 1.21 C ATOM 1431 CG2 VAL A 96 34.230 31.768 -19.273 1.00 1.37 C ATOM 0 H VAL A 96 33.970 27.640 -18.070 1.00 0.47 H new ATOM 0 HA VAL A 96 33.649 30.382 -17.066 1.00 0.48 H new ATOM 0 HB VAL A 96 35.611 30.290 -18.610 1.00 0.55 H new ATOM 0 HG11 VAL A 96 35.222 29.987 -21.026 1.00 1.21 H new ATOM 0 HG12 VAL A 96 34.905 28.503 -20.096 1.00 1.21 H new ATOM 0 HG13 VAL A 96 33.547 29.494 -20.681 1.00 1.21 H new ATOM 0 HG21 VAL A 96 34.893 32.173 -20.038 1.00 1.37 H new ATOM 0 HG22 VAL A 96 33.198 31.825 -19.620 1.00 1.37 H new ATOM 0 HG23 VAL A 96 34.337 32.348 -18.356 1.00 1.37 H new ATOM 1441 N VAL A 97 31.469 30.603 -18.361 1.00 0.50 N ATOM 1442 CA VAL A 97 30.108 30.616 -18.885 1.00 0.53 C ATOM 1443 C VAL A 97 30.117 30.399 -20.398 1.00 0.60 C ATOM 1444 O VAL A 97 30.881 31.048 -21.116 1.00 0.67 O ATOM 1445 CB VAL A 97 29.435 31.957 -18.552 1.00 0.60 C ATOM 1446 CG1 VAL A 97 28.010 32.019 -19.085 1.00 0.69 C ATOM 1447 CG2 VAL A 97 29.468 32.193 -17.052 1.00 0.57 C ATOM 0 H VAL A 97 31.755 31.479 -17.923 1.00 0.50 H new ATOM 0 HA VAL A 97 29.546 29.806 -18.420 1.00 0.53 H new ATOM 0 HB VAL A 97 29.994 32.751 -19.046 1.00 0.60 H new ATOM 0 HG11 VAL A 97 27.568 32.982 -18.830 1.00 0.69 H new ATOM 0 HG12 VAL A 97 28.021 31.901 -20.168 1.00 0.69 H new ATOM 0 HG13 VAL A 97 27.420 31.219 -18.639 1.00 0.69 H new ATOM 0 HG21 VAL A 97 28.989 33.145 -16.823 1.00 0.57 H new ATOM 0 HG22 VAL A 97 28.936 31.388 -16.545 1.00 0.57 H new ATOM 0 HG23 VAL A 97 30.503 32.215 -16.710 1.00 0.57 H new ATOM 1457 N ALA A 98 29.267 29.493 -20.874 1.00 0.61 N ATOM 1458 CA ALA A 98 29.287 29.099 -22.275 1.00 0.70 C ATOM 1459 C ALA A 98 28.428 30.008 -23.141 1.00 0.83 C ATOM 1460 O ALA A 98 28.874 30.472 -24.189 1.00 0.89 O ATOM 1461 CB ALA A 98 28.832 27.654 -22.432 1.00 0.76 C ATOM 0 H ALA A 98 28.559 29.021 -20.311 1.00 0.61 H new ATOM 0 HA ALA A 98 30.318 29.194 -22.616 1.00 0.70 H new ATOM 0 HB1 ALA A 98 28.854 27.378 -23.486 1.00 0.76 H new ATOM 0 HB2 ALA A 98 29.500 26.999 -21.872 1.00 0.76 H new ATOM 0 HB3 ALA A 98 27.816 27.549 -22.050 1.00 0.76 H new ATOM 1467 N ARG A 99 27.192 30.255 -22.725 1.00 0.97 N ATOM 1468 CA ARG A 99 26.263 30.984 -23.577 1.00 1.17 C ATOM 1469 C ARG A 99 25.142 31.629 -22.771 1.00 1.38 C ATOM 1470 O ARG A 99 24.463 30.956 -21.996 1.00 1.41 O ATOM 1471 CB ARG A 99 25.677 30.018 -24.607 1.00 1.25 C ATOM 1472 CG ARG A 99 25.428 30.644 -25.966 1.00 1.85 C ATOM 1473 CD ARG A 99 25.006 29.592 -26.976 1.00 2.04 C ATOM 1474 NE ARG A 99 25.140 30.069 -28.348 1.00 2.61 N ATOM 1475 CZ ARG A 99 26.005 29.564 -29.230 1.00 2.99 C ATOM 1476 NH1 ARG A 99 26.772 28.523 -28.911 1.00 2.82 N ATOM 1477 NH2 ARG A 99 26.089 30.092 -30.440 1.00 3.92 N ATOM 0 H ARG A 99 26.816 29.968 -21.822 1.00 0.97 H new ATOM 0 HA ARG A 99 26.807 31.786 -24.075 1.00 1.17 H new ATOM 0 HB2 ARG A 99 26.356 29.174 -24.726 1.00 1.25 H new ATOM 0 HB3 ARG A 99 24.737 29.620 -24.224 1.00 1.25 H new ATOM 0 HG2 ARG A 99 24.654 31.407 -25.884 1.00 1.85 H new ATOM 0 HG3 ARG A 99 26.332 31.144 -26.312 1.00 1.85 H new ATOM 0 HD2 ARG A 99 25.613 28.697 -26.842 1.00 2.04 H new ATOM 0 HD3 ARG A 99 23.971 29.306 -26.791 1.00 2.04 H new ATOM 0 HE ARG A 99 24.537 30.834 -28.651 1.00 2.61 H new ATOM 0 HH11 ARG A 99 26.702 28.103 -27.984 1.00 2.82 H new ATOM 0 HH12 ARG A 99 27.429 28.146 -29.594 1.00 2.82 H new ATOM 0 HH21 ARG A 99 25.495 30.881 -30.695 1.00 3.92 H new ATOM 0 HH22 ARG A 99 26.748 29.710 -31.118 1.00 3.92 H new ATOM 1688 N ALA A 112 17.701 27.159 -18.716 1.00 1.24 N ATOM 1689 CA ALA A 112 18.537 27.141 -17.524 1.00 1.02 C ATOM 1690 C ALA A 112 19.961 27.605 -17.824 1.00 0.97 C ATOM 1691 O ALA A 112 20.708 27.943 -16.915 1.00 1.15 O ATOM 1692 CB ALA A 112 18.554 25.747 -16.924 1.00 1.06 C ATOM 0 HA ALA A 112 18.109 27.840 -16.805 1.00 1.02 H new ATOM 0 HB1 ALA A 112 19.182 25.742 -16.033 1.00 1.06 H new ATOM 0 HB2 ALA A 112 17.539 25.454 -16.655 1.00 1.06 H new ATOM 0 HB3 ALA A 112 18.954 25.042 -17.653 1.00 1.06 H new ATOM 1698 N GLY A 113 20.330 27.620 -19.098 1.00 0.94 N ATOM 1699 CA GLY A 113 21.663 28.051 -19.474 1.00 0.89 C ATOM 1700 C GLY A 113 22.670 26.927 -19.375 1.00 0.79 C ATOM 1701 O GLY A 113 22.370 25.873 -18.820 1.00 0.83 O ATOM 0 H GLY A 113 19.732 27.342 -19.876 1.00 0.94 H new ATOM 0 HA2 GLY A 113 21.646 28.434 -20.494 1.00 0.89 H new ATOM 0 HA3 GLY A 113 21.973 28.874 -18.830 1.00 0.89 H new ATOM 1705 N LEU A 114 23.877 27.146 -19.886 1.00 0.73 N ATOM 1706 CA LEU A 114 24.873 26.087 -19.915 1.00 0.66 C ATOM 1707 C LEU A 114 26.275 26.632 -19.708 1.00 0.58 C ATOM 1708 O LEU A 114 26.607 27.736 -20.153 1.00 0.63 O ATOM 1709 CB LEU A 114 24.799 25.315 -21.235 1.00 0.74 C ATOM 1710 CG LEU A 114 23.566 24.418 -21.385 1.00 0.83 C ATOM 1711 CD1 LEU A 114 23.408 23.951 -22.819 1.00 0.93 C ATOM 1712 CD2 LEU A 114 23.662 23.210 -20.468 1.00 0.80 C ATOM 0 H LEU A 114 24.184 28.035 -20.280 1.00 0.73 H new ATOM 0 HA LEU A 114 24.651 25.407 -19.092 1.00 0.66 H new ATOM 0 HB2 LEU A 114 24.814 26.029 -22.059 1.00 0.74 H new ATOM 0 HB3 LEU A 114 25.693 24.699 -21.330 1.00 0.74 H new ATOM 0 HG LEU A 114 22.694 25.009 -21.106 1.00 0.83 H new ATOM 0 HD11 LEU A 114 22.526 23.316 -22.900 1.00 0.93 H new ATOM 0 HD12 LEU A 114 23.294 24.816 -23.473 1.00 0.93 H new ATOM 0 HD13 LEU A 114 24.291 23.385 -23.117 1.00 0.93 H new ATOM 0 HD21 LEU A 114 22.776 22.588 -20.592 1.00 0.80 H new ATOM 0 HD22 LEU A 114 24.550 22.631 -20.721 1.00 0.80 H new ATOM 0 HD23 LEU A 114 23.729 23.544 -19.433 1.00 0.80 H new ATOM 1724 N ILE A 115 27.081 25.850 -19.014 1.00 0.49 N ATOM 1725 CA ILE A 115 28.472 26.178 -18.771 1.00 0.42 C ATOM 1726 C ILE A 115 29.358 25.176 -19.500 1.00 0.43 C ATOM 1727 O ILE A 115 29.053 23.977 -19.520 1.00 0.47 O ATOM 1728 CB ILE A 115 28.782 26.139 -17.259 1.00 0.34 C ATOM 1729 CG1 ILE A 115 27.828 27.064 -16.499 1.00 0.36 C ATOM 1730 CG2 ILE A 115 30.228 26.530 -16.992 1.00 0.31 C ATOM 1731 CD1 ILE A 115 27.737 26.760 -15.015 1.00 0.28 C ATOM 0 H ILE A 115 26.787 24.965 -18.601 1.00 0.49 H new ATOM 0 HA ILE A 115 28.668 27.185 -19.140 1.00 0.42 H new ATOM 0 HB ILE A 115 28.637 25.118 -16.905 1.00 0.34 H new ATOM 0 HG12 ILE A 115 28.155 28.096 -16.630 1.00 0.36 H new ATOM 0 HG13 ILE A 115 26.834 26.986 -16.938 1.00 0.36 H new ATOM 0 HG21 ILE A 115 30.422 26.495 -15.920 1.00 0.31 H new ATOM 0 HG22 ILE A 115 30.893 25.835 -17.504 1.00 0.31 H new ATOM 0 HG23 ILE A 115 30.406 27.540 -17.360 1.00 0.31 H new ATOM 0 HD11 ILE A 115 27.043 27.455 -14.543 1.00 0.28 H new ATOM 0 HD12 ILE A 115 27.381 25.740 -14.874 1.00 0.28 H new ATOM 0 HD13 ILE A 115 28.722 26.866 -14.561 1.00 0.28 H new ATOM 1743 N GLU A 116 30.432 25.655 -20.111 1.00 0.43 N ATOM 1744 CA GLU A 116 