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 117 LYS NZ :NH3+ -151:sc= -3.2 (180deg=0) USER MOD Set 1.2: A 126 ASN : amide:sc= -3.69 K(o=-6.9,f=-6.2!) USER MOD Set 2.1: A 98 SER OG : rot 140:sc=-0.00491 USER MOD Set 2.2: A 107 HIS : no HD1:sc= -3.59! K(o=-3.6!,f=-1.4) 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 158:sc= -0.0528 (180deg=-0.95) 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= -1.23! C(o=-1.2!,f=-4.3!) USER MOD Single : A 79 HIS : no HD1:sc= -1.52! K(o=-1.5!,f=-0.56) USER MOD Single : A 88 SER OG : rot 170:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 150:sc= -0.0668 USER MOD Single : A 100 LYS NZ :NH3+ -168:sc= 0.0587 (180deg=-0.212) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 106 GLN : amide:sc= -1.92 K(o=-1.9,f=-9.3!) USER MOD Single : A 109 LYS NZ :NH3+ -168:sc= 0.985 (180deg=0.854) USER MOD Single : A 118 TYR OH : rot 180:sc= -0.0244 USER MOD Single : A 124 LYS NZ :NH3+ -163:sc=-0.000794 (180deg=-0.378) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 ASN : amide:sc= -2.45! K(o=-2.4!,f=-0.76) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 HIS : no HD1:sc= -0.593 X(o=-0.59,f=-0.69) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot -37:sc= 0.168 USER MOD Single : A 143 ASN : amide:sc= -0.0198 X(o=-0.02,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 GLN : amide:sc= -0.0151 X(o=-0.015,f=-0.25) USER MOD Single : A 153 GLN : amide:sc= -0.388 K(o=-0.39,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N TRP A 60 -0.208 -0.045 -1.044 1.00 45.44 N ATOM 2 CA TRP A 60 0.737 -0.043 -2.155 1.00 65.24 C ATOM 3 C TRP A 60 1.148 -1.465 -2.523 1.00 1.14 C ATOM 4 O TRP A 60 2.002 -1.672 -3.385 1.00 51.42 O ATOM 5 CB TRP A 60 1.975 0.782 -1.798 1.00 52.14 C ATOM 6 CG TRP A 60 2.411 0.613 -0.374 1.00 51.15 C ATOM 7 CD1 TRP A 60 2.349 1.549 0.618 1.00 30.02 C ATOM 8 CD2 TRP A 60 2.978 -0.562 0.214 1.00 34.54 C ATOM 9 NE1 TRP A 60 2.843 1.026 1.789 1.00 60.11 N ATOM 10 CE2 TRP A 60 3.234 -0.268 1.568 1.00 63.12 C ATOM 11 CE3 TRP A 60 3.291 -1.836 -0.269 1.00 1.50 C ATOM 12 CZ2 TRP A 60 3.790 -1.200 2.440 1.00 64.44 C ATOM 13 CZ3 TRP A 60 3.843 -2.760 0.597 1.00 2.34 C ATOM 14 CH2 TRP A 60 4.088 -2.439 1.939 1.00 14.04 C ATOM 0 HA TRP A 60 0.245 0.408 -3.017 1.00 65.24 H new ATOM 0 HB2 TRP A 60 2.795 0.498 -2.458 1.00 52.14 H new ATOM 0 HB3 TRP A 60 1.767 1.836 -1.984 1.00 52.14 H new ATOM 0 HD1 TRP A 60 1.968 2.553 0.500 1.00 30.02 H new ATOM 0 HE1 TRP A 60 2.908 1.521 2.678 1.00 60.11 H new ATOM 0 HE3 TRP A 60 3.105 -2.093 -1.301 1.00 1.50 H new ATOM 0 HZ2 TRP A 60 3.979 -0.955 3.475 1.00 64.44 H new ATOM 0 HZ3 TRP A 60 4.090 -3.747 0.234 1.00 2.34 H new ATOM 0 HH2 TRP A 60 4.520 -3.184 2.591 1.00 14.04 H new ATOM 25 N PHE A 61 0.535 -2.442 -1.863 1.00 21.30 N ATOM 26 CA PHE A 61 0.838 -3.845 -2.120 1.00 62.32 C ATOM 27 C PHE A 61 -0.134 -4.434 -3.138 1.00 51.03 C ATOM 28 O PHE A 61 -1.336 -4.172 -3.089 1.00 32.52 O ATOM 29 CB PHE A 61 0.780 -4.648 -0.819 1.00 70.41 C ATOM 30 CG PHE A 61 0.410 -6.090 -1.021 1.00 23.24 C ATOM 31 CD1 PHE A 61 1.180 -6.910 -1.830 1.00 41.10 C ATOM 32 CD2 PHE A 61 -0.707 -6.626 -0.401 1.00 13.41 C ATOM 33 CE1 PHE A 61 0.843 -8.237 -2.017 1.00 60.23 C ATOM 34 CE2 PHE A 61 -1.049 -7.952 -0.584 1.00 71.21 C ATOM 35 CZ PHE A 61 -0.274 -8.759 -1.394 1.00 42.32 C ATOM 0 H PHE A 61 -0.174 -2.288 -1.146 1.00 21.30 H new ATOM 0 HA PHE A 61 1.846 -3.904 -2.530 1.00 62.32 H new ATOM 0 HB2 PHE A 61 1.750 -4.596 -0.326 1.00 70.41 H new ATOM 0 HB3 PHE A 61 0.056 -4.186 -0.148 1.00 70.41 H new ATOM 0 HD1 PHE A 61 2.054 -6.507 -2.320 1.00 41.10 H new ATOM 0 HD2 PHE A 61 -1.318 -6.000 0.233 1.00 13.41 H new ATOM 0 HE1 PHE A 61 1.452 -8.865 -2.650 1.00 60.23 H new ATOM 0 HE2 PHE A 61 -1.922 -8.357 -0.094 1.00 71.21 H new ATOM 0 HZ PHE A 61 -0.541 -9.795 -1.540 1.00 42.32 H new ATOM 45 N PHE A 62 0.395 -5.230 -4.061 1.00 43.14 N ATOM 46 CA PHE A 62 -0.424 -5.855 -5.093 1.00 32.00 C ATOM 47 C PHE A 62 -0.234 -7.369 -5.095 1.00 71.04 C ATOM 48 O PHE A 62 0.892 -7.864 -5.079 1.00 71.31 O ATOM 49 CB PHE A 62 -0.074 -5.284 -6.468 1.00 40.54 C ATOM 50 CG PHE A 62 -0.838 -4.037 -6.812 1.00 12.00 C ATOM 51 CD1 PHE A 62 -0.536 -2.832 -6.199 1.00 3.12 C ATOM 52 CD2 PHE A 62 -1.860 -4.071 -7.748 1.00 4.53 C ATOM 53 CE1 PHE A 62 -1.237 -1.683 -6.513 1.00 2.21 C ATOM 54 CE2 PHE A 62 -2.564 -2.925 -8.066 1.00 42.31 C ATOM 55 CZ PHE A 62 -2.253 -1.730 -7.447 1.00 41.31 C ATOM 0 H PHE A 62 1.388 -5.458 -4.116 1.00 43.14 H new ATOM 0 HA PHE A 62 -1.469 -5.638 -4.873 1.00 32.00 H new ATOM 0 HB2 PHE A 62 0.994 -5.067 -6.501 1.00 40.54 H new ATOM 0 HB3 PHE A 62 -0.269 -6.041 -7.227 1.00 40.54 H new ATOM 0 HD1 PHE A 62 0.257 -2.790 -5.467 1.00 3.12 H new ATOM 0 HD2 PHE A 62 -2.109 -5.003 -8.234 1.00 4.53 H new ATOM 0 HE1 PHE A 62 -0.991 -0.750 -6.029 1.00 2.21 H new ATOM 0 HE2 PHE A 62 -3.357 -2.964 -8.798 1.00 42.31 H new ATOM 0 HZ PHE A 62 -2.803 -0.834 -7.693 1.00 41.31 H new ATOM 65 N GLY A 63 -1.345 -8.099 -5.115 1.00 73.12 N ATOM 66 CA GLY A 63 -1.280 -9.549 -5.119 1.00 13.15 C ATOM 67 C GLY A 63 -0.322 -10.084 -6.164 1.00 51.11 C ATOM 68 O GLY A 63 0.870 -10.246 -5.900 1.00 54.04 O ATOM 0 H GLY A 63 -2.289 -7.712 -5.129 1.00 73.12 H new ATOM 0 HA2 GLY A 63 -0.970 -9.898 -4.134 1.00 13.15 H new ATOM 0 HA3 GLY A 63 -2.275 -9.954 -5.302 1.00 13.15 H new ATOM 72 N LYS A 64 -0.843 -10.361 -7.355 1.00 25.02 N ATOM 73 CA LYS A 64 -0.026 -10.882 -8.445 1.00 11.42 C ATOM 74 C LYS A 64 -0.287 -10.112 -9.736 1.00 34.42 C ATOM 75 O LYS A 64 -1.288 -10.344 -10.415 1.00 51.32 O ATOM 76 CB LYS A 64 -0.313 -12.370 -8.658 1.00 43.34 C ATOM 77 CG LYS A 64 -0.471 -13.150 -7.365 1.00 74.32 C ATOM 78 CD LYS A 64 0.822 -13.844 -6.970 1.00 54.22 C ATOM 79 CE LYS A 64 1.078 -13.736 -5.475 1.00 11.31 C ATOM 80 NZ LYS A 64 0.320 -14.762 -4.707 1.00 0.14 N ATOM 0 H LYS A 64 -1.827 -10.233 -7.590 1.00 25.02 H new ATOM 0 HA LYS A 64 1.022 -10.756 -8.174 1.00 11.42 H new ATOM 0 HB2 LYS A 64 -1.223 -12.475 -9.249 1.00 43.34 H new ATOM 0 HB3 LYS A 64 0.498 -12.808 -9.240 1.00 43.34 H new ATOM 0 HG2 LYS A 64 -0.781 -12.475 -6.567 1.00 74.32 H new ATOM 0 HG3 LYS A 64 -1.262 -13.891 -7.481 1.00 74.32 H new ATOM 0 HD2 LYS A 64 0.775 -14.894 -7.257 1.00 54.22 H new ATOM 0 HD3 LYS A 64 1.655 -13.401 -7.516 1.00 54.22 H new ATOM 0 HE2 LYS A 64 2.144 -13.851 -5.280 1.00 11.31 H new ATOM 0 HE3 LYS A 64 0.796 -12.742 -5.129 1.00 11.31 H new ATOM 0 HZ1 LYS A 64 0.521 -14.655 -3.692 1.00 0.14 H new ATOM 0 HZ2 LYS A 64 -0.699 -14.637 -4.873 1.00 0.14 H new ATOM 0 HZ3 LYS A 64 0.608 -15.712 -5.019 1.00 0.14 H new ATOM 94 N ILE A 65 0.618 -9.199 -10.069 1.00 3.15 N ATOM 95 CA ILE A 65 0.486 -8.398 -11.279 1.00 71.34 C ATOM 96 C ILE A 65 1.766 -8.438 -12.107 1.00 51.02 C ATOM 97 O ILE A 65 2.876 -8.345 -11.584 1.00 4.31 O ATOM 98 CB ILE A 65 0.146 -6.933 -10.951 1.00 13.42 C ATOM 99 CG1 ILE A 65 1.169 -6.356 -9.970 1.00 70.12 C ATOM 100 CG2 ILE A 65 -1.260 -6.831 -10.378 1.00 53.24 C ATOM 101 CD1 ILE A 65 1.722 -5.014 -10.394 1.00 44.31 C ATOM 0 H ILE A 65 1.451 -8.995 -9.517 1.00 3.15 H new ATOM 0 HA ILE A 65 -0.331 -8.831 -11.856 1.00 71.34 H new ATOM 0 HB ILE A 65 0.186 -6.352 -11.872 1.00 13.42 H new ATOM 0 HG12 ILE A 65 0.703 -6.255 -8.990 1.00 70.12 H new ATOM 0 HG13 ILE A 65 1.993 -7.061 -9.860 1.00 70.12 H new ATOM 0 HG21 ILE A 65 -1.486 -5.789 -10.151 1.00 53.24 H new ATOM 0 HG22 ILE A 65 -1.978 -7.208 -11.107 1.00 53.24 H new ATOM 0 HG23 ILE A 65 -1.325 -7.423 -9.465 1.00 53.24 H new ATOM 0 HD11 ILE A 65 2.441 -4.666 -9.652 1.00 44.31 H new ATOM 0 HD12 ILE A 65 2.217 -5.113 -11.360 1.00 44.31 H new ATOM 0 HD13 ILE A 65 0.907 -4.294 -10.476 1.00 44.31 H new ATOM 113 N PRO A 66 1.610 -8.578 -13.432 1.00 74.00 N ATOM 114 CA PRO A 66 2.742 -8.631 -14.362 1.00 11.35 C ATOM 115 C PRO A 66 3.451 -7.287 -14.488 1.00 52.44 C ATOM 116 O PRO A 66 2.817 -6.232 -14.431 1.00 64.44 O ATOM 117 CB PRO A 66 2.091 -9.020 -15.691 1.00 44.24 C ATOM 118 CG PRO A 66 0.682 -8.550 -15.576 1.00 24.04 C ATOM 119 CD PRO A 66 0.315 -8.695 -14.125 1.00 24.24 C ATOM 0 HA PRO A 66 3.511 -9.328 -14.029 1.00 11.35 H new ATOM 0 HB2 PRO A 66 2.598 -8.548 -16.533 1.00 44.24 H new ATOM 0 HB3 PRO A 66 2.137 -10.097 -15.854 1.00 44.24 H new ATOM 0 HG2 PRO A 66 0.588 -7.514 -15.901 1.00 24.04 H new ATOM 0 HG3 PRO A 66 0.020 -9.143 -16.207 1.00 24.04 H new ATOM 0 HD2 PRO A 66 -0.382 -7.920 -13.807 1.00 24.24 H new ATOM 0 HD3 PRO A 66 -0.162 -9.654 -13.925 1.00 24.24 H new ATOM 127 N ARG A 67 4.768 -7.331 -14.661 1.00 73.31 N ATOM 128 CA ARG A 67 5.562 -6.116 -14.795 1.00 64.44 C ATOM 129 C ARG A 67 4.796 -5.048 -15.569 1.00 55.12 C ATOM 130 O ARG A 67 4.757 -3.885 -15.168 1.00 73.14 O ATOM 131 CB ARG A 67 6.885 -6.422 -15.501 1.00 52.11 C ATOM 132 CG ARG A 67 6.730 -7.301 -16.731 1.00 72.31 C ATOM 133 CD ARG A 67 7.902 -8.257 -16.884 1.00 25.43 C ATOM 134 NE ARG A 67 9.169 -7.634 -16.509 1.00 61.23 N ATOM 135 CZ ARG A 67 10.309 -8.304 -16.383 1.00 60.44 C ATOM 136 NH1 ARG A 67 10.341 -9.612 -16.601 1.00 53.13 N ATOM 137 NH2 ARG A 67 11.421 -7.667 -16.039 1.00 54.43 N ATOM 0 H ARG A 67 5.308 -8.195 -14.712 1.00 73.31 H new ATOM 0 HA ARG A 67 5.770 -5.736 -13.795 1.00 64.44 H new ATOM 0 HB2 ARG A 67 7.357 -5.484 -15.793 1.00 52.11 H new ATOM 0 HB3 ARG A 67 7.558 -6.912 -14.797 1.00 52.11 H new ATOM 0 HG2 ARG A 67 5.803 -7.869 -16.659 1.00 72.31 H new ATOM 0 HG3 ARG A 67 6.652 -6.675 -17.620 1.00 72.31 H new ATOM 0 HD2 ARG A 67 7.734 -9.138 -16.265 1.00 25.43 H new ATOM 0 HD3 ARG A 67 7.958 -8.599 -17.917 1.00 25.43 H new ATOM 0 HE ARG A 67 9.179 -6.629 -16.334 1.00 61.23 H new ATOM 0 HH11 ARG A 67 9.489 -10.106 -16.866 1.00 53.13 H new ATOM 0 HH12 ARG A 67 11.218 -10.124 -16.504 1.00 53.13 H new ATOM 0 HH21 ARG A 67 11.401 -6.661 -15.871 1.00 54.43 H new ATOM 0 HH22 ARG A 67 12.295 -8.183 -15.943 1.00 54.43 H new ATOM 151 N ALA A 68 4.187 -5.451 -16.680 1.00 65.10 N ATOM 152 CA ALA A 68 3.421 -4.529 -17.509 1.00 32.31 C ATOM 153 C ALA A 68 2.369 -3.794 -16.684 1.00 65.35 C ATOM 154 O ALA A 68 2.320 -2.564 -16.676 1.00 24.12 O ATOM 155 CB ALA A 68 2.764 -5.276 -18.660 1.00 61.23 C ATOM 0 H ALA A 68 4.210 -6.410 -17.026 1.00 65.10 H new ATOM 0 HA ALA A 68 4.109 -3.788 -17.916 1.00 32.31 H new ATOM 0 HB1 ALA A 68 2.195 -4.575 -19.271 1.00 61.23 H new ATOM 0 HB2 ALA A 68 3.532 -5.750 -19.271 1.00 61.23 H new ATOM 0 HB3 ALA A 68 2.094 -6.039 -18.263 1.00 61.23 H new ATOM 161 N LYS A 69 1.529 -4.556 -15.992 1.00 53.54 N ATOM 162 CA LYS A 69 0.478 -3.977 -15.164 1.00 35.44 C ATOM 163 C LYS A 69 1.040 -2.896 -14.247 1.00 24.12 C ATOM 164 O LYS A 69 0.399 -1.872 -14.013 1.00 23.13 O ATOM 165 CB LYS A 69 -0.200 -5.067 -14.329 1.00 5.10 C ATOM 166 CG LYS A 69 -1.698 -5.164 -14.557 1.00 31.43 C ATOM 167 CD LYS A 69 -2.018 -5.711 -15.938 1.00 21.53 C ATOM 168 CE LYS A 69 -3.263 -6.585 -15.917 1.00 24.34 C ATOM 169 NZ LYS A 69 -4.442 -5.884 -16.495 1.00 34.13 N ATOM 0 H LYS A 69 1.556 -5.576 -15.988 1.00 53.54 H new ATOM 0 HA LYS A 69 -0.260 -3.521 -15.824 1.00 35.44 H new ATOM 0 HB2 LYS A 69 0.257 -6.029 -14.562 1.00 5.10 H new ATOM 0 HB3 LYS A 69 -0.014 -4.873 -13.273 1.00 5.10 H new ATOM 0 HG2 LYS A 69 -2.141 -5.808 -13.798 1.00 31.43 H new ATOM 0 HG3 LYS A 69 -2.149 -4.178 -14.442 1.00 31.43 H new ATOM 0 HD2 LYS A 69 -2.164 -4.884 -16.633 1.00 21.53 H new ATOM 0 HD3 LYS A 69 -1.171 -6.291 -16.306 1.00 21.53 H new ATOM 0 HE2 LYS A 69 -3.074 -7.500 -16.478 1.00 24.34 H new ATOM 0 HE3 LYS A 69 -3.483 -6.880 -14.891 1.00 24.34 H new ATOM 0 HZ1 LYS A 69 -5.270 -6.513 -16.463 1.00 34.13 H new ATOM 0 HZ2 LYS A 69 -4.639 -5.024 -15.945 1.00 34.13 H new ATOM 0 HZ3 LYS A 69 -4.242 -5.625 -17.482 1.00 34.13 H new ATOM 183 N ALA A 70 2.243 -3.130 -13.732 1.00 20.31 N ATOM 184 CA ALA A 70 2.893 -2.175 -12.844 1.00 2.41 C ATOM 185 C ALA A 70 3.175 -0.860 -13.564 1.00 31.12 C ATOM 186 O ALA A 70 3.027 0.217 -12.988 1.00 15.02 O ATOM 187 CB ALA A 70 4.183 -2.762 -12.290 1.00 13.14 C ATOM 0 H ALA A 70 2.787 -3.973 -13.915 1.00 20.31 H new ATOM 0 HA ALA A 70 2.216 -1.968 -12.015 1.00 2.41 H new ATOM 0 HB1 ALA A 70 4.658 -2.037 -11.628 1.00 13.14 H new ATOM 0 HB2 ALA A 70 3.959 -3.671 -11.732 1.00 13.14 H new ATOM 0 HB3 ALA A 70 4.858 -2.999 -13.113 1.00 13.14 H new ATOM 193 N GLU A 71 3.583 -0.957 -14.825 1.00 75.14 N ATOM 194 CA GLU A 71 3.886 0.226 -15.622 1.00 63.44 C ATOM 195 C GLU A 71 2.618 1.019 -15.923 1.00 42.42 C ATOM 196 O GLU A 71 2.671 2.225 -16.162 1.00 1.45 O ATOM 197 CB GLU A 71 4.572 -0.176 -16.930 1.00 2.40 C ATOM 198 CG GLU A 71 5.883 -0.918 -16.727 1.00 54.42 C ATOM 199 CD GLU A 71 5.919 -2.247 -17.456 1.00 31.14 C ATOM 200 OE1 GLU A 71 5.519 -2.286 -18.638 1.00 34.20 O ATOM 201 OE2 GLU A 71 6.347 -3.248 -16.844 1.00 10.11 O ATOM 0 H GLU A 71 3.711 -1.842 -15.316 1.00 75.14 H new ATOM 0 HA GLU A 71 4.561 0.859 -15.045 1.00 63.44 H new ATOM 0 HB2 GLU A 71 3.894 -0.805 -17.508 1.00 2.40 H new ATOM 0 HB3 GLU A 71 4.759 0.720 -17.522 1.00 2.40 H new ATOM 0 HG2 GLU A 71 6.707 -0.295 -17.075 1.00 54.42 H new ATOM 0 HG3 GLU A 71 6.039 -1.088 -15.662 1.00 54.42 H new ATOM 208 N GLU A 72 1.480 0.332 -15.911 1.00 1.54 N ATOM 209 CA GLU A 72 0.199 0.973 -16.183 1.00 51.25 C ATOM 210 C GLU A 72 -0.340 1.665 -14.935 1.00 12.22 C ATOM 211 O GLU A 72 -0.884 2.767 -15.009 1.00 23.21 O ATOM 212 CB GLU A 72 -0.815 -0.057 -16.687 1.00 5.21 C ATOM 213 CG GLU A 72 -0.558 -0.516 -18.112 1.00 74.43 C ATOM 214 CD GLU A 72 -0.934 0.533 -19.140 1.00 52.21 C ATOM 215 OE1 GLU A 72 -2.127 0.606 -19.504 1.00 2.11 O ATOM 216 OE2 GLU A 72 -0.037 1.281 -19.581 1.00 3.12 O ATOM 0 H GLU A 72 1.419 -0.667 -15.716 1.00 1.54 H new ATOM 0 HA GLU A 72 0.356 1.726 -16.955 1.00 51.25 H new ATOM 0 HB2 GLU A 72 -0.799 -0.924 -16.026 1.00 5.21 H new ATOM 0 HB3 GLU A 72 -1.816 0.371 -16.627 1.00 5.21 H new ATOM 0 HG2 GLU A 72 0.497 -0.767 -18.224 1.00 74.43 H new ATOM 0 HG3 GLU A 72 -1.125 -1.427 -18.304 1.00 74.43 H new ATOM 223 N MET A 73 -0.186 1.010 -13.789 1.00 23.10 N ATOM 224 CA MET A 73 -0.656 1.562 -12.524 1.00 33.01 C ATOM 225 C MET A 73 0.114 2.828 -12.163 1.00 42.12 C ATOM 226 O MET A 73 -0.448 3.772 -11.606 1.00 73.13 O ATOM 227 CB MET A 73 -0.512 0.527 -11.406 1.00 40.32 C ATOM 228 CG MET A 73 -1.384 -0.703 -11.601 1.00 3.24 C ATOM 229 SD MET A 73 -3.107 -0.288 -11.933 1.00 45.40 S ATOM 230 CE MET A 73 -3.168 -0.496 -13.711 1.00 20.11 C ATOM 0 H MET A 73 0.261 0.096 -13.710 1.00 23.10 H new ATOM 0 HA MET A 73 -1.709 1.819 -12.638 1.00 33.01 H new ATOM 0 HB2 MET A 73 0.531 0.217 -11.341 1.00 40.32 H new ATOM 0 HB3 MET A 73 -0.765 0.994 -10.454 1.00 40.32 H new ATOM 0 HG2 MET A 73 -0.991 -1.295 -12.428 1.00 3.24 H new ATOM 0 HG3 MET A 73 -1.330 -1.327 -10.709 1.00 3.24 H new ATOM 0 HE1 MET A 73 -4.199 -0.663 -14.023 1.00 20.11 H new ATOM 0 HE2 MET A 73 -2.783 0.401 -14.196 1.00 20.11 H new ATOM 0 HE3 MET A 73 -2.559 -1.353 -13.998 1.00 20.11 H new ATOM 240 N LEU A 74 1.403 2.842 -12.483 1.00 44.03 N ATOM 241 CA LEU A 74 2.252 3.993 -12.193 1.00 35.14 C ATOM 242 C LEU A 74 2.164 5.029 -13.308 1.00 43.24 C ATOM 243 O LEU A 74 1.997 6.221 -13.050 1.00 54.14 O ATOM 244 CB LEU A 74 3.703 3.548 -12.007 1.00 21.51 C ATOM 245 CG LEU A 74 3.927 2.367 -11.061 1.00 43.03 C ATOM 246 CD1 LEU A 74 5.316 1.781 -11.260 1.00 23.45 C ATOM 247 CD2 LEU A 74 3.729 2.797 -9.615 1.00 43.11 C ATOM 0 H LEU A 74 1.884 2.069 -12.944 1.00 44.03 H new ATOM 0 HA LEU A 74 1.898 4.450 -11.269 1.00 35.14 H new ATOM 0 HB2 LEU A 74 4.110 3.287 -12.984 1.00 21.51 H new ATOM 0 HB3 LEU A 74 4.278 4.397 -11.638 1.00 21.51 H new ATOM 0 HG LEU A 74 3.193 1.595 -11.293 1.00 43.03 H new ATOM 0 HD11 LEU A 74 5.458 0.942 -10.579 1.00 23.45 H new ATOM 0 HD12 LEU A 74 5.421 1.435 -12.288 1.00 23.45 H new ATOM 0 HD13 LEU A 74 6.066 2.545 -11.056 1.00 23.45 H new ATOM 0 HD21 LEU A 74 3.892 1.944 -8.956 1.00 43.11 H new ATOM 0 HD22 LEU A 74 4.439 3.586 -9.370 1.00 43.11 H new ATOM 0 HD23 LEU A 74 2.713 3.169 -9.482 1.00 43.11 H new ATOM 259 N SER A 75 2.277 4.566 -14.549 1.00 43.22 N ATOM 260 CA SER A 75 2.213 5.453 -15.705 1.00 11.21 C ATOM 261 C SER A 75 0.973 6.340 -15.641 1.00 1.14 C ATOM 262 O SER A 75 1.042 7.544 -15.889 1.00 25.01 O ATOM 263 CB SER A 75 2.204 4.639 -17.000 1.00 24.52 C ATOM 264 OG SER A 75 1.974 5.470 -18.124 1.00 3.10 O ATOM 0 H SER A 75 2.413 3.582 -14.780 1.00 43.22 H new ATOM 0 HA SER A 75 3.097 6.091 -15.691 1.00 11.21 H new ATOM 0 HB2 SER A 75 3.157 4.122 -17.115 1.00 24.52 H new ATOM 0 HB3 SER A 75 1.431 3.873 -16.946 1.00 24.52 H new ATOM 0 HG SER A 75 1.975 4.926 -18.939 1.00 3.10 H new ATOM 270 N LYS A 76 -0.162 5.736 -15.305 1.00 62.03 N ATOM 271 CA LYS A 76 -1.419 6.468 -15.206 1.00 43.42 C ATOM 272 C LYS A 76 -1.314 7.592 -14.180 1.00 34.34 C ATOM 273 O LYS A 76 -2.024 8.593 -14.269 1.00 43.41 O ATOM 274 CB LYS A 76 -2.557 5.519 -14.825 1.00 52.25 C ATOM 275 CG LYS A 76 -2.447 4.973 -13.413 1.00 22.24 C ATOM 276 CD LYS A 76 -3.747 4.331 -12.960 1.00 34.23 C ATOM 277 CE LYS A 76 -3.950 2.968 -13.604 1.00 54.12 C ATOM 278 NZ LYS A 76 -5.340 2.796 -14.111 1.00 31.42 N ATOM 0 H LYS A 76 -0.237 4.740 -15.096 1.00 62.03 H new ATOM 0 HA LYS A 76 -1.633 6.908 -16.180 1.00 43.42 H new ATOM 0 HB2 LYS A 76 -3.507 6.044 -14.930 1.00 52.25 H new ATOM 0 HB3 LYS A 76 -2.574 4.686 -15.527 1.00 52.25 H new ATOM 0 HG2 LYS A 76 -1.643 4.239 -13.368 1.00 22.24 H new ATOM 0 HG3 LYS A 76 -2.181 5.780 -12.730 1.00 22.24 H new ATOM 0 HD2 LYS A 76 -3.743 4.225 -11.875 1.00 34.23 H new ATOM 0 HD3 LYS A 76 -4.583 4.982 -13.213 1.00 34.23 H new ATOM 0 HE2 LYS A 76 -3.246 2.847 -14.427 1.00 54.12 H new ATOM 0 HE3 LYS A 76 -3.729 2.186 -12.877 1.00 54.12 H new ATOM 0 HZ1 LYS A 76 -5.438 1.855 -14.543 1.00 31.42 H new ATOM 0 HZ2 LYS A 76 -6.011 2.887 -13.322 1.00 31.42 H new ATOM 0 HZ3 LYS A 76 -5.543 3.526 -14.823 1.00 31.42 H new ATOM 292 N GLN A 77 -0.425 7.418 -13.207 1.00 73.21 N ATOM 293 CA GLN A 77 -0.229 8.418 -12.165 1.00 3.13 C ATOM 294 C GLN A 77 0.240 9.741 -12.761 1.00 51.22 C ATOM 295 O GLN A 77 0.675 9.795 -13.912 1.00 21.04 O ATOM 296 CB GLN A 77 0.788 7.920 -11.136 1.00 1.40 C ATOM 297 CG GLN A 77 0.481 6.531 -10.600 1.00 45.15 C ATOM 298 CD GLN A 77 -0.745 6.507 -9.710 1.00 21.53 C ATOM 299 OE1 GLN A 77 -1.207 7.547 -9.241 1.00 51.32 O ATOM 300 NE2 GLN A 77 -1.280 5.315 -9.471 1.00 23.21 N ATOM 0 H GLN A 77 0.170 6.594 -13.119 1.00 73.21 H new ATOM 0 HA GLN A 77 -1.186 8.583 -11.670 1.00 3.13 H new ATOM 0 HB2 GLN A 77 1.779 7.914 -11.590 1.00 1.40 H new ATOM 0 HB3 GLN A 77 0.823 8.622 -10.303 1.00 1.40 H new ATOM 0 HG2 GLN A 77 0.332 5.848 -11.436 1.00 45.15 H new ATOM 0 HG3 GLN A 77 1.340 6.164 -10.038 1.00 45.15 H new ATOM 0 HE21 GLN A 77 -0.865 4.478 -9.880 1.00 23.21 H new ATOM 0 HE22 GLN A 77 -2.106 5.236 -8.878 1.00 23.21 H new ATOM 309 N ARG A 78 0.147 10.806 -11.972 1.00 4.32 N ATOM 310 CA ARG A 78 0.560 12.130 -12.423 1.00 25.22 C ATOM 311 C ARG A 78 1.888 12.532 -11.786 1.00 35.42 C ATOM 312 O ARG A 78 2.673 13.273 -12.378 1.00 21.25 O ATOM 313 CB ARG A 78 -0.514 13.165 -12.085 1.00 42.33 C ATOM 314 CG ARG A 78 -1.932 12.664 -12.302 1.00 53.22 C ATOM 315 CD ARG A 78 -2.180 12.305 -13.759 1.00 44.10 C ATOM 316 NE ARG A 78 -3.599 12.347 -14.100 1.00 31.13 N ATOM 317 CZ ARG A 78 -4.088 11.930 -15.262 1.00 54.22 C ATOM 318 NH1 ARG A 78 -3.277 11.442 -16.190 1.00 41.43 N ATOM 319 NH2 ARG A 78 -5.392 12.000 -15.498 1.00 14.40 N ATOM 0 H ARG A 78 -0.211 10.778 -11.017 1.00 4.32 H new ATOM 0 HA ARG A 78 0.692 12.093 -13.504 1.00 25.22 H new ATOM 0 HB2 ARG A 78 -0.400 13.468 -11.044 1.00 42.33 H new ATOM 0 HB3 ARG A 78 -0.354 14.054 -12.695 1.00 42.33 H new ATOM 0 HG2 ARG A 78 -2.110 11.790 -11.676 1.00 53.22 H new ATOM 0 HG3 ARG A 78 -2.641 13.430 -11.989 1.00 53.22 H new ATOM 0 HD2 ARG A 78 -1.633 12.996 -14.401 1.00 44.10 H new ATOM 0 HD3 ARG A 78 -1.789 11.307 -13.958 1.00 44.10 H new ATOM 0 HE ARG A 78 -4.250 12.717 -13.408 1.00 31.13 H new ATOM 0 HH11 ARG A 78 -2.274 11.386 -16.013 1.00 41.43 H new ATOM 0 HH12 ARG A 78 -3.656 11.123 -17.082 1.00 41.43 H new ATOM 0 HH21 ARG A 78 -6.020 12.374 -14.786 1.00 14.40 H new ATOM 0 HH22 ARG A 78 -5.767 11.679 -16.391 1.00 14.40 H new ATOM 333 N HIS A 79 2.131 12.038 -10.576 1.00 32.02 N ATOM 334 CA HIS A 79 3.363 12.346 -9.858 1.00 72.52 C ATOM 335 C HIS A 79 4.541 11.576 -10.447 1.00 62.12 C ATOM 336 O HIS A 79 4.375 10.779 -11.371 1.00 22.13 O ATOM 337 CB HIS A 79 3.211 12.011 -8.374 1.00 74.31 C ATOM 338 CG HIS A 79 1.790 12.028 -7.899 1.00 5.33 C ATOM 339 ND1 HIS A 79 1.297 11.139 -6.968 1.00 24.25 N ATOM 340 CD2 HIS A 79 0.756 12.836 -8.230 1.00 31.12 C ATOM 341 CE1 HIS A 79 0.021 11.397 -6.748 1.00 13.32 C ATOM 342 NE2 HIS A 79 -0.332 12.423 -7.501 1.00 54.12 N ATOM 0 H HIS A 79 1.492 11.423 -10.072 1.00 32.02 H new ATOM 0 HA HIS A 79 3.559 13.413 -9.963 1.00 72.52 H new ATOM 0 HB2 HIS A 79 3.636 11.025 -8.187 1.00 74.31 H new ATOM 0 HB3 HIS A 79 3.790 12.724 -7.788 1.00 74.31 H new ATOM 0 HD2 HIS A 79 0.782 13.653 -8.936 1.00 31.12 H new ATOM 0 HE1 HIS A 79 -0.624 10.860 -6.068 1.00 13.32 H new ATOM 0 HE2 HIS A 79 -1.262 12.841 -7.535 1.00 54.12 H new ATOM 350 N ASP A 80 5.730 11.820 -9.908 1.00 2.44 N ATOM 351 CA ASP A 80 6.936 11.150 -10.379 1.00 44.24 C ATOM 352 C ASP A 80 7.627 10.408 -9.240 1.00 32.15 C ATOM 353 O ASP A 80 8.217 11.023 -8.352 1.00 60.34 O ATOM 354 CB ASP A 80 7.898 12.164 -11.001 1.00 65.43 C ATOM 355 CG ASP A 80 7.306 12.857 -12.212 1.00 53.21 C ATOM 356 OD1 ASP A 80 6.640 13.899 -12.033 1.00 22.12 O ATOM 357 OD2 ASP A 80 7.508 12.359 -13.339 1.00 31.11 O ATOM 0 H ASP A 80 5.885 12.478 -9.144 1.00 2.44 H new ATOM 0 HA ASP A 80 6.645 10.423 -11.137 1.00 44.24 H new ATOM 0 HB2 ASP A 80 8.167 12.911 -10.254 1.00 65.43 H new ATOM 0 HB3 ASP A 80 8.819 11.657 -11.290 1.00 65.43 H new ATOM 362 N GLY A 81 7.547 9.081 -9.270 1.00 63.11 N ATOM 363 CA GLY A 81 8.168 8.277 -8.234 1.00 33.44 C ATOM 364 C GLY A 81 7.196 7.303 -7.596 1.00 4.11 C ATOM 365 O GLY A 81 7.458 6.773 -6.517 1.00 33.43 O ATOM 0 H GLY A 81 7.063 8.549 -9.993 1.00 63.11 H new ATOM 0 HA2 GLY A 81 9.005 7.724 -8.660 1.00 33.44 H new ATOM 0 HA3 GLY A 81 8.578 8.933 -7.466 1.00 33.44 H new ATOM 369 