USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 759 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 137 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 138 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 117 LYS NZ :NH3+ -168:sc= 0.472 (180deg=0) USER MOD Set 2.2: A 126 ASN : amide:sc= 0.349 K(o=0.82,f=-4.9!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 159:sc= -0.0559 (180deg=-0.689) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -3.15! C(o=-3.1!,f=-9.1!) USER MOD Single : A 79 HIS : no HD1:sc= -2.18! K(o=-2.2!,f=-0.81) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 150:sc= 0 USER MOD Single : A 98 SER OG : rot 20:sc= 0.00811 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 GLN : amide:sc= -0.0898 K(o=-0.09,f=-2.2) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ -128:sc= 0 (180deg=-1.12!) USER MOD Single : A 118 TYR OH : rot -80:sc= 1.02 USER MOD Single : A 124 LYS NZ :NH3+ 162:sc=-0.00178 (180deg=-0.14) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= -2.2! K(o=-2.2!,f=-0.62) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 HIS : no HE2:sc= -0.73 K(o=-0.73,f=-1.6!) USER MOD Single : A 139 SER OG : rot -120:sc= -0.828 USER MOD Single : A 141 SER OG : rot 22:sc= -0.282 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 GLN : amide:sc= -0.204 K(o=-0.2,f=1.6) USER MOD ----------------------------------------------------------------- ATOM 1 N TRP A 60 0.474 -0.023 -2.684 1.00 21.41 N ATOM 2 CA TRP A 60 1.392 -0.647 -1.738 1.00 24.12 C ATOM 3 C TRP A 60 1.835 -2.020 -2.233 1.00 10.41 C ATOM 4 O TRP A 60 2.978 -2.200 -2.653 1.00 40.44 O ATOM 5 CB TRP A 60 0.732 -0.775 -0.364 1.00 24.31 C ATOM 6 CG TRP A 60 1.717 -0.838 0.764 1.00 32.25 C ATOM 7 CD1 TRP A 60 1.898 0.093 1.746 1.00 5.44 C ATOM 8 CD2 TRP A 60 2.655 -1.887 1.025 1.00 24.44 C ATOM 9 NE1 TRP A 60 2.894 -0.313 2.602 1.00 34.51 N ATOM 10 CE2 TRP A 60 3.373 -1.526 2.182 1.00 4.22 C ATOM 11 CE3 TRP A 60 2.958 -3.098 0.396 1.00 12.20 C ATOM 12 CZ2 TRP A 60 4.374 -2.331 2.719 1.00 61.41 C ATOM 13 CZ3 TRP A 60 3.951 -3.896 0.930 1.00 64.12 C ATOM 14 CH2 TRP A 60 4.649 -3.511 2.082 1.00 4.02 C ATOM 0 HA TRP A 60 2.273 -0.011 -1.652 1.00 24.12 H new ATOM 0 HB2 TRP A 60 0.066 0.074 -0.208 1.00 24.31 H new ATOM 0 HB3 TRP A 60 0.114 -1.673 -0.348 1.00 24.31 H new ATOM 0 HD1 TRP A 60 1.340 1.013 1.837 1.00 5.44 H new ATOM 0 HE1 TRP A 60 3.223 0.205 3.417 1.00 34.51 H new ATOM 0 HE3 TRP A 60 2.425 -3.404 -0.492 1.00 12.20 H new ATOM 0 HZ2 TRP A 60 4.914 -2.035 3.606 1.00 61.41 H new ATOM 0 HZ3 TRP A 60 4.194 -4.833 0.451 1.00 64.12 H new ATOM 0 HH2 TRP A 60 5.419 -4.158 2.475 1.00 4.02 H new ATOM 25 N PHE A 61 0.923 -2.985 -2.181 1.00 24.04 N ATOM 26 CA PHE A 61 1.221 -4.342 -2.623 1.00 72.25 C ATOM 27 C PHE A 61 0.177 -4.829 -3.624 1.00 53.00 C ATOM 28 O PHE A 61 -0.971 -4.383 -3.607 1.00 42.15 O ATOM 29 CB PHE A 61 1.277 -5.292 -1.425 1.00 12.20 C ATOM 30 CG PHE A 61 0.872 -6.700 -1.756 1.00 45.24 C ATOM 31 CD1 PHE A 61 1.628 -7.464 -2.631 1.00 52.12 C ATOM 32 CD2 PHE A 61 -0.263 -7.259 -1.193 1.00 74.25 C ATOM 33 CE1 PHE A 61 1.259 -8.760 -2.938 1.00 72.11 C ATOM 34 CE2 PHE A 61 -0.637 -8.555 -1.496 1.00 51.12 C ATOM 35 CZ PHE A 61 0.124 -9.306 -2.371 1.00 2.25 C ATOM 0 H PHE A 61 -0.028 -2.852 -1.837 1.00 24.04 H new ATOM 0 HA PHE A 61 2.194 -4.331 -3.114 1.00 72.25 H new ATOM 0 HB2 PHE A 61 2.291 -5.299 -1.024 1.00 12.20 H new ATOM 0 HB3 PHE A 61 0.626 -4.911 -0.638 1.00 12.20 H new ATOM 0 HD1 PHE A 61 2.516 -7.042 -3.078 1.00 52.12 H new ATOM 0 HD2 PHE A 61 -0.863 -6.676 -0.510 1.00 74.25 H new ATOM 0 HE1 PHE A 61 1.857 -9.345 -3.620 1.00 72.11 H new ATOM 0 HE2 PHE A 61 -1.523 -8.980 -1.049 1.00 51.12 H new ATOM 0 HZ PHE A 61 -0.168 -10.318 -2.611 1.00 2.25 H new ATOM 45 N PHE A 62 0.583 -5.747 -4.495 1.00 42.40 N ATOM 46 CA PHE A 62 -0.316 -6.294 -5.505 1.00 3.44 C ATOM 47 C PHE A 62 -0.105 -7.797 -5.663 1.00 40.55 C ATOM 48 O PHE A 62 1.019 -8.289 -5.579 1.00 61.22 O ATOM 49 CB PHE A 62 -0.097 -5.592 -6.847 1.00 10.14 C ATOM 50 CG PHE A 62 -0.939 -4.361 -7.023 1.00 41.35 C ATOM 51 CD1 PHE A 62 -0.639 -3.195 -6.337 1.00 24.42 C ATOM 52 CD2 PHE A 62 -2.031 -4.369 -7.876 1.00 51.11 C ATOM 53 CE1 PHE A 62 -1.411 -2.060 -6.498 1.00 30.55 C ATOM 54 CE2 PHE A 62 -2.807 -3.237 -8.041 1.00 61.02 C ATOM 55 CZ PHE A 62 -2.497 -2.082 -7.350 1.00 53.21 C ATOM 0 H PHE A 62 1.529 -6.128 -4.522 1.00 42.40 H new ATOM 0 HA PHE A 62 -1.341 -6.121 -5.176 1.00 3.44 H new ATOM 0 HB2 PHE A 62 0.954 -5.320 -6.938 1.00 10.14 H new ATOM 0 HB3 PHE A 62 -0.316 -6.291 -7.654 1.00 10.14 H new ATOM 0 HD1 PHE A 62 0.209 -3.173 -5.668 1.00 24.42 H new ATOM 0 HD2 PHE A 62 -2.279 -5.270 -8.418 1.00 51.11 H new ATOM 0 HE1 PHE A 62 -1.165 -1.157 -5.958 1.00 30.55 H new ATOM 0 HE2 PHE A 62 -3.655 -3.256 -8.710 1.00 61.02 H new ATOM 0 HZ PHE A 62 -3.103 -1.197 -7.476 1.00 53.21 H new ATOM 65 N GLY A 63 -1.196 -8.520 -5.894 1.00 35.24 N ATOM 66 CA GLY A 63 -1.111 -9.959 -6.060 1.00 20.32 C ATOM 67 C GLY A 63 -0.996 -10.369 -7.515 1.00 35.13 C ATOM 68 O GLY A 63 -1.909 -10.135 -8.308 1.00 2.44 O ATOM 0 H GLY A 63 -2.138 -8.135 -5.969 1.00 35.24 H new ATOM 0 HA2 GLY A 63 -0.248 -10.335 -5.511 1.00 20.32 H new ATOM 0 HA3 GLY A 63 -1.994 -10.425 -5.623 1.00 20.32 H new ATOM 72 N LYS A 64 0.128 -10.982 -7.868 1.00 42.03 N ATOM 73 CA LYS A 64 0.360 -11.425 -9.238 1.00 24.42 C ATOM 74 C LYS A 64 -0.042 -10.344 -10.235 1.00 61.05 C ATOM 75 O LYS A 64 -1.214 -10.220 -10.592 1.00 31.52 O ATOM 76 CB LYS A 64 -0.422 -12.710 -9.519 1.00 62.32 C ATOM 77 CG LYS A 64 0.218 -13.954 -8.927 1.00 62.02 C ATOM 78 CD LYS A 64 -0.800 -14.810 -8.193 1.00 14.42 C ATOM 79 CE LYS A 64 -1.147 -14.221 -6.834 1.00 1.50 C ATOM 80 NZ LYS A 64 -2.613 -14.248 -6.575 1.00 71.10 N ATOM 0 H LYS A 64 0.893 -11.184 -7.224 1.00 42.03 H new ATOM 0 HA LYS A 64 1.426 -11.623 -9.354 1.00 24.42 H new ATOM 0 HB2 LYS A 64 -1.431 -12.606 -9.120 1.00 62.32 H new ATOM 0 HB3 LYS A 64 -0.517 -12.839 -10.597 1.00 62.32 H new ATOM 0 HG2 LYS A 64 0.681 -14.539 -9.722 1.00 62.02 H new ATOM 0 HG3 LYS A 64 1.013 -13.663 -8.240 1.00 62.02 H new ATOM 0 HD2 LYS A 64 -1.705 -14.898 -8.795 1.00 14.42 H new ATOM 0 HD3 LYS A 64 -0.404 -15.817 -8.064 1.00 14.42 H new ATOM 0 HE2 LYS A 64 -0.630 -14.780 -6.054 1.00 1.50 H new ATOM 0 HE3 LYS A 64 -0.788 -13.193 -6.781 1.00 1.50 H new ATOM 0 HZ1 LYS A 64 -2.808 -13.838 -5.639 1.00 71.10 H new ATOM 0 HZ2 LYS A 64 -3.105 -13.694 -7.305 1.00 71.10 H new ATOM 0 HZ3 LYS A 64 -2.952 -15.231 -6.600 1.00 71.10 H new ATOM 94 N ILE A 65 0.937 -9.565 -10.683 1.00 51.12 N ATOM 95 CA ILE A 65 0.684 -8.496 -11.642 1.00 22.33 C ATOM 96 C ILE A 65 1.877 -8.298 -12.571 1.00 73.12 C ATOM 97 O ILE A 65 3.023 -8.191 -12.136 1.00 44.41 O ATOM 98 CB ILE A 65 0.374 -7.165 -10.932 1.00 20.10 C ATOM 99 CG1 ILE A 65 1.556 -6.741 -10.057 1.00 74.12 C ATOM 100 CG2 ILE A 65 -0.891 -7.292 -10.097 1.00 74.30 C ATOM 101 CD1 ILE A 65 2.217 -5.460 -10.515 1.00 63.20 C ATOM 0 H ILE A 65 1.912 -9.654 -10.398 1.00 51.12 H new ATOM 0 HA ILE A 65 -0.184 -8.796 -12.228 1.00 22.33 H new ATOM 0 HB ILE A 65 0.211 -6.397 -11.688 1.00 20.10 H new ATOM 0 HG12 ILE A 65 1.211 -6.616 -9.031 1.00 74.12 H new ATOM 0 HG13 ILE A 65 2.297 -7.540 -10.049 1.00 74.12 H new ATOM 0 HG21 ILE A 65 -1.097 -6.343 -9.602 1.00 74.30 H new ATOM 0 HG22 ILE A 65 -1.729 -7.553 -10.743 1.00 74.30 H new ATOM 0 HG23 ILE A 65 -0.755 -8.071 -9.347 1.00 74.30 H new ATOM 0 HD11 ILE A 65 3.046 -5.220 -9.849 1.00 63.20 H new ATOM 0 HD12 ILE A 65 2.592 -5.587 -11.530 1.00 63.20 H new ATOM 0 HD13 ILE A 65 1.490 -4.648 -10.496 1.00 63.20 H new ATOM 113 N PRO A 66 1.602 -8.247 -13.883 1.00 42.51 N ATOM 114 CA PRO A 66 2.639 -8.058 -14.902 1.00 62.30 C ATOM 115 C PRO A 66 3.234 -6.655 -14.871 1.00 52.55 C ATOM 116 O PRO A 66 2.535 -5.680 -14.594 1.00 32.05 O ATOM 117 CB PRO A 66 1.891 -8.294 -16.217 1.00 5.22 C ATOM 118 CG PRO A 66 0.470 -7.971 -15.908 1.00 4.34 C ATOM 119 CD PRO A 66 0.258 -8.367 -14.473 1.00 23.53 C ATOM 0 HA PRO A 66 3.486 -8.728 -14.751 1.00 62.30 H new ATOM 0 HB2 PRO A 66 2.278 -7.657 -17.012 1.00 5.22 H new ATOM 0 HB3 PRO A 66 1.998 -9.325 -16.554 1.00 5.22 H new ATOM 0 HG2 PRO A 66 0.271 -6.909 -16.053 1.00 4.34 H new ATOM 0 HG3 PRO A 66 -0.206 -8.515 -16.567 1.00 4.34 H new ATOM 0 HD2 PRO A 66 -0.458 -7.712 -13.977 1.00 23.53 H new ATOM 0 HD3 PRO A 66 -0.128 -9.383 -14.389 1.00 23.53 H new ATOM 127 N ARG A 67 4.528 -6.559 -15.159 1.00 52.33 N ATOM 128 CA ARG A 67 5.216 -5.274 -15.164 1.00 2.51 C ATOM 129 C ARG A 67 4.367 -4.204 -15.846 1.00 23.44 C ATOM 130 O ARG A 67 4.407 -3.033 -15.470 1.00 65.21 O ATOM 131 CB ARG A 67 6.566 -5.397 -15.873 1.00 2.32 C ATOM 132 CG ARG A 67 6.526 -6.279 -17.110 1.00 3.02 C ATOM 133 CD ARG A 67 7.197 -7.621 -16.859 1.00 41.50 C ATOM 134 NE ARG A 67 8.581 -7.467 -16.418 1.00 52.30 N ATOM 135 CZ ARG A 67 9.594 -7.233 -17.245 1.00 11.13 C ATOM 136 NH1 ARG A 67 9.379 -7.126 -18.549 1.00 32.14 N ATOM 137 NH2 ARG A 67 10.825 -7.105 -16.767 1.00 44.24 N ATOM 0 H ARG A 67 5.121 -7.356 -15.392 1.00 52.33 H new ATOM 0 HA ARG A 67 5.382 -4.976 -14.129 1.00 2.51 H new ATOM 0 HB2 ARG A 67 6.909 -4.402 -16.157 1.00 2.32 H new ATOM 0 HB3 ARG A 67 7.299 -5.800 -15.174 1.00 2.32 H new ATOM 0 HG2 ARG A 67 5.491 -6.439 -17.411 1.00 3.02 H new ATOM 0 HG3 ARG A 67 7.023 -5.771 -17.937 1.00 3.02 H new ATOM 0 HD2 ARG A 67 6.635 -8.172 -16.104 1.00 41.50 H new ATOM 0 HD3 ARG A 67 7.172 -8.215 -17.772 1.00 41.50 H new ATOM 0 HE ARG A 67 8.781 -7.543 -15.421 1.00 52.30 H new ATOM 0 HH11 ARG A 67 8.434 -7.223 -18.920 1.00 32.14 H new ATOM 0 HH12 ARG A 67 10.159 -6.946 -19.181 1.00 32.14 H new ATOM 0 HH21 ARG A 67 10.994 -7.186 -15.764 1.00 44.24 H new ATOM 0 HH22 ARG A 67 11.603 -6.925 -17.402 1.00 44.24 H new ATOM 151 N ALA A 68 3.600 -4.617 -16.850 1.00 2.54 N ATOM 152 CA ALA A 68 2.741 -3.695 -17.582 1.00 71.04 C ATOM 153 C ALA A 68 1.675 -3.097 -16.671 1.00 55.54 C ATOM 154 O ALA A 68 1.500 -1.879 -16.619 1.00 10.12 O ATOM 155 CB ALA A 68 2.093 -4.403 -18.763 1.00 35.44 C ATOM 0 H ALA A 68 3.556 -5.583 -17.174 1.00 2.54 H new ATOM 0 HA ALA A 68 3.360 -2.880 -17.956 1.00 71.04 H new ATOM 0 HB1 ALA A 68 1.454 -3.703 -19.301 1.00 35.44 H new ATOM 0 HB2 ALA A 68 2.867 -4.776 -19.433 1.00 35.44 H new ATOM 0 HB3 ALA A 68 1.493 -5.238 -18.402 1.00 35.44 H new ATOM 161 N LYS A 69 0.962 -3.960 -15.955 1.00 44.12 N ATOM 162 CA LYS A 69 -0.087 -3.517 -15.045 1.00 73.31 C ATOM 163 C LYS A 69 0.453 -2.501 -14.045 1.00 10.53 C ATOM 164 O LYS A 69 -0.118 -1.424 -13.870 1.00 23.42 O ATOM 165 CB LYS A 69 -0.683 -4.714 -14.301 1.00 32.25 C ATOM 166 CG LYS A 69 -2.156 -4.942 -14.595 1.00 43.00 C ATOM 167 CD LYS A 69 -2.354 -5.689 -15.903 1.00 63.41 C ATOM 168 CE LYS A 69 -3.069 -7.014 -15.686 1.00 14.35 C ATOM 169 NZ LYS A 69 -4.527 -6.910 -15.974 1.00 22.52 N ATOM 0 H LYS A 69 1.092 -4.971 -15.988 1.00 44.12 H new ATOM 0 HA LYS A 69 -0.868 -3.038 -15.636 1.00 73.31 H new ATOM 0 HB2 LYS A 69 -0.125 -5.611 -14.568 1.00 32.25 H new ATOM 0 HB3 LYS A 69 -0.554 -4.565 -13.229 1.00 32.25 H new ATOM 0 HG2 LYS A 69 -2.607 -5.508 -13.780 1.00 43.00 H new ATOM 0 HG3 LYS A 69 -2.672 -3.983 -14.641 1.00 43.00 H new ATOM 0 HD2 LYS A 69 -2.931 -5.072 -16.592 1.00 63.41 H new ATOM 0 HD3 LYS A 69 -1.386 -5.869 -16.370 1.00 63.41 H new ATOM 0 HE2 LYS A 69 -2.625 -7.776 -16.327 1.00 14.35 H new ATOM 0 HE3 LYS A 69 -2.924 -7.341 -14.656 1.00 14.35 H new ATOM 0 HZ1 LYS A 69 -4.979 -7.833 -15.815 1.00 22.52 H new ATOM 0 HZ2 LYS A 69 -4.955 -6.201 -15.345 1.00 22.52 H new ATOM 0 HZ3 LYS A 69 -4.666 -6.623 -16.964 1.00 22.52 H new ATOM 183 N ALA A 70 1.557 -2.849 -13.392 1.00 0.42 N ATOM 184 CA ALA A 70 2.176 -1.965 -12.412 1.00 12.51 C ATOM 185 C ALA A 70 2.410 -0.576 -12.996 1.00 44.34 C ATOM 186 O ALA A 70 2.033 0.431 -12.397 1.00 64.24 O ATOM 187 CB ALA A 70 3.486 -2.559 -11.918 1.00 21.44 C ATOM 0 H ALA A 70 2.041 -3.737 -13.524 1.00 0.42 H new ATOM 0 HA ALA A 70 1.494 -1.866 -11.568 1.00 12.51 H new ATOM 0 HB1 ALA A 70 3.937 -1.888 -11.187 1.00 21.44 H new ATOM 0 HB2 ALA A 70 3.295 -3.526 -11.453 1.00 21.44 H new ATOM 0 HB3 ALA A 70 4.167 -2.689 -12.759 1.00 21.44 H new ATOM 193 N GLU A 71 3.036 -0.530 -14.169 1.00 13.24 N ATOM 194 CA GLU A 71 3.321 0.737 -14.832 1.00 63.11 C ATOM 195 C GLU A 71 2.052 1.571 -14.982 1.00 2.15 C ATOM 196 O GLU A 71 2.088 2.797 -14.882 1.00 45.04 O ATOM 197 CB GLU A 71 3.946 0.489 -16.207 1.00 23.45 C ATOM 198 CG GLU A 71 5.227 -0.328 -16.154 1.00 54.14 C ATOM 199 CD GLU A 71 5.433 -1.170 -17.399 1.00 12.42 C ATOM 200 OE1 GLU A 71 4.799 -0.866 -18.431 1.00 74.31 O ATOM 201 OE2 GLU A 71 6.227 -2.131 -17.341 1.00 24.05 O ATOM 0 H GLU A 71 3.355 -1.354 -14.678 1.00 13.24 H new ATOM 0 HA GLU A 71 4.028 1.290 -14.213 1.00 63.11 H new ATOM 0 HB2 GLU A 71 3.222 -0.026 -16.838 1.00 23.45 H new ATOM 0 HB3 GLU A 71 4.156 1.448 -16.680 1.00 23.45 H new ATOM 0 HG2 GLU A 71 6.077 0.343 -16.029 1.00 54.14 H new ATOM 0 HG3 GLU A 71 5.203 -0.978 -15.280 1.00 54.14 H new ATOM 208 N GLU A 72 0.932 0.896 -15.221 1.00 42.31 N ATOM 209 CA GLU A 72 -0.348 1.575 -15.386 1.00 4.43 C ATOM 210 C GLU A 72 -0.876 2.072 -14.043 1.00 54.43 C ATOM 211 O GLU A 72 -1.368 3.195 -13.935 1.00 42.53 O ATOM 212 CB GLU A 72 -1.369 0.637 -16.033 1.00 4.23 C ATOM 213 CG GLU A 72 -1.073 0.328 -17.491 1.00 24.35 C ATOM 214 CD GLU A 72 -1.151 1.557 -18.375 1.00 64.23 C ATOM 215 OE1 GLU A 72 -2.240 2.162 -18.456 1.00 43.22 O ATOM 216 OE2 GLU A 72 -0.121 1.913 -18.987 1.00 15.14 O ATOM 0 H GLU A 72 0.885 -0.119 -15.305 1.00 42.31 H new ATOM 0 HA GLU A 72 -0.193 2.435 -16.037 1.00 4.43 H new ATOM 0 HB2 GLU A 72 -1.399 -0.297 -15.471 1.00 4.23 H new ATOM 0 HB3 GLU A 72 -2.360 1.085 -15.959 1.00 4.23 H new ATOM 0 HG2 GLU A 72 -0.078 -0.110 -17.571 1.00 24.35 H new ATOM 0 HG3 GLU A 72 -1.780 -0.419 -17.851 1.00 24.35 H new ATOM 223 N MET A 73 -0.772 1.227 -13.023 1.00 70.12 N ATOM 224 CA MET A 73 -1.239 1.580 -11.688 1.00 0.14 C ATOM 225 C MET A 73 -0.511 2.815 -11.166 1.00 23.31 C ATOM 226 O MET A 73 -1.079 3.614 -10.421 1.00 3.43 O ATOM 227 CB MET A 73 -1.034 0.408 -10.726 1.00 3.21 C ATOM 228 CG MET A 73 -1.826 -0.833 -11.103 1.00 24.31 C ATOM 229 SD MET A 73 -3.563 -0.477 -11.427 1.00 51.13 S ATOM 230 CE MET A 73 -3.597 -0.555 -13.216 1.00 65.14 C ATOM 0 H MET A 73 -0.368 0.293 -13.096 1.00 70.12 H new ATOM 0 HA MET A 73 -2.303 1.807 -11.751 1.00 0.14 H new ATOM 0 HB2 MET A 73 0.026 0.156 -10.693 1.00 3.21 H new ATOM 0 HB3 MET A 73 -1.319 0.719 -9.721 1.00 3.21 H new ATOM 0 HG2 MET A 73 -1.381 -1.288 -11.988 1.00 24.31 H new ATOM 0 HG3 MET A 73 -1.753 -1.564 -10.298 1.00 24.31 H new ATOM 0 HE1 MET A 73 -4.619 -0.730 -13.553 1.00 65.14 H new ATOM 0 HE2 MET A 73 -3.235 0.387 -13.628 1.00 65.14 H new ATOM 0 HE3 MET A 73 -2.958 -1.370 -13.557 1.00 65.14 H new ATOM 240 N LEU A 74 0.749 2.964 -11.561 1.00 53.22 N ATOM 241 CA LEU A 74 1.555 4.102 -11.133 1.00 50.10 C ATOM 242 C LEU A 74 1.311 5.311 -12.031 1.00 24.20 C ATOM 243 O LEU A 74 1.027 6.407 -11.549 1.00 44.32 O ATOM 244 CB LEU A 74 3.040 3.734 -11.146 1.00 34.12 C ATOM 245 CG LEU A 74 3.423 2.465 -10.384 1.00 30.22 C ATOM 246 CD1 LEU A 74 4.839 2.037 -10.738 1.00 33.22 C ATOM 247 CD2 LEU A 74 3.289 2.683 -8.884 1.00 20.53 C ATOM 0 H LEU A 74 1.234 2.311 -12.177 1.00 53.22 H new ATOM 0 HA LEU A 74 1.260 4.363 -10.116 1.00 50.10 H new ATOM 0 HB2 LEU A 74 3.357 3.621 -12.183 1.00 34.12 H new ATOM 0 HB3 LEU A 74 3.604 4.568 -10.729 1.00 34.12 H new ATOM 0 HG LEU A 74 2.740 1.668 -10.677 1.00 30.22 H new ATOM 0 HD11 LEU A 74 5.094 1.132 -10.186 1.00 33.22 H new ATOM 0 HD12 LEU A 74 4.903 1.840 -11.808 1.00 33.22 H new ATOM 0 HD13 LEU A 74 5.536 2.832 -10.474 1.00 33.22 H new ATOM 0 HD21 LEU A 74 3.566 1.770 -8.357 1.00 20.53 H new ATOM 0 HD22 LEU A 74 3.948 3.494 -8.574 1.00 20.53 H new ATOM 0 HD23 LEU A 74 2.258 2.942 -8.645 1.00 20.53 H new ATOM 259 N SER A 75 1.422 5.102 -13.339 1.00 24.21 N ATOM 260 CA SER A 75 1.216 6.175 -14.305 1.00 33.43 C ATOM 261 C SER A 75 -0.099 6.901 -14.037 1.00 71.30 C ATOM 262 O SER A 75 -0.171 8.128 -14.111 1.00 70.41 O ATOM 263 CB SER A 75 1.222 5.616 -15.729 1.00 30.42 C ATOM 264 OG SER A 75 1.602 6.609 -16.665 1.00 52.21 O ATOM 0 H SER A 75 1.653 4.200 -13.754 1.00 24.21 H new ATOM 0 HA SER A 75 2.033 6.888 -14.199 1.00 33.43 H new ATOM 0 HB2 SER A 75 1.910 4.773 -15.789 1.00 30.42 H new ATOM 0 HB3 SER A 75 0.231 5.237 -15.978 1.00 30.42 H new ATOM 0 HG SER A 75 1.600 6.226 -17.567 1.00 52.21 H new ATOM 270 N LYS A 76 -1.138 6.134 -13.725 1.00 73.33 N ATOM 271 CA LYS A 76 -2.452 6.701 -13.445 1.00 2.12 C ATOM 272 C LYS A 76 -2.387 7.667 -12.266 1.00 22.11 C ATOM 273 O LYS A 76 -3.142 8.636 -12.205 1.00 15.25 O ATOM 274 CB LYS A 76 -3.459 5.587 -13.150 1.00 50.23 C ATOM 275 CG LYS A 76 -3.170 4.830 -11.866 1.00 21.31 C ATOM 276 CD LYS A 76 -4.445 4.296 -11.234 1.00 43.03 C ATOM 277 CE LYS A 76 -4.664 2.830 -11.576 1.00 14.24 C ATOM 278 NZ LYS A 76 -6.105 2.458 -11.520 1.00 72.33 N ATOM 0 H LYS A 76 -1.096 5.117 -13.660 1.00 73.33 H new ATOM 0 HA LYS A 76 -2.778 7.252 -14.327 1.00 2.12 H new ATOM 0 HB2 LYS A 76 -4.458 6.018 -13.090 1.00 50.23 H new ATOM 0 HB3 LYS A 76 -3.465 4.884 -13.983 1.00 50.23 H new ATOM 0 HG2 LYS A 76 -2.492 4.002 -12.075 1.00 21.31 H new ATOM 0 HG3 LYS A 76 -2.661 5.488 -11.161 1.00 21.31 H new ATOM 0 HD2 LYS A 76 -4.393 4.415 -10.152 1.00 43.03 H new ATOM 0 HD3 LYS A 76 -5.297 4.882 -11.579 1.00 43.03 H new ATOM 0 HE2 LYS A 76 -4.275 2.628 -12.574 1.00 14.24 H new ATOM 0 HE3 LYS A 76 -4.101 2.207 -10.882 1.00 14.24 H new ATOM 0 HZ1 LYS A 76 -6.213 1.452 -11.759 1.00 72.33 H new ATOM 0 HZ2 LYS A 76 -6.470 2.627 -10.561 1.00 72.33 H new ATOM 0 HZ3 LYS A 76 -6.639 3.035 -12.201 1.00 72.33 H new ATOM 292 N GLN A 77 -1.479 7.396 -11.334 1.00 21.40 N ATOM 293 CA GLN A 77 -1.316 8.242 -10.158 1.00 22.12 C ATOM 294 C GLN A 77 -1.028 9.685 -10.561 1.00 35.52 C ATOM 295 O GLN A 77 -0.799 9.977 -11.734 1.00 50.43 O ATOM 296 CB GLN A 77 -0.185 7.712 -9.275 1.00 21.33 C ATOM 297 CG GLN A 77 -0.303 6.229 -8.960 1.00 1.21 C ATOM 298 CD GLN A 77 -1.582 5.890 -8.219 1.00 65.25 C ATOM 299 OE1 GLN A 77 -2.257 6.771 -7.687 1.00 4.14 O ATOM 300 NE2 GLN A 77 -1.922 4.607 -8.182 1.00 63.24 N ATOM 0 H GLN A 77 -0.845 6.598 -11.371 1.00 21.40 H new ATOM 0 HA GLN A 77 -2.249 8.220 -9.594 1.00 22.12 H new ATOM 0 HB2 GLN A 77 0.768 7.895 -9.771 1.00 21.33 H new ATOM 0 HB3 GLN A 77 -0.171 8.273 -8.341 1.00 21.33 H new ATOM 0 HG2 GLN A 77 -0.264 5.660 -9.889 1.00 1.21 H new ATOM 0 HG3 GLN A 77 0.553 5.920 -8.360 1.00 1.21 H new ATOM 0 HE21 GLN A 77 -1.333 3.910 -8.637 1.00 63.24 H new ATOM 0 HE22 GLN A 77 -2.773 4.319 -7.699 1.00 63.24 H new ATOM 309 N ARG A 78 -1.043 10.582 -9.580 1.00 72.34 N ATOM 310 CA ARG A 78 -0.786 11.994 -9.833 1.00 42.25 C ATOM 311 C ARG A 78 0.592 12.397 -9.316 1.00 60.11 C ATOM 312 O ARG A 78 1.283 13.212 -9.928 1.00 52.23 O ATOM 313 CB ARG A 78 -1.863 12.857 -9.173 1.00 4.00 C ATOM 314 CG ARG A 78 -3.270 12.307 -9.338 1.00 41.24 C ATOM 315 CD ARG A 78 -3.743 12.412 -10.780 1.00 21.31 C ATOM 316 NE ARG A 78 -5.196 12.523 -10.872 1.00 72.24 N ATOM 317 CZ ARG A 78 -5.831 12.995 -11.940 1.00 23.33 C ATOM 318 NH1 ARG A 78 -5.143 13.397 -13.000 1.00 33.32 N ATOM 319 NH2 ARG A 78 -7.156 13.065 -11.948 1.00 63.23 N ATOM 0 H ARG A 78 -1.230 10.356 -8.603 1.00 72.34 H new ATOM 0 HA ARG A 78 -0.812 12.155 -10.911 1.00 42.25 H new ATOM 0 HB2 ARG A 78 -1.641 12.950 -8.110 1.00 4.00 H new ATOM 0 HB3 ARG A 78 -1.822 13.861 -9.596 1.00 4.00 H new ATOM 0 HG2 ARG A 78 -3.294 11.264 -9.021 1.00 41.24 H new ATOM 0 HG3 ARG A 78 -3.954 12.853 -8.689 1.00 41.24 H new ATOM 0 HD2 ARG A 78 -3.282 13.281 -11.250 1.00 21.31 H new ATOM 0 HD3 ARG A 78 -3.410 11.535 -11.335 1.00 21.31 H new ATOM 0 HE ARG A 78 -5.754 12.222 -10.073 1.00 72.24 H new ATOM 0 HH11 ARG A 78 -4.124 13.344 -12.997 1.00 33.32 H new ATOM 0 HH12 ARG A 78 -5.632 13.759 -13.818 1.00 33.32 H new ATOM 0 HH21 ARG A 78 -7.688 12.757 -11.134 1.00 63.23 H new ATOM 0 HH22 ARG A 78 -7.643 13.427 -12.768 1.00 63.23 H new ATOM 333 N HIS A 79 0.985 11.821 -8.185 1.00 25.53 N ATOM 334 CA HIS A 79 2.281 12.119 -7.585 1.00 11.32 C ATOM 335 C HIS A 79 3.416 11.556 -8.435 1.00 1.43 C ATOM 336 O HIS A 79 3.179 10.935 -9.471 1.00 24.34 O ATOM 337 CB HIS A 79 2.355 11.546 -6.169 1.00 45.13 C ATOM 338 CG HIS A 79 1.015 11.353 -5.530 1.00 11.11 C ATOM 339 ND1 HIS A 79 0.745 10.335 -4.639 1.00 43.35 N ATOM 340 CD2 HIS A 79 -0.135 12.056 -5.655 1.00 10.01 C ATOM 341 CE1 HIS A 79 -0.513 10.419 -4.246 1.00 1.42 C ATOM 342 NE2 HIS A 79 -1.069 11.456 -4.847 1.00 72.41 N ATOM 0 H HIS A 79 0.425 11.145 -7.665 1.00 25.53 H new ATOM 0 HA HIS A 79 2.391 13.202 -7.536 1.00 11.32 H new ATOM 0 HB2 HIS A 79 2.875 10.588 -6.200 1.00 45.13 H new ATOM 0 HB3 HIS A 79 2.952 12.213 -5.547 1.00 45.13 H new ATOM 0 HD2 HIS A 79 -0.289 12.927 -6.275 1.00 10.01 H new ATOM 0 HE1 HIS A 79 -1.004 9.753 -3.551 1.00 1.42 H new ATOM 0 HE2 HIS A 79 -2.035 11.761 -4.730 1.00 72.41 H new ATOM 350 N ASP A 80 4.648 11.779 -7.990 1.00 51.32 N ATOM 351 CA ASP A 80 5.820 11.294 -8.710 1.00 11.12 C ATOM 352 C ASP A 80 6.692 10.427 -7.807 1.00 12.44 C ATOM 353 O ASP A 80 7.297 10.918 -6.854 1.00 73.13 O ATOM 354 CB ASP A 80 6.635 12.470 -9.251 1.00 61.52 C ATOM 355 CG ASP A 80 5.762 13.637 -9.667 1.00 71.12 C ATOM 356 OD1 ASP A 80 4.725 13.399 -10.322 1.00 43.11 O ATOM 357 OD2 ASP A 80 6.115 14.788 -9.337 1.00 54.31 O ATOM 0 H ASP A 80 4.861 12.292 -7.135 1.00 51.32 H new ATOM 0 HA ASP A 80 5.476 10.685 -9.546 1.00 11.12 H new ATOM 0 HB2 ASP A 80 7.340 12.801 -8.488 1.00 61.52 H new ATOM 0 HB3 ASP A 80 7.224 12.137 -10.106 1.00 61.52 H new ATOM 362 N GLY A 81 6.750 9.135 -8.112 1.00 64.44 N ATOM 363 CA GLY A 81 7.550 8.220 -7.318 1.00 75.02 C ATOM 364 C GLY A 81 6.709 7.160 -6.634 1.00 63.01 C ATOM 365 O GLY A 81 7.108 6.608 -5.609 1.00 64.24 O ATOM 0 H GLY A 81 6.257 8.705 -8.895 1.00 64.44 H new ATOM 0 HA2 GLY A 81 8.288 7.737 -7.959 1.00 75.02 H new ATOM 0 HA3 GLY A 81 8.102 8.783 -6.566 1.00 75.02 H new ATOM 369 N ALA A 82 5.541 6.876 -7.201 1.00 2.10 N ATOM 