USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 730 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 GLN : amide:sc= -0.356 K(o=-1.9,f=0.48) USER MOD Set 1.2: A 121 GLN : amide:sc= -1.52 K(o=-1.9,f=0.48) USER MOD Set 2.1: A 112 THR OG1 : rot 61:sc= 1.21 USER MOD Set 2.2: A 116 ASN : amide:sc= -1.27 K(o=-0.058,f=0.88) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ -116:sc= 1.2 (180deg=-0.786) USER MOD Single : A 62 GLN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : A 65 LYS NZ :NH3+ -163:sc= 1.22 (180deg=1.18) USER MOD Single : A 75 ASN : amide:sc= -1.18 K(o=-1.2,f=-4.6!) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 60:sc= -0.0101 USER MOD Single : A 81 ASN : amide:sc= 1.6 K(o=1.6,f=-0.053) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 90 HIS : no HD1:sc= -3.04! X(o=-3!,f=-3.4) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0.17 X(o=0.17,f=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.588 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 77:sc= 0.402 USER MOD Single : A 110 ASN : amide:sc= -0.0675 X(o=-0.067,f=-0.48) USER MOD Single : A 113 GLN : amide:sc= -0.221 X(o=-0.22,f=0) USER MOD Single : A 122 LYS NZ :NH3+ -163:sc= 0.851 (180deg=0.662) USER MOD Single : A 125 ASN : amide:sc= 0.0931 K(o=0.093,f=-3!) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 HIS : no HE2:sc= -0.23 K(o=-0.23,f=-3.7) USER MOD Single : A 129 GLN : amide:sc= 0.586 K(o=0.59,f=-2.8!) USER MOD Single : A 130 GLN : amide:sc= -0.267 X(o=-0.27,f=0) USER MOD Single : A 137 GLN : amide:sc= -0.297 K(o=-0.3,f=-0.89) USER MOD Single : A 141 SER OG : rot 107:sc= 0.979 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 HIS : no HD1:sc= 0.065 K(o=0.065,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 52 2.263 -16.204 -4.609 1.00 0.00 N ATOM 2 CA ALA A 52 2.342 -14.943 -5.318 1.00 0.00 C ATOM 3 C ALA A 52 1.295 -13.953 -4.798 1.00 0.00 C ATOM 4 O ALA A 52 1.215 -12.831 -5.291 1.00 0.00 O ATOM 5 CB ALA A 52 2.257 -15.179 -6.825 1.00 0.00 C ATOM 0 HA ALA A 52 3.310 -14.481 -5.126 1.00 0.00 H new ATOM 0 HB1 ALA A 52 2.317 -14.224 -7.347 1.00 0.00 H new ATOM 0 HB2 ALA A 52 3.082 -15.818 -7.140 1.00 0.00 H new ATOM 0 HB3 ALA A 52 1.311 -15.664 -7.065 1.00 0.00 H new ATOM 11 N GLU A 53 0.552 -14.313 -3.751 1.00 0.00 N ATOM 12 CA GLU A 53 -0.155 -13.366 -2.892 1.00 0.00 C ATOM 13 C GLU A 53 0.748 -12.858 -1.763 1.00 0.00 C ATOM 14 O GLU A 53 0.289 -12.363 -0.736 1.00 0.00 O ATOM 15 CB GLU A 53 -1.411 -13.963 -2.281 1.00 0.00 C ATOM 16 CG GLU A 53 -2.255 -14.841 -3.207 1.00 0.00 C ATOM 17 CD GLU A 53 -3.719 -14.848 -2.747 1.00 0.00 C ATOM 18 OE1 GLU A 53 -4.003 -14.642 -1.555 1.00 0.00 O ATOM 19 OE2 GLU A 53 -4.607 -14.898 -3.634 1.00 0.00 O ATOM 0 H GLU A 53 0.423 -15.286 -3.473 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.443 -12.536 -3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -1.122 -14.557 -1.414 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.036 -13.148 -1.916 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -2.190 -14.470 -4.230 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.863 -15.858 -3.211 1.00 0.00 H new ATOM 26 N ASN A 54 2.053 -13.029 -1.922 1.00 0.00 N ATOM 27 CA ASN A 54 3.085 -12.313 -1.198 1.00 0.00 C ATOM 28 C ASN A 54 3.919 -11.512 -2.193 1.00 0.00 C ATOM 29 O ASN A 54 5.027 -11.078 -1.879 1.00 0.00 O ATOM 30 CB ASN A 54 3.896 -13.311 -0.370 1.00 0.00 C ATOM 31 CG ASN A 54 3.247 -13.457 0.992 1.00 0.00 C ATOM 32 OD1 ASN A 54 3.663 -12.847 1.968 1.00 0.00 O ATOM 33 ND2 ASN A 54 2.178 -14.223 1.084 1.00 0.00 N ATOM 0 H ASN A 54 2.434 -13.700 -2.589 1.00 0.00 H new ATOM 0 HA ASN A 54 2.664 -11.596 -0.494 1.00 0.00 H new ATOM 0 HB2 ASN A 54 3.935 -14.276 -0.875 1.00 0.00 H new ATOM 0 HB3 ASN A 54 4.924 -12.965 -0.263 1.00 0.00 H new ATOM 0 HD21 ASN A 54 1.689 -14.312 1.975 1.00 0.00 H new ATOM 0 HD22 ASN A 54 1.840 -14.727 0.264 1.00 0.00 H new ATOM 40 N ARG A 55 3.411 -11.319 -3.418 1.00 0.00 N ATOM 41 CA ARG A 55 4.046 -10.433 -4.377 1.00 0.00 C ATOM 42 C ARG A 55 4.028 -9.004 -3.863 1.00 0.00 C ATOM 43 O ARG A 55 3.033 -8.595 -3.262 1.00 0.00 O ATOM 44 CB ARG A 55 3.296 -10.432 -5.710 1.00 0.00 C ATOM 45 CG ARG A 55 3.858 -11.424 -6.716 1.00 0.00 C ATOM 46 CD ARG A 55 3.498 -11.018 -8.150 1.00 0.00 C ATOM 47 NE ARG A 55 4.439 -9.999 -8.660 1.00 0.00 N ATOM 48 CZ ARG A 55 5.670 -10.253 -9.131 1.00 0.00 C ATOM 49 NH1 ARG A 55 6.146 -11.496 -9.157 1.00 0.00 N ATOM 50 NH2 ARG A 55 6.424 -9.250 -9.563 1.00 0.00 N ATOM 0 H ARG A 55 2.562 -11.769 -3.759 1.00 0.00 H new ATOM 0 HA ARG A 55 5.066 -10.793 -4.515 1.00 0.00 H new ATOM 0 HB2 ARG A 55 2.246 -10.664 -5.529 1.00 0.00 H new ATOM 0 HB3 ARG A 55 3.332 -9.430 -6.139 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.942 -11.479 -6.611 1.00 0.00 H new ATOM 0 HG3 ARG A 55 3.467 -12.420 -6.507 1.00 0.00 H new ATOM 0 HD2 ARG A 55 3.519 -11.895 -8.797 1.00 0.00 H new ATOM 0 HD3 ARG A 55 2.481 -10.626 -8.177 1.00 0.00 H new ATOM 0 HE ARG A 55 4.129 -9.027 -8.654 1.00 0.00 H new ATOM 0 HH11 ARG A 55 5.574 -12.269 -8.817 1.00 0.00 H new ATOM 0 HH12 ARG A 55 7.083 -11.676 -9.517 1.00 0.00 H new ATOM 0 HH21 ARG A 55 6.067 -8.295 -9.536 1.00 0.00 H new ATOM 0 HH22 ARG A 55 7.361 -9.434 -9.922 1.00 0.00 H new ATOM 64 N PRO A 56 5.025 -8.208 -4.263 1.00 0.00 N ATOM 65 CA PRO A 56 4.954 -6.778 -4.138 1.00 0.00 C ATOM 66 C PRO A 56 3.841 -6.289 -5.068 1.00 0.00 C ATOM 67 O PRO A 56 3.969 -6.343 -6.292 1.00 0.00 O ATOM 68 CB PRO A 56 6.346 -6.271 -4.502 1.00 0.00 C ATOM 69 CG PRO A 56 7.015 -7.374 -5.318 1.00 0.00 C ATOM 70 CD PRO A 56 6.134 -8.604 -5.114 1.00 0.00 C ATOM 0 HA PRO A 56 4.704 -6.412 -3.142 1.00 0.00 H new ATOM 0 HB2 PRO A 56 6.283 -5.348 -5.078 1.00 0.00 H new ATOM 0 HB3 PRO A 56 6.924 -6.049 -3.605 1.00 0.00 H new ATOM 0 HG2 PRO A 56 7.077 -7.103 -6.372 1.00 0.00 H new ATOM 0 HG3 PRO A 56 8.033 -7.556 -4.975 1.00 0.00 H new ATOM 0 HD2 PRO A 56 5.769 -8.978 -6.071 1.00 0.00 H new ATOM 0 HD3 PRO A 56 6.703 -9.411 -4.652 1.00 0.00 H new ATOM 78 N GLY A 57 2.733 -5.845 -4.484 1.00 0.00 N ATOM 79 CA GLY A 57 1.583 -5.282 -5.161 1.00 0.00 C ATOM 80 C GLY A 57 0.404 -6.242 -5.279 1.00 0.00 C ATOM 81 O GLY A 57 -0.626 -5.829 -5.810 1.00 0.00 O ATOM 0 H GLY A 57 2.612 -5.872 -3.472 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.260 -4.389 -4.626 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.881 -4.964 -6.160 1.00 0.00 H new ATOM 85 N ALA A 58 0.505 -7.491 -4.824 1.00 0.00 N ATOM 86 CA ALA A 58 -0.665 -8.361 -4.762 1.00 0.00 C ATOM 87 C ALA A 58 -1.721 -7.782 -3.786 1.00 0.00 C ATOM 88 O ALA A 58 -1.400 -6.967 -2.911 1.00 0.00 O ATOM 89 CB ALA A 58 -0.176 -9.783 -4.479 1.00 0.00 C ATOM 0 H ALA A 58 1.373 -7.917 -4.498 1.00 0.00 H new ATOM 0 HA ALA A 58 -1.204 -8.410 -5.708 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -1.030 -10.458 -4.427 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.492 -10.104 -5.278 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.359 -9.801 -3.530 1.00 0.00 H new ATOM 95 N PHE A 59 -3.001 -8.107 -4.014 1.00 0.00 N ATOM 96 CA PHE A 59 -4.152 -7.460 -3.376 1.00 0.00 C ATOM 97 C PHE A 59 -4.619 -8.313 -2.180 1.00 0.00 C ATOM 98 O PHE A 59 -5.067 -9.434 -2.414 1.00 0.00 O ATOM 99 CB PHE A 59 -5.339 -7.369 -4.368 1.00 0.00 C ATOM 100 CG PHE A 59 -5.540 -6.117 -5.212 1.00 0.00 C ATOM 101 CD1 PHE A 59 -4.524 -5.163 -5.413 1.00 0.00 C ATOM 102 CD2 PHE A 59 -6.806 -5.893 -5.795 1.00 0.00 C ATOM 103 CE1 PHE A 59 -4.777 -4.001 -6.157 1.00 0.00 C ATOM 104 CE2 PHE A 59 -7.044 -4.749 -6.578 1.00 0.00 C ATOM 105 CZ PHE A 59 -6.022 -3.812 -6.761 1.00 0.00 C ATOM 0 H PHE A 59 -3.270 -8.846 -4.664 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.849 -6.463 -3.057 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.251 -8.211 -5.055 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.253 -7.521 -3.793 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.543 -5.327 -4.991 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.600 -6.608 -5.638 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.007 -3.251 -6.263 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -8.010 -4.595 -7.035 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.196 -2.939 -7.372 1.00 0.00 H new ATOM 115 N ILE A 60 -4.642 -7.794 -0.940 1.00 0.00 N ATOM 116 CA ILE A 60 -5.160 -8.546 0.225 1.00 0.00 C ATOM 117 C ILE A 60 -6.647 -8.926 0.059 1.00 0.00 C ATOM 118 O ILE A 60 -7.020 -10.062 0.307 1.00 0.00 O ATOM 119 CB ILE A 60 -4.944 -7.779 1.561 1.00 0.00 C ATOM 120 CG1 ILE A 60 -3.471 -7.650 2.000 1.00 0.00 C ATOM 121 CG2 ILE A 60 -5.724 -8.461 2.692 1.00 0.00 C ATOM 122 CD1 ILE A 60 -3.292 -6.882 3.321 1.00 0.00 C ATOM 0 H ILE A 60 -4.309 -6.857 -0.715 1.00 0.00 H new ATOM 0 HA ILE A 60 -4.580 -9.468 0.269 1.00 0.00 H new ATOM 0 HB ILE A 60 -5.308 -6.770 1.368 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -3.043 -8.647 2.107 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -2.909 -7.144 1.215 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.566 -7.916 3.623 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.787 -8.465 2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -5.374 -9.487 2.808 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -2.232 -6.829 3.570 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -3.690 -5.873 3.212 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -3.827 -7.399 4.118 1.00 0.00 H new ATOM 134 N LYS A 61 -7.518 -7.960 -0.259 1.00 0.00 N ATOM 135 CA LYS A 61 -8.941 -8.171 -0.560 1.00 0.00 C ATOM 136 C LYS A 61 -9.708 -9.045 0.456 1.00 0.00 C ATOM 137 O LYS A 61 -10.415 -9.963 0.057 1.00 0.00 O ATOM 138 CB LYS A 61 -8.984 -8.702 -2.018 1.00 0.00 C ATOM 139 CG LYS A 61 -10.009 -8.035 -2.931 1.00 0.00 C ATOM 140 CD LYS A 61 -11.469 -8.310 -2.573 1.00 0.00 C ATOM 141 CE LYS A 61 -12.001 -9.628 -3.145 1.00 0.00 C ATOM 142 NZ LYS A 61 -11.701 -10.810 -2.319 1.00 0.00 N ATOM 0 H LYS A 61 -7.244 -6.979 -0.316 1.00 0.00 H new ATOM 0 HA LYS A 61 -9.486 -7.232 -0.466 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.995 -8.579 -2.460 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -9.190 -9.772 -1.990 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -9.843 -6.958 -2.913 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -9.833 -8.367 -3.954 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -11.572 -8.326 -1.488 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -12.085 -7.489 -2.939 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -13.081 -9.548 -3.267 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -11.579 -9.777 -4.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -11.078 -11.453 -2.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -11.227 -10.510 -1.