N ALA A 82 6.072 7.069 -8.264 1.00 15.03 N ATOM 370 CA ALA A 82 5.058 6.153 -7.756 1.00 20.24 C ATOM 371 C ALA A 82 5.629 4.751 -7.569 1.00 50.24 C ATOM 372 O ALA A 82 6.163 4.158 -8.507 1.00 23.04 O ATOM 373 CB ALA A 82 3.861 6.117 -8.694 1.00 60.22 C ATOM 0 H ALA A 82 5.840 7.501 -9.158 1.00 15.03 H new ATOM 0 HA ALA A 82 4.731 6.517 -6.782 1.00 20.24 H new ATOM 0 HB1 ALA A 82 3.112 5.429 -8.302 1.00 60.22 H new ATOM 0 HB2 ALA A 82 3.431 7.115 -8.773 1.00 60.22 H new ATOM 0 HB3 ALA A 82 4.181 5.781 -9.680 1.00 60.22 H new ATOM 379 N PHE A 83 5.513 4.227 -6.354 1.00 23.13 N ATOM 380 CA PHE A 83 6.020 2.895 -6.044 1.00 72.12 C ATOM 381 C PHE A 83 4.873 1.901 -5.885 1.00 23.41 C ATOM 382 O PHE A 83 3.767 2.269 -5.487 1.00 25.05 O ATOM 383 CB PHE A 83 6.861 2.930 -4.766 1.00 54.14 C ATOM 384 CG PHE A 83 6.044 3.082 -3.515 1.00 54.32 C ATOM 385 CD1 PHE A 83 5.495 4.308 -3.175 1.00 54.34 C ATOM 386 CD2 PHE A 83 5.824 1.999 -2.679 1.00 41.52 C ATOM 387 CE1 PHE A 83 4.743 4.451 -2.024 1.00 42.23 C ATOM 388 CE2 PHE A 83 5.073 2.136 -1.527 1.00 1.21 C ATOM 389 CZ PHE A 83 4.531 3.364 -1.200 1.00 21.43 C ATOM 0 H PHE A 83 5.072 4.704 -5.567 1.00 23.13 H new ATOM 0 HA PHE A 83 6.648 2.570 -6.874 1.00 72.12 H new ATOM 0 HB2 PHE A 83 7.445 2.012 -4.700 1.00 54.14 H new ATOM 0 HB3 PHE A 83 7.570 3.755 -4.830 1.00 54.14 H new ATOM 0 HD1 PHE A 83 5.656 5.162 -3.817 1.00 54.34 H new ATOM 0 HD2 PHE A 83 6.244 1.037 -2.931 1.00 41.52 H new ATOM 0 HE1 PHE A 83 4.322 5.412 -1.770 1.00 42.23 H new ATOM 0 HE2 PHE A 83 4.910 1.284 -0.883 1.00 1.21 H new ATOM 0 HZ PHE A 83 3.942 3.473 -0.301 1.00 21.43 H new ATOM 399 N LEU A 84 5.145 0.639 -6.199 1.00 72.23 N ATOM 400 CA LEU A 84 4.137 -0.410 -6.092 1.00 72.31 C ATOM 401 C LEU A 84 4.789 -1.787 -6.022 1.00 22.23 C ATOM 402 O LEU A 84 5.409 -2.241 -6.984 1.00 41.01 O ATOM 403 CB LEU A 84 3.178 -0.348 -7.283 1.00 5.33 C ATOM 404 CG LEU A 84 2.436 -1.642 -7.616 1.00 25.51 C ATOM 405 CD1 LEU A 84 1.122 -1.339 -8.317 1.00 53.13 C ATOM 406 CD2 LEU A 84 3.305 -2.549 -8.476 1.00 41.20 C ATOM 0 H LEU A 84 6.055 0.317 -6.530 1.00 72.23 H new ATOM 0 HA LEU A 84 3.575 -0.246 -5.172 1.00 72.31 H new ATOM 0 HB2 LEU A 84 2.440 0.431 -7.089 1.00 5.33 H new ATOM 0 HB3 LEU A 84 3.743 -0.040 -8.163 1.00 5.33 H new ATOM 0 HG LEU A 84 2.215 -2.161 -6.684 1.00 25.51 H new ATOM 0 HD11 LEU A 84 0.608 -2.273 -8.546 1.00 53.13 H new ATOM 0 HD12 LEU A 84 0.495 -0.730 -7.666 1.00 53.13 H new ATOM 0 HD13 LEU A 84 1.320 -0.797 -9.242 1.00 53.13 H new ATOM 0 HD21 LEU A 84 2.761 -3.466 -8.703 1.00 41.20 H new ATOM 0 HD22 LEU A 84 3.558 -2.037 -9.405 1.00 41.20 H new ATOM 0 HD23 LEU A 84 4.220 -2.795 -7.937 1.00 41.20 H new ATOM 418 N ILE A 85 4.644 -2.447 -4.878 1.00 34.42 N ATOM 419 CA ILE A 85 5.216 -3.774 -4.684 1.00 11.23 C ATOM 420 C ILE A 85 4.252 -4.861 -5.145 1.00 33.40 C ATOM 421 O ILE A 85 3.082 -4.872 -4.761 1.00 51.54 O ATOM 422 CB ILE A 85 5.581 -4.019 -3.208 1.00 33.13 C ATOM 423 CG1 ILE A 85 6.565 -2.954 -2.719 1.00 73.21 C ATOM 424 CG2 ILE A 85 6.168 -5.411 -3.032 1.00 31.54 C ATOM 425 CD1 ILE A 85 6.941 -3.102 -1.262 1.00 30.45 C ATOM 0 H ILE A 85 4.135 -2.085 -4.071 1.00 34.42 H new ATOM 0 HA ILE A 85 6.123 -3.818 -5.286 1.00 11.23 H new ATOM 0 HB ILE A 85 4.673 -3.950 -2.608 1.00 33.13 H new ATOM 0 HG12 ILE A 85 7.469 -3.001 -3.326 1.00 73.21 H new ATOM 0 HG13 ILE A 85 6.127 -1.968 -2.875 1.00 73.21 H new ATOM 0 HG21 ILE A 85 6.421 -5.569 -1.984 1.00 31.54 H new ATOM 0 HG22 ILE A 85 5.437 -6.156 -3.345 1.00 31.54 H new ATOM 0 HG23 ILE A 85 7.067 -5.506 -3.641 1.00 31.54 H new ATOM 0 HD11 ILE A 85 7.641 -2.314 -0.985 1.00 30.45 H new ATOM 0 HD12 ILE A 85 6.045 -3.025 -0.646 1.00 30.45 H new ATOM 0 HD13 ILE A 85 7.408 -4.074 -1.104 1.00 30.45 H new ATOM 437 N ARG A 86 4.751 -5.777 -5.969 1.00 2.21 N ATOM 438 CA ARG A 86 3.934 -6.870 -6.482 1.00 42.11 C ATOM 439 C ARG A 86 4.554 -8.221 -6.135 1.00 54.34 C ATOM 440 O ARG A 86 5.775 -8.367 -6.117 1.00 21.13 O ATOM 441 CB ARG A 86 3.772 -6.745 -7.998 1.00 71.31 C ATOM 442 CG ARG A 86 5.090 -6.749 -8.754 1.00 45.42 C ATOM 443 CD ARG A 86 5.182 -5.577 -9.719 1.00 43.11 C ATOM 444 NE ARG A 86 6.564 -5.271 -10.079 1.00 23.03 N ATOM 445 CZ ARG A 86 7.225 -5.891 -11.050 1.00 5.12 C ATOM 446 NH1 ARG A 86 6.634 -6.845 -11.755 1.00 54.00 N ATOM 447 NH2 ARG A 86 8.481 -5.556 -11.318 1.00 23.34 N ATOM 0 H ARG A 86 5.717 -5.784 -6.295 1.00 2.21 H new ATOM 0 HA ARG A 86 2.952 -6.809 -6.012 1.00 42.11 H new ATOM 0 HB2 ARG A 86 3.154 -7.568 -8.358 1.00 71.31 H new ATOM 0 HB3 ARG A 86 3.237 -5.822 -8.223 1.00 71.31 H new ATOM 0 HG2 ARG A 86 5.917 -6.704 -8.046 1.00 45.42 H new ATOM 0 HG3 ARG A 86 5.192 -7.684 -9.305 1.00 45.42 H new ATOM 0 HD2 ARG A 86 4.614 -5.805 -10.621 1.00 43.11 H new ATOM 0 HD3 ARG A 86 4.722 -4.698 -9.267 1.00 43.11 H new ATOM 0 HE ARG A 86 7.048 -4.541 -9.556 1.00 23.03 H new ATOM 0 HH11 ARG A 86 5.669 -7.105 -11.553 1.00 54.00 H new ATOM 0 HH12 ARG A 86 7.144 -7.319 -12.500 1.00 54.00 H new ATOM 0 HH21 ARG A 86 8.939 -4.822 -10.778 1.00 23.34 H new ATOM 0 HH22 ARG A 86 8.988 -6.033 -12.064 1.00 23.34 H new ATOM 461 N GLU A 87 3.702 -9.204 -5.861 1.00 54.33 N ATOM 462 CA GLU A 87 4.166 -10.542 -5.514 1.00 2.41 C ATOM 463 C GLU A 87 4.209 -11.440 -6.747 1.00 4.31 C ATOM 464 O GLU A 87 3.313 -11.399 -7.590 1.00 1.53 O ATOM 465 CB GLU A 87 3.258 -11.161 -4.450 1.00 14.21 C ATOM 466 CG GLU A 87 3.985 -12.094 -3.497 1.00 31.31 C ATOM 467 CD GLU A 87 3.356 -12.125 -2.117 1.00 45.12 C ATOM 468 OE1 GLU A 87 2.115 -12.234 -2.034 1.00 21.13 O ATOM 469 OE2 GLU A 87 4.105 -12.039 -1.122 1.00 22.34 O ATOM 0 H GLU A 87 2.687 -9.099 -5.873 1.00 54.33 H new ATOM 0 HA GLU A 87 5.176 -10.456 -5.113 1.00 2.41 H new ATOM 0 HB2 GLU A 87 2.789 -10.362 -3.876 1.00 14.21 H new ATOM 0 HB3 GLU A 87 2.457 -11.712 -4.944 1.00 14.21 H new ATOM 0 HG2 GLU A 87 3.989 -13.101 -3.913 1.00 31.31 H new ATOM 0 HG3 GLU A 87 5.025 -11.781 -3.411 1.00 31.31 H new ATOM 476 N SER A 88 5.258 -12.250 -6.845 1.00 64.00 N ATOM 477 CA SER A 88 5.422 -13.155 -7.976 1.00 72.35 C ATOM 478 C SER A 88 4.251 -14.129 -8.067 1.00 14.03 C ATOM 479 O SER A 88 3.564 -14.383 -7.078 1.00 21.13 O ATOM 480 CB SER A 88 6.735 -13.930 -7.852 1.00 2.15 C ATOM 481 OG SER A 88 7.586 -13.672 -8.955 1.00 4.44 O ATOM 0 H SER A 88 6.007 -12.298 -6.155 1.00 64.00 H new ATOM 0 HA SER A 88 5.447 -12.556 -8.887 1.00 72.35 H new ATOM 0 HB2 SER A 88 7.239 -13.651 -6.927 1.00 2.15 H new ATOM 0 HB3 SER A 88 6.526 -14.998 -7.792 1.00 2.15 H new ATOM 0 HG SER A 88 8.474 -14.046 -8.777 1.00 4.44 H new ATOM 487 N GLU A 89 4.030 -14.670 -9.261 1.00 32.23 N ATOM 488 CA GLU A 89 2.941 -15.615 -9.481 1.00 23.33 C ATOM 489 C GLU A 89 3.412 -17.049 -9.255 1.00 31.21 C ATOM 490 O GLU A 89 2.772 -17.818 -8.537 1.00 43.00 O ATOM 491 CB GLU A 89 2.386 -15.466 -10.899 1.00 32.54 C ATOM 492 CG GLU A 89 1.953 -14.050 -11.237 1.00 44.23 C ATOM 493 CD GLU A 89 0.479 -13.956 -11.579 1.00 10.32 C ATOM 494 OE1 GLU A 89 -0.333 -14.603 -10.885 1.00 25.44 O ATOM 495 OE2 GLU A 89 0.137 -13.235 -12.539 1.00 74.45 O ATOM 0 H GLU A 89 4.590 -14.470 -10.090 1.00 32.23 H new ATOM 0 HA GLU A 89 2.150 -15.393 -8.764 1.00 23.33 H new ATOM 0 HB2 GLU A 89 3.146 -15.785 -11.613 1.00 32.54 H new ATOM 0 HB3 GLU A 89 1.535 -16.136 -11.019 1.00 32.54 H new ATOM 0 HG2 GLU A 89 2.168 -13.397 -10.391 1.00 44.23 H new ATOM 0 HG3 GLU A 89 2.541 -13.686 -12.079 1.00 44.23 H new ATOM 502 N SER A 90 4.534 -17.402 -9.874 1.00 1.13 N ATOM 503 CA SER A 90 5.089 -18.744 -9.745 1.00 32.34 C ATOM 504 C SER A 90 6.042 -18.826 -8.556 1.00 64.05 C ATOM 505 O SER A 90 6.464 -19.912 -8.158 1.00 54.52 O ATOM 506 CB SER A 90 5.820 -19.143 -11.028 1.00 52.41 C ATOM 507 OG SER A 90 5.023 -20.003 -11.823 1.00 75.20 O ATOM 0 H SER A 90 5.077 -16.777 -10.470 1.00 1.13 H new ATOM 0 HA SER A 90 4.264 -19.436 -9.576 1.00 32.34 H new ATOM 0 HB2 SER A 90 6.076 -18.249 -11.597 1.00 52.41 H new ATOM 0 HB3 SER A 90 6.757 -19.640 -10.777 1.00 52.41 H new ATOM 0 HG SER A 90 5.512 -20.242 -12.638 1.00 75.20 H new ATOM 513 N ALA A 91 6.379 -17.669 -7.995 1.00 74.30 N ATOM 514 CA ALA A 91 7.281 -17.609 -6.852 1.00 15.24 C ATOM 515 C ALA A 91 6.628 -16.891 -5.675 1.00 51.10 C ATOM 516 O ALA A 91 6.735 -15.674 -5.523 1.00 13.14 O ATOM 517 CB ALA A 91 8.579 -16.917 -7.240 1.00 21.43 C ATOM 0 H ALA A 91 6.041 -16.761 -8.314 1.00 74.30 H new ATOM 0 HA ALA A 91 7.505 -18.630 -6.543 1.00 15.24 H new ATOM 0 HB1 ALA A 91 9.243 -16.879 -6.377 1.00 21.43 H new ATOM 0 HB2 ALA A 91 9.061 -17.472 -8.045 1.00 21.43 H new ATOM 0 HB3 ALA A 91 8.364 -15.903 -7.577 1.00 21.43 H new ATOM 523 N PRO A 92 5.935 -17.660 -4.822 1.00 54.04 N ATOM 524 CA PRO A 92 5.251 -17.118 -3.644 1.00 72.14 C ATOM 525 C PRO A 92 6.228 -16.642 -2.575 1.00 32.54 C ATOM 526 O PRO A 92 7.084 -17.400 -2.121 1.00 64.34 O ATOM 527 CB PRO A 92 4.433 -18.306 -3.131 1.00 52.15 C ATOM 528 CG PRO A 92 5.163 -19.508 -3.621 1.00 22.50 C ATOM 529 CD PRO A 92 5.765 -19.118 -4.942 1.00 44.23 C ATOM 0 HA PRO A 92 4.649 -16.243 -3.889 1.00 72.14 H new ATOM 0 HB2 PRO A 92 4.366 -18.300 -2.043 1.00 52.15 H new ATOM 0 HB3 PRO A 92 3.413 -18.279 -3.514 1.00 52.15 H new ATOM 0 HG2 PRO A 92 5.936 -19.810 -2.914 1.00 22.50 H new ATOM 0 HG3 PRO A 92 4.487 -20.355 -3.735 1.00 22.50 H new ATOM 0 HD2 PRO A 92 6.717 -19.621 -5.114 1.00 44.23 H new ATOM 0 HD3 PRO A 92 5.111 -19.379 -5.774 1.00 44.23 H new ATOM 537 N GLY A 93 6.093 -15.382 -2.174 1.00 52.45 N ATOM 538 CA GLY A 93 6.970 -14.827 -1.160 1.00 64.14 C ATOM 539 C GLY A 93 7.905 -13.771 -1.717 1.00 20.41 C ATOM 540 O GLY A 93 8.284 -12.835 -1.013 1.00 52.12 O ATOM 0 H GLY A 93 5.391 -14.735 -2.534 1.00 52.45 H new ATOM 0 HA2 GLY A 93 6.368 -14.391 -0.363 1.00 64.14 H new ATOM 0 HA3 GLY A 93 7.558 -15.629 -0.714 1.00 64.14 H new ATOM 544 N ASP A 94 8.279 -13.923 -2.982 1.00 41.35 N ATOM 545 CA ASP A 94 9.176 -12.975 -3.633 1.00 42.32 C ATOM 546 C ASP A 94 8.498 -11.620 -3.811 1.00 44.24 C ATOM 547 O ASP A 94 7.390 -11.533 -4.340 1.00 34.24 O ATOM 548 CB ASP A 94 9.627 -13.516 -4.991 1.00 0.02 C ATOM 549 CG ASP A 94 11.116 -13.795 -5.037 1.00 64.31 C ATOM 550 OD1 ASP A 94 11.672 -14.220 -4.003 1.00 23.30 O ATOM 551 OD2 ASP A 94 11.726 -13.588 -6.107 1.00 63.02 O ATOM 0 H ASP A 94 7.975 -14.693 -3.577 1.00 41.35 H new ATOM 0 HA ASP A 94 10.050 -12.843 -2.995 1.00 42.32 H new ATOM 0 HB2 ASP A 94 9.081 -14.433 -5.213 1.00 0.02 H new ATOM 0 HB3 ASP A 94 9.371 -12.797 -5.769 1.00 0.02 H new ATOM 556 N PHE A 95 9.172 -10.564 -3.366 1.00 53.04 N ATOM 557 CA PHE A 95 8.634 -9.213 -3.475 1.00 13.12 C ATOM 558 C PHE A 95 9.366 -8.421 -4.555 1.00 35.14 C ATOM 559 O PHE A 95 10.577 -8.558 -4.727 1.00 33.24 O ATOM 560 CB PHE A 95 8.744 -8.488 -2.132 1.00 30.01 C ATOM 561 CG PHE A 95 7.712 -8.921 -1.130 1.00 60.33 C ATOM 562 CD1 PHE A 95 6.372 -8.631 -1.327 1.00 13.42 C ATOM 563 CD2 PHE A 95 8.082 -9.619 0.008 1.00 5.02 C ATOM 564 CE1 PHE A 95 5.419 -9.028 -0.407 1.00 64.22 C ATOM 565 CE2 PHE A 95 7.135 -10.019 0.931 1.00 73.51 C ATOM 566 CZ PHE A 95 5.802 -9.723 0.724 1.00 53.34 C ATOM 0 H