31.347 24.772 -20.813 1.00 0.47 C ATOM 1745 C GLU A 116 32.432 24.276 -19.868 1.00 0.45 C ATOM 1746 O GLU A 116 33.236 25.048 -19.346 1.00 0.49 O ATOM 1747 CB GLU A 116 31.941 25.457 -22.056 1.00 0.54 C ATOM 1748 CG GLU A 116 32.457 26.867 -21.825 1.00 0.84 C ATOM 1749 CD GLU A 116 32.925 27.523 -23.113 1.00 1.03 C ATOM 1750 OE1 GLU A 116 34.157 27.605 -23.336 1.00 1.14 O ATOM 1751 OE2 GLU A 116 32.069 27.976 -23.902 1.00 1.40 O ATOM 0 H GLU A 116 30.688 26.642 -20.134 1.00 0.43 H new ATOM 0 HA GLU A 116 30.788 23.905 -21.166 1.00 0.47 H new ATOM 0 HB2 GLU A 116 32.759 24.844 -22.434 1.00 0.54 H new ATOM 0 HB3 GLU A 116 31.179 25.488 -22.835 1.00 0.54 H new ATOM 0 HG2 GLU A 116 31.669 27.472 -21.376 1.00 0.84 H new ATOM 0 HG3 GLU A 116 33.282 26.839 -21.113 1.00 0.84 H new ATOM 1758 N ILE A 117 32.415 22.972 -19.629 1.00 0.47 N ATOM 1759 CA ILE A 117 33.307 22.351 -18.667 1.00 0.50 C ATOM 1760 C ILE A 117 34.578 21.900 -19.360 1.00 0.56 C ATOM 1761 O ILE A 117 34.517 21.263 -20.407 1.00 0.63 O ATOM 1762 CB ILE A 117 32.629 21.131 -18.004 1.00 0.53 C ATOM 1763 CG1 ILE A 117 31.185 21.477 -17.645 1.00 0.48 C ATOM 1764 CG2 ILE A 117 33.388 20.678 -16.759 1.00 0.60 C ATOM 1765 CD1 ILE A 117 31.056 22.649 -16.703 1.00 0.41 C ATOM 0 H ILE A 117 31.785 22.320 -20.095 1.00 0.47 H new ATOM 0 HA ILE A 117 33.547 23.085 -17.898 1.00 0.50 H new ATOM 0 HB ILE A 117 32.640 20.306 -18.716 1.00 0.53 H new ATOM 0 HG12 ILE A 117 30.635 21.696 -18.560 1.00 0.48 H new ATOM 0 HG13 ILE A 117 30.714 20.605 -17.192 1.00 0.48 H new ATOM 0 HG21 ILE A 117 32.884 19.818 -16.318 1.00 0.60 H new ATOM 0 HG22 ILE A 117 34.405 20.400 -17.034 1.00 0.60 H new ATOM 0 HG23 ILE A 117 33.418 21.492 -16.035 1.00 0.60 H new ATOM 0 HD11 ILE A 117 30.002 22.834 -16.495 1.00 0.41 H new ATOM 0 HD12 ILE A 117 31.576 22.426 -15.771 1.00 0.41 H new ATOM 0 HD13 ILE A 117 31.496 23.534 -17.161 1.00 0.41 H new ATOM 1777 N LEU A 118 35.718 22.227 -18.778 1.00 0.61 N ATOM 1778 CA LEU A 118 36.994 21.868 -19.371 1.00 0.70 C ATOM 1779 C LEU A 118 37.395 20.465 -18.956 1.00 0.79 C ATOM 1780 O LEU A 118 36.983 19.983 -17.900 1.00 0.88 O ATOM 1781 CB LEU A 118 38.099 22.855 -18.956 1.00 0.84 C ATOM 1782 CG LEU A 118 38.666 22.694 -17.530 1.00 0.96 C ATOM 1783 CD1 LEU A 118 39.801 23.684 -17.303 1.00 1.15 C ATOM 1784 CD2 LEU A 118 37.588 22.883 -16.472 1.00 1.21 C ATOM 0 H LEU A 118 35.787 22.739 -17.898 1.00 0.61 H new ATOM 0 HA LEU A 118 36.876 21.909 -20.454 1.00 0.70 H new ATOM 0 HB2 LEU A 118 38.923 22.762 -19.663 1.00 0.84 H new ATOM 0 HB3 LEU A 118 37.707 23.867 -19.055 1.00 0.84 H new ATOM 0 HG LEU A 118 39.048 21.677 -17.437 1.00 0.96 H new ATOM 0 HD11 LEU A 118 40.194 23.562 -16.294 1.00 1.15 H new ATOM 0 HD12 LEU A 118 40.595 23.499 -18.026 1.00 1.15 H new ATOM 0 HD13 LEU A 118 39.427 24.700 -17.426 1.00 1.15 H new ATOM 0 HD21 LEU A 118 38.026 22.762 -15.481 1.00 1.21 H new ATOM 0 HD22 LEU A 118 37.162 23.882 -16.561 1.00 1.21 H new ATOM 0 HD23 LEU A 118 36.803 22.140 -16.615 1.00 1.21 H new ATOM 1796 N ASP A 119 38.177 19.807 -19.797 1.00 0.83 N ATOM 1797 CA ASP A 119 38.793 18.537 -19.435 1.00 0.95 C ATOM 1798 C ASP A 119 39.623 18.712 -18.171 1.00 1.01 C ATOM 1799 O ASP A 119 40.132 19.801 -17.905 1.00 0.98 O ATOM 1800 CB ASP A 119 39.681 18.024 -20.573 1.00 1.05 C ATOM 1801 CG ASP A 119 38.893 17.694 -21.820 1.00 1.65 C ATOM 1802 OD1 ASP A 119 38.852 18.542 -22.736 1.00 2.29 O ATOM 1803 OD2 ASP A 119 38.312 16.588 -21.890 1.00 2.22 O ATOM 0 H ASP A 119 38.402 20.131 -20.738 1.00 0.83 H new ATOM 0 HA ASP A 119 38.005 17.806 -19.254 1.00 0.95 H new ATOM 0 HB2 ASP A 119 40.432 18.777 -20.811 1.00 1.05 H new ATOM 0 HB3 ASP A 119 40.216 17.135 -20.239 1.00 1.05 H new ATOM 1808 N GLU A 120 39.767 17.649 -17.395 1.00 1.17 N ATOM 1809 CA GLU A 120 40.505 17.727 -16.137 1.00 1.32 C ATOM 1810 C GLU A 120 41.966 18.094 -16.390 1.00 1.33 C ATOM 1811 O GLU A 120 42.624 18.688 -15.533 1.00 1.44 O ATOM 1812 CB GLU A 120 40.414 16.408 -15.370 1.00 1.55 C ATOM 1813 CG GLU A 120 40.986 15.223 -16.121 1.00 1.63 C ATOM 1814 CD GLU A 120 40.937 13.949 -15.311 1.00 1.96 C ATOM 1815 OE1 GLU A 120 41.406 13.954 -14.157 1.00 1.89 O ATOM 1816 OE2 GLU A 120 40.422 12.938 -15.824 1.00 2.78 O ATOM 0 H GLU A 120 39.387 16.727 -17.609 1.00 1.17 H new ATOM 0 HA GLU A 120 40.052 18.510 -15.529 1.00 1.32 H new ATOM 0 HB2 GLU A 120 40.940 16.513 -14.421 1.00 1.55 H new ATOM 0 HB3 GLU A 120 39.369 16.207 -15.134 1.00 1.55 H new ATOM 0 HG2 GLU A 120 40.431 15.082 -17.049 1.00 1.63 H new ATOM 0 HG3 GLU A 120 42.019 15.435 -16.397 1.00 1.63 H new ATOM 1823 N LEU A 121 42.455 17.765 -17.580 1.00 1.28 N ATOM 1824 CA LEU A 121 43.823 18.088 -17.969 1.00 1.34 C ATOM 1825 C LEU A 121 43.867 19.465 -18.628 1.00 1.21 C ATOM 1826 O LEU A 121 44.911 19.893 -19.121 1.00 1.27 O ATOM 1827 CB LEU A 121 44.381 17.031 -18.937 1.00 1.45 C ATOM 1828 CG LEU A 121 44.398 15.575 -18.437 1.00 1.65 C ATOM 1829 CD1 LEU A 121 44.686 15.503 -16.942 1.00 1.77 C ATOM 1830 CD2 LEU A 121 43.097 14.864 -18.782 1.00 1.65 C ATOM 0 H LEU A 121 41.921 17.272 -18.296 1.00 1.28 H new ATOM 0 HA LEU A 121 44.441 18.096 -17.071 1.00 1.34 H new ATOM 0 HB2 LEU A 121 43.796 17.068 -19.856 1.00 1.45 H new ATOM 0 HB3 LEU A 121 45.401 17.313 -19.197 1.00 1.45 H new ATOM 0 HG LEU A 121 45.208 15.058 -18.951 1.00 1.65 H new ATOM 0 HD11 LEU A 121 44.691 14.461 -16.622 1.00 1.77 H new ATOM 0 HD12 LEU A 121 45.659 15.950 -16.737 1.00 1.77 H new ATOM 0 HD13 LEU A 121 43.915 16.047 -16.396 1.00 1.77 H new ATOM 0 HD21 LEU A 121 43.136 13.837 -18.418 1.00 1.65 H new ATOM 0 HD22 LEU A 121 42.262 15.385 -18.313 1.00 1.65 H new ATOM 0 HD23 LEU A 121 42.960 14.860 -19.863 1.00 1.65 H new ATOM 1842 N ARG A 122 42.717 20.147 -18.616 1.00 1.11 N ATOM 1843 CA ARG A 122 42.554 21.455 -19.248 1.00 1.08 C ATOM 1844 C ARG A 122 42.815 21.364 -20.745 1.00 1.13 C ATOM 1845 O ARG A 122 43.895 21.702 -21.227 1.00 1.46 O ATOM 1846 CB ARG A 122 43.475 22.497 -18.607 1.00 1.24 C ATOM 1847 CG ARG A 122 43.306 23.892 -19.186 1.00 1.80 C ATOM 1848 CD ARG A 122 44.425 24.820 -18.749 1.00 2.04 C ATOM 1849 NE ARG A 122 44.337 26.116 -19.415 1.00 2.50 N ATOM 1850 CZ ARG A 122 44.983 26.418 -20.541 1.00 3.32 C ATOM 1851 NH1 ARG A 122 45.775 25.520 -21.116 1.00 3.73 N ATOM 1852 NH2 ARG A 122 44.840 27.616 -21.091 1.00 4.14 N ATOM 0 H ARG A 122 41.870 19.803 -18.164 1.00 1.11 H new ATOM 0 HA ARG A 122 41.523 21.774 -19.094 1.00 1.08 H new ATOM 0 HB2 ARG A 122 43.281 22.531 -17.535 1.00 1.24 H new ATOM 0 HB3 ARG A 122 44.511 22.182 -18.734 1.00 1.24 H new ATOM 0 HG2 ARG A 122 43.285 23.834 -20.274 1.00 1.80 H new ATOM 0 HG3 ARG A 122 42.347 24.304 -18.870 1.00 1.80 H new ATOM 0 HD2 ARG A 