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -12.586 -11.302 -2.083 1.00 0.00 H new ATOM 156 N GLN A 62 -9.666 -8.719 1.758 1.00 0.00 N ATOM 157 CA GLN A 62 -10.378 -9.508 2.778 1.00 0.00 C ATOM 158 C GLN A 62 -11.905 -9.346 2.757 1.00 0.00 C ATOM 159 O GLN A 62 -12.592 -10.094 3.452 1.00 0.00 O ATOM 160 CB GLN A 62 -9.900 -9.190 4.206 1.00 0.00 C ATOM 161 CG GLN A 62 -8.390 -9.311 4.382 1.00 0.00 C ATOM 162 CD GLN A 62 -7.974 -9.762 5.775 1.00 0.00 C ATOM 163 OE1 GLN A 62 -8.191 -10.918 6.138 1.00 0.00 O ATOM 164 NE2 GLN A 62 -7.332 -8.889 6.534 1.00 0.00 N ATOM 0 H GLN A 62 -9.151 -7.920 2.128 1.00 0.00 H new ATOM 0 HA GLN A 62 -10.135 -10.536 2.509 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -10.208 -8.178 4.467 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.395 -9.864 4.905 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -8.003 -10.019 3.649 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.929 -8.347 4.168 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -7.172 -7.940 6.196 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -6.997 -9.165 7.457 1.00 0.00 H new ATOM 173 N GLY A 63 -12.465 -8.365 2.047 1.00 0.00 N ATOM 174 CA GLY A 63 -13.914 -8.178 1.990 1.00 0.00 C ATOM 175 C GLY A 63 -14.448 -7.191 3.030 1.00 0.00 C ATOM 176 O GLY A 63 -15.662 -7.010 3.162 1.00 0.00 O ATOM 0 H GLY A 63 -11.934 -7.686 1.502 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -14.187 -7.827 0.995 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -14.402 -9.142 2.133 1.00 0.00 H new ATOM 180 N ARG A 64 -13.554 -6.557 3.789 1.00 0.00 N ATOM 181 CA ARG A 64 -13.903 -5.577 4.811 1.00 0.00 C ATOM 182 C ARG A 64 -14.356 -4.251 4.201 1.00 0.00 C ATOM 183 O ARG A 64 -14.176 -4.023 3.005 1.00 0.00 O ATOM 184 CB ARG A 64 -12.747 -5.373 5.787 1.00 0.00 C ATOM 185 CG ARG A 64 -11.510 -4.891 5.038 1.00 0.00 C ATOM 186 CD ARG A 64 -10.400 -4.545 6.023 1.00 0.00 C ATOM 187 NE ARG A 64 -9.930 -5.707 6.795 1.00 0.00 N ATOM 188 CZ ARG A 64 -8.964 -5.655 7.717 1.00 0.00 C ATOM 189 NH1 ARG A 64 -8.157 -4.605 7.797 1.00 0.00 N ATOM 190 NH2 ARG A 64 -8.822 -6.665 8.562 1.00 0.00 N ATOM 0 H ARG A 64 -12.550 -6.715 3.707 1.00 0.00 H new ATOM 0 HA ARG A 64 -14.751 -5.976 5.369 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -13.027 -4.645 6.548 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -12.528 -6.307 6.304 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -11.168 -5.664 4.350 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -11.758 -4.017 4.436 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -9.560 -4.115 5.478 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -10.759 -3.780 6.712 1.00 0.00 H new ATOM 0 HE ARG A 64 -10.370 -6.609 6.615 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.270 -3.825 7.150 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.424 -4.578 8.506 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -9.446 -7.470 8.504 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.089 -6.638 9.270 1.00 0.00 H new ATOM 204 N LYS A 65 -14.837 -3.345 5.055 1.00 0.00 N ATOM 205 CA LYS A 65 -14.983 -1.930 4.756 1.00 0.00 C ATOM 206 C LYS A 65 -14.088 -1.163 5.723 1.00 0.00 C ATOM 207 O LYS A 65 -14.048 -1.518 6.904 1.00 0.00 O ATOM 208 CB LYS A 65 -16.441 -1.498 4.964 1.00 0.00 C ATOM 209 CG LYS A 65 -16.766 -0.252 4.130 1.00 0.00 C ATOM 210 CD LYS A 65 -17.892 0.616 4.683 1.00 0.00 C ATOM 211 CE LYS A 65 -19.078 -0.158 5.257 1.00 0.00 C ATOM 212 NZ LYS A 65 -19.956 0.731 6.041 1.00 0.00 N ATOM 0 H LYS A 65 -15.142 -3.588 5.997 1.00 0.00 H new ATOM 0 HA LYS A 65 -14.705 -1.730 3.721 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -17.109 -2.312 4.684 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -16.616 -1.290 6.020 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -15.865 0.356 4.047 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -17.032 -0.567 3.121 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -17.485 1.260 5.463 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -18.253 1.268 3.887 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -19.646 -0.615 4.447 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.717 -0.969 5.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.576 0.159 6.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.375 1.359 6.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -20.536 1.304 5.395 1.00 0.00 H new ATOM 226 N LEU A 66 -13.389 -0.136 5.250 1.00 0.00 N ATOM 227 CA LEU A 66 -12.781 0.911 6.054 1.00 0.00 C ATOM 228 C LEU A 66 -13.621 2.187 5.894 1.00 0.00 C ATOM 229 O LEU A 66 -14.814 2.124 5.592 1.00 0.00 O ATOM 230 CB LEU A 66 -11.339 1.162 5.589 1.00 0.00 C ATOM 231 CG LEU A 66 -10.382 -0.018 5.464 1.00 0.00 C ATOM 232 CD1 LEU A 66 -10.218 -0.877 6.718 1.00 0.00 C ATOM 233 CD2 LEU A 66 -10.627 -0.893 4.257 1.00 0.00 C ATOM 0 H LEU A 66 -13.225 -0.008 4.251 1.00 0.00 H new ATOM 0 HA LEU A 66 -12.752 0.612 7.102 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.388 1.649 4.615 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.891 1.876 6.280 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.430 0.494 5.320 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -9.516 -1.686 6.516 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.838 -0.262 7.533 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.183 -1.297 7.000 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -9.903 -1.707 4.245 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.635 -1.305 4.305 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.520 -0.299 3.349 1.00 0.00 H new ATOM 245 N ASP A 67 -12.991 3.348 6.062 1.00 0.00 N ATOM 246 CA ASP A 67 -13.629 4.660 6.047 1.00 0.00 C ATOM 247 C ASP A 67 -12.774 5.667 5.265 1.00 0.00 C ATOM 248 O ASP A 67 -12.531 6.793 5.708 1.00 0.00 O ATOM 249 CB ASP A 67 -13.910 5.086 7.496 1.00 0.00 C ATOM 250 CG ASP A 67 -15.070 6.071 7.543 1.00 0.00 C ATOM 251 OD1 ASP A 67 -16.193 5.683 7.158 1.00 0.00 O ATOM 252 OD2 ASP A 67 -14.898 7.209 8.039 1.00 0.00 O ATOM 0 H ASP A 67 -11.984 3.401 6.218 1.00 0.00 H new ATOM 0 HA ASP A 67 -14.584 4.620 5.524 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -14.144 4.210 8.101 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -13.019 5.542 7.927 1.00 0.00 H new ATOM 257 N ILE A 68 -12.299 5.267 4.081 1.00 0.00 N ATOM 258 CA ILE A 68 -11.329 6.026 3.283 1.00 0.00 C ATOM 259 C ILE A 68 -12.094 7.154 2.572 1.00 0.00 C ATOM 260 O ILE A 68 -13.306 7.066 2.350 1.00 0.00 O ATOM 261 CB ILE A 68 -10.605 5.094 2.271 1.00 0.00 C ATOM 262 CG1 ILE A 68 -10.170 3.761 2.921 1.00 0.00 C ATOM 263 CG2 ILE A 68 -9.412 5.775 1.560 1.00 0.00 C ATOM 264 CD1 ILE A 68 -9.360 2.853 2.000 1.00 0.00 C ATOM 0 H ILE A 68 -12.583 4.391 3.642 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.555 6.454 3.920 1.00 0.00 H new ATOM 0 HB ILE A 68 -11.344 4.871 1.501 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.579 3.979 3.810 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -11.059 3.224 3.253 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -8.951 5.071 0.868 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -9.766 6.646 1.009 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -8.677 6.089 2.302 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -9.094 1.939 2.532 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -9.955 2.602 1.122 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -8.452 3.368 1.688 1.00 0.00 H new ATOM 276 N ASP A 69 -11.399 8.251 2.285 1.00 0.00 N ATOM 277 CA ASP A 69 -11.912 9.516 1.798 1.00 0.00 C ATOM 278 C ASP A 69 -11.676 9.630 0.289 1.00 0.00 C ATOM 279 O ASP A 69 -10.529 9.705 -0.174 1.00 0.00 O ATOM 280 CB ASP A 69 -11.250 10.655 2.597 1.00 0.00 C ATOM 281 CG ASP A 69 -9.717 10.747 2.518 1.00 0.00 C ATOM 282 OD1 ASP A 69 -9.010 9.709 2.545 1.00 0.00 O ATOM 283 OD2 ASP A 69 -9.175 11.873 2.456 1.00 0.00 O ATOM 0 H ASP A 69 -10.385 8.274 2.397 1.00 0.00 H new ATOM 0 HA ASP A 69 -12.989 9.584 1.948 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -11.667 11.601 2.252 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -11.532 10.546 3.644 1.00 0.00 H new ATOM 288 N PHE A 70 -12.763 9.609 -0.495 1.00 0.00 N ATOM 289 CA PHE A 70 -12.721 9.563 -1.954 1.00 0.00 C ATOM 290 C PHE A 70 -13.268 10.844 -2.617 1.00 0.00 C ATOM 291 O PHE A 70 -12.702 11.276 -3.626 1.00 0.00 O ATOM 292 CB PHE A 70 -13.458 8.302 -2.448 1.00 0.00 C ATOM 293 CG PHE A 70 -12.829 6.974 -2.080 1.00 0.00 C ATOM 294 CD1 PHE A 70 -11.771 6.481 -2.857 1.00 0.00 C ATOM 295 CD2 PHE A 70 -13.316 6.204 -1.006 1.00 0.00 C ATOM 296 CE1 PHE A 70 -11.147 5.272 -2.514 1.00 0.00 C ATOM 297 CE2 PHE A 70 -12.721 4.967 -0.696 1.00 0.00 C ATOM 298 CZ PHE A 70 -11.606 4.514 -1.423 1.00 0.00 C ATOM 0 H PHE A 70 -13.712 9.624 -0.121 1.00 0.00 H new ATOM 0 HA PHE A 70 -11.675 9.510 -2.256 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -14.474 8.322 -2.053 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -13.537 8.355 -3.534 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -11.435 7.034 -3.722 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -14.148 6.564 -0.419 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -10.306 4.921 -3.094 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -13.123 4.363 0.104 1.00 0.00 H new ATOM 0 HZ PHE A 70 -11.109 3.596 -1.147 1.00 0.00 H new ATOM 308 N GLY A 71 -14.350 11.456 -2.117 1.00 0.00 N ATOM 309 CA GLY A 71 -15.039 12.567 -2.789 1.00 0.00 C ATOM 310 C GLY A 71 -16.562 12.511 -2.667 1.00 0.00 C ATOM 311 O GLY A 71 -17.101 12.852 -1.611 1.00 0.00 O ATOM 0 H GLY A 71 -14.775 11.192 -1.228 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -14.684 13.509 -2.370 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -14.768 12.565 -3.845 1.00 0.00 H new ATOM 315 N ALA A 72 -17.284 12.117 -3.720 1.00 0.00 N ATOM 316 CA ALA A 72 -18.714 11.800 -3.692 1.00 0.00 C ATOM 317 C ALA A 72 -18.993 10.356 -4.134 1.00 0.00 C ATOM 318 O ALA A 72 -19.122 9.474 -3.283 1.00 0.00 O ATOM 319 CB ALA A 72 -19.512 12.834 -4.501 1.00 0.00 C ATOM 0 H ALA A 72 -16.874 12.006 -4.647 1.00 0.00 H new ATOM 0 HA ALA A 72 -19.055 11.863 -2.659 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -20.572 12.582 -4.469 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -19.362 13.825 -4.073 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -19.169 12.829 -5.536 1.00 0.00 H new ATOM 325 N GLU A 73 -19.096 10.121 -5.452 1.00 0.00 N ATOM 326 CA GLU A 73 -19.612 8.886 -6.059 1.00 0.00 C ATOM 327 C GLU A 73 -18.865 7.633 -5.605 1.00 0.00 C ATOM 328 O GLU A 73 -19.477 6.585 -5.413 1.00 0.00 O ATOM 329 CB GLU A 73 -19.669 8.979 -7.600 1.00 0.00 C ATOM 330 CG GLU A 73 -18.511 9.721 -8.285 1.00 0.00 C ATOM 331 CD GLU A 73 -18.541 9.667 -9.817 1.00 0.00 C ATOM 332 OE1 GLU A 73 -19.521 9.204 -10.441 1.00 0.00 O ATOM 333 OE2 GLU A 73 -17.570 10.174 -10.431 1.00 0.00 O ATOM 0 H GLU A 73 -18.812 10.811 -6.148 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.634 8.784 -5.693 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -19.711 7.967 -8.002 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -20.601 9.471 -7.878 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -18.528 10.764 -7.970 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -17.569 9.298 -7.937 1.00 0.00 H new ATOM 340 N GLY A 74 -17.558 7.739 -5.400 1.00 0.00 N ATOM 341 CA GLY A 74 -16.691 6.658 -4.977 1.00 0.00 C ATOM 342 C GLY A 74 -16.926 6.213 -3.537 1.00 0.00 C ATOM 343 O GLY A 74 -16.828 5.022 -3.281 1.00 0.00 O ATOM 0 H GLY A 74 -17.058 8.618 -5.531 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -16.838 5.805 -5.640 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -15.653 6.972 -5.086 1.00 0.00 H new ATOM 347 N ASN A 75 -17.281 7.109 -2.609 1.00 0.00 N ATOM 348 CA ASN A 75 -17.614 6.725 -1.231 1.00 0.00 C ATOM 349 C ASN A 75 -18.901 5.917 -1.283 1.00 0.00 C ATOM 350 O ASN A 75 -18.995 4.812 -0.758 1.00 0.00 O ATOM 351 CB ASN A 75 -17.866 7.926 -0.307 1.00 0.00 C ATOM 352 CG ASN A 75 -16.750 8.943 -0.272 1.00 0.00 C ATOM 353 OD1 ASN A 75 -15.608 8.667 0.059 1.00 0.00 O ATOM 354 ND2 ASN A 75 -17.060 10.152 -0.694 1.00 0.00 N ATOM 0 H ASN A 75 -17.345 8.111 -2.788 1.00 0.00 H new ATOM 0 HA ASN A 75 -16.766 6.171 -0.829 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -18.783 