PHE A 95 10.091 -10.618 -2.927 1.00 53.04 H new ATOM 0 HA PHE A 95 7.583 -9.289 -3.755 1.00 13.12 H new ATOM 0 HB2 PHE A 95 9.737 -8.659 -1.716 1.00 30.01 H new ATOM 0 HB3 PHE A 95 8.649 -7.415 -2.299 1.00 30.01 H new ATOM 0 HD1 PHE A 95 6.068 -8.088 -2.210 1.00 13.42 H new ATOM 0 HD2 PHE A 95 9.123 -9.853 0.176 1.00 5.02 H new ATOM 0 HE1 PHE A 95 4.377 -8.795 -0.572 1.00 64.22 H new ATOM 0 HE2 PHE A 95 7.437 -10.563 1.814 1.00 73.51 H new ATOM 0 HZ PHE A 95 5.060 -10.034 1.445 1.00 53.34 H new ATOM 576 N SER A 96 8.621 -7.593 -5.280 1.00 13.22 N ATOM 577 CA SER A 96 9.197 -6.782 -6.346 1.00 53.20 C ATOM 578 C SER A 96 8.613 -5.372 -6.333 1.00 35.54 C ATOM 579 O SER A 96 7.418 -5.181 -6.565 1.00 1.54 O ATOM 580 CB SER A 96 8.947 -7.437 -7.706 1.00 15.13 C ATOM 581 OG SER A 96 9.318 -6.572 -8.765 1.00 13.42 O ATOM 0 H SER A 96 7.617 -7.466 -5.149 1.00 13.22 H new ATOM 0 HA SER A 96 10.271 -6.713 -6.176 1.00 53.20 H new ATOM 0 HB2 SER A 96 9.514 -8.366 -7.775 1.00 15.13 H new ATOM 0 HB3 SER A 96 7.893 -7.699 -7.799 1.00 15.13 H new ATOM 0 HG SER A 96 9.611 -7.104 -9.534 1.00 13.42 H new ATOM 587 N LEU A 97 9.463 -4.389 -6.059 1.00 72.24 N ATOM 588 CA LEU A 97 9.033 -2.996 -6.015 1.00 53.12 C ATOM 589 C LEU A 97 9.123 -2.354 -7.396 1.00 60.10 C ATOM 590 O LEU A 97 10.163 -2.413 -8.052 1.00 1.52 O ATOM 591 CB LEU A 97 9.886 -2.210 -5.018 1.00 54.41 C ATOM 592 CG LEU A 97 9.591 -0.713 -4.917 1.00 10.41 C ATOM 593 CD1 LEU A 97 10.068 0.011 -6.167 1.00 31.14 C ATOM 594 CD2 LEU A 97 8.104 -0.475 -4.696 1.00 22.44 C ATOM 0 H LEU A 97 10.454 -4.531 -5.864 1.00 72.24 H new ATOM 0 HA LEU A 97 7.992 -2.973 -5.691 1.00 53.12 H new ATOM 0 HB2 LEU A 97 9.756 -2.653 -4.031 1.00 54.41 H new ATOM 0 HB3 LEU A 97 10.934 -2.336 -5.289 1.00 54.41 H new ATOM 0 HG LEU A 97 10.134 -0.313 -4.060 1.00 10.41 H new ATOM 0 HD11 LEU A 97 9.850 1.075 -6.077 1.00 31.14 H new ATOM 0 HD12 LEU A 97 11.143 -0.130 -6.282 1.00 31.14 H new ATOM 0 HD13 LEU A 97 9.554 -0.392 -7.040 1.00 31.14 H new ATOM 0 HD21 LEU A 97 7.913 0.596 -4.627 1.00 22.44 H new ATOM 0 HD22 LEU A 97 7.541 -0.890 -5.532 1.00 22.44 H new ATOM 0 HD23 LEU A 97 7.791 -0.960 -3.771 1.00 22.44 H new ATOM 606 N SER A 98 8.027 -1.740 -7.830 1.00 61.25 N ATOM 607 CA SER A 98 7.982 -1.088 -9.134 1.00 71.41 C ATOM 608 C SER A 98 7.823 0.421 -8.981 1.00 44.44 C ATOM 609 O SER A 98 6.769 0.909 -8.573 1.00 61.51 O ATOM 610 CB SER A 98 6.831 -1.651 -9.970 1.00 33.42 C ATOM 611 OG SER A 98 7.169 -1.687 -11.345 1.00 52.45 O ATOM 0 H SER A 98 7.159 -1.680 -7.298 1.00 61.25 H new ATOM 0 HA SER A 98 8.924 -1.287 -9.645 1.00 71.41 H new ATOM 0 HB2 SER A 98 6.586 -2.656 -9.626 1.00 33.42 H new ATOM 0 HB3 SER A 98 5.940 -1.039 -9.827 1.00 33.42 H new ATOM 0 HG SER A 98 6.831 -2.516 -11.743 1.00 52.45 H new ATOM 617 N VAL A 99 8.880 1.157 -9.312 1.00 53.44 N ATOM 618 CA VAL A 99 8.859 2.612 -9.214 1.00 22.13 C ATOM 619 C VAL A 99 8.874 3.257 -10.595 1.00 72.30 C ATOM 620 O VAL A 99 9.728 2.950 -11.427 1.00 71.10 O ATOM 621 CB VAL A 99 10.058 3.136 -8.402 1.00 4.33 C ATOM 622 CG1 VAL A 99 10.793 4.221 -9.174 1.00 42.14 C ATOM 623 CG2 VAL A 99 9.599 3.653 -7.047 1.00 12.40 C ATOM 0 H VAL A 99 9.761 0.770 -9.650 1.00 53.44 H new ATOM 0 HA VAL A 99 7.936 2.881 -8.701 1.00 22.13 H new ATOM 0 HB VAL A 99 10.750 2.310 -8.235 1.00 4.33 H new ATOM 0 HG11 VAL A 99 11.637 4.579 -8.584 1.00 42.14 H new ATOM 0 HG12 VAL A 99 11.156 3.814 -10.117 1.00 42.14 H new ATOM 0 HG13 VAL A 99 10.113 5.049 -9.374 1.00 42.14 H new ATOM 0 HG21 VAL A 99 10.459 4.019 -6.487 1.00 12.40 H new ATOM 0 HG22 VAL A 99 8.886 4.465 -7.190 1.00 12.40 H new ATOM 0 HG23 VAL A 99 9.122 2.845 -6.492 1.00 12.40 H new ATOM 633 N LYS A 100 7.922 4.153 -10.833 1.00 44.24 N ATOM 634 CA LYS A 100 7.825 4.844 -12.114 1.00 3.44 C ATOM 635 C LYS A 100 8.731 6.072 -12.139 1.00 72.44 C ATOM 636 O LYS A 100 8.537 7.015 -11.372 1.00 73.13 O ATOM 637 CB LYS A 100 6.377 5.260 -12.383 1.00 44.15 C ATOM 638 CG LYS A 100 6.251 6.455 -13.313 1.00 33.13 C ATOM 639 CD LYS A 100 4.796 6.775 -13.614 1.00 63.14 C ATOM 640 CE LYS A 100 4.666 8.031 -14.462 1.00 43.02 C ATOM 641 NZ LYS A 100 5.301 9.209 -13.809 1.00 43.12 N ATOM 0 H LYS A 100 7.207 4.418 -10.156 1.00 44.24 H new ATOM 0 HA LYS A 100 8.151 4.157 -12.895 1.00 3.44 H new ATOM 0 HB2 LYS A 100 5.839 4.416 -12.815 1.00 44.15 H new ATOM 0 HB3 LYS A 100 5.893 5.495 -11.435 1.00 44.15 H new ATOM 0 HG2 LYS A 100 6.729 7.323 -12.859 1.00 33.13 H new ATOM 0 HG3 LYS A 100 6.780 6.250 -14.244 1.00 33.13 H new ATOM 0 HD2 LYS A 100 4.337 5.934 -14.134 1.00 63.14 H new ATOM 0 HD3 LYS A 100 4.251 6.907 -12.680 1.00 63.14 H new ATOM 0 HE2 LYS A 100 5.128 7.862 -15.435 1.00 43.02 H new ATOM 0 HE3 LYS A 100 3.612 8.240 -14.642 1.00 43.02 H new ATOM 0 HZ1 LYS A 100 5.020 10.076 -14.309 1.00 43.12 H new ATOM 0 HZ2 LYS A 100 4.991 9.265 -12.818 1.00 43.12 H new ATOM 0 HZ3 LYS A 100 6.336 9.109 -13.843 1.00 43.12 H new ATOM 655 N PHE A 101 9.720 6.053 -13.027 1.00 55.21 N ATOM 656 CA PHE A 101 10.655 7.165 -13.153 1.00 73.00 C ATOM 657 C PHE A 101 10.511 7.845 -14.511 1.00 41.33 C ATOM 658 O PHE A 101 11.081 7.398 -15.505 1.00 64.03 O ATOM 659 CB PHE A 101 12.092 6.674 -12.965 1.00 53.12 C ATOM 660 CG PHE A 101 12.493 6.531 -11.525 1.00 11.31 C ATOM 661 CD1 PHE A 101 12.245 7.550 -10.619 1.00 22.43 C ATOM 662 CD2 PHE A 101 13.118 5.379 -11.077 1.00 64.34 C ATOM 663 CE1 PHE A 101 12.613 7.421 -9.292 1.00 52.24 C ATOM 664 CE2 PHE A 101 13.488 5.244 -9.752 1.00 51.54 C ATOM 665 CZ PHE A 101 13.236 6.267 -8.859 1.00 51.41 C ATOM 0 H PHE A 101 9.894 5.280 -13.669 1.00 55.21 H new ATOM 0 HA PHE A 101 10.423 7.893 -12.376 1.00 73.00 H new ATOM 0 HB2 PHE A 101 12.207 5.711 -13.463 1.00 53.12 H new ATOM 0 HB3 PHE A 101 12.772 7.370 -13.456 1.00 53.12 H new ATOM 0 HD1 PHE A 101 11.759 8.455 -10.953 1.00 22.43 H new ATOM 0 HD2 PHE A 101 13.319 4.576 -11.771 1.00 64.34 H new ATOM 0 HE1 PHE A 101 12.413 8.222 -8.595 1.00 52.24 H new ATOM 0 HE2 PHE A 101 13.973 4.340 -9.416 1.00 51.54 H new ATOM 0 HZ PHE A 101 13.526 6.165 -7.824 1.00 51.41 H new ATOM 675 N GLY A 102 9.743 8.930 -14.545 1.00 4.41 N ATOM 676 CA GLY A 102 9.537 9.655 -15.785 1.00 42.13 C ATOM 677 C GLY A 102 8.892 8.799 -16.857 1.00 22.22 C ATOM 678 O GLY A 102 7.794 8.278 -16.667 1.00 21.23 O ATOM 0 H GLY A 102 9.260 9.320 -13.736 1.00 4.41 H new ATOM 0 HA2 GLY A 102 8.910 10.526 -15.593 1.00 42.13 H new ATOM 0 HA3 GLY A 102 10.495 10.026 -16.149 1.00 42.13 H new ATOM 682 N ASN A 103 9.576 8.654 -17.988 1.00 14.15 N ATOM 683 CA ASN A 103 9.061 7.857 -19.095 1.00 21.41 C ATOM 684 C ASN A 103 9.641 6.446 -19.064 1.00 74.44 C ATOM 685 O ASN A 103 9.681 5.758 -20.085 1.00 34.23 O ATOM 686 CB ASN A 103 9.391 8.527 -20.430 1.00 63.10 C ATOM 687 CG ASN A 103 8.162 9.097 -21.110 1.00 73.04 C ATOM 688 OD1 ASN A 103 7.166 8.399 -21.303 1.00 14.50 O ATOM 689 ND2 ASN A 103 8.227 10.371 -21.478 1.00 55.34 N ATOM 0 H ASN A 103 10.487 9.078 -18.161 1.00 14.15 H new ATOM 0 HA ASN A 103 7.978 7.789 -18.989 1.00 21.41 H new ATOM 0 HB2 ASN A 103 10.114 9.326 -20.264 1.00 63.10 H new ATOM 0 HB3 ASN A 103 9.864 7.801 -21.091 1.00 63.10 H new ATOM 0 HD21 ASN A 103 7.431 10.809 -21.941 1.00 55.34 H new ATOM 0 HD22 ASN A 103 9.073 10.911 -21.298 1.00 55.34 H new ATOM 696 N ASP A 104 10.088 6.021 -17.888 1.00 10.22 N ATOM 697 CA ASP A 104 10.664 4.692 -17.723 1.00 71.52 C ATOM 698 C ASP A 104 10.514 4.209 -16.284 1.00 24.12 C ATOM 699 O ASP A 104 11.152 4.736 -15.372 1.00 32.21 O ATOM 700 CB ASP A 104 12.141 4.699 -18.121 1.00 12.42 C ATOM 701 CG ASP A 104 12.397 5.501 -19.382 1.00 13.12 C ATOM 702 OD1 ASP A 104 12.317 6.746 -19.320 1.00 31.44 O ATOM 703 OD2 ASP A 104 12.676 4.884 -20.431 1.00 71.12 O ATOM 0 H ASP A 104 10.063 6.578 -17.034 1.00 10.22 H new ATOM 0 HA ASP A 104 10.124 4.006 -18.375 1.00 71.52 H new ATOM 0 HB2 ASP A 104 12.732 5.113 -17.304 1.00 12.42 H new ATOM 0 HB3 ASP A 104 12.479 3.674 -18.271 1.00 12.42 H new ATOM 708 N VAL A 105 9.667 3.204 -16.087 1.00 13.00 N ATOM 709 CA VAL A 105 9.433 2.650 -14.759 1.00 0.13 C ATOM 710 C VAL A 105 10.384 1.494 -14.471 1.00 34.54 C ATOM 711 O VAL A 105 10.396 0.495 -15.189 1.00 63.33 O ATOM 712 CB VAL A 105 7.982 2.158 -14.603 1.00 53.30 C ATOM 713 CG1 VAL A 105 7.449 1.637 -15.929 1.00 42.11 C ATOM 714 CG2 VAL A 105 7.895 1.087 -13.526 1.00 42.23 C ATOM 0 H VAL A 105 9.131 2.757 -16.831 1.00 13.00 H new ATOM 0 HA VAL A 105 9.615 3.453 -14.045 1.00 0.13 H new ATOM 0 HB VAL A 105 7.362 3.001 -14.296 1.00 53.30 H new ATOM 0 HG11 VAL A 105 6.423 1.294 -15.799 1.00 42.11 H new ATOM 0 HG12 VAL A 105 7.473 2.436 -16.670 1.00 42.11 H new ATOM 0 HG13 VAL A 105 8.069 0.807 -16.269 1.00 42.11 H new ATOM 0 HG21 VAL A 105 6.863 0.751 -13.429 1.00 42.23 H new ATOM 0 HG22 VAL A 105 8.527 0.243 -13.801 1.00 42.23 H new ATOM 0 HG23 VAL A 105 8.233 1.499 -12.575 1.00 42.23 H new ATOM 724 N GLN A 106 11.178 1.636 -13.414 1.00 55.43 N ATOM 725 CA GLN A 106 12.132 0.603 -13.031 1.00 60.23 C ATOM 726 C GLN A 106 11.607 -0.215 -11.856 1.00 14.10 C ATOM 727 O GLN A 106 10.563 0.101 -11.284 1.00 0.13 O ATOM 728 CB GLN A 106 13.479 1.231 -12.669 1.00 53.42 C ATOM 729 CG GLN A 106 13.861 2.405 -13.557 1.00 71.41 C ATOM 730 CD GLN A 106 13.918 2.031 -15.025 1.00 50.02 C ATOM 731 OE1 GLN A 106 13.010 1.385 -15.549 1.00 51.00 O ATOM 732 NE2 GLN A 106 14.988 2.437 -15.698 1.00 63.34 N ATOM 0 H GLN A 106 11.179 2.457 -12.808 1.00 55.43 H new ATOM 0 HA GLN A 106 12.267 -0.064 -13.883 1.00 60.23 H new ATOM 0 HB2 GLN A 106 13.448 1.566 -11.632 1.00 53.42 H new ATOM 0 HB3 GLN A 106 14.255 0.469 -12.735 1.00 53.42 H new ATOM 0 HG2 GLN A 106 13.139 3.210 -13.419 1.00 71.41 H new ATOM 0 HG3 GLN A 106 14.832 2.790 -13.246 1.00 71.41 H new ATOM 0 HE21 GLN A 106 15.717 2.970 -15.224 1.00 63.34 H new ATOM 0 HE22 GLN A 106 15.081 2.216 -16.689 1.00 63.34 H new ATOM 741 N HIS A 107 12.336 -1.268 -11.501 1.00 1.22 N ATOM 742 CA HIS A 107 11.943 -2.131 -10.393 1.00 24.32 C ATOM 743 C HIS A 107 13.168 -2.618 -9.623 1.00 75.54 C ATOM 744 O HIS A 107 14.295 -2.529 -10.110 1.00 21.24 O ATOM 745 CB HIS A 107 11.142 -3.327 -10.909 1.00 42.33 C ATOM 746 CG HIS A 107 10.736 -3.200 -12.345 1.00 52.03 C ATOM 747 ND1 HIS A 107 11.129 -4.092 -13.320 1.00 61.23 N ATOM 748 CD2 HIS A 107 9.965 -2.279 -12.969 1.00 54.01 C ATOM 749 CE1 HIS A 107 10.619 -3.724 -14.482 1.00 71.51 C ATOM 750 NE2 HIS A 107 9.908 -2.627 -14.296 1.00 74.12 N ATOM 0 H HIS A 107 13.202 -1.544 -11.964 1.00 1.22 H new ATOM 0 HA HIS A 107 11.317 -1.549 -9.716 1.00 24.32 H new ATOM 0 HB2 HIS A 107 11.737 -4.232 -10.787 1.00 42.33 H new ATOM 0 HB3 HIS A 107 10.248 -3.447 -10.296 1.00 42.33 H new ATOM 0 HD2 HIS A 107 9.484 -1.429 -12.509 1.00 54.01 H new ATOM 0 HE1 HIS A 107 10.760 -4.234 -15.424 1.00 71.51 H new ATOM 0 HE2 HIS A 107 9.399 -2.120 -15.020 1.00 74.12 H new ATOM 758 N PHE A 108 12.938 -3.133 -8.420 1.00 12.12 N ATOM 759 CA PHE A 108 14.022 -3.633 -7.582 1.00 51.53 C ATOM 760 C PHE A 108 13.655 -4.978 -6.963 1.00 12.35 C ATOM 761 O PHE A 108 12.594 -5.126 -6.355 1.00 4.13 O ATOM 762 CB