122 44.381 24.961 -17.669 1.00 2.04 H new ATOM 0 HD3 ARG A 122 45.388 24.360 -18.971 1.00 2.04 H new ATOM 0 HE ARG A 122 43.746 26.833 -18.994 1.00 2.50 H new ATOM 0 HH11 ARG A 122 45.890 24.598 -20.696 1.00 3.73 H new ATOM 0 HH12 ARG A 122 46.269 25.753 -21.978 1.00 3.73 H new ATOM 0 HH21 ARG A 122 44.234 28.310 -20.652 1.00 4.14 H new ATOM 0 HH22 ARG A 122 45.336 27.844 -21.953 1.00 4.14 H new ATOM 1866 N THR A 123 41.831 20.878 -21.479 1.00 1.08 N ATOM 1867 CA THR A 123 41.960 20.753 -22.916 1.00 1.20 C ATOM 1868 C THR A 123 40.873 21.554 -23.624 1.00 1.15 C ATOM 1869 O THR A 123 41.135 22.634 -24.160 1.00 1.38 O ATOM 1870 CB THR A 123 41.901 19.273 -23.349 1.00 1.40 C ATOM 1871 OG1 THR A 123 42.817 18.504 -22.558 1.00 1.86 O ATOM 1872 CG2 THR A 123 42.251 19.123 -24.823 1.00 1.87 C ATOM 0 H THR A 123 40.936 20.564 -21.103 1.00 1.08 H new ATOM 0 HA THR A 123 42.932 21.155 -23.202 1.00 1.20 H new ATOM 0 HB THR A 123 40.885 18.910 -23.197 1.00 1.40 H new ATOM 0 HG1 THR A 123 42.777 17.564 -22.833 1.00 1.86 H new ATOM 0 HG21 THR A 123 42.202 18.071 -25.103 1.00 1.87 H new ATOM 0 HG22 THR A 123 41.543 19.692 -25.425 1.00 1.87 H new ATOM 0 HG23 THR A 123 43.259 19.499 -24.998 1.00 1.87 H new ATOM 1880 N THR A 124 39.652 21.039 -23.590 1.00 1.01 N ATOM 1881 CA THR A 124 38.524 21.678 -24.249 1.00 1.03 C ATOM 1882 C THR A 124 37.251 21.500 -23.433 1.00 0.89 C ATOM 1883 O THR A 124 37.297 20.983 -22.318 1.00 0.85 O ATOM 1884 CB THR A 124 38.303 21.087 -25.655 1.00 1.26 C ATOM 1885 OG1 THR A 124 38.525 19.668 -25.633 1.00 1.54 O ATOM 1886 CG2 THR A 124 39.222 21.739 -26.677 1.00 1.53 C ATOM 0 H THR A 124 39.417 20.172 -23.108 1.00 1.01 H new ATOM 0 HA THR A 124 38.754 22.740 -24.336 1.00 1.03 H new ATOM 0 HB THR A 124 37.272 21.288 -25.947 1.00 1.26 H new ATOM 0 HG1 THR A 124 38.381 19.300 -26.530 1.00 1.54 H new ATOM 0 HG21 THR A 124 39.043 21.301 -27.659 1.00 1.53 H new ATOM 0 HG22 THR A 124 39.022 22.810 -26.715 1.00 1.53 H new ATOM 0 HG23 THR A 124 40.261 21.574 -26.390 1.00 1.53 H new ATOM 1894 N VAL A 125 36.128 21.946 -23.983 1.00 0.90 N ATOM 1895 CA VAL A 125 34.828 21.690 -23.385 1.00 0.82 C ATOM 1896 C VAL A 125 34.471 20.213 -23.543 1.00 0.86 C ATOM 1897 O VAL A 125 34.676 19.632 -24.606 1.00 0.96 O ATOM 1898 CB VAL A 125 33.728 22.578 -24.024 1.00 0.82 C ATOM 1899 CG1 VAL A 125 33.704 22.423 -25.540 1.00 1.17 C ATOM 1900 CG2 VAL A 125 32.361 22.259 -23.431 1.00 1.29 C ATOM 0 H VAL A 125 36.094 22.489 -24.846 1.00 0.90 H new ATOM 0 HA VAL A 125 34.883 21.940 -22.325 1.00 0.82 H new ATOM 0 HB VAL A 125 33.968 23.617 -23.796 1.00 0.82 H new ATOM 0 HG11 VAL A 125 32.923 23.058 -25.958 1.00 1.17 H new ATOM 0 HG12 VAL A 125 34.670 22.717 -25.951 1.00 1.17 H new ATOM 0 HG13 VAL A 125 33.502 21.383 -25.796 1.00 1.17 H new ATOM 0 HG21 VAL A 125 31.606 22.894 -23.895 1.00 1.29 H new ATOM 0 HG22 VAL A 125 32.119 21.213 -23.617 1.00 1.29 H new ATOM 0 HG23 VAL A 125 32.379 22.442 -22.357 1.00 1.29 H new ATOM 1910 N ILE A 126 33.985 19.596 -22.476 1.00 0.82 N ATOM 1911 CA ILE A 126 33.625 18.188 -22.524 1.00 0.90 C ATOM 1912 C ILE A 126 32.282 18.000 -23.225 1.00 0.93 C ATOM 1913 O ILE A 126 32.215 17.472 -24.334 1.00 1.03 O ATOM 1914 CB ILE A 126 33.530 17.598 -21.100 1.00 0.89 C ATOM 1915 CG1 ILE A 126 34.822 17.853 -20.320 1.00 0.87 C ATOM 1916 CG2 ILE A 126 33.243 16.108 -21.160 1.00 1.00 C ATOM 1917 CD1 ILE A 126 34.693 17.591 -18.835 1.00 0.87 C ATOM 0 H ILE A 126 33.832 20.045 -21.573 1.00 0.82 H new ATOM 0 HA ILE A 126 34.404 17.668 -23.081 1.00 0.90 H new ATOM 0 HB ILE A 126 32.709 18.094 -20.582 1.00 0.89 H new ATOM 0 HG12 ILE A 126 35.612 17.221 -20.725 1.00 0.87 H new ATOM 0 HG13 ILE A 126 35.131 18.887 -20.473 1.00 0.87 H new ATOM 0 HG21 ILE A 126 33.179 15.709 -20.148 1.00 1.00 H new ATOM 0 HG22 ILE A 126 32.298 15.940 -21.676 1.00 1.00 H new ATOM 0 HG23 ILE A 126 34.045 15.604 -21.699 1.00 1.00 H new ATOM 0 HD11 ILE A 126 35.646 17.792 -18.346 1.00 0.87 H new ATOM 0 HD12 ILE A 126 33.926 18.242 -18.416 1.00 0.87 H new ATOM 0 HD13 ILE A 126 34.414 16.550 -18.672 1.00 0.87 H new ATOM 1929 N SER A 127 31.209 18.438 -22.581 1.00 0.87 N ATOM 1930 CA SER A 127 29.904 18.446 -23.221 1.00 0.92 C ATOM 1931 C SER A 127 29.158 19.747 -22.937 1.00 0.84 C ATOM 1932 O SER A 127 29.222 20.701 -23.710 1.00 0.85 O ATOM 1933 CB SER A 127 29.087 17.237 -22.761 1.00 0.99 C ATOM 1934 OG SER A 127 29.808 16.037 -22.980 1.00 1.56 O ATOM 0 H SER A 127 31.217 18.790 -21.624 1.00 0.87 H new ATOM 0 HA SER A 127 30.049 18.380 -24.299 1.00 0.92 H new ATOM 0 HB2 SER A 127 28.846 17.335 -21.702 1.00 0.99 H new ATOM 0 HB3 SER A 127 28.141 17.203 -23.301 1.00 0.99 H new ATOM 0 HG SER A 127 29.272 15.274 -22.679 1.00 1.56 H new ATOM 1940 N GLN A 128 28.489 19.773 -21.787 1.00 0.79 N ATOM 1941 CA GLN A 128 27.721 20.925 -21.341 1.00 0.74 C ATOM 1942 C GLN A 128 27.187 20.650 -19.939 1.00 0.69 C ATOM 1943 O GLN A 128 26.826 19.515 -19.633 1.00 0.73 O ATOM 1944 CB GLN A 128 26.550 21.207 -22.296 1.00 0.86 C ATOM 1945 CG GLN A 128 25.520 20.087 -22.348 1.00 1.02 C ATOM 1946 CD GLN A 128 24.313 20.433 -23.194 1.00 1.43 C ATOM 1947 OE1 GLN A 128 24.414 21.167 -24.176 1.00 2.08 O ATOM 1948 NE2 GLN A 128 23.157 19.920 -22.810 1.00 1.88 N ATOM 0 H GLN A 128 28.467 18.988 -21.136 1.00 0.79 H new ATOM 0 HA GLN A 128 28.370 21.801 -21.331 1.00 0.74 H new ATOM 0 HB2 GLN A 128 26.056 22.129 -21.989 1.00 0.86 H new ATOM 0 HB3 GLN A 128 26.943 21.374 -23.299 1.00 0.86 H new ATOM 0 HG2 GLN A 128 25.989 19.187 -22.745 1.00 1.02 H new ATOM 0 HG3 GLN A 128 25.192 19.855 -21.335 1.00 1.02 H new ATOM 0 HE21 GLN A 128 23.115 19.315 -21.990 1.00 1.88 H new ATOM 0 HE22 GLN A 128 22.307 20.129 -23.334 1.00 1.88 H new ATOM 1957 N HIS A 129 27.156 21.659 -19.080 1.00 0.63 N ATOM 1958 CA HIS A 129 26.514 21.508 -17.777 1.00 0.60 C ATOM 1959 C HIS A 129 25.446 22.565 -17.581 1.00 0.58 C ATOM 1960 O HIS A 129 25.711 23.762 -17.691 1.00 0.54 O ATOM 1961 CB HIS A 129 27.510 21.578 -16.611 1.00 0.54 C ATOM 1962 CG HIS A 129 28.324 20.335 -16.394 1.00 0.58 C ATOM 1963 ND1 HIS A 129 28.661 19.342 -17.255 1.00 0.58 N flip ATOM 1964 CD2 HIS A 129 28.910 20.003 -15.190 1.00 0.65 C flip ATOM 1965 CE1 HIS A 129 29.456 18.409 -16.590 1.00 0.65 C flip ATOM 1966 NE2 HIS A 129 29.577 18.853 -15.359 1.00 0.68 N flip ATOM 0 H HIS A 129 27.561 22.579 -19.255 1.00 0.63 H new ATOM 0 HA HIS A 129 26.064 20.515 -17.773 1.00 0.60 H new ATOM 0 HB2 HIS A 129 28.189 22.413 -16.783 1.00 0.54 H new ATOM 0 HB3 HIS A 129 26.960 21.798 -15.696 1.00 0.54 H new ATOM 0 HD1 HIS A 129 28.378 19.287 -18.233 1.00 0.58 H new ATOM 0 HD2 HIS A 129 28.843 20.570 -14.273 1.00 0.65 H new ATOM 0 HE1 HIS A 129 29.884 17.507 -17.002 1.00 0.65 H new ATOM 1974 N GLU A 130 24.244 22.104 -17.298 1.00 0.64 N ATOM 1975 CA GLU A 130 23.114 22.975 -17.054 1.00 0.64 C ATOM 1976 C GLU A 130 23.122 23.389 -15.587 1.00 0.56 C ATOM 1977 O GLU A 130 23.504 22.598 -14.719 1.00 0.54 O ATOM 1978 CB GLU A 130 21.836 22.215 -17.409 1.00 0.77 C ATOM 1979 CG GLU A 130 20.710 23.071 -17.949 1.00 0.82 C ATOM 1980 CD GLU A 130 19.531 22.224 -18.391 1.00 0.98 C ATOM 1981 OE1 GLU A 130 19.557 21.716 -19.532 1.00 1.18 O ATOM 1982 OE2 GLU A 130 18.597 22.033 -17.586 1.00 1.19 O ATOM 0 H GLU A 130 24.024 21.110 -17.231 1.00 0.64 H new ATOM 0 HA GLU A 130 23.169 23.876 -17.665 1.00 0.64 H new ATOM 0 HB2 GLU A 130 22.079 21.452 -18.149 1.00 0.77 H new ATOM 0 HB3 GLU A 130 21.482 21.695 -16.519 1.00 0.77 H new ATOM 0 HG2 GLU A 130 20.387 23.775 -17.182 1.00 0.82 H new ATOM 0 HG3 GLU A 130 21.072 23.661 -18.791 1.00 0.82 H new ATOM 1989 N PHE A 131 22.734 24.620 -15.301 1.00 0.53 N ATOM 1990 CA PHE A 131 22.733 25.084 -13.925 1.00 0.46 C ATOM 1991 C PHE A 131 21.325 25.432 -13.458 1.00 0.51 C ATOM 1992 O PHE A 131 20.565 26.094 -14.160 1.00 0.74 O ATOM 1993 CB PHE A 131 23.695 26.263 -13.719 1.00 0.42 C ATOM 1994 CG PHE A 131 23.594 27.379 -14.725 1.00 0.48 C ATOM 1995 CD1 PHE A 131 22.769 28.468 -14.496 1.00 0.60 C ATOM 1996 CD2 PHE A 131 24.354 27.355 -15.884 1.00 0.46 C ATOM 1997 CE1 PHE A 131 22.702 29.510 -15.404 1.00 0.70 C ATOM 1998 CE2 PHE A 131 24.288 28.392 -16.796 1.00 0.56 C ATOM 1999 CZ PHE A 131 23.463 29.471 -16.554 1.00 0.68 C ATOM 0 H PHE A 131 22.421 25.305 -15.989 1.00 0.53 H new ATOM 0 HA PHE A 131 23.094 24.261 -13.308 1.00 0.46 H new ATOM 0 HB2 PHE A 131 23.522 26.678 -12.726 1.00 0.42 H new ATOM 0 HB3 PHE A 131 24.716 25.880 -13.731 1.00 0.42 H new ATOM 0 HD1 PHE A 131 22.171 28.504 -13.598 1.00 0.60 H new ATOM 0 HD2 PHE A 131 25.006 26.516 -16.077 1.00 0.46 H new ATOM 0 HE1 PHE A 131 22.055 30.353 -15.213 1.00 0.70 H new ATOM 0 HE2 PHE A 131 24.882 28.357 -17.697 1.00 0.56 H new ATOM 0 HZ PHE A 131 23.413 30.284 -17.264 1.00 0.68 H new ATOM 2009 N GLY A 132 21.002 24.965 -12.262 1.00 0.48 N ATOM 2010 CA GLY A 132 19.677 25.140 -11.696 1.00 0.51 C ATOM 2011 C GLY A 132 19.448 26.528 -11.138 1.00 0.50 C ATOM 2012 O GLY A 132 20.395 27.214 -10.770 1.00 0.47 O ATOM 0 H GLY A 132 21.649 24.456 -11.660 1.00 0.48 H new ATOM 0 HA2 GLY A 132 18.931 24.936 -12.464 1.00 0.51 H new ATOM 0 HA3 GLY A 132 19.527 24.407 -10.903 1.00 0.51 H new ATOM 2016 N ILE A 133 18.190 26.953 -11.107 1.00 0.54 N ATOM 2017 CA ILE A 133 17.814 28.266 -10.574 1.00 0.55 C ATOM 2018 C ILE A 133 18.415 28.513 -9.183 1.00 0.54 C ATOM 2019 O ILE A 133 18.832 29.625 -8.866 1.00 0.56 O ATOM 2020 CB ILE A 133 16.275 28.408 -10.509 1.00 0.60 C ATOM 2021 CG1 ILE A 133 15.868 29.836 -10.135 1.00 0.64 C ATOM 2022 CG2 ILE A 133 15.663 27.405 -9.537 1.00 0.61 C ATOM 2023 CD1 ILE A 133 16.127 30.852 -11.227 1.00 0.67 C ATOM 0 H ILE A 133 17.402 26.403 -11.448 1.00 0.54 H new ATOM 0 HA ILE A 133 18.218 29.015 -11.255 1.00 0.55 H new ATOM 0 HB ILE A 133 15.887 28.191 -11.504 1.00 0.60 H new ATOM 0 HG12 ILE A 133 14.807 29.848 -9.885 1.00 0.64 H new ATOM 0 HG13 ILE A 133 16.410 30.135 -9.238 1.00 0.64 H new ATOM 0 HG21 ILE A 133 14.581 27.533 -9.516 1.00 0.61 H new ATOM 0 HG22 ILE A 133 15.903 26.392 -9.860 1.00 0.61 H new ATOM 0 HG23 ILE A 133 16.067 27.572 -8.539 1.00 0.61 H new ATOM 0 HD11 ILE A 133 15.813 31.839 -10.888 1.00 0.67 H new ATOM 0 HD12 ILE A 133 17.191 30.871 -11.462 1.00 0.67 H new ATOM 0 HD13 ILE A 133 15.563 30.579 -12.119 1.00 0.67 H new ATOM 2035 N THR A 134 18.467 27.467 -8.370 1.00 0.57 N ATOM 2036 CA THR A 134 19.029 27.551 -7.034 1.00 0.61 C ATOM 2037 C THR A 134 20.551 27.488 -7.084 1.00 0.57 C ATOM 2038 O THR A 134 21.245 28.100 -6.269 1.00 0.61 O ATOM 2039 CB THR A 134 18.490 26.405 -6.168 1.00 0.71 C ATOM 2040 OG1 THR A 134 18.447 25.205 -6.946 1.00 1.35 O ATOM 2041 CG2 THR A 134 17.100 26.727 -5.645 1.00 0.86 C ATOM 0 H THR A 134 18.121 26.540 -8.619 1.00 0.57 H new ATOM 0 HA THR A 134 18.736 28.505 -6.596 1.00 0.61 H new ATOM 0 HB THR A 134 19.154 26.271 -5.314 1.00 0.71 H new ATOM 0 HG1 THR A 134 17.526 24.873 -6.984 1.00 1.35 H new ATOM 0 HG21 THR A 134 16.740 25.899 -5.034 1.00 0.86 H new ATOM 0 HG22 THR A 134 17.140 27.633 -5.041 1.00 0.86 H new ATOM 0 HG23 THR A 134 16.422 26.880 -6.484 1.00 0.86 H new ATOM 2049 N SER A 135 21.054 26.739 -8.053 1.00 0.54 N ATOM 2050 CA SER A 135 22.477 26.653 -8.308 1.00 0.57 C ATOM 2051 C SER A 135 23.007 28.008 -8.754 1.00 0.46 C ATOM 2052 O SER A 135 24.145 28.374 -8.457 1.00 0.44 O ATOM 2053 CB SER A 135 22.744 25.611 -9.391 1.00 0.72 C ATOM 2054 OG SER A 135 22.232 24.345 -9.018 1.00 1.10 O ATOM 0 H SER A 135 20.484 26.175 -8.683 1.00 0.54 H new ATOM 0 HA SER A 135 22.987 26.357 -7.391 1.00 0.57 H new ATOM 0 HB2 SER A 135 22.287 25.930 -10.328 1.00 0.72 H new ATOM 0 HB3 SER A 135 23.817 25.535 -9.570 1.00 0.72 H new ATOM 0 HG SER A 135 22.415 23.696 -9.729 1.00 1.10 H new ATOM 2060 N LEU A 136 22.160 28.748 -9.458 1.00 0.45 N ATOM 2061 CA LEU A 136 22.516 30.058 -9.972 1.00 0.43 C ATOM 2062 C LEU A 136 22.446 31.112 -8.869 1.00 0.47 C ATOM 2063 O LEU A 136 21.664 32.053 -8.949 1.00 0.53 O ATOM 2064 CB LEU A 136 21.617 30.447 -11.148 1.00 0.48 C ATOM 2065 CG LEU A 136 22.071 31.687 -11.928 1.00 0.81 C ATOM 2066 CD1 LEU A 136 23.489 31.503 -12.465 1.00 1.46 C ATOM 2067 CD2 LEU A 136 21.097 31.985 -13.060 1.00 1.24 C ATOM 0 H LEU A 136 21.210 28.455 -9.687 1.00 0.45 H new ATOM 0 HA LEU A 136 23.544 30.009 -10.332 1.00 0.43 H new ATOM 0 HB2 LEU A 136 21.560 29.604 -11.837 1.00 0.48 H new ATOM 0 HB3 LEU A 136 20.609 30.621 -10.773 1.00 0.48 H new ATOM 0 HG LEU A 136 22.079 32.538 -11.247 1.00 0.81 H new ATOM 0 HD11 LEU A 136 23.789 32.395 -13.014 1.00 1.46 H new ATOM 0 HD12 LEU A 136 24.175 31.342 -11.633 1.00 1.46 H new ATOM 0 HD13 LEU A 136 23.517 30.641 -13.131 1.00 1.46 H new ATOM 0 HD21 LEU A 136 21.432 32.868 -13.605 1.00 1.24 H new ATOM 0 HD22 LEU A 136 21.056 31.133 -13.739 1.00 1.24 H new ATOM 0 HD23 LEU A 136 20.105 32.168 -12.648 1.00 1.24 H new ATOM 2079 N VAL A 137 23.220 30.899 -7.808 1.00 0.49 N ATOM 2080 CA VAL A 137 23.334 31.857 -6.703 1.00 0.60 C ATOM 2081 C VAL A 137 23.496 33.280 -7.237 1.00 0.65 C ATOM 2082 O VAL A 137 22.898 34.231 -6.733 1.00 0.77 O ATOM 2083 CB VAL A 137 24.552 31.519 -5.814 1.00 0.63 C ATOM 2084 CG1 VAL A 137 24.611 32.421 -4.595 1.00 0.82 C ATOM 2085 CG2 VAL A 137 24.522 30.056 -5.397 1.00 0.59 C ATOM 0 H VAL A 137 23.787 30.060 -7.687 1.00 0.49 H new ATOM 0 HA VAL A 137 22.420 31.791 -6.113 1.00 0.60 H new ATOM 0 HB VAL A 137 25.453 31.693 -6.402 1.00 0.63 H new ATOM 0 HG11 VAL A 137 25.479 