Browse entries in the PDBbind-CN Database
HEADER 5DP5_COMPLEX COMPND 5DP5_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 181 MET GLY PRO SER LEU ASP PHE ALA LEU SER LEU LEU ARG SEQRES 2 A 181 ARG ASN VAL ARG GLN VAL GLN THR ASP GLN GLY HIS PHE SEQRES 3 A 181 THR MET LEU GLY VAL ARG ASP ARG LEU ALA VAL LEU PRO SEQRES 4 A 181 ARG HIS SER GLN PRO GLY LYS THR ILE TRP ILE GLU HIS SEQRES 5 A 181 LYS LEU VAL ASN ILE LEU ASP ALA VAL GLU LEU VAL ASP SEQRES 6 A 181 GLU GLN GLY VAL ASN LEU GLU LEU THR LEU ILE THR LEU SEQRES 7 A 181 ASP THR ASN GLU LYS PHE ARG ASP ILE THR LYS PHE ILE SEQRES 8 A 181 PRO GLU ASN ILE SER THR ALA SER ASP ALA THR LEU VAL SEQRES 9 A 181 ILE ASN THR GLU HIS MET PRO SER MET PHE VAL PRO VAL SEQRES 10 A 181 GLY ASP VAL VAL GLN TYR GLY PHE LEU ASN LEU SER GLY SEQRES 11 A 181 LYS PRO THR HIS ARG THR MET MET TYR ASN PHE PRO THR SEQRES 12 A 181 LYS ALA GLY GLN CYS GLY GLY VAL VAL THR SER VAL GLY SEQRES 13 A 181 LYS VAL ILE GLY ILE HIS ILE GLY GLY ASN GLY ARG GLN SEQRES 14 A 181 GLY PHE CYS ALA GLY LEU LYS ARG SER TYR PHE ALA HET UNN A 269 74 ATOM 1 N MET A 0 -0.023 -32.448 -26.706 1.00 49.96 N ATOM 2 CA MET A 0 -0.323 -31.673 -25.468 1.00 47.79 C ATOM 3 C MET A 0 -0.715 -32.579 -24.344 1.00 45.73 C ATOM 4 O MET A 0 -1.546 -33.469 -24.512 1.00 52.39 O ATOM 5 CB MET A 0 -1.481 -30.688 -25.677 1.00 48.63 C ATOM 6 CG MET A 0 -1.750 -29.767 -24.475 1.00 46.74 C ATOM 7 SD MET A 0 -2.376 -28.135 -24.915 1.00 45.75 S ATOM 8 CE MET A 0 -1.590 -27.783 -26.486 1.00 49.26 C ATOM 9 HN3 MET A 0 -0.867 -32.985 -26.991 1.00 0.00 H ATOM 10 HN2 MET A 0 0.761 -33.106 -26.520 1.00 0.00 H ATOM 11 HN1 MET A 0 0.246 -31.792 -27.467 1.00 0.00 H ATOM 12 N GLY A 1 -0.157 -32.291 -23.182 1.00 40.59 N ATOM 13 CA GLY A 1 -0.544 -32.939 -21.964 1.00 38.70 C ATOM 14 C GLY A 1 -1.911 -32.440 -21.540 1.00 38.86 C ATOM 15 O GLY A 1 -2.430 -31.444 -22.063 1.00 36.58 O ATOM 16 H GLY A 1 0.590 -31.568 -23.150 1.00 0.00 H ATOM 17 N PRO A 2 -2.514 -33.146 -20.601 1.00 39.52 N ATOM 18 CA PRO A 2 -3.887 -32.921 -20.176 1.00 40.37 C ATOM 19 C PRO A 2 -4.074 -31.760 -19.189 1.00 36.95 C ATOM 20 O PRO A 2 -5.140 -31.131 -19.173 1.00 30.56 O ATOM 21 CB PRO A 2 -4.240 -34.245 -19.508 1.00 41.48 C ATOM 22 CG PRO A 2 -2.929 -34.747 -18.950 1.00 41.61 C ATOM 23 CD PRO A 2 -1.902 -34.317 -19.933 1.00 41.67 C ATOM 24 N SER A 3 -3.064 -31.512 -18.359 1.00 34.53 N ATOM 25 CA SER A 3 -3.100 -30.386 -17.446 1.00 31.45 C ATOM 26 C SER A 3 -3.100 -29.085 -18.215 1.00 28.17 C ATOM 27 O SER A 3 -3.897 -28.187 -17.925 1.00 25.30 O ATOM 28 CB SER A 3 -1.913 -30.410 -16.486 1.00 34.03 C ATOM 29 OG SER A 3 -2.290 -30.902 -15.201 1.00 33.54 O ATOM 30 HG SER A 3 -2.992 -30.318 -14.818 1.00 0.00 H ATOM 31 H SER A 3 -2.233 -32.137 -18.365 1.00 0.00 H ATOM 32 N LEU A 4 -2.225 -28.991 -19.213 1.00 23.93 N ATOM 33 CA LEU A 4 -2.149 -27.788 -20.015 1.00 21.94 C ATOM 34 C LEU A 4 -3.399 -27.601 -20.891 1.00 21.06 C ATOM 35 O LEU A 4 -3.865 -26.486 -21.087 1.00 20.72 O ATOM 36 CB LEU A 4 -0.881 -27.812 -20.884 1.00 21.66 C ATOM 37 CG LEU A 4 -0.677 -26.676 -21.871 1.00 20.73 C ATOM 38 CD1 LEU A 4 -0.466 -25.353 -21.144 1.00 19.60 C ATOM 39 CD2 LEU A 4 0.524 -26.935 -22.812 1.00 20.79 C ATOM 40 H LEU A 4 -1.590 -29.789 -19.419 1.00 0.00 H ATOM 41 N ASP A 5 -3.911 -28.695 -21.421 1.00 19.43 N ATOM 42 CA ASP A 5 -5.112 -28.679 -22.243 1.00 19.92 C ATOM 43 C ASP A 5 -6.340 -28.195 -21.470 1.00 20.39 C ATOM 44 O ASP A 5 -7.160 -27.422 -22.002 1.00 24.99 O ATOM 45 CB ASP A 5 -5.337 -30.104 -22.773 1.00 19.24 C ATOM 46 CG ASP A 5 -6.570 -30.241 -23.602 1.00 20.72 C ATOM 47 OD1 ASP A 5 -6.495 -30.062 -24.805 1.00 21.50 O ATOM 48 OD2 ASP A 5 -7.606 -30.593 -23.050 1.00 22.34 O ATOM 49 H ASP A 5 -3.438 -29.604 -21.245 1.00 0.00 H ATOM 50 N PHE A 6 -6.487 -28.650 -20.231 1.00 20.40 N ATOM 51 CA PHE A 6 -7.583 -28.224 -19.360 1.00 20.68 C ATOM 52 C PHE A 6 -7.540 -26.716 -18.988 1.00 19.83 C ATOM 53 O PHE A 6 -8.554 -26.016 -19.062 1.00 16.72 O ATOM 54 CB PHE A 6 -7.612 -29.102 -18.120 1.00 21.12 C ATOM 55 CG PHE A 6 -8.773 -28.823 -17.196 1.00 20.88 C ATOM 56 CD1 PHE A 6 -10.037 -29.316 -17.487 1.00 20.05 C ATOM 57 CD2 PHE A 6 -8.589 -28.109 -16.025 1.00 20.00 C ATOM 58 CE1 PHE A 6 -11.093 -29.081 -16.631 1.00 18.98 C ATOM 59 CE2 PHE A 6 -9.643 -27.880 -15.165 1.00 19.54 C ATOM 60 CZ PHE A 6 -10.896 -28.367 -15.480 1.00 19.17 C ATOM 61 H PHE A 6 -5.796 -29.336 -19.865 1.00 0.00 H ATOM 62 N ALA A 7 -6.343 -26.192 -18.697 1.00 22.16 N ATOM 63 CA ALA A 7 -6.189 -24.770 -18.339 1.00 21.11 C ATOM 64 C ALA A 7 -6.432 -23.860 -19.548 1.00 20.25 C ATOM 65 O ALA A 7 -7.068 -22.798 -19.419 1.00 20.61 O ATOM 66 CB ALA A 7 -4.821 -24.516 -17.722 1.00 21.13 C ATOM 67 H ALA A 7 -5.502 -26.803 -18.724 1.00 0.00 H ATOM 68 N LEU A 8 -5.957 -24.278 -20.713 1.00 18.69 N ATOM 69 CA LEU A 8 -6.122 -23.491 -21.908 1.00 20.09 C ATOM 70 C LEU A 8 -7.591 -23.469 -22.316 1.00 20.93 C ATOM 71 O LEU A 8 -8.146 -22.422 -22.669 1.00 18.36 O ATOM 72 CB LEU A 8 -5.218 -23.986 -23.054 1.00 21.83 C ATOM 73 CG LEU A 8 -3.702 -23.704 -22.846 1.00 22.00 C ATOM 74 CD1 LEU A 8 -2.906 -24.592 -23.814 1.00 24.41 C ATOM 75 CD2 LEU A 8 -3.395 -22.219 -23.020 1.00 22.03 C ATOM 76 H LEU A 8 -5.457 -25.189 -20.765 1.00 0.00 H ATOM 77 N SER A 9 -8.224 -24.614 -22.190 1.00 21.60 N ATOM 78 CA SER A 9 -9.644 -24.713 -22.491 1.00 25.22 C ATOM 79 C SER A 9 -10.486 -23.844 -21.549 1.00 23.85 C ATOM 80 O SER A 9 -11.401 -23.135 -21.975 1.00 24.78 O ATOM 81 CB SER A 9 -10.072 -26.177 -22.395 1.00 26.35 C ATOM 82 OG SER A 9 -11.401 -26.299 -22.821 1.00 32.55 O ATOM 83 HG SER A 9 -11.680 -27.247 -22.760 1.00 0.00 H ATOM 84 H SER A 9 -7.705 -25.457 -21.872 1.00 0.00 H ATOM 85 N LEU A 10 -10.159 -23.914 -20.270 1.00 22.09 N ATOM 86 CA LEU A 10 -10.698 -22.982 -19.303 1.00 22.66 C ATOM 87 C LEU A 10 -10.610 -21.511 -19.750 1.00 22.41 C ATOM 88 O LEU A 10 -11.639 -20.794 -19.759 1.00 22.10 O ATOM 89 CB LEU A 10 -10.016 -23.161 -17.949 1.00 22.49 C ATOM 90 CG LEU A 10 -10.618 -24.018 -16.858 1.00 24.40 C ATOM 91 CD1 LEU A 10 -9.837 -23.799 -15.567 1.00 25.13 C ATOM 92 CD2 LEU A 10 -12.098 -23.742 -16.605 1.00 24.68 C ATOM 93 H LEU A 10 -9.501 -24.654 -19.952 1.00 0.00 H ATOM 94 N LEU A 11 -9.419 -21.066 -20.154 1.00 21.59 N ATOM 95 CA LEU A 11 -9.221 -19.724 -20.735 1.00 21.84 C ATOM 96 C LEU A 11 -10.050 -19.399 -21.968 1.00 22.83 C ATOM 97 O LEU A 11 -10.504 -18.279 -22.151 1.00 23.74 O ATOM 98 CB LEU A 11 -7.755 -19.529 -21.138 1.00 22.02 C ATOM 99 CG LEU A 11 -6.756 -19.175 -20.035 1.00 23.37 C ATOM 100 CD1 LEU A 11 -5.346 -19.283 -20.607 1.00 24.57 C ATOM 101 CD2 LEU A 11 -6.987 -17.758 -19.543 1.00 22.24 C ATOM 102 H LEU A 11 -8.594 -21.692 -20.055 1.00 0.00 H ATOM 103 N ARG A 12 -10.158 -20.366 -22.858 1.00 22.55 N ATOM 104 CA ARG A 12 -10.877 -20.212 -24.101 1.00 21.39 C ATOM 105 C ARG A 12 -12.408 -20.170 -23.864 1.00 20.65 C ATOM 106 O ARG A 12 -13.129 -19.416 -24.512 1.00 20.32 O ATOM 107 CB ARG A 12 -10.502 -21.396 -24.987 1.00 23.64 C ATOM 108 CG ARG A 12 -10.868 -21.265 -26.457 1.00 25.72 C ATOM 109 CD ARG A 12 -10.484 -22.528 -27.244 1.00 28.84 C ATOM 110 NE ARG A 12 -11.264 -23.691 -26.744 1.00 32.22 N ATOM 111 CZ ARG A 12 -10.764 -24.757 -26.109 1.00 31.43 C ATOM 112 NH1 ARG A 12 -9.443 -24.901 -25.914 1.00 32.74 N ATOM 113 NH2 ARG A 12 -11.587 -25.687 -25.670 1.00 29.15 N ATOM 114 HE ARG A 12 -12.292 -23.674 -26.902 1.00 0.00 H ATOM 115 HH12 ARG A 12 -9.079 -25.739 -25.417 1.00 0.00 H ATOM 116 HH11 ARG A 12 -8.784 -24.174 -26.260 1.00 0.00 H ATOM 117 HH22 ARG A 12 -11.212 -26.521 -25.175 1.00 0.00 H ATOM 118 HH21 ARG A 12 -12.611 -25.587 -25.819 1.00 0.00 H ATOM 119 H ARG A 12 -9.705 -21.280 -22.656 1.00 0.00 H ATOM 120 N ARG A 13 -12.914 -20.973 -22.948 1.00 20.65 N ATOM 121 CA ARG A 13 -14.369 -21.142 -22.815 1.00 21.39 C ATOM 122 C ARG A 13 -14.993 -20.468 -21.548 1.00 20.98 C ATOM 123 O ARG A 13 -16.211 -20.176 -21.513 1.00 19.11 O ATOM 124 CB ARG A 13 -14.667 -22.632 -22.738 1.00 23.51 C ATOM 125 CG ARG A 13 -14.150 -23.476 -23.875 1.00 27.67 C ATOM 126 CD ARG A 13 -15.098 -23.523 -25.049 1.00 29.48 C ATOM 127 NE ARG A 13 -16.149 -24.526 -24.901 1.00 32.15 N ATOM 128 CZ ARG A 13 -16.011 -25.851 -25.095 1.00 33.63 C ATOM 129 NH1 ARG A 13 -14.840 -26.425 -25.392 1.00 36.50 N ATOM 130 NH2 ARG A 13 -17.058 -26.624 -24.955 1.00 33.63 N ATOM 131 HE ARG A 13 -17.091 -24.185 -24.620 1.00 0.00 H ATOM 132 HH12 ARG A 13 -14.786 -27.454 -25.532 1.00 0.00 H ATOM 133 HH11 ARG A 13 -13.983 -25.842 -25.482 1.00 0.00 H ATOM 134 HH22 ARG A 13 -16.970 -27.650 -25.101 1.00 0.00 H ATOM 135 HH21 ARG A 13 -17.978 -26.212 -24.698 1.00 0.00 H ATOM 136 H ARG A 13 -12.276 -21.493 -22.312 1.00 0.00 H ATOM 137 N ASN A 14 -14.214 -20.329 -20.472 1.00 19.24 N ATOM 138 CA ASN A 14 -14.800 -19.945 -19.155 1.00 18.33 C ATOM 139 C ASN A 14 -14.182 -18.754 -18.371 1.00 18.63 C ATOM 140 O ASN A 14 -14.802 -18.255 -17.408 1.00 16.78 O ATOM 141 CB ASN A 14 -14.888 -21.159 -18.221 1.00 18.88 C ATOM 142 CG ASN A 14 -15.804 -22.253 -18.753 1.00 20.37 C ATOM 143 OD1 ASN A 14 -15.369 -23.133 -19.516 1.00 21.22 O ATOM 144 ND2 ASN A 14 -17.077 -22.189 -18.394 1.00 19.79 N ATOM 145 HD22 ASN A 14 -17.399 -21.436 -17.753 1.00 0.00 H ATOM 146 HD21 ASN A 14 -17.754 -22.892 -18.753 1.00 0.00 H ATOM 147 H ASN A 14 -13.190 -20.490 -20.553 1.00 0.00 H ATOM 148 N VAL A 15 -12.976 -18.326 -18.723 1.00 16.11 N ATOM 149 CA VAL A 15 -12.255 -17.373 -17.892 1.00 16.13 C ATOM 150 C VAL A 15 -12.066 -16.141 -18.720 1.00 17.04 C ATOM 151 O VAL A 15 -11.345 -16.182 -19.724 1.00 16.08 O ATOM 152 CB VAL A 15 -10.892 -17.940 -17.385 1.00 17.67 C ATOM 153 CG1 VAL A 15 -10.090 -16.879 -16.598 1.00 17.81 C ATOM 154 CG2 VAL A 15 -11.112 -19.172 -16.548 1.00 16.94 C ATOM 155 H VAL A 15 -12.542 -18.675 -19.601 1.00 0.00 H ATOM 156 N ARG A 16 -12.736 -15.057 -18.301 1.00 17.04 N ATOM 157 CA ARG A 16 -12.842 -13.843 -19.062 1.00 16.46 C ATOM 158 C ARG A 16 -12.210 -12.623 -18.413 1.00 15.62 C ATOM 159 O ARG A 16 -12.247 -12.436 -17.180 1.00 13.87 O ATOM 160 CB ARG A 16 -14.312 -13.504 -19.278 1.00 18.17 C ATOM 161 CG ARG A 16 -15.101 -14.607 -19.900 1.00 21.07 C ATOM 162 CD ARG A 16 -14.767 -14.738 -21.350 1.00 25.19 C ATOM 163 NE ARG A 16 -15.875 -15.407 -21.975 1.00 29.59 N ATOM 164 CZ ARG A 16 -15.826 -16.586 -22.586 1.00 33.05 C ATOM 165 NH1 ARG A 16 -14.680 -17.250 -22.771 1.00 32.22 N ATOM 166 NH2 ARG A 16 -16.969 -17.067 -23.075 1.00 36.55 N ATOM 167 HE ARG A 16 -16.797 -14.926 -21.947 1.00 0.00 H ATOM 168 HH12 ARG A 16 -14.685 -18.171 -23.254 1.00 0.00 H ATOM 169 HH11 ARG A 16 -13.784 -16.846 -22.432 1.00 0.00 H ATOM 170 HH22 ARG A 16 -16.981 -17.986 -23.562 1.00 0.00 H ATOM 171 HH21 ARG A 16 -17.849 -16.523 -22.970 1.00 0.00 H ATOM 172 H ARG A 16 -13.205 -15.098 -17.374 1.00 0.00 H ATOM 173 N GLN A 17 -11.686 -11.765 -19.294 1.00 15.38 N ATOM 174 CA GLN A 17 -11.262 -10.411 -18.972 1.00 16.61 C ATOM 175 C GLN A 17 -12.442 -9.452 -18.721 1.00 17.24 C ATOM 176 O GLN A 17 -13.306 -9.216 -19.587 1.00 17.36 O ATOM 177 CB GLN A 17 -10.341 -9.861 -20.091 1.00 16.87 C ATOM 178 CG GLN A 17 -9.235 -10.818 -20.569 1.00 17.11 C ATOM 179 CD GLN A 17 -8.392 -10.220 -21.700 1.00 17.47 C ATOM 180 OE1 GLN A 17 -8.673 -9.159 -22.168 1.00 17.29 O ATOM 181 NE2 GLN A 17 -7.364 -10.914 -22.099 1.00 18.76 N ATOM 182 HE22 GLN A 17 -7.157 -11.835 -21.662 1.00 0.00 H ATOM 183 HE21 GLN A 17 -6.750 -10.547 -22.854 1.00 0.00 H ATOM 184 H GLN A 17 -11.574 -12.087 -20.276 1.00 0.00 H ATOM 185 N VAL A 18 -12.471 -8.893 -17.517 1.00 18.42 N ATOM 186 CA VAL A 18 -13.505 -7.925 -17.150 1.00 19.24 C ATOM 187 C VAL A 18 -12.940 -6.677 -16.428 1.00 20.22 C ATOM 188 O VAL A 18 -11.835 -6.668 -15.912 1.00 21.09 O ATOM 189 CB VAL A 18 -14.654 -8.576 -16.337 1.00 18.00 C ATOM 190 CG1 VAL A 18 -15.032 -9.956 -16.903 1.00 18.29 C ATOM 191 CG2 VAL A 18 -14.298 -8.688 -14.869 1.00 18.36 C ATOM 192 H VAL A 18 -11.743 -9.149 -16.820 1.00 0.00 H ATOM 193 N GLN A 19 -13.752 -5.629 -16.436 1.00 22.21 N ATOM 194 CA GLN A 19 -13.468 -4.392 -15.749 1.00 23.02 C ATOM 195 C GLN A 19 -14.766 -3.934 -15.136 1.00 21.75 C ATOM 196 O GLN A 19 -15.800 -3.952 -15.789 1.00 19.77 O ATOM 197 CB GLN A 19 -12.981 -3.295 -16.736 1.00 25.44 C ATOM 198 CG GLN A 19 -11.599 -3.501 -17.348 1.00 25.97 C ATOM 199 CD GLN A 19 -11.329 -2.489 -18.449 1.00 27.12 C ATOM 200 OE1 GLN A 19 -11.385 -1.297 -18.194 1.00 23.18 O ATOM 201 NE2 GLN A 19 -11.084 -2.976 -19.706 1.00 27.20 N ATOM 202 HE22 GLN A 19 -11.047 -4.003 -19.868 1.00 0.00 H ATOM 203 HE21 GLN A 19 -10.935 -2.319 -20.498 1.00 0.00 H ATOM 204 H GLN A 19 -14.643 -5.702 -16.967 1.00 0.00 H ATOM 205 N THR A 20 -14.692 -3.520 -13.881 1.00 22.64 N ATOM 206 CA THR A 20 -15.752 -2.776 -13.239 1.00 23.39 C ATOM 207 C THR A 20 -15.201 -1.400 -12.963 1.00 25.54 C ATOM 208 O THR A 20 -14.041 -1.119 -13.270 1.00 23.00 O ATOM 209 CB THR A 20 -16.133 -3.411 -11.910 1.00 20.66 C ATOM 210 OG1 THR A 20 -14.997 -3.394 -11.025 1.00 18.92 O ATOM 211 CG2 THR A 20 -16.570 -4.847 -12.157 1.00 19.51 C ATOM 212 HG1 THR A 20 -15.247 -3.808 -10.161 1.00 0.00 H ATOM 213 H THR A 20 -13.835 -3.739 -13.334 1.00 0.00 H ATOM 214 N ASP A 21 -16.006 -0.579 -12.299 1.00 28.62 N ATOM 215 CA ASP A 21 -15.525 0.705 -11.758 1.00 28.15 C ATOM 216 C ASP A 21 -14.444 0.561 -10.725 1.00 26.61 C ATOM 217 O ASP A 21 -13.800 1.554 -10.432 1.00 27.72 O ATOM 218 CB ASP A 21 -16.678 1.529 -11.147 1.00 27.33 C ATOM 219 CG ASP A 21 -17.784 1.742 -12.126 1.00 28.69 C ATOM 220 OD1 ASP A 21 -17.515 1.561 -13.321 1.00 33.20 O ATOM 221 OD2 ASP A 21 -18.933 2.013 -11.747 1.00 27.69 O ATOM 222 H ASP A 21 -17.000 -0.849 -12.157 1.00 0.00 H ATOM 223 N GLN A 22 -14.247 -0.644 -10.168 1.00 25.90 N ATOM 224 CA GLN A 22 -13.131 -0.907 -9.209 1.00 23.95 C ATOM 225 C GLN A 22 -11.818 -1.353 -9.875 1.00 24.23 C ATOM 226 O GLN A 22 -10.836 -1.558 -9.191 1.00 24.64 O ATOM 227 CB GLN A 22 -13.532 -1.974 -8.175 1.00 24.08 C ATOM 228 CG GLN A 22 -14.661 -1.543 -7.251 1.00 24.36 C ATOM 229 CD GLN A 22 -14.389 -0.187 -6.628 1.00 27.77 C ATOM 230 OE1 GLN A 22 -15.184 0.760 -6.788 1.00 29.28 O ATOM 231 NE2 GLN A 22 -13.246 -0.067 -5.935 1.00 26.86 N ATOM 232 HE22 GLN A 22 -12.614 -0.886 -5.829 1.00 0.00 H ATOM 233 HE21 GLN A 22 -12.992 0.845 -5.504 1.00 0.00 H ATOM 234 H GLN A 22 -14.893 -1.422 -10.412 1.00 0.00 H ATOM 235 N GLY A 23 -11.830 -1.581 -11.189 1.00 24.93 N ATOM 236 CA GLY A 23 -10.640 -1.974 -11.951 1.00 24.92 C ATOM 237 C GLY A 23 -10.755 -3.290 -12.734 1.00 22.30 C ATOM 238 O GLY A 23 -11.838 -3.738 -13.090 1.00 22.66 O ATOM 239 H GLY A 23 -12.730 -1.475 -11.700 1.00 0.00 H ATOM 240 N HIS A 24 -9.612 -3.916 -12.958 1.00 21.45 N ATOM 241 CA HIS A 24 -9.493 -5.140 -13.737 1.00 21.36 C ATOM 242 C HIS A 24 -9.599 -6.417 -12.899 1.00 19.92 C ATOM 243 O HIS A 24 -8.977 -6.549 -11.843 1.00 21.69 O ATOM 244 CB HIS A 24 -8.163 -5.128 -14.496 1.00 21.90 C ATOM 245 CG HIS A 24 -8.141 -4.159 -15.628 1.00 23.93 C ATOM 246 ND1 HIS A 24 -7.809 -2.828 -15.479 1.00 27.03 N ATOM 247 CD2 HIS A 24 -8.454 -4.322 -16.930 1.00 24.09 C ATOM 248 CE1 HIS A 24 -7.910 -2.221 -16.647 1.00 26.13 C ATOM 249 NE2 HIS A 24 -8.286 -3.111 -17.547 1.00 25.46 N ATOM 250 H HIS A 24 -8.745 -3.509 -12.553 1.00 0.00 H ATOM 251 N PHE A 25 -10.386 -7.366 -13.390 1.00 18.46 N ATOM 252 CA PHE A 25 -10.652 -8.649 -12.684 1.00 17.58 C ATOM 253 C PHE A 25 -10.745 -9.773 -13.712 1.00 17.75 C ATOM 254 O PHE A 25 -10.969 -9.546 -14.895 1.00 18.13 O ATOM 255 CB PHE A 25 -11.968 -8.584 -11.853 1.00 17.68 C ATOM 256 CG PHE A 25 -11.898 -7.600 -10.742 1.00 17.08 C ATOM 257 CD1 PHE A 25 -11.320 -7.955 -9.488 1.00 17.85 C ATOM 258 CD2 PHE A 25 -12.254 -6.308 -10.955 1.00 17.14 C ATOM 259 CE1 PHE A 25 -11.158 -7.007 -8.504 1.00 18.58 C ATOM 260 CE2 PHE A 25 -12.125 -5.357 -9.951 1.00 19.14 C ATOM 261 CZ PHE A 25 -11.571 -5.694 -8.717 1.00 18.66 C ATOM 262 H PHE A 25 -10.839 -7.206 -14.312 1.00 0.00 H ATOM 263 N THR A 26 -10.549 -10.979 -13.232 1.00 17.97 N ATOM 264 CA THR A 26 -10.744 -12.206 -13.963 1.00 16.79 C ATOM 265 C THR A 26 -12.132 -12.747 -13.578 1.00 16.35 C ATOM 266 O THR A 26 -12.428 -12.824 -12.408 1.00 15.68 O ATOM 267 CB THR A 26 -9.661 -13.243 -13.553 1.00 17.58 C ATOM 268 OG1 THR A 26 -8.304 -12.832 -13.923 1.00 15.95 O ATOM 269 CG2 THR A 26 -9.956 -14.571 -14.214 1.00 17.14 C ATOM 270 HG1 THR A 26 -8.086 -11.976 -13.475 1.00 0.00 H ATOM 271 H THR A 26 -10.227 -11.055 -12.246 1.00 0.00 H ATOM 272 N MET A 27 -13.006 -13.054 -14.550 1.00 14.82 N ATOM 273 CA MET A 27 -14.340 -13.551 -14.257 1.00 16.18 C ATOM 274 C MET A 27 -14.393 -15.052 -14.630 1.00 16.53 C ATOM 275 O MET A 27 -13.837 -15.479 -15.678 1.00 17.20 O ATOM 276 CB MET A 27 -15.407 -12.762 -15.037 1.00 16.20 C ATOM 277 CG MET A 27 -16.839 -13.004 -14.596 1.00 15.99 C ATOM 278 SD MET A 27 -18.081 -12.412 -15.777 1.00 15.93 S ATOM 279 CE MET A 27 -17.533 -13.160 -17.316 1.00 16.83 C ATOM 280 H MET A 27 -12.720 -12.932 -15.542 1.00 0.00 H ATOM 281 N LEU A 28 -15.028 -15.847 -13.780 1.00 15.96 N ATOM 282 CA LEU A 28 -15.299 -17.236 -14.102 1.00 16.15 C ATOM 283 C LEU A 28 -16.797 -17.420 -14.485 1.00 17.26 C ATOM 284 O LEU A 28 -17.704 -17.221 -13.655 1.00 15.58 O ATOM 285 CB LEU A 28 -14.934 -18.128 -12.964 1.00 16.41 C ATOM 286 CG LEU A 28 -15.149 -19.635 -13.239 1.00 15.89 C ATOM 287 CD1 LEU A 28 -14.183 -20.217 -14.227 1.00 15.31 C ATOM 288 CD2 LEU A 28 -15.033 -20.364 -11.898 1.00 16.11 C ATOM 289 H LEU A 28 -15.339 -15.467 -12.863 1.00 0.00 H ATOM 290 N GLY A 29 -17.020 -17.738 -15.752 1.00 17.11 N ATOM 291 CA GLY A 29 -18.329 -18.208 -16.234 1.00 19.90 C ATOM 292 C GLY A 29 -18.462 -19.703 -15.930 1.00 21.19 C ATOM 293 O GLY A 29 -17.598 -20.490 -16.311 1.00 22.50 O ATOM 294 H GLY A 29 -16.239 -17.652 -16.433 1.00 0.00 H ATOM 295 N VAL A 30 -19.531 -20.080 -15.229 1.00 20.79 N ATOM 296 CA VAL A 30 -19.722 -21.431 -14.689 1.00 21.66 C ATOM 297 C VAL A 30 -20.710 -22.280 -15.502 1.00 20.37 C ATOM 298 O VAL A 30 -20.439 -23.431 -15.824 1.00 22.27 O ATOM 299 CB VAL A 30 -20.147 -21.334 -13.201 1.00 22.97 C ATOM 300 CG1 VAL A 30 -20.485 -22.703 -12.616 1.00 24.85 C ATOM 301 CG2 VAL A 30 -19.018 -20.689 -12.414 1.00 23.09 C ATOM 302 H VAL A 30 -20.275 -19.374 -15.054 1.00 0.00 H ATOM 303 N ARG A 31 -21.840 -21.707 -15.875 1.00 19.71 N ATOM 304 CA ARG A 31 -22.827 -22.422 -16.670 1.00 18.77 C ATOM 305 C ARG A 31 -23.856 -21.397 -17.099 1.00 18.90 C ATOM 306 O ARG A 31 -23.966 -20.320 -16.462 1.00 18.91 O ATOM 307 CB ARG A 31 -23.517 -23.524 -15.852 1.00 19.64 C ATOM 308 CG ARG A 31 -24.405 -23.037 -14.694 1.00 18.93 C ATOM 309 CD ARG A 31 -25.320 -24.139 -14.149 1.00 21.47 C ATOM 310 NE ARG A 31 -26.014 -23.686 -12.936 1.00 21.05 N ATOM 311 CZ ARG A 31 -26.980 -22.759 -12.898 1.00 23.17 C ATOM 312 NH1 ARG A 31 -27.419 -22.193 -14.000 1.00 23.84 N ATOM 313 NH2 ARG A 31 -27.531 -22.402 -11.746 1.00 22.66 N ATOM 314 HE ARG A 31 -25.732 -24.120 -12.034 1.00 0.00 H ATOM 315 HH12 ARG A 31 -28.170 -21.475 -13.952 1.00 0.00 H ATOM 316 HH11 ARG A 31 -27.016 -22.463 -14.920 1.00 0.00 H ATOM 317 HH22 ARG A 31 -28.280 -21.681 -11.729 1.00 0.00 H ATOM 318 HH21 ARG A 31 -27.214 -22.843 -10.859 1.00 0.00 H ATOM 319 H ARG A 31 -22.028 -20.723 -15.594 1.00 0.00 H ATOM 320 N ASP A 32 -24.614 -21.721 -18.151 1.00 18.97 N ATOM 321 CA ASP A 32 -25.752 -20.872 -18.601 1.00 19.58 C ATOM 322 C ASP A 32 -25.334 -19.410 -18.650 1.00 18.00 C ATOM 323 O ASP A 32 -24.434 -19.106 -19.355 1.00 15.99 O ATOM 324 CB ASP A 32 -26.990 -21.108 -17.725 1.00 21.37 C ATOM 325 CG ASP A 32 -27.393 -22.551 -17.733 1.00 23.54 C ATOM 326 OD1 ASP A 32 -27.725 -23.071 -18.844 1.00 23.68 O ATOM 327 OD2 ASP A 32 -27.280 -23.180 -16.664 1.00 24.91 O ATOM 328 H ASP A 32 -24.402 -22.595 -18.673 1.00 0.00 H ATOM 329 N ARG A 33 -25.958 -18.513 -17.883 1.00 18.09 N ATOM 330 CA ARG A 33 -25.562 -17.122 -17.896 1.00 19.25 C ATOM 331 C ARG A 33 -24.956 -16.701 -16.543 1.00 16.72 C ATOM 332 O ARG A 33 -25.011 -15.560 -16.163 1.00 16.56 O ATOM 333 CB ARG A 33 -26.787 -16.253 -18.211 1.00 22.71 C ATOM 334 CG ARG A 33 -27.087 -16.181 -19.677 1.00 29.49 C ATOM 335 CD ARG A 33 -28.246 -17.041 -20.107 1.00 35.70 C ATOM 336 NE ARG A 33 -28.343 -16.983 -21.572 1.00 44.75 N ATOM 337 CZ ARG A 33 -29.103 -17.769 -22.315 1.00 44.48 C ATOM 338 NH1 ARG A 33 -29.875 -18.695 -21.755 1.00 47.24 N ATOM 339 NH2 ARG A 33 -29.080 -17.624 -23.630 1.00 47.01 N ATOM 340 HE ARG A 33 -27.769 -16.268 -22.063 1.00 0.00 H ATOM 341 HH12 ARG A 33 -30.468 -19.307 -22.351 1.00 0.00 H ATOM 342 HH11 ARG A 33 -29.886 -18.807 -20.721 1.00 0.00 H ATOM 343 HH22 ARG A 33 -29.671 -18.233 -24.231 1.00 0.00 H ATOM 344 HH21 ARG A 33 -28.471 -16.901 -24.063 1.00 0.00 H ATOM 345 H ARG A 33 -26.739 -18.818 -17.268 1.00 0.00 H ATOM 346 N LEU A 34 -24.423 -17.659 -15.829 1.00 15.36 N ATOM 347 CA LEU A 34 -24.084 -17.503 -14.466 1.00 14.26 C ATOM 348 C LEU A 34 -22.593 -17.451 -14.440 1.00 12.78 C ATOM 349 O LEU A 34 -21.924 -18.391 -14.843 1.00 12.47 O ATOM 350 CB LEU A 34 -24.572 -18.705 -13.638 1.00 14.67 C ATOM 351 CG LEU A 34 -24.239 -18.608 -12.115 1.00 15.63 C ATOM 352 CD1 LEU A 34 -24.941 -17.418 -11.522 1.00 14.59 C ATOM 353 CD2 LEU A 34 -24.685 -19.883 -11.393 1.00 17.13 C ATOM 354 H LEU A 34 -24.241 -18.576 -16.285 1.00 0.00 H ATOM 355 N ALA A 35 -22.073 -16.349 -13.926 1.00 12.99 N ATOM 356 CA ALA A 35 -20.649 -16.216 -13.588 1.00 12.03 C ATOM 357 C ALA A 35 -20.406 -15.781 -12.141 1.00 12.59 C ATOM 358 O ALA A 35 -21.327 -15.428 -11.389 1.00 13.74 O ATOM 359 CB ALA A 35 -19.988 -15.238 -14.542 1.00 12.83 C ATOM 360 H ALA A 35 -22.701 -15.539 -13.753 1.00 0.00 H ATOM 361 N VAL A 36 -19.158 -15.888 -11.738 1.00 13.12 N ATOM 362 CA VAL A 36 -18.724 -15.490 -10.438 1.00 14.60 C ATOM 363 C VAL A 36 -17.507 -14.545 -10.538 1.00 15.74 C ATOM 364 O VAL A 36 -16.594 -14.706 -11.396 1.00 14.15 O ATOM 365 CB VAL A 36 -18.428 -16.717 -9.543 1.00 15.48 C ATOM 366 CG1 VAL A 36 -17.225 -17.480 -10.028 1.00 16.22 C ATOM 367 CG2 VAL A 36 -18.301 -16.342 -8.041 1.00 17.21 C ATOM 368 H VAL A 36 -18.456 -16.281 -12.397 1.00 0.00 H ATOM 369 N LEU A 37 -17.553 -13.546 -9.644 1.00 17.38 N ATOM 370 CA LEU A 37 -16.498 -12.568 -9.434 1.00 18.83 C ATOM 371 C LEU A 37 -16.230 -12.434 -7.928 1.00 19.03 C ATOM 372 O LEU A 37 -17.108 -12.794 -7.114 1.00 17.74 O ATOM 373 CB LEU A 37 -16.970 -11.193 -9.926 1.00 19.75 C ATOM 374 CG LEU A 37 -17.021 -10.870 -11.412 1.00 21.16 C ATOM 375 CD1 LEU A 37 -17.779 -9.555 -11.561 1.00 22.60 C ATOM 376 CD2 LEU A 37 -15.660 -10.765 -12.047 1.00 21.06 C ATOM 377 H LEU A 37 -18.408 -13.465 -9.057 1.00 0.00 H ATOM 378 N PRO A 38 -15.074 -11.836 -7.563 1.00 19.26 N ATOM 379 CA PRO A 38 -14.816 -11.434 -6.165 1.00 19.77 C ATOM 380 C PRO A 38 -15.734 -10.328 -5.785 1.00 19.93 C ATOM 381 O PRO A 38 -15.987 -9.423 -6.609 1.00 20.82 O ATOM 382 CB PRO A 38 -13.356 -10.944 -6.164 1.00 19.56 C ATOM 383 CG PRO A 38 -12.801 -11.327 -7.461 1.00 20.47 C ATOM 384 CD PRO A 38 -13.941 -11.498 -8.440 1.00 19.17 C ATOM 385 N ARG A 39 -16.294 -10.396 -4.580 1.00 18.42 N ATOM 386 CA ARG A 39 -17.260 -9.406 -4.173 1.00 18.76 C ATOM 387 C ARG A 39 -16.683 -7.978 -4.249 1.00 17.65 C ATOM 388 O ARG A 39 -17.417 -7.056 -4.651 1.00 18.95 O ATOM 389 CB ARG A 39 -17.789 -9.676 -2.771 1.00 19.72 C ATOM 390 CG ARG A 39 -18.891 -8.741 -2.340 1.00 22.35 C ATOM 391 CD ARG A 39 -18.985 -8.694 -0.820 1.00 24.64 C ATOM 392 NE ARG A 39 -17.672 -8.478 -0.249 1.00 25.55 N ATOM 393 CZ ARG A 39 -17.031 -7.326 -0.256 1.00 27.45 C ATOM 394 NH1 ARG A 39 -17.589 -6.241 -0.774 1.00 31.21 N ATOM 395 NH2 ARG A 39 -15.815 -7.257 0.251 1.00 29.36 N ATOM 396 HE ARG A 39 -17.201 -9.290 0.199 1.00 0.00 H ATOM 397 HH12 ARG A 39 -17.071 -5.339 -0.773 1.00 0.00 H ATOM 398 HH11 ARG A 39 -18.544 -6.292 -1.182 1.00 0.00 H ATOM 399 HH22 ARG A 39 -15.302 -6.353 0.250 1.00 0.00 H ATOM 400 HH21 ARG A 39 -15.370 -8.107 0.652 1.00 0.00 H ATOM 401 H ARG A 39 -16.034 -11.165 -3.930 1.00 0.00 H ATOM 402 N HIS A 40 -15.411 -7.786 -3.893 1.00 16.35 N ATOM 403 CA HIS A 40 -14.842 -6.444 -3.900 1.00 15.36 C ATOM 404 C HIS A 40 -14.820 -5.773 -5.272 1.00 15.43 C ATOM 405 O HIS A 40 -14.724 -4.547 -5.356 1.00 13.30 O ATOM 406 CB HIS A 40 -13.451 -6.402 -3.258 1.00 15.10 C ATOM 407 CG HIS A 40 -12.462 -7.330 -3.862 1.00 15.15 C ATOM 408 ND1 HIS A 40 -12.245 -8.608 -3.381 1.00 15.74 N ATOM 409 CD2 HIS A 40 -11.586 -7.157 -4.882 1.00 14.91 C ATOM 410 CE1 HIS A 40 -11.299 -9.193 -4.094 1.00 15.34 C ATOM 411 NE2 HIS A 40 -10.890 -8.335 -5.017 1.00 15.87 N ATOM 412 H HIS A 40 -14.824 -8.596 -3.610 1.00 0.00 H ATOM 413 N SER A 41 -14.945 -6.544 -6.355 1.00 17.04 N ATOM 414 CA SER A 41 -15.102 -5.922 -7.686 1.00 17.43 C ATOM 415 C SER A 41 -16.366 -5.071 -7.842 1.00 19.35 C ATOM 416 O SER A 41 -16.461 -4.266 -8.779 1.00 20.79 O ATOM 417 CB SER A 41 -15.060 -6.990 -8.802 1.00 18.45 C ATOM 418 OG SER A 41 -16.309 -7.673 -8.860 1.00 16.93 O ATOM 419 HG SER A 41 -16.484 -8.113 -7.990 1.00 0.00 H ATOM 420 H SER A 41 -14.932 -7.580 -6.262 1.00 0.00 H ATOM 421 N GLN A 42 -17.364 -5.266 -6.977 1.00 21.26 N ATOM 422 CA GLN A 42 -18.591 -4.468 -7.003 1.00 21.84 C ATOM 423 C GLN A 42 -19.159 -4.214 -8.416 1.00 21.29 C ATOM 424 O GLN A 42 -19.301 -3.050 -8.823 1.00 19.87 O ATOM 425 CB GLN A 42 -18.351 -3.119 -6.314 1.00 24.40 C ATOM 426 CG GLN A 42 -17.408 -3.198 -5.129 1.00 26.77 C ATOM 427 CD GLN A 42 -18.072 -3.593 -3.811 1.00 35.53 C ATOM 428 OE1 GLN A 42 -19.152 -4.236 -3.769 1.00 37.19 O ATOM 429 NE2 GLN A 42 -17.401 -3.232 -2.692 1.00 42.36 N ATOM 430 HE22 GLN A 42 -16.510 -2.700 -2.768 1.00 0.00 H ATOM 431 HE21 GLN A 42 -17.776 -3.486 -1.756 1.00 0.00 H ATOM 432 H GLN A 42 -17.266 -6.012 -6.259 1.00 0.00 H ATOM 433 N PRO A 43 -19.514 -5.283 -9.142 1.00 21.18 N ATOM 434 CA PRO A 43 -20.178 -5.102 -10.432 1.00 22.99 C ATOM 435 C PRO A 43 -21.438 -4.239 -10.298 1.00 25.92 C ATOM 436 O PRO A 43 -22.234 -4.417 -9.390 1.00 23.09 O ATOM 437 CB PRO A 43 -20.557 -6.524 -10.840 1.00 22.01 C ATOM 438 CG PRO A 43 -20.516 -7.334 -9.601 1.00 22.09 C ATOM 439 CD PRO A 43 -19.462 -6.703 -8.741 1.00 21.68 C ATOM 440 N GLY A 44 -21.606 -3.296 -11.204 1.00 29.59 N ATOM 441 CA GLY A 44 -22.775 -2.414 -11.167 1.00 31.52 C ATOM 442 C GLY A 44 -23.842 -3.010 -12.035 1.00 28.83 C ATOM 443 O GLY A 44 -23.977 -4.228 -12.039 1.00 34.00 O ATOM 444 H GLY A 44 -20.898 -3.177 -11.956 1.00 0.00 H ATOM 445 N LYS A 45 -24.586 -2.163 -12.766 1.00 26.73 N ATOM 446 CA LYS A 45 -25.685 -2.614 -13.625 1.00 26.31 C ATOM 447 C LYS A 45 -25.202 -3.200 -14.963 1.00 23.78 C ATOM 448 O LYS A 45 -25.964 -3.900 -15.675 1.00 20.97 O ATOM 449 CB LYS A 45 -26.654 -1.469 -13.895 1.00 29.66 C ATOM 450 CG LYS A 45 -27.333 -0.882 -12.668 1.00 30.44 C ATOM 451 CD LYS A 45 -27.941 -1.952 -11.786 1.00 31.89 C ATOM 452 CE LYS A 45 -28.610 -1.337 -10.564 1.00 33.89 C ATOM 453 NZ LYS A 45 -28.590 -2.288 -9.415 1.00 35.07 N ATOM 454 HZ1 LYS A 45 -29.100 -3.156 -9.676 1.00 0.00 H ATOM 455 HZ2 LYS A 45 -27.605 -2.522 -9.177 1.00 0.00 H ATOM 456 HZ3 LYS A 45 -29.051 -1.847 -8.594 1.00 0.00 H ATOM 457 H LYS A 45 -24.374 -1.146 -12.721 1.00 0.00 H ATOM 458 N THR A 46 -23.957 -2.860 -15.319 1.00 21.73 N ATOM 459 CA THR A 46 -23.298 -3.376 -16.528 1.00 21.35 C ATOM 460 C THR A 46 -21.864 -3.704 -16.145 1.00 18.64 C ATOM 461 O THR A 46 -21.370 -3.178 -15.206 1.00 18.36 O ATOM 462 CB THR A 46 -23.184 -2.318 -17.660 1.00 20.93 C ATOM 463 OG1 THR A 46 -22.343 -1.255 -17.206 1.00 18.05 O ATOM 464 CG2 THR A 46 -24.574 -1.797 -18.104 1.00 22.55 C ATOM 465 HG1 THR A 46 -21.447 -1.615 -16.988 1.00 0.00 H ATOM 466 H THR A 46 -23.431 -2.200 -14.712 1.00 0.00 H ATOM 467 N ILE A 47 -21.224 -4.563 -16.900 1.00 18.89 N ATOM 468 CA ILE A 47 -19.811 -4.882 -16.704 1.00 19.21 C ATOM 469 C ILE