8.424 -0.623 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -18.036 7.559 0.705 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -16.341 10.873 -0.748 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -18.019 10.367 -0.967 1.00 0.00 H new ATOM 361 N ARG A 76 -19.902 6.474 -1.971 1.00 0.00 N ATOM 362 CA ARG A 76 -21.176 5.813 -2.239 1.00 0.00 C ATOM 363 C ARG A 76 -20.962 4.432 -2.875 1.00 0.00 C ATOM 364 O ARG A 76 -21.730 3.513 -2.581 1.00 0.00 O ATOM 365 CB ARG A 76 -22.027 6.736 -3.126 1.00 0.00 C ATOM 366 CG ARG A 76 -22.721 7.863 -2.337 1.00 0.00 C ATOM 367 CD ARG A 76 -24.173 7.521 -1.971 1.00 0.00 C ATOM 368 NE ARG A 76 -25.007 7.360 -3.178 1.00 0.00 N ATOM 369 CZ ARG A 76 -25.771 8.295 -3.760 1.00 0.00 C ATOM 370 NH1 ARG A 76 -25.873 9.520 -3.253 1.00 0.00 N ATOM 371 NH2 ARG A 76 -26.437 7.985 -4.871 1.00 0.00 N ATOM 0 H ARG A 76 -19.845 7.414 -2.363 1.00 0.00 H new ATOM 0 HA ARG A 76 -21.707 5.635 -1.304 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -21.393 7.177 -3.895 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -22.783 6.141 -3.639 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -22.158 8.063 -1.425 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -22.705 8.778 -2.929 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -24.196 6.602 -1.385 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -24.587 8.310 -1.343 1.00 0.00 H new ATOM 0 HE ARG A 76 -25.001 6.439 -3.616 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -25.364 9.765 -2.404 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -26.461 10.215 -3.713 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -26.361 7.048 -5.266 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -27.023 8.685 -5.326 1.00 0.00 H new ATOM 385 N TYR A 77 -19.956 4.280 -3.740 1.00 0.00 N ATOM 386 CA TYR A 77 -19.579 3.025 -4.384 1.00 0.00 C ATOM 387 C TYR A 77 -18.848 2.085 -3.420 1.00 0.00 C ATOM 388 O TYR A 77 -19.061 0.874 -3.466 1.00 0.00 O ATOM 389 CB TYR A 77 -18.667 3.325 -5.570 1.00 0.00 C ATOM 390 CG TYR A 77 -18.651 2.206 -6.577 1.00 0.00 C ATOM 391 CD1 TYR A 77 -19.711 2.114 -7.491 1.00 0.00 C ATOM 392 CD2 TYR A 77 -17.582 1.296 -6.633 1.00 0.00 C ATOM 393 CE1 TYR A 77 -19.712 1.116 -8.472 1.00 0.00 C ATOM 394 CE2 TYR A 77 -17.596 0.271 -7.596 1.00 0.00 C ATOM 395 CZ TYR A 77 -18.676 0.160 -8.500 1.00 0.00 C ATOM 396 OH TYR A 77 -18.724 -0.879 -9.369 1.00 0.00 O ATOM 0 H TYR A 77 -19.361 5.059 -4.020 1.00 0.00 H new ATOM 0 HA TYR A 77 -20.493 2.530 -4.712 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -18.997 4.243 -6.056 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -17.653 3.501 -5.210 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -20.530 2.816 -7.437 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -16.756 1.383 -5.942 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -20.504 1.078 -9.205 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -16.779 -0.433 -7.645 1.00 0.00 H new ATOM 0 HH TYR A 77 -17.929 -1.440 -9.253 1.00 0.00 H new ATOM 406 N TYR A 78 -17.971 2.614 -2.560 1.00 0.00 N ATOM 407 CA TYR A 78 -17.259 1.829 -1.566 1.00 0.00 C ATOM 408 C TYR A 78 -18.304 1.226 -0.643 1.00 0.00 C ATOM 409 O TYR A 78 -18.461 0.018 -0.656 1.00 0.00 O ATOM 410 CB TYR A 78 -16.195 2.649 -0.811 1.00 0.00 C ATOM 411 CG TYR A 78 -15.178 1.806 -0.053 1.00 0.00 C ATOM 412 CD1 TYR A 78 -14.512 0.738 -0.691 1.00 0.00 C ATOM 413 CD2 TYR A 78 -14.897 2.080 1.302 1.00 0.00 C ATOM 414 CE1 TYR A 78 -13.719 -0.150 0.058 1.00 0.00 C ATOM 415 CE2 TYR A 78 -14.049 1.236 2.041 1.00 0.00 C ATOM 416 CZ TYR A 78 -13.529 0.073 1.437 1.00 0.00 C ATOM 417 OH TYR A 78 -12.894 -0.843 2.208 1.00 0.00 O ATOM 0 H TYR A 78 -17.739 3.607 -2.540 1.00 0.00 H new ATOM 0 HA TYR A 78 -16.688 1.037 -2.051 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -15.666 3.281 -1.524 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -16.696 3.313 -0.107 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -14.611 0.602 -1.758 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -15.337 2.945 1.776 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.257 -1.000 -0.422 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -13.798 1.477 3.063 1.00 0.00 H new ATOM 0 HH TYR A 78 -11.984 -0.981 1.870 1.00 0.00 H new ATOM 427 N GLU A 79 -19.115 2.035 0.038 1.00 0.00 N ATOM 428 CA GLU A 79 -20.219 1.600 0.895 1.00 0.00 C ATOM 429 C GLU A 79 -21.123 0.566 0.207 1.00 0.00 C ATOM 430 O GLU A 79 -21.646 -0.345 0.860 1.00 0.00 O ATOM 431 CB GLU A 79 -21.056 2.831 1.247 1.00 0.00 C ATOM 432 CG GLU A 79 -20.348 3.798 2.201 1.00 0.00 C ATOM 433 CD GLU A 79 -20.133 3.214 3.606 1.00 0.00 C ATOM 434 OE1 GLU A 79 -20.950 2.394 4.073 1.00 0.00 O ATOM 435 OE2 GLU A 79 -19.097 3.524 4.237 1.00 0.00 O ATOM 0 H GLU A 79 -19.018 3.050 0.007 1.00 0.00 H new ATOM 0 HA GLU A 79 -19.798 1.127 1.782 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -21.313 3.361 0.330 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -21.993 2.506 1.700 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -19.382 4.074 1.778 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -20.934 4.714 2.281 1.00 0.00 H new ATOM 442 N ALA A 80 -21.290 0.684 -1.113 1.00 0.00 N ATOM 443 CA ALA A 80 -22.066 -0.273 -1.884 1.00 0.00 C ATOM 444 C ALA A 80 -21.430 -1.653 -2.006 1.00 0.00 C ATOM 445 O ALA A 80 -22.142 -2.656 -1.904 1.00 0.00 O ATOM 446 CB ALA A 80 -22.370 0.265 -3.295 1.00 0.00 C ATOM 0 H ALA A 80 -20.892 1.442 -1.668 1.00 0.00 H new ATOM 0 HA ALA A 80 -22.987 -0.398 -1.315 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -22.952 -0.473 -3.848 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -22.939 1.191 -3.216 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -21.435 0.458 -3.820 1.00 0.00 H new ATOM 452 N ASN A 81 -20.138 -1.736 -2.313 1.00 0.00 N ATOM 453 CA ASN A 81 -19.483 -2.976 -2.736 1.00 0.00 C ATOM 454 C ASN A 81 -17.991 -2.934 -2.397 1.00 0.00 C ATOM 455 O ASN A 81 -17.130 -3.279 -3.202 1.00 0.00 O ATOM 456 CB ASN A 81 -19.785 -3.279 -4.218 1.00 0.00 C ATOM 457 CG ASN A 81 -19.630 -2.073 -5.131 1.00 0.00 C ATOM 458 OD1 ASN A 81 -20.606 -1.571 -5.682 1.00 0.00 O ATOM 459 ND2 ASN A 81 -18.424 -1.558 -5.257 1.00 0.00 N ATOM 0 H ASN A 81 -19.507 -0.936 -2.275 1.00 0.00 H new ATOM 0 HA ASN A 81 -19.895 -3.816 -2.177 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -19.120 -4.071 -4.561 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -20.803 -3.659 -4.302 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -18.283 -0.722 -5.823 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -17.631 -1.996 -4.788 1.00 0.00 H new ATOM 466 N TYR A 82 -17.695 -2.513 -1.174 1.00 0.00 N ATOM 467 CA TYR A 82 -16.382 -2.356 -0.555 1.00 0.00 C ATOM 468 C TYR A 82 -15.584 -3.648 -0.560 1.00 0.00 C ATOM 469 O TYR A 82 -14.368 -3.656 -0.738 1.00 0.00 O ATOM 470 CB TYR A 82 -16.594 -1.911 0.900 1.00 0.00 C ATOM 471 CG TYR A 82 -17.735 -2.606 1.645 1.00 0.00 C ATOM 472 CD1 TYR A 82 -17.496 -3.823 2.314 1.00 0.00 C ATOM 473 CD2 TYR A 82 -19.028 -2.036 1.697 1.00 0.00 C ATOM 474 CE1 TYR A 82 -18.513 -4.451 3.054 1.00 0.00 C ATOM 475 CE2 TYR A 82 -20.031 -2.638 2.474 1.00 0.00 C ATOM 476 CZ TYR A 82 -19.780 -3.840 3.166 1.00 0.00 C ATOM 477 OH TYR A 82 -20.749 -4.407 3.932 1.00 0.00 O ATOM 0 H TYR A 82 -18.438 -2.247 -0.528 1.00 0.00 H new ATOM 0 HA TYR A 82 -15.818 -1.620 -1.128 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -15.669 -2.079 1.451 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -16.779 -0.837 0.909 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -16.519 -4.279 2.257 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -19.244 -1.137 1.139 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -18.325 -5.399 3.536 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -21.004 -2.175 2.542 1.00 0.00 H new ATOM 0 HH TYR A 82 -21.558 -3.855 3.898 1.00 0.00 H new ATOM 487 N TRP A 83 -16.297 -4.756 -0.395 1.00 0.00 N ATOM 488 CA TRP A 83 -15.757 -6.090 -0.270 1.00 0.00 C ATOM 489 C TRP A 83 -15.045 -6.570 -1.540 1.00 0.00 C ATOM 490 O TRP A 83 -14.399 -7.617 -1.509 1.00 0.00 O ATOM 491 CB TRP A 83 -16.903 -7.017 0.146 1.00 0.00 C ATOM 492 CG TRP A 83 -18.040 -7.103 -0.826 1.00 0.00 C ATOM 493 CD1 TRP A 83 -19.044 -6.211 -0.971 1.00 0.00 C ATOM 494 CD2 TRP A 83 -18.305 -8.152 -1.795 1.00 0.00 C ATOM 495 NE1 TRP A 83 -19.910 -6.642 -1.954 1.00 0.00 N ATOM 496 CE2 TRP A 83 -19.499 -7.834 -2.506 1.00 0.00 C ATOM 497 CE3 TRP A 83 -17.653 -9.351 -2.130 1.00 0.00 C ATOM 498 CZ2 TRP A 83 -20.019 -8.666 -3.509 1.00 0.00 C ATOM 499 CZ3 TRP A 83 -18.163 -10.191 -3.133 1.00 0.00 C ATOM 500 CH2 TRP A 83 -19.336 -9.851 -3.831 1.00 0.00 C ATOM 0 H TRP A 83 -17.316 -4.740 -0.343 1.00 0.00 H new ATOM 0 HA TRP A 83 -14.978 -6.096 0.492 1.00 0.00 H new ATOM 0 HB2 TRP A 83 -16.501 -8.018 0.300 1.00 0.00 H new ATOM 0 HB3 TRP A 83 -17.292 -6.679 1.106 1.00 0.00 H new ATOM 0 HD1 TRP A 83 -19.152 -5.299 -0.403 1.00 0.00 H new ATOM 0 HE1 TRP A 83 -20.751 -6.139 -2.237 1.00 0.00 H new ATOM 0 HE3 TRP A 83 -16.749 -9.630 -1.610 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 -20.930 -8.400 -4.025 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 -17.648 -11.110 -3.372 1.00 0.00 H new ATOM 0 HH2 TRP A 83 -19.710 -10.498 -4.611 1.00 0.00 H new ATOM 511 N GLN A 84 -15.142 -5.800 -2.628 1.00 0.00 N ATOM 512 CA GLN A 84 -14.521 -6.069 -3.911 1.00 0.00 C ATOM 513 C GLN A 84 -13.145 -5.405 -4.062 1.00 0.00 C ATOM 514 O GLN A 84 -12.558 -5.460 -5.140 1.00 0.00 O ATOM 515 CB GLN A 84 -15.504 -5.677 -5.026 1.00 0.00 C ATOM 516 CG GLN A 84 -16.794 -6.528 -4.975 1.00 0.00 C ATOM 517 CD GLN A 84 -16.974 -7.388 -6.226 1.00 0.00 C ATOM 518 OE1 GLN A 84 -16.031 -8.018 -6.705 1.00 0.00 O ATOM 519 NE2 GLN A 84 -18.168 -7.438 -6.789 1.00 0.00 N ATOM 0 H GLN A 84 -15.682 -4.935 -2.629 1.00 0.00 H new ATOM 0 HA GLN A 84 -14.312 -7.136 -3.985 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -15.760 -4.622 -4.931 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -15.023 -5.803 -5.996 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -16.767 -7.172 -4.096 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -17.656 -5.870 -4.862 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -18.944 -6.913 -6.386 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -18.314 -8.001 -7.627 1.00 0.00 H new ATOM 528 N PHE A 85 -12.607 -4.775 -3.010 1.00 0.00 N ATOM 529 CA PHE A 85 -11.379 -3.986 -3.073 1.00 0.00 C ATOM 530 C PHE A 85 -10.346 -4.522 -2.078 1.00 0.00 C ATOM 531 O PHE A 85 -10.727 -5.199 -1.116 1.00 0.00 O ATOM 532 CB PHE A 85 -11.726 -2.528 -2.760 1.00 0.00 C ATOM 533 CG PHE A 85 -12.620 -1.854 -3.782 1.00 0.00 C ATOM 534 CD1 PHE A 85 -14.005 -2.102 -3.792 1.00 0.00 C ATOM 535 CD2 PHE A 85 -12.069 -0.963 -4.721 1.00 0.00 C ATOM 536 CE1 PHE A 85 -14.837 -1.379 -4.662 1.00 0.00 C ATOM 537 CE2 PHE A 85 -12.897 -0.298 -5.637 1.00 0.00 C ATOM 538 CZ PHE A 85 -14.287 -0.474 -5.582 1.00 0.00 C ATOM 0 H PHE A 85 -13.022 -4.802 -2.079 1.00 0.00 H new ATOM 0 HA PHE A 85 -10.943 -4.055 -4.070 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -12.215 -2.486 -1.787 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -10.800 -1.959 -2.676 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -14.427 -2.846 -3.133 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -11.003 -0.790 -4.737 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -15.907 -1.521 -4.623 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.464 0.350 -6.385 1.00 