32.158 -3.990 1.00 0.82 H new ATOM 0 HG12 VAL A 137 24.693 33.460 -4.915 1.00 0.82 H new ATOM 0 HG13 VAL A 137 23.704 32.294 -4.004 1.00 0.82 H new ATOM 0 HG21 VAL A 137 25.388 29.838 -4.772 1.00 0.59 H new ATOM 0 HG22 VAL A 137 23.609 29.856 -4.835 1.00 0.59 H new ATOM 0 HG23 VAL A 137 24.547 29.424 -6.285 1.00 0.59 H new ATOM 2095 N ASN A 138 24.285 33.402 -8.290 1.00 0.59 N ATOM 2096 CA ASN A 138 24.561 34.690 -8.910 1.00 0.66 C ATOM 2097 C ASN A 138 23.517 35.030 -9.968 1.00 0.58 C ATOM 2098 O ASN A 138 23.823 35.679 -10.965 1.00 0.60 O ATOM 2099 CB ASN A 138 25.960 34.690 -9.530 1.00 0.76 C ATOM 2100 CG ASN A 138 27.055 34.840 -8.491 1.00 1.36 C ATOM 2101 OD1 ASN A 138 27.517 33.726 -7.948 1.00 2.08 O flip ATOM 2102 ND2 ASN A 138 27.477 35.949 -8.171 1.00 2.17 N flip ATOM 0 H ASN A 138 24.752 32.615 -8.740 1.00 0.59 H new ATOM 0 HA ASN A 138 24.515 35.453 -8.133 1.00 0.66 H new ATOM 0 HB2 ASN A 138 26.110 33.761 -10.080 1.00 0.76 H new ATOM 0 HB3 ASN A 138 26.034 35.503 -10.252 1.00 0.76 H new ATOM 0 HD21 ASN A 138 27.096 36.786 -8.612 1.00 2.17 H new ATOM 0 HD22 ASN A 138 28.208 36.032 -7.465 1.00 2.17 H new ATOM 2109 N LYS A 139 22.279 34.611 -9.736 1.00 0.55 N ATOM 2110 CA LYS A 139 21.172 34.915 -10.643 1.00 0.56 C ATOM 2111 C LYS A 139 20.940 36.424 -10.741 1.00 0.66 C ATOM 2112 O LYS A 139 20.271 36.906 -11.653 1.00 0.76 O ATOM 2113 CB LYS A 139 19.894 34.219 -10.162 1.00 0.62 C ATOM 2114 CG LYS A 139 19.440 34.660 -8.775 1.00 0.75 C ATOM 2115 CD LYS A 139 18.838 33.501 -7.984 1.00 0.96 C ATOM 2116 CE LYS A 139 17.484 33.065 -8.519 1.00 0.74 C ATOM 2117 NZ LYS A 139 16.413 34.050 -8.203 1.00 1.39 N ATOM 0 H LYS A 139 22.012 34.056 -8.923 1.00 0.55 H new ATOM 0 HA LYS A 139 21.433 34.545 -11.635 1.00 0.56 H new ATOM 0 HB2 LYS A 139 19.094 34.415 -10.876 1.00 0.62 H new ATOM 0 HB3 LYS A 139 20.058 33.141 -10.155 1.00 0.62 H new ATOM 0 HG2 LYS A 139 20.288 35.072 -8.228 1.00 0.75 H new ATOM 0 HG3 LYS A 139 18.703 35.458 -8.870 1.00 0.75 H new ATOM 0 HD2 LYS A 139 19.524 32.654 -8.010 1.00 0.96 H new ATOM 0 HD3 LYS A 139 18.734 33.795 -6.940 1.00 0.96 H new ATOM 0 HE2 LYS A 139 17.547 32.933 -9.599 1.00 0.74 H new ATOM 0 HE3 LYS A 139 17.222 32.096 -8.094 1.00 0.74 H new ATOM 0 HZ1 LYS A 139 15.482 33.601 -8.320 1.00 1.39 H new ATOM 0 HZ2 LYS A 139 16.519 34.375 -7.221 1.00 1.39 H new ATOM 0 HZ3 LYS A 139 16.488 34.863 -8.847 1.00 1.39 H new ATOM 2131 N ARG A 140 21.503 37.157 -9.791 1.00 0.73 N ATOM 2132 CA ARG A 140 21.345 38.600 -9.735 1.00 0.87 C ATOM 2133 C ARG A 140 22.473 39.310 -10.478 1.00 0.86 C ATOM 2134 O ARG A 140 22.433 40.521 -10.682 1.00 1.01 O ATOM 2135 CB ARG A 140 21.305 39.054 -8.279 1.00 1.03 C ATOM 2136 CG ARG A 140 22.590 38.785 -7.508 1.00 1.11 C ATOM 2137 CD ARG A 140 22.460 39.212 -6.056 1.00 1.39 C ATOM 2138 NE ARG A 140 23.650 38.891 -5.274 1.00 1.65 N ATOM 2139 CZ ARG A 140 23.695 38.944 -3.944 1.00 2.04 C ATOM 2140 NH1 ARG A 140 22.615 39.299 -3.258 1.00 2.31 N ATOM 2141 NH2 ARG A 140 24.817 38.647 -3.302 1.00 2.46 N ATOM 0 H ARG A 140 22.078 36.770 -9.043 1.00 0.73 H new ATOM 0 HA ARG A 140 20.407 38.863 -10.224 1.00 0.87 H new ATOM 0 HB2 ARG A 140 21.093 40.123 -8.249 1.00 1.03 H new ATOM 0 HB3 ARG A 140 20.480 38.551 -7.775 1.00 1.03 H new ATOM 0 HG2 ARG A 140 22.831 37.723 -7.557 1.00 1.11 H new ATOM 0 HG3 ARG A 140 23.416 39.321 -7.975 1.00 1.11 H new ATOM 0 HD2 ARG A 140 22.277 40.286 -6.011 1.00 1.39 H new ATOM 0 HD3 ARG A 140 21.593 38.722 -5.612 1.00 1.39 H new ATOM 0 HE ARG A 140 24.494 38.611 -5.774 1.00 1.65 H new ATOM 0 HH11 ARG A 140 21.752 39.531 -3.750 1.00 2.31 H new ATOM 0 HH12 ARG A 140 22.648 39.340 -2.239 1.00 2.31 H new ATOM 0 HH21 ARG A 140 25.649 38.377 -3.827 1.00 2.46 H new ATOM 0 HH22 ARG A 140 24.848 38.689 -2.283 1.00 2.46 H new ATOM 2155 N ASP A 141 23.477 38.546 -10.872 1.00 0.73 N ATOM 2156 CA ASP A 141 24.628 39.095 -11.591 1.00 0.75 C ATOM 2157 C ASP A 141 24.341 39.145 -13.097 1.00 0.72 C ATOM 2158 O ASP A 141 23.382 38.537 -13.577 1.00 0.75 O ATOM 2159 CB ASP A 141 25.886 38.249 -11.320 1.00 0.74 C ATOM 2160 CG ASP A 141 27.162 38.890 -11.846 1.00 1.24 C ATOM 2161 OD1 ASP A 141 27.802 39.652 -11.096 1.00 1.89 O ATOM 2162 OD2 ASP A 141 27.532 38.631 -13.010 1.00 1.57 O ATOM 0 H ASP A 141 23.524 37.540 -10.709 1.00 0.73 H new ATOM 0 HA ASP A 141 24.806 40.109 -11.233 1.00 0.75 H new ATOM 0 HB2 ASP A 141 25.984 38.088 -10.246 1.00 0.74 H new ATOM 0 HB3 ASP A 141 25.763 37.268 -11.780 1.00 0.74 H new ATOM 2167 N LEU A 142 25.172 39.867 -13.836 1.00 0.85 N ATOM 2168 CA LEU A 142 25.030 39.976 -15.280 1.00 0.92 C ATOM 2169 C LEU A 142 25.985 39.001 -15.968 1.00 0.80 C ATOM 2170 O LEU A 142 26.755 39.374 -16.857 1.00 1.03 O ATOM 2171 CB LEU A 142 25.298 41.414 -15.743 1.00 1.16 C ATOM 2172 CG LEU A 142 26.643 42.010 -15.308 1.00 2.05 C ATOM 2173 CD1 LEU A 142 27.118 43.026 -16.330 1.00 2.56 C ATOM 2174 CD2 LEU A 142 26.524 42.674 -13.944 1.00 2.88 C ATOM 0 H LEU A 142 25.959 40.391 -13.453 1.00 0.85 H new ATOM 0 HA LEU A 142 24.007 39.720 -15.554 1.00 0.92 H new ATOM 0 HB2 LEU A 142 25.243 41.443 -16.831 1.00 1.16 H new ATOM 0 HB3 LEU A 142 24.499 42.053 -15.367 1.00 1.16 H new ATOM 0 HG LEU A 142 27.368 41.199 -15.239 1.00 2.05 H new ATOM 0 HD11 LEU A 142 28.073 43.443 -16.012 1.00 2.56 H new ATOM 0 HD12 LEU A 142 27.239 42.539 -17.298 1.00 2.56 H new ATOM 0 HD13 LEU A 142 26.383 43.827 -16.416 1.00 2.56 H new ATOM 0 HD21 LEU A 142 27.490 43.089 -13.656 1.00 2.88 H new ATOM 0 HD22 LEU A 142 25.785 43.474 -13.992 1.00 2.88 H new ATOM 0 HD23 LEU A 142 26.212 41.935 -13.206 1.00 2.88 H new ATOM 2186 N LEU A 143 25.896 37.749 -15.551 1.00 0.90 N ATOM 2187 CA LEU A 143 26.803 36.694 -15.988 1.00 0.81 C ATOM 2188 C LEU A 143 26.746 36.494 -17.511 1.00 0.88 C ATOM 2189 O LEU A 143 25.676 36.276 -18.083 1.00 0.97 O ATOM 2190 CB LEU A 143 26.440 35.404 -15.244 1.00 0.70 C ATOM 2191 CG LEU A 143 27.512 34.315 -15.232 1.00 0.60 C ATOM 2192 CD1 LEU A 143 28.848 34.882 -14.778 1.00 0.65 C ATOM 2193 CD2 LEU A 143 27.101 33.172 -14.316 1.00 0.58 C ATOM 0 H LEU A 143 25.185 37.430 -14.892 1.00 0.90 H new ATOM 0 HA LEU A 143 27.829 36.978 -15.752 1.00 0.81 H new ATOM 0 HB2 LEU A 143 26.197 35.659 -14.212 1.00 0.70 H new ATOM 0 HB3 LEU A 143 25.536 34.992 -15.692 1.00 0.70 H new ATOM 0 HG LEU A 143 27.618 33.935 -16.248 1.00 0.60 H new ATOM 0 HD11 LEU A 143 29.597 34.091 -14.776 1.00 0.65 H new ATOM 0 HD12 LEU A 143 29.158 35.674 -15.460 1.00 0.65 H new ATOM 0 HD13 LEU A 143 28.748 35.289 -13.772 1.00 0.65 H new ATOM 0 HD21 LEU A 143 27.876 32.406 -14.320 1.00 0.58 H new ATOM 0 HD22 LEU A 143 26.968 33.548 -13.302 1.00 0.58 H new ATOM 0 HD23 LEU A 143 26.164 32.742 -14.669 