PHE A 108 14.350 -2.623 -6.480 1.00 62.13 C ATOM 763 CG PHE A 108 14.740 -1.270 -7.003 1.00 74.13 C ATOM 764 CD1 PHE A 108 13.776 -0.388 -7.465 1.00 44.25 C ATOM 765 CD2 PHE A 108 16.069 -0.881 -7.033 1.00 40.33 C ATOM 766 CE1 PHE A 108 14.131 0.858 -7.947 1.00 43.31 C ATOM 767 CE2 PHE A 108 16.430 0.364 -7.513 1.00 51.14 C ATOM 768 CZ PHE A 108 15.460 1.234 -7.972 1.00 40.10 C ATOM 0 H PHE A 108 12.011 -3.215 -8.003 1.00 12.12 H new ATOM 0 HA PHE A 108 14.901 -3.771 -8.212 1.00 51.53 H new ATOM 0 HB2 PHE A 108 13.484 -2.515 -5.827 1.00 62.13 H new ATOM 0 HB3 PHE A 108 15.163 -3.015 -5.869 1.00 62.13 H new ATOM 0 HD1 PHE A 108 12.736 -0.677 -7.448 1.00 44.25 H new ATOM 0 HD2 PHE A 108 16.832 -1.558 -6.677 1.00 40.33 H new ATOM 0 HE1 PHE A 108 13.370 1.537 -8.304 1.00 43.31 H new ATOM 0 HE2 PHE A 108 17.470 0.656 -7.529 1.00 51.14 H new ATOM 0 HZ PHE A 108 15.740 2.206 -8.350 1.00 40.10 H new ATOM 778 N LYS A 109 14.539 -5.957 -7.121 1.00 42.54 N ATOM 779 CA LYS A 109 14.311 -7.290 -6.578 1.00 70.20 C ATOM 780 C LYS A 109 14.578 -7.319 -5.076 1.00 54.15 C ATOM 781 O LYS A 109 15.702 -7.087 -4.631 1.00 33.41 O ATOM 782 CB LYS A 109 15.205 -8.311 -7.285 1.00 60.32 C ATOM 783 CG LYS A 109 14.448 -9.238 -8.221 1.00 10.22 C ATOM 784 CD LYS A 109 14.902 -10.680 -8.066 1.00 11.44 C ATOM 785 CE LYS A 109 14.007 -11.445 -7.102 1.00 45.23 C ATOM 786 NZ LYS A 109 13.222 -12.503 -7.796 1.00 42.21 N ATOM 0 H LYS A 109 15.421 -5.852 -7.622 1.00 42.54 H new ATOM 0 HA LYS A 109 13.266 -7.551 -6.749 1.00 70.20 H new ATOM 0 HB2 LYS A 109 15.969 -7.780 -7.853 1.00 60.32 H new ATOM 0 HB3 LYS A 109 15.723 -8.909 -6.535 1.00 60.32 H new ATOM 0 HG2 LYS A 109 13.379 -9.168 -8.018 1.00 10.22 H new ATOM 0 HG3 LYS A 109 14.598 -8.917 -9.252 1.00 10.22 H new ATOM 0 HD2 LYS A 109 14.895 -11.172 -9.039 1.00 11.44 H new ATOM 0 HD3 LYS A 109 15.930 -10.702 -7.705 1.00 11.44 H new ATOM 0 HE2 LYS A 109 14.618 -11.899 -6.322 1.00 45.23 H new ATOM 0 HE3 LYS A 109 13.326 -10.751 -6.610 1.00 45.23 H new ATOM 0 HZ1 LYS A 109 12.484 -12.862 -7.158 1.00 42.21 H new ATOM 0 HZ2 LYS A 109 12.779 -12.104 -8.648 1.00 42.21 H new ATOM 0 HZ3 LYS A 109 13.854 -13.283 -8.067 1.00 42.21 H new ATOM 800 N VAL A 110 13.537 -7.606 -4.301 1.00 1.35 N ATOM 801 CA VAL A 110 13.660 -7.667 -2.849 1.00 31.40 C ATOM 802 C VAL A 110 14.116 -9.049 -2.394 1.00 61.23 C ATOM 803 O VAL A 110 13.438 -10.049 -2.634 1.00 33.14 O ATOM 804 CB VAL A 110 12.326 -7.326 -2.158 1.00 5.21 C ATOM 805 CG1 VAL A 110 12.337 -7.799 -0.712 1.00 45.03 C ATOM 806 CG2 VAL A 110 12.054 -5.831 -2.236 1.00 73.33 C ATOM 0 H VAL A 110 12.600 -7.800 -4.654 1.00 1.35 H new ATOM 0 HA VAL A 110 14.408 -6.928 -2.563 1.00 31.40 H new ATOM 0 HB VAL A 110 11.523 -7.847 -2.679 1.00 5.21 H new ATOM 0 HG11 VAL A 110 11.387 -7.549 -0.240 1.00 45.03 H new ATOM 0 HG12 VAL A 110 12.484 -8.879 -0.683 1.00 45.03 H new ATOM 0 HG13 VAL A 110 13.149 -7.308 -0.175 1.00 45.03 H new ATOM 0 HG21 VAL A 110 11.108 -5.607 -1.743 1.00 73.33 H new ATOM 0 HG22 VAL A 110 12.859 -5.288 -1.740 1.00 73.33 H new ATOM 0 HG23 VAL A 110 12.000 -5.525 -3.281 1.00 73.33 H new ATOM 816 N LEU A 111 15.269 -9.099 -1.737 1.00 2.43 N ATOM 817 CA LEU A 111 15.817 -10.359 -1.247 1.00 2.33 C ATOM 818 C LEU A 111 15.326 -10.653 0.167 1.00 74.32 C ATOM 819 O LEU A 111 15.171 -9.745 0.983 1.00 43.40 O ATOM 820 CB LEU A 111 17.346 -10.315 -1.269 1.00 21.44 C ATOM 821 CG LEU A 111 17.997 -10.293 -2.652 1.00 23.31 C ATOM 822 CD1 LEU A 111 17.381 -11.356 -3.549 1.00 3.21 C ATOM 823 CD2 LEU A 111 17.862 -8.915 -3.283 1.00 75.53 C ATOM 0 H LEU A 111 15.843 -8.281 -1.531 1.00 2.43 H new ATOM 0 HA LEU A 111 15.473 -11.157 -1.905 1.00 2.33 H new ATOM 0 HB2 LEU A 111 17.672 -9.430 -0.722 1.00 21.44 H new ATOM 0 HB3 LEU A 111 17.722 -11.182 -0.726 1.00 21.44 H new ATOM 0 HG LEU A 111 19.058 -10.515 -2.537 1.00 23.31 H new ATOM 0 HD11 LEU A 111 17.857 -11.325 -4.529 1.00 3.21 H new ATOM 0 HD12 LEU A 111 17.531 -12.339 -3.103 1.00 3.21 H new ATOM 0 HD13 LEU A 111 16.313 -11.166 -3.658 1.00 3.21 H new ATOM 0 HD21 LEU A 111 18.331 -8.918 -4.267 1.00 75.53 H new ATOM 0 HD22 LEU A 111 16.806 -8.663 -3.385 1.00 75.53 H new ATOM 0 HD23 LEU A 111 18.352 -8.175 -2.650 1.00 75.53 H new ATOM 835 N ARG A 112 15.083 -11.929 0.450 1.00 63.14 N ATOM 836 CA ARG A 112 14.610 -12.344 1.765 1.00 43.41 C ATOM 837 C ARG A 112 15.339 -13.599 2.234 1.00 62.52 C ATOM 838 O ARG A 112 16.125 -14.187 1.490 1.00 21.24 O ATOM 839 CB ARG A 112 13.102 -12.599 1.731 1.00 44.20 C ATOM 840 CG ARG A 112 12.321 -11.534 0.979 1.00 42.13 C ATOM 841 CD ARG A 112 12.005 -11.975 -0.442 1.00 13.51 C ATOM 842 NE ARG A 112 11.215 -13.203 -0.471 1.00 12.41 N ATOM 843 CZ ARG A 112 11.741 -14.411 -0.633 1.00 63.32 C ATOM 844 NH1 ARG A 112 13.051 -14.553 -0.780 1.00 24.22 N ATOM 845 NH2 ARG A 112 10.957 -15.481 -0.649 1.00 31.44 N ATOM 0 H ARG A 112 15.206 -12.693 -0.214 1.00 63.14 H new ATOM 0 HA ARG A 112 14.819 -11.539 2.469 1.00 43.41 H new ATOM 0 HB2 ARG A 112 12.916 -13.568 1.268 1.00 44.20 H new ATOM 0 HB3 ARG A 112 12.729 -12.657 2.753 1.00 44.20 H new ATOM 0 HG2 ARG A 112 11.393 -11.319 1.509 1.00 42.13 H new ATOM 0 HG3 ARG A 112 12.896 -10.608 0.955 1.00 42.13 H new ATOM 0 HD2 ARG A 112 11.461 -11.182 -0.955 1.00 13.51 H new ATOM 0 HD3 ARG A 112 12.935 -12.129 -0.989 1.00 13.51 H new ATOM 0 HE ARG A 112 10.204 -13.128 -0.361 1.00 12.41 H new ATOM 0 HH11 ARG A 112 13.657 -13.733 -0.769 1.00 24.22 H new ATOM 0 HH12 ARG A 112 13.452 -15.482 -0.904 1.00 24.22 H new ATOM 0 HH21 ARG A 112 9.949 -15.376 -0.537 1.00 31.44 H new ATOM 0 HH22 ARG A 112 11.363 -16.409 -0.774 1.00 31.44 H new ATOM 859 N ASP A 113 15.073 -14.004 3.471 1.00 63.32 N ATOM 860 CA ASP A 113 15.703 -15.190 4.039 1.00 22.51 C ATOM 861 C ASP A 113 14.654 -16.150 4.592 1.00 24.42 C ATOM 862 O ASP A 113 13.462 -16.001 4.331 1.00 53.44 O ATOM 863 CB ASP A 113 16.683 -14.794 5.145 1.00 51.35 C ATOM 864 CG ASP A 113 18.088 -15.299 4.882 1.00 51.14 C ATOM 865 OD1 ASP A 113 18.239 -16.238 4.073 1.00 75.31 O ATOM 866 OD2 ASP A 113 19.037 -14.755 5.485 1.00 31.41 O ATOM 0 H ASP A 113 14.425 -13.528 4.099 1.00 63.32 H new ATOM 0 HA ASP A 113 16.250 -15.696 3.244 1.00 22.51 H new ATOM 0 HB2 ASP A 113 16.702 -13.708 5.238 1.00 51.35 H new ATOM 0 HB3 ASP A 113 16.330 -15.189 6.098 1.00 51.35 H new ATOM 871 N GLY A 114 15.109 -17.138 5.358 1.00 15.00 N ATOM 872 CA GLY A 114 14.197 -18.109 5.935 1.00 51.32 C ATOM 873 C GLY A 114 13.757 -17.730 7.335 1.00 23.43 C ATOM 874 O GLY A 114 13.498 -18.599 8.168 1.00 60.05 O ATOM 0 H GLY A 114 16.092 -17.283 5.589 1.00 15.00 H new ATOM 0 HA2 GLY A 114 13.320 -18.204 5.295 1.00 51.32 H new ATOM 0 HA3 GLY A 114 14.680 -19.086 5.961 1.00 51.32 H new ATOM 878 N ALA A 115 13.675 -16.430 7.597 1.00 74.01 N ATOM 879 CA ALA A 115 13.263 -15.939 8.906 1.00 3.21 C ATOM 880 C ALA A 115 12.289 -14.773 8.774 1.00 60.21 C ATOM 881 O ALA A 115 11.970 -14.103 9.755 1.00 23.44 O ATOM 882 CB ALA A 115 14.480 -15.523 9.720 1.00 53.22 C ATOM 0 H ALA A 115 13.888 -15.698 6.920 1.00 74.01 H new ATOM 0 HA ALA A 115 12.751 -16.749 9.426 1.00 3.21 H new ATOM 0 HB1 ALA A 115 14.158 -15.158 10.695 1.00 53.22 H new ATOM 0 HB2 ALA A 115 15.139 -16.381 9.853 1.00 53.22 H new ATOM 0 HB3 ALA A 115 15.015 -14.732 9.195 1.00 53.22 H new ATOM 888 N GLY A 116 11.819 -14.536 7.553 1.00 44.22 N ATOM 889 CA GLY A 116 10.887 -13.450 7.315 1.00 53.32 C ATOM 890 C GLY A 116 11.558 -12.091 7.350 1.00 71.01 C ATOM 891 O GLY A 116 10.974 -11.113 7.819 1.00 63.44 O ATOM 0 H GLY A 116 12.067 -15.077 6.725 1.00 44.22 H new ATOM 0 HA2 GLY A 116 10.410 -13.591 6.345 1.00 53.32 H new ATOM 0 HA3 GLY A 116 10.098 -13.481 8.066 1.00 53.32 H new ATOM 895 N LYS A 117 12.789 -12.028 6.854 1.00 21.14 N ATOM 896 CA LYS A 117 13.542 -10.780 6.831 1.00 40.34 C ATOM 897 C LYS A 117 13.799 -10.327 5.397 1.00 5.20 C ATOM 898 O LYS A 117 13.991 -11.149 4.501 1.00 64.10 O ATOM 899 CB LYS A 117 14.871 -10.948 7.570 1.00 3.21 C ATOM 900 CG LYS A 117 15.227 -9.767 8.457 1.00 64.20 C ATOM 901 CD LYS A 117 15.603 -10.216 9.859 1.00 24.50 C ATOM 902 CE LYS A 117 16.333 -9.119 10.619 1.00 60.41 C ATOM 903 NZ LYS A 117 15.404 -8.316 11.461 1.00 40.54 N ATOM 0 H LYS A 117 13.287 -12.828 6.462 1.00 21.14 H new ATOM 0 HA LYS A 117 12.948 -10.017 7.334 1.00 40.34 H new ATOM 0 HB2 LYS A 117 14.826 -11.850 8.181 1.00 3.21 H new ATOM 0 HB3 LYS A 117 15.667 -11.096 6.840 1.00 3.21 H new ATOM 0 HG2 LYS A 117 16.058 -9.216 8.015 1.00 64.20 H new ATOM 0 HG3 LYS A 117 14.381 -9.081 8.508 1.00 64.20 H new ATOM 0 HD2 LYS A 117 14.703 -10.501 10.404 1.00 24.50 H new ATOM 0 HD3 LYS A 117 16.235 -11.102 9.801 1.00 24.50 H new ATOM 0 HE2 LYS A 117 17.102 -9.564 11.250 1.00 60.41 H new ATOM 0 HE3 LYS A 117 16.841 -8.463 9.912 1.00 60.41 H new ATOM 0 HZ1 LYS A 117 15.774 -7.349 11.561 1.00 40.54 H new ATOM 0 HZ2 LYS A 117 14.467 -8.283 11.010 1.00 40.54 H new ATOM 0 HZ3 LYS A 117 15.320 -8.754 12.401 1.00 40.54 H new ATOM 917 N TYR A 118 13.803 -9.015 5.188 1.00 65.13 N ATOM 918 CA TYR A 118 14.037 -8.453 3.863 1.00 74.34 C ATOM 919 C TYR A 118 15.342 -7.664 3.827 1.00 31.23 C ATOM 920 O TYR A 118 15.814 -7.176 4.854 1.00 14.53 O ATOM 921 CB TYR A 118 12.871 -7.550 3.456 1.00 33.41 C ATOM 922 CG TYR A 118 11.516 -8.202 3.618 1.00 53.44 C ATOM 923 CD1 TYR A 118 11.039 -9.101 2.672 1.00 34.22 C ATOM 924 CD2 TYR A 118 10.712 -7.917 4.715 1.00 43.34 C ATOM 925 CE1 TYR A 118 9.801 -9.698 2.815 1.00 31.20 C ATOM 926 CE2 TYR A 118 9.474 -8.510 4.866 1.00 21.04 C ATOM 927 CZ TYR A 118 9.023 -9.400 3.914 1.00 53.20 C ATOM 928 OH TYR A 118 7.789 -9.992 4.061 1.00 42.21 O ATOM 0 H TYR A 118 13.647 -8.321 5.919 1.00 65.13 H new ATOM 0 HA TYR A 118 14.114 -9.278 3.155 1.00 74.34 H new ATOM 0 HB2 TYR A 118 12.901 -6.640 4.055 1.00 33.41 H new ATOM 0 HB3 TYR A 118 12.999 -7.251 2.416 1.00 33.41 H new ATOM 0 HD1 TYR A 118 11.646 -9.337 1.810 1.00 34.22 H new ATOM 0 HD2 TYR A 118 11.061 -7.220 5.462 1.00 43.34 H new ATOM 0 HE1 TYR A 118 9.445 -10.394 2.070 1.00 31.20 H new ATOM 0 HE2 TYR A 118 8.862 -8.278 5.725 1.00 21.04 H new ATOM 0 HH TYR A 118 7.371 -9.675 4.889 1.00 42.21 H new ATOM 938 N PHE A 119 15.921 -7.543 2.637 1.00 34.52 N ATOM 939 CA PHE A 119 17.172 -6.814 2.466 1.00 72.31 C ATOM 940 C PHE A 119 17.505 -6.646 0.986 1.00 22.24 C ATOM 941 O PHE A 119 16.951 -7.337 0.131 1.00 73.22 O ATOM 942 CB PHE A 119 18.313 -7.543 3.178 1.00 62.31 C ATOM 943 CG PHE A 119 18.104 -9.027 3.283 1.00 52.14 C ATOM 944 CD1 PHE A 119 17.646 -9.754 2.196 1.00 54.33 C ATOM 945 CD2 PHE A 119 18.365 -9.695 4.468 1.00 13.34 C ATOM 946 CE1 PHE A 119 17.452 -11.119 2.289 1.00 61.25 C ATOM 947 CE2 PHE A 119 18.174 -11.060 4.567 1.00 14.10 C ATOM 948 CZ PHE A 119 17.716 -11.773 3.476 1.00 14.12 C ATOM 0 H PHE A 119 15.544 -7.941 1.777 1.00 34.52 H new ATOM 0 HA PHE A 119 17.051 -5.825 2.908 1.00 72.31 H new ATOM 0 HB2 PHE A 119 19.244 -7.352 2.644 1.00 62.31 H new ATOM 0 HB3 PHE A 119 18.429 -7.129 4.180 1.00 62.31 H new ATOM 0 HD1 PHE A 119 17.438 -9.248 1.265 1.00 54.33 H new ATOM 0 HD2 PHE A 119 18.722 -9.143 5.325 1.00 13.34 H new ATOM 0 HE1 PHE A 119 17.094 -11.674 1.434 1.00 61.25 H new ATOM 0 HE2 PHE A 119 18.383 -11.569 5.496 1.00 14.10 H new ATOM 0 HZ PHE A 119 17.565 -12.840 3.551 1.00 14.12 H new ATOM 958 N LEU A 120 18.414 -5.723 0.692 1.00 21.13 N ATOM 959 CA LEU A 120 18.822 -5.462 -0.684 1.00 23.42 C ATOM 960 C LEU A 120 20.285 -5.034 -0.746 1.00 60.30 C ATOM 961 O LEU A 120 21.179 -5.866 -0.900 1.00 23.10 O ATOM 962 CB LEU A 120 17.936 -4.381 -1.303 1.00 53.24 C ATOM 963 CG LEU A 120 16.488 -4.782 -1.591 1.00 25.45 C ATOM 964 CD1 LEU A 120 15.571 -4.308 -0.474 1.00 43.32 C ATOM 965 CD2 LEU A 120 16.035 -4.221 -2.931 1.00 22.55 C ATOM 0 H LEU A 120 18.883 -5.143 1.388 1.00 21.13 H new ATOM 0 HA LEU A 120 18.708 -6.385 -1.252 1.00 23.42 H new ATOM 0 HB2 LEU A 120 17.927 -3.520 -0.635 1.00 53.24 H new ATOM 0 HB3 LEU A 120 18.394 -4.055 -2.237 1.00 53.24 H new ATOM 0 HG LEU A 120 16.435 -5.870 -1.640 1.00 25.45 H new ATOM 0 HD11 LEU A 120 14.545 -4.602 -0.696 1.00 43.32 H new ATOM 0 HD12 LEU A 120 15.882 -4.759 0.468 1.00 43.32 H new ATOM 0 HD13 LEU A 120 15.628 -3.223 -0.393 1.00 43.32 H new ATOM 0 HD21 LEU A 120 15.003 -4.516 -3.119 1.00 22.55 H new ATOM 0 HD22 LEU A 120 16.103 -3.133 -2.912 1.00 22.55 H new ATOM 0 HD23 LEU A 120 16.674 -4.611 -3.723 1.00 22.55 H new ATOM 977 N TRP A 121 20.521 -3.733 -0.623 1.00 74.13 N ATOM 978 CA TRP A 121 21.876 -3.195 -0.664 1.00 14.25 C ATOM 979 C TRP A 121 22.588 -3.415 0.666 1.00 4.12 C ATOM 980 O TRP A 121 22.375 -4.425 1.336 1.00 31.24 O ATOM 981 CB TRP A 121 21.844 -1.703 -0.999 1.00 10.25 C ATOM 982 CG TRP A 121 20.914 -1.367 -2.125 1.00 44.41 C ATOM 983 CD1 TRP A 121 19.581 -1.085 -2.032 1.00 22.45 C ATOM 984 CD2 TRP A 121 21.248 -1.278 -3.515 1.00 24.45 C ATOM 985 NE1 TRP A 121 19.066 -0.828 -3.279 1.00 43.22 N ATOM 986 CE2 TRP A 121 20.069 -0.939 -4.206 1.00 11.12 C ATOM 987 CE3 TRP A 121 22.429 -1.451 -4.242 1.00 22.13 C ATOM 988 CZ2 TRP A 121 20.039 -0.771 -5.588 1.00 14.24 C ATOM 989 CZ3 TRP A 121 22.397 -1.284 -5.613 1.00 63.21 C ATOM 990 CH2 TRP A 121 21.209 -0.946 -6.274 1.00 61.14 C ATOM 0 H TRP A 121 19.792 -3.031 -0.494 1.00 74.13 H new ATOM 0 HA TRP A 121 22.427 -3.723 -1.442 1.00 14.25 H new ATOM 0 HB2 TRP A 121 21.545 -1.145 -0.112 1.00 10.25 H new ATOM 0 HB3 TRP A 121 22.850 -1.374 -1.258 1.00 10.25 H new ATOM 0 HD1 TRP A 121 19.015 -1.067 -1.113 1.00 22.45 H new ATOM 0 HE1 TRP A 121 18.095 -0.593 -3.482 1.00 43.22 H new ATOM 0 HE3 TRP A 121 23.350 -1.711 -3.741 1.00 22.13 H new ATOM 0 HZ2 TRP A 121 19.124 -0.512 -6.100 1.00 14.24 H new ATOM 0 HZ3 TRP A 121 23.303 -1.416 -6.185 1.00 63.21 H new ATOM 0 HH2 TRP A 121 21.217 -0.821 -7.347 1.00 61.14 H new ATOM 1001 N VAL A 122 23.436 -2.463 1.043 1.00 1.11 N ATOM 1002 CA VAL A 122 24.180 -2.553 2.294 1.00 15.42 C ATOM 1003 C VAL A 122 23.288 -2.230 3.488 1.00 74.12 C ATOM 1004 O VAL A 122 23.670 -1.467 4.374 1.00 3.53 O ATOM 1005 CB VAL A 122 25.389 -1.599 2.298 1.00 13.43 C ATOM 1006 CG1 VAL A 122 26.349 -1.948 1.172 1.00 72.44 C ATOM 1007 CG2 VAL A 122 24.927 -0.153 2.187 1.00 71.40 C ATOM 0 H VAL A 122 23.625 -1.621 0.500 1.00 1.11 H new ATOM 0 HA VAL A 122 24.537 -3.580 2.377 1.00 15.42 H new ATOM 0 HB VAL A 122 25.919 -1.716 3.244 1.00 13.43 H new ATOM 0 HG11 VAL A 122 27.197 -1.263 1.191 1.00 72.44 H new ATOM 0 HG12 VAL A 122 26.705 -2.970 1.301 1.00 72.44 H new ATOM 0 HG13 VAL A 122 25.834 -1.862 0.215 1.00 72.44 H new ATOM 0 HG21 VAL A 122 25.794 0.507 2.191 1.00 71.40 H new ATOM 0 HG22 VAL A 122 24.373 -0.018 1.258 1.00 71.40 H new ATOM 0 HG23 VAL A 122 24.283 0.089 3.032 1.00 71.40 H new ATOM 1017 N VAL A 123 22.095 -2.818 3.504 1.00 3.35 N ATOM 1018 CA VAL A 123 21.148 -2.595 4.590 1.00 2.43 C ATOM 1019 C VAL A 123 20.063 -3.666 4.602 1.00 5.22 C ATOM 1020 O VAL A 123 19.731 -4.240 3.565 1.00 33.12 O ATOM 1021 CB VAL A 123 20.485 -1.209 4.481 1.00 52.15 C ATOM 1022 CG1 VAL A 123 19.423 -1.210 3.391 1.00 11.15 C ATOM 1023 CG2 VAL A 123 19.888 -0.797 5.818 1.00 43.21 C ATOM 0 H VAL A 123 21.762 -3.452 2.777 1.00 3.35 H new ATOM 0 HA VAL A 123 21.715 -2.646 5.520 1.00 2.43 H new ATOM 0 HB VAL A 123 21.249 -0.480 4.211 1.00 52.15 H new ATOM 0 HG11 VAL A 123 18.965 -0.223 3.328 1.00 11.15 H new ATOM 0 HG12 VAL A 123 19.883 -1.458 2.435 1.00 11.15 H new ATOM 0 HG13 VAL A 123 18.659 -1.950 3.628 1.00 11.15 H new ATOM 0 HG21 VAL A 123 19.424 0.185 5.722 1.00 43.21 H new ATOM 0 HG22 VAL A 123 19.136 -1.526 6.121 1.00 43.21 H new ATOM 0 HG23 VAL A 123 20.676 -0.754 6.570 1.00 43.21 H new ATOM 1033 N LYS A 124 19.514 -3.930 5.783 1.00 60.43 N ATOM 1034 CA LYS A 124 18.465 -4.932 5.931 1.00 15.45 C ATOM 1035 C LYS A 124 17.241 -4.338 6.622 1.00 33.52 C ATOM 1036 O LYS A 124 17.256 -3.184 7.051 1.00 71.41 O ATOM 1037 CB LYS A 124 18.983 -6.129 6.730 1.00 25.51 C ATOM 1038 CG LYS A 124 20.400 -6.536 6.365 1.00 65.35 C ATOM 1039 CD LYS A 124 21.169 -7.031 7.578 1.00 22.42 C ATOM 1040 CE LYS A 124 20.610 -8.349 8.093 1.00 61.14 C ATOM 1041 NZ LYS A 124 19.629 -8.143 9.194 1.00 62.21 N ATOM 0 H LYS A 124 19.778 -3.464 6.651 1.00 60.43 H new ATOM 0 HA LYS A 124 18.173 -5.267 4.936 1.00 15.45 H new ATOM 0 HB2 LYS A 124 18.945 -5.890 7.793 1.00 25.51 H new ATOM 0 HB3 LYS A 124 18.318 -6.977 6.570 1.00 25.51 H new ATOM 0 HG2 LYS A 124 20.371 -7.319 5.607 1.00 65.35 H new ATOM 0 HG3 LYS A 124 20.921 -5.686 5.925 1.00 65.35 H new ATOM 0 HD2 LYS A 124 22.220 -7.157 7.317 1.00 22.42 H new ATOM 0 HD3 LYS A 124 21.125 -6.282 8.369 1.00 22.42 H new ATOM 0 HE2 LYS A 124 20.130 -8.884 7.274 1.00 61.14 H new ATOM 0 HE3 LYS A 124 21.428 -8.976 8.448 1.00 61.14 H new ATOM 0 HZ1 LYS A 124 19.489 -9.037 9.706 1.00 62.21 H new ATOM 0 HZ2 LYS A 124 19.990 -7.421 9.850 1.00 62.21 H new ATOM 0 HZ3 LYS A 124 18.722 -7.827 8.796 1.00 62.21 H new ATOM 1055 N PHE A 125 16.182 -5.135 6.728 1.00 64.20 N ATOM 1056 CA PHE A 125 14.950 -4.689 7.367 1.00 2.24 C ATOM 1057 C PHE A 125 14.154 -5.876 7.902 1.00 1.42 C ATOM 1058 O PHE A 125 14.456 -7.028 7.595 1.00 53.12 O ATOM 1059 CB PHE A 125 14.097 -3.892 6.378 1.00 10.03 C ATOM 1060 CG PHE A 125 14.905 -3.061 5.424 1.00 42.44 C ATOM 1061 CD1 PHE A 125 15.570 -3.652 4.361 1.00 12.50 C ATOM 1062 CD2 PHE A 125 15.000 -1.688 5.588 1.00 31.13 C ATOM 1063 CE1 PHE A 125 16.315 -2.889 3.482 1.00 52.33 C ATOM 1064 CE2 PHE A 125 15.743 -0.920 4.712 1.00 62.12 C ATOM 1065 CZ PHE A 125 16.401 -1.521 3.656 1.00 34.34 C ATOM 0 H PHE A 125 16.153 -6.093 6.379 1.00 64.20 H new ATOM 0 HA PHE A 125 15.217 -4.046 8.206 1.00 2.24 H new ATOM 0 HB2 PHE A 125 13.475 -4.582 5.809 1.00 10.03 H new ATOM 0 HB3 PHE A 125 13.423 -3.240 6.934 1.00 10.03 H new ATOM 0 HD1 PHE A 125 15.505 -4.721 4.218 1.00 12.50 H new ATOM 0 HD2 PHE A 125 14.487 -1.212 6.411 1.00 31.13 H new ATOM 0 HE1 PHE A 125 16.830 -3.362 2.659 1.00 52.33 H new ATOM 0 HE2 PHE A 125 15.809 0.149 4.853 1.00 62.12 H new ATOM 0 HZ PHE A 125 16.981 -0.923 2.969 1.00 34.34 H new ATOM 1075 N ASN A 126 13.136 -5.584 8.705 1.00 0.13 N ATOM 1076 CA ASN A 126 12.296 -6.626 9.285 1.00 65.34 C ATOM 1077 C ASN A 126 11.005 -6.789 8.489 1.00 13.13 C ATOM 1078 O ASN A 126 10.559 -7.907 8.231 1.00 0.03 O ATOM 1079 CB ASN A 126 11.973 -6.297 10.743 1.00 35.33 C ATOM 1080 CG ASN A 126 13.171 -6.475 11.656 1.00 75.31 C ATOM 1081 OD1 ASN A 126 13.171 -7.334 12.538 1.00 32.00 O ATOM 1082 ND2 ASN A 126 14.199 -5.662 11.447 1.00 1.32 N ATOM 0 H ASN A 126 12.873 -4.635 8.969 1.00 0.13 H new ATOM 0 HA ASN A 126 12.846 -7.566 9.246 1.00 65.34 H new ATOM 0 HB2 ASN A 126 11.618 -5.269 10.810 1.00 35.33 H new ATOM 0 HB3 ASN A 126 11.160 -6.938 11.086 1.00 35.33 H new ATOM 0 HD21 ASN A 126 15.033 -5.735 12.029 1.00 1.32 H new ATOM 0 HD22 ASN A 126 14.155 -4.965 10.704 1.00 1.32 H new ATOM 1089 N SER A 127 10.409 -5.665 8.103 1.00 35.41 N ATOM 1090 CA SER A 127 9.166 -5.683 7.340 1.00 42.32 C ATOM 1091 C SER A 127 9.293 -4.838 6.076 1.00 43.41 C ATOM 1092 O SER A 127 10.242 -4.067 5.923 1.00 13.52 O ATOM 1093 CB SER A 127 8.009 -5.167 8.197 1.00 32.23 C ATOM 1094 OG SER A 127 6.759 -5.547 7.648 1.00 12.31 O ATOM 0 H SER A 127 10.766 -4.731 8.306 1.00 35.41 H new ATOM 0 HA SER A 127 8.962 -6.713 7.049 1.00 42.32 H new ATOM 0 HB2 SER A 127 8.099 -5.559 9.210 1.00 32.23 H new ATOM 0 HB3 SER A 127 8.063 -4.081 8.270 1.00 32.23 H new ATOM 0 HG SER A 127 6.036 -5.207 8.215 1.00 12.31 H new ATOM 1100 N LEU A 128 8.331 -4.988 5.172 1.00 25.21 N ATOM 1101 CA LEU A 128 8.334 -4.239 3.920 1.00 20.41 C ATOM 1102 C LEU A 128 8.029 -2.765 4.167 1.00 72.44 C ATOM 1103 O LEU A 128 8.810 -1.890 3.798 1.00 4.34 O ATOM 1104 CB LEU A 128 7.310 -4.829 2.949 1.00 52.54 C ATOM 1105 CG LEU A 128 7.643 -6.207 2.377 1.00 74.20 C ATOM 1106 CD1 LEU A 128 6.539 -6.678 1.443 1.00 32.40 C ATOM 1107 CD2 LEU A 128 8.980 -6.175 1.652 1.00 60.13 C ATOM 0 H LEU A 128 7.539 -5.621 5.283 1.00 25.21 H new ATOM 0 HA LEU A 128 9.328 -4.316 3.480 1.00 20.41 H new ATOM 0 HB2 LEU A 128 6.349 -4.893 3.460 1.00 52.54 H new ATOM 0 HB3 LEU A 128 7.184 -4.134 2.119 1.00 52.54 H new ATOM 0 HG LEU A 128 7.718 -6.914 3.203 1.00 74.20 H new ATOM 0 HD11 LEU A 128 6.793 -7.661 1.045 1.00 32.40 H new ATOM 0 HD12 LEU A 128 5.600 -6.741 1.992 1.00 32.40 H new ATOM 0 HD13 LEU A 128 6.432 -5.971 0.621 1.00 32.40 H new ATOM 0 HD21 LEU A 128 9.201 -7.164 1.252 1.00 60.13 H new ATOM 0 HD22 LEU A 128 8.934 -5.455 0.835 1.00 60.13 H new ATOM 0 HD23 LEU A 128 9.765 -5.883 2.349 1.00 60.13 H new ATOM 1119 N ASN A 129 6.888 -2.499 4.794 1.00 74.52 N ATOM 1120 CA ASN A 129 6.480 -1.131 5.091 1.00 33.23 C ATOM 1121 C ASN A 129 7.670 -0.297 5.555 1.00 63.32 C ATOM 1122 O ASN A 129 7.759 0.893 5.257 1.00 4.32 O ATOM 1123 CB ASN A 129 5.389 -1.124 6.164 1.00 0.13 C ATOM 1124 CG ASN A 129 5.327 0.191 6.917 1.00 42.21 C ATOM 1125 OD1 ASN A 129 4.417 0.995 6.711 1.00 23.54 O ATOM 1126 ND2 ASN A 129 6.298 0.417 7.794 1.00 22.23 N ATOM 0 H ASN A 129 6.230 -3.213 5.106 1.00 74.52 H new ATOM 0 HA ASN A 129 6.084 -0.690 4.176 1.00 33.23 H new ATOM 0 HB2 ASN A 129 4.423 -1.318 5.698 1.00 0.13 H new ATOM 0 HB3 ASN A 129 5.571 -1.935 6.869 1.00 0.13 H new ATOM 0 HD21 ASN A 129 6.310 1.285 8.329 1.00 22.23 H new ATOM 0 HD22 ASN A 129 7.032 -0.278 7.932 1.00 22.23 H new ATOM 1133 N GLU A 130 8.582 -0.932 6.284 1.00 24.24 N ATOM 1134 CA GLU A 130 9.767 -0.248 6.789 1.00 63.22 C ATOM 1135 C GLU A 130 10.641 0.245 5.639 1.00 4.24 C ATOM 1136 O GLU A 130 11.148 1.368 5.667 1.00 22.51 O ATOM 1137 CB GLU A 130 10.575 -1.180 7.694 1.00 31.53 C ATOM 1138 CG GLU A 130 10.876 -0.591 9.062 1.00 52.51 C ATOM 1139 CD GLU A 130 11.881 0.543 9.000 1.00 63.21 C ATOM 1140 OE1 GLU A 130 12.695 0.562 8.053 1.00 70.14 O ATOM 1141 OE2 GLU A 130 11.855 1.410 9.898 1.00 60.20 O ATOM 0 H GLU A 130 8.523 -1.918 6.538 1.00 24.24 H new ATOM 0 HA GLU A 130 9.438 0.614 7.369 1.00 63.22 H new ATOM 0 HB2 GLU A 130 10.027 -2.113 7.822 1.00 31.53 H new ATOM 0 HB3 GLU A 130 11.514 -1.428 7.200 1.00 31.53 H new ATOM 0 HG2 GLU A 130 9.951 -0.227 9.509 1.00 52.51 H new ATOM 0 HG3 GLU A 130 11.259 -1.375 9.715 1.00 52.51 H new ATOM 1148 N LEU A 131 