370 CA ALA A 82 4.643 5.875 -6.639 1.00 53.23 C ATOM 371 C ALA A 82 5.321 4.512 -6.558 1.00 43.02 C ATOM 372 O ALA A 82 5.942 4.058 -7.520 1.00 11.12 O ATOM 373 CB ALA A 82 3.370 5.785 -7.468 1.00 34.24 C ATOM 0 H ALA A 82 5.195 7.325 -8.049 1.00 2.10 H new ATOM 0 HA ALA A 82 4.384 6.183 -5.626 1.00 53.23 H new ATOM 0 HB1 ALA A 82 2.708 5.034 -7.038 1.00 34.24 H new ATOM 0 HB2 ALA A 82 2.868 6.753 -7.470 1.00 34.24 H new ATOM 0 HB3 ALA A 82 3.621 5.504 -8.491 1.00 34.24 H new ATOM 379 N PHE A 83 5.200 3.863 -5.405 1.00 11.53 N ATOM 380 CA PHE A 83 5.803 2.552 -5.198 1.00 3.23 C ATOM 381 C PHE A 83 4.748 1.452 -5.262 1.00 22.34 C ATOM 382 O PHE A 83 3.600 1.653 -4.864 1.00 32.20 O ATOM 383 CB PHE A 83 6.524 2.506 -3.849 1.00 34.04 C ATOM 384 CG PHE A 83 5.625 2.143 -2.701 1.00 53.42 C ATOM 385 CD1 PHE A 83 4.702 3.054 -2.212 1.00 72.23 C ATOM 386 CD2 PHE A 83 5.703 0.892 -2.111 1.00 40.12 C ATOM 387 CE1 PHE A 83 3.873 2.723 -1.157 1.00 12.22 C ATOM 388 CE2 PHE A 83 4.876 0.556 -1.056 1.00 25.31 C ATOM 389 CZ PHE A 83 3.961 1.473 -0.577 1.00 61.23 C ATOM 0 H PHE A 83 4.689 4.224 -4.599 1.00 11.53 H new ATOM 0 HA PHE A 83 6.527 2.383 -5.995 1.00 3.23 H new ATOM 0 HB2 PHE A 83 7.338 1.783 -3.905 1.00 34.04 H new ATOM 0 HB3 PHE A 83 6.975 3.479 -3.654 1.00 34.04 H new ATOM 0 HD1 PHE A 83 4.630 4.034 -2.661 1.00 72.23 H new ATOM 0 HD2 PHE A 83 6.418 0.171 -2.480 1.00 40.12 H new ATOM 0 HE1 PHE A 83 3.157 3.441 -0.786 1.00 12.22 H new ATOM 0 HE2 PHE A 83 4.945 -0.423 -0.606 1.00 25.31 H new ATOM 0 HZ PHE A 83 3.316 1.213 0.249 1.00 61.23 H new ATOM 399 N LEU A 84 5.145 0.288 -5.765 1.00 44.31 N ATOM 400 CA LEU A 84 4.235 -0.845 -5.882 1.00 72.43 C ATOM 401 C LEU A 84 5.001 -2.164 -5.852 1.00 73.22 C ATOM 402 O LEU A 84 5.796 -2.452 -6.747 1.00 52.14 O ATOM 403 CB LEU A 84 3.425 -0.742 -7.176 1.00 34.43 C ATOM 404 CG LEU A 84 2.681 -2.008 -7.605 1.00 3.03 C ATOM 405 CD1 LEU A 84 1.411 -1.651 -8.361 1.00 1.43 C ATOM 406 CD2 LEU A 84 3.581 -2.892 -8.457 1.00 14.32 C ATOM 0 H LEU A 84 6.091 0.105 -6.098 1.00 44.31 H new ATOM 0 HA LEU A 84 3.554 -0.822 -5.031 1.00 72.43 H new ATOM 0 HB2 LEU A 84 2.698 0.062 -7.063 1.00 34.43 H new ATOM 0 HB3 LEU A 84 4.100 -0.451 -7.981 1.00 34.43 H new ATOM 0 HG LEU A 84 2.402 -2.563 -6.710 1.00 3.03 H new ATOM 0 HD11 LEU A 84 0.895 -2.564 -8.658 1.00 1.43 H new ATOM 0 HD12 LEU A 84 0.759 -1.059 -7.718 1.00 1.43 H new ATOM 0 HD13 LEU A 84 1.667 -1.073 -9.249 1.00 1.43 H new ATOM 0 HD21 LEU A 84 3.036 -3.788 -8.753 1.00 14.32 H new ATOM 0 HD22 LEU A 84 3.891 -2.345 -9.347 1.00 14.32 H new ATOM 0 HD23 LEU A 84 4.462 -3.177 -7.881 1.00 14.32 H new ATOM 418 N ILE A 85 4.754 -2.962 -4.819 1.00 30.21 N ATOM 419 CA ILE A 85 5.418 -4.252 -4.675 1.00 11.24 C ATOM 420 C ILE A 85 4.516 -5.390 -5.141 1.00 0.50 C ATOM 421 O ILE A 85 3.396 -5.546 -4.655 1.00 32.30 O ATOM 422 CB ILE A 85 5.837 -4.509 -3.215 1.00 71.11 C ATOM 423 CG1 ILE A 85 6.732 -3.375 -2.711 1.00 60.11 C ATOM 424 CG2 ILE A 85 6.551 -5.847 -3.097 1.00 61.22 C ATOM 425 CD1 ILE A 85 7.173 -3.546 -1.274 1.00 73.32 C ATOM 0 H ILE A 85 4.099 -2.738 -4.070 1.00 30.21 H new ATOM 0 HA ILE A 85 6.310 -4.219 -5.301 1.00 11.24 H new ATOM 0 HB ILE A 85 4.941 -4.542 -2.596 1.00 71.11 H new ATOM 0 HG12 ILE A 85 7.614 -3.309 -3.348 1.00 60.11 H new ATOM 0 HG13 ILE A 85 6.197 -2.430 -2.808 1.00 60.11 H new ATOM 0 HG21 ILE A 85 6.841 -6.014 -2.060 1.00 61.22 H new ATOM 0 HG22 ILE A 85 5.883 -6.645 -3.421 1.00 61.22 H new ATOM 0 HG23 ILE A 85 7.441 -5.841 -3.726 1.00 61.22 H new ATOM 0 HD11 ILE A 85 7.804 -2.706 -0.985 1.00 73.32 H new ATOM 0 HD12 ILE A 85 6.297 -3.582 -0.626 1.00 73.32 H new ATOM 0 HD13 ILE A 85 7.736 -4.474 -1.174 1.00 73.32 H new ATOM 437 N ARG A 86 5.013 -6.182 -6.085 1.00 31.20 N ATOM 438 CA ARG A 86 4.252 -7.307 -6.617 1.00 4.42 C ATOM 439 C ARG A 86 4.902 -8.633 -6.233 1.00 44.30 C ATOM 440 O ARG A 86 6.123 -8.722 -6.105 1.00 51.12 O ATOM 441 CB ARG A 86 4.143 -7.202 -8.139 1.00 42.50 C ATOM 442 CG ARG A 86 5.485 -7.050 -8.837 1.00 31.21 C ATOM 443 CD ARG A 86 5.469 -5.900 -9.831 1.00 42.31 C ATOM 444 NE ARG A 86 6.817 -5.465 -10.187 1.00 64.51 N ATOM 445 CZ ARG A 86 7.545 -6.035 -11.142 1.00 14.31 C ATOM 446 NH1 ARG A 86 7.056 -7.055 -11.833 1.00 33.21 N ATOM 447 NH2 ARG A 86 8.764 -5.583 -11.408 1.00 14.24 N ATOM 0 H ARG A 86 5.939 -6.066 -6.497 1.00 31.20 H new ATOM 0 HA ARG A 86 3.252 -7.274 -6.185 1.00 4.42 H new ATOM 0 HB2 ARG A 86 3.643 -8.092 -8.521 1.00 42.50 H new ATOM 0 HB3 ARG A 86 3.513 -6.349 -8.392 1.00 42.50 H new ATOM 0 HG2 ARG A 86 6.265 -6.880 -8.095 1.00 31.21 H new ATOM 0 HG3 ARG A 86 5.734 -7.976 -9.355 1.00 31.21 H new ATOM 0 HD2 ARG A 86 4.937 -6.207 -10.732 1.00 42.31 H new ATOM 0 HD3 ARG A 86 4.918 -5.061 -9.406 1.00 42.31 H new ATOM 0 HE ARG A 86 7.222 -4.681 -9.675 1.00 64.51 H new ATOM 0 HH11 ARG A 86 6.119 -7.404 -11.632 1.00 33.21 H new ATOM 0 HH12 ARG A 86 7.617 -7.491 -12.565 1.00 33.21 H new ATOM 0 HH21 ARG A 86 9.143 -4.797 -10.879 1.00 14.24 H new ATOM 0 HH22 ARG A 86 9.322 -6.021 -12.141 1.00 14.24 H new ATOM 461 N GLU A 87 4.078 -9.659 -6.050 1.00 73.25 N ATOM 462 CA GLU A 87 4.573 -10.980 -5.680 1.00 1.30 C ATOM 463 C GLU A 87 4.506 -11.938 -6.865 1.00 70.34 C ATOM 464 O GLU A 87 3.700 -11.758 -7.778 1.00 70.22 O ATOM 465 CB GLU A 87 3.765 -11.542 -4.509 1.00 33.01 C ATOM 466 CG GLU A 87 4.417 -12.740 -3.839 1.00 13.45 C ATOM 467 CD GLU A 87 3.492 -13.434 -2.857 1.00 43.04 C ATOM 468 OE1 GLU A 87 2.261 -13.376 -3.060 1.00 43.32 O ATOM 469 OE2 GLU A 87 3.999 -14.035 -1.887 1.00 61.04 O ATOM 0 H GLU A 87 3.065 -9.601 -6.152 1.00 73.25 H new ATOM 0 HA GLU A 87 5.615 -10.877 -5.377 1.00 1.30 H new ATOM 0 HB2 GLU A 87 3.620 -10.756 -3.768 1.00 33.01 H new ATOM 0 HB3 GLU A 87 2.776 -11.830 -4.866 1.00 33.01 H new ATOM 0 HG2 GLU A 87 4.731 -13.452 -4.602 1.00 13.45 H new ATOM 0 HG3 GLU A 87 5.317 -12.415 -3.317 1.00 13.45 H new ATOM 476 N SER A 88 5.359 -12.957 -6.844 1.00 63.10 N ATOM 477 CA SER A 88 5.401 -13.942 -7.918 1.00 72.24 C ATOM 478 C SER A 88 4.163 -14.834 -7.886 1.00 24.13 C ATOM 479 O SER A 88 3.503 -14.959 -6.855 1.00 53.42 O ATOM 480 CB SER A 88 6.664 -14.798 -7.806 1.00 33.35 C ATOM 481 OG SER A 88 7.670 -14.342 -8.693 1.00 71.41 O ATOM 0 H SER A 88 6.031 -13.122 -6.094 1.00 63.10 H new ATOM 0 HA SER A 88 5.417 -13.407 -8.867 1.00 72.24 H new ATOM 0 HB2 SER A 88 7.037 -14.769 -6.782 1.00 33.35 H new ATOM 0 HB3 SER A 88 6.423 -15.838 -8.028 1.00 33.35 H new ATOM 0 HG SER A 88 8.467 -14.905 -8.601 1.00 71.41 H new ATOM 487 N GLU A 89 3.857 -15.452 -9.022 1.00 20.40 N ATOM 488 CA GLU A 89 2.699 -16.332 -9.124 1.00 34.22 C ATOM 489 C GLU A 89 2.916 -17.613 -8.323 1.00 62.02 C ATOM 490 O GLU A 89 2.200 -17.885 -7.360 1.00 12.32 O ATOM 491 CB GLU A 89 2.418 -16.675 -10.588 1.00 53.34 C ATOM 492 CG GLU A 89 2.373 -15.460 -11.500 1.00 2.11 C ATOM 493 CD GLU A 89 1.098 -15.390 -12.318 1.00 21.35 C ATOM 494 OE1 GLU A 89 0.004 -15.458 -11.719 1.00 4.41 O ATOM 495 OE2 GLU A 89 1.195 -15.268 -13.557 1.00 33.23 O ATOM 0 H GLU A 89 4.394 -15.360 -9.884 1.00 20.40 H new ATOM 0 HA GLU A 89 1.839 -15.806 -8.710 1.00 34.22 H new ATOM 0 HB2 GLU A 89 3.187 -17.359 -10.946 1.00 53.34 H new ATOM 0 HB3 GLU A 89 1.466 -17.203 -10.653 1.00 53.34 H new ATOM 0 HG2 GLU A 89 2.464 -14.556 -10.898 1.00 2.11 H new ATOM 0 HG3 GLU A 89 3.231 -15.483 -12.172 1.00 2.11 H new ATOM 502 N SER A 90 3.910 -18.397 -8.730 1.00 52.40 N ATOM 503 CA SER A 90 4.220 -19.651 -8.054 1.00 72.03 C ATOM 504 C SER A 90 5.543 -19.550 -7.302 1.00 63.31 C ATOM 505 O SER A 90 6.337 -20.491 -7.292 1.00 10.33 O ATOM 506 CB SER A 90 4.281 -20.798 -9.065 1.00 54.21 C ATOM 507 OG SER A 90 3.025 -21.444 -9.179 1.00 73.21 O ATOM 0 H SER A 90 4.514 -18.186 -9.524 1.00 52.40 H new ATOM 0 HA SER A 90 3.427 -19.853 -7.334 1.00 72.03 H new ATOM 0 HB2 SER A 90 4.585 -20.413 -10.038 1.00 54.21 H new ATOM 0 HB3 SER A 90 5.038 -21.519 -8.756 1.00 54.21 H new ATOM 0 HG SER A 90 3.090 -22.172 -9.832 1.00 73.21 H new ATOM 513 N ALA A 91 5.774 -18.402 -6.674 1.00 35.25 N ATOM 514 CA ALA A 91 6.999 -18.178 -5.917 1.00 0.11 C ATOM 515 C ALA A 91 6.716 -17.413 -4.628 1.00 64.22 C ATOM 516 O ALA A 91 6.840 -16.190 -4.564 1.00 10.10 O ATOM 517 CB ALA A 91 8.014 -17.427 -6.766 1.00 71.45 C ATOM 0 H ALA A 91 5.128 -17.612 -6.675 1.00 35.25 H new ATOM 0 HA ALA A 91 7.414 -19.150 -5.649 1.00 0.11 H new ATOM 0 HB1 ALA A 91 8.924 -17.267 -6.188 1.00 71.45 H new ATOM 0 HB2 ALA A 91 8.248 -18.012 -7.656 1.00 71.45 H new ATOM 0 HB3 ALA A 91 7.598 -16.464 -7.063 1.00 71.45 H new ATOM 523 N PRO A 92 6.327 -18.149 -3.576 1.00 51.52 N ATOM 524 CA PRO A 92 6.018 -17.560 -2.270 1.00 4.24 C ATOM 525 C PRO A 92 7.262 -17.031 -1.564 1.00 3.21 C ATOM 526 O PRO A 92 8.100 -17.803 -1.099 1.00 13.20 O ATOM 527 CB PRO A 92 5.416 -18.729 -1.487 1.00 21.21 C ATOM 528 CG PRO A 92 5.989 -19.947 -2.125 1.00 61.31 C ATOM 529 CD PRO A 92 6.158 -19.611 -3.581 1.00 63.40 C ATOM 0 HA PRO A 92 5.353 -16.700 -2.358 1.00 4.24 H new ATOM 0 HB2 PRO A 92 5.678 -18.675 -0.430 1.00 21.21 H new ATOM 0 HB3 PRO A 92 4.328 -18.726 -1.546 1.00 21.21 H new ATOM 0 HG2 PRO A 92 6.944 -20.212 -1.672 1.00 61.31 H new ATOM 0 HG3 PRO A 92 5.327 -20.803 -1.996 1.00 61.31 H new ATOM 0 HD2 PRO A 92 7.024 -20.114 -4.012 1.00 63.40 H new ATOM 0 HD3 PRO A 92 5.290 -19.913 -4.167 1.00 63.40 H new ATOM 537 N GLY A 93 7.376 -15.708 -1.487 1.00 64.21 N ATOM 538 CA GLY A 93 8.521 -15.099 -0.836 1.00 24.01 C ATOM 539 C GLY A 93 9.225 -14.092 -1.723 1.00 41.35 C ATOM 540 O GLY A 93 9.898 -13.185 -1.233 1.00 23.33 O ATOM 0 H GLY A 93 6.696 -15.048 -1.864 1.00 64.21 H new ATOM 0 HA2 GLY A 93 8.195 -14.606 0.080 1.00 24.01 H new ATOM 0 HA3 GLY A 93 9.226 -15.878 -0.545 1.00 24.01 H new ATOM 544 N ASP A 94 9.071 -14.251 -3.033 1.00 42.43 N ATOM 545 CA ASP A 94 9.698 -13.348 -3.992 1.00 12.11 C ATOM 546 C ASP A 94 8.981 -12.002 -4.020 1.00 14.22 C ATOM 547 O ASP A 94 7.790 -11.927 -4.326 1.00 4.01 O ATOM 548 CB ASP A 94 9.694 -13.971 -5.389 1.00 4.41 C ATOM 549 CG ASP A 94 10.954 -13.649 -6.169 1.00 72.22 C ATOM 550 OD1 ASP A 94 11.473 -12.524 -6.020 1.00 11.54 O ATOM 551 OD2 ASP A 94 11.420 -14.523 -6.930 1.00 61.21 O ATOM 0 H ASP A 94 8.518 -14.996 -3.455 1.00 42.43 H new ATOM 0 HA ASP A 94 10.729 -13.184 -3.679 1.00 12.11 H new ATOM 0 HB2 ASP A 94 9.591 -15.053 -5.301 1.00 4.41 H new ATOM 0 HB3 ASP A 94 8.826 -13.612 -5.942 1.00 4.41 H new ATOM 556 N PHE A 95 9.712 -10.940 -3.697 1.00 63.41 N ATOM 557 CA PHE A 95 9.146 -9.597 -3.683 1.00 54.21 C ATOM 558 C PHE A 95 9.873 -8.689 -4.671 1.00 24.35 C ATOM 559 O PHE A 95 11.101 -8.711 -4.762 1.00 33.12 O ATOM 560 CB PHE A 95 9.222 -9.003 -2.275 1.00 43.21 C ATOM 561 CG PHE A 95 8.229 -9.598 -1.318 1.00 62.14 C ATOM 562 CD1 PHE A 95 6.887 -9.262 -1.394 1.00 62.10 C ATOM 563 CD2 PHE A 95 8.638 -10.493 -0.343 1.00 31.30 C ATOM 564 CE1 PHE A 95 5.971 -9.808 -0.515 1.00 74.34 C ATOM 565 CE2 PHE A 95 7.726 -11.043 0.538 1.00 71.10 C ATOM 566 CZ PHE A 95 6.391 -10.699 0.453 1.00 71.35 C ATOM 0 H PHE A 95 10.698 -10.984 -3.441 1.00 63.41 