1.00 0.58 H new ATOM 2205 N GLN A 144 27.915 36.572 -18.151 1.00 0.90 N ATOM 2206 CA GLN A 144 28.026 36.499 -19.611 1.00 1.00 C ATOM 2207 C GLN A 144 29.086 35.475 -20.018 1.00 0.92 C ATOM 2208 O GLN A 144 29.815 34.972 -19.165 1.00 0.84 O ATOM 2209 CB GLN A 144 28.418 37.875 -20.156 1.00 1.21 C ATOM 2210 CG GLN A 144 29.767 38.363 -19.635 1.00 1.27 C ATOM 2211 CD GLN A 144 30.138 39.745 -20.131 1.00 1.47 C ATOM 2212 OE1 GLN A 144 29.272 40.584 -20.387 1.00 1.71 O ATOM 2213 NE2 GLN A 144 31.432 39.998 -20.269 1.00 1.77 N ATOM 0 H GLN A 144 28.809 36.687 -17.674 1.00 0.90 H new ATOM 0 HA GLN A 144 27.064 36.192 -20.022 1.00 1.00 H new ATOM 0 HB2 GLN A 144 28.449 37.832 -21.245 1.00 1.21 H new ATOM 0 HB3 GLN A 144 27.648 38.598 -19.887 1.00 1.21 H new ATOM 0 HG2 GLN A 144 29.747 38.369 -18.545 1.00 1.27 H new ATOM 0 HG3 GLN A 144 30.541 37.657 -19.935 1.00 1.27 H new ATOM 0 HE21 GLN A 144 32.119 39.278 -20.047 1.00 1.77 H new ATOM 0 HE22 GLN A 144 31.741 40.913 -20.597 1.00 1.77 H new ATOM 2222 N LYS A 145 29.189 35.170 -21.316 1.00 0.97 N ATOM 2223 CA LYS A 145 30.235 34.261 -21.778 1.00 0.98 C ATOM 2224 C LYS A 145 31.588 34.946 -21.672 1.00 1.01 C ATOM 2225 O LYS A 145 31.732 36.114 -22.037 1.00 1.11 O ATOM 2226 CB LYS A 145 30.033 33.782 -23.224 1.00 1.06 C ATOM 2227 CG LYS A 145 31.173 32.872 -23.678 1.00 1.17 C ATOM 2228 CD LYS A 145 31.052 32.396 -25.117 1.00 1.25 C ATOM 2229 CE LYS A 145 32.190 31.434 -25.442 1.00 1.41 C ATOM 2230 NZ LYS A 145 32.141 30.920 -26.837 1.00 1.43 N ATOM 0 H LYS A 145 28.576 35.530 -22.047 1.00 0.97 H new ATOM 0 HA LYS A 145 30.186 33.381 -21.136 1.00 0.98 H new ATOM 0 HB2 LYS A 145 29.086 33.247 -23.302 1.00 1.06 H new ATOM 0 HB3 LYS A 145 29.968 34.644 -23.888 1.00 1.06 H new ATOM 0 HG2 LYS A 145 32.117 33.404 -23.561 1.00 1.17 H new ATOM 0 HG3 LYS A 145 31.213 32.003 -23.021 1.00 1.17 H new ATOM 0 HD2 LYS A 145 30.092 31.902 -25.266 1.00 1.25 H new ATOM 0 HD3 LYS A 145 31.080 33.249 -25.795 1.00 1.25 H new ATOM 0 HE2 LYS A 145 33.142 31.940 -25.281 1.00 1.41 H new ATOM 0 HE3 LYS A 145 32.155 30.593 -24.750 1.00 1.41 H new ATOM 0 HZ1 LYS A 145 32.939 30.272 -26.997 1.00 1.43 H new ATOM 0 HZ2 LYS A 145 31.247 30.411 -26.988 1.00 1.43 H new ATOM 0 HZ3 LYS A 145 32.203 31.716 -27.503 1.00 1.43 H new ATOM 2244 N GLY A 146 32.569 34.220 -21.174 1.00 0.97 N ATOM 2245 CA GLY A 146 33.886 34.786 -21.005 1.00 1.06 C ATOM 2246 C GLY A 146 34.138 35.174 -19.570 1.00 1.00 C ATOM 2247 O GLY A 146 35.257 35.515 -19.195 1.00 1.07 O ATOM 0 H GLY A 146 32.478 33.247 -20.883 1.00 0.97 H new ATOM 0 HA2 GLY A 146 34.638 34.065 -21.326 1.00 1.06 H new ATOM 0 HA3 GLY A 146 33.992 35.662 -21.644 1.00 1.06 H new ATOM 2251 N ASP A 147 33.088 35.118 -18.763 1.00 0.90 N ATOM 2252 CA ASP A 147 33.216 35.364 -17.341 1.00 0.87 C ATOM 2253 C ASP A 147 33.458 34.035 -16.646 1.00 0.72 C ATOM 2254 O ASP A 147 32.673 33.096 -16.810 1.00 0.63 O ATOM 2255 CB ASP A 147 31.954 36.038 -16.803 1.00 0.89 C ATOM 2256 CG ASP A 147 32.207 36.784 -15.510 1.00 1.35 C ATOM 2257 OD1 ASP A 147 32.161 38.023 -15.507 1.00 1.94 O ATOM 2258 OD2 ASP A 147 32.460 36.119 -14.484 1.00 1.60 O ATOM 0 H ASP A 147 32.140 34.904 -19.072 1.00 0.90 H new ATOM 0 HA ASP A 147 34.054 36.034 -17.150 1.00 0.87 H new ATOM 0 HB2 ASP A 147 31.569 36.731 -17.550 1.00 0.89 H new ATOM 0 HB3 ASP A 147 31.184 35.284 -16.640 1.00 0.89 H new ATOM 2263 N LEU A 148 34.552 33.940 -15.910 1.00 0.75 N ATOM 2264 CA LEU A 148 34.934 32.686 -15.283 1.00 0.66 C ATOM 2265 C LEU A 148 34.005 32.374 -14.130 1.00 0.60 C ATOM 2266 O LEU A 148 33.517 33.271 -13.450 1.00 0.63 O ATOM 2267 CB LEU A 148 36.384 32.732 -14.804 1.00 0.75 C ATOM 2268 CG LEU A 148 37.427 32.929 -15.908 1.00 0.93 C ATOM 2269 CD1 LEU A 148 38.826 32.943 -15.319 1.00 1.46 C ATOM 2270 CD2 LEU A 148 37.314 31.835 -16.963 1.00 1.79 C ATOM 0 H LEU A 148 35.191 34.715 -15.732 1.00 0.75 H new ATOM 0 HA LEU A 148 34.851 31.893 -16.026 1.00 0.66 H new ATOM 0 HB2 LEU A 148 36.486 33.541 -14.081 1.00 0.75 H new ATOM 0 HB3 LEU A 148 36.606 31.804 -14.277 1.00 0.75 H new ATOM 0 HG LEU A 148 37.236 33.890 -16.386 1.00 0.93 H new ATOM 0 HD11 LEU A 148 39.555 33.084 -16.117 1.00 1.46 H new ATOM 0 HD12 LEU A 148 38.911 33.759 -14.602 1.00 1.46 H new ATOM 0 HD13 LEU A 148 39.018 31.996 -14.815 1.00 1.46 H new ATOM 0 HD21 LEU A 148 38.065 31.996 -17.736 1.00 1.79 H new ATOM 0 HD22 LEU A 148 37.476 30.863 -16.498 1.00 1.79 H new ATOM 0 HD23 LEU A 148 36.321 31.862 -17.411 1.00 1.79 H new ATOM 2282 N VAL A 149 33.755 31.102 -13.908 1.00 0.53 N ATOM 2283 CA VAL A 149 32.760 30.714 -12.943 1.00 0.48 C ATOM 2284 C VAL A 149 33.177 29.460 -12.184 1.00 0.46 C ATOM 2285 O VAL A 149 33.861 28.583 -12.721 1.00 0.49 O ATOM 2286 CB VAL A 149 31.395 30.510 -13.638 1.00 0.50 C ATOM 2287 CG1 VAL A 149 31.374 29.248 -14.479 1.00 1.16 C ATOM 2288 CG2 VAL A 149 30.261 30.524 -12.637 1.00 1.10 C ATOM 0 H VAL A 149 34.224 30.328 -14.379 1.00 0.53 H new ATOM 0 HA VAL A 149 32.664 31.518 -12.213 1.00 0.48 H new ATOM 0 HB VAL A 149 31.249 31.351 -14.316 1.00 0.50 H new ATOM 0 HG11 VAL A 149 30.397 29.141 -14.951 1.00 1.16 H new ATOM 0 HG12 VAL A 149 32.143 29.311 -15.249 1.00 1.16 H new ATOM 0 HG13 VAL A 149 31.566 28.384 -13.843 1.00 1.16 H new ATOM 0 HG21 VAL A 149 29.314 30.378 -13.157 1.00 1.10 H new ATOM 0 HG22 VAL A 149 30.405 29.722 -11.913 1.00 1.10 H new ATOM 0 HG23 VAL A 149 30.246 31.482 -12.118 1.00 1.10 H new ATOM 2298 N SER A 150 32.779 29.404 -10.926 1.00 0.46 N ATOM 2299 CA SER A 150 33.044 28.258 -10.078 1.00 0.47 C ATOM 2300 C SER A 150 31.741 27.538 -9.769 1.00 0.41 C ATOM 2301 O SER A 150 30.688 28.169 -9.666 1.00 0.49 O ATOM 2302 CB SER A 150 33.740 28.701 -8.784 1.00 0.59 C ATOM 2303 OG SER A 150 33.049 29.775 -8.163 1.00 1.44 O ATOM 0 H SER A 150 32.263 30.153 -10.464 1.00 0.46 H new ATOM 0 HA SER A 150 33.709 27.571 -10.602 1.00 0.47 H new ATOM 0 HB2 SER A 150 33.800 27.859 -8.095 1.00 0.59 H new ATOM 0 HB3 SER A 150 34.763 29.005 -9.006 1.00 0.59 H new ATOM 0 HG SER A 150 32.567 30.290 -8.843 1.00 1.44 H new ATOM 2309 N PHE A 151 31.809 26.220 -9.660 1.00 0.34 N ATOM 2310 CA PHE A 151 30.628 25.400 -9.425 1.00 0.34 C ATOM 2311 C PHE A 151 31.038 24.003 -8.991 1.00 0.41 C ATOM 2312 O PHE A 151 32.161 23.565 -9.246 1.00 0.49 O ATOM 2313 CB PHE A 151 29.760 25.323 -10.689 1.00 0.30 C ATOM 2314 CG PHE A 151 30.547 25.044 -11.933 1.00 0.35 C ATOM 2315 CD1 PHE A 151 30.997 26.089 -12.719 1.00 0.39 C ATOM 2316 CD2 PHE A 151 30.850 23.748 -12.305 1.00 0.47 C ATOM 2317 CE1 PHE A 151 31.742 25.851 -13.855 1.00 0.53 C ATOM 2318 CE2 PHE A 151 31.587 23.497 -13.442 1.00 0.59 C ATOM 2319 CZ PHE A 151 32.036 24.551 -14.220 1.00 0.61 C ATOM 0 