10.814 -0.601 4.630 1.00 22.22 N ATOM 1149 CA LEU A 131 11.627 -0.253 3.470 1.00 5.22 C ATOM 1150 C LEU A 131 10.989 0.884 2.679 1.00 74.02 C ATOM 1151 O LEU A 131 11.646 1.871 2.348 1.00 24.33 O ATOM 1152 CB LEU A 131 11.815 -1.474 2.569 1.00 62.42 C ATOM 1153 CG LEU A 131 12.856 -2.495 3.030 1.00 31.31 C ATOM 1154 CD1 LEU A 131 12.228 -3.508 3.975 1.00 70.00 C ATOM 1155 CD2 LEU A 131 13.482 -3.196 1.833 1.00 20.44 C ATOM 0 H LEU A 131 10.402 -1.533 4.592 1.00 22.22 H new ATOM 0 HA LEU A 131 12.601 0.080 3.827 1.00 5.22 H new ATOM 0 HB2 LEU A 131 10.855 -1.982 2.474 1.00 62.42 H new ATOM 0 HB3 LEU A 131 12.092 -1.127 1.574 1.00 62.42 H new ATOM 0 HG LEU A 131 13.643 -1.966 3.568 1.00 31.31 H new ATOM 0 HD11 LEU A 131 12.984 -4.226 4.293 1.00 70.00 H new ATOM 0 HD12 LEU A 131 11.828 -2.992 4.848 1.00 70.00 H new ATOM 0 HD13 LEU A 131 11.421 -4.032 3.463 1.00 70.00 H new ATOM 0 HD21 LEU A 131 14.220 -3.919 2.180 1.00 20.44 H new ATOM 0 HD22 LEU A 131 12.707 -3.712 1.267 1.00 20.44 H new ATOM 0 HD23 LEU A 131 13.968 -2.459 1.193 1.00 20.44 H new ATOM 1167 N VAL A 132 9.702 0.740 2.380 1.00 75.43 N ATOM 1168 CA VAL A 132 8.972 1.756 1.630 1.00 22.51 C ATOM 1169 C VAL A 132 9.122 3.128 2.276 1.00 14.24 C ATOM 1170 O VAL A 132 9.309 4.132 1.589 1.00 51.20 O ATOM 1171 CB VAL A 132 7.475 1.409 1.526 1.00 10.41 C ATOM 1172 CG1 VAL A 132 6.711 2.541 0.855 1.00 34.43 C ATOM 1173 CG2 VAL A 132 7.282 0.103 0.771 1.00 52.12 C ATOM 0 H VAL A 132 9.143 -0.071 2.646 1.00 75.43 H new ATOM 0 HA VAL A 132 9.401 1.781 0.628 1.00 22.51 H new ATOM 0 HB VAL A 132 7.078 1.281 2.533 1.00 10.41 H new ATOM 0 HG11 VAL A 132 5.655 2.279 0.790 1.00 34.43 H new ATOM 0 HG12 VAL A 132 6.823 3.453 1.441 1.00 34.43 H new ATOM 0 HG13 VAL A 132 7.107 2.703 -0.147 1.00 34.43 H new ATOM 0 HG21 VAL A 132 6.218 -0.127 0.707 1.00 52.12 H new ATOM 0 HG22 VAL A 132 7.693 0.199 -0.234 1.00 52.12 H new ATOM 0 HG23 VAL A 132 7.796 -0.701 1.298 1.00 52.12 H new ATOM 1183 N ASP A 133 9.038 3.164 3.602 1.00 51.13 N ATOM 1184 CA ASP A 133 9.165 4.414 4.342 1.00 24.12 C ATOM 1185 C ASP A 133 10.583 4.967 4.236 1.00 63.54 C ATOM 1186 O ASP A 133 10.807 6.018 3.636 1.00 10.51 O ATOM 1187 CB ASP A 133 8.797 4.201 5.811 1.00 31.03 C ATOM 1188 CG ASP A 133 8.228 5.451 6.453 1.00 51.34 C ATOM 1189 OD1 ASP A 133 7.016 5.704 6.286 1.00 5.05 O ATOM 1190 OD2 ASP A 133 8.994 6.178 7.120 1.00 62.32 O ATOM 0 H ASP A 133 8.883 2.342 4.186 1.00 51.13 H new ATOM 0 HA ASP A 133 8.478 5.138 3.904 1.00 24.12 H new ATOM 0 HB2 ASP A 133 8.069 3.394 5.887 1.00 31.03 H new ATOM 0 HB3 ASP A 133 9.682 3.884 6.362 1.00 31.03 H new ATOM 1195 N TYR A 134 11.537 4.251 4.822 1.00 50.34 N ATOM 1196 CA TYR A 134 12.933 4.672 4.796 1.00 71.24 C ATOM 1197 C TYR A 134 13.368 5.030 3.378 1.00 54.22 C ATOM 1198 O TYR A 134 14.314 5.793 3.180 1.00 14.30 O ATOM 1199 CB TYR A 134 13.831 3.566 5.352 1.00 31.22 C ATOM 1200 CG TYR A 134 15.256 3.634 4.853 1.00 43.35 C ATOM 1201 CD1 TYR A 134 16.075 4.710 5.174 1.00 11.13 C ATOM 1202 CD2 TYR A 134 15.784 2.624 4.058 1.00 44.30 C ATOM 1203 CE1 TYR A 134 17.378 4.778 4.720 1.00 74.44 C ATOM 1204 CE2 TYR A 134 17.086 2.683 3.600 1.00 23.40 C ATOM 1205 CZ TYR A 134 17.879 3.761 3.933 1.00 11.23 C ATOM 1206 OH TYR A 134 19.176 3.824 3.478 1.00 71.32 O ATOM 0 H TYR A 134 11.369 3.377 5.320 1.00 50.34 H new ATOM 0 HA TYR A 134 13.030 5.559 5.422 1.00 71.24 H new ATOM 0 HB2 TYR A 134 13.833 3.624 6.440 1.00 31.22 H new ATOM 0 HB3 TYR A 134 13.408 2.598 5.085 1.00 31.22 H new ATOM 0 HD1 TYR A 134 15.686 5.507 5.790 1.00 11.13 H new ATOM 0 HD2 TYR A 134 15.166 1.779 3.794 1.00 44.30 H new ATOM 0 HE1 TYR A 134 18.001 5.622 4.979 1.00 74.44 H new ATOM 0 HE2 TYR A 134 17.481 1.889 2.984 1.00 23.40 H new ATOM 0 HH TYR A 134 19.372 3.030 2.939 1.00 71.32 H new ATOM 1216 N HIS A 135 12.669 4.474 2.393 1.00 31.12 N ATOM 1217 CA HIS A 135 12.981 4.735 0.992 1.00 33.24 C ATOM 1218 C HIS A 135 12.420 6.084 0.553 1.00 10.13 C ATOM 1219 O HIS A 135 13.028 6.786 -0.255 1.00 12.42 O ATOM 1220 CB HIS A 135 12.417 3.623 0.107 1.00 25.20 C ATOM 1221 CG HIS A 135 13.301 2.416 0.026 1.00 42.43 C ATOM 1222 ND1 HIS A 135 12.824 1.150 -0.240 1.00 11.33 N ATOM 1223 CD2 HIS A 135 14.640 2.288 0.175 1.00 4.30 C ATOM 1224 CE1 HIS A 135 13.831 0.295 -0.248 1.00 51.35 C ATOM 1225 NE2 HIS A 135 14.945 0.961 0.000 1.00 35.31 N ATOM 0 H HIS A 135 11.883 3.840 2.539 1.00 31.12 H new ATOM 0 HA HIS A 135 14.065 4.760 0.885 1.00 33.24 H new ATOM 0 HB2 HIS A 135 11.442 3.324 0.491 1.00 25.20 H new ATOM 0 HB3 HIS A 135 12.258 4.015 -0.898 1.00 25.20 H new ATOM 0 HD2 HIS A 135 15.339 3.082 0.391 1.00 4.30 H new ATOM 0 HE1 HIS A 135 13.756 -0.767 -0.427 1.00 51.35 H new ATOM 0 HE2 HIS A 135 15.879 0.555 0.053 1.00 35.31 H new ATOM 1233 N ARG A 136 11.257 6.440 1.090 1.00 24.55 N ATOM 1234 CA ARG A 136 10.614 7.703 0.752 1.00 2.43 C ATOM 1235 C ARG A 136 11.278 8.865 1.486 1.00 23.21 C ATOM 1236 O ARG A 136 11.176 10.017 1.066 1.00 13.42 O ATOM 1237 CB ARG A 136 9.125 7.651 1.100 1.00 43.33 C ATOM 1238 CG ARG A 136 8.804 8.190 2.484 1.00 34.01 C ATOM 1239 CD ARG A 136 7.320 8.074 2.796 1.00 31.53 C ATOM 1240 NE ARG A 136 6.700 9.380 3.001 1.00 35.34 N ATOM 1241 CZ ARG A 136 6.746 10.043 4.151 1.00 21.03 C ATOM 1242 NH1 ARG A 136 7.381 9.525 5.194 1.00 40.32 N ATOM 1243 NH2 ARG A 136 6.157 11.227 4.260 1.00 1.00 N ATOM 0 H ARG A 136 10.741 5.871 1.761 1.00 24.55 H new ATOM 0 HA ARG A 136 10.725 7.862 -0.321 1.00 2.43 H new ATOM 0 HB2 ARG A 136 8.567 8.223 0.358 1.00 43.33 H new ATOM 0 HB3 ARG A 136 8.781 6.619 1.032 1.00 43.33 H new ATOM 0 HG2 ARG A 136 9.378 7.642 3.231 1.00 34.01 H new ATOM 0 HG3 ARG A 136 9.110 9.234 2.549 1.00 34.01 H new ATOM 0 HD2 ARG A 136 6.817 7.558 1.978 1.00 31.53 H new ATOM 0 HD3 ARG A 136 7.184 7.464 3.689 1.00 31.53 H new ATOM 0 HE ARG A 136 6.204 9.807 2.218 1.00 35.34 H new ATOM 0 HH11 ARG A 136 7.836 8.615 5.114 1.00 40.32 H new ATOM 0 HH12 ARG A 136 7.415 10.036 6.076 1.00 40.32 H new ATOM 0 HH21 ARG A 136 5.668 11.629 3.460 1.00 1.00 H new ATOM 0 HH22 ARG A 136 6.193 11.735 5.144 1.00 1.00 H new ATOM 1257 N SER A 137 11.959 8.553 2.585 1.00 74.45 N ATOM 1258 CA SER A 137 12.636 9.570 3.379 1.00 12.54 C ATOM 1259 C SER A 137 14.061 9.790 2.880 1.00 13.43 C ATOM 1260 O SER A 137 14.605 10.890 2.983 1.00 0.40 O ATOM 1261 CB SER A 137 12.657 9.165 4.854 1.00 11.35 C ATOM 1262 OG SER A 137 12.857 10.292 5.690 1.00 13.31 O ATOM 0 H SER A 137 12.056 7.604 2.945 1.00 74.45 H new ATOM 0 HA SER A 137 12.085 10.504 3.274 1.00 12.54 H new ATOM 0 HB2 SER A 137 11.717 8.678 5.114 1.00 11.35 H new ATOM 0 HB3 SER A 137 13.451 8.437 5.023 1.00 11.35 H new ATOM 0 HG SER A 137 12.865 10.007 6.627 1.00 13.31 H new ATOM 1268 N THR A 138 14.661 8.735 2.339 1.00 51.05 N ATOM 1269 CA THR A 138 16.022 8.811 1.824 1.00 24.41 C ATOM 1270 C THR A 138 16.079 8.401 0.357 1.00 43.21 C ATOM 1271 O THR A 138 15.308 7.553 -0.091 1.00 54.43 O ATOM 1272 CB THR A 138 16.979 7.914 2.633 1.00 40.21 C ATOM 1273 OG1 THR A 138 17.308 8.545 3.876 1.00 62.14 O ATOM 1274 CG2 THR A 138 18.252 7.634 1.848 1.00 54.02 C ATOM 0 H THR A 138 14.226 7.817 2.246 1.00 51.05 H new ATOM 0 HA THR A 138 16.339 9.849 1.921 1.00 24.41 H new ATOM 0 HB THR A 138 16.476 6.967 2.828 1.00 40.21 H new ATOM 0 HG1 THR A 138 17.915 7.968 4.385 1.00 62.14 H new ATOM 0 HG21 THR A 138 18.912 6.999 2.439 1.00 54.02 H new ATOM 0 HG22 THR A 138 18.001 7.128 0.916 1.00 54.02 H new ATOM 0 HG23 THR A 138 18.757 8.574 1.626 1.00 54.02 H new ATOM 1282 N SER A 139 16.999 9.008 -0.387 1.00 14.31 N ATOM 1283 CA SER A 139 17.154 8.709 -1.806 1.00 31.35 C ATOM 1284 C SER A 139 17.040 7.209 -2.060 1.00 32.34 C ATOM 1285 O SER A 139 17.213 6.398 -1.149 1.00 50.13 O ATOM 1286 CB SER A 139 18.503 9.222 -2.312 1.00 42.11 C ATOM 1287 OG SER A 139 19.575 8.623 -1.605 1.00 20.41 O ATOM 0 H SER A 139 17.648 9.710 -0.031 1.00 14.31 H new ATOM 0 HA SER A 139 16.355 9.214 -2.348 1.00 31.35 H new ATOM 0 HB2 SER A 139 18.601 9.008 -3.376 1.00 42.11 H new ATOM 0 HB3 SER A 139 18.549 10.305 -2.199 1.00 42.11 H new ATOM 0 HG SER A 139 20.426 8.967 -1.949 1.00 20.41 H new ATOM 1293 N VAL A 140 16.747 6.846 -3.305 1.00 11.34 N ATOM 1294 CA VAL A 140 16.610 5.444 -3.681 1.00 2.34 C ATOM 1295 C VAL A 140 17.211 5.183 -5.057 1.00 44.41 C ATOM 1296 O VAL A 140 17.790 4.125 -5.303 1.00 1.13 O ATOM 1297 CB VAL A 140 15.134 5.006 -3.686 1.00 33.11 C ATOM 1298 CG1 VAL A 140 14.542 5.105 -2.288 1.00 61.11 C ATOM 1299 CG2 VAL A 140 14.334 5.842 -4.673 1.00 14.41 C ATOM 0 H VAL A 140 16.600 7.504 -4.070 1.00 11.34 H new ATOM 0 HA VAL A 140 17.151 4.862 -2.935 1.00 2.34 H new ATOM 0 HB VAL A 140 15.084 3.964 -4.002 1.00 33.11 H new ATOM 0 HG11 VAL A 140 13.498 4.791 -2.312 1.00 61.11 H new ATOM 0 HG12 VAL A 140 15.100 4.459 -1.610 1.00 61.11 H new ATOM 0 HG13 VAL A 140 14.603 6.136 -1.939 1.00 61.11 H new ATOM 0 HG21 VAL A 140 13.293 5.519 -4.664 1.00 14.41 H new ATOM 0 HG22 VAL A 140 14.390 6.893 -4.389 1.00 14.41 H new ATOM 0 HG23 VAL A 140 14.744 5.714 -5.675 1.00 14.41 H new ATOM 1309 N SER A 141 17.071 6.156 -5.952 1.00 73.12 N ATOM 1310 CA SER A 141 17.597 6.031 -7.306 1.00 61.53 C ATOM 1311 C SER A 141 19.068 6.433 -7.357 1.00 13.41 C ATOM 1312 O SER A 141 19.485 7.384 -6.695 1.00 24.41 O ATOM 1313 CB SER A 141 16.786 6.895 -8.274 1.00 2.15 C ATOM 1314 OG SER A 141 17.267 8.228 -8.292 1.00 65.24 O ATOM 0 H SER A 141 16.598 7.040 -5.764 1.00 73.12 H new ATOM 0 HA SER A 141 17.513 4.987 -7.606 1.00 61.53 H new ATOM 0 HB2 SER A 141 16.840 6.472 -9.277 1.00 2.15 H new ATOM 0 HB3 SER A 141 15.736 6.888 -7.981 1.00 2.15 H new ATOM 0 HG SER A 141 17.540 8.489 -7.388 1.00 65.24 H new ATOM 1320 N ARG A 142 19.848 5.703 -8.147 1.00 52.43 N ATOM 1321 CA ARG A 142 21.272 5.983 -8.284 1.00 62.22 C ATOM 1322 C ARG A 142 21.532 6.915 -9.464 1.00 24.01 C ATOM 1323 O ARG A 142 22.640 6.963 -9.997 1.00 2.44 O ATOM 1324 CB ARG A 142 22.054 4.681 -8.467 1.00 73.54 C ATOM 1325 CG ARG A 142 21.585 3.556 -7.558 1.00 43.04 C ATOM 1326 CD ARG A 142 22.686 3.112 -6.608 1.00 45.42 C ATOM 1327 NE ARG A 142 22.814 4.008 -5.462 1.00 0.21 N ATOM 1328 CZ ARG A 142 23.686 3.822 -4.477 1.00 34.21 C ATOM 1329 NH1 ARG A 142 24.502 2.778 -4.499 1.00 24.42 N ATOM 1330 NH2 ARG A 142 23.742 4.681 -3.468 1.00 13.25 N ATOM 0 H ARG A 142 19.518 4.913 -8.702 1.00 52.43 H new ATOM 0 HA ARG A 142 21.609 6.476 -7.372 1.00 62.22 H new ATOM 0 HB2 ARG A 142 21.968 4.358 -9.505 1.00 73.54 H new ATOM 0 HB3 ARG A 142 23.111 4.872 -8.279 1.00 73.54 H new ATOM 0 HG2 ARG A 142 20.719 3.887 -6.984 1.00 43.04 H new ATOM 0 HG3 ARG A 142 21.261 2.709 -8.163 1.00 43.04 H new ATOM 0 HD2 ARG A 142 22.476 2.102 -6.257 1.00 45.42 H new ATOM 0 HD3 ARG A 142 23.634 3.072 -7.145 1.00 45.42 H new ATOM 0 HE ARG A 142 22.200 4.821 -5.415 1.00 0.21 H new ATOM 0 HH11 ARG A 142 24.461 2.115 -5.273 1.00 24.42 H new ATOM 0 HH12 ARG A 142 25.171 2.637 -3.742 1.00 24.42 H new ATOM 0 HH21 ARG A 142 23.115 5.485 -3.448 1.00 13.25 H new ATOM 0 HH22 ARG A 142 24.412 4.537 -2.712 1.00 13.25 H new ATOM 1344 N ASN A 143 20.503 