H new ATOM 0 HA PHE A 95 8.101 -9.668 -3.984 1.00 54.21 H new ATOM 0 HB2 PHE A 95 10.227 -9.151 -1.881 1.00 43.21 H new ATOM 0 HB3 PHE A 95 9.058 -7.927 -2.334 1.00 43.21 H new ATOM 0 HD1 PHE A 95 6.553 -8.565 -2.149 1.00 62.10 H new ATOM 0 HD2 PHE A 95 9.681 -10.764 -0.270 1.00 31.30 H new ATOM 0 HE1 PHE A 95 4.928 -9.538 -0.585 1.00 74.34 H new ATOM 0 HE2 PHE A 95 8.057 -11.741 1.292 1.00 71.10 H new ATOM 0 HZ PHE A 95 5.677 -11.126 1.142 1.00 71.35 H new ATOM 576 N SER A 96 9.107 -7.893 -5.408 1.00 52.44 N ATOM 577 CA SER A 96 9.677 -6.980 -6.393 1.00 21.23 C ATOM 578 C SER A 96 9.018 -5.607 -6.306 1.00 40.05 C ATOM 579 O SER A 96 7.807 -5.474 -6.485 1.00 75.33 O ATOM 580 CB SER A 96 9.512 -7.550 -7.803 1.00 3.10 C ATOM 581 OG SER A 96 9.690 -6.543 -8.784 1.00 10.32 O ATOM 0 H SER A 96 8.090 -7.861 -5.343 1.00 52.44 H new ATOM 0 HA SER A 96 10.739 -6.868 -6.177 1.00 21.23 H new ATOM 0 HB2 SER A 96 10.236 -8.349 -7.962 1.00 3.10 H new ATOM 0 HB3 SER A 96 8.521 -7.992 -7.906 1.00 3.10 H new ATOM 0 HG SER A 96 10.053 -6.943 -9.601 1.00 10.32 H new ATOM 587 N LEU A 97 9.824 -4.587 -6.031 1.00 71.42 N ATOM 588 CA LEU A 97 9.321 -3.223 -5.921 1.00 14.42 C ATOM 589 C LEU A 97 9.314 -2.533 -7.281 1.00 42.13 C ATOM 590 O LEU A 97 10.149 -2.821 -8.138 1.00 62.25 O ATOM 591 CB LEU A 97 10.173 -2.422 -4.934 1.00 72.14 C ATOM 592 CG LEU A 97 9.859 -0.929 -4.834 1.00 41.14 C ATOM 593 CD1 LEU A 97 8.822 -0.673 -3.752 1.00 4.45 C ATOM 594 CD2 LEU A 97 11.128 -0.135 -4.559 1.00 53.44 C ATOM 0 H LEU A 97 10.829 -4.679 -5.880 1.00 71.42 H new ATOM 0 HA LEU A 97 8.296 -3.269 -5.553 1.00 14.42 H new ATOM 0 HB2 LEU A 97 10.059 -2.864 -3.944 1.00 72.14 H new ATOM 0 HB3 LEU A 97 11.220 -2.535 -5.214 1.00 72.14 H new ATOM 0 HG LEU A 97 9.447 -0.599 -5.788 1.00 41.14 H new ATOM 0 HD11 LEU A 97 8.611 0.395 -3.695 1.00 4.45 H new ATOM 0 HD12 LEU A 97 7.905 -1.212 -3.992 1.00 4.45 H new ATOM 0 HD13 LEU A 97 9.205 -1.019 -2.792 1.00 4.45 H new ATOM 0 HD21 LEU A 97 10.886 0.926 -4.491 1.00 53.44 H new ATOM 0 HD22 LEU A 97 11.569 -0.468 -3.619 1.00 53.44 H new ATOM 0 HD23 LEU A 97 11.839 -0.294 -5.370 1.00 53.44 H new ATOM 606 N SER A 98 8.368 -1.619 -7.471 1.00 71.03 N ATOM 607 CA SER A 98 8.252 -0.889 -8.728 1.00 52.21 C ATOM 608 C SER A 98 7.934 0.582 -8.475 1.00 25.14 C ATOM 609 O SER A 98 6.809 0.934 -8.123 1.00 54.50 O ATOM 610 CB SER A 98 7.165 -1.513 -9.606 1.00 44.43 C ATOM 611 OG SER A 98 7.152 -0.925 -10.896 1.00 11.34 O ATOM 0 H SER A 98 7.671 -1.366 -6.771 1.00 71.03 H new ATOM 0 HA SER A 98 9.209 -0.952 -9.246 1.00 52.21 H new ATOM 0 HB2 SER A 98 7.335 -2.586 -9.694 1.00 44.43 H new ATOM 0 HB3 SER A 98 6.192 -1.382 -9.133 1.00 44.43 H new ATOM 0 HG SER A 98 8.014 -0.491 -11.066 1.00 11.34 H new ATOM 617 N VAL A 99 8.936 1.437 -8.656 1.00 23.43 N ATOM 618 CA VAL A 99 8.766 2.870 -8.448 1.00 75.31 C ATOM 619 C VAL A 99 8.726 3.617 -9.777 1.00 23.54 C ATOM 620 O VAL A 99 9.483 3.309 -10.697 1.00 63.14 O ATOM 621 CB VAL A 99 9.897 3.450 -7.579 1.00 21.41 C ATOM 622 CG1 VAL A 99 10.558 4.628 -8.278 1.00 73.24 C ATOM 623 CG2 VAL A 99 9.364 3.860 -6.215 1.00 34.13 C ATOM 0 H VAL A 99 9.874 1.162 -8.946 1.00 23.43 H new ATOM 0 HA VAL A 99 7.816 3.004 -7.930 1.00 75.31 H new ATOM 0 HB VAL A 99 10.651 2.677 -7.432 1.00 21.41 H new ATOM 0 HG11 VAL A 99 11.355 5.024 -7.648 1.00 73.24 H new ATOM 0 HG12 VAL A 99 10.977 4.299 -9.229 1.00 73.24 H new ATOM 0 HG13 VAL A 99 9.817 5.407 -8.458 1.00 73.24 H new ATOM 0 HG21 VAL A 99 10.177 4.268 -5.614 1.00 34.13 H new ATOM 0 HG22 VAL A 99 8.590 4.617 -6.339 1.00 34.13 H new ATOM 0 HG23 VAL A 99 8.943 2.989 -5.712 1.00 34.13 H new ATOM 633 N LYS A 100 7.839 4.601 -9.870 1.00 34.25 N ATOM 634 CA LYS A 100 7.700 5.395 -11.085 1.00 22.24 C ATOM 635 C LYS A 100 8.670 6.572 -11.079 1.00 23.21 C ATOM 636 O LYS A 100 8.893 7.201 -10.044 1.00 61.50 O ATOM 637 CB LYS A 100 6.264 5.905 -11.225 1.00 20.44 C ATOM 638 CG LYS A 100 6.075 6.883 -12.371 1.00 72.41 C ATOM 639 CD LYS A 100 4.645 6.869 -12.886 1.00 21.14 C ATOM 640 CE LYS A 100 3.888 8.119 -12.462 1.00 64.51 C ATOM 641 NZ LYS A 100 3.860 9.143 -13.543 1.00 31.33 N ATOM 0 H LYS A 100 7.205 4.868 -9.117 1.00 34.25 H new ATOM 0 HA LYS A 100 7.936 4.756 -11.936 1.00 22.24 H new ATOM 0 HB2 LYS A 100 5.598 5.055 -11.371 1.00 20.44 H new ATOM 0 HB3 LYS A 100 5.966 6.387 -10.294 1.00 20.44 H new ATOM 0 HG2 LYS A 100 6.333 7.889 -12.039 1.00 72.41 H new ATOM 0 HG3 LYS A 100 6.757 6.630 -13.182 1.00 72.41 H new ATOM 0 HD2 LYS A 100 4.649 6.796 -13.974 1.00 21.14 H new ATOM 0 HD3 LYS A 100 4.130 5.985 -12.510 1.00 21.14 H new ATOM 0 HE2 LYS A 100 2.867 7.851 -12.189 1.00 64.51 H new ATOM 0 HE3 LYS A 100 4.355 8.542 -11.573 1.00 64.51 H new ATOM 0 HZ1 LYS A 100 3.335 9.979 -13.216 1.00 31.33 H new ATOM 0 HZ2 LYS A 100 4.833 9.418 -13.786 1.00 31.33 H new ATOM 0 HZ3 LYS A 100 3.392 8.748 -14.383 1.00 31.33 H new ATOM 655 N PHE A 101 9.244 6.866 -12.241 1.00 72.31 N ATOM 656 CA PHE A 101 10.190 7.968 -12.370 1.00 12.13 C ATOM 657 C PHE A 101 9.911 8.779 -13.632 1.00 5.11 C ATOM 658 O PHE A 101 10.284 8.380 -14.734 1.00 73.34 O ATOM 659 CB PHE A 101 11.624 7.436 -12.398 1.00 3.44 C ATOM 660 CG PHE A 101 12.146 7.047 -11.044 1.00 34.01 C ATOM 661 CD1 PHE A 101 12.118 7.947 -9.991 1.00 1.10 C ATOM 662 CD2 PHE A 101 12.664 5.781 -10.824 1.00 73.34 C ATOM 663 CE1 PHE A 101 12.597 7.592 -8.744 1.00 33.12 C ATOM 664 CE2 PHE A 101 13.143 5.420 -9.580 1.00 23.35 C ATOM 665 CZ PHE A 101 13.111 6.327 -8.538 1.00 71.33 C ATOM 0 H PHE A 101 9.070 6.356 -13.107 1.00 72.31 H new ATOM 0 HA PHE A 101 10.069 8.621 -11.506 1.00 12.13 H new ATOM 0 HB2 PHE A 101 11.669 6.570 -13.058 1.00 3.44 H new ATOM 0 HB3 PHE A 101 12.277 8.197 -12.825 1.00 3.44 H new ATOM 0 HD1 PHE A 101 11.717 8.938 -10.146 1.00 1.10 H new ATOM 0 HD2 PHE A 101 12.694 5.068 -11.635 1.00 73.34 H new ATOM 0 HE1 PHE A 101 12.569 8.303 -7.932 1.00 33.12 H new ATOM 0 HE2 PHE A 101 13.542 4.429 -9.422 1.00 23.35 H new ATOM 0 HZ PHE A 101 13.487 6.047 -7.565 1.00 71.33 H new ATOM 675 N GLY A 102 9.253 9.922 -13.461 1.00 31.40 N ATOM 676 CA GLY A 102 8.935 10.771 -14.594 1.00 34.02 C ATOM 677 C GLY A 102 8.176 10.032 -15.678 1.00 34.43 C ATOM 678 O GLY A 102 6.962 9.855 -15.584 1.00 53.14 O ATOM 0 H GLY A 102 8.935 10.275 -12.558 1.00 31.40 H new ATOM 0 HA2 GLY A 102 8.341 11.619 -14.253 1.00 34.02 H new ATOM 0 HA3 GLY A 102 9.857 11.175 -15.012 1.00 34.02 H new ATOM 682 N ASN A 103 8.892 9.599 -16.710 1.00 43.42 N ATOM 683 CA ASN A 103 8.278 8.877 -17.818 1.00 70.11 C ATOM 684 C ASN A 103 8.903 7.494 -17.979 1.00 41.52 C ATOM 685 O ASN A 103 8.940 6.943 -19.079 1.00 43.24 O ATOM 686 CB ASN A 103 8.427 9.671 -19.117 1.00 62.14 C ATOM 687 CG ASN A 103 7.119 9.792 -19.875 1.00 31.33 C ATOM 688 OD1 ASN A 103 6.223 10.534 -19.473 1.00 53.21 O ATOM 689 ND2 ASN A 103 7.004 9.060 -20.977 1.00 34.23 N ATOM 0 H ASN A 103 9.899 9.736 -16.802 1.00 43.42 H new ATOM 0 HA ASN A 103 7.218 8.754 -17.596 1.00 70.11 H new ATOM 0 HB2 ASN A 103 8.805 10.668 -18.889 1.00 62.14 H new ATOM 0 HB3 ASN A 103 9.168 9.187 -19.752 1.00 62.14 H new ATOM 0 HD21 ASN A 103 6.147 9.099 -21.528 1.00 34.23 H new ATOM 0 HD22 ASN A 103 7.773 8.459 -21.272 1.00 34.23 H new ATOM 696 N ASP A 104 9.392 6.940 -16.875 1.00 42.25 N ATOM 697 CA ASP A 104 10.014 5.621 -16.893 1.00 43.41 C ATOM 698 C ASP A 104 9.761 4.883 -15.582 1.00 53.43 C ATOM 699 O ASP A 104 10.117 5.365 -14.507 1.00 45.52 O ATOM 700 CB ASP A 104 11.519 5.747 -17.140 1.00 35.25 C ATOM 701 CG ASP A 104 11.929 5.215 -18.498 1.00 60.35 C ATOM 702 OD1 ASP A 104 11.896 3.981 -18.687 1.00 34.12 O ATOM 703 OD2 ASP A 104 12.285 6.032 -19.373 1.00 55.15 O ATOM 0 H ASP A 104 9.370 7.383 -15.957 1.00 42.25 H new ATOM 0 HA ASP A 104 9.567 5.046 -17.704 1.00 43.41 H new ATOM 0 HB2 ASP A 104 11.811 6.794 -17.060 1.00 35.25 H new ATOM 0 HB3 ASP A 104 12.058 5.205 -16.363 1.00 35.25 H new ATOM 708 N VAL A 105 9.141 3.711 -15.679 1.00 42.32 N ATOM 709 CA VAL A 105 8.840 2.906 -14.502 1.00 14.35 C ATOM 710 C VAL A 105 9.968 1.926 -14.202 1.00 42.11 C ATOM 711 O VAL A 105 10.222 1.003 -14.975 1.00 62.21 O ATOM 712 CB VAL A 105 7.526 2.121 -14.680 1.00 4.45 C ATOM 713 CG1 VAL A 105 7.227 1.293 -13.439 1.00 51.23 C ATOM 714 CG2 VAL A 105 6.377 3.069 -14.988 1.00 43.21 C ATOM 0 H VAL A 105 8.838 3.298 -16.561 1.00 42.32 H new ATOM 0 HA VAL A 105 8.732 3.597 -13.666 1.00 14.35 H new ATOM 0 HB VAL A 105 7.641 1.440 -15.523 1.00 4.45 H new ATOM 0 HG11 VAL A 105 6.296 0.745 -13.583 1.00 51.23 H new ATOM 0 HG12 VAL A 105 8.040 0.587 -13.268 1.00 51.23 H new ATOM 0 HG13 VAL A 105 7.131 1.952 -12.576 1.00 51.23 H new ATOM 0 HG21 VAL A 105 5.457 2.498 -15.111 1.00 43.21 H new ATOM 0 HG22 VAL A 105 6.258 3.776 -14.167 1.00 43.21 H new ATOM 0 HG23 VAL A 105 6.591 3.614 -15.908 1.00 43.21 H new ATOM 724 N GLN A 106 10.641 2.134 -13.075 1.00 64.41 N ATOM 725 CA GLN A 106 11.744 1.268 -12.674 1.00 33.43 C ATOM 726 C GLN A 106 11.307 0.305 -11.574 1.00 62.03 C ATOM 727 O GLN A 106 10.193 0.399 -11.058 1.00 51.54 O ATOM 728 CB GLN A 106 12.930 2.106 -12.193 1.00 34.31 C ATOM 729 CG GLN A 106 13.309 3.226 -13.147 1.00 45.24 C ATOM 730 CD GLN A 106 14.002 2.719 -14.397 1.00 32.30 C ATOM 731 OE1 GLN A 106 14.129 1.511 -14.603 1.00 41.53 O ATOM 732 NE2 GLN A 106 14.454 3.640 -15.239 1.00 53.44 N ATOM 0 H GLN A 106 10.442 2.894 -12.424 1.00 64.41 H new ATOM 0 HA GLN A 106 12.049 0.685 -13.543 1.00 33.43 H new ATOM 0 HB2 GLN A 106 12.691 2.534 -11.220 1.00 34.31 H new ATOM 0 HB3 GLN A 106 13.792 1.454 -12.051 1.00 34.31 H new ATOM 0 HG2 GLN A 106 12.411 3.775 -13.431 1.00 45.24 H new ATOM 0 HG3 GLN A 106 13.964 3.930 -12.633 1.00 45.24 H new ATOM 0 HE21 GLN A 106 14.327 4.630 -15.028 1.00 53.44 H new ATOM 0 HE22 GLN A 106 14.928 3.358 -16.097 1.00 53.44 H new ATOM 741 N HIS A 107 12.192 -0.622 -11.220 1.00 50.32 N ATOM 742 CA HIS A 107 11.898 -1.602 -10.181 1.00 72.22 C ATOM 743 C HIS A 107 13.167 -2.000 -9.435 1.00 24.52 C ATOM 744 O HIS A 107 14.278 -1.714 -9.882 1.00 3.02 O ATOM 745 CB HIS A 107 11.241 -2.841 -10.791 1.00 12.03 C ATOM 746 CG HIS A 107 11.530 -3.015 -12.250 1.00 35.30 C ATOM 747 ND1 HIS A 107 12.751 -3.437 -12.730 1.00 45.22 N ATOM 748 CD2 HIS A 107 10.745 -2.824 -13.337 1.00 25.24 C ATOM 749 CE1 HIS A 107 12.707 -3.496 -14.049 1.00 41.32 C ATOM 750 NE2 HIS A 107 11.500 -3.129 -14.442 1.00 65.33 N ATOM 0 H HIS A 107 13.118 -0.715 -11.637 1.00 50.32 H new ATOM 0 HA HIS A 107 11.208 -1.146 -9.471 1.00 72.22 H new ATOM 0 HB2 HIS A 107 11.583 -3.725 -10.253 1.00 12.03 H new ATOM 0 HB3 HIS A 107 10.162 -2.778 -10.648 1.00 12.03 H new ATOM 0 HD2 HIS A 107 9.717 -2.493 -13.335 1.00 25.24 H new ATOM 0 HE1 HIS A 107 13.519 -3.793 -14.696 1.00 41.32 H new ATOM 0 HE2 HIS A 107 11.181 -3.080 -15.410 1.00 65.33 H new ATOM 758 N PHE A 108 12.995 -2.662 -8.295 1.00 42.11 N ATOM 759 CA PHE A 108 14.127 -3.098 -7.486 1.00 2.13 C ATOM 760 C PHE A 108 13.902 -4.509 -6.952 1.00 22.45 C ATOM 761 O PHE A 108 12.949 -4.763 -6.215 1.00 13.41 O ATOM 762 CB PHE A 108 14.352 -2.130 -6.322 1.00 