A 47 -19.191 -5.011 -18.079 1.00 18.17 C ATOM 470 O ILE A 47 -19.838 -5.437 -19.025 1.00 19.89 O ATOM 471 CB ILE A 47 -19.656 -6.201 -15.888 1.00 18.42 C ATOM 472 CG1 ILE A 47 -18.200 -6.555 -15.603 1.00 18.10 C ATOM 473 CG2 ILE A 47 -20.382 -7.335 -16.588 1.00 19.61 C ATOM 474 CD1 ILE A 47 -18.033 -7.691 -14.599 1.00 19.16 C ATOM 475 H ILE A 47 -21.741 -5.036 -17.668 1.00 0.00 H ATOM 476 N TRP A 48 -17.937 -4.639 -18.197 1.00 18.15 N ATOM 477 CA TRP A 48 -17.229 -4.755 -19.460 1.00 19.00 C ATOM 478 C TRP A 48 -16.648 -6.169 -19.569 1.00 18.21 C ATOM 479 O TRP A 48 -15.802 -6.524 -18.810 1.00 18.79 O ATOM 480 CB TRP A 48 -16.129 -3.699 -19.542 1.00 19.70 C ATOM 481 CG TRP A 48 -15.352 -3.734 -20.855 1.00 20.24 C ATOM 482 CD1 TRP A 48 -14.126 -4.271 -21.050 1.00 19.92 C ATOM 483 CD2 TRP A 48 -15.794 -3.261 -22.138 1.00 20.86 C ATOM 484 NE1 TRP A 48 -13.750 -4.136 -22.366 1.00 21.10 N ATOM 485 CE2 TRP A 48 -14.762 -3.544 -23.066 1.00 21.42 C ATOM 486 CE3 TRP A 48 -16.937 -2.605 -22.590 1.00 20.32 C ATOM 487 CZ2 TRP A 48 -14.842 -3.186 -24.429 1.00 20.39 C ATOM 488 CZ3 TRP A 48 -17.023 -2.270 -23.962 1.00 20.60 C ATOM 489 CH2 TRP A 48 -15.974 -2.558 -24.845 1.00 20.37 C ATOM 490 HE1 TRP A 48 -12.838 -4.437 -22.765 1.00 0.00 H ATOM 491 H TRP A 48 -17.440 -4.253 -17.369 1.00 0.00 H ATOM 492 N ILE A 49 -17.086 -6.963 -20.520 1.00 17.87 N ATOM 493 CA ILE A 49 -16.546 -8.312 -20.679 1.00 16.90 C ATOM 494 C ILE A 49 -15.854 -8.361 -22.040 1.00 19.46 C ATOM 495 O ILE A 49 -16.494 -8.175 -23.098 1.00 16.77 O ATOM 496 CB ILE A 49 -17.626 -9.400 -20.537 1.00 15.38 C ATOM 497 CG1 ILE A 49 -18.436 -9.196 -19.258 1.00 14.64 C ATOM 498 CG2 ILE A 49 -17.034 -10.799 -20.485 1.00 14.57 C ATOM 499 CD1 ILE A 49 -19.471 -10.267 -19.055 1.00 14.05 C ATOM 500 H ILE A 49 -17.827 -6.627 -21.168 1.00 0.00 H ATOM 501 N GLU A 50 -14.525 -8.539 -21.954 1.00 22.20 N ATOM 502 CA GLU A 50 -13.601 -8.582 -23.090 1.00 24.30 C ATOM 503 C GLU A 50 -13.657 -7.437 -24.071 1.00 26.01 C ATOM 504 O GLU A 50 -12.719 -6.649 -24.141 1.00 24.79 O ATOM 505 CB GLU A 50 -13.674 -9.928 -23.814 1.00 25.80 C ATOM 506 CG GLU A 50 -12.397 -10.721 -23.563 1.00 30.78 C ATOM 507 CD GLU A 50 -12.664 -12.083 -23.026 1.00 31.62 C ATOM 508 OE1 GLU A 50 -13.668 -12.678 -23.481 1.00 36.74 O ATOM 509 OE2 GLU A 50 -11.889 -12.544 -22.161 1.00 28.05 O ATOM 510 H GLU A 50 -14.119 -8.656 -21.004 1.00 0.00 H ATOM 511 N HIS A 51 -14.700 -7.394 -24.890 1.00 27.30 N ATOM 512 CA HIS A 51 -14.766 -6.381 -25.949 1.00 30.16 C ATOM 513 C HIS A 51 -16.093 -5.672 -25.993 1.00 27.25 C ATOM 514 O HIS A 51 -16.390 -5.022 -26.965 1.00 26.60 O ATOM 515 CB HIS A 51 -14.447 -6.998 -27.333 1.00 33.77 C ATOM 516 CG HIS A 51 -13.100 -7.663 -27.402 1.00 39.17 C ATOM 517 ND1 HIS A 51 -11.928 -7.027 -27.042 1.00 41.23 N ATOM 518 CD2 HIS A 51 -12.744 -8.916 -27.773 1.00 41.53 C ATOM 519 CE1 HIS A 51 -10.910 -7.857 -27.193 1.00 39.84 C ATOM 520 NE2 HIS A 51 -11.379 -9.009 -27.638 1.00 42.57 N ATOM 521 H HIS A 51 -15.473 -8.081 -24.781 1.00 0.00 H ATOM 522 N LYS A 52 -16.874 -5.754 -24.921 1.00 24.76 N ATOM 523 CA LYS A 52 -18.226 -5.271 -24.985 1.00 23.61 C ATOM 524 C LYS A 52 -18.871 -5.150 -23.627 1.00 21.47 C ATOM 525 O LYS A 52 -18.534 -5.857 -22.690 1.00 20.55 O ATOM 526 CB LYS A 52 -19.054 -6.146 -25.931 1.00 25.42 C ATOM 527 CG LYS A 52 -19.565 -7.426 -25.355 1.00 25.02 C ATOM 528 CD LYS A 52 -20.917 -7.805 -25.943 1.00 27.92 C ATOM 529 CE LYS A 52 -20.769 -8.431 -27.320 1.00 30.54 C ATOM 530 NZ LYS A 52 -21.581 -9.680 -27.495 1.00 31.06 N ATOM 531 HZ1 LYS A 52 -21.281 -10.388 -26.795 1.00 0.00 H ATOM 532 HZ2 LYS A 52 -22.588 -9.459 -27.357 1.00 0.00 H ATOM 533 HZ3 LYS A 52 -21.435 -10.055 -28.454 1.00 0.00 H ATOM 534 H LYS A 52 -16.508 -6.166 -24.039 1.00 0.00 H ATOM 535 N LEU A 53 -19.758 -4.175 -23.518 1.00 22.27 N ATOM 536 CA LEU A 53 -20.472 -3.904 -22.296 1.00 22.13 C ATOM 537 C LEU A 53 -21.650 -4.852 -22.253 1.00 22.49 C ATOM 538 O LEU A 53 -22.416 -4.971 -23.229 1.00 20.35 O ATOM 539 CB LEU A 53 -20.924 -2.426 -22.237 1.00 23.35 C ATOM 540 CG LEU A 53 -21.238 -1.905 -20.843 1.00 23.25 C ATOM 541 CD1 LEU A 53 -20.059 -2.031 -19.859 1.00 22.63 C ATOM 542 CD2 LEU A 53 -21.699 -0.477 -20.920 1.00 24.73 C ATOM 543 H LEU A 53 -19.948 -3.579 -24.349 1.00 0.00 H ATOM 544 N VAL A 54 -21.756 -5.557 -21.134 1.00 21.21 N ATOM 545 CA VAL A 54 -22.748 -6.606 -20.935 1.00 20.92 C ATOM 546 C VAL A 54 -23.611 -6.195 -19.754 1.00 21.97 C ATOM 547 O VAL A 54 -23.097 -5.762 -18.735 1.00 23.35 O ATOM 548 CB VAL A 54 -22.060 -7.950 -20.669 1.00 20.64 C ATOM 549 CG1 VAL A 54 -23.085 -9.059 -20.464 1.00 20.22 C ATOM 550 CG2 VAL A 54 -21.115 -8.268 -21.827 1.00 20.52 C ATOM 551 H VAL A 54 -21.096 -5.350 -20.357 1.00 0.00 H ATOM 552 N ASN A 55 -24.923 -6.315 -19.901 1.00 22.43 N ATOM 553 CA ASN A 55 -25.861 -6.004 -18.813 1.00 22.87 C ATOM 554 C ASN A 55 -25.875 -7.061 -17.747 1.00 20.46 C ATOM 555 O ASN A 55 -25.942 -8.249 -18.057 1.00 19.66 O ATOM 556 CB ASN A 55 -27.273 -5.876 -19.381 1.00 25.37 C ATOM 557 CG ASN A 55 -27.410 -4.682 -20.273 1.00 30.06 C ATOM 558 OD1 ASN A 55 -26.611 -3.744 -20.176 1.00 34.10 O ATOM 559 ND2 ASN A 55 -28.425 -4.686 -21.148 1.00 33.70 N ATOM 560 HD22 ASN A 55 -29.071 -5.500 -21.191 1.00 0.00 H ATOM 561 HD21 ASN A 55 -28.567 -3.875 -21.784 1.00 0.00 H ATOM 562 H ASN A 55 -25.300 -6.639 -20.814 1.00 0.00 H ATOM 563 N ILE A 56 -25.844 -6.647 -16.484 1.00 19.58 N ATOM 564 CA ILE A 56 -26.013 -7.604 -15.388 1.00 19.28 C ATOM 565 C ILE A 56 -27.462 -7.621 -14.934 1.00 18.57 C ATOM 566 O ILE A 56 -27.953 -6.590 -14.535 1.00 18.81 O ATOM 567 CB ILE A 56 -25.115 -7.229 -14.209 1.00 18.02 C ATOM 568 CG1 ILE A 56 -23.646 -7.502 -14.599 1.00 18.57 C ATOM 569 CG2 ILE A 56 -25.548 -7.952 -12.949 1.00 17.41 C ATOM 570 CD1 ILE A 56 -22.635 -6.968 -13.607 1.00 18.79 C ATOM 571 H ILE A 56 -25.699 -5.639 -16.273 1.00 0.00 H ATOM 572 N LEU A 57 -28.105 -8.789 -14.945 1.00 17.10 N ATOM 573 CA LEU A 57 -29.522 -8.904 -14.626 1.00 19.04 C ATOM 574 C LEU A 57 -29.767 -9.105 -13.102 1.00 21.45 C ATOM 575 O LEU A 57 -30.835 -8.809 -12.609 1.00 20.16 O ATOM 576 CB LEU A 57 -30.162 -10.085 -15.387 1.00 18.64 C ATOM 577 CG LEU A 57 -30.161 -9.905 -16.919 1.00 18.77 C ATOM 578 CD1 LEU A 57 -30.536 -11.193 -17.589 1.00 18.12 C ATOM 579 CD2 LEU A 57 -31.150 -8.804 -17.336 1.00 19.37 C ATOM 580 H LEU A 57 -27.575 -9.650 -15.190 1.00 0.00 H ATOM 581 N ASP A 58 -28.766 -9.627 -12.402 1.00 21.91 N ATOM 582 CA ASP A 58 -28.889 -9.972 -11.016 1.00 22.71 C ATOM 583 C ASP A 58 -27.501 -10.208 -10.457 1.00 20.97 C ATOM 584 O ASP A 58 -26.635 -10.815 -11.113 1.00 19.84 O ATOM 585 CB ASP A 58 -29.679 -11.255 -10.881 1.00 27.03 C ATOM 586 CG ASP A 58 -30.234 -11.429 -9.528 1.00 32.32 C ATOM 587 OD1 ASP A 58 -30.982 -10.529 -9.077 1.00 37.50 O ATOM 588 OD2 ASP A 58 -29.902 -12.442 -8.891 1.00 37.87 O ATOM 589 H ASP A 58 -27.856 -9.792 -12.879 1.00 0.00 H ATOM 590 N ALA A 59 -27.317 -9.803 -9.218 1.00 19.47 N ATOM 591 CA ALA A 59 -26.045 -9.961 -8.518 1.00 19.39 C ATOM 592 C ALA A 59 -26.390 -10.419 -7.100 1.00 22.34 C ATOM 593 O ALA A 59 -27.241 -9.787 -6.453 1.00 22.52 O ATOM 594 CB ALA A 59 -25.272 -8.658 -8.522 1.00 18.76 C ATOM 595 H ALA A 59 -28.109 -9.352 -8.717 1.00 0.00 H ATOM 596 N VAL A 60 -25.845 -11.581 -6.707 1.00 21.19 N ATOM 597 CA VAL A 60 -26.043 -12.157 -5.407 1.00 21.81 C ATOM 598 C VAL A 60 -24.669 -12.263 -4.713 1.00 22.93 C ATOM 599 O VAL A 60 -23.772 -13.056 -5.119 1.00 21.04 O ATOM 600 CB VAL A 60 -26.740 -13.538 -5.513 1.00 22.23 C ATOM 601 CG1 VAL A 60 -26.774 -14.230 -4.172 1.00 20.24 C ATOM 602 CG2 VAL A 60 -28.161 -13.397 -6.065 1.00 21.64 C ATOM 603 H VAL A 60 -25.244 -12.094 -7.384 1.00 0.00 H ATOM 604 N GLU A 61 -24.502 -11.455 -3.663 1.00 22.83 N ATOM 605 CA GLU A 61 -23.316 -11.535 -2.789 1.00 24.77 C ATOM 606 C GLU A 61 -23.471 -12.638 -1.725 1.00 26.08 C ATOM 607 O GLU A 61 -24.394 -12.581 -0.899 1.00 30.15 O ATOM 608 CB GLU A 61 -22.997 -10.187 -2.129 1.00 25.51 C ATOM 609 CG GLU A 61 -22.697 -9.062 -3.132 1.00 24.74 C ATOM 610 CD GLU A 61 -22.247 -7.764 -2.488 1.00 27.24 C ATOM 611 OE1 GLU A 61 -22.267 -7.648 -1.251 1.00 28.01 O ATOM 612 OE2 GLU A 61 -21.857 -6.851 -3.227 1.00 28.86 O ATOM 613 H GLU A 61 -25.233 -10.745 -3.454 1.00 0.00 H ATOM 614 N LEU A 62 -22.584 -13.631 -1.762 1.00 22.09 N ATOM 615 CA LEU A 62 -22.705 -14.828 -0.939 1.00 22.27 C ATOM 616 C LEU A 62 -22.154 -14.641 0.495 1.00 22.06 C ATOM 617 O LEU A 62 -20.989 -14.263 0.688 1.00 21.82 O ATOM 618 CB LEU A 62 -21.960 -15.984 -1.610 1.00 22.90 C ATOM 619 CG LEU A 62 -22.487 -16.405 -2.976 1.00 23.29 C ATOM 620 CD1 LEU A 62 -21.526 -17.433 -3.550 1.00 23.33 C ATOM 621 CD2 LEU A 62 -23.918 -16.970 -2.865 1.00 24.21 C ATOM 622 H LEU A 62 -21.771 -13.549 -2.405 1.00 0.00 H ATOM 623 N VAL A 63 -22.997 -14.932 1.483 1.00 21.48 N ATOM 624 CA VAL A 63 -22.567 -14.913 2.902 1.00 21.98 C ATOM 625 C VAL A 63 -22.818 -16.281 3.515 1.00 22.65 C ATOM 626 O VAL A 63 -23.661 -17.030 3.052 1.00 26.18 O ATOM 627 CB VAL A 63 -23.302 -13.815 3.711 1.00 21.79 C ATOM 628 CG1 VAL A 63 -22.904 -12.416 3.235 1.00 22.55 C ATOM 629 CG2 VAL A 63 -24.815 -14.009 3.678 1.00 22.27 C ATOM 630 H VAL A 63 -23.981 -15.179 1.254 1.00 0.00 H ATOM 