7.653 -9.866 1.00 50.05 N ATOM 1345 CA ASN A 143 20.620 8.583 -10.984 1.00 10.02 C ATOM 1346 C ASN A 143 20.281 10.005 -10.546 1.00 25.21 C ATOM 1347 O ASN A 143 21.070 10.929 -10.743 1.00 54.14 O ATOM 1348 CB ASN A 143 19.698 8.157 -12.128 1.00 30.30 C ATOM 1349 CG ASN A 143 20.421 7.334 -13.177 1.00 33.32 C ATOM 1350 OD1 ASN A 143 20.159 6.141 -13.335 1.00 3.04 O ATOM 1351 ND2 ASN A 143 21.336 7.969 -13.900 1.00 32.22 N ATOM 0 H ASN A 143 19.579 7.626 -9.435 1.00 50.05 H new ATOM 0 HA ASN A 143 21.653 8.565 -11.333 1.00 10.02 H new ATOM 0 HB2 ASN A 143 18.867 7.578 -11.725 1.00 30.30 H new ATOM 0 HB3 ASN A 143 19.271 9.044 -12.596 1.00 30.30 H new ATOM 0 HD21 ASN A 143 21.855 7.467 -14.621 1.00 32.22 H new ATOM 0 HD22 ASN A 143 21.520 8.958 -13.735 1.00 32.22 H new ATOM 1358 N GLN A 144 19.105 10.170 -9.950 1.00 51.44 N ATOM 1359 CA GLN A 144 18.662 11.479 -9.485 1.00 5.43 C ATOM 1360 C GLN A 144 18.239 11.422 -8.021 1.00 20.23 C ATOM 1361 O GLN A 144 18.418 10.403 -7.353 1.00 53.34 O ATOM 1362 CB GLN A 144 17.502 11.984 -10.344 1.00 42.50 C ATOM 1363 CG GLN A 144 17.886 13.122 -11.276 1.00 50.15 C ATOM 1364 CD GLN A 144 17.028 13.168 -12.525 1.00 72.23 C ATOM 1365 OE1 GLN A 144 15.802 13.256 -12.447 1.00 61.34 O ATOM 1366 NE2 GLN A 144 17.669 13.108 -13.687 1.00 13.42 N ATOM 0 H GLN A 144 18.442 9.414 -9.778 1.00 51.44 H new ATOM 0 HA GLN A 144 19.499 12.171 -9.576 1.00 5.43 H new ATOM 0 HB2 GLN A 144 17.112 11.156 -10.936 1.00 42.50 H new ATOM 0 HB3 GLN A 144 16.695 12.317 -9.691 1.00 42.50 H new ATOM 0 HG2 GLN A 144 17.797 14.069 -10.743 1.00 50.15 H new ATOM 0 HG3 GLN A 144 18.932 13.015 -11.562 1.00 50.15 H new ATOM 0 HE21 GLN A 144 18.686 13.036 -13.705 1.00 13.42 H new ATOM 0 HE22 GLN A 144 17.144 13.134 -14.561 1.00 13.42 H new ATOM 1375 N GLN A 145 17.678 12.521 -7.528 1.00 52.54 N ATOM 1376 CA GLN A 145 17.230 12.595 -6.143 1.00 2.43 C ATOM 1377 C GLN A 145 15.707 12.621 -6.063 1.00 64.51 C ATOM 1378 O GLN A 145 15.094 13.688 -6.056 1.00 3.44 O ATOM 1379 CB GLN A 145 17.809 13.838 -5.463 1.00 72.33 C ATOM 1380 CG GLN A 145 19.221 13.640 -4.935 1.00 54.51 C ATOM 1381 CD GLN A 145 19.579 14.629 -3.843 1.00 54.32 C ATOM 1382 OE1 GLN A 145 18.826 14.814 -2.886 1.00 41.42 O ATOM 1383 NE2 GLN A 145 20.733 15.271 -3.981 1.00 10.04 N ATOM 0 H GLN A 145 17.523 13.373 -8.067 1.00 52.54 H new ATOM 0 HA GLN A 145 17.588 11.705 -5.625 1.00 2.43 H new ATOM 0 HB2 GLN A 145 17.808 14.664 -6.174 1.00 72.33 H new ATOM 0 HB3 GLN A 145 17.158 14.127 -4.638 1.00 72.33 H new ATOM 0 HG2 GLN A 145 19.322 12.626 -4.549 1.00 54.51 H new ATOM 0 HG3 GLN A 145 19.930 13.740 -5.757 1.00 54.51 H new ATOM 0 HE21 GLN A 145 21.326 15.086 -4.790 1.00 10.04 H new ATOM 0 HE22 GLN A 145 21.027 15.949 -3.278 1.00 10.04 H new ATOM 1392 N ILE A 146 15.103 11.439 -6.004 1.00 64.54 N ATOM 1393 CA ILE A 146 13.652 11.326 -5.925 1.00 23.22 C ATOM 1394 C ILE A 146 13.235 10.376 -4.807 1.00 2.21 C ATOM 1395 O ILE A 146 14.046 9.597 -4.305 1.00 13.44 O ATOM 1396 CB ILE A 146 13.052 10.831 -7.254 1.00 63.01 C ATOM 1397 CG1 ILE A 146 13.618 11.637 -8.425 1.00 73.14 C ATOM 1398 CG2 ILE A 146 11.535 10.930 -7.220 1.00 15.15 C ATOM 1399 CD1 ILE A 146 13.434 10.963 -9.767 1.00 71.11 C ATOM 0 H ILE A 146 15.596 10.546 -6.009 1.00 64.54 H new ATOM 0 HA ILE A 146 13.269 12.324 -5.713 1.00 23.22 H new ATOM 0 HB ILE A 146 13.325 9.785 -7.392 1.00 63.01 H new ATOM 0 HG12 ILE A 146 13.136 12.615 -8.449 1.00 73.14 H new ATOM 0 HG13 ILE A 146 14.681 11.810 -8.257 1.00 73.14 H new ATOM 0 HG21 ILE A 146 11.126 10.576 -8.166 1.00 15.15 H new ATOM 0 HG22 ILE A 146 11.149 10.317 -6.406 1.00 15.15 H new ATOM 0 HG23 ILE A 146 11.242 11.968 -7.063 1.00 15.15 H new ATOM 0 HD11 ILE A 146 13.859 11.591 -10.551 1.00 71.11 H new ATOM 0 HD12 ILE A 146 13.940 9.997 -9.762 1.00 71.11 H new ATOM 0 HD13 ILE A 146 12.371 10.815 -9.957 1.00 71.11 H new ATOM 1411 N PHE A 147 11.965 10.445 -4.423 1.00 31.01 N ATOM 1412 CA PHE A 147 11.439 9.591 -3.365 1.00 32.44 C ATOM 1413 C PHE A 147 10.255 8.769 -3.867 1.00 23.11 C ATOM 1414 O PHE A 147 9.788 8.955 -4.991 1.00 62.24 O ATOM 1415 CB PHE A 147 11.014 10.436 -2.162 1.00 33.41 C ATOM 1416 CG PHE A 147 12.144 11.206 -1.541 1.00 53.23 C ATOM 1417 CD1 PHE A 147 13.366 10.598 -1.303 1.00 51.54 C ATOM 1418 CD2 PHE A 147 11.983 12.538 -1.195 1.00 45.32 C ATOM 1419 CE1 PHE A 147 14.408 11.305 -0.733 1.00 20.13 C ATOM 1420 CE2 PHE A 147 13.022 13.250 -0.625 1.00 20.22 C ATOM 1421 CZ PHE A 147 14.235 12.632 -0.392 1.00 43.11 C ATOM 0 H PHE A 147 11.281 11.084 -4.829 1.00 31.01 H new ATOM 0 HA PHE A 147 12.230 8.907 -3.058 1.00 32.44 H new ATOM 0 HB2 PHE A 147 10.238 11.134 -2.475 1.00 33.41 H new ATOM 0 HB3 PHE A 147 10.572 9.784 -1.408 1.00 33.41 H new ATOM 0 HD1 PHE A 147 13.506 9.560 -1.566 1.00 51.54 H new ATOM 0 HD2 PHE A 147 11.036 13.025 -1.372 1.00 45.32 H new ATOM 0 HE1 PHE A 147 15.356 10.820 -0.555 1.00 20.13 H new ATOM 0 HE2 PHE A 147 12.885 14.289 -0.362 1.00 20.22 H new ATOM 0 HZ PHE A 147 15.047 13.186 0.056 1.00 43.11 H new ATOM 1431 N LEU A 148 9.775 7.859 -3.026 1.00 42.31 N ATOM 1432 CA LEU A 148 8.646 7.007 -3.384 1.00 2.44 C ATOM 1433 C LEU A 148 7.323 7.718 -3.119 1.00 53.13 C ATOM 1434 O LEU A 148 6.933 7.918 -1.969 1.00 2.42 O ATOM 1435 CB LEU A 148 8.701 5.697 -2.596 1.00 11.44 C ATOM 1436 CG LEU A 148 10.009 4.911 -2.690 1.00 41.41 C ATOM 1437 CD1 LEU A 148 9.974 3.704 -1.767 1.00 20.43 C ATOM 1438 CD2 LEU A 148 10.270 4.480 -4.126 1.00 34.01 C ATOM 0 H LEU A 148 10.150 7.692 -2.092 1.00 42.31 H new ATOM 0 HA LEU A 148 8.712 6.786 -4.449 1.00 2.44 H new ATOM 0 HB2 LEU A 148 8.509 5.919 -1.546 1.00 11.44 H new ATOM 0 HB3 LEU A 148 7.890 5.055 -2.940 1.00 11.44 H new ATOM 0 HG LEU A 148 10.825 5.561 -2.373 1.00 41.41 H new ATOM 0 HD11 LEU A 148 10.913 3.157 -1.848 1.00 20.43 H new ATOM 0 HD12 LEU A 148 9.835 4.037 -0.738 1.00 20.43 H new ATOM 0 HD13 LEU A 148 9.149 3.052 -2.052 1.00 20.43 H new ATOM 0 HD21 LEU A 148 11.205 3.922 -4.174 1.00 34.01 H new ATOM 0 HD22 LEU A 148 9.452 3.848 -4.471 1.00 34.01 H new ATOM 0 HD23 LEU A 148 10.340 5.361 -4.763 1.00 34.01 H new ATOM 1450 N ARG A 149 6.635 8.095 -4.192 1.00 51.12 N ATOM 1451 CA ARG A 149 5.354 8.783 -4.076 1.00 65.53 C ATOM 1452 C ARG A 149 4.229 7.792 -3.793 1.00 61.55 C ATOM 1453 O ARG A 149 4.181 6.708 -4.377 1.00 2.42 O ATOM 1454 CB ARG A 149 5.052 9.562 -5.357 1.00 41.03 C ATOM 1455 CG ARG A 149 5.903 10.810 -5.526 1.00 41.11 C ATOM 1456 CD ARG A 149 5.300 11.999 -4.794 1.00 23.45 C ATOM 1457 NE ARG A 149 5.612 13.264 -5.453 1.00 65.30 N ATOM 1458 CZ ARG A 149 5.360 14.453 -4.918 1.00 51.13 C ATOM 1459 NH1 ARG A 149 4.795 14.539 -3.722 1.00 13.30 N ATOM 1460 NH2 ARG A 149 5.673 15.560 -5.580 1.00 63.43 N ATOM 0 H ARG A 149 6.943 7.936 -5.151 1.00 51.12 H new ATOM 0 HA ARG A 149 5.419 9.481 -3.241 1.00 65.53 H new ATOM 0 HB2 ARG A 149 5.207 8.908 -6.215 1.00 41.03 H new ATOM 0 HB3 ARG A 149 4.000 9.847 -5.359 1.00 41.03 H new ATOM 0 HG2 ARG A 149 6.908 10.620 -5.148 1.00 41.11 H new ATOM 0 HG3 ARG A 149 6.000 11.045 -6.586 1.00 41.11 H new ATOM 0 HD2 ARG A 149 4.218 11.878 -4.736 1.00 23.45 H new ATOM 0 HD3 ARG A 149 5.674 12.022 -3.770 1.00 23.45 H new ATOM 0 HE ARG A 149 6.047 13.233 -6.375 1.00 65.30 H new ATOM 0 HH11 ARG A 149 4.553 13.691 -3.210 1.00 13.30 H new ATOM 0 HH12 ARG A 149 4.603 15.454 -3.313 1.00 13.30 H new ATOM 0 HH21 ARG A 149 6.108 15.498 -6.501 1.00 63.43 H new ATOM 0 HH22 ARG A 149 5.479 16.473 -5.168 1.00 63.43 H new ATOM 1474 N ASP A 150 3.327 8.170 -2.895 1.00 73.10 N ATOM 1475 CA ASP A 150 2.201 7.315 -2.535 1.00 3.20 C ATOM 1476 C ASP A 150 1.307 7.057 -3.743 1.00 71.34 C ATOM 1477 O ASP A 150 0.622 7.960 -4.226 1.00 25.44 O ATOM 1478 CB ASP A 150 1.387 7.955 -1.410 1.00 11.24 C ATOM 1479 CG ASP A 150 0.384 6.994 -0.802 1.00 53.43 C ATOM 1480 OD1 ASP A 150 0.740 5.815 -0.599 1.00 42.21 O ATOM 1481 OD2 ASP A 150 -0.758 7.421 -0.531 1.00 53.41 O ATOM 0 H ASP A 150 3.353 9.063 -2.402 1.00 73.10 H new ATOM 0 HA ASP A 150 2.597 6.361 -2.189 1.00 3.20 H new ATOM 0 HB2 ASP A 150 2.064 8.310 -0.632 1.00 11.24 H new ATOM 0 HB3 ASP A 150 0.861 8.828 -1.797 1.00 11.24 H new ATOM 1486 N ILE A 151 1.319 5.819 -4.228 1.00 13.52 N ATOM 1487 CA ILE A 151 0.509 5.443 -5.380 1.00 34.14 C ATOM 1488 C ILE A 151 -0.977 5.465 -5.038 1.00 13.24 C ATOM 1489 O ILE A 151 -1.374 5.105 -3.930 1.00 12.11 O ATOM 1490 CB ILE A 151 0.884 4.042 -5.898 1.00 33.12 C ATOM 1491 CG1 ILE A 151 0.557 3.921 -7.388 1.00 35.24 C ATOM 1492 CG2 ILE A 151 0.155 2.970 -5.101 1.00 61.01 C ATOM 1493 CD1 ILE A 151 0.347 2.495 -7.846 1.00 74.31 C ATOM 0 H ILE A 151 1.880 5.060 -3.841 1.00 13.52 H new ATOM 0 HA ILE A 151 0.711 6.177 -6.161 1.00 34.14 H new ATOM 0 HB ILE A 151 1.957 3.897 -5.768 1.00 33.12 H new ATOM 0 HG12 ILE A 151 -0.342 4.499 -7.603 1.00 35.24 H new ATOM 0 HG13 ILE A 151 1.367 4.365 -7.967 1.00 35.24 H new ATOM 0 HG21 ILE A 151 0.430 1.985 -5.479 1.00 61.01 H new ATOM 0 HG22 ILE A 151 0.433 3.046 -4.050 1.00 61.01 H new ATOM 0 HG23 ILE A 151 -0.921 3.110 -5.203 1.00 61.01 H new ATOM 0 HD11 ILE A 151 0.119 2.485 -8.912 1.00 74.31 H new ATOM 0 HD12 ILE A 151 1.253 1.917 -7.663 1.00 74.31 H new ATOM 0 HD13 ILE A 151 -0.483 2.054 -7.293 1.00 74.31 H new ATOM 1505 N GLU A 152 -1.794 5.889 -5.997 1.00 63.14 N ATOM 1506 CA GLU A 152 -3.236 5.957 -5.797 1.00 75.23 C ATOM 1507 C GLU A 152 -3.860 4.565 -5.855 1.00 2.11 C ATOM 1508 O GLU A 152 -4.345 4.135 -6.901 1.00 21.43 O ATOM 1509 CB GLU A 152 -3.878 6.859 -6.853 1.00 53.22 C ATOM 1510 CG GLU A 152 -4.114 8.282 -6.376 1.00 2.31 C ATOM 1511 CD GLU A 152 -5.048 9.056 -7.286 1.00 31.20 C ATOM 1512 OE1 GLU A 152 -6.278 8.887 -7.156 1.00 14.34 O ATOM 1513 OE2 GLU A 152 -4.548 9.830 -8.129 1.00 0.13 O ATOM 0 H GLU A 152 -1.481 6.190 -6.920 1.00 63.14 H new ATOM 0 HA GLU A 152 -3.420 6.378 -4.809 1.00 75.23 H new ATOM 0 HB2 GLU A 152 -3.239 6.882 -7.736 1.00 53.22 H new ATOM 0 HB3 GLU A 152 -4.830 6.425 -7.159 1.00 53.22 H new ATOM 0 HG2 GLU A 152 -4.531 8.259 -5.369 1.00 2.31 H new ATOM 0 HG3 GLU A 152 -3.159 8.803 -6.314 1.00 2.31 H new ATOM 1520 N GLN A 153 -3.842 3.868 -4.724 1.00 25.34 N ATOM 1521 CA GLN A 153 -4.404 2.525 -4.646 1.00 25.54 C ATOM 1522 C GLN A 153 -5.906 2.547 -4.905 1.00 53.31 C ATOM 1523 O GLN A 153 -6.540 3.601 -4.852 1.00 40.44 O ATOM 1524 CB GLN A 153 -4.120 1.909 -3.274 1.00 50.03 C ATOM 1525 CG GLN A 153 -3.689 0.452 -3.338 1.00 55.54 C ATOM 1526 CD GLN A 153 -4.618 -0.465 -2.567 1.00 43.11 C ATOM 1527 OE1 GLN A 153 -5.465 -0.007 -1.800 1.00 74.31 O ATOM 1528 NE2 GLN A 153 -4.462 -1.769 -2.767 1.00 14.53 N ATOM 0 H GLN A 153 -3.445 4.211 -3.849 1.00 25.34 H new ATOM 0 HA GLN A 153 -3.930 1.915 -5.416 1.00 25.54 H new ATOM 0 HB2 GLN A 153 -3.340 2.488 -2.779 1.00 50.03 H new ATOM 0 HB3 GLN A 153 -5.015 1.988 -2.657 1.00 50.03 H new ATOM 0 HG2 GLN A 153 -3.652 0.133 -4.380 1.00 55.54 H new ATOM 0 HG3 GLN A 153 -2.679 0.358 -2.940 1.00 55.54 H new ATOM 0 HE21 GLN A 153 -3.747 -2.104 -3.412 1.00 14.53 H new ATOM 0 HE22 GLN A 153 -5.058 -2.435 -2.275 1.00 14.53 H new