42.01 C ATOM 763 CG PHE A 108 14.743 -0.747 -6.760 1.00 32.24 C ATOM 764 CD1 PHE A 108 13.776 0.187 -7.095 1.00 72.40 C ATOM 765 CD2 PHE A 108 16.077 -0.382 -6.836 1.00 1.50 C ATOM 766 CE1 PHE A 108 14.132 1.460 -7.498 1.00 12.13 C ATOM 767 CE2 PHE A 108 16.439 0.890 -7.237 1.00 40.55 C ATOM 768 CZ PHE A 108 15.465 1.812 -7.570 1.00 3.01 C ATOM 0 H PHE A 108 12.083 -2.908 -7.911 1.00 42.11 H new ATOM 0 HA PHE A 108 15.013 -3.105 -8.120 1.00 2.13 H new ATOM 0 HB2 PHE A 108 13.440 -2.070 -5.728 1.00 42.01 H new ATOM 0 HB3 PHE A 108 15.130 -2.530 -5.672 1.00 42.01 H new ATOM 0 HD1 PHE A 108 12.732 -0.083 -7.041 1.00 72.40 H new ATOM 0 HD2 PHE A 108 16.843 -1.099 -6.579 1.00 1.50 H new ATOM 0 HE1 PHE A 108 13.368 2.179 -7.756 1.00 12.13 H new ATOM 0 HE2 PHE A 108 17.482 1.163 -7.290 1.00 40.55 H new ATOM 0 HZ PHE A 108 15.746 2.806 -7.886 1.00 3.01 H new ATOM 778 N LYS A 109 14.787 -5.426 -7.329 1.00 31.22 N ATOM 779 CA LYS A 109 14.688 -6.813 -6.889 1.00 14.33 C ATOM 780 C LYS A 109 15.001 -6.935 -5.401 1.00 33.11 C ATOM 781 O LYS A 109 16.160 -6.868 -4.993 1.00 22.13 O ATOM 782 CB LYS A 109 15.642 -7.695 -7.696 1.00 24.20 C ATOM 783 CG LYS A 109 14.938 -8.609 -8.684 1.00 13.32 C ATOM 784 CD LYS A 109 15.584 -9.983 -8.731 1.00 70.11 C ATOM 785 CE LYS A 109 15.308 -10.773 -7.461 1.00 3.44 C ATOM 786 NZ LYS A 109 16.027 -12.077 -7.451 1.00 73.03 N ATOM 0 H LYS A 109 15.582 -5.233 -7.939 1.00 31.22 H new ATOM 0 HA LYS A 109 13.665 -7.149 -7.056 1.00 14.33 H new ATOM 0 HB2 LYS A 109 16.341 -7.058 -8.238 1.00 24.20 H new ATOM 0 HB3 LYS A 109 16.231 -8.302 -7.009 1.00 24.20 H new ATOM 0 HG2 LYS A 109 13.889 -8.709 -8.405 1.00 13.32 H new ATOM 0 HG3 LYS A 109 14.962 -8.160 -9.677 1.00 13.32 H new ATOM 0 HD2 LYS A 109 15.207 -10.534 -9.593 1.00 70.11 H new ATOM 0 HD3 LYS A 109 16.660 -9.876 -8.867 1.00 70.11 H new ATOM 0 HE2 LYS A 109 15.611 -10.185 -6.595 1.00 3.44 H new ATOM 0 HE3 LYS A 109 14.236 -10.949 -7.368 1.00 3.44 H new ATOM 0 HZ1 LYS A 109 15.354 -12.843 -7.248 1.00 73.03 H new ATOM 0 HZ2 LYS A 109 16.466 -12.239 -8.380 1.00 73.03 H new ATOM 0 HZ3 LYS A 109 16.764 -12.061 -6.718 1.00 73.03 H new ATOM 800 N VAL A 110 13.960 -7.116 -4.595 1.00 35.35 N ATOM 801 CA VAL A 110 14.124 -7.251 -3.152 1.00 50.21 C ATOM 802 C VAL A 110 14.902 -8.515 -2.803 1.00 50.42 C ATOM 803 O VAL A 110 14.480 -9.626 -3.126 1.00 51.11 O ATOM 804 CB VAL A 110 12.763 -7.284 -2.433 1.00 35.23 C ATOM 805 CG1 VAL A 110 12.925 -7.782 -1.005 1.00 1.04 C ATOM 806 CG2 VAL A 110 12.114 -5.908 -2.456 1.00 22.21 C ATOM 0 H VAL A 110 12.994 -7.173 -4.917 1.00 35.35 H new ATOM 0 HA VAL A 110 14.684 -6.379 -2.814 1.00 50.21 H new ATOM 0 HB VAL A 110 12.109 -7.977 -2.962 1.00 35.23 H new ATOM 0 HG11 VAL A 110 11.953 -7.798 -0.513 1.00 1.04 H new ATOM 0 HG12 VAL A 110 13.343 -8.789 -1.016 1.00 1.04 H new ATOM 0 HG13 VAL A 110 13.596 -7.116 -0.461 1.00 1.04 H new ATOM 0 HG21 VAL A 110 11.153 -5.950 -1.943 1.00 22.21 H new ATOM 0 HG22 VAL A 110 12.763 -5.191 -1.952 1.00 22.21 H new ATOM 0 HG23 VAL A 110 11.961 -5.595 -3.489 1.00 22.21 H new ATOM 816 N LEU A 111 16.040 -8.338 -2.142 1.00 23.14 N ATOM 817 CA LEU A 111 16.879 -9.465 -1.747 1.00 53.12 C ATOM 818 C LEU A 111 16.399 -10.066 -0.430 1.00 73.22 C ATOM 819 O LEU A 111 16.414 -9.404 0.608 1.00 63.51 O ATOM 820 CB LEU A 111 18.336 -9.020 -1.617 1.00 25.23 C ATOM 821 CG LEU A 111 19.258 -9.392 -2.779 1.00 22.23 C ATOM 822 CD1 LEU A 111 19.080 -10.855 -3.154 1.00 24.21 C ATOM 823 CD2 LEU A 111 18.992 -8.496 -3.979 1.00 54.40 C ATOM 0 H LEU A 111 16.404 -7.425 -1.868 1.00 23.14 H new ATOM 0 HA LEU A 111 16.807 -10.229 -2.521 1.00 53.12 H new ATOM 0 HB2 LEU A 111 18.355 -7.937 -1.497 1.00 25.23 H new ATOM 0 HB3 LEU A 111 18.746 -9.449 -0.703 1.00 25.23 H new ATOM 0 HG LEU A 111 20.290 -9.242 -2.461 1.00 22.23 H new ATOM 0 HD11 LEU A 111 19.744 -11.102 -3.983 1.00 24.21 H new ATOM 0 HD12 LEU A 111 19.322 -11.483 -2.296 1.00 24.21 H new ATOM 0 HD13 LEU A 111 18.047 -11.031 -3.453 1.00 24.21 H new ATOM 0 HD21 LEU A 111 19.657 -8.775 -4.796 1.00 54.40 H new ATOM 0 HD22 LEU A 111 17.956 -8.613 -4.298 1.00 54.40 H new ATOM 0 HD23 LEU A 111 19.172 -7.457 -3.704 1.00 54.40 H new ATOM 835 N ARG A 112 15.975 -11.325 -0.480 1.00 15.31 N ATOM 836 CA ARG A 112 15.491 -12.016 0.709 1.00 1.44 C ATOM 837 C ARG A 112 16.331 -13.257 0.996 1.00 11.11 C ATOM 838 O ARG A 112 16.793 -13.932 0.076 1.00 33.31 O ATOM 839 CB ARG A 112 14.023 -12.409 0.535 1.00 21.03 C ATOM 840 CG ARG A 112 13.755 -13.220 -0.722 1.00 52.32 C ATOM 841 CD ARG A 112 13.191 -12.351 -1.836 1.00 5.54 C ATOM 842 NE ARG A 112 13.872 -12.581 -3.107 1.00 73.02 N ATOM 843 CZ ARG A 112 13.939 -13.768 -3.700 1.00 50.22 C ATOM 844 NH1 ARG A 112 13.370 -14.826 -3.139 1.00 51.15 N ATOM 845 NH2 ARG A 112 14.576 -13.898 -4.857 1.00 1.22 N ATOM 0 H ARG A 112 15.957 -11.887 -1.331 1.00 15.31 H new ATOM 0 HA ARG A 112 15.579 -11.335 1.556 1.00 1.44 H new ATOM 0 HB2 ARG A 112 13.704 -12.985 1.404 1.00 21.03 H new ATOM 0 HB3 ARG A 112 13.414 -11.505 0.511 1.00 21.03 H new ATOM 0 HG2 ARG A 112 14.680 -13.689 -1.058 1.00 52.32 H new ATOM 0 HG3 ARG A 112 13.054 -14.023 -0.495 1.00 52.32 H new ATOM 0 HD2 ARG A 112 12.127 -12.556 -1.952 1.00 5.54 H new ATOM 0 HD3 ARG A 112 13.285 -11.301 -1.559 1.00 5.54 H new ATOM 0 HE ARG A 112 14.321 -11.787 -3.564 1.00 73.02 H new ATOM 0 HH11 ARG A 112 12.879 -14.730 -2.250 1.00 51.15 H new ATOM 0 HH12 ARG A 112 13.423 -15.736 -3.596 1.00 51.15 H new ATOM 0 HH21 ARG A 112 15.015 -13.086 -5.292 1.00 1.22 H new ATOM 0 HH22 ARG A 112 14.627 -14.810 -5.312 1.00 1.22 H new ATOM 859 N ASP A 113 16.525 -13.551 2.277 1.00 11.50 N ATOM 860 CA ASP A 113 17.309 -14.711 2.685 1.00 14.44 C ATOM 861 C ASP A 113 16.399 -15.854 3.124 1.00 12.11 C ATOM 862 O ASP A 113 15.175 -15.730 3.103 1.00 70.15 O ATOM 863 CB ASP A 113 18.261 -14.335 3.822 1.00 72.21 C ATOM 864 CG ASP A 113 19.413 -15.311 3.958 1.00 34.34 C ATOM 865 OD1 ASP A 113 19.763 -15.960 2.951 1.00 65.44 O ATOM 866 OD2 ASP A 113 19.964 -15.426 5.073 1.00 51.31 O ATOM 0 H ASP A 113 16.150 -13.002 3.051 1.00 11.50 H new ATOM 0 HA ASP A 113 17.893 -15.044 1.827 1.00 14.44 H new ATOM 0 HB2 ASP A 113 18.655 -13.334 3.646 1.00 72.21 H new ATOM 0 HB3 ASP A 113 17.706 -14.299 4.760 1.00 72.21 H new ATOM 871 N GLY A 114 17.006 -16.968 3.521 1.00 22.03 N ATOM 872 CA GLY A 114 16.236 -18.118 3.958 1.00 12.42 C ATOM 873 C GLY A 114 15.825 -18.021 5.414 1.00 55.31 C ATOM 874 O GLY A 114 15.776 -19.027 6.120 1.00 35.13 O ATOM 0 H GLY A 114 18.018 -17.095 3.548 1.00 22.03 H new ATOM 0 HA2 GLY A 114 15.345 -18.212 3.338 1.00 12.42 H new ATOM 0 HA3 GLY A 114 16.825 -19.023 3.809 1.00 12.42 H new ATOM 878 N ALA A 115 15.530 -16.806 5.864 1.00 13.42 N ATOM 879 CA ALA A 115 15.120 -16.581 7.245 1.00 25.11 C ATOM 880 C ALA A 115 13.910 -15.656 7.316 1.00 43.14 C ATOM 881 O ALA A 115 12.958 -15.918 8.049 1.00 70.32 O ATOM 882 CB ALA A 115 16.275 -16.005 8.051 1.00 44.12 C ATOM 0 H ALA A 115 15.567 -15.962 5.292 1.00 13.42 H new ATOM 0 HA ALA A 115 14.835 -17.542 7.674 1.00 25.11 H new ATOM 0 HB1 ALA A 115 15.955 -15.842 9.080 1.00 44.12 H new ATOM 0 HB2 ALA A 115 17.112 -16.703 8.038 1.00 44.12 H new ATOM 0 HB3 ALA A 115 16.587 -15.057 7.613 1.00 44.12 H new ATOM 888 N GLY A 116 13.955 -14.571 6.548 1.00 10.12 N ATOM 889 CA GLY A 116 12.856 -13.623 6.540 1.00 43.25 C ATOM 890 C GLY A 116 13.331 -12.185 6.617 1.00 35.10 C ATOM 891 O GLY A 116 12.667 -11.335 7.211 1.00 32.44 O ATOM 0 H GLY A 116 14.732 -14.332 5.932 1.00 10.12 H new ATOM 0 HA2 GLY A 116 12.268 -13.760 5.632 1.00 43.25 H new ATOM 0 HA3 GLY A 116 12.195 -13.830 7.382 1.00 43.25 H new ATOM 895 N LYS A 117 14.484 -11.911 6.016 1.00 15.14 N ATOM 896 CA LYS A 117 15.048 -10.566 6.019 1.00 33.45 C ATOM 897 C LYS A 117 15.128 -10.007 4.603 1.00 53.32 C ATOM 898 O LYS A 117 15.211 -10.759 3.632 1.00 53.14 O ATOM 899 CB LYS A 117 16.440 -10.577 6.655 1.00 40.25 C ATOM 900 CG LYS A 117 16.468 -11.178 8.049 1.00 20.01 C ATOM 901 CD LYS A 117 16.713 -10.117 9.109 1.00 63.12 C ATOM 902 CE LYS A 117 16.864 -10.734 10.491 1.00 73.21 C ATOM 903 NZ LYS A 117 15.668 -10.485 11.343 1.00 41.22 N ATOM 0 H LYS A 117 15.046 -12.603 5.520 1.00 15.14 H new ATOM 0 HA LYS A 117 14.392 -9.924 6.607 1.00 33.45 H new ATOM 0 HB2 LYS A 117 17.119 -11.138 6.013 1.00 40.25 H new ATOM 0 HB3 LYS A 117 16.817 -9.555 6.702 1.00 40.25 H new ATOM 0 HG2 LYS A 117 15.522 -11.681 8.248 1.00 20.01 H new ATOM 0 HG3 LYS A 117 17.250 -11.936 8.104 1.00 20.01 H new ATOM 0 HD2 LYS A 117 17.613 -9.554 8.861 1.00 63.12 H new ATOM 0 HD3 LYS A 117 15.885 -9.408 9.114 1.00 63.12 H new ATOM 0 HE2 LYS A 117 17.024 -11.808 10.394 1.00 73.21 H new ATOM 0 HE3 LYS A 117 17.749 -10.323 10.978 1.00 73.21 H new ATOM 0 HZ1 LYS A 117 15.885 -10.738 12.328 1.00 41.22 H new ATOM 0 HZ2 LYS A 117 15.409 -9.479 11.292 1.00 41.22 H new ATOM 0 HZ3 LYS A 117 14.874 -11.064 11.004 1.00 41.22 H new ATOM 917 N TYR A 118 15.104 -8.683 4.492 1.00 33.24 N ATOM 918 CA TYR A 118 15.173 -8.023 3.194 1.00 34.12 C ATOM 919 C TYR A 118 16.278 -6.971 3.176 1.00 75.32 C ATOM 920 O TYR A 118 16.640 -6.416 4.213 1.00 33.13 O ATOM 921 CB TYR A 118 13.829 -7.374 2.857 1.00 44.13 C ATOM 922 CG TYR A 118 12.665 -8.337 2.895 1.00 74.23 C ATOM 923 CD1 TYR A 118 12.533 -9.336 1.938 1.00 31.41 C ATOM 924 CD2 TYR A 118 11.696 -8.248 3.886 1.00 15.12 C ATOM 925 CE1 TYR A 118 11.470 -10.219 1.968 1.00 1.43 C ATOM 926 CE2 TYR A 118 10.630 -9.127 3.925 1.00 3.51 C ATOM 927 CZ TYR A 118 10.522 -10.110 2.964 1.00 52.10 C ATOM 928 OH TYR A 118 9.461 -10.986 2.998 1.00 23.14 O ATOM 0 H TYR A 118 15.037 -8.046 5.286 1.00 33.24 H new ATOM 0 HA TYR A 118 15.403 -8.778 2.442 1.00 34.12 H new ATOM 0 HB2 TYR A 118 13.641 -6.562 3.559 1.00 44.13 H new ATOM 0 HB3 TYR A 118 13.889 -6.929 1.864 1.00 44.13 H new ATOM 0 HD1 TYR A 118 13.274 -9.424 1.157 1.00 31.41 H new ATOM 0 HD2 TYR A 118 11.777 -7.478 4.639 1.00 15.12 H new ATOM 0 HE1 TYR A 118 11.382 -10.989 1.216 1.00 1.43 H new ATOM 0 HE2 TYR A 118 9.886 -9.044 4.704 1.00 3.51 H new ATOM 0 HH TYR A 118 8.780 -10.700 2.354 1.00 23.14 H new ATOM 938 N PHE A 119 16.809 -6.702 1.988 1.00 42.10 N ATOM 939 CA PHE A 119 17.873 -5.717 1.832 1.00 23.03 C ATOM 940 C PHE A 119 18.114 -5.405 0.358 1.00 10.22 C ATOM 941 O PHE A 119 17.580 -6.076 -0.526 1.00 23.52 O ATOM 942 CB PHE A 119 19.165 -6.225 2.475 1.00 24.12 C ATOM 943 CG PHE A 119 19.637 -7.537 1.917 1.00 31.42 C ATOM 944 CD1 PHE A 119 18.859 -8.677 2.040 1.00 30.33 C ATOM 945 CD2 PHE A 119 20.859 -7.631 1.270 1.00 35.20 C ATOM 946 CE1 PHE A 119 19.290 -9.886 1.528 1.00 73.54 C ATOM 947 CE2 PHE A 119 21.294 -8.837 0.755 1.00 23.50 C ATOM 948 CZ PHE A 119 20.510 -9.967 0.885 1.00 55.30 C ATOM 0 H PHE A 119 16.520 -7.152 1.119 1.00 42.10 H new ATOM 0 HA PHE A 119 17.562 -4.800 2.333 1.00 23.03 H new ATOM 0 HB2 PHE A 119 19.947 -5.479 2.338 1.00 24.12 H new ATOM 0 HB3 PHE A 119 19.010 -6.331 3.549 1.00 24.12 H new ATOM 0 HD1 PHE A 119 17.904 -8.620 2.542 1.00 30.33 H new ATOM 0 HD2 PHE A 119 21.478 -6.752 1.167 