631 N ASP A 64 -22.097 -16.621 4.559 1.00 24.32 N ATOM 632 CA ASP A 64 -22.385 -17.884 5.203 1.00 26.58 C ATOM 633 C ASP A 64 -23.570 -17.725 6.162 1.00 29.30 C ATOM 634 O ASP A 64 -24.236 -16.683 6.159 1.00 31.43 O ATOM 635 CB ASP A 64 -21.139 -18.467 5.870 1.00 26.97 C ATOM 636 CG ASP A 64 -20.801 -17.791 7.168 1.00 24.88 C ATOM 637 OD1 ASP A 64 -21.555 -16.910 7.569 1.00 27.01 O ATOM 638 OD2 ASP A 64 -19.781 -18.123 7.776 1.00 25.92 O ATOM 639 H ASP A 64 -21.341 -16.000 4.912 1.00 0.00 H ATOM 640 N GLU A 65 -23.819 -18.769 6.960 1.00 31.52 N ATOM 641 CA GLU A 65 -24.948 -18.822 7.892 1.00 31.68 C ATOM 642 C GLU A 65 -24.863 -17.829 9.023 1.00 30.50 C ATOM 643 O GLU A 65 -25.881 -17.440 9.547 1.00 31.97 O ATOM 644 CB GLU A 65 -25.085 -20.211 8.520 1.00 34.97 C ATOM 645 CG GLU A 65 -24.324 -20.395 9.864 1.00 37.52 C ATOM 646 CD GLU A 65 -22.874 -20.842 9.710 1.00 40.68 C ATOM 647 OE1 GLU A 65 -22.437 -21.129 8.553 1.00 43.86 O ATOM 648 OE2 GLU A 65 -22.171 -20.960 10.761 1.00 41.55 O ATOM 649 H GLU A 65 -23.177 -19.586 6.917 1.00 0.00 H ATOM 650 N GLN A 66 -23.656 -17.478 9.431 1.00 32.36 N ATOM 651 CA GLN A 66 -23.409 -16.427 10.422 1.00 34.31 C ATOM 652 C GLN A 66 -23.499 -15.028 9.788 1.00 29.63 C ATOM 653 O GLN A 66 -23.107 -14.059 10.393 1.00 31.84 O ATOM 654 CB GLN A 66 -21.982 -16.587 10.993 1.00 38.61 C ATOM 655 CG GLN A 66 -21.650 -17.956 11.607 1.00 43.61 C ATOM 656 CD GLN A 66 -20.162 -18.385 11.460 1.00 47.61 C ATOM 657 OE1 GLN A 66 -19.239 -17.808 12.088 1.00 45.19 O ATOM 658 NE2 GLN A 66 -19.936 -19.451 10.672 1.00 46.57 N ATOM 659 HE22 GLN A 66 -20.726 -19.902 10.168 1.00 0.00 H ATOM 660 HE21 GLN A 66 -18.971 -19.825 10.567 1.00 0.00 H ATOM 661 H GLN A 66 -22.837 -17.975 9.027 1.00 0.00 H ATOM 662 N GLY A 67 -23.950 -14.926 8.545 1.00 28.15 N ATOM 663 CA GLY A 67 -23.908 -13.664 7.802 1.00 25.03 C ATOM 664 C GLY A 67 -22.503 -13.157 7.494 1.00 22.65 C ATOM 665 O GLY A 67 -22.323 -11.974 7.202 1.00 24.35 O ATOM 666 H GLY A 67 -24.346 -15.769 8.083 1.00 0.00 H ATOM 667 N VAL A 68 -21.496 -14.009 7.525 1.00 21.61 N ATOM 668 CA VAL A 68 -20.126 -13.542 7.279 1.00 22.04 C ATOM 669 C VAL A 68 -19.826 -13.656 5.763 1.00 23.35 C ATOM 670 O VAL A 68 -20.247 -14.599 5.100 1.00 21.93 O ATOM 671 CB VAL A 68 -19.084 -14.289 8.117 1.00 23.89 C ATOM 672 CG1 VAL A 68 -17.658 -13.814 7.803 1.00 25.61 C ATOM 673 CG2 VAL A 68 -19.391 -14.149 9.619 1.00 22.21 C ATOM 674 H VAL A 68 -21.673 -15.014 7.724 1.00 0.00 H ATOM 675 N ASN A 69 -19.133 -12.636 5.269 1.00 22.90 N ATOM 676 CA ASN A 69 -18.652 -12.510 3.903 1.00 23.08 C ATOM 677 C ASN A 69 -17.967 -13.737 3.363 1.00 20.82 C ATOM 678 O ASN A 69 -17.104 -14.303 4.018 1.00 20.72 O ATOM 679 CB ASN A 69 -17.665 -11.338 3.868 1.00 21.79 C ATOM 680 CG ASN A 69 -17.119 -11.066 2.479 1.00 21.56 C ATOM 681 OD1 ASN A 69 -17.885 -11.023 1.524 1.00 22.52 O ATOM 682 ND2 ASN A 69 -15.796 -10.930 2.353 1.00 18.15 N ATOM 683 HD22 ASN A 69 -15.186 -10.974 3.194 1.00 0.00 H ATOM 684 HD21 ASN A 69 -15.376 -10.780 1.414 1.00 0.00 H ATOM 685 H ASN A 69 -18.914 -11.855 5.920 1.00 0.00 H ATOM 686 N LEU A 70 -18.353 -14.167 2.155 1.00 21.89 N ATOM 687 CA LEU A 70 -17.602 -15.206 1.475 1.00 19.08 C ATOM 688 C LEU A 70 -16.783 -14.666 0.299 1.00 19.59 C ATOM 689 O LEU A 70 -15.990 -15.409 -0.317 1.00 18.71 O ATOM 690 CB LEU A 70 -18.543 -16.351 1.062 1.00 20.86 C ATOM 691 CG LEU A 70 -19.308 -16.982 2.246 1.00 20.13 C ATOM 692 CD1 LEU A 70 -20.218 -18.097 1.742 1.00 19.79 C ATOM 693 CD2 LEU A 70 -18.279 -17.500 3.250 1.00 20.30 C ATOM 694 H LEU A 70 -19.194 -13.755 1.703 1.00 0.00 H ATOM 695 N GLU A 71 -16.955 -13.383 0.013 1.00 18.65 N ATOM 696 CA GLU A 71 -16.158 -12.671 -0.970 1.00 18.92 C ATOM 697 C GLU A 71 -16.404 -13.126 -2.407 1.00 18.73 C ATOM 698 O GLU A 71 -15.520 -13.028 -3.282 1.00 16.78 O ATOM 699 CB GLU A 71 -14.692 -12.732 -0.585 1.00 19.59 C ATOM 700 CG GLU A 71 -13.767 -11.780 -1.295 1.00 21.41 C ATOM 701 CD GLU A 71 -14.197 -10.347 -1.194 1.00 25.06 C ATOM 702 OE1 GLU A 71 -14.846 -9.960 -0.190 1.00 24.75 O ATOM 703 OE2 GLU A 71 -13.920 -9.614 -2.158 1.00 26.23 O ATOM 704 H GLU A 71 -17.698 -12.860 0.518 1.00 0.00 H ATOM 705 N LEU A 72 -17.628 -13.588 -2.667 1.00 19.55 N ATOM 706 CA LEU A 72 -18.021 -13.982 -4.012 1.00 18.25 C ATOM 707 C LEU A 72 -19.303 -13.300 -4.352 1.00 19.23 C ATOM 708 O LEU A 72 -20.210 -13.210 -3.518 1.00 18.17 O ATOM 709 CB LEU A 72 -18.194 -15.509 -4.133 1.00 18.94 C ATOM 710 CG LEU A 72 -16.942 -16.375 -3.896 1.00 19.74 C ATOM 711 CD1 LEU A 72 -17.271 -17.849 -3.703 1.00 20.47 C ATOM 712 CD2 LEU A 72 -15.934 -16.204 -5.045 1.00 20.28 C ATOM 713 H LEU A 72 -18.317 -13.668 -1.892 1.00 0.00 H ATOM 714 N THR A 73 -19.406 -12.882 -5.614 1.00 18.30 N ATOM 715 CA THR A 73 -20.662 -12.404 -6.168 1.00 18.72 C ATOM 716 C THR A 73 -21.038 -13.191 -7.406 1.00 18.06 C ATOM 717 O THR A 73 -20.274 -13.305 -8.409 1.00 16.73 O ATOM 718 CB THR A 73 -20.571 -10.899 -6.490 1.00 19.99 C ATOM 719 OG1 THR A 73 -20.239 -10.201 -5.286 1.00 19.90 O ATOM 720 CG2 THR A 73 -21.859 -10.374 -7.051 1.00 19.99 C ATOM 721 HG1 THR A 73 -20.176 -9.231 -5.475 1.00 0.00 H ATOM 722 H THR A 73 -18.562 -12.898 -6.221 1.00 0.00 H ATOM 723 N LEU A 74 -22.222 -13.752 -7.331 1.00 19.15 N ATOM 724 CA LEU A 74 -22.810 -14.469 -8.449 1.00 21.32 C ATOM 725 C LEU A 74 -23.548 -13.464 -9.313 1.00 22.30 C ATOM 726 O LEU A 74 -24.476 -12.792 -8.847 1.00 22.73 O ATOM 727 CB LEU A 74 -23.790 -15.521 -7.972 1.00 21.53 C ATOM 728 CG LEU A 74 -23.401 -16.994 -7.849 1.00 24.25 C ATOM 729 CD1 LEU A 74 -21.909 -17.227 -7.663 1.00 25.83 C ATOM 730 CD2 LEU A 74 -24.225 -17.651 -6.759 1.00 22.64 C ATOM 731 H LEU A 74 -22.757 -13.681 -6.442 1.00 0.00 H ATOM 732 N ILE A 75 -23.154 -13.389 -10.582 1.00 21.13 N ATOM 733 CA ILE A 75 -23.835 -12.534 -11.542 1.00 20.16 C ATOM 734 C ILE A 75 -24.494 -13.344 -12.688 1.00 18.33 C ATOM 735 O ILE A 75 -24.003 -14.354 -13.173 1.00 19.44 O ATOM 736 CB ILE A 75 -22.903 -11.400 -12.051 1.00 19.55 C ATOM 737 CG1 ILE A 75 -21.655 -11.972 -12.698 1.00 19.45 C ATOM 738 CG2 ILE A 75 -22.459 -10.534 -10.872 1.00 20.59 C ATOM 739 CD1 ILE A 75 -20.844 -10.998 -13.500 1.00 19.46 C ATOM 740 H ILE A 75 -22.340 -13.955 -10.895 1.00 0.00 H ATOM 741 N THR A 76 -25.654 -12.876 -13.080 1.00 17.78 N ATOM 742 CA THR A 76 -26.461 -13.465 -14.150 1.00 17.56 C ATOM 743 C THR A 76 -26.418 -12.477 -15.298 1.00 16.10 C ATOM 744 O THR A 76 -26.728 -11.316 -15.102 1.00 14.33 O ATOM 745 CB THR A 76 -27.897 -13.666 -13.690 1.00 16.58 C ATOM 746 OG1 THR A 76 -27.873 -14.606 -12.646 1.00 17.07 O ATOM 747 CG2 THR A 76 -28.770 -14.224 -14.802 1.00 17.54 C ATOM 748 HG1 THR A 76 -28.795 -14.761 -12.322 1.00 0.00 H ATOM 749 H THR A 76 -26.025 -12.031 -12.600 1.00 0.00 H ATOM 750 N LEU A 77 -25.938 -12.919 -16.468 1.00 17.05 N ATOM 751 CA LEU A 77 -25.662 -12.008 -17.562 1.00 18.01 C ATOM 752 C LEU A 77 -26.772 -11.995 -18.604 1.00 19.07 C ATOM 753 O LEU A 77 -27.448 -13.020 -18.846 1.00 21.03 O ATOM 754 CB LEU A 77 -24.370 -12.415 -18.281 1.00 18.68 C ATOM 755 CG LEU A 77 -23.158 -12.565 -17.403 1.00 19.58 C ATOM 756 CD1 LEU A 77 -22.035 -13.083 -18.294 1.00 18.12 C ATOM 757 CD2 LEU A 77 -22.856 -11.171 -16.780 1.00 19.89 C ATOM 758 H LEU A 77 -25.760 -13.936 -16.594 1.00 0.00 H ATOM 759 N ASP A 78 -26.939 -10.836 -19.256 1.00 18.80 N ATOM 760 CA ASP A 78 -27.891 -10.727 -20.361 1.00 18.00 C ATOM 761 C ASP A 78 -27.090 -11.027 -21.630 1.00 19.35 C ATOM 762 O ASP A 78 -26.587 -10.171 -22.288 1.00 17.41 O ATOM 763 CB ASP A 78 -28.502 -9.354 -20.429 1.00 17.49 C ATOM 764 CG ASP A 78 -29.442 -9.187 -21.594 1.00 17.11 C ATOM 765 OD1 ASP A 78 -29.784 -10.183 -22.253 1.00 16.07 O ATOM 766 OD2 ASP A 78 -29.879 -8.045 -21.779 1.00 16.92 O ATOM 767 H ASP A 78 -26.384 -10.003 -18.972 1.00 0.00 H ATOM 768 N THR A 79 -26.944 -12.294 -21.919 1.00 24.06 N ATOM 769 CA THR A 79 -26.238 -12.717 -23.104 1.00 26.17 C ATOM 770 C THR A 79 -26.920 -13.874 -23.758 1.00 26.57 C ATOM 771 O THR A 79 -27.752 -14.554 -23.149 1.00 27.71 O ATOM 772 CB THR A 79 -24.839 -13.209 -22.747 1.00 27.17 C ATOM 773 OG1 THR A 79 -24.943 -14.179 -21.697 1.00 27.06 O ATOM 774 CG2 THR A 79 -24.010 -12.074 -22.315 1.00 28.21 C ATOM 775 HG1 THR A 79 -25.498 -14.939 -22.005 1.00 0.00 H ATOM 776 H THR A 79 -27.345 -13.011 -21.282 1.00 0.00 H ATOM 777 N ASN A 80 -26.528 -14.094 -25.014 1.00 30.01 N ATOM 778 CA ASN A 80 -26.936 -15.244 -25.818 1.00 31.23 C ATOM 779 C ASN A 80 -26.115 -16.448 -25.422 1.00 33.48 C ATOM 780 O ASN A 80 -26.609 -17.559 -25.383 1.00 41.60 O ATOM 781 CB ASN A 80 -26.623 -14.952 -27.297 1.00 31.64 C ATOM 782 CG ASN A 80 -27.386 -13.770 -27.833 1.00 35.42 C ATOM 783 OD1 ASN A 80 -26.807 -12.808 -28.349 1.00 39.62 O ATOM 784 ND2 ASN A 80 -28.702 -13.822 -27.699 1.00 36.57 N ATOM 785 HD22 ASN A 80 -29.147 -14.652 -27.258 1.00 0.00 H ATOM 786 HD21 ASN A 80 -29.290 -13.033 -28.034 1.00 0.00 H ATOM 787 H ASN A 80 -25.888 -13.400 -25.451 1.00 0.00 H ATOM 788 N GLU A 81 -24.822 -16.241 -25.179 1.00 33.76 N ATOM 789 CA GLU A 81 -23.935 -17.351 -24.797 1.00 32.51 C ATOM 790 C GLU A 81 -24.411 -18.094 -23.535 1.00 29.86 C ATOM 791 O GLU A 81 -24.830 -17.470 -22.593 1.00 33.31 O ATOM 792 CB GLU A 81 -22.525 -16.822 -24.551 1.00 