0.00 H new ATOM 0 HZ PHE A 85 -14.931 0.085 -6.245 1.00 0.00 H new ATOM 548 N PRO A 86 -9.041 -4.247 -2.275 1.00 0.00 N ATOM 549 CA PRO A 86 -8.006 -4.684 -1.354 1.00 0.00 C ATOM 550 C PRO A 86 -8.208 -4.035 0.015 1.00 0.00 C ATOM 551 O PRO A 86 -8.635 -2.889 0.104 1.00 0.00 O ATOM 552 CB PRO A 86 -6.662 -4.325 -1.990 1.00 0.00 C ATOM 553 CG PRO A 86 -7.011 -3.233 -2.993 1.00 0.00 C ATOM 554 CD PRO A 86 -8.447 -3.551 -3.401 1.00 0.00 C ATOM 0 HA PRO A 86 -8.044 -5.760 -1.181 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.950 -3.970 -1.245 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -6.209 -5.187 -2.480 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.933 -2.242 -2.547 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -6.339 -3.250 -3.851 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.998 -2.639 -3.630 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -8.469 -4.170 -4.298 1.00 0.00 H new ATOM 562 N ASP A 87 -7.919 -4.775 1.080 1.00 0.00 N ATOM 563 CA ASP A 87 -7.811 -4.277 2.455 1.00 0.00 C ATOM 564 C ASP A 87 -6.500 -3.502 2.586 1.00 0.00 C ATOM 565 O ASP A 87 -6.482 -2.309 2.892 1.00 0.00 O ATOM 566 CB ASP A 87 -7.849 -5.502 3.383 1.00 0.00 C ATOM 567 CG ASP A 87 -7.292 -5.273 4.787 1.00 0.00 C ATOM 568 OD1 ASP A 87 -7.293 -4.135 5.274 1.00 0.00 O ATOM 569 OD2 ASP A 87 -6.948 -6.313 5.423 1.00 0.00 O ATOM 0 H ASP A 87 -7.746 -5.778 1.011 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.625 -3.602 2.721 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -8.882 -5.840 3.470 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.288 -6.310 2.914 1.00 0.00 H new ATOM 574 N GLY A 88 -5.404 -4.176 2.246 1.00 0.00 N ATOM 575 CA GLY A 88 -4.067 -3.641 2.140 1.00 0.00 C ATOM 576 C GLY A 88 -3.406 -4.167 0.874 1.00 0.00 C ATOM 577 O GLY A 88 -3.954 -5.047 0.199 1.00 0.00 O ATOM 0 H GLY A 88 -5.438 -5.171 2.025 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -4.101 -2.552 2.119 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -3.480 -3.925 3.014 1.00 0.00 H new ATOM 581 N ILE A 89 -2.232 -3.626 0.565 1.00 0.00 N ATOM 582 CA ILE A 89 -1.309 -4.147 -0.440 1.00 0.00 C ATOM 583 C ILE A 89 -0.044 -4.570 0.280 1.00 0.00 C ATOM 584 O ILE A 89 0.476 -3.827 1.120 1.00 0.00 O ATOM 585 CB ILE A 89 -0.997 -3.086 -1.508 1.00 0.00 C ATOM 586 CG1 ILE A 89 -2.246 -2.671 -2.294 1.00 0.00 C ATOM 587 CG2 ILE A 89 0.089 -3.563 -2.486 1.00 0.00 C ATOM 588 CD1 ILE A 89 -3.045 -3.794 -2.929 1.00 0.00 C ATOM 0 H ILE A 89 -1.884 -2.784 1.023 1.00 0.00 H new ATOM 0 HA ILE A 89 -1.757 -4.995 -0.958 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.626 -2.216 -0.966 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.905 -2.119 -1.623 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.941 -1.981 -3.081 1.00 0.00 H new ATOM 0 HG21 ILE A 89 0.280 -2.785 -3.225 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.006 -3.775 -1.936 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.248 -4.468 -2.991 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -3.903 -3.377 -3.456 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -2.414 -4.336 -3.634 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -3.392 -4.477 -2.154 1.00 0.00 H new ATOM 600 N HIS A 90 0.457 -5.743 -0.085 1.00 0.00 N ATOM 601 CA HIS A 90 1.758 -6.233 0.326 1.00 0.00 C ATOM 602 C HIS A 90 2.777 -5.479 -0.519 1.00 0.00 C ATOM 603 O HIS A 90 2.820 -5.661 -1.733 1.00 0.00 O ATOM 604 CB HIS A 90 1.882 -7.760 0.138 1.00 0.00 C ATOM 605 CG HIS A 90 0.611 -8.506 -0.171 1.00 0.00 C ATOM 606 ND1 HIS A 90 -0.587 -8.433 0.499 1.00 0.00 N ATOM 607 CD2 HIS A 90 0.452 -9.363 -1.214 1.00 0.00 C ATOM 608 CE1 HIS A 90 -1.467 -9.189 -0.183 1.00 0.00 C ATOM 609 NE2 HIS A 90 -0.884 -9.764 -1.241 1.00 0.00 N ATOM 0 H HIS A 90 -0.046 -6.393 -0.690 1.00 0.00 H new ATOM 0 HA HIS A 90 1.922 -6.060 1.390 1.00 0.00 H new ATOM 0 HB2 HIS A 90 2.592 -7.948 -0.668 1.00 0.00 H new ATOM 0 HB3 HIS A 90 2.312 -8.181 1.046 1.00 0.00 H new ATOM 0 HD2 HIS A 90 1.224 -9.678 -1.901 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -2.505 -9.315 0.088 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -1.327 -10.373 -1.929 1.00 0.00 H new ATOM 617 N TYR A 91 3.547 -4.577 0.074 1.00 0.00 N ATOM 618 CA TYR A 91 4.692 -3.951 -0.573 1.00 0.00 C ATOM 619 C TYR A 91 5.707 -3.641 0.525 1.00 0.00 C ATOM 620 O TYR A 91 5.335 -3.587 1.705 1.00 0.00 O ATOM 621 CB TYR A 91 4.235 -2.696 -1.341 1.00 0.00 C ATOM 622 CG TYR A 91 5.204 -2.204 -2.398 1.00 0.00 C ATOM 623 CD1 TYR A 91 5.429 -2.988 -3.542 1.00 0.00 C ATOM 624 CD2 TYR A 91 5.839 -0.955 -2.273 1.00 0.00 C ATOM 625 CE1 TYR A 91 6.309 -2.546 -4.544 1.00 0.00 C ATOM 626 CE2 TYR A 91 6.702 -0.491 -3.284 1.00 0.00 C ATOM 627 CZ TYR A 91 6.944 -1.291 -4.424 1.00 0.00 C ATOM 628 OH TYR A 91 7.792 -0.866 -5.402 1.00 0.00 O ATOM 0 H TYR A 91 3.392 -4.255 1.030 1.00 0.00 H new ATOM 0 HA TYR A 91 5.157 -4.604 -1.312 1.00 0.00 H new ATOM 0 HB2 TYR A 91 3.278 -2.908 -1.817 1.00 0.00 H new ATOM 0 HB3 TYR A 91 4.063 -1.893 -0.625 1.00 0.00 H new ATOM 0 HD1 TYR A 91 4.923 -3.936 -3.652 1.00 0.00 H new ATOM 0 HD2 TYR A 91 5.664 -0.349 -1.397 1.00 0.00 H new ATOM 0 HE1 TYR A 91 6.500 -3.167 -5.407 1.00 0.00 H new ATOM 0 HE2 TYR A 91 7.178 0.474 -3.189 1.00 0.00 H new ATOM 0 HH TYR A 91 8.145 0.018 -5.168 1.00 0.00 H new ATOM 638 N ASN A 92 6.986 -3.473 0.182 1.00 0.00 N ATOM 639 CA ASN A 92 7.957 -3.062 1.196 1.00 0.00 C ATOM 640 C ASN A 92 7.777 -1.578 1.486 1.00 0.00 C ATOM 641 O ASN A 92 7.076 -0.865 0.761 1.00 0.00 O ATOM 642 CB ASN A 92 9.420 -3.336 0.786 1.00 0.00 C ATOM 643 CG ASN A 92 10.122 -4.135 1.876 1.00 0.00 C ATOM 644 OD1 ASN A 92 9.753 -5.281 2.136 1.00 0.00 O ATOM 645 ND2 ASN A 92 11.123 -3.570 2.530 1.00 0.00 N ATOM 0 H ASN A 92 7.364 -3.609 -0.756 1.00 0.00 H new ATOM 0 HA ASN A 92 7.765 -3.660 2.087 1.00 0.00 H new ATOM 0 HB2 ASN A 92 9.446 -3.886 -0.155 1.00 0.00 H new ATOM 0 HB3 ASN A 92 9.943 -2.394 0.619 1.00 0.00 H new ATOM 0 HD21 ASN A 92 11.606 -4.085 3.266 1.00 0.00 H new ATOM 0 HD22 ASN A 92 11.412 -2.620 2.298 1.00 0.00 H new ATOM 652 N GLY A 93 8.513 -1.082 2.475 1.00 0.00 N ATOM 653 CA GLY A 93 8.872 0.321 2.549 1.00 0.00 C ATOM 654 C GLY A 93 9.725 0.744 1.345 1.00 0.00 C ATOM 655 O GLY A 93 9.854 0.057 0.334 1.00 0.00 O ATOM 0 H GLY A 93 8.875 -1.645 3.245 1.00 0.00 H new ATOM 0 HA2 GLY A 93 7.968 0.928 2.588 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.422 0.509 3.471 1.00 0.00 H new ATOM 659 N CYS A 94 10.328 1.913 1.451 1.00 0.00 N ATOM 660 CA CYS A 94 10.931 2.650 0.348 1.00 0.00 C ATOM 661 C CYS A 94 12.420 2.317 0.185 1.00 0.00 C ATOM 662 O CYS A 94 12.799 1.771 -0.848 1.00 0.00 O ATOM 663 CB CYS A 94 10.661 4.154 0.496 1.00 0.00 C ATOM 664 SG CYS A 94 11.051 4.933 2.093 1.00 0.00 S ATOM 0 H CYS A 94 10.417 2.398 2.344 1.00 0.00 H new ATOM 0 HA CYS A 94 10.458 2.331 -0.581 1.00 0.00 H new ATOM 0 HB2 CYS A 94 11.227 4.674 -0.277 1.00 0.00 H new ATOM 0 HB3 CYS A 94 9.605 4.327 0.288 1.00 0.00 H new ATOM 669 N SER A 95 13.244 2.597 1.202 1.00 0.00 N ATOM 670 CA SER A 95 14.706 2.622 1.112 1.00 0.00 C ATOM 671 C SER A 95 15.161 3.535 -0.032 1.00 0.00 C ATOM 672 O SER A 95 15.509 3.083 -1.122 1.00 0.00 O ATOM 673 CB SER A 95 15.270 1.198 1.042 1.00 0.00 C ATOM 674 OG SER A 95 14.965 0.513 2.241 1.00 0.00 O ATOM 0 H SER A 95 12.900 2.819 2.136 1.00 0.00 H new ATOM 0 HA SER A 95 15.121 3.058 2.021 1.00 0.00 H new ATOM 0 HB2 SER A 95 14.845 0.668 0.189 1.00 0.00 H new ATOM 0 HB3 SER A 95 16.349 1.229 0.892 1.00 0.00 H new ATOM 0 HG SER A 95 15.323 -0.398 2.197 1.00 0.00 H new ATOM 680 N GLU A 96 15.119 4.842 0.239 1.00 0.00 N ATOM 681 CA GLU A 96 15.416 5.920 -0.696 1.00 0.00 C ATOM 682 C GLU A 96 15.954 7.134 0.048 1.00 0.00 C ATOM 683 O GLU A 96 16.761 7.863 -0.503 1.00 0.00 O ATOM 684 CB GLU A 96 14.119 6.279 -1.432 1.00 0.00 C ATOM 685 CG GLU A 96 14.216 7.423 -2.452 1.00 0.00 C ATOM 686 CD GLU A 96 14.865 6.989 -3.762 1.00 0.00 C ATOM 687 OE1 GLU A 96 14.155 6.418 -4.615 1.00 0.00 O ATOM 688 OE2 GLU A 96 16.072 7.245 -3.956 1.00 0.00 O ATOM 0 H GLU A 96 14.864 5.190 1.163 1.00 0.00 H new ATOM 0 HA GLU A 96 16.177 5.600 -1.408 1.00 0.00 H new ATOM 0 HB2 GLU A 96 13.760 5.389 -1.948 1.00 0.00 H new ATOM 0 HB3 GLU A 96 13.365 6.544 -0.690 1.00 0.00 H new ATOM 0 HG2 GLU A 96 13.217 7.808 -2.656 1.00 0.00 H new ATOM 0 HG3 GLU A 96 14.791 8.242 -2.020 1.00 0.00 H new ATOM 695 N ALA A 97 15.527 7.357 1.297 1.00 0.00 N ATOM 696 CA ALA A 97 16.043 8.310 2.275 1.00 0.00 C ATOM 697 C ALA A 97 15.463 9.707 2.056 1.00 0.00 C ATOM 698 O ALA A 97 15.606 10.596 2.894 1.00 0.00 O ATOM 699 CB ALA A 97 17.568 8.280 2.284 1.00 0.00 C ATOM 0 H ALA A 97 14.743 6.827 1.678 1.00 0.00 H new ATOM 0 HA ALA A 97 15.714 8.012 3.271 1.00 0.00 H new ATOM 0 HB1 ALA A 97 17.942 8.995 3.017 1.00 0.00 H new ATOM 0 HB2 ALA A 97 17.911 7.279 2.546 1.00 0.00 H new ATOM 0 HB3 ALA A 97 17.943 8.545 1.295 1.00 0.00 H new ATOM 705 N ASN A 98 14.756 9.892 0.943 1.00 0.00 N ATOM 706 CA ASN A 98 14.315 11.205 0.455 1.00 0.00 C ATOM 707 C ASN A 98 13.114 11.111 -0.488 1.00 0.00 C ATOM 708 O ASN A 98 13.018 11.864 -1.459 1.00 0.00 O ATOM 709 CB ASN A 98 15.497 11.979 -0.167 1.00 0.00 C ATOM 710 CG ASN A 98 16.230 11.245 -1.278 1.00 0.00 C ATOM 711 OD1 ASN A 98 17.399 10.919 -1.124 1.00 0.00 O ATOM 712 ND2 ASN A 98 15.577 10.948 -2.385 1.00 0.00 N ATOM 0 H ASN A 98 14.466 9.121 0.341 1.00 0.00 H new ATOM 0 HA ASN A 98 13.963 11.774 1.316 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.126 12.925 -0.560 1.00 0.00 H new ATOM 0 HB3 ASN A 98 16.210 12.219 0.622 1.00 0.00 H new ATOM 0 HD21 ASN A 98 16.047 10.437 -3.133 1.00 0.00 H new ATOM 0 HD22 ASN A 98 14.603 11.229 -2.493 1.00 0.00 H new ATOM 719 N VAL A 99 12.212 10.168 -0.221 1.00 0.00 N ATOM 720 CA VAL A 99 11.044 9.900 -1.056 1.00 0.00 C ATOM 721 C VAL A 99 9.840 10.724 -0.572 1.00 0.00 C ATOM 722 O VAL A 99 9.931 11.425 0.437 1.00 0.00 O ATOM 723 CB VAL A 99 10.826 8.377 -1.054 1.00 0.00 C ATOM 724 CG1 VAL A 99 10.201 7.872 0.247 1.00 0.00 C ATOM 725 CG2 VAL A 99 10.097 7.852 -2.286 1.00 0.00 C ATOM 0 H VAL A 99 12.274 9.559 0.595 1.00 0.00 H new ATOM 0 HA VAL A 99 11.190 10.215 -2.089 1.00 0.00 H new ATOM 0 HB VAL A 99 11.828 7.953 -1.110 1.00 0.00 H new ATOM 0 HG11 VAL A 99 10.070 6.791 0.192 1.00 0.00 H new ATOM 0 HG12 VAL A 99 10.855 8.116 1.084 1.00 0.00 H new ATOM 0 HG13 VAL A 99 9.231 8.348 0.394 1.00 0.00 H new ATOM 0 HG21 VAL A 99 9.983 6.771 -2.208 1.00 0.00 H new ATOM 0 HG22 VAL A 99 9.113 8.317 -2.352 1.00 0.00 H new ATOM 0 HG23 VAL A 99 10.673 8.093 -3.180 1.00 0.00 H new ATOM 735 N THR A 100 8.708 10.622 -1.263 1.00 0.00 N ATOM 736 CA THR A 100 7.501 11.410 -1.029 1.00 0.00 C ATOM 737 C THR A 100 6.263 10.547 -1.195 1.00 0.00 C ATOM 738 O THR A 100 6.330 9.414 -1.682 1.00 0.00 O ATOM 739 CB THR A 100 7.475 12.584 -2.032 1.00 0.00 C ATOM 740 OG1 THR A 100 7.352 12.069 -3.344 1.00 0.00 O ATOM 741 CG2 THR A 100 8.712 13.478 -1.949 1.00 0.00 C ATOM 0 H THR A 100 8.602 9.961 -2.033 1.00 0.00 H new ATOM 0 HA THR A 100 7.507 11.796 -0.010 1.00 0.00 H new ATOM 0 HB THR A 100 6.620 13.208 -1.773 1.00 0.00 H new ATOM 0 HG1 THR A 100 7.333 12.809 -3.986 1.00 0.00 H new ATOM 0 HG21 THR A 100 8.629 14.282 -2.680 1.00 0.00 H new ATOM 0 HG22 THR A 100 8.787 13.903 -0.948 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.603 12.887 -2.160 1.00 0.00 H new ATOM 749 N LYS A 101 5.104 11.110 -0.844 1.00 0.00 N ATOM 750 CA LYS A 101 3.825 10.471 -1.082 1.00 0.00 C ATOM 751 C LYS A 101 3.497 10.329 -2.564 1.00 0.00 C ATOM 752 O LYS A 101 2.540 9.632 -2.879 1.00 0.00 O ATOM 753 CB LYS A 101 2.709 11.241 -0.359 1.00 0.00 C ATOM 754 CG LYS A 101 2.049 10.278 0.625 1.00 0.00 C ATOM 755 CD LYS A 101 0.728 10.805 1.196 1.00 0.00 C ATOM 756 CE LYS A 101 -0.354 10.802 0.105 1.00 0.00 C ATOM 757 NZ LYS A 101 -1.558 11.573 0.475 1.00 0.00 N ATOM 0 H LYS A 101 5.035 12.020 -0.388 1.00 0.00 H new ATOM 0 HA LYS A 101 3.895 9.460 -0.680 1.00 0.00 H new ATOM 0 HB2 LYS A 101 3.117 12.105 0.166 1.00 0.00 H new ATOM 0 HB3 LYS A 101 1.978 11.618 -1.074 1.00 0.00 H new ATOM 0 HG2 LYS A 101 1.867 9.327 0.125 1.00 0.00 H new ATOM 0 HG3 LYS A 101 2.738 10.080 1.446 1.00 0.00 H new ATOM 0 HD2 LYS A 101 0.412 10.185 2.035 1.00 0.00 H new ATOM 0 HD3 LYS A 101 0.866 11.816 1.580 1.00 0.00 H new ATOM 0 HE2 LYS A 101 0.065 11.214 -0.813 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.642 9.773 -0.