1.00 35.20 H new ATOM 0 HE1 PHE A 119 18.674 -10.767 1.630 1.00 73.54 H new ATOM 0 HE2 PHE A 119 22.247 -8.896 0.251 1.00 23.50 H new ATOM 0 HZ PHE A 119 20.850 -10.911 0.485 1.00 55.30 H new ATOM 958 N LEU A 120 18.920 -4.381 0.101 1.00 64.13 N ATOM 959 CA LEU A 120 19.232 -3.978 -1.266 1.00 65.02 C ATOM 960 C LEU A 120 20.738 -4.004 -1.511 1.00 72.34 C ATOM 961 O LEU A 120 21.220 -4.711 -2.396 1.00 60.41 O ATOM 962 CB LEU A 120 18.683 -2.578 -1.544 1.00 4.42 C ATOM 963 CG LEU A 120 17.162 -2.460 -1.637 1.00 53.40 C ATOM 964 CD1 LEU A 120 16.681 -1.194 -0.944 1.00 30.22 C ATOM 965 CD2 LEU A 120 16.714 -2.476 -3.091 1.00 75.31 C ATOM 0 H LEU A 120 19.369 -3.815 0.821 1.00 64.13 H new ATOM 0 HA LEU A 120 18.759 -4.688 -1.945 1.00 65.02 H new ATOM 0 HB2 LEU A 120 19.032 -1.910 -0.757 1.00 4.42 H new ATOM 0 HB3 LEU A 120 19.113 -2.220 -2.479 1.00 4.42 H new ATOM 0 HG LEU A 120 16.719 -3.318 -1.131 1.00 53.40 H new ATOM 0 HD11 LEU A 120 15.596 -1.127 -1.021 1.00 30.22 H new ATOM 0 HD12 LEU A 120 16.970 -1.222 0.107 1.00 30.22 H new ATOM 0 HD13 LEU A 120 17.133 -0.324 -1.421 1.00 30.22 H new ATOM 0 HD21 LEU A 120 15.628 -2.391 -3.138 1.00 75.31 H new ATOM 0 HD22 LEU A 120 17.167 -1.638 -3.621 1.00 75.31 H new ATOM 0 HD23 LEU A 120 17.025 -3.411 -3.557 1.00 75.31 H new ATOM 977 N TRP A 121 21.474 -3.231 -0.721 1.00 71.33 N ATOM 978 CA TRP A 121 22.925 -3.168 -0.851 1.00 42.34 C ATOM 979 C TRP A 121 23.555 -2.527 0.381 1.00 73.51 C ATOM 980 O TRP A 121 24.664 -2.884 0.780 1.00 54.44 O ATOM 981 CB TRP A 121 23.312 -2.380 -2.104 1.00 55.13 C ATOM 982 CG TRP A 121 22.170 -1.611 -2.698 1.00 2.22 C ATOM 983 CD1 TRP A 121 21.142 -1.018 -2.022 1.00 60.10 C ATOM 984 CD2 TRP A 121 21.941 -1.353 -4.087 1.00 71.54 C ATOM 985 NE1 TRP A 121 20.287 -0.408 -2.908 1.00 2.20 N ATOM 986 CE2 TRP A 121 20.755 -0.598 -4.181 1.00 65.21 C ATOM 987 CE3 TRP A 121 22.622 -1.686 -5.261 1.00 43.53 C ATOM 988 CZ2 TRP A 121 20.239 -0.173 -5.402 1.00 10.40 C ATOM 989 CZ3 TRP A 121 22.108 -1.263 -6.472 1.00 42.42 C ATOM 990 CH2 TRP A 121 20.927 -0.512 -6.535 1.00 74.13 C ATOM 0 H TRP A 121 21.090 -2.639 0.016 1.00 71.33 H new ATOM 0 HA TRP A 121 23.301 -4.187 -0.940 1.00 42.34 H new ATOM 0 HB2 TRP A 121 24.117 -1.688 -1.855 1.00 55.13 H new ATOM 0 HB3 TRP A 121 23.704 -3.069 -2.851 1.00 55.13 H new ATOM 0 HD1 TRP A 121 21.019 -1.027 -0.949 1.00 60.10 H new ATOM 0 HE1 TRP A 121 19.441 0.104 -2.658 1.00 2.20 H new ATOM 0 HE3 TRP A 121 23.534 -2.264 -5.223 1.00 43.53 H new ATOM 0 HZ2 TRP A 121 19.328 0.404 -5.453 1.00 10.40 H new ATOM 0 HZ3 TRP A 121 22.626 -1.516 -7.386 1.00 42.42 H new ATOM 0 HH2 TRP A 121 20.552 -0.194 -7.497 1.00 74.13 H new ATOM 1001 N VAL A 122 22.840 -1.581 0.981 1.00 2.30 N ATOM 1002 CA VAL A 122 23.329 -0.892 2.169 1.00 10.34 C ATOM 1003 C VAL A 122 22.212 -0.691 3.187 1.00 55.02 C ATOM 1004 O VAL A 122 22.191 0.302 3.915 1.00 73.25 O ATOM 1005 CB VAL A 122 23.937 0.478 1.814 1.00 51.12 C ATOM 1006 CG1 VAL A 122 25.331 0.308 1.230 1.00 41.42 C ATOM 1007 CG2 VAL A 122 23.032 1.227 0.847 1.00 43.10 C ATOM 0 H VAL A 122 21.920 -1.274 0.664 1.00 2.30 H new ATOM 0 HA VAL A 122 24.104 -1.523 2.604 1.00 10.34 H new ATOM 0 HB VAL A 122 24.021 1.067 2.727 1.00 51.12 H new ATOM 0 HG11 VAL A 122 25.745 1.286 0.985 1.00 41.42 H new ATOM 0 HG12 VAL A 122 25.973 -0.185 1.959 1.00 41.42 H new ATOM 0 HG13 VAL A 122 25.275 -0.299 0.326 1.00 41.42 H new ATOM 0 HG21 VAL A 122 23.476 2.193 0.607 1.00 43.10 H new ATOM 0 HG22 VAL A 122 22.914 0.644 -0.067 1.00 43.10 H new ATOM 0 HG23 VAL A 122 22.056 1.381 1.307 1.00 43.10 H new ATOM 1017 N VAL A 123 21.283 -1.641 3.233 1.00 52.12 N ATOM 1018 CA VAL A 123 20.162 -1.570 4.163 1.00 51.24 C ATOM 1019 C VAL A 123 19.494 -2.931 4.323 1.00 11.30 C ATOM 1020 O VAL A 123 19.304 -3.661 3.350 1.00 43.42 O ATOM 1021 CB VAL A 123 19.110 -0.546 3.696 1.00 2.44 C ATOM 1022 CG1 VAL A 123 18.368 -1.061 2.473 1.00 65.15 C ATOM 1023 CG2 VAL A 123 18.140 -0.229 4.824 1.00 55.40 C ATOM 0 H VAL A 123 21.285 -2.469 2.637 1.00 52.12 H new ATOM 0 HA VAL A 123 20.567 -1.252 5.124 1.00 51.24 H new ATOM 0 HB VAL A 123 19.623 0.375 3.418 1.00 2.44 H new ATOM 0 HG11 VAL A 123 17.629 -0.324 2.158 1.00 65.15 H new ATOM 0 HG12 VAL A 123 19.077 -1.233 1.663 1.00 65.15 H new ATOM 0 HG13 VAL A 123 17.865 -1.996 2.720 1.00 65.15 H new ATOM 0 HG21 VAL A 123 17.403 0.496 4.478 1.00 55.40 H new ATOM 0 HG22 VAL A 123 17.632 -1.142 5.135 1.00 55.40 H new ATOM 0 HG23 VAL A 123 18.688 0.187 5.669 1.00 55.40 H new ATOM 1033 N LYS A 124 19.138 -3.267 5.558 1.00 12.22 N ATOM 1034 CA LYS A 124 18.489 -4.540 5.848 1.00 15.22 C ATOM 1035 C LYS A 124 17.363 -4.358 6.861 1.00 11.04 C ATOM 1036 O LYS A 124 17.423 -3.478 7.720 1.00 3.31 O ATOM 1037 CB LYS A 124 19.510 -5.547 6.380 1.00 22.33 C ATOM 1038 CG LYS A 124 20.786 -5.612 5.558 1.00 34.21 C ATOM 1039 CD LYS A 124 21.319 -7.032 5.468 1.00 61.14 C ATOM 1040 CE LYS A 124 22.827 -7.049 5.270 1.00 21.32 C ATOM 1041 NZ LYS A 124 23.553 -6.654 6.509 1.00 43.13 N ATOM 0 H LYS A 124 19.288 -2.675 6.375 1.00 12.22 H new ATOM 0 HA LYS A 124 18.062 -4.921 4.920 1.00 15.22 H new ATOM 0 HB2 LYS A 124 19.763 -5.287 7.408 1.00 22.33 H new ATOM 0 HB3 LYS A 124 19.053 -6.536 6.405 1.00 22.33 H new ATOM 0 HG2 LYS A 124 20.594 -5.230 4.555 1.00 34.21 H new ATOM 0 HG3 LYS A 124 21.542 -4.966 6.006 1.00 34.21 H new ATOM 0 HD2 LYS A 124 21.064 -7.576 6.378 1.00 61.14 H new ATOM 0 HD3 LYS A 124 20.836 -7.551 4.640 1.00 61.14 H new ATOM 0 HE2 LYS A 124 23.142 -8.047 4.967 1.00 21.32 H new ATOM 0 HE3 LYS A 124 23.095 -6.370 4.460 1.00 21.32 H new ATOM 0 HZ1 LYS A 124 24.544 -6.962 6.444 1.00 43.13 H new ATOM 0 HZ2 LYS A 124 23.518 -5.620 6.617 1.00 43.13 H new ATOM 0 HZ3 LYS A 124 23.104 -7.103 7.333 1.00 43.13 H new ATOM 1055 N PHE A 125 16.337 -5.197 6.756 1.00 4.45 N ATOM 1056 CA PHE A 125 15.198 -5.128 7.664 1.00 21.42 C ATOM 1057 C PHE A 125 14.547 -6.499 7.824 1.00 23.31 C ATOM 1058 O PHE A 125 14.991 -7.482 7.231 1.00 11.41 O ATOM 1059 CB PHE A 125 14.169 -4.120 7.150 1.00 10.41 C ATOM 1060 CG PHE A 125 14.600 -2.690 7.308 1.00 4.32 C ATOM 1061 CD1 PHE A 125 14.613 -2.090 8.557 1.00 22.24 C ATOM 1062 CD2 PHE A 125 14.994 -1.945 6.208 1.00 72.10 C ATOM 1063 CE1 PHE A 125 15.009 -0.774 8.705 1.00 20.34 C ATOM 1064 CE2 PHE A 125 15.391 -0.629 6.350 1.00 41.21 C ATOM 1065 CZ PHE A 125 15.400 -0.043 7.601 1.00 74.14 C ATOM 0 H PHE A 125 16.271 -5.932 6.052 1.00 4.45 H new ATOM 0 HA PHE A 125 15.561 -4.801 8.638 1.00 21.42 H new ATOM 0 HB2 PHE A 125 13.973 -4.318 6.096 1.00 10.41 H new ATOM 0 HB3 PHE A 125 13.229 -4.269 7.682 1.00 10.41 H new ATOM 0 HD1 PHE A 125 14.310 -2.657 9.425 1.00 22.24 H new ATOM 0 HD2 PHE A 125 14.991 -2.398 5.228 1.00 72.10 H new ATOM 0 HE1 PHE A 125 15.013 -0.318 9.684 1.00 20.34 H new ATOM 0 HE2 PHE A 125 15.694 -0.059 5.484 1.00 41.21 H new ATOM 0 HZ PHE A 125 15.712 0.985 7.715 1.00 74.14 H new ATOM 1075 N ASN A 126 13.492 -6.556 8.631 1.00 65.54 N ATOM 1076 CA ASN A 126 12.780 -7.806 8.870 1.00 24.53 C ATOM 1077 C ASN A 126 11.567 -7.926 7.953 1.00 64.13 C ATOM 1078 O ASN A 126 11.253 -9.010 7.461 1.00 51.45 O ATOM 1079 CB ASN A 126 12.338 -7.894 10.332 1.00 4.45 C ATOM 1080 CG ASN A 126 13.324 -7.230 11.275 1.00 52.41 C ATOM 1081 OD1 ASN A 126 14.286 -7.852 11.724 1.00 62.30 O ATOM 1082 ND2 ASN A 126 13.087 -5.959 11.579 1.00 11.10 N ATOM 0 H ASN A 126 13.112 -5.752 9.130 1.00 65.54 H new ATOM 0 HA ASN A 126 13.460 -8.629 8.652 1.00 24.53 H new ATOM 0 HB2 ASN A 126 11.361 -7.424 10.442 1.00 4.45 H new ATOM 0 HB3 ASN A 126 12.221 -8.941 10.611 1.00 4.45 H new ATOM 0 HD21 ASN A 126 13.715 -5.459 12.208 1.00 11.10 H new ATOM 0 HD22 ASN A 126 12.277 -5.482 11.183 1.00 11.10 H new ATOM 1089 N SER A 127 10.890 -6.805 7.727 1.00 42.22 N ATOM 1090 CA SER A 127 9.710 -6.784 6.871 1.00 52.00 C ATOM 1091 C SER A 127 9.891 -5.800 5.719 1.00 63.30 C ATOM 1092 O SER A 127 10.730 -4.900 5.782 1.00 54.00 O ATOM 1093 CB SER A 127 8.470 -6.410 7.685 1.00 11.14 C ATOM 1094 OG SER A 127 7.491 -7.433 7.624 1.00 65.11 O ATOM 0 H SER A 127 11.139 -5.899 8.125 1.00 42.22 H new ATOM 0 HA SER A 127 9.576 -7.783 6.455 1.00 52.00 H new ATOM 0 HB2 SER A 127 8.752 -6.234 8.723 1.00 11.14 H new ATOM 0 HB3 SER A 127 8.050 -5.478 7.306 1.00 11.14 H new ATOM 0 HG SER A 127 6.710 -7.170 8.154 1.00 65.11 H new ATOM 1100 N LEU A 128 9.100 -5.979 4.667 1.00 0.20 N ATOM 1101 CA LEU A 128 9.172 -5.108 3.499 1.00 12.40 C ATOM 1102 C LEU A 128 8.745 -3.687 3.852 1.00 13.45 C ATOM 1103 O LEU A 128 9.295 -2.716 3.334 1.00 14.23 O ATOM 1104 CB LEU A 128 8.288 -5.654 2.376 1.00 2.50 C ATOM 1105 CG LEU A 128 8.618 -7.064 1.888 1.00 63.51 C ATOM 1106 CD1 LEU A 128 7.364 -7.763 1.388 1.00 73.44 C ATOM 1107 CD2 LEU A 128 9.676 -7.017 0.795 1.00 3.11 C ATOM 0 H LEU A 128 8.402 -6.719 4.599 1.00 0.20 H new ATOM 0 HA LEU A 128 10.207 -5.083 3.159 1.00 12.40 H new ATOM 0 HB2 LEU A 128 7.253 -5.642 2.717 1.00 2.50 H new ATOM 0 HB3 LEU A 128 8.352 -4.973 1.527 1.00 2.50 H new ATOM 0 HG LEU A 128 9.017 -7.634 2.727 1.00 63.51 H new ATOM 0 HD11 LEU A 128 7.619 -8.766 1.045 1.00 73.44 H new ATOM 0 HD12 LEU A 128 6.638 -7.830 2.198 1.00 73.44 H new ATOM 0 HD13 LEU A 128 6.935 -7.195 0.562 1.00 73.44 H new ATOM 0 HD21 LEU A 128 9.898 -8.030 0.460 1.00 3.11 H new ATOM 0 HD22 LEU A 128 9.305 -6.430 -0.045 1.00 3.11 H new ATOM 0 HD23 LEU A 128 10.583 -6.557 1.187 1.00 3.11 H new ATOM 1119 N ASN A 129 7.762 -3.573 4.740 1.00 71.10 N ATOM 1120 CA ASN A 129 7.262 -2.270 5.164 1.00 20.44 C ATOM 1121 C ASN A 129 8.412 -1.347 5.554 1.00 43.01 C ATOM 1122 O ASN A 129 8.426 -0.171 5.192 1.00 63.00 O ATOM 1123 CB ASN A 129 6.299 -2.430 6.343 1.00 44.40 C ATOM 1124 CG ASN A 129 5.193 -3.426 6.055 1.00 11.22 C ATOM 1125 OD1 ASN A 129 4.087 -3.048 5.668 1.00 42.41 O ATOM 1126 ND2 ASN A 129 5.487 -4.707 6.244 1.00 33.02 N ATOM 0 H ASN A 129 7.296 -4.367 5.180 1.00 71.10 H new ATOM 0 HA ASN A 129 6.729 -1.822 4.325 1.00 20.44 H new ATOM 0 HB2 ASN A 129 6.856 -2.754 7.222 1.00 44.40 H new ATOM 0 HB3 ASN A 129 5.859 -1.462 6.583 1.00 44.40 H new ATOM 0 HD21 ASN A 129 4.783 -5.423 6.067 1.00 33.02 H new ATOM 0 HD22 ASN A 129 6.417 -4.975 6.566 1.00 33.02 H new ATOM 1133 N GLU A 130 9.375 -1.889 6.293 1.00 20.12 N ATOM 1134 CA GLU A 130 10.529 -1.113 6.732 1.00 61.23 C ATOM 1135 C GLU A 130 11.225 -0.455 5.544 1.00 63.11 C ATOM 1136 O GLU A 130 11.851 0.597 5.681 1.00 14.32 O ATOM 1137 CB GLU A 130 11.517 -2.007 7.484 1.00 33.53 C ATOM 1138 CG GLU A 130 11.145 -2.235 8.940 1.00 52.51 C ATOM 1139 CD GLU A 130 10.044 -3.264 9.107 1.00 11.21 C ATOM 1140 OE1 GLU A 130 10.361 -4.470 9.155 1.00 24.42 O ATOM 1141 OE2 GLU A 130 8.864 -2.862 9.190 1.00 44.30 O ATOM 0 H GLU A 130 9.379 -2.862 6.600 1.00 20.12 H new ATOM 0 HA GLU A 130 10.175 -0.331 7.403 1.00 61.23 H new ATOM 0 HB2 GLU A 130 11.579 -2.971 6.978 1.00 33.53 H new ATOM 0 HB3 GLU A 130 12.509 -1.558 7.437 1.00 33.53 H new ATOM 0 HG2 GLU A 130 12.028 -2.561 9.490 1.00 52.51 H new ATOM 0 HG3 GLU A 130 10.825 -1.291 9.381 1.00 52.51 H new ATOM 1148 N LEU A 131 