32.25 C ATOM 793 CG GLU A 81 -21.570 -17.907 -24.132 1.00 33.54 C ATOM 794 CD GLU A 81 -20.173 -17.411 -23.981 1.00 34.10 C ATOM 795 OE1 GLU A 81 -19.271 -18.257 -23.906 1.00 33.39 O ATOM 796 OE2 GLU A 81 -19.988 -16.186 -23.962 1.00 38.46 O ATOM 797 H GLU A 81 -24.433 -15.280 -25.261 1.00 0.00 H ATOM 798 N LYS A 82 -24.387 -19.429 -23.559 1.00 29.20 N ATOM 799 CA LYS A 82 -24.352 -20.230 -22.356 1.00 28.31 C ATOM 800 C LYS A 82 -22.899 -20.645 -22.225 1.00 24.83 C ATOM 801 O LYS A 82 -22.294 -21.075 -23.218 1.00 24.41 O ATOM 802 CB LYS A 82 -25.242 -21.462 -22.466 1.00 28.66 C ATOM 803 CG LYS A 82 -26.654 -21.146 -22.948 1.00 32.10 C ATOM 804 CD LYS A 82 -27.708 -21.857 -22.113 1.00 34.95 C ATOM 805 CE LYS A 82 -27.844 -23.340 -22.429 1.00 36.82 C ATOM 806 NZ LYS A 82 -29.156 -23.644 -23.071 1.00 36.04 N ATOM 807 HZ1 LYS A 82 -29.927 -23.372 -22.428 1.00 0.00 H ATOM 808 HZ2 LYS A 82 -29.238 -23.109 -23.959 1.00 0.00 H ATOM 809 HZ3 LYS A 82 -29.214 -24.663 -23.272 1.00 0.00 H ATOM 810 H LYS A 82 -24.394 -19.912 -24.480 1.00 0.00 H ATOM 811 N PHE A 83 -22.330 -20.490 -21.023 1.00 21.49 N ATOM 812 CA PHE A 83 -20.949 -20.912 -20.743 1.00 20.07 C ATOM 813 C PHE A 83 -20.933 -22.414 -20.850 1.00 20.73 C ATOM 814 O PHE A 83 -21.890 -23.058 -20.435 1.00 21.69 O ATOM 815 CB PHE A 83 -20.512 -20.532 -19.297 1.00 19.38 C ATOM 816 CG PHE A 83 -20.358 -19.047 -19.083 1.00 19.06 C ATOM 817 CD1 PHE A 83 -19.383 -18.326 -19.779 1.00 19.12 C ATOM 818 CD2 PHE A 83 -21.256 -18.346 -18.273 1.00 19.32 C ATOM 819 CE1 PHE A 83 -19.264 -16.933 -19.635 1.00 19.73 C ATOM 820 CE2 PHE A 83 -21.141 -16.969 -18.123 1.00 18.90 C ATOM 821 CZ PHE A 83 -20.135 -16.259 -18.796 1.00 19.54 C ATOM 822 H PHE A 83 -22.885 -20.055 -20.259 1.00 0.00 H ATOM 823 N ARG A 84 -19.858 -22.989 -21.374 1.00 20.68 N ATOM 824 CA ARG A 84 -19.661 -24.393 -21.182 1.00 21.57 C ATOM 825 C ARG A 84 -19.833 -24.683 -19.702 1.00 21.51 C ATOM 826 O ARG A 84 -19.238 -24.008 -18.870 1.00 23.36 O ATOM 827 CB ARG A 84 -18.268 -24.843 -21.628 1.00 22.63 C ATOM 828 CG ARG A 84 -18.025 -26.270 -21.163 1.00 23.54 C ATOM 829 CD ARG A 84 -16.631 -26.746 -21.415 1.00 26.11 C ATOM 830 NE ARG A 84 -15.621 -25.953 -20.740 1.00 26.51 N ATOM 831 CZ ARG A 84 -14.347 -26.301 -20.703 1.00 27.51 C ATOM 832 NH1 ARG A 84 -13.945 -27.419 -21.298 1.00 28.54 N ATOM 833 NH2 ARG A 84 -13.474 -25.554 -20.060 1.00 25.18 N ATOM 834 HE ARG A 84 -15.912 -25.074 -20.266 1.00 0.00 H ATOM 835 HH12 ARG A 84 -12.942 -27.692 -21.268 1.00 0.00 H ATOM 836 HH11 ARG A 84 -14.633 -28.021 -21.793 1.00 0.00 H ATOM 837 HH22 ARG A 84 -12.472 -25.831 -20.033 1.00 0.00 H ATOM 838 HH21 ARG A 84 -13.786 -24.687 -19.579 1.00 0.00 H ATOM 839 H ARG A 84 -19.170 -22.428 -21.916 1.00 0.00 H ATOM 840 N ASP A 85 -20.637 -25.683 -19.359 1.00 20.89 N ATOM 841 CA ASP A 85 -20.912 -26.007 -17.945 1.00 19.10 C ATOM 842 C ASP A 85 -19.720 -26.707 -17.341 1.00 19.72 C ATOM 843 O ASP A 85 -19.432 -27.850 -17.675 1.00 22.44 O ATOM 844 CB ASP A 85 -22.092 -26.956 -17.835 1.00 19.19 C ATOM 845 CG ASP A 85 -22.577 -27.145 -16.430 1.00 19.18 C ATOM 846 OD1 ASP A 85 -21.827 -27.066 -15.442 1.00 18.51 O ATOM 847 OD2 ASP A 85 -23.760 -27.445 -16.302 1.00 21.24 O ATOM 848 H ASP A 85 -21.084 -26.252 -20.106 1.00 0.00 H ATOM 849 N ILE A 86 -19.080 -26.051 -16.389 1.00 19.72 N ATOM 850 CA ILE A 86 -17.965 -26.627 -15.659 1.00 19.92 C ATOM 851 C ILE A 86 -18.304 -26.974 -14.207 1.00 18.15 C ATOM 852 O ILE A 86 -17.407 -27.169 -13.418 1.00 17.25 O ATOM 853 CB ILE A 86 -16.764 -25.664 -15.653 1.00 20.79 C ATOM 854 CG1 ILE A 86 -17.163 -24.329 -15.020 1.00 21.96 C ATOM 855 CG2 ILE A 86 -16.227 -25.502 -17.060 1.00 19.97 C ATOM 856 CD1 ILE A 86 -16.013 -23.350 -14.891 1.00 23.70 C ATOM 857 H ILE A 86 -19.387 -25.085 -16.154 1.00 0.00 H ATOM 858 N THR A 87 -19.574 -27.067 -13.863 1.00 17.79 N ATOM 859 CA THR A 87 -19.974 -27.379 -12.484 1.00 19.07 C ATOM 860 C THR A 87 -19.487 -28.723 -11.951 1.00 20.57 C ATOM 861 O THR A 87 -19.216 -28.915 -10.744 1.00 19.12 O ATOM 862 CB THR A 87 -21.520 -27.239 -12.288 1.00 18.99 C ATOM 863 OG1 THR A 87 -22.272 -28.027 -13.208 1.00 17.65 O ATOM 864 CG2 THR A 87 -21.934 -25.829 -12.478 1.00 19.13 C ATOM 865 HG1 THR A 87 -22.059 -27.746 -14.133 1.00 0.00 H ATOM 866 H THR A 87 -20.308 -26.916 -14.584 1.00 0.00 H ATOM 867 N LYS A 88 -19.368 -29.685 -12.855 1.00 22.43 N ATOM 868 CA LYS A 88 -18.891 -30.967 -12.435 1.00 23.05 C ATOM 869 C LYS A 88 -17.395 -30.932 -12.134 1.00 22.15 C ATOM 870 O LYS A 88 -16.918 -31.876 -11.553 1.00 19.43 O ATOM 871 CB LYS A 88 -19.163 -32.003 -13.488 1.00 24.41 C ATOM 872 CG LYS A 88 -18.321 -31.800 -14.721 1.00 25.41 C ATOM 873 CD LYS A 88 -18.889 -32.630 -15.837 1.00 27.90 C ATOM 874 CE LYS A 88 -18.089 -32.375 -17.074 1.00 29.21 C ATOM 875 NZ LYS A 88 -18.966 -32.784 -18.187 1.00 29.52 N ATOM 876 HZ1 LYS A 88 -19.206 -33.791 -18.085 1.00 0.00 H ATOM 877 HZ2 LYS A 88 -19.836 -32.215 -18.168 1.00 0.00 H ATOM 878 HZ3 LYS A 88 -18.472 -32.634 -19.090 1.00 0.00 H ATOM 879 H LYS A 88 -19.616 -29.511 -13.850 1.00 0.00 H ATOM 880 N PHE A 89 -16.662 -29.891 -12.548 1.00 20.68 N ATOM 881 CA PHE A 89 -15.245 -29.783 -12.138 1.00 22.02 C ATOM 882 C PHE A 89 -15.041 -29.079 -10.800 1.00 21.94 C ATOM 883 O PHE A 89 -13.920 -29.085 -10.259 1.00 20.98 O ATOM 884 CB PHE A 89 -14.352 -29.097 -13.178 1.00 24.18 C ATOM 885 CG PHE A 89 -14.483 -29.629 -14.562 1.00 25.68 C ATOM 886 CD1 PHE A 89 -14.394 -30.979 -14.824 1.00 27.09 C ATOM 887 CD2 PHE A 89 -14.667 -28.764 -15.623 1.00 28.13 C ATOM 888 CE1 PHE A 89 -14.502 -31.452 -16.125 1.00 26.25 C ATOM 889 CE2 PHE A 89 -14.782 -29.229 -16.925 1.00 28.13 C ATOM 890 CZ PHE A 89 -14.703 -30.586 -17.173 1.00 26.60 C ATOM 891 H PHE A 89 -17.087 -29.161 -13.155 1.00 0.00 H ATOM 892 N ILE A 90 -16.126 -28.548 -10.238 1.00 23.08 N ATOM 893 CA ILE A 90 -16.140 -27.862 -8.943 1.00 23.05 C ATOM 894 C ILE A 90 -16.554 -28.882 -7.871 1.00 24.70 C ATOM 895 O ILE A 90 -17.644 -29.533 -7.980 1.00 23.25 O ATOM 896 CB ILE A 90 -17.162 -26.718 -8.951 1.00 22.65 C ATOM 897 CG1 ILE A 90 -16.842 -25.707 -10.072 1.00 23.00 C ATOM 898 CG2 ILE A 90 -17.251 -26.036 -7.600 1.00 22.43 C ATOM 899 CD1 ILE A 90 -17.915 -24.667 -10.195 1.00 22.92 C ATOM 900 H ILE A 90 -17.026 -28.626 -10.754 1.00 0.00 H ATOM 901 N PRO A 91 -15.710 -29.035 -6.835 1.00 24.56 N ATOM 902 CA PRO A 91 -16.014 -30.042 -5.805 1.00 25.29 C ATOM 903 C PRO A 91 -17.262 -29.688 -5.026 1.00 25.25 C ATOM 904 O PRO A 91 -17.638 -28.518 -4.975 1.00 23.66 O ATOM 905 CB PRO A 91 -14.765 -30.056 -4.909 1.00 26.22 C ATOM 906 CG PRO A 91 -14.013 -28.817 -5.236 1.00 25.99 C ATOM 907 CD PRO A 91 -14.429 -28.339 -6.596 1.00 25.00 C ATOM 908 N GLU A 92 -17.905 -30.710 -4.470 1.00 25.25 N ATOM 909 CA GLU A 92 -19.091 -30.533 -3.657 1.00 28.40 C ATOM 910 C GLU A 92 -18.777 -29.801 -2.353 1.00 26.77 C ATOM 911 O GLU A 92 -19.664 -29.185 -1.751 1.00 25.62 O ATOM 912 CB GLU A 92 -19.740 -31.889 -3.355 1.00 32.03 C ATOM 913 CG GLU A 92 -19.842 -32.836 -4.535 1.00 37.03 C ATOM 914 CD GLU A 92 -21.122 -33.681 -4.540 1.00 42.01 C ATOM 915 OE1 GLU A 92 -22.229 -33.139 -4.299 1.00 50.63 O ATOM 916 OE2 GLU A 92 -21.042 -34.890 -4.825 1.00 44.52 O ATOM 917 H GLU A 92 -17.543 -31.673 -4.624 1.00 0.00 H ATOM 918 N ASN A 93 -17.519 -29.880 -1.903 1.00 27.52 N ATOM 919 CA ASN A 93 -17.097 -29.153 -0.727 1.00 26.87 C ATOM 920 C ASN A 93 -15.754 -28.543 -0.983 1.00 27.36 C ATOM 921 O ASN A 93 -15.066 -28.930 -1.897 1.00 24.40 O ATOM 922 CB ASN A 93 -17.066 -30.091 0.479 1.00 29.78 C ATOM 923 CG ASN A 93 -18.481 -30.544 0.873 1.00 32.22 C ATOM 924 OD1 ASN A 93 -18.961 -31.628 0.474 1.00 36.04 O ATOM 925 ND2 ASN A 93 -19.184 -29.678 1.577 1.00 33.11 N ATOM 926 HD22 ASN A 93 -18.748 -28.787 1.890 1.00 0.00 H ATOM 927 HD21 ASN A 93 -20.174 -29.886 1.819 1.00 0.00 H ATOM 928 H ASN A 93 -16.832 -30.475 -2.409 1.00 0.00 H ATOM 929 N ILE A 94 -15.385 -27.590 -0.147 1.00 27.82 N ATOM 930 CA ILE A 94 -14.183 -26.818 -0.361 1.00 28.57 C ATOM 931 C ILE A 94 -13.010 -27.732 -0.097 1.00 28.44 C ATOM 932 O ILE A 94 -12.891 -28.286 0.977 1.00 28.52 O ATOM 933 CB ILE A 94 -14.231 -25.518 0.466 1.00 29.65 C ATOM 934 CG1 ILE A 94 -15.418 -24.718 -0.027 1.00 29.95 C ATOM 935 CG2 ILE A 94 -12.933 -24.712 0.342 1.00 32.02 C ATOM 936 CD1 ILE A 94 -15.702 -23.454 0.731 1.00 33.08 C ATOM 937 H ILE A 94 -15.974 -27.390 0.686 1.00 0.00 H ATOM 938 N SER A 95 -12.201 -27.946 -1.130 1.00 26.68 N ATOM 939 CA SER A 95 -11.201 -28.990 -1.155 1.00 28.54 C ATOM 940 C SER A 95 -9.828 -28.428 -1.450 1.00 32.60 C ATOM 941 O SER A 95 -9.688 -27.478 -2.201 1.00 40.48 O ATOM 942 CB SER A 95 -11.500 -30.005 -2.244 1.00 27.89 C ATOM 943 OG SER A 95 -12.788 -30.567 -2.120 1.00 26.25 O ATOM 944 HG SER A 95 -13.467 -29.849 -2.177 1.00 0.00 H ATOM 945 H SER A 95 -12.292 -27.331 -1.963 1.00 0.00 H ATOM 946 N THR A 96 -8.811 -29.076 -0.915 1.00 29.63 N ATOM 947 CA THR A 96 -7.453 -28.644 -1.051 1.00 28.98 C ATOM 948 C THR A 96 -6.864 -29.264 -2.275 1.00 27.32 C ATOM 949 O THR A 96 -7.510 -30.040 -2.939 1.00 23.27 O ATOM 950 CB THR A 96 -6.664 -29.096 0.169 1.00 31.11 C ATOM 951 OG1 THR A 96 -6.603 -30.519 0.192 1.00 33.64 O ATOM 952 CG2 THR A 96 -7.357 -28.635 1.393 1.00 31.19 C ATOM 953 