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.249 11.532 -0.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.979 11.167 1.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -1.295 12.563 0.652 1.00 0.00 H new ATOM 771 N GLU A 102 4.254 10.967 -3.455 1.00 0.00 N ATOM 772 CA GLU A 102 4.249 10.616 -4.860 1.00 0.00 C ATOM 773 C GLU A 102 5.241 9.477 -5.045 1.00 0.00 C ATOM 774 O GLU A 102 4.823 8.334 -5.187 1.00 0.00 O ATOM 775 CB GLU A 102 4.564 11.851 -5.724 1.00 0.00 C ATOM 776 CG GLU A 102 3.289 12.370 -6.392 1.00 0.00 C ATOM 777 CD GLU A 102 2.804 11.396 -7.464 1.00 0.00 C ATOM 778 OE1 GLU A 102 3.389 11.423 -8.571 1.00 0.00 O ATOM 779 OE2 GLU A 102 1.874 10.610 -7.185 1.00 0.00 O ATOM 0 H GLU A 102 4.881 11.736 -3.218 1.00 0.00 H new ATOM 0 HA GLU A 102 3.266 10.278 -5.189 1.00 0.00 H new ATOM 0 HB2 GLU A 102 5.003 12.634 -5.105 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.302 11.593 -6.484 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.511 12.509 -5.642 1.00 0.00 H new ATOM 0 HG3 GLU A 102 3.479 13.346 -6.840 1.00 0.00 H new ATOM 786 N ALA A 103 6.544 9.767 -4.991 1.00 0.00 N ATOM 787 CA ALA A 103 7.603 8.888 -5.473 1.00 0.00 C ATOM 788 C ALA A 103 7.562 7.477 -4.872 1.00 0.00 C ATOM 789 O ALA A 103 7.950 6.519 -5.540 1.00 0.00 O ATOM 790 CB ALA A 103 8.954 9.565 -5.211 1.00 0.00 C ATOM 0 H ALA A 103 6.896 10.641 -4.601 1.00 0.00 H new ATOM 0 HA ALA A 103 7.450 8.739 -6.542 1.00 0.00 H new ATOM 0 HB1 ALA A 103 9.759 8.921 -5.566 1.00 0.00 H new ATOM 0 HB2 ALA A 103 8.992 10.518 -5.739 1.00 0.00 H new ATOM 0 HB3 ALA A 103 9.073 9.738 -4.141 1.00 0.00 H new ATOM 796 N PHE A 104 7.100 7.320 -3.630 1.00 0.00 N ATOM 797 CA PHE A 104 6.966 6.007 -3.021 1.00 0.00 C ATOM 798 C PHE A 104 5.680 5.324 -3.520 1.00 0.00 C ATOM 799 O PHE A 104 5.763 4.208 -4.041 1.00 0.00 O ATOM 800 CB PHE A 104 7.089 6.097 -1.489 1.00 0.00 C ATOM 801 CG PHE A 104 6.285 5.034 -0.796 1.00 0.00 C ATOM 802 CD1 PHE A 104 6.698 3.689 -0.826 1.00 0.00 C ATOM 803 CD2 PHE A 104 5.023 5.382 -0.294 1.00 0.00 C ATOM 804 CE1 PHE A 104 5.828 2.685 -0.373 1.00 0.00 C ATOM 805 CE2 PHE A 104 4.140 4.372 0.088 1.00 0.00 C ATOM 806 CZ PHE A 104 4.537 3.024 0.069 1.00 0.00 C ATOM 0 H PHE A 104 6.813 8.093 -3.029 1.00 0.00 H new ATOM 0 HA PHE A 104 7.789 5.364 -3.334 1.00 0.00 H new ATOM 0 HB2 PHE A 104 8.137 6.003 -1.203 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.755 7.079 -1.156 1.00 0.00 H new ATOM 0 HD1 PHE A 104 7.679 3.431 -1.196 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.738 6.420 -0.204 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.150 1.654 -0.364 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.139 4.629 0.402 1.00 0.00 H new ATOM 0 HZ PHE A 104 3.854 2.252 0.392 1.00 0.00 H new ATOM 816 N VAL A 105 4.514 5.970 -3.382 1.00 0.00 N ATOM 817 CA VAL A 105 3.212 5.397 -3.739 1.00 0.00 C ATOM 818 C VAL A 105 3.196 5.039 -5.231 1.00 0.00 C ATOM 819 O VAL A 105 2.684 3.982 -5.591 1.00 0.00 O ATOM 820 CB VAL A 105 2.069 6.362 -3.343 1.00 0.00 C ATOM 821 CG1 VAL A 105 0.672 5.863 -3.757 1.00 0.00 C ATOM 822 CG2 VAL A 105 2.059 6.660 -1.836 1.00 0.00 C ATOM 0 H VAL A 105 4.450 6.919 -3.014 1.00 0.00 H new ATOM 0 HA VAL A 105 3.048 4.475 -3.181 1.00 0.00 H new ATOM 0 HB VAL A 105 2.281 7.277 -3.897 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.080 6.589 -3.448 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.635 5.741 -4.840 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.471 4.905 -3.277 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.240 7.341 -1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.925 5.731 -1.282 1.00 0.00 H new ATOM 0 HG23 VAL A 105 3.005 7.120 -1.550 1.00 0.00 H new ATOM 832 N THR A 106 3.834 5.849 -6.077 1.00 0.00 N ATOM 833 CA THR A 106 4.113 5.588 -7.477 1.00 0.00 C ATOM 834 C THR A 106 4.685 4.180 -7.659 1.00 0.00 C ATOM 835 O THR A 106 4.096 3.391 -8.393 1.00 0.00 O ATOM 836 CB THR A 106 5.062 6.691 -7.976 1.00 0.00 C ATOM 837 OG1 THR A 106 4.391 7.929 -8.059 1.00 0.00 O ATOM 838 CG2 THR A 106 5.669 6.433 -9.351 1.00 0.00 C ATOM 0 H THR A 106 4.188 6.758 -5.778 1.00 0.00 H new ATOM 0 HA THR A 106 3.201 5.614 -8.073 1.00 0.00 H new ATOM 0 HB THR A 106 5.866 6.701 -7.240 1.00 0.00 H new ATOM 0 HG1 THR A 106 4.297 8.311 -7.161 1.00 0.00 H new ATOM 0 HG21 THR A 106 6.324 7.262 -9.621 1.00 0.00 H new ATOM 0 HG22 THR A 106 6.245 5.508 -9.327 1.00 0.00 H new ATOM 0 HG23 THR A 106 4.872 6.344 -10.090 1.00 0.00 H new ATOM 846 N GLY A 107 5.800 3.841 -7.001 1.00 0.00 N ATOM 847 CA GLY A 107 6.463 2.552 -7.170 1.00 0.00 C ATOM 848 C GLY A 107 5.600 1.378 -6.703 1.00 0.00 C ATOM 849 O GLY A 107 5.583 0.316 -7.334 1.00 0.00 O ATOM 0 H GLY A 107 6.266 4.458 -6.335 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.718 2.414 -8.221 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.399 2.554 -6.612 1.00 0.00 H new ATOM 853 N CYS A 108 4.861 1.589 -5.615 1.00 0.00 N ATOM 854 CA CYS A 108 3.902 0.650 -5.045 1.00 0.00 C ATOM 855 C CYS A 108 2.785 0.358 -6.063 1.00 0.00 C ATOM 856 O CYS A 108 2.517 -0.803 -6.389 1.00 0.00 O ATOM 857 CB CYS A 108 3.427 1.260 -3.716 1.00 0.00 C ATOM 858 SG CYS A 108 2.042 0.481 -2.855 1.00 0.00 S ATOM 0 H CYS A 108 4.919 2.458 -5.085 1.00 0.00 H new ATOM 0 HA CYS A 108 4.335 -0.327 -4.829 1.00 0.00 H new ATOM 0 HB2 CYS A 108 4.277 1.271 -3.034 1.00 0.00 H new ATOM 0 HB3 CYS A 108 3.157 2.299 -3.906 1.00 0.00 H new ATOM 863 N ILE A 109 2.175 1.393 -6.640 1.00 0.00 N ATOM 864 CA ILE A 109 1.162 1.273 -7.687 1.00 0.00 C ATOM 865 C ILE A 109 1.745 0.680 -8.958 1.00 0.00 C ATOM 866 O ILE A 109 1.097 -0.124 -9.613 1.00 0.00 O ATOM 867 CB ILE A 109 0.538 2.659 -7.937 1.00 0.00 C ATOM 868 CG1 ILE A 109 -0.683 2.742 -7.012 1.00 0.00 C ATOM 869 CG2 ILE A 109 0.154 2.995 -9.387 1.00 0.00 C ATOM 870 CD1 ILE A 109 -0.990 4.193 -6.692 1.00 0.00 C ATOM 0 H ILE A 109 2.376 2.360 -6.386 1.00 0.00 H new ATOM 0 HA ILE A 109 0.382 0.586 -7.359 1.00 0.00 H new ATOM 0 HB ILE A 109 1.302 3.407 -7.725 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -1.545 2.276 -7.490 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -0.491 2.190 -6.092 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -0.274 3.997 -9.427 1.00 0.00 H new ATOM 0 HG22 ILE A 109 1.042 2.954 -10.017 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -0.579 2.273 -9.746 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.858 4.245 -6.035 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -0.132 4.646 -6.196 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -1.201 4.732 -7.615 1.00 0.00 H new ATOM 882 N ASN A 110 2.963 1.047 -9.339 1.00 0.00 N ATOM 883 CA ASN A 110 3.615 0.428 -10.496 1.00 0.00 C ATOM 884 C ASN A 110 3.688 -1.084 -10.311 1.00 0.00 C ATOM 885 O ASN A 110 3.564 -1.831 -11.275 1.00 0.00 O ATOM 886 CB ASN A 110 5.028 0.956 -10.745 1.00 0.00 C ATOM 887 CG ASN A 110 5.118 2.417 -11.149 1.00 0.00 C ATOM 888 OD1 ASN A 110 4.214 2.967 -11.786 1.00 0.00 O ATOM 889 ND2 ASN A 110 6.230 3.036 -10.814 1.00 0.00 N ATOM 0 H ASN A 110 3.518 1.763 -8.871 1.00 0.00 H new ATOM 0 HA ASN A 110 3.005 0.687 -11.362 1.00 0.00 H new ATOM 0 HB2 ASN A 110 5.616 0.811 -9.839 1.00 0.00 H new ATOM 0 HB3 ASN A 110 5.490 0.352 -11.526 1.00 0.00 H new ATOM 0 HD21 ASN A 110 6.372 4.010 -11.081 1.00 0.00 H new ATOM 0 HD22 ASN A 110 6.950 2.542 -10.287 1.00 0.00 H new ATOM 896 N ALA A 111 3.853 -1.548 -9.071 1.00 0.00 N ATOM 897 CA ALA A 111 3.909 -2.961 -8.778 1.00 0.00 C ATOM 898 C ALA A 111 2.519 -3.574 -8.887 1.00 0.00 C ATOM 899 O ALA A 111 2.338 -4.552 -9.609 1.00 0.00 O ATOM 900 CB ALA A 111 4.546 -3.157 -7.400 1.00 0.00 C ATOM 0 H ALA A 111 3.950 -0.948 -8.252 1.00 0.00 H new ATOM 0 HA ALA A 111 4.531 -3.482 -9.506 1.00 0.00 H new ATOM 0 HB1 ALA A 111 4.593 -4.221 -7.169 1.00 0.00 H new ATOM 0 HB2 ALA A 111 5.554 -2.741 -7.403 1.00 0.00 H new ATOM 0 HB3 ALA A 111 3.946 -2.648 -6.646 1.00 0.00 H new ATOM 906 N THR A 112 1.534 -3.007 -8.194 1.00 0.00 N ATOM 907 CA THR A 112 0.194 -3.579 -8.139 1.00 0.00 C ATOM 908 C THR A 112 -0.515 -3.529 -9.504 1.00 0.00 C ATOM 909 O THR A 112 -1.218 -4.476 -9.864 1.00 0.00 O ATOM 910 CB THR A 112 -0.586 -2.892 -7.012 1.00 0.00 C ATOM 911 OG1 THR A 112 -1.700 -3.632 -6.641 1.00 0.00 O ATOM 912 CG2 THR A 112 -1.096 -1.535 -7.422 1.00 0.00 C ATOM 0 H THR A 112 1.642 -2.145 -7.659 1.00 0.00 H new ATOM 0 HA THR A 112 0.255 -4.642 -7.908 1.00 0.00 H new ATOM 0 HB THR A 112 0.120 -2.802 -6.186 1.00 0.00 H new ATOM 0 HG1 THR A 112 -1.415 -4.512 -6.318 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.642 -1.086 -6.593 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.255 -0.896 -7.691 1.00 0.00 H new ATOM 0 HG23 THR A 112 -1.761 -1.640 -8.280 1.00 0.00 H new ATOM 920 N GLN A 113 -0.275 -2.495 -10.321 1.00 0.00 N ATOM 921 CA GLN A 113 -0.859 -2.406 -11.662 1.00 0.00 C ATOM 922 C GLN A 113 -0.259 -3.436 -12.627 1.00 0.00 C ATOM 923 O GLN A 113 -0.667 -3.541 -13.785 1.00 0.00 O ATOM 924 CB GLN A 113 -0.715 -0.999 -12.245 1.00 0.00 C ATOM 925 CG GLN A 113 0.689 -0.656 -12.755 1.00 0.00 C ATOM 926 CD GLN A 113 0.709 0.743 -13.338 1.00 0.00 C ATOM 927 OE1 GLN A 113 0.542 0.898 -14.542 1.00 0.00 O ATOM 928 NE2 GLN A 113 0.850 1.775 -12.522 1.00 0.00 N ATOM 0 H GLN A 113 0.322 -1.706 -10.073 1.00 0.00 H new ATOM 0 HA GLN A 113 -1.919 -2.631 -11.548 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -1.422 -0.887 -13.067 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -0.996 -0.274 -11.481 1.00 0.00 H new ATOM 0 HG2 GLN A 113 1.408 -0.727 -11.938 1.00 0.00 H new ATOM 0 HG3 GLN A 113 0.995 -1.378 -13.513 1.00 0.00 H new ATOM 0 HE21 GLN A 113 0.988 1.620 -11.523 1.00 0.00 H new ATOM 0 HE22 GLN A 113 0.821 2.725 -12.892 1.00 0.00 H new ATOM 937 N ALA A 114 0.762 -4.164 -12.183 1.00 0.00 N ATOM 938 CA ALA A 114 1.288 -5.323 -12.864 1.00 0.00 C ATOM 939 C ALA A 114 0.995 -6.603 -12.075 1.00 0.00 C ATOM 940 O ALA A 114 1.048 -7.681 -12.667 1.00 0.00 O ATOM 941 CB ALA A 114 2.766 -5.077 -13.125 1.00 0.00 C ATOM 0 H ALA A 114 1.253 -3.951 -11.315 1.00 0.00 H new ATOM 0 HA ALA A 114 0.797 -5.475 -13.825 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.193 -5.938 -13.640 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.883 -4.188 -13.745 1.00 0.00 H new ATOM 0 HB3 ALA A 114 3.283 -4.928 -12.177 1.00 0.00 H new ATOM 947 N ALA A 115 0.623 -6.512 -10.787 1.00 0.00 N ATOM 948 CA ALA A 115 0.155 -7.659 -10.018 1.00 0.00 C ATOM 949 C ALA A 115 -1.196 -8.119 -10.566 1.00 0.00 C ATOM 950 O ALA A 115 -1.397 -9.321 -10.746 1.00 0.00 O ATOM 951 CB ALA A 115 0.047 -7.321 -8.521 1.00 0.00 C ATOM 0 H ALA A 115 0.641 -5.640 -10.258 1.00 0.00 H