11.113 -1.082 4.378 1.00 20.33 N ATOM 1149 CA LEU A 131 11.732 -0.559 3.165 1.00 14.12 C ATOM 1150 C LEU A 131 10.855 0.514 2.526 1.00 23.42 C ATOM 1151 O LEU A 131 11.344 1.566 2.115 1.00 63.24 O ATOM 1152 CB LEU A 131 11.981 -1.691 2.167 1.00 22.12 C ATOM 1153 CG LEU A 131 13.253 -2.512 2.387 1.00 14.42 C ATOM 1154 CD1 LEU A 131 13.026 -3.572 3.454 1.00 51.42 C ATOM 1155 CD2 LEU A 131 13.706 -3.152 1.084 1.00 70.55 C ATOM 0 H LEU A 131 10.599 -1.953 4.247 1.00 20.33 H new ATOM 0 HA LEU A 131 12.686 -0.108 3.438 1.00 14.12 H new ATOM 0 HB2 LEU A 131 11.127 -2.367 2.195 1.00 22.12 H new ATOM 0 HB3 LEU A 131 12.017 -1.264 1.165 1.00 22.12 H new ATOM 0 HG LEU A 131 14.040 -1.842 2.732 1.00 14.42 H new ATOM 0 HD11 LEU A 131 13.941 -4.146 3.597 1.00 51.42 H new ATOM 0 HD12 LEU A 131 12.749 -3.091 4.392 1.00 51.42 H new ATOM 0 HD13 LEU A 131 12.224 -4.240 3.139 1.00 51.42 H new ATOM 0 HD21 LEU A 131 14.612 -3.732 1.259 1.00 70.55 H new ATOM 0 HD22 LEU A 131 12.921 -3.809 0.709 1.00 70.55 H new ATOM 0 HD23 LEU A 131 13.910 -2.374 0.348 1.00 70.55 H new ATOM 1167 N VAL A 132 9.557 0.241 2.448 1.00 33.52 N ATOM 1168 CA VAL A 132 8.611 1.183 1.863 1.00 41.23 C ATOM 1169 C VAL A 132 8.627 2.512 2.609 1.00 13.50 C ATOM 1170 O VAL A 132 8.536 3.579 2.001 1.00 72.14 O ATOM 1171 CB VAL A 132 7.178 0.619 1.871 1.00 31.02 C ATOM 1172 CG1 VAL A 132 6.183 1.682 1.432 1.00 53.03 C ATOM 1173 CG2 VAL A 132 7.085 -0.611 0.981 1.00 73.00 C ATOM 0 H VAL A 132 9.136 -0.626 2.783 1.00 33.52 H new ATOM 0 HA VAL A 132 8.923 1.345 0.831 1.00 41.23 H new ATOM 0 HB VAL A 132 6.929 0.322 2.890 1.00 31.02 H new ATOM 0 HG11 VAL A 132 5.176 1.265 1.444 1.00 53.03 H new ATOM 0 HG12 VAL A 132 6.232 2.531 2.114 1.00 53.03 H new ATOM 0 HG13 VAL A 132 6.426 2.014 0.423 1.00 53.03 H new ATOM 0 HG21 VAL A 132 6.066 -0.996 0.998 1.00 73.00 H new ATOM 0 HG22 VAL A 132 7.354 -0.342 -0.041 1.00 73.00 H new ATOM 0 HG23 VAL A 132 7.769 -1.377 1.346 1.00 73.00 H new ATOM 1183 N ASP A 133 8.743 2.441 3.930 1.00 12.24 N ATOM 1184 CA ASP A 133 8.772 3.639 4.761 1.00 1.41 C ATOM 1185 C ASP A 133 10.133 4.324 4.680 1.00 61.30 C ATOM 1186 O ASP A 133 10.242 5.459 4.216 1.00 73.14 O ATOM 1187 CB ASP A 133 8.451 3.286 6.214 1.00 12.42 C ATOM 1188 CG ASP A 133 8.420 4.507 7.113 1.00 21.33 C ATOM 1189 OD1 ASP A 133 7.670 5.455 6.801 1.00 60.33 O ATOM 1190 OD2 ASP A 133 9.147 4.514 8.129 1.00 11.20 O ATOM 0 H ASP A 133 8.819 1.566 4.449 1.00 12.24 H new ATOM 0 HA ASP A 133 8.015 4.329 4.387 1.00 1.41 H new ATOM 0 HB2 ASP A 133 7.486 2.782 6.258 1.00 12.42 H new ATOM 0 HB3 ASP A 133 9.195 2.583 6.587 1.00 12.42 H new ATOM 1195 N TYR A 134 11.168 3.627 5.135 1.00 20.34 N ATOM 1196 CA TYR A 134 12.522 4.168 5.118 1.00 54.33 C ATOM 1197 C TYR A 134 12.793 4.914 3.815 1.00 52.51 C ATOM 1198 O TYR A 134 13.413 5.978 3.812 1.00 3.35 O ATOM 1199 CB TYR A 134 13.545 3.046 5.298 1.00 20.11 C ATOM 1200 CG TYR A 134 14.907 3.371 4.727 1.00 72.51 C ATOM 1201 CD1 TYR A 134 15.706 4.352 5.300 1.00 22.23 C ATOM 1202 CD2 TYR A 134 15.394 2.697 3.614 1.00 53.15 C ATOM 1203 CE1 TYR A 134 16.951 4.652 4.782 1.00 51.44 C ATOM 1204 CE2 TYR A 134 16.638 2.990 3.089 1.00 74.00 C ATOM 1205 CZ TYR A 134 17.412 3.968 3.676 1.00 3.53 C ATOM 1206 OH TYR A 134 18.651 4.264 3.156 1.00 43.22 O ATOM 0 H TYR A 134 11.095 2.685 5.520 1.00 20.34 H new ATOM 0 HA TYR A 134 12.615 4.871 5.945 1.00 54.33 H new ATOM 0 HB2 TYR A 134 13.649 2.827 6.361 1.00 20.11 H new ATOM 0 HB3 TYR A 134 13.167 2.141 4.822 1.00 20.11 H new ATOM 0 HD1 TYR A 134 15.348 4.890 6.165 1.00 22.23 H new ATOM 0 HD2 TYR A 134 14.790 1.931 3.151 1.00 53.15 H new ATOM 0 HE1 TYR A 134 17.560 5.417 5.240 1.00 51.44 H new ATOM 0 HE2 TYR A 134 17.002 2.456 2.224 1.00 74.00 H new ATOM 0 HH TYR A 134 18.825 3.692 2.380 1.00 43.22 H new ATOM 1216 N HIS A 135 12.322 4.349 2.708 1.00 65.13 N ATOM 1217 CA HIS A 135 12.512 4.960 1.397 1.00 3.10 C ATOM 1218 C HIS A 135 11.528 6.106 1.184 1.00 1.44 C ATOM 1219 O HIS A 135 11.833 7.079 0.494 1.00 1.12 O ATOM 1220 CB HIS A 135 12.342 3.915 0.294 1.00 11.01 C ATOM 1221 CG HIS A 135 13.576 3.104 0.042 1.00 54.25 C ATOM 1222 ND1 HIS A 135 13.745 1.822 0.521 1.00 0.51 N ATOM 1223 CD2 HIS A 135 14.703 3.399 -0.647 1.00 23.13 C ATOM 1224 CE1 HIS A 135 14.924 1.365 0.140 1.00 23.44 C ATOM 1225 NE2 HIS A 135 15.526 2.302 -0.570 1.00 75.21 N ATOM 0 H HIS A 135 11.806 3.469 2.692 1.00 65.13 H new ATOM 0 HA HIS A 135 13.525 5.361 1.354 1.00 3.10 H new ATOM 0 HB2 HIS A 135 11.525 3.245 0.562 1.00 11.01 H new ATOM 0 HB3 HIS A 135 12.052 4.417 -0.629 1.00 11.01 H new ATOM 0 HD1 HIS A 135 13.066 1.307 1.082 1.00 0.51 H new ATOM 0 HD2 HIS A 135 14.916 4.324 -1.161 1.00 23.13 H new ATOM 0 HE1 HIS A 135 15.328 0.390 0.370 1.00 23.44 H new ATOM 1233 N ARG A 136 10.347 5.984 1.781 1.00 10.23 N ATOM 1234 CA ARG A 136 9.318 7.009 1.655 1.00 33.04 C ATOM 1235 C ARG A 136 9.838 8.363 2.128 1.00 43.33 C ATOM 1236 O ARG A 136 9.407 9.409 1.642 1.00 10.02 O ATOM 1237 CB ARG A 136 8.078 6.618 2.461 1.00 15.13 C ATOM 1238 CG ARG A 136 6.797 6.612 1.643 1.00 15.32 C ATOM 1239 CD ARG A 136 5.732 5.733 2.281 1.00 63.11 C ATOM 1240 NE ARG A 136 5.353 6.208 3.609 1.00 52.45 N ATOM 1241 CZ ARG A 136 4.449 7.160 3.818 1.00 25.51 C ATOM 1242 NH1 ARG A 136 3.836 7.733 2.792 1.00 10.33 N ATOM 1243 NH2 ARG A 136 4.158 7.538 5.056 1.00 52.11 N ATOM 0 H ARG A 136 10.079 5.186 2.357 1.00 10.23 H new ATOM 0 HA ARG A 136 9.049 7.090 0.602 1.00 33.04 H new ATOM 0 HB2 ARG A 136 8.231 5.627 2.889 1.00 15.13 H new ATOM 0 HB3 ARG A 136 7.964 7.311 3.295 1.00 15.13 H new ATOM 0 HG2 ARG A 136 6.420 7.630 1.547 1.00 15.32 H new ATOM 0 HG3 ARG A 136 7.009 6.255 0.635 1.00 15.32 H new ATOM 0 HD2 ARG A 136 4.851 5.708 1.640 1.00 63.11 H new ATOM 0 HD3 ARG A 136 6.102 4.710 2.354 1.00 63.11 H new ATOM 0 HE ARG A 136 5.806 5.787 4.420 1.00 52.45 H new ATOM 0 HH11 ARG A 136 4.057 7.444 1.839 1.00 10.33 H new ATOM 0 HH12 ARG A 136 3.143 8.463 2.955 1.00 10.33 H new ATOM 0 HH21 ARG A 136 4.628 7.098 5.847 1.00 52.11 H new ATOM 0 HH22 ARG A 136 3.464 8.268 5.216 1.00 52.11 H new ATOM 1257 N SER A 137 10.767 8.336 3.078 1.00 65.22 N ATOM 1258 CA SER A 137 11.344 9.561 3.619 1.00 12.00 C ATOM 1259 C SER A 137 12.738 9.803 3.049 1.00 1.50 C ATOM 1260 O SER A 137 13.149 10.946 2.846 1.00 5.54 O ATOM 1261 CB SER A 137 11.410 9.487 5.146 1.00 44.43 C ATOM 1262 OG SER A 137 12.432 8.601 5.570 1.00 51.45 O ATOM 0 H SER A 137 11.136 7.479 3.489 1.00 65.22 H new ATOM 0 HA SER A 137 10.703 10.394 3.330 1.00 12.00 H new ATOM 0 HB2 SER A 137 11.594 10.481 5.554 1.00 44.43 H new ATOM 0 HB3 SER A 137 10.449 9.154 5.539 1.00 44.43 H new ATOM 0 HG SER A 137 12.455 8.573 6.549 1.00 51.45 H new ATOM 1268 N THR A 138 13.462 8.719 2.792 1.00 65.30 N ATOM 1269 CA THR A 138 14.811 8.812 2.247 1.00 72.53 C ATOM 1270 C THR A 138 14.829 8.462 0.763 1.00 22.41 C ATOM 1271 O THR A 138 14.180 7.509 0.332 1.00 34.12 O ATOM 1272 CB THR A 138 15.784 7.881 2.994 1.00 24.11 C ATOM 1273 OG1 THR A 138 15.745 8.157 4.399 1.00 74.53 O ATOM 1274 CG2 THR A 138 17.205 8.056 2.478 1.00 55.22 C ATOM 0 H THR A 138 13.137 7.766 2.952 1.00 65.30 H new ATOM 0 HA THR A 138 15.135 9.844 2.378 1.00 72.53 H new ATOM 0 HB THR A 138 15.474 6.851 2.817 1.00 24.11 H new ATOM 0 HG1 THR A 138 16.365 7.560 4.867 1.00 74.53 H new ATOM 0 HG21 THR A 138 17.874 7.388 3.021 1.00 55.22 H new ATOM 0 HG22 THR A 138 17.238 7.817 1.415 1.00 55.22 H new ATOM 0 HG23 THR A 138 17.522 9.088 2.628 1.00 55.22 H new ATOM 1282 N SER A 139 15.578 9.238 -0.014 1.00 60.50 N ATOM 1283 CA SER A 139 15.678 9.011 -1.451 1.00 24.10 C ATOM 1284 C SER A 139 15.726 7.518 -1.764 1.00 2.45 C ATOM 1285 O SER A 139 16.065 6.703 -0.905 1.00 53.15 O ATOM 1286 CB SER A 139 16.923 9.701 -2.012 1.00 4.03 C ATOM 1287 OG SER A 139 16.613 10.445 -3.177 1.00 13.31 O ATOM 0 H SER A 139 16.124 10.029 0.327 1.00 60.50 H new ATOM 0 HA SER A 139 14.792 9.435 -1.923 1.00 24.10 H new ATOM 0 HB2 SER A 139 17.347 10.362 -1.257 1.00 4.03 H new ATOM 0 HB3 SER A 139 17.682 8.955 -2.245 1.00 4.03 H new ATOM 0 HG SER A 139 17.137 10.105 -3.932 1.00 13.31 H new ATOM 1293 N VAL A 140 15.384 7.168 -2.999 1.00 63.33 N ATOM 1294 CA VAL A 140 15.389 5.774 -3.427 1.00 73.14 C ATOM 1295 C VAL A 140 16.126 5.608 -4.752 1.00 14.13 C ATOM 1296 O VAL A 140 16.341 4.489 -5.218 1.00 41.50 O ATOM 1297 CB VAL A 140 13.956 5.229 -3.578 1.00 21.52 C ATOM 1298 CG1 VAL A 140 13.154 6.092 -4.540 1.00 22.30 C ATOM 1299 CG2 VAL A 140 13.984 3.781 -4.044 1.00 31.21 C ATOM 0 H VAL A 140 15.100 7.830 -3.721 1.00 63.33 H new ATOM 0 HA VAL A 140 15.907 5.207 -2.653 1.00 73.14 H new ATOM 0 HB VAL A 140 13.468 5.264 -2.604 1.00 21.52 H new ATOM 0 HG11 VAL A 140 12.145 5.691 -4.634 1.00 22.30 H new ATOM 0 HG12 VAL A 140 13.105 7.112 -4.159 1.00 22.30 H new ATOM 0 HG13 VAL A 140 13.636 6.092 -5.517 1.00 22.30 H new ATOM 0 HG21 VAL A 140 12.964 3.412 -4.145 1.00 31.21 H new ATOM 0 HG22 VAL A 140 14.490 3.719 -5.007 1.00 31.21 H new ATOM 0 HG23 VAL A 140 14.519 3.174 -3.313 1.00 31.21 H new ATOM 1309 N SER A 141 16.510 6.729 -5.353 1.00 4.30 N ATOM 1310 CA SER A 141 17.221 6.709 -6.626 1.00 71.22 C ATOM 1311 C SER A 141 18.672 7.145 -6.446 1.00 33.23 C ATOM 1312 O SER A 141 18.976 7.995 -5.609 1.00 44.01 O ATOM 1313 CB SER A 141 16.524 7.621 -7.638 1.00 4.13 C ATOM 1314 OG SER A 141 16.626 8.981 -7.253 1.00 4.13 O ATOM 0 H SER A 141 16.341 7.663 -4.979 1.00 4.30 H new ATOM 0 HA SER A 141 17.212 5.686 -7.003 1.00 71.22 H new ATOM 0 HB2 SER A 141 16.970 7.484 -8.623 1.00 4.13 H new ATOM 0 HB3 SER A 141 15.474 7.341 -7.722 1.00 4.13 H new ATOM 0 HG SER A 141 17.382 9.091 -6.639 1.00 4.13 H new ATOM 1320 N ARG A 142 19.563 6.556 -7.237 1.00 33.23 N ATOM 1321 CA ARG A 142 20.982 6.881 -7.164 1.00 51.53 C ATOM 1322 C ARG A 142 21.359 7.907 -8.230 1.00 25.44 C ATOM 1323 O ARG A 142 22.499 7.944 -8.692 1.00 54.44 O ATOM 1324 CB ARG A 142 21.826 5.617 -7.336 1.00 4.54 C ATOM 1325 CG ARG A 142 21.496 4.524 -6.333 1.00 71.32 C ATOM 1326 CD ARG A 142 22.713 3.667 -6.021 1.00 44.55 C ATOM 1327 NE ARG A 142 22.992 3.614 -4.589 1.00 23.41 N ATOM 1328 CZ ARG A 142 23.695 4.537 -3.942 1.00 20.41 C ATOM 1329 NH1 ARG A 142 24.187 5.580 -4.596 1.00 60.52 N ATOM 1330 NH2 ARG A 142 23.906 4.418 -2.637 1.00 64.33 N ATOM 0 H ARG A 142 19.327 5.851 -7.936 1.00 33.23 H new ATOM 0 HA ARG A 142 21.181 7.311 -6.183 1.00 51.53 H new ATOM 0 HB2 ARG A 142 21.682 5.229 -8.344 1.00 4.54 H new ATOM 0 HB3 ARG A 142 22.880 5.878 -7.242 1.00 4.54 H new ATOM 0 HG2 ARG A 142 21.121 4.974 -5.414 1.00 71.32 H new ATOM 0 HG3 ARG A 142 20.698 3.895 -6.728 1.00 71.32 H new ATOM 0 HD2 ARG A 142 22.551 2.657 -6.396 1.00 44.55 H new ATOM 0 HD3 ARG A 142 23.581 4.066 -6.545 1.00 44.55 H new ATOM 0 HE ARG A 142 22.627 2.825 -4.056 1.00 23.41 H new ATOM 0 HH11 ARG A 142 24.026 5.675 -5.599 1.00 60.52 H new ATOM 0 HH12 ARG A 142 24.726 6.287 -4.096 1.00 60.52 H new ATOM 0 HH21 ARG A 142 23.528 3.617 -2.130 1.00 64.33 H new ATOM 0 HH22 ARG A 142 24.446 5.127 -2.141 1.00 64.33 H new ATOM 1344 N ASN A 143 