H PHE A 151 32.678 25.690 -9.731 1.00 0.34 H new ATOM 0 HA PHE A 151 30.042 25.862 -8.630 1.00 0.34 H new ATOM 0 HB2 PHE A 151 29.010 24.543 -10.559 1.00 0.30 H new ATOM 0 HB3 PHE A 151 29.223 26.264 -10.810 1.00 0.30 H new ATOM 0 HD1 PHE A 151 30.762 27.105 -12.439 1.00 0.39 H new ATOM 0 HD2 PHE A 151 30.506 22.923 -11.698 1.00 0.47 H new ATOM 0 HE1 PHE A 151 32.094 26.676 -14.456 1.00 0.53 H new ATOM 0 HE2 PHE A 151 31.814 22.480 -13.726 1.00 0.59 H new ATOM 0 HZ PHE A 151 32.615 24.357 -15.111 1.00 0.61 H new ATOM 2329 N ARG A 152 30.134 23.308 -8.327 1.00 0.44 N ATOM 2330 CA ARG A 152 30.408 21.957 -7.882 1.00 0.51 C ATOM 2331 C ARG A 152 29.320 21.025 -8.396 1.00 0.50 C ATOM 2332 O ARG A 152 28.133 21.278 -8.208 1.00 0.54 O ATOM 2333 CB ARG A 152 30.459 21.901 -6.350 1.00 0.69 C ATOM 2334 CG ARG A 152 31.013 23.164 -5.706 1.00 0.94 C ATOM 2335 CD ARG A 152 31.019 23.069 -4.186 1.00 1.05 C ATOM 2336 NE ARG A 152 31.222 24.376 -3.562 1.00 1.29 N ATOM 2337 CZ ARG A 152 31.724 24.565 -2.340 1.00 1.57 C ATOM 2338 NH1 ARG A 152 32.093 23.527 -1.592 1.00 2.03 N ATOM 2339 NH2 ARG A 152 31.844 25.796 -1.862 1.00 2.20 N ATOM 0 H ARG A 152 29.206 23.656 -8.085 1.00 0.44 H new ATOM 0 HA ARG A 152 31.375 21.642 -8.275 1.00 0.51 H new ATOM 0 HB2 ARG A 152 29.454 21.721 -5.969 1.00 0.69 H new ATOM 0 HB3 ARG A 152 31.071 21.052 -6.047 1.00 0.69 H new ATOM 0 HG2 ARG A 152 32.028 23.339 -6.063 1.00 0.94 H new ATOM 0 HG3 ARG A 152 30.415 24.021 -6.014 1.00 0.94 H new ATOM 0 HD2 ARG A 152 30.074 22.646 -3.844 1.00 1.05 H new ATOM 0 HD3 ARG A 152 31.808 22.387 -3.867 1.00 1.05 H new ATOM 0 HE ARG A 152 30.961 25.203 -4.100 1.00 1.29 H new ATOM 0 HH11 ARG A 152 31.993 22.578 -1.952 1.00 2.03 H new ATOM 0 HH12 ARG A 152 32.476 23.681 -0.659 1.00 2.03 H new ATOM 0 HH21 ARG A 152 31.553 26.593 -2.428 1.00 2.20 H new ATOM 0 HH22 ARG A 152 32.227 25.946 -0.929 1.00 2.20 H new ATOM 2353 N ILE A 153 29.728 19.980 -9.091 1.00 0.51 N ATOM 2354 CA ILE A 153 28.808 18.936 -9.496 1.00 0.56 C ATOM 2355 C ILE A 153 28.921 17.748 -8.546 1.00 0.65 C ATOM 2356 O ILE A 153 30.002 17.175 -8.380 1.00 0.75 O ATOM 2357 CB ILE A 153 29.042 18.513 -10.967 1.00 0.58 C ATOM 2358 CG1 ILE A 153 28.166 17.320 -11.346 1.00 1.23 C ATOM 2359 CG2 ILE A 153 30.501 18.192 -11.222 1.00 0.93 C ATOM 2360 CD1 ILE A 153 28.275 16.949 -12.807 1.00 1.24 C ATOM 0 H ILE A 153 30.693 19.832 -9.387 1.00 0.51 H new ATOM 0 HA ILE A 153 27.792 19.328 -9.440 1.00 0.56 H new ATOM 0 HB ILE A 153 28.762 19.359 -11.595 1.00 0.58 H new ATOM 0 HG12 ILE A 153 28.448 16.461 -10.737 1.00 1.23 H new ATOM 0 HG13 ILE A 153 27.127 17.550 -11.112 1.00 1.23 H new ATOM 0 HG21 ILE A 153 30.632 17.898 -12.263 1.00 0.93 H new ATOM 0 HG22 ILE A 153 31.109 19.072 -11.014 1.00 0.93 H new ATOM 0 HG23 ILE A 153 30.812 17.374 -10.572 1.00 0.93 H new ATOM 0 HD11 ILE A 153 27.630 16.095 -13.015 1.00 1.24 H new ATOM 0 HD12 ILE A 153 27.966 17.795 -13.421 1.00 1.24 H new ATOM 0 HD13 ILE A 153 29.307 16.689 -13.040 1.00 1.24 H new ATOM 2372 N ASP A 154 27.815 17.386 -7.919 1.00 0.71 N ATOM 2373 CA ASP A 154 27.825 16.310 -6.939 1.00 0.82 C ATOM 2374 C ASP A 154 26.516 15.518 -6.975 1.00 0.96 C ATOM 2375 O ASP A 154 26.313 14.704 -7.872 1.00 1.09 O ATOM 2376 CB ASP A 154 28.122 16.861 -5.530 1.00 0.84 C ATOM 2377 CG ASP A 154 27.163 17.958 -5.085 1.00 1.45 C ATOM 2378 OD1 ASP A 154 27.285 19.094 -5.591 1.00 1.92 O ATOM 2379 OD2 ASP A 154 26.308 17.694 -4.222 1.00 1.73 O ATOM 0 H ASP A 154 26.903 17.817 -8.069 1.00 0.71 H new ATOM 0 HA ASP A 154 28.626 15.617 -7.199 1.00 0.82 H new ATOM 0 HB2 ASP A 154 28.080 16.041 -4.813 1.00 0.84 H new ATOM 0 HB3 ASP A 154 29.140 17.250 -5.509 1.00 0.84 H new ATOM 2384 N GLU A 155 25.615 15.789 -6.039 1.00 1.00 N ATOM 2385 CA GLU A 155 24.368 15.042 -5.920 1.00 1.17 C ATOM 2386 C GLU A 155 23.365 15.520 -6.954 1.00 1.23 C ATOM 2387 O GLU A 155 22.520 14.760 -7.413 1.00 1.46 O ATOM 2388 CB GLU A 155 23.776 15.201 -4.515 1.00 1.25 C ATOM 2389 CG GLU A 155 24.684 14.709 -3.403 1.00 1.32 C ATOM 2390 CD GLU A 155 24.022 13.658 -2.541 1.00 2.00 C ATOM 2391 OE1 GLU A 155 23.140 14.012 -1.723 1.00 2.28 O ATOM 2392 OE2 GLU A 155 24.377 12.470 -2.676 1.00 2.76 O ATOM 0 H GLU A 155 25.726 16.528 -5.345 1.00 1.00 H new ATOM 0 HA GLU A 155 24.585 13.988 -6.094 1.00 1.17 H new ATOM 0 HB2 GLU A 155 23.548 16.253 -4.345 1.00 1.25 H new ATOM 0 HB3 GLU A 155 22.832 14.658 -4.466 1.00 1.25 H new ATOM 0 HG2 GLU A 155 25.595 14.298 -3.837 1.00 1.32 H new ATOM 0 HG3 GLU A 155 24.980 15.553 -2.780 1.00 1.32 H new ATOM 2399 N SER A 156 23.479 16.785 -7.327 1.00 1.10 N ATOM 2400 CA SER A 156 22.566 17.379 -8.290 1.00 1.19 C ATOM 2401 C SER A 156 22.866 16.883 -9.704 1.00 1.14 C ATOM 2402 O SER A 156 22.026 16.990 -10.598 1.00 1.27 O ATOM 2403 CB SER A 156 22.673 18.909 -8.235 1.00 1.17 C ATOM 2404 OG SER A 156 21.856 19.526 -9.213 1.00 1.98 O ATOM 0 H SER A 156 24.196 17.421 -6.977 1.00 1.10 H new ATOM 0 HA SER A 156 21.550 17.079 -8.032 1.00 1.19 H new ATOM 0 HB2 SER A 156 22.382 19.259 -7.244 1.00 1.17 H new ATOM 0 HB3 SER A 156 23.710 19.207 -8.387 1.00 1.17 H new ATOM 0 HG SER A 156 21.947 20.500 -9.149 1.00 1.98 H new ATOM 2410 N GLY A 157 24.060 16.325 -9.897 1.00 1.04 N ATOM 2411 CA GLY A 157 24.471 15.885 -11.226 1.00 1.09 C ATOM 2412 C GLY A 157 24.514 17.027 -12.225 1.00 1.02 C ATOM 2413 O GLY A 157 24.446 16.813 -13.434 1.00 1.27 O ATOM 0 H GLY A 157 24.749 16.169 -9.162 1.00 1.04 H new ATOM 0 HA2 GLY A 157 25.456 15.422 -11.164 1.00 1.09 H new ATOM 0 HA3 GLY A 157 23.781 15.120 -11.582 1.00 1.09 H new ATOM 2417 N ARG A 158 24.633 18.240 -11.708 1.00 0.79 N ATOM 2418 CA ARG A 158 24.660 19.444 -12.525 1.00 0.72 C ATOM 2419 C ARG A 158 25.676 20.409 -11.948 1.00 0.56 C ATOM 2420 O ARG A 158 26.417 20.057 -11.035 1.00 0.57 O ATOM 2421 CB ARG A 158 23.293 20.135 -12.546 1.00 0.85 C ATOM 2422 CG ARG A 158 22.167 19.315 -13.148 1.00 1.47 C ATOM 2423 CD ARG A 158 20.886 20.132 -13.195 1.00 1.52 C ATOM 2424 NE ARG A 158 19.750 19.370 -13.715 1.00 2.12 N ATOM 2425 CZ ARG A 158 18.954 19.800 -14.697 1.00 2.75 C ATOM 2426 NH1 ARG A 158 19.203 20.959 -15.288 1.00 3.00 N ATOM 2427 NH2 ARG A 158 17.908 19.074 -15.078 1.00 3.61 N ATOM 0 H ARG A 158 24.714 18.418 -10.707 1.00 0.79 H new ATOM 0 HA ARG A 158 24.924 19.158 -13.543 1.00 0.72 H new ATOM 0 HB2 ARG A 158 23.022 20.401 -11.524 1.00 0.85 H new ATOM 0 HB3 ARG A 158 23.382 21.066 -13.105 1.00 0.85 H new ATOM 0 HG2 ARG A 158 22.439 18.994 -14.154 1.00 1.47 H new ATOM 0 HG3 ARG A 158 22.009 18.413 -12.557 1.00 1.47 H new ATOM 0 HD2 ARG A 158 20.651 20.489 -12.192 1.00 1.52 H new ATOM 0 HD3 ARG A 158 21.044 21.012 -13.818 1.00 1.52 H new ATOM 0 HE ARG A 158 