new ATOM 0 HA ALA A 115 0.880 -8.467 -10.118 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.304 -8.196 -7.975 1.00 0.00 H new ATOM 0 HB2 ALA A 115 1.026 -7.026 -8.143 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -0.657 -6.501 -8.383 1.00 0.00 H new ATOM 957 N ASN A 116 -2.104 -7.170 -10.829 1.00 0.00 N ATOM 958 CA ASN A 116 -3.522 -7.434 -11.080 1.00 0.00 C ATOM 959 C ASN A 116 -3.911 -6.754 -12.390 1.00 0.00 C ATOM 960 O ASN A 116 -4.739 -5.840 -12.424 1.00 0.00 O ATOM 961 CB ASN A 116 -4.400 -7.004 -9.884 1.00 0.00 C ATOM 962 CG ASN A 116 -3.740 -7.296 -8.548 1.00 0.00 C ATOM 963 OD1 ASN A 116 -3.539 -8.440 -8.155 1.00 0.00 O ATOM 964 ND2 ASN A 116 -3.276 -6.251 -7.891 1.00 0.00 N ATOM 0 H ASN A 116 -1.866 -6.179 -10.874 1.00 0.00 H new ATOM 0 HA ASN A 116 -3.694 -8.505 -11.184 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -4.611 -5.937 -9.957 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -5.357 -7.523 -9.934 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -2.737 -6.385 -7.036 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -3.456 -5.309 -8.238 1.00 0.00 H new ATOM 971 N GLN A 117 -3.241 -7.150 -13.478 1.00 0.00 N ATOM 972 CA GLN A 117 -3.317 -6.465 -14.765 1.00 0.00 C ATOM 973 C GLN A 117 -4.768 -6.297 -15.218 1.00 0.00 C ATOM 974 O GLN A 117 -5.238 -5.164 -15.247 1.00 0.00 O ATOM 975 CB GLN A 117 -2.331 -7.076 -15.771 1.00 0.00 C ATOM 976 CG GLN A 117 -0.909 -6.588 -15.461 1.00 0.00 C ATOM 977 CD GLN A 117 -0.251 -5.772 -16.578 1.00 0.00 C ATOM 978 OE1 GLN A 117 0.183 -6.298 -17.596 1.00 0.00 O ATOM 979 NE2 GLN A 117 -0.149 -4.469 -16.418 1.00 0.00 N ATOM 0 H GLN A 117 -2.626 -7.964 -13.486 1.00 0.00 H new ATOM 0 HA GLN A 117 -2.971 -5.436 -14.670 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -2.372 -8.164 -15.720 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -2.610 -6.793 -16.786 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.938 -5.981 -14.556 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -0.282 -7.453 -15.245 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -0.510 -4.029 -15.571 1.00 0.00 H new ATOM 0 HE22 GLN A 117 0.291 -3.899 -17.141 1.00 0.00 H new ATOM 988 N GLY A 118 -5.514 -7.385 -15.415 1.00 0.00 N ATOM 989 CA GLY A 118 -6.921 -7.353 -15.812 1.00 0.00 C ATOM 990 C GLY A 118 -7.900 -6.885 -14.725 1.00 0.00 C ATOM 991 O GLY A 118 -9.084 -7.239 -14.796 1.00 0.00 O ATOM 0 H GLY A 118 -5.150 -8.331 -15.301 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -7.023 -6.696 -16.676 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -7.213 -8.352 -16.135 1.00 0.00 H new ATOM 995 N GLU A 119 -7.458 -6.163 -13.687 1.00 0.00 N ATOM 996 CA GLU A 119 -8.323 -5.539 -12.708 1.00 0.00 C ATOM 997 C GLU A 119 -8.176 -4.011 -12.759 1.00 0.00 C ATOM 998 O GLU A 119 -9.212 -3.349 -12.799 1.00 0.00 O ATOM 999 CB GLU A 119 -8.120 -6.240 -11.363 1.00 0.00 C ATOM 1000 CG GLU A 119 -8.545 -5.397 -10.168 1.00 0.00 C ATOM 1001 CD GLU A 119 -9.227 -6.236 -9.082 1.00 0.00 C ATOM 1002 OE1 GLU A 119 -8.568 -7.033 -8.370 1.00 0.00 O ATOM 1003 OE2 GLU A 119 -10.478 -6.152 -9.019 1.00 0.00 O ATOM 0 H GLU A 119 -6.467 -6.000 -13.511 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.382 -5.675 -12.925 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.685 -7.172 -11.359 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -7.068 -6.504 -11.255 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.671 -4.901 -9.746 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -9.226 -4.614 -10.501 1.00 0.00 H new ATOM 1010 N PHE A 120 -6.972 -3.421 -12.850 1.00 0.00 N ATOM 1011 CA PHE A 120 -6.926 -1.991 -13.205 1.00 0.00 C ATOM 1012 C PHE A 120 -7.091 -1.756 -14.709 1.00 0.00 C ATOM 1013 O PHE A 120 -7.612 -0.711 -15.103 1.00 0.00 O ATOM 1014 CB PHE A 120 -5.668 -1.266 -12.750 1.00 0.00 C ATOM 1015 CG PHE A 120 -5.364 -1.367 -11.276 1.00 0.00 C ATOM 1016 CD1 PHE A 120 -4.650 -2.460 -10.752 1.00 0.00 C ATOM 1017 CD2 PHE A 120 -5.779 -0.329 -10.430 1.00 0.00 C ATOM 1018 CE1 PHE A 120 -4.266 -2.470 -9.408 1.00 0.00 C ATOM 1019 CE2 PHE A 120 -5.380 -0.323 -9.087 1.00 0.00 C ATOM 1020 CZ PHE A 120 -4.605 -1.381 -8.588 1.00 0.00 C ATOM 0 H PHE A 120 -6.072 -3.875 -12.695 1.00 0.00 H new ATOM 0 HA PHE A 120 -7.772 -1.572 -12.661 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -4.819 -1.661 -13.307 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -5.760 -0.212 -13.014 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -4.398 -3.294 -11.390 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -6.405 0.464 -10.813 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -3.714 -3.306 -9.004 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -5.667 0.492 -8.439 1.00 0.00 H new ATOM 0 HZ PHE A 120 -4.266 -1.358 -7.563 1.00 0.00 H new ATOM 1030 N GLN A 121 -6.644 -2.673 -15.574 1.00 0.00 N ATOM 1031 CA GLN A 121 -6.892 -2.577 -17.009 1.00 0.00 C ATOM 1032 C GLN A 121 -8.284 -3.143 -17.278 1.00 0.00 C ATOM 1033 O GLN A 121 -8.444 -4.246 -17.797 1.00 0.00 O ATOM 1034 CB GLN A 121 -5.785 -3.257 -17.835 1.00 0.00 C ATOM 1035 CG GLN A 121 -4.446 -2.504 -17.752 1.00 0.00 C ATOM 1036 CD GLN A 121 -3.294 -3.349 -17.237 1.00 0.00 C ATOM 1037 OE1 GLN A 121 -2.844 -3.222 -16.103 1.00 0.00 O ATOM 1038 NE2 GLN A 121 -2.768 -4.207 -18.081 1.00 0.00 N ATOM 0 H GLN A 121 -6.105 -3.494 -15.298 1.00 0.00 H new ATOM 0 HA GLN A 121 -6.865 -1.536 -17.330 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -5.647 -4.279 -17.481 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -6.099 -3.320 -18.877 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -4.192 -2.126 -18.742 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -4.567 -1.638 -17.101 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -3.154 -4.300 -19.020 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -1.973 -4.780 -17.797 1.00 0.00 H new ATOM 1047 N LYS A 122 -9.309 -2.383 -16.891 1.00 0.00 N ATOM 1048 CA LYS A 122 -10.653 -2.573 -17.421 1.00 0.00 C ATOM 1049 C LYS A 122 -10.769 -1.848 -18.761 1.00 0.00 C ATOM 1050 O LYS A 122 -9.912 -1.019 -19.077 1.00 0.00 O ATOM 1051 CB LYS A 122 -11.700 -2.091 -16.398 1.00 0.00 C ATOM 1052 CG LYS A 122 -11.776 -2.975 -15.154 1.00 0.00 C ATOM 1053 CD LYS A 122 -12.063 -4.449 -15.464 1.00 0.00 C ATOM 1054 CE LYS A 122 -12.155 -5.247 -14.164 1.00 0.00 C ATOM 1055 NZ LYS A 122 -11.938 -6.685 -14.412 1.00 0.00 N ATOM 0 H LYS A 122 -9.230 -1.628 -16.210 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.846 -3.632 -17.595 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -11.462 -1.071 -16.097 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -12.679 -2.062 -16.876 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.834 -2.904 -14.610 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.555 -2.593 -14.494 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.995 -4.537 -16.022 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -11.274 -4.857 -16.096 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -11.413 -4.880 -13.454 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -13.134 -5.096 -13.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.282 -7.233 -13.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -12.457 -6.972 -15.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -10.923 -6.865 -14.547 1.00 0.00 H new ATOM 1069 N PRO A 123 -11.827 -2.125 -19.540 1.00 0.00 N ATOM 1070 CA PRO A 123 -12.099 -1.416 -20.784 1.00 0.00 C ATOM 1071 C PRO A 123 -12.376 0.067 -20.543 1.00 0.00 C ATOM 1072 O PRO A 123 -12.019 0.916 -21.362 1.00 0.00 O ATOM 1073 CB PRO A 123 -13.344 -2.089 -21.378 1.00 0.00 C ATOM 1074 CG PRO A 123 -13.482 -3.401 -20.621 1.00 0.00 C ATOM 1075 CD PRO A 123 -12.872 -3.099 -19.272 1.00 0.00 C ATOM 0 HA PRO A 123 -11.238 -1.465 -21.451 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -14.229 -1.465 -21.251 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -13.227 -2.261 -22.448 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -14.525 -3.704 -20.531 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -12.957 -4.212 -21.126 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -13.616 -2.700 -18.583 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -12.464 -3.999 -18.813 1.00 0.00 H new ATOM 1083 N ASP A 124 -13.022 0.342 -19.414 1.00 0.00 N ATOM 1084 CA ASP A 124 -13.895 1.444 -19.052 1.00 0.00 C ATOM 1085 C ASP A 124 -14.846 0.780 -18.069 1.00 0.00 C ATOM 1086 O ASP A 124 -15.585 -0.144 -18.421 1.00 0.00 O ATOM 1087 CB ASP A 124 -14.684 2.074 -20.208 1.00 0.00 C ATOM 1088 CG ASP A 124 -15.559 3.211 -19.672 1.00 0.00 C ATOM 1089 OD1 ASP A 124 -16.703 2.945 -19.211 1.00 0.00 O ATOM 1090 OD2 ASP A 124 -15.108 4.367 -19.698 1.00 0.00 O ATOM 0 H ASP A 124 -12.928 -0.297 -18.624 1.00 0.00 H new ATOM 0 HA ASP A 124 -13.318 2.286 -18.670 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -13.998 2.455 -20.965 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -15.305 1.320 -20.691 1.00 0.00 H new ATOM 1095 N ASN A 125 -14.706 1.136 -16.803 1.00 0.00 N ATOM 1096 CA ASN A 125 -15.672 0.938 -15.749 1.00 0.00 C ATOM 1097 C ASN A 125 -16.035 2.358 -15.294 1.00 0.00 C ATOM 1098 O ASN A 125 -15.580 3.334 -15.888 1.00 0.00 O ATOM 1099 CB ASN A 125 -15.023 0.075 -14.660 1.00 0.00 C ATOM 1100 CG ASN A 125 -16.050 -0.492 -13.696 1.00 0.00 C ATOM 1101 OD1 ASN A 125 -16.431 0.163 -12.729 1.00 0.00 O ATOM 1102 ND2 ASN A 125 -16.499 -1.709 -13.930 1.00 0.00 N ATOM 0 H ASN A 125 -13.861 1.599 -16.469 1.00 0.00 H new ATOM 0 HA ASN A 125 -16.579 0.409 -16.042 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -14.473 -0.743 -15.125 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -14.298 0.673 -14.107 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -17.181 -2.131 -13.300 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -16.164 -2.229 -14.741 1.00 0.00 H new ATOM 1109 N LYS A 126 -16.817 2.509 -14.231 1.00 0.00 N ATOM 1110 CA LYS A 126 -17.113 3.813 -13.658 1.00 0.00 C ATOM 1111 C LYS A 126 -16.281 4.038 -12.412 1.00 0.00 C ATOM 1112 O LYS A 126 -15.355 4.850 -12.422 1.00 0.00 O ATOM 1113 CB LYS A 126 -18.616 3.995 -13.397 1.00 0.00 C ATOM 1114 CG LYS A 126 -19.080 5.443 -13.631 1.00 0.00 C ATOM 1115 CD LYS A 126 -18.095 6.579 -13.270 1.00 0.00 C ATOM 1116 CE LYS A 126 -18.784 7.946 -13.261 1.00 0.00 C ATOM 1117 NZ LYS A 126 -19.125 8.400 -14.625 1.00 0.00 N ATOM 0 H LYS A 126 -17.262 1.731 -13.744 1.00 0.00 H new ATOM 0 HA LYS A 126 -16.839 4.578 -14.385 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -19.179 3.326 -14.048 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -18.842 3.705 -12.371 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -19.340 5.546 -14.685 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -19.996 5.599 -13.060 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -17.659 6.385 -12.290 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -17.274 6.590 -13.987 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -19.691 7.891 -12.659 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -18.131 8.679 -12.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -19.590 9.329 -14.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -18.257 8.477 -15.