20.394 8.736 -8.614 1.00 25.12 N ATOM 1345 CA ASN A 143 20.625 9.761 -9.625 1.00 63.23 C ATOM 1346 C ASN A 143 20.069 11.107 -9.172 1.00 51.34 C ATOM 1347 O ASN A 143 20.759 12.125 -9.229 1.00 35.10 O ATOM 1348 CB ASN A 143 19.983 9.351 -10.952 1.00 50.22 C ATOM 1349 CG ASN A 143 20.913 9.555 -12.132 1.00 43.33 C ATOM 1350 OD1 ASN A 143 20.710 10.453 -12.950 1.00 15.14 O ATOM 1351 ND2 ASN A 143 21.941 8.720 -12.226 1.00 45.12 N ATOM 0 H ASN A 143 19.445 8.718 -8.241 1.00 25.12 H new ATOM 0 HA ASN A 143 21.701 9.862 -9.766 1.00 63.23 H new ATOM 0 HB2 ASN A 143 19.689 8.303 -10.902 1.00 50.22 H new ATOM 0 HB3 ASN A 143 19.073 9.930 -11.106 1.00 50.22 H new ATOM 0 HD21 ASN A 143 22.601 8.808 -12.999 1.00 45.12 H new ATOM 0 HD22 ASN A 143 22.071 7.990 -11.525 1.00 45.12 H new ATOM 1358 N GLN A 144 18.818 11.103 -8.723 1.00 1.50 N ATOM 1359 CA GLN A 144 18.169 12.325 -8.260 1.00 64.34 C ATOM 1360 C GLN A 144 17.611 12.145 -6.852 1.00 65.05 C ATOM 1361 O GLN A 144 17.760 11.084 -6.247 1.00 62.23 O ATOM 1362 CB GLN A 144 17.047 12.726 -9.219 1.00 61.23 C ATOM 1363 CG GLN A 144 17.496 13.674 -10.319 1.00 65.23 C ATOM 1364 CD GLN A 144 16.467 13.817 -11.423 1.00 11.33 C ATOM 1365 OE1 GLN A 144 15.308 14.145 -11.167 1.00 52.12 O ATOM 1366 NE2 GLN A 144 16.885 13.572 -12.659 1.00 4.21 N ATOM 0 H GLN A 144 18.234 10.269 -8.670 1.00 1.50 H new ATOM 0 HA GLN A 144 18.917 13.117 -8.236 1.00 64.34 H new ATOM 0 HB2 GLN A 144 16.630 11.827 -9.673 1.00 61.23 H new ATOM 0 HB3 GLN A 144 16.245 13.197 -8.650 1.00 61.23 H new ATOM 0 HG2 GLN A 144 17.699 14.654 -9.888 1.00 65.23 H new ATOM 0 HG3 GLN A 144 18.432 13.313 -10.745 1.00 65.23 H new ATOM 0 HE21 GLN A 144 17.855 13.303 -12.826 1.00 4.21 H new ATOM 0 HE22 GLN A 144 16.236 13.653 -13.442 1.00 4.21 H new ATOM 1375 N GLN A 145 16.970 13.189 -6.338 1.00 33.01 N ATOM 1376 CA GLN A 145 16.391 13.146 -5.000 1.00 73.43 C ATOM 1377 C GLN A 145 14.877 12.973 -5.068 1.00 11.52 C ATOM 1378 O GLN A 145 14.136 13.950 -5.187 1.00 63.04 O ATOM 1379 CB GLN A 145 16.737 14.421 -4.230 1.00 41.12 C ATOM 1380 CG GLN A 145 16.365 15.697 -4.968 1.00 44.21 C ATOM 1381 CD GLN A 145 15.662 16.702 -4.078 1.00 1.54 C ATOM 1382 OE1 GLN A 145 16.214 17.152 -3.073 1.00 32.23 O ATOM 1383 NE2 GLN A 145 14.437 17.062 -4.443 1.00 31.45 N ATOM 0 H GLN A 145 16.838 14.074 -6.827 1.00 33.01 H new ATOM 0 HA GLN A 145 16.813 12.289 -4.476 1.00 73.43 H new ATOM 0 HB2 GLN A 145 16.225 14.405 -3.268 1.00 41.12 H new ATOM 0 HB3 GLN A 145 17.807 14.431 -4.021 1.00 41.12 H new ATOM 0 HG2 GLN A 145 17.267 16.150 -5.379 1.00 44.21 H new ATOM 0 HG3 GLN A 145 15.719 15.450 -5.811 1.00 44.21 H new ATOM 0 HE21 GLN A 145 14.018 16.664 -5.283 1.00 31.45 H new ATOM 0 HE22 GLN A 145 13.915 17.736 -3.883 1.00 31.45 H new ATOM 1392 N ILE A 146 14.424 11.727 -4.991 1.00 22.42 N ATOM 1393 CA ILE A 146 12.999 11.427 -5.042 1.00 54.54 C ATOM 1394 C ILE A 146 12.609 10.420 -3.966 1.00 60.34 C ATOM 1395 O ILE A 146 13.389 9.532 -3.620 1.00 41.31 O ATOM 1396 CB ILE A 146 12.589 10.875 -6.420 1.00 71.52 C ATOM 1397 CG1 ILE A 146 13.153 11.756 -7.536 1.00 41.32 C ATOM 1398 CG2 ILE A 146 11.074 10.783 -6.525 1.00 30.30 C ATOM 1399 CD1 ILE A 146 13.261 11.049 -8.869 1.00 10.01 C ATOM 0 H ILE A 146 15.024 10.908 -4.893 1.00 22.42 H new ATOM 0 HA ILE A 146 12.473 12.365 -4.864 1.00 54.54 H new ATOM 0 HB ILE A 146 13.003 9.873 -6.530 1.00 71.52 H new ATOM 0 HG12 ILE A 146 12.518 12.634 -7.650 1.00 41.32 H new ATOM 0 HG13 ILE A 146 14.140 12.113 -7.242 1.00 41.32 H new ATOM 0 HG21 ILE A 146 10.800 10.391 -7.505 1.00 30.30 H new ATOM 0 HG22 ILE A 146 10.695 10.117 -5.749 1.00 30.30 H new ATOM 0 HG23 ILE A 146 10.640 11.774 -6.396 1.00 30.30 H new ATOM 0 HD11 ILE A 146 13.668 11.734 -9.612 1.00 10.01 H new ATOM 0 HD12 ILE A 146 13.920 10.186 -8.771 1.00 10.01 H new ATOM 0 HD13 ILE A 146 12.272 10.716 -9.185 1.00 10.01 H new ATOM 1411 N PHE A 147 11.396 10.562 -3.442 1.00 23.52 N ATOM 1412 CA PHE A 147 10.902 9.663 -2.405 1.00 72.02 C ATOM 1413 C PHE A 147 9.754 8.805 -2.931 1.00 3.41 C ATOM 1414 O PHE A 147 9.183 9.091 -3.984 1.00 71.52 O ATOM 1415 CB PHE A 147 10.439 10.463 -1.186 1.00 34.32 C ATOM 1416 CG PHE A 147 11.510 11.338 -0.601 1.00 52.30 C ATOM 1417 CD1 PHE A 147 12.828 10.913 -0.565 1.00 32.43 C ATOM 1418 CD2 PHE A 147 11.198 12.587 -0.087 1.00 65.12 C ATOM 1419 CE1 PHE A 147 13.816 11.716 -0.028 1.00 1.14 C ATOM 1420 CE2 PHE A 147 12.182 13.395 0.451 1.00 64.24 C ATOM 1421 CZ PHE A 147 13.493 12.958 0.482 1.00 54.44 C ATOM 0 H PHE A 147 10.737 11.290 -3.718 1.00 23.52 H new ATOM 0 HA PHE A 147 11.719 9.004 -2.110 1.00 72.02 H new ATOM 0 HB2 PHE A 147 9.589 11.084 -1.470 1.00 34.32 H new ATOM 0 HB3 PHE A 147 10.087 9.772 -0.420 1.00 34.32 H new ATOM 0 HD1 PHE A 147 13.086 9.942 -0.961 1.00 32.43 H new ATOM 0 HD2 PHE A 147 10.175 12.933 -0.107 1.00 65.12 H new ATOM 0 HE1 PHE A 147 14.840 11.373 -0.007 1.00 1.14 H new ATOM 0 HE2 PHE A 147 11.927 14.367 0.847 1.00 64.24 H new ATOM 0 HZ PHE A 147 14.263 13.587 0.904 1.00 54.44 H new ATOM 1431 N LEU A 148 9.423 7.754 -2.190 1.00 74.44 N ATOM 1432 CA LEU A 148 8.344 6.853 -2.581 1.00 34.32 C ATOM 1433 C LEU A 148 6.983 7.457 -2.248 1.00 70.42 C ATOM 1434 O LEU A 148 6.600 7.544 -1.081 1.00 60.04 O ATOM 1435 CB LEU A 148 8.501 5.503 -1.879 1.00 34.24 C ATOM 1436 CG LEU A 148 9.910 4.909 -1.874 1.00 34.25 C ATOM 1437 CD1 LEU A 148 9.901 3.520 -1.254 1.00 21.10 C ATOM 1438 CD2 LEU A 148 10.473 4.861 -3.286 1.00 44.21 C ATOM 0 H LEU A 148 9.885 7.504 -1.316 1.00 74.44 H new ATOM 0 HA LEU A 148 8.401 6.704 -3.659 1.00 34.32 H new ATOM 0 HB2 LEU A 148 8.171 5.613 -0.846 1.00 34.24 H new ATOM 0 HB3 LEU A 148 7.829 4.789 -2.354 1.00 34.24 H new ATOM 0 HG LEU A 148 10.552 5.550 -1.270 1.00 34.25 H new ATOM 0 HD11 LEU A 148 10.912 3.113 -1.259 1.00 21.10 H new ATOM 0 HD12 LEU A 148 9.540 3.582 -0.227 1.00 21.10 H new ATOM 0 HD13 LEU A 148 9.245 2.868 -1.831 1.00 21.10 H new ATOM 0 HD21 LEU A 148 11.476 4.436 -3.263 1.00 44.21 H new ATOM 0 HD22 LEU A 148 9.831 4.243 -3.913 1.00 44.21 H new ATOM 0 HD23 LEU A 148 10.516 5.870 -3.695 1.00 44.21 H new ATOM 1450 N ARG A 149 6.256 7.870 -3.281 1.00 63.24 N ATOM 1451 CA ARG A 149 4.938 8.464 -3.099 1.00 13.41 C ATOM 1452 C ARG A 149 3.891 7.390 -2.820 1.00 32.12 C ATOM 1453 O ARG A 149 3.900 6.325 -3.437 1.00 61.21 O ATOM 1454 CB ARG A 149 4.541 9.268 -4.339 1.00 1.13 C ATOM 1455 CG ARG A 149 5.149 10.661 -4.382 1.00 32.42 C ATOM 1456 CD ARG A 149 4.378 11.632 -3.501 1.00 44.14 C ATOM 1457 NE ARG A 149 4.404 12.992 -4.034 1.00 21.21 N ATOM 1458 CZ ARG A 149 3.921 14.045 -3.384 1.00 60.21 C ATOM 1459 NH1 ARG A 149 3.378 13.895 -2.184 1.00 10.42 N ATOM 1460 NH2 ARG A 149 3.981 15.251 -3.935 1.00 21.43 N ATOM 0 H ARG A 149 6.558 7.804 -4.253 1.00 63.24 H new ATOM 0 HA ARG A 149 4.985 9.133 -2.240 1.00 13.41 H new ATOM 0 HB2 ARG A 149 4.846 8.720 -5.230 1.00 1.13 H new ATOM 0 HB3 ARG A 149 3.455 9.354 -4.374 1.00 1.13 H new ATOM 0 HG2 ARG A 149 6.188 10.616 -4.054 1.00 32.42 H new ATOM 0 HG3 ARG A 149 5.154 11.025 -5.409 1.00 32.42 H new ATOM 0 HD2 ARG A 149 3.345 11.298 -3.411 1.00 44.14 H new ATOM 0 HD3 ARG A 149 4.803 11.627 -2.497 1.00 44.14 H new ATOM 0 HE ARG A 149 4.815 13.141 -4.955 1.00 21.21 H new ATOM 0 HH11 ARG A 149 3.330 12.970 -1.758 1.00 10.42 H new ATOM 0 HH12 ARG A 149 3.008 14.705 -1.687 1.00 10.42 H new ATOM 0 HH21 ARG A 149 4.398 15.370 -4.858 1.00 21.43 H new ATOM 0 HH22 ARG A 149 3.610 16.059 -3.435 1.00 21.43 H new ATOM 1474 N ASP A 150 2.990 7.677 -1.886 1.00 44.02 N ATOM 1475 CA ASP A 150 1.936 6.736 -1.525 1.00 44.04 C ATOM 1476 C ASP A 150 1.037 6.442 -2.722 1.00 50.41 C ATOM 1477 O ASP A 150 0.291 7.310 -3.178 1.00 21.23 O ATOM 1478 CB ASP A 150 1.103 7.290 -0.369 1.00 32.12 C ATOM 1479 CG ASP A 150 1.084 8.806 -0.343 1.00 32.42 C ATOM 1480 OD1 ASP A 150 0.261 9.401 -1.069 1.00 73.31 O ATOM 1481 OD2 ASP A 150 1.893 9.397 0.403 1.00 34.22 O ATOM 0 H ASP A 150 2.969 8.554 -1.365 1.00 44.02 H new ATOM 0 HA ASP A 150 2.406 5.805 -1.210 1.00 44.04 H new ATOM 0 HB2 ASP A 150 0.082 6.918 -0.450 1.00 32.12 H new ATOM 0 HB3 ASP A 150 1.503 6.918 0.574 1.00 32.12 H new ATOM 1486 N ILE A 151 1.114 5.216 -3.227 1.00 32.45 N ATOM 1487 CA ILE A 151 0.307 4.808 -4.370 1.00 52.50 C ATOM 1488 C ILE A 151 -1.147 4.587 -3.966 1.00 22.11 C ATOM 1489 O ILE A 151 -1.433 4.187 -2.838 1.00 71.42 O ATOM 1490 CB ILE A 151 0.851 3.519 -5.013 1.00 4.30 C ATOM 1491 CG1 ILE A 151 0.401 3.422 -6.472 1.00 63.31 C ATOM 1492 CG2 ILE A 151 0.390 2.300 -4.228 1.00 43.31 C ATOM 1493 CD1 ILE A 151 0.561 2.038 -7.062 1.00 42.24 C ATOM 0 H ILE A 151 1.727 4.487 -2.862 1.00 32.45 H new ATOM 0 HA ILE A 151 0.360 5.617 -5.098 1.00 52.50 H new ATOM 0 HB ILE A 151 1.940 3.551 -4.990 1.00 4.30 H new ATOM 0 HG12 ILE A 151 -0.645 3.719 -6.542 1.00 63.31 H new ATOM 0 HG13 ILE A 151 0.974 4.131 -7.069 1.00 63.31 H new ATOM 0 HG21 ILE A 151 0.783 1.397 -4.695 1.00 43.31 H new ATOM 0 HG22 ILE A 151 0.756 2.367 -3.203 1.00 43.31 H new ATOM 0 HG23 ILE A 151 -0.699 2.261 -4.222 1.00 43.31 H new ATOM 0 HD11 ILE A 151 0.223 2.043 -8.098 1.00 42.24 H new ATOM 0 HD12 ILE A 151 1.610 1.745 -7.024 1.00 42.24 H new ATOM 0 HD13 ILE A 151 -0.035 1.327 -6.489 1.00 42.24 H new ATOM 1505 N GLU A 152 -2.060 4.848 -4.896 1.00 13.44 N ATOM 1506 CA GLU A 152 -3.485 4.676 -4.636 1.00 2.33 C ATOM 1507 C GLU A 152 -3.948 3.281 -5.044 1.00 65.40 C ATOM 1508 O GLU A 152 -4.154 3.006 -6.226 1.00 34.24 O ATOM 1509 CB GLU A 152 -4.295 5.734 -5.388 1.00 3.41 C ATOM 1510 CG GLU A 152 -4.449 7.039 -4.625 1.00 2.14 C ATOM 1511 CD GLU A 152 -5.882 7.533 -4.596 1.00 73.35 C ATOM 1512 OE1 GLU A 152 -6.781 6.726 -4.277 1.00 63.13 O ATOM 1513 OE2 GLU A 152 -6.106 8.725 -4.894 1.00 20.33 O ATOM 0 H GLU A 152 -1.839 5.179 -5.835 1.00 13.44 H new ATOM 0 HA GLU A 152 -3.649 4.796 -3.565 1.00 2.33 H new ATOM 0 HB2 GLU A 152 -3.813 5.937 -6.344 1.00 3.41 H new ATOM 0 HB3 GLU A 152 -5.284 5.333 -5.609 1.00 3.41 H new ATOM 0 HG2 GLU A 152 -4.095 6.902 -3.603 1.00 2.14 H new ATOM 0 HG3 GLU A 152 -3.816 7.799 -5.082 1.00 2.14 H new ATOM 1520 N GLN A 153 -4.107 2.404 -4.058 1.00 2.35 N ATOM 1521 CA GLN A 153 -4.544 1.037 -4.314 1.00 64.02 C ATOM 1522 C GLN A 153 -6.030 0.995 -4.653 1.00 60.11 C ATOM 1523 O GLN A 153 -6.777 1.920 -4.333 1.00 21.55 O ATOM 1524 CB GLN A 153 -4.260 0.152 -3.099 1.00 52.11 C ATOM 1525 CG GLN A 153 -3.444 -1.088 -3.427 1.00 0.25 C ATOM 1526 CD GLN A 153 -4.310 -2.277 -3.791 1.00 33.55 C ATOM 1527 OE1 GLN A 153 -4.195 -2.832 -4.884 1.00 34.32 O ATOM 1528 NE2 GLN A 153 -5.184 -2.676 -2.874 1.00 32.42 N ATOM 0 H GLN A 153 -3.940 2.616 -3.074 1.00 2.35 H new ATOM 0 HA GLN A 153 -3.984 0.658 -5.169 1.00 64.02 H new ATOM 0 HB2 GLN A 153 -3.729 0.738 -2.349 1.00 52.11 H new ATOM 0 HB3 GLN A 153 -5.207 -0.154 -2.653 1.00 52.11 H new ATOM 0 HG2 GLN A 153 -2.771 -0.867 -4.255 1.00 0.25 H new ATOM 0 HG3 GLN A 153 -2.821 -1.346 -2.570 1.00 0.25 H new ATOM 0 HE21 GLN A 153 -5.246 -2.187 -1.981 1.00 32.42 H new ATOM 0 HE22 GLN A 153 -5.794 -3.472 -3.063 1.00 32.42 H new