19.555 18.457 -13.303 1.00 2.12 H new ATOM 0 HH11 ARG A 158 20.001 21.521 -14.993 1.00 3.00 H new ATOM 0 HH12 ARG A 158 18.596 21.290 -16.038 1.00 3.00 H new ATOM 0 HH21 ARG A 158 17.711 18.184 -14.620 1.00 3.61 H new ATOM 0 HH22 ARG A 158 17.303 19.406 -15.829 1.00 3.61 H new ATOM 2441 N ALA A 159 25.707 21.625 -12.462 1.00 0.48 N ATOM 2442 CA ALA A 159 26.563 22.646 -11.891 1.00 0.39 C ATOM 2443 C ALA A 159 25.834 23.358 -10.755 1.00 0.39 C ATOM 2444 O ALA A 159 24.893 24.116 -10.991 1.00 0.48 O ATOM 2445 CB ALA A 159 26.992 23.633 -12.966 1.00 0.37 C ATOM 0 H ALA A 159 25.155 21.927 -13.265 1.00 0.48 H new ATOM 0 HA ALA A 159 27.459 22.177 -11.485 1.00 0.39 H new ATOM 0 HB1 ALA A 159 27.635 24.395 -12.525 1.00 0.37 H new ATOM 0 HB2 ALA A 159 27.539 23.105 -13.747 1.00 0.37 H new ATOM 0 HB3 ALA A 159 26.110 24.107 -13.397 1.00 0.37 H new ATOM 2451 N ALA A 160 26.252 23.088 -9.523 1.00 0.38 N ATOM 2452 CA ALA A 160 25.648 23.709 -8.353 1.00 0.41 C ATOM 2453 C ALA A 160 26.622 24.685 -7.719 1.00 0.41 C ATOM 2454 O ALA A 160 27.822 24.613 -7.979 1.00 0.42 O ATOM 2455 CB ALA A 160 25.225 22.649 -7.348 1.00 0.49 C ATOM 0 H ALA A 160 27.010 22.440 -9.310 1.00 0.38 H new ATOM 0 HA ALA A 160 24.760 24.257 -8.667 1.00 0.41 H new ATOM 0 HB1 ALA A 160 24.775 23.130 -6.479 1.00 0.49 H new ATOM 0 HB2 ALA A 160 24.498 21.980 -7.809 1.00 0.49 H new ATOM 0 HB3 ALA A 160 26.098 22.076 -7.034 1.00 0.49 H new ATOM 2461 N CYS A 161 26.107 25.595 -6.893 1.00 0.47 N ATOM 2462 CA CYS A 161 26.940 26.599 -6.235 1.00 0.51 C ATOM 2463 C CYS A 161 27.637 27.477 -7.280 1.00 0.42 C ATOM 2464 O CYS A 161 28.781 27.895 -7.102 1.00 0.49 O ATOM 2465 CB CYS A 161 27.968 25.909 -5.319 1.00 0.63 C ATOM 2466 SG CYS A 161 28.991 27.030 -4.326 1.00 1.55 S ATOM 0 H CYS A 161 25.115 25.657 -6.664 1.00 0.47 H new ATOM 0 HA CYS A 161 26.309 27.242 -5.621 1.00 0.51 H new ATOM 0 HB2 CYS A 161 27.437 25.235 -4.646 1.00 0.63 H new ATOM 0 HB3 CYS A 161 28.624 25.293 -5.934 1.00 0.63 H new ATOM 0 HG CYS A 161 29.407 28.011 -5.070 1.00 1.55 H new ATOM 2472 N VAL A 162 26.922 27.766 -8.366 1.00 0.37 N ATOM 2473 CA VAL A 162 27.463 28.556 -9.465 1.00 0.35 C ATOM 2474 C VAL A 162 27.803 29.972 -9.009 1.00 0.39 C ATOM 2475 O VAL A 162 26.921 30.775 -8.680 1.00 0.48 O ATOM 2476 CB VAL A 162 26.477 28.617 -10.648 1.00 0.45 C ATOM 2477 CG1 VAL A 162 27.037 29.454 -11.787 1.00 1.15 C ATOM 2478 CG2 VAL A 162 26.145 27.219 -11.135 1.00 1.26 C ATOM 0 H VAL A 162 25.959 27.461 -8.506 1.00 0.37 H new ATOM 0 HA VAL A 162 28.377 28.063 -9.796 1.00 0.35 H new ATOM 0 HB VAL A 162 25.561 29.093 -10.297 1.00 0.45 H new ATOM 0 HG11 VAL A 162 26.320 29.479 -12.607 1.00 1.15 H new ATOM 0 HG12 VAL A 162 27.222 30.469 -11.436 1.00 1.15 H new ATOM 0 HG13 VAL A 162 27.972 29.015 -12.136 1.00 1.15 H new ATOM 0 HG21 VAL A 162 25.448 27.281 -11.970 1.00 1.26 H new ATOM 0 HG22 VAL A 162 27.058 26.721 -11.461 1.00 1.26 H new ATOM 0 HG23 VAL A 162 25.690 26.650 -10.324 1.00 1.26 H new ATOM 2488 N ASN A 163 29.090 30.266 -8.991 1.00 0.43 N ATOM 2489 CA ASN A 163 29.578 31.535 -8.491 1.00 0.53 C ATOM 2490 C ASN A 163 30.554 32.155 -9.477 1.00 0.52 C ATOM 2491 O ASN A 163 31.625 31.598 -9.736 1.00 0.53 O ATOM 2492 CB ASN A 163 30.260 31.337 -7.137 1.00 0.67 C ATOM 2493 CG ASN A 163 30.721 32.643 -6.516 1.00 1.29 C ATOM 2494 OD1 ASN A 163 31.846 32.601 -5.815 1.00 1.96 O flip ATOM 2495 ND2 ASN A 163 30.078 33.681 -6.671 1.00 2.05 N flip ATOM 0 H ASN A 163 29.821 29.636 -9.321 1.00 0.43 H new ATOM 0 HA ASN A 163 28.730 32.209 -8.369 1.00 0.53 H new ATOM 0 HB2 ASN A 163 29.569 30.840 -6.456 1.00 0.67 H new ATOM 0 HB3 ASN A 163 31.118 30.675 -7.260 1.00 0.67 H new ATOM 0 HD21 ASN A 163 29.217 33.671 -7.218 1.00 2.05 H new ATOM 0 HD22 ASN A 163 30.406 34.551 -6.253 1.00 2.05 H new ATOM 2502 N ALA A 164 30.163 33.288 -10.042 1.00 0.53 N ATOM 2503 CA ALA A 164 31.011 34.024 -10.967 1.00 0.56 C ATOM 2504 C ALA A 164 32.311 34.452 -10.296 1.00 0.63 C ATOM 2505 O ALA A 164 32.305 35.004 -9.196 1.00 0.75 O ATOM 2506 CB ALA A 164 30.270 35.237 -11.504 1.00 0.60 C ATOM 0 H ALA A 164 29.255 33.721 -9.873 1.00 0.53 H new ATOM 0 HA ALA A 164 31.261 33.365 -11.798 1.00 0.56 H new ATOM 0 HB1 ALA A 164 30.914 35.780 -12.195 1.00 0.60 H new ATOM 0 HB2 ALA A 164 29.370 34.912 -12.026 1.00 0.60 H new ATOM 0 HB3 ALA A 164 29.993 35.890 -10.676 1.00 0.60 H new ATOM 2512 N VAL A 165 33.418 34.189 -10.962 1.00 0.62 N ATOM 2513 CA VAL A 165 34.728 34.517 -10.428 1.00 0.70 C ATOM 2514 C VAL A 165 35.481 35.432 -11.386 1.00 0.71 C ATOM 2515 O VAL A 165 35.939 35.005 -12.447 1.00 0.95 O ATOM 2516 CB VAL A 165 35.583 33.255 -10.169 1.00 1.07 C ATOM 2517 CG1 VAL A 165 36.959 33.640 -9.639 1.00 1.43 C ATOM 2518 CG2 VAL A 165 34.886 32.314 -9.203 1.00 1.56 C ATOM 0 H VAL A 165 33.437 33.746 -11.881 1.00 0.62 H new ATOM 0 HA VAL A 165 34.562 35.023 -9.477 1.00 0.70 H new ATOM 0 HB VAL A 165 35.710 32.733 -11.118 1.00 1.07 H new ATOM 0 HG11 VAL A 165 37.546 32.739 -9.463 1.00 1.43 H new ATOM 0 HG12 VAL A 165 37.468 34.268 -10.370 1.00 1.43 H new ATOM 0 HG13 VAL A 165 36.848 34.189 -8.704 1.00 1.43 H new ATOM 0 HG21 VAL A 165 35.509 31.435 -9.038 1.00 1.56 H new ATOM 0 HG22 VAL A 165 34.720 32.824 -8.254 1.00 1.56 H new ATOM 0 HG23 VAL A 165 33.928 32.007 -9.622 1.00 1.56 H new ATOM 2528 N ARG A 166 35.605 36.694 -11.012 1.00 0.84 N ATOM 2529 CA ARG A 166 36.378 37.629 -11.802 1.00 1.15 C ATOM 2530 C ARG A 166 37.839 37.564 -11.375 1.00 1.13 C ATOM 2531 O ARG A 166 38.186 37.909 -10.247 1.00 1.05 O ATOM 2532 CB ARG A 166 35.825 39.051 -11.672 1.00 1.51 C ATOM 2533 CG ARG A 166 34.528 39.269 -12.447 1.00 1.76 C ATOM 2534 CD ARG A 166 33.329 38.618 -11.768 1.00 1.58 C ATOM 2535 NE ARG A 166 32.244 38.364 -12.715 1.00 1.94 N ATOM 2536 CZ ARG A 166 30.957 38.638 -12.503 1.00 2.24 C ATOM 2537 NH1 ARG A 166 30.554 39.221 -11.378 1.00 2.45 N ATOM 2538 NH2 ARG A 166 30.073 38.330 -13.441 1.00 2.94 N ATOM 0 H ARG A 166 35.183 37.090 -10.172 1.00 0.84 H new ATOM 0 HA ARG A 166 36.304 37.352 -12.854 1.00 1.15 H new ATOM 0 HB2 ARG A 166 35.652 39.271 -10.619 1.00 1.51 H new ATOM 0 HB3 ARG A 166 36.575 39.759 -12.026 1.00 1.51 H new ATOM 0 HG2 ARG A 166 34.346 40.339 -12.552 1.00 1.76 H new ATOM 0 HG3 ARG A 166 34.637 38.864 -13.453 1.00 1.76 H new ATOM 0 HD2 ARG A 166 33.637 37.680 -11.307 1.00 1.58 H new ATOM 0 HD3 ARG A 166 32.969 39.264 -10.967 1.00 1.58 H new ATOM 0 HE ARG A 166 32.492 37.943 -13.610 1.00 1.94 H new ATOM 0 HH11 ARG A 166 31.234 39.467 -10.659 1.00 2.45 H new ATOM 0 HH12 ARG A 166 29.565 39.423 -11.234 1.00 2.45 H new ATOM 0 HH21 ARG A 166 30.382 37.890 -14.308 1.00 2.94 H new ATOM 0 HH22 ARG A 166 29.084 38.532 -13.296 1.00 2.94 H new