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -19.769 7.714 -15.068 1.00 0.00 H new ATOM 1131 N LEU A 127 -16.634 3.377 -11.309 1.00 0.00 N ATOM 1132 CA LEU A 127 -16.131 3.734 -9.999 1.00 0.00 C ATOM 1133 C LEU A 127 -15.222 2.659 -9.463 1.00 0.00 C ATOM 1134 O LEU A 127 -14.367 3.009 -8.665 1.00 0.00 O ATOM 1135 CB LEU A 127 -17.268 3.952 -8.996 1.00 0.00 C ATOM 1136 CG LEU A 127 -17.767 5.385 -8.787 1.00 0.00 C ATOM 1137 CD1 LEU A 127 -16.646 6.390 -8.508 1.00 0.00 C ATOM 1138 CD2 LEU A 127 -18.684 5.909 -9.886 1.00 0.00 C ATOM 0 H LEU A 127 -17.275 2.583 -11.307 1.00 0.00 H new ATOM 0 HA LEU A 127 -15.577 4.665 -10.120 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.116 3.344 -9.313 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -16.942 3.566 -8.030 1.00 0.00 H new ATOM 0 HG LEU A 127 -18.375 5.299 -7.887 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -17.074 7.383 -8.371 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -16.111 6.097 -7.605 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.954 6.406 -9.350 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -18.986 6.930 -9.652 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -18.154 5.897 -10.838 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -19.568 5.276 -9.955 1.00 0.00 H new ATOM 1150 N HIS A 128 -15.346 1.395 -9.881 1.00 0.00 N ATOM 1151 CA HIS A 128 -14.391 0.399 -9.425 1.00 0.00 C ATOM 1152 C HIS A 128 -12.984 0.834 -9.850 1.00 0.00 C ATOM 1153 O HIS A 128 -12.100 0.812 -9.005 1.00 0.00 O ATOM 1154 CB HIS A 128 -14.830 -1.018 -9.827 1.00 0.00 C ATOM 1155 CG HIS A 128 -13.764 -1.889 -10.425 1.00 0.00 C ATOM 1156 ND1 HIS A 128 -13.032 -2.872 -9.798 1.00 0.00 N ATOM 1157 CD2 HIS A 128 -13.430 -1.900 -11.745 1.00 0.00 C ATOM 1158 CE1 HIS A 128 -12.287 -3.484 -10.729 1.00 0.00 C ATOM 1159 NE2 HIS A 128 -12.538 -2.959 -11.938 1.00 0.00 N ATOM 0 H HIS A 128 -16.072 1.053 -10.511 1.00 0.00 H new ATOM 0 HA HIS A 128 -14.359 0.339 -8.337 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -15.228 -1.518 -8.944 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -15.648 -0.935 -10.543 1.00 0.00 H new ATOM 0 HD1 HIS A 128 -13.053 -3.095 -8.803 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -13.788 -1.218 -12.502 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -11.587 -4.283 -10.534 1.00 0.00 H new ATOM 1167 N GLN A 129 -12.809 1.370 -11.066 1.00 0.00 N ATOM 1168 CA GLN A 129 -11.546 1.955 -11.514 1.00 0.00 C ATOM 1169 C GLN A 129 -11.114 3.107 -10.592 1.00 0.00 C ATOM 1170 O GLN A 129 -10.028 3.080 -10.011 1.00 0.00 O ATOM 1171 CB GLN A 129 -11.586 2.263 -13.023 1.00 0.00 C ATOM 1172 CG GLN A 129 -12.504 3.413 -13.381 1.00 0.00 C ATOM 1173 CD GLN A 129 -12.679 3.672 -14.878 1.00 0.00 C ATOM 1174 OE1 GLN A 129 -12.504 2.796 -15.722 1.00 0.00 O ATOM 1175 NE2 GLN A 129 -13.080 4.876 -15.238 1.00 0.00 N ATOM 0 H GLN A 129 -13.548 1.408 -11.768 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.740 1.228 -11.417 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -10.577 2.494 -13.365 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -11.908 1.371 -13.559 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.485 3.222 -12.946 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -12.120 4.321 -12.915 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -13.223 5.598 -14.532 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -13.247 5.085 -16.222 1.00 0.00 H new ATOM 1184 N GLN A 130 -11.975 4.113 -10.414 1.00 0.00 N ATOM 1185 CA GLN A 130 -11.590 5.344 -9.745 1.00 0.00 C ATOM 1186 C GLN A 130 -11.350 5.138 -8.250 1.00 0.00 C ATOM 1187 O GLN A 130 -10.344 5.619 -7.722 1.00 0.00 O ATOM 1188 CB GLN A 130 -12.640 6.441 -10.002 1.00 0.00 C ATOM 1189 CG GLN A 130 -12.297 7.223 -11.283 1.00 0.00 C ATOM 1190 CD GLN A 130 -12.708 8.697 -11.245 1.00 0.00 C ATOM 1191 OE1 GLN A 130 -12.151 9.511 -11.975 1.00 0.00 O ATOM 1192 NE2 GLN A 130 -13.681 9.103 -10.439 1.00 0.00 N ATOM 0 H GLN A 130 -12.945 4.092 -10.728 1.00 0.00 H new ATOM 0 HA GLN A 130 -10.639 5.669 -10.168 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -13.629 5.992 -10.096 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -12.679 7.122 -9.152 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -11.223 7.161 -11.457 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -12.785 6.743 -12.131 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -14.150 8.434 -9.828 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -13.960 10.084 -10.430 1.00 0.00 H new ATOM 1201 N VAL A 131 -12.260 4.441 -7.566 1.00 0.00 N ATOM 1202 CA VAL A 131 -12.098 4.068 -6.170 1.00 0.00 C ATOM 1203 C VAL A 131 -10.811 3.272 -6.067 1.00 0.00 C ATOM 1204 O VAL A 131 -9.967 3.650 -5.270 1.00 0.00 O ATOM 1205 CB VAL A 131 -13.322 3.288 -5.639 1.00 0.00 C ATOM 1206 CG1 VAL A 131 -13.160 2.763 -4.204 1.00 0.00 C ATOM 1207 CG2 VAL A 131 -14.559 4.186 -5.638 1.00 0.00 C ATOM 0 H VAL A 131 -13.137 4.119 -7.975 1.00 0.00 H new ATOM 0 HA VAL A 131 -12.035 4.955 -5.540 1.00 0.00 H new ATOM 0 HB VAL A 131 -13.422 2.435 -6.310 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -14.062 2.228 -3.908 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -12.306 2.087 -4.158 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -12.997 3.601 -3.526 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -15.415 3.626 -5.262 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -14.381 5.050 -4.998 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -14.764 4.524 -6.654 1.00 0.00 H new ATOM 1217 N LEU A 132 -10.616 2.221 -6.873 1.00 0.00 N ATOM 1218 CA LEU A 132 -9.456 1.354 -6.720 1.00 0.00 C ATOM 1219 C LEU A 132 -8.160 2.144 -6.873 1.00 0.00 C ATOM 1220 O LEU A 132 -7.211 1.873 -6.149 1.00 0.00 O ATOM 1221 CB LEU A 132 -9.537 0.156 -7.683 1.00 0.00 C ATOM 1222 CG LEU A 132 -8.513 -0.956 -7.479 1.00 0.00 C ATOM 1223 CD1 LEU A 132 -8.698 -1.601 -6.107 1.00 0.00 C ATOM 1224 CD2 LEU A 132 -8.724 -1.979 -8.607 1.00 0.00 C ATOM 0 H LEU A 132 -11.245 1.957 -7.631 1.00 0.00 H new ATOM 0 HA LEU A 132 -9.456 0.947 -5.709 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -10.533 -0.279 -7.602 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -9.435 0.530 -8.702 1.00 0.00 H new ATOM 0 HG LEU A 132 -7.497 -0.564 -7.513 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -7.961 -2.393 -5.975 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -8.565 -0.848 -5.330 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -9.700 -2.023 -6.036 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -8.009 -2.794 -8.498 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -9.738 -2.376 -8.553 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -8.576 -1.493 -9.571 1.00 0.00 H new ATOM 1236 N TRP A 133 -8.121 3.164 -7.731 1.00 0.00 N ATOM 1237 CA TRP A 133 -6.956 4.028 -7.841 1.00 0.00 C ATOM 1238 C TRP A 133 -6.664 4.774 -6.532 1.00 0.00 C ATOM 1239 O TRP A 133 -5.589 4.597 -5.964 1.00 0.00 O ATOM 1240 CB TRP A 133 -7.088 4.957 -9.054 1.00 0.00 C ATOM 1241 CG TRP A 133 -5.771 5.285 -9.679 1.00 0.00 C ATOM 1242 CD1 TRP A 133 -5.230 6.514 -9.816 1.00 0.00 C ATOM 1243 CD2 TRP A 133 -4.808 4.360 -10.264 1.00 0.00 C ATOM 1244 NE1 TRP A 133 -3.984 6.405 -10.398 1.00 0.00 N ATOM 1245 CE2 TRP A 133 -3.700 5.108 -10.758 1.00 0.00 C ATOM 1246 CE3 TRP A 133 -4.772 2.961 -10.437 1.00 0.00 C ATOM 1247 CZ2 TRP A 133 -2.621 4.504 -11.418 1.00 0.00 C ATOM 1248 CZ3 TRP A 133 -3.734 2.356 -11.172 1.00 0.00 C ATOM 1249 CH2 TRP A 133 -2.654 3.120 -11.646 1.00 0.00 C ATOM 0 H TRP A 133 -8.887 3.408 -8.359 1.00 0.00 H new ATOM 0 HA TRP A 133 -6.080 3.402 -8.014 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -7.731 4.486 -9.798 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -7.579 5.880 -8.747 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -5.700 7.439 -9.516 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -3.350 7.191 -10.544 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -5.547 2.348 -10.002 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -1.778 5.094 -11.746 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -3.768 1.295 -11.373 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -1.850 2.642 -12.186 1.00 0.00 H new ATOM 1260 N ARG A 134 -7.596 5.588 -6.017 1.00 0.00 N ATOM 1261 CA ARG A 134 -7.386 6.320 -4.754 1.00 0.00 C ATOM 1262 C ARG A 134 -7.169 5.361 -3.586 1.00 0.00 C ATOM 1263 O ARG A 134 -6.379 5.650 -2.694 1.00 0.00 O ATOM 1264 CB ARG A 134 -8.579 7.254 -4.485 1.00 0.00 C ATOM 1265 CG ARG A 134 -8.713 7.815 -3.052 1.00 0.00 C ATOM 1266 CD ARG A 134 -7.538 8.687 -2.604 1.00 0.00 C ATOM 1267 NE ARG A 134 -7.690 9.126 -1.202 1.00 0.00 N ATOM 1268 CZ ARG A 134 -6.848 9.952 -0.574 1.00 0.00 C ATOM 1269 NH1 ARG A 134 -5.812 10.460 -1.229 1.00 0.00 N ATOM 1270 NH2 ARG A 134 -7.048 10.313 0.685 1.00 0.00 N ATOM 0 H ARG A 134 -8.502 5.758 -6.453 1.00 0.00 H new ATOM 0 HA ARG A 134 -6.483 6.923 -4.851 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.514 8.095 -5.175 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -9.495 6.714 -4.726 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -9.630 8.401 -2.988 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -8.818 6.982 -2.357 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -6.608 8.129 -2.712 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -7.464 9.560 -3.253 1.00 0.00 H new ATOM 0 HE ARG A 134 -8.492 8.775 -0.678 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -5.660 10.220 -2.209 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -5.167 11.091 -0.753 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -7.858 9.959 1.195 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -6.392 10.945 1.145 1.00 0.00 H new ATOM 1284 N LEU A 135 -7.888 4.247 -3.572 1.00 0.00 N ATOM 1285 CA LEU A 135 -7.845 3.261 -2.514 1.00 0.00 C ATOM 1286 C LEU A 135 -6.421 2.712 -2.463 1.00 0.00 C ATOM 1287 O LEU A 135 -5.776 2.785 -1.424 1.00 0.00 O ATOM 1288 CB LEU A 135 -8.949 2.214 -2.775 1.00 0.00 C ATOM 1289 CG LEU A 135 -9.247 1.280 -1.604 1.00 0.00 C ATOM 1290 CD1 LEU A 135 -10.691 0.757 -1.597 1.00 0.00 C ATOM 1291 CD2 LEU A 135 -8.343 0.079 -1.688 1.00 0.00 C ATOM 0 H LEU A 135 -8.535 4.002 -4.322 1.00 0.00 H new ATOM 0 HA LEU A 135 -8.059 3.667 -1.525 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -9.867 2.736 -3.045 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -8.660 1.611 -3.636 1.00 0.00 H new ATOM 0 HG LEU A 135 -9.087 1.864 -0.698 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.836 0.100 -0.740 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.382 1.597 -1.531 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.882 0.202 -2.516 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.551 -0.592 -0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -8.520 -0.444 -2.628 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -7.303 0.402 -1.643 1.00 0.00 H new ATOM 1303 N VAL A 136 -5.895 2.229 -3.588 1.00 0.00 N ATOM 1304 CA VAL A 136 -4.559 1.652 -3.661 1.00 0.00 C ATOM 1305 C VAL A 136 -3.469 2.723 -3.520 1.00 0.00 C ATOM 1306 O VAL A 136 -2.398 2.400 -3.011 1.00 0.00 O ATOM 1307 CB VAL A 136 -4.458 0.736 -4.903 1.00 0.00 C ATOM 1308 CG1 VAL A 136 -3.153 -0.059 -4.922 1.00 0.00 C ATOM 1309 CG2 VAL A 136 -5.548 -0.353 -4.908 1.00 0.00 C ATOM 0 H VAL A 136 -6.390 2.229 -4.480 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.376 1.002 -2.805 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.545 1.418 -5.749 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -3.124 -0.689 -5.811 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -2.308 0.629 -4.937 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -3.095 -0.685 -4.032 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -5.439 -0.973 -5.798 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -5.446 -0.974 -4.018 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -6.532 0.117 -4.911 1.00 0.00 H new ATOM 1319 N GLN A 137 -3.732 4.001 -3.820 1.00 0.00 N ATOM 1320 CA GLN A 137 -2.848 5.079 -3.379 1.00 0.00 C ATOM 1321 C GLN A 137 -2.762 5.087 -1.855 1.00 0.00 C ATOM 1322 O GLN A 137 -1.659 5.058 -1.303 1.00 0.00 O ATOM 1323 CB GLN A 137 -3.314 6.452 -3.890 1.00 0.00 C ATOM 1324 CG GLN A 137 -3.093 6.642 -5.394 1.00 0.00 C ATOM 1325 CD GLN A 137 -3.932 7.771 -5.984 1.00 0.00 C ATOM 1326 OE1 GLN A 137 -4.598 8.547 -5.296 1.00 0.00 O ATOM 1327 NE2 GLN A 137 -3.940 7.884 -7.297 1.00 0.00 N ATOM 0 H GLN A 137 -4.541 4.308 -4.360 1.00 0.00 H new ATOM 0 HA GLN A 137 -1.861 4.892 -3.802 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -4.374 6.575 -3.666 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -2.781 7.234 -3.349 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -2.038 6.847 -5.577 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -3.331 5.712 -5.911 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -3.389 7.242 -7.867 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -4.497 8.613 -7.743 1.00 0.00 H new ATOM 1336 N GLU A 138 -3.905 5.141 -1.166 1.00 0.00 N ATOM 1337 CA GLU A 138 -3.895 5.315 0.275 1.00 0.00 C ATOM 1338 C GLU A 138 -3.330 4.092 0.986 1.00 0.00 C ATOM 1339 O GLU A 138 -2.588 4.255 1.947 1.00 0.00 O ATOM 1340 CB GLU A 138 -5.279 5.707 0.815 1.00 0.00 C ATOM 1341 CG GLU A 138 -5.182 6.361 2.202 1.00 0.00 C ATOM 1342 CD GLU A 138 -4.161 7.525 2.213 1.00 0.00 C ATOM 1343 OE1 GLU A 138 -4.335 8.523 1.485 1.00 0.00 O ATOM 1344 OE2 GLU A 138 -3.075 7.406 2.849 1.00 0.00 O ATOM 0 H GLU A 138 -4.833 5.067 -1.582 1.00 0.00 H new ATOM 0 HA GLU A 138 -3.226 6.147 0.493 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -5.759 6.396 0.120 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -5.911 4.821 0.873 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -6.162 6.733 2.499 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -4.889 5.612 2.938 1.00 0.00 H new ATOM 1351 N LEU A 139 -3.600 2.888 0.483 1.00 0.00 N ATOM 1352 CA LEU A 139 -3.057 1.639 1.014 1.00 0.00 C ATOM 1353 C LEU A 139 -1.533 1.581 0.925 1.00 0.00 C ATOM 1354 O LEU A 139 -0.935 0.813 1.685 1.00 0.00 O ATOM 1355 CB LEU A 139 -3.662 0.447 0.258 1.00 0.00 C ATOM 1356 CG LEU A 139 -4.922 -0.151 0.887 1.00 0.00 C ATOM 1357 CD1 LEU A 139 -6.030 0.843 1.222 1.00 0.00 C ATOM 1358 CD2 LEU A 139 -5.466 -1.217 -0.072 1.00 0.00 C ATOM 0 H LEU A 139 -4.214 2.751 -0.320 1.00 0.00 H new ATOM 0 HA LEU A 139 -3.325 1.592 2.069 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -3.897 0.763 -0.758 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -2.907 -0.335 0.181 1.00 0.00 H new ATOM 0 HG LEU A 139 -4.618 -0.561 1.850 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.874 0.312 1.662 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -5.655 1.580 1.932 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -6.353 1.348 0.312 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -6.367 -1.662 0.351 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -5.705 -0.756 -1.031 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -4.714 -1.992 -0.219 1.00 0.00 H new ATOM 1370 N CYS A 140 -0.907 2.347 0.023 1.00 0.00 N ATOM 1371 CA CYS A 140 0.536 2.516 0.004 1.00 0.00 C ATOM 1372 C CYS A 140 0.916 3.535 1.079 1.00 0.00 C ATOM 1373 O CYS A 140 1.805 3.267 1.885 1.00 0.00 O ATOM 1374 CB CYS A 140 1.030 3.008 -1.366 1.00 0.00 C ATOM 1375 SG CYS A 140 0.695 2.008 -2.844 1.00 0.00 S ATOM 0 H CYS A 140 -1.393 2.863 -0.710 1.00 0.00 H new ATOM 0 HA CYS A 140 1.005 1.551 0.198 1.00 0.00 H new ATOM 0 HB2 CYS A 140 0.599 3.995 -1.534 1.00 0.00 H new ATOM 0 HB3 CYS A 140 2.110 3.139 -1.297 1.00 0.00 H new ATOM 1380 N SER A 141 0.332 4.744 1.043 1.00 0.00 N ATOM 1381 CA SER A 141 0.745 5.809 1.945 1.00 0.00 C ATOM 1382 C SER A 141 0.418 5.447 3.391 1.00 0.00 C ATOM 1383 O SER A 141 1.321 5.095 4.147 1.00 0.00 O ATOM 1384 CB SER A 141 0.213 7.183 1.509 1.00 0.00 C ATOM 1385 OG SER A 141 -1.130 7.204 1.056 1.00 0.00 O ATOM 0 H SER A 141 -0.420 4.998 0.402 1.00 0.00 H new ATOM 0 HA SER A 141 1.829 5.905 1.888 1.00 0.00 H new ATOM 0 HB2 SER A 141 0.305 7.872 2.349 1.00 0.00 H new ATOM 0 HB3 SER A 141 0.852 7.564 0.713 1.00 0.00 H new ATOM 0 HG SER A 141 -1.696 7.634 1.730 1.00 0.00 H new ATOM 1391 N LEU A 142 -0.858 5.560 3.769 1.00 0.00 N ATOM 1392 CA LEU A 142 -1.418 5.330 5.096 1.00 0.00 C ATOM 1393 C LEU A 142 -0.482 5.781 6.230 1.00 0.00 C ATOM 1394 O LEU A 142 -0.345 5.057 7.216 1.00 0.00 O ATOM 1395 CB LEU A 142 -1.936 3.871 5.186 1.00 0.00 C ATOM 1396 CG LEU A 142 -3.409 3.826 5.639 1.00 0.00 C ATOM 1397 CD1 LEU A 142 -4.088 2.531 5.179 1.00 0.00 C ATOM 1398 CD2 LEU A 142 -3.540 3.980 7.158 1.00 0.00 C ATOM 0 H LEU A 142 -1.578 5.836 3.102 1.00 0.00 H new ATOM 0 HA LEU A 142 -2.284 5.974 5.247 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -1.837 3.387 4.214 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -1.320 3.307 5.887 1.00 0.00 H new ATOM 0 HG LEU A 142 -3.913 4.671 5.170 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -5.126 2.526 5.512 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -4.056 2.470 4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -3.566 1.675 5.606 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -4.593 3.943 7.438 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -3.004 3.170 7.653 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -3.116 4.936 7.465 1.00 0.00 H new ATOM 1410 N LYS A 143 0.149 6.962 6.056 1.00 0.00 N ATOM 1411 CA LYS A 143 1.237 7.651 6.788 1.00 0.00 C ATOM 1412 C LYS A 143 2.372 7.943 5.784 1.00 0.00 C ATOM 1413 O LYS A 143 2.141 7.922 4.571 1.00 0.00 O ATOM 1414 CB LYS A 143 1.667 6.889 8.060 1.00 0.00 C ATOM 1415 CG LYS A 143 2.452 7.657 9.138 1.00 0.00 C ATOM 1416 CD LYS A 143 1.754 7.475 10.497 1.00 0.00 C ATOM 1417 CE LYS A 143 2.574 7.938 11.701 1.00 0.00 C ATOM 1418 NZ LYS A 143 3.212 6.811 12.409 1.00 0.00 N ATOM 0 H LYS A 143 -0.141 7.547 5.272 1.00 0.00 H new ATOM 0 HA LYS A 143 0.891 8.605 7.186 1.00 0.00 H new ATOM 0 HB2 LYS A 143 0.768 6.486 8.527 1.00 0.00 H new ATOM 0 HB3 LYS A 143 2.273 6.038 7.749 1.00 0.00 H new ATOM 0 HG2 LYS A 143 3.477 7.290 9.190 1.00 0.00 H new ATOM 0 HG3 LYS A 143 2.505 8.715 8.882 1.00 0.00 H new ATOM 0 HD2 LYS A 143 0.812 8.023 10.483 1.00 0.00 H new ATOM 0 HD3 LYS A 143 1.507 6.421 10.626 1.00 0.00 H new ATOM 0 HE2 LYS A 143 3.342 8.637 11.368 1.00 0.00 H new ATOM 0 HE3 LYS A 143 1.928 8.479 12.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 3.757 7.173 13.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 2.480 6.156 12.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 3.850 6.309 11.759 1.00 0.00 H new ATOM 1432 N HIS A 144 3.561 8.312 6.263 1.00 0.00 N ATOM 1433 CA HIS A 144 4.778 8.503 5.471 1.00 0.00 C ATOM 1434 C HIS A 144 5.593 7.205 5.477 1.00 0.00 C ATOM 1435 O HIS A 144 5.356 6.333 6.317 1.00 0.00 O ATOM 1436 CB HIS A 144 5.606 9.658 6.062 1.00 0.00 C ATOM 1437 CG HIS A 144 5.896 9.511 7.535 1.00 0.00 C ATOM 1438 ND1 HIS A 144 5.025 9.802 8.559 1.00 0.00 N ATOM 1439 CD2 HIS A 144 7.038 9.001 8.090 1.00 0.00 C ATOM 1440 CE1 HIS A 144 5.614 9.404 9.698 1.00 0.00 C ATOM 1441 NE2 HIS A 144 6.849 8.927 9.474 1.00 0.00 N ATOM 0 H HIS A 144 3.709 8.494 7.256 1.00 0.00 H new ATOM 0 HA HIS A 144 4.514 8.754 4.444 1.00 0.00 H new ATOM 0 HB2 HIS A 144 6.550 9.729 5.521 1.00 0.00 H new ATOM 0 HB3 HIS A 144 5.073 10.595 5.898 1.00 0.00 H new ATOM 0 HD2 HIS A 144 7.928 8.707 7.554 1.00 0.00 H new ATOM 0 HE1 HIS A 144 5.152 9.460 10.673 1.00 0.00 H new ATOM 0 HE2 HIS A 144 7.512 8.582 10.169 1.00 0.00 H new ATOM 1449 N CYS A 145 6.610 7.108 4.608 1.00 0.00 N ATOM 1450 CA CYS A 145 7.476 5.932 4.580 1.00 0.00 C ATOM 1451 C CYS A 145 8.209 5.778 5.915 1.00 0.00 C ATOM 1452 O CYS A 145 7.974 4.787 6.604 1.00 0.00 O ATOM 1453 CB CYS A 145 8.451 5.919 3.394 1.00 0.00 C ATOM 1454 SG CYS A 145 9.528 4.458 3.362 1.00 0.00 S ATOM 0 H CYS A 145 6.847 7.826 3.923 1.00 0.00 H new ATOM 0 HA CYS A 145 6.829 5.067 4.432 1.00 0.00 H new ATOM 0 HB2 CYS A 145 7.882 5.962 2.465 1.00 0.00 H new ATOM 0 HB3 CYS A 145 9.069 6.816 3.431 1.00 0.00 H new ATOM 1459 N GLU A 146 9.109 6.711 6.271 1.00 0.00 N ATOM 1460 CA GLU A 146 9.799 6.698 7.569 1.00 0.00 C ATOM 1461 C GLU A 146 10.706 7.913 7.760 1.00 0.00 C ATOM 1462 O GLU A 146 10.553 8.630 8.748 1.00 0.00 O ATOM 1463 CB GLU A 146 10.651 5.417 7.731 1.00 0.00 C ATOM 1464 CG GLU A 146 10.179 4.582 8.931 1.00 0.00 C ATOM 1465 CD GLU A 146 10.828 3.197 8.969 1.00 0.00 C ATOM 1466 OE1 GLU A 146 10.486 2.351 8.092 1.00 0.00 O ATOM 1467 OE2 GLU A 146 11.649 2.935 9.861 1.00 0.00 O ATOM 0 H GLU A 146 9.376 7.490 5.670 1.00 0.00 H new ATOM 0 HA GLU A 146 9.016 6.726 8.327 1.00 0.00 H new ATOM 0 HB2 GLU A 146 10.589 4.819 6.822 1.00 0.00 H new ATOM 0 HB3 GLU A 146 11.698 5.688 7.863 1.00 0.00 H new ATOM 0 HG2 GLU A 146 10.410 5.114 9.854 1.00 0.00 H new ATOM 0 HG3 GLU A 146 9.095 4.472 8.890 1.00 0.00 H new ATOM 1474 N PHE A 147 11.666 8.109 6.845 1.00 0.00 N ATOM 1475 CA PHE A 147 12.742 9.098 6.975 1.00 0.00 C ATOM 1476 C PHE A 147 12.164 10.497 7.187 1.00 0.00 C ATOM 1477 O PHE A 147 12.553 11.244 8.081 1.00 0.00 O ATOM 1478 CB PHE A 147 13.617 9.087 5.708 1.00 0.00 C ATOM 1479 CG PHE A 147 14.124 7.726 5.278 1.00 0.00 C ATOM 1480 CD1 PHE A 147 15.282 7.202 5.877 1.00 0.00 C ATOM 1481 CD2 PHE A 147 13.480 7.001 4.254 1.00 0.00 C ATOM 1482 CE1 PHE A 147 15.792 5.957 5.476 1.00 0.00 C ATOM 1483 CE2 PHE A 147 14.005 5.762 3.842 1.00 0.00 C ATOM 1484 CZ PHE A 147 15.153 5.235 4.456 1.00 0.00 C ATOM 0 H PHE A 147 11.716 7.574 5.978 1.00 0.00 H new ATOM 0 HA PHE A 147 13.350 8.836 7.841 1.00 0.00 H new ATOM 0 HB2 PHE A 147 13.043 9.518 4.887 1.00 0.00 H new ATOM 0 HB3 PHE A 147 14.474 9.739 5.874 1.00 0.00 H new ATOM 0 HD1 PHE A 147 15.784 7.762 6.652 1.00 0.00 H new ATOM 0 HD2 PHE A 147 12.589 7.395 3.788 1.00 0.00 H new ATOM 0 HE1 PHE A 147 16.675 5.555 5.952 1.00 0.00 H new ATOM 0 HE2 PHE A 147 13.522 5.212 3.048 1.00 0.00 H new ATOM 0 HZ PHE A 147 15.543 4.277 4.144 1.00 0.00 H new ATOM 1494 N TRP A 148 11.200 10.825 6.337 1.00 0.00 N ATOM 1495 CA TRP A 148 10.446 12.050 6.274 1.00 0.00 C ATOM 1496 C TRP A 148 9.245 11.936 7.205 1.00 0.00 C ATOM 1497 O TRP A 148 8.108 11.782 6.760 1.00 0.00 O ATOM 1498 CB TRP A 148 10.055 12.272 4.810 1.00 0.00 C ATOM 1499 CG TRP A 148 9.449 11.114 4.055 1.00 0.00 C ATOM 1500 CD1 TRP A 148 10.042 9.933 3.739 1.00 0.00 C ATOM 1501 CD2 TRP A 148 8.099 11.033 3.507 1.00 0.00 C ATOM 1502 NE1 TRP A 148 9.185 9.185 2.968 1.00 0.00 N ATOM 1503 CE2 TRP A 148 7.965 9.791 2.822 1.00 0.00 C ATOM 1504 CE3 TRP A 148 6.963 11.869 3.541 1.00 0.00 C ATOM 1505 CZ2 TRP A 148 6.782 9.396 2.192 1.00 0.00 C ATOM 1506 CZ3 TRP A 148 5.758 11.481 2.926 1.00 0.00 C ATOM 1507 CH2 TRP A 148 5.675 10.248 2.256 1.00 0.00 C ATOM 0 H TRP A 148 10.906 10.172 5.610 1.00 0.00 H new ATOM 0 HA TRP A 148 11.021 12.914 6.607 1.00 0.00 H new ATOM 0 HB2 TRP A 148 9.347 13.100 4.775 1.00 0.00 H new ATOM 0 HB3 TRP A 148 10.947 12.592 4.271 1.00 0.00 H new ATOM 0 HD1 TRP A 148 11.032 9.630 4.046 1.00 0.00 H new ATOM 0 HE1 TRP A 148 9.428 8.285 2.554 1.00 0.00 H new ATOM 0 HE3 TRP A 148 7.019 12.822 4.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 6.724 8.454 1.667 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 4.897 12.131 2.969 1.00 0.00 H new ATOM 0 HH2 TRP A 148 4.747 9.956 1.786 1.00 0.00 H new