HG1 THR A 96 -6.090 -30.813 0.986 1.00 0.00 H ATOM 954 H THR A 96 -9.005 -29.940 -0.370 1.00 0.00 H ATOM 955 N ALA A 97 -5.620 -28.943 -2.580 1.00 29.23 N ATOM 956 CA ALA A 97 -4.975 -29.519 -3.750 1.00 29.80 C ATOM 957 C ALA A 97 -3.462 -29.434 -3.663 1.00 27.78 C ATOM 958 O ALA A 97 -2.924 -28.638 -2.915 1.00 32.28 O ATOM 959 CB ALA A 97 -5.468 -28.813 -5.015 1.00 30.43 C ATOM 960 H ALA A 97 -5.098 -28.274 -1.980 1.00 0.00 H ATOM 961 N SER A 98 -2.768 -30.243 -4.455 1.00 28.65 N ATOM 962 CA SER A 98 -1.307 -30.135 -4.523 1.00 32.14 C ATOM 963 C SER A 98 -0.907 -29.428 -5.797 1.00 32.19 C ATOM 964 O SER A 98 -1.492 -29.671 -6.847 1.00 31.35 O ATOM 965 CB SER A 98 -0.651 -31.508 -4.502 1.00 30.45 C ATOM 966 OG SER A 98 -0.857 -32.113 -3.251 1.00 28.78 O ATOM 967 HG SER A 98 -1.829 -32.211 -3.089 1.00 0.00 H ATOM 968 H SER A 98 -3.262 -30.956 -5.029 1.00 0.00 H ATOM 969 N ASP A 99 0.104 -28.574 -5.715 1.00 31.44 N ATOM 970 CA ASP A 99 0.692 -28.005 -6.919 1.00 31.42 C ATOM 971 C ASP A 99 -0.370 -27.439 -7.862 1.00 27.27 C ATOM 972 O ASP A 99 -0.383 -27.777 -9.045 1.00 24.60 O ATOM 973 CB ASP A 99 1.447 -29.078 -7.683 1.00 34.13 C ATOM 974 CG ASP A 99 2.899 -29.125 -7.363 1.00 38.95 C ATOM 975 OD1 ASP A 99 3.417 -28.295 -6.574 1.00 42.46 O ATOM 976 OD2 ASP A 99 3.525 -30.037 -7.922 1.00 43.48 O ATOM 977 H ASP A 99 0.480 -28.308 -4.782 1.00 0.00 H ATOM 978 N ALA A 100 -1.217 -26.564 -7.327 1.00 26.34 N ATOM 979 CA ALA A 100 -2.253 -25.861 -8.108 1.00 23.66 C ATOM 980 C ALA A 100 -1.650 -24.797 -9.016 1.00 24.67 C ATOM 981 O ALA A 100 -0.483 -24.390 -8.865 1.00 23.85 O ATOM 982 CB ALA A 100 -3.245 -25.205 -7.180 1.00 22.72 C ATOM 983 H ALA A 100 -1.146 -26.366 -6.309 1.00 0.00 H ATOM 984 N THR A 101 -2.447 -24.376 -9.990 1.00 21.66 N ATOM 985 CA THR A 101 -2.055 -23.327 -10.868 1.00 21.53 C ATOM 986 C THR A 101 -3.161 -22.288 -10.810 1.00 20.02 C ATOM 987 O THR A 101 -4.359 -22.609 -10.886 1.00 18.61 O ATOM 988 CB THR A 101 -1.860 -23.817 -12.296 1.00 20.17 C ATOM 989 OG1 THR A 101 -0.805 -24.753 -12.326 1.00 20.73 O ATOM 990 CG2 THR A 101 -1.454 -22.659 -13.209 1.00 19.48 C ATOM 991 HG1 THR A 101 0.027 -24.322 -12.006 1.00 0.00 H ATOM 992 H THR A 101 -3.378 -24.822 -10.114 1.00 0.00 H ATOM 993 N LEU A 102 -2.756 -21.045 -10.643 1.00 19.70 N ATOM 994 CA LEU A 102 -3.695 -19.935 -10.687 1.00 19.02 C ATOM 995 C LEU A 102 -3.768 -19.410 -12.115 1.00 20.07 C ATOM 996 O LEU A 102 -2.749 -19.087 -12.707 1.00 18.48 O ATOM 997 CB LEU A 102 -3.206 -18.853 -9.773 1.00 19.64 C ATOM 998 CG LEU A 102 -4.071 -17.661 -9.585 1.00 19.15 C ATOM 999 CD1 LEU A 102 -5.439 -18.081 -9.024 1.00 20.80 C ATOM 1000 CD2 LEU A 102 -3.355 -16.702 -8.654 1.00 20.21 C ATOM 1001 H LEU A 102 -1.747 -20.854 -10.477 1.00 0.00 H ATOM 1002 N VAL A 103 -4.976 -19.371 -12.661 1.00 21.01 N ATOM 1003 CA VAL A 103 -5.206 -18.897 -14.039 1.00 21.03 C ATOM 1004 C VAL A 103 -5.887 -17.528 -13.997 1.00 19.83 C ATOM 1005 O VAL A 103 -7.039 -17.348 -13.543 1.00 19.22 O ATOM 1006 CB VAL A 103 -6.035 -19.913 -14.854 1.00 22.00 C ATOM 1007 CG1 VAL A 103 -6.309 -19.427 -16.298 1.00 21.51 C ATOM 1008 CG2 VAL A 103 -5.327 -21.267 -14.819 1.00 22.11 C ATOM 1009 H VAL A 103 -5.791 -19.686 -12.097 1.00 0.00 H ATOM 1010 N ILE A 104 -5.126 -16.556 -14.470 1.00 17.60 N ATOM 1011 CA ILE A 104 -5.547 -15.180 -14.509 1.00 17.00 C ATOM 1012 C ILE A 104 -5.723 -14.752 -15.958 1.00 15.61 C ATOM 1013 O ILE A 104 -4.970 -15.174 -16.878 1.00 15.27 O ATOM 1014 CB ILE A 104 -4.476 -14.290 -13.864 1.00 17.07 C ATOM 1015 CG1 ILE A 104 -4.294 -14.582 -12.376 1.00 16.92 C ATOM 1016 CG2 ILE A 104 -4.783 -12.804 -14.030 1.00 17.32 C ATOM 1017 CD1 ILE A 104 -2.838 -14.466 -11.975 1.00 16.32 C ATOM 1018 H ILE A 104 -4.180 -16.796 -14.830 1.00 0.00 H ATOM 1019 N ASN A 105 -6.732 -13.896 -16.137 1.00 15.47 N ATOM 1020 CA ASN A 105 -7.099 -13.350 -17.444 1.00 15.42 C ATOM 1021 C ASN A 105 -7.771 -11.987 -17.334 1.00 14.90 C ATOM 1022 O ASN A 105 -8.989 -11.827 -17.135 1.00 15.24 O ATOM 1023 CB ASN A 105 -7.987 -14.311 -18.230 1.00 16.43 C ATOM 1024 CG ASN A 105 -8.008 -13.992 -19.684 1.00 16.93 C ATOM 1025 OD1 ASN A 105 -7.005 -13.506 -20.256 1.00 15.96 O ATOM 1026 ND2 ASN A 105 -9.145 -14.256 -20.318 1.00 19.36 N ATOM 1027 HD22 ASN A 105 -9.949 -14.660 -19.797 1.00 0.00 H ATOM 1028 HD21 ASN A 105 -9.231 -14.059 -21.336 1.00 0.00 H ATOM 1029 H ASN A 105 -7.285 -13.603 -15.306 1.00 0.00 H ATOM 1030 N THR A 106 -6.930 -11.013 -17.523 1.00 15.11 N ATOM 1031 CA THR A 106 -7.244 -9.616 -17.428 1.00 16.29 C ATOM 1032 C THR A 106 -6.629 -8.910 -18.662 1.00 17.77 C ATOM 1033 O THR A 106 -5.746 -9.459 -19.344 1.00 17.58 O ATOM 1034 CB THR A 106 -6.575 -9.200 -16.134 1.00 17.24 C ATOM 1035 OG1 THR A 106 -7.481 -9.410 -15.031 1.00 19.15 O ATOM 1036 CG2 THR A 106 -6.019 -7.912 -16.176 1.00 16.75 C ATOM 1037 HG1 THR A 106 -7.041 -9.137 -14.187 1.00 0.00 H ATOM 1038 H THR A 106 -5.950 -11.267 -17.762 1.00 0.00 H ATOM 1039 N GLU A 107 -7.066 -7.699 -18.951 1.00 19.83 N ATOM 1040 CA GLU A 107 -6.458 -6.934 -20.054 1.00 20.76 C ATOM 1041 C GLU A 107 -4.976 -6.677 -19.773 1.00 19.64 C ATOM 1042 O GLU A 107 -4.149 -6.699 -20.669 1.00 17.01 O ATOM 1043 CB GLU A 107 -7.217 -5.606 -20.222 1.00 23.02 C ATOM 1044 CG GLU A 107 -6.804 -4.849 -21.464 1.00 26.48 C ATOM 1045 CD GLU A 107 -7.228 -3.419 -21.417 1.00 29.49 C ATOM 1046 OE1 GLU A 107 -8.076 -3.045 -20.588 1.00 34.07 O ATOM 1047 OE2 GLU A 107 -6.687 -2.656 -22.212 1.00 36.47 O ATOM 1048 H GLU A 107 -7.842 -7.283 -18.398 1.00 0.00 H ATOM 1049 N HIS A 108 -4.641 -6.438 -18.514 1.00 19.53 N ATOM 1050 CA HIS A 108 -3.259 -6.214 -18.090 1.00 21.06 C ATOM 1051 C HIS A 108 -2.383 -7.471 -17.897 1.00 19.91 C ATOM 1052 O HIS A 108 -1.136 -7.401 -18.007 1.00 19.62 O ATOM 1053 CB HIS A 108 -3.236 -5.348 -16.800 1.00 23.41 C ATOM 1054 CG HIS A 108 -3.844 -3.980 -16.976 1.00 26.53 C ATOM 1055 ND1 HIS A 108 -3.867 -3.319 -18.190 1.00 29.71 N ATOM 1056 CD2 HIS A 108 -4.420 -3.136 -16.085 1.00 27.74 C ATOM 1057 CE1 HIS A 108 -4.428 -2.130 -18.044 1.00 28.83 C ATOM 1058 NE2 HIS A 108 -4.787 -2.000 -16.777 1.00 31.58 N ATOM 1059 H HIS A 108 -5.393 -6.408 -17.796 1.00 0.00 H ATOM 1060 N MET A 109 -3.025 -8.599 -17.646 1.00 18.40 N ATOM 1061 CA MET A 109 -2.401 -9.896 -17.346 1.00 18.90 C ATOM 1062 C MET A 109 -3.206 -10.958 -18.109 1.00 17.83 C ATOM 1063 O MET A 109 -3.894 -11.803 -17.546 1.00 21.09 O ATOM 1064 CB MET A 109 -2.342 -10.183 -15.813 1.00 18.72 C ATOM 1065 CG MET A 109 -1.279 -9.384 -15.053 1.00 19.97 C ATOM 1066 SD MET A 109 -1.159 -9.595 -13.246 1.00 22.59 S ATOM 1067 CE MET A 109 -2.123 -8.223 -12.650 1.00 23.31 C ATOM 1068 H MET A 109 -4.064 -8.566 -17.662 1.00 0.00 H ATOM 1069 N PRO A 110 -3.171 -10.884 -19.432 1.00 18.30 N ATOM 1070 CA PRO A 110 -3.881 -11.860 -20.229 1.00 18.41 C ATOM 1071 C PRO A 110 -3.256 -13.261 -20.211 1.00 17.22 C ATOM 1072 O PRO A 110 -2.000 -13.427 -20.290 1.00 18.69 O ATOM 1073 CB PRO A 110 -3.778 -11.262 -21.634 1.00 19.31 C ATOM 1074 CG PRO A 110 -2.392 -10.692 -21.627 1.00 18.23 C ATOM 1075 CD PRO A 110 -2.290 -10.042 -20.257 1.00 18.82 C ATOM 1076 N SER A 111 -4.137 -14.246 -20.182 1.00 16.53 N ATOM 1077 CA SER A 111 -3.808 -15.667 -20.252 1.00 17.14 C ATOM 1078 C SER A 111 -2.573 -16.032 -19.447 1.00 17.39 C ATOM 1079 O SER A 111 -1.646 -16.613 -20.011 1.00 17.47 O ATOM 1080 CB SER A 111 -3.582 -16.029 -21.715 1.00 18.13 C ATOM 1081 OG SER A 111 -4.817 -15.983 -22.398 1.00 19.07 O ATOM 1082 HG SER A 111 -5.194 -15.070 -22.335 1.00 0.00 H ATOM 1083 H SER A 111 -5.142 -13.989 -20.103 1.00 0.00 H ATOM 1084 N MET A 112 -2.588 -15.708 -18.144 1.00 18.17 N ATOM 1085 CA MET A 112 -1.418 -15.838 -17.239 1.00 19.08 C ATOM 1086 C MET A 112 -1.538 -17.029 -16.289 1.00 19.69 C ATOM 1087 O MET A 112 -2.538 -17.205 -15.566 1.00 20.78 O ATOM 1088 CB MET A 112 -1.184 -14.527 -16.472 1.00 17.73 C ATOM 1089 CG MET A 112 -0.082 -14.530 -15.395 1.00 18.22 C ATOM 1090 SD MET A 112 -0.071 -12.950 -14.522 1.00 18.91 S ATOM 1091 CE MET A 112 1.535 -13.022 -13.752 1.00 17.38 C ATOM 1092 H MET A 112 -3.475 -15.343 -17.743 1.00 0.00 H ATOM 1093 N PHE A 113 -0.490 -17.848 -16.287 1.00 22.13 N ATOM 1094 CA PHE A 113 -0.454 -19.069 -15.499 1.00 23.91 C ATOM 1095 C PHE A 113 0.523 -18.889 -14.360 1.00 22.56 C ATOM 1096 O PHE A 113 1.682 -18.629 -14.594 1.00 21.63 O ATOM 1097 CB PHE A 113 0.048 -20.230 -16.349 1.00 27.07 C ATOM 1098 CG PHE A 113 -0.913 -20.693 -17.400 1.00 31.48 C ATOM 1099 CD1 PHE A 113 -1.217 -22.026 -17.521 1.00 32.30 C ATOM 1100 CD2 PHE A 113 -1.483 -19.802 -18.308 1.00 35.92 C ATOM 1101 CE1 PHE A 113 -2.068 -22.470 -18.506 1.00 33.13 C ATOM 1102 CE2 PHE A 113 -2.356 -20.244 -19.269 1.00 36.67 C ATOM 1103 CZ PHE A 113 -2.653 -21.587 -19.370 1.00 32.94 C ATOM 1104 H PHE A 113 0.335 -17.606 -16.872 1.00 0.00 H ATOM 1105 N VAL A 114 0.055 -19.082 -13.143 1.00 22.40 N ATOM 1106 CA VAL A 114 0.866 -18.812 -11.967 1.00 23.11 C ATOM 1107 C VAL A 114 0.892 -20.052 -11.050 1.00 23.30 C ATOM 1108 O VAL A 114 -0.106 -20.424 -10.424 1.00 21.20 O ATOM 1109 CB VAL A 114 0.349 -17.576 -11.229 1.00 22.93 C ATOM 1110 CG1 VAL A 114 1.095 -17.363 -9.917 1.00 24.41 C ATOM 1111 CG2 VAL A 114 0.501 -16.356 -12.115 1.00 22.42 C ATOM 1112 H VAL A 114 -0.916 -19.435 -13.021 1.00 0.00 H ATOM 1113 N PRO A 115 2.064 -20.676 -10.948 1.00 26.39 N ATOM 1114 CA PRO A 115 2.238 -21.908 -10.228 1.00 27.80 C ATOM 1115 C PRO A 115 2.287 -21.629 -8.740 1.00 25.50 C ATOM 1116 O PRO A 115 3.351 -21.388 -8.209 1.00 28.11 O ATOM 1117 CB PRO A 115 3.608 -22.380 -10.738 1.00 28.75 C ATOM 1118 CG PRO A 115 4.376 -21.127 -10.852 1.00 28.01 C ATOM 1119 CD PRO A 115 3.372 -20.071 -11.276 1.00 28.23 C ATOM 1120 N VAL A 116 1.161 -21.663 -8.060 1.00 24.74 N ATOM 1121 CA VAL A 116 1.141 -21.227 -6.646 1.00 25.28 C ATOM 1122 C VAL A 116 1.443 -22.358 -5.662 1.00 25.90 C ATOM 1123 O VAL A 116 1.516 -22.114 -4.460 1.00 27.20 O ATOM 1124 CB VAL A 116 -0.200 -20.583 -6.211 1.00 24.44 C ATOM 1125 CG1 VAL A 116 -0.530 -19.337 -7.036 1.00 24.07 C ATOM 1126 CG2 VAL A 116 -1.330 -21.598 -6.244 1.00 25.64 C ATOM 1127 H VAL A 116 0.287 -21.996 -8.515 1.00 0.00 H ATOM 1128 N GLY A 117 1.541 -23.592 -6.148 1.00 27.74 N ATOM 1129 CA GLY A 117 1.766 -24.731 -5.249 1.00 29.61 C ATOM 1130 C GLY A 117 0.568 -25.253 -4.460 1.00 30.18 C ATOM 1131 O GLY A 117 -0.574 -25.111 -4.854 1.00 27.85 O ATOM 1132 H GLY A 117 1.458 -23.751 -7.172 1.00 0.00 H ATOM 1133 N ASP A 118 0.846 -25.916 -3.341 1.00 30.29 N ATOM 1134 CA ASP A 118 -0.195 -26.576 -2.588 1.00 29.47 C ATOM 1135 C ASP A 118 -1.162 -25.528 -2.055 1.00 27.49 C ATOM 1136 O ASP A 118 -0.786 -24.417 -1.672 1.00 27.00 O ATOM 1137 CB ASP A 118 0.349 -27.438 -1.411 1.00 32.08 C ATOM 1138 CG ASP A 118 1.351 -28.523 -1.827 1.00 32.21 C ATOM 1139 OD1 ASP A 118 1.440 -29.009 -2.992 1.00 27.45 O ATOM 1140 OD2 ASP A 118 2.085 -28.918 -0.902 1.00 37.23 O ATOM 1141 H ASP A 118 1.829 -25.960 -3.003 1.00 0.00 H ATOM 1142 N VAL A 119 -2.434 -25.892 -2.047 1.00 25.95 N ATOM 1143 CA VAL A 119 -3.489 -25.002 -1.592 1.00 24.09 C ATOM 1144 C VAL A 119 -4.068 -25.594 -0.342 1.00 23.59 C ATOM 1145 O VAL A 119 -4.570 -26.698 -0.386 1.00 27.32 O ATOM 1146 CB VAL A 119 -4.603 -24.917 -2.647 1.00 21.67 C ATOM 1147 CG1 VAL A 119 -5.818 -24.238 -2.057 1.00 20.84 C ATOM 1148 CG2 VAL A 119 -4.083 -24.165 -3.859 1.00 20.37 C ATOM 1149 H VAL A 119 -2.687 -26.845 -2.377 1.00 0.00 H ATOM 1150 N VAL A 120 -4.013 -24.902 0.777 1.00 25.60 N ATOM 1151 CA VAL A 120 -4.387 -25.541 2.045 1.00 26.22 C ATOM 1152 C VAL A 120 -5.600 -24.890 2.633 1.00 29.03 C ATOM 1153 O VAL A 120 -5.865 -23.731 2.313 1.00 29.36 O ATOM 1154 CB VAL A 120 -3.219 -25.552 3.088 1.00 24.50 C ATOM 1155 CG1 VAL A 120 -1.954 -26.113 2.472 1.00 24.40 C ATOM 1156 CG2 VAL A 120 -2.968 -24.182 3.693 1.00 25.18 C ATOM 1157 H VAL A 120 -3.706 -23.908 0.763 1.00 0.00 H ATOM 1158 N GLN A 121 -6.328 -25.607 3.512 1.00 32.19 N ATOM 1159 CA GLN A 121 -7.448 -24.988 4.223 1.00 33.53 C ATOM 1160 C GLN A 121 -6.858 -23.864 5.028 1.00 34.13 C ATOM 1161 O GLN A 121 -5.808 -24.014 5.618 1.00 36.95 O ATOM 1162 CB GLN A 121 -8.185 -25.912 5.212 1.00 33.76 C ATOM 1163 CG GLN A 121 -8.859 -27.148 4.656 1.00 35.56 C ATOM 1164 CD GLN A 121 -9.783 -26.887 3.472 1.00 37.58 C ATOM 1165 OE1 GLN A 121 -10.202 -25.747 3.175 1.00 36.43 O ATOM 1166 NE2 GLN A 121 -10.106 -27.947 2.789 1.00 36.63 N ATOM 1167 HE22 GLN A 121 -9.736 -28.878 3.068 1.00 0.00 H ATOM 1168 HE21 GLN A 121 -10.734 -27.863 1.964 1.00 0.00 H ATOM 1169 H GLN A 121 -6.093 -26.605 3.686 1.00 0.00 H ATOM 1170 N TYR A 122 -7.539 -22.734 5.045 1.00 35.38 N ATOM 1171 CA TYR A 122 -7.128 -21.604 5.845 1.00 34.00 C ATOM 1172 C TYR A 122 -8.296 -21.187 6.727 1.00 32.15 C ATOM 1173 O TYR A 122 -8.129 -20.964 7.910 1.00 28.82 O ATOM 1174 CB TYR A 122 -6.630 -20.450 4.952 1.00 35.24 C ATOM 1175 CG TYR A 122 -5.774 -19.426 5.685 1.00 35.40 C ATOM 1176 CD1 TYR A 122 -4.400 -19.614 5.839 1.00 36.65 C ATOM 1177 CD2 TYR A 122 -6.334 -18.298 6.246 1.00 36.26 C ATOM 1178 CE1 TYR A 122 -3.614 -18.698 6.525 1.00 35.68 C ATOM 1179 CE2 TYR A 122 -5.549 -17.372 6.933 1.00 37.85 C ATOM 1180 CZ TYR A 122 -4.190 -17.586 7.059 1.00 36.93 C ATOM 1181 OH TYR A 122 -3.419 -16.686 7.749 1.00 38.61 O ATOM 1182 HH TYR A 122 -2.476 -16.988 7.743 1.00 0.00 H ATOM 1183 H TYR A 122 -8.398 -22.655 4.464 1.00 0.00 H ATOM 1184 N GLY A 123 -9.488 -21.084 6.164 1.00 32.30 N ATOM 1185 CA GLY A 123 -10.667 -20.684 6.939 1.00 31.46 C ATOM 1186 C GLY A 123 -10.937 -19.178 6.946 1.00 34.45 C ATOM 1187 O GLY A 123 -11.383 -18.596 5.929 1.00 35.10 O ATOM 1188 H GLY A 123 -9.592 -21.291 5.150 1.00 0.00 H ATOM 1189 N PHE A 124 -10.674 -18.556 8.099 1.00 32.44 N ATOM 1190 CA PHE A 124 -10.866 -17.132 8.334 1.00 32.00 C ATOM 1191 C PHE A 124 -9.738 -16.233 7.785 1.00 32.80 C ATOM 1192 O PHE A 124 -8.544 -16.506 7.965 1.00 36.75 O ATOM 1193 CB PHE A 124 -11.000 -16.889 9.825 1.00 34.02 C ATOM 1194 CG PHE A 124 -11.118 -15.454 10.182 1.00 32.94 C ATOM 1195 CD1 PHE A 124 -12.362 -14.929 10.497 1.00 33.10 C ATOM 1196 CD2 PHE A 124 -9.996 -14.613 10.167 1.00 31.85 C ATOM 1197 CE1 PHE A 124 -12.494 -13.597 10.838 1.00 33.90 C ATOM 1198 CE2 PHE A 124 -10.123 -13.272 10.477 1.00 33.27 C ATOM 1199 CZ PHE A 124 -11.374 -12.763 10.827 1.00 34.33 C ATOM 1200 H PHE A 124 -10.306 -19.130 8.884 1.00 0.00 H ATOM 1201 N LEU A 125 -10.130 -15.146 7.116 1.00 33.01 N ATOM 1202 CA LEU A 125 -9.179 -14.167 6.587 1.00 30.24 C ATOM 1203 C LEU A 125 -9.751 -12.793 6.794 1.00 29.82 C ATOM 1204 O LEU A 125 -10.939 -12.564 6.663 1.00 29.33 O ATOM 1205 CB LEU A 125 -8.854 -14.432 5.120 1.00 30.17 C ATOM 1206 CG LEU A 125 -7.913 -13.489 4.383 1.00 30.67 C ATOM 1207 CD1 LEU A 125 -6.513 -13.609 4.941 1.00 31.28 C ATOM 1208 CD2 LEU A 125 -7.912 -13.799 2.884 1.00 30.50 C ATOM 1209 H LEU A 125 -11.147 -14.989 6.965 1.00 0.00 H ATOM 1210 N ASN A 126 -8.903 -11.873 7.201 1.00 31.70 N ATOM 1211 CA ASN A 126 -9.351 -10.521 7.422 1.00 36.34 C ATOM 1212 C ASN A 126 -8.951 -9.649 6.235 1.00 38.63 C ATOM 1213 O ASN A 126 -7.775 -9.423 5.981 1.00 41.07 O ATOM 1214 CB ASN A 126 -8.777 -9.990 8.714 1.00 38.83 C ATOM 1215 CG ASN A 126 -8.646 -8.510 8.706 1.00 38.02 C ATOM 1216 OD1 ASN A 126 -7.545 -8.004 8.895 1.00 39.94 O ATOM 1217 ND2 ASN A 126 -9.764 -7.791 8.484 1.00 40.52 N ATOM 1218 HD22 ASN A 126 -10.671 -8.275 8.330 1.00 0.00 H ATOM 1219 HD21 ASN A 126 -9.719 -6.752 8.467 1.00 0.00 H ATOM 1220 H ASN A 126 -7.906 -12.122 7.364 1.00 0.00 H ATOM 1221 N LEU A 127 -9.946 -9.177 5.502 1.00 35.39 N ATOM 1222 CA LEU A 127 -9.713 -8.530 4.223 1.00 34.21 C ATOM 1223 C LEU A 127 -9.836 -7.031 4.358 1.00 31.49 C ATOM 1224 O LEU A 127 -10.895 -6.484 4.152 1.00 26.76 O ATOM 1225 CB LEU A 127 -10.765 -9.006 3.245 1.00 37.09 C ATOM 1226 CG LEU A 127 -10.241 -9.661 2.009 1.00 40.59 C ATOM 1227 CD1 LEU A 127 -8.947 -10.439 2.231 1.00 41.68 C ATOM 1228 CD2 LEU A 127 -11.366 -10.569 1.512 1.00 41.86 C ATOM 1229 H LEU A 127 -10.921 -9.272 5.851 1.00 0.00 H ATOM 1230 N SER A 128 -8.742 -6.365 4.717 1.00 35.27 N ATOM 1231 CA SER A 128 -8.748 -4.919 4.873 1.00 34.26 C ATOM 1232 C SER A 128 -9.924 -4.463 5.743 1.00 34.79 C ATOM 1233 O SER A 128 -10.638 -3.535 5.400 1.00 38.80 O ATOM 1234 CB SER A 128 -8.767 -4.272 3.480 1.00 34.16 C ATOM 1235 OG SER A 128 -7.597 -4.641 2.751 1.00 29.32 O ATOM 1236 HG SER A 128 -7.620 -4.219 1.856 1.00 0.00 H ATOM 1237 H SER A 128 -7.862 -6.891 4.890 1.00 0.00 H ATOM 1238 N GLY A 129 -10.142 -5.164 6.852 1.00 36.51 N ATOM 1239 CA GLY A 129 -11.244 -4.854 7.782 1.00 36.33 C ATOM 1240 C GLY A 129 -12.543 -5.638 7.595 1.00 38.30 C ATOM 1241 O GLY A 129 -13.528 -5.428 8.320 1.00 35.99 O ATOM 1242 H GLY A 129 -9.511 -5.961 7.072 1.00 0.00 H ATOM 1243 N LYS A 130 -12.577 -6.546 6.627 1.00 36.30 N ATOM 1244 CA LYS A 130 -13.776 -7.336 6.374 1.00 32.03 C ATOM 1245 C LYS A 130 -13.450 -8.797 6.675 1.00 32.54 C ATOM 1246 O LYS A 130 -12.577 -9.403 6.018 1.00 30.80 O ATOM 1247 CB LYS A 130 -14.214 -7.124 4.943 1.00 33.01 C ATOM 1248 CG LYS A 130 -15.126 -8.180 4.367 1.00 33.55 C ATOM 1249 CD LYS A 130 -16.554 -7.723 4.414 1.00 34.76 C ATOM 1250 CE LYS A 130 -16.831 -6.546 3.486 1.00 34.28 C ATOM 1251 NZ LYS A 130 -18.050 -5.853 3.988 1.00 36.04 N ATOM 1252 HZ1 LYS A 130 -18.851 -6.516 3.982 1.00 0.00 H ATOM 1253 HZ2 LYS A 130 -17.882 -5.518 4.958 1.00 0.00 H ATOM 1254 HZ3 LYS A 130 -18.265 -5.042 3.373 1.00 0.00 H ATOM 1255 H LYS A 130 -11.733 -6.697 6.038 1.00 0.00 H ATOM 1256 N PRO A 131 -14.084 -9.349 7.736 1.00 30.11 N ATOM 1257 CA PRO A 131 -13.963 -10.773 8.042 1.00 29.48 C ATOM 1258 C PRO A 131 -14.629 -11.659 6.961 1.00 27.53 C ATOM 1259 O PRO A 131 -15.706 -11.379 6.477 1.00 28.04 O ATOM 1260 CB PRO A 131 -14.664 -10.931 9.392 1.00 30.65 C ATOM 1261 CG PRO A 131 -15.157 -9.573 9.806 1.00 29.91 C ATOM 1262 CD PRO A 131 -14.975 -8.634 8.664 1.00 29.66 C ATOM 1263 N THR A 132 -13.980 -12.749 6.646 1.00 27.23 N ATOM 1264 CA THR A 132 -14.291 -13.483 5.454 1.00 27.86 C ATOM 1265 C THR A 132 -14.028 -14.922 5.793 1.00 26.35 C ATOM 1266 O THR A 132 -12.946 -15.250 6.307 1.00 30.98 O ATOM 1267 CB THR A 132 -13.387 -13.007 4.292 1.00 25.31 C ATOM 1268 OG1 THR A 132 -13.720 -11.636 4.010 1.00 24.65 O ATOM 1269 CG2 THR A 132 -13.551 -13.915 3.029 1.00 24.11 C ATOM 1270 HG1 THR A 132 -13.561 -11.086 4.818 1.00 0.00 H ATOM 1271 H THR A 132 -13.223 -13.091 7.272 1.00 0.00 H ATOM 1272 N HIS A 133 -15.028 -15.769 5.532 1.00 25.00 N ATOM 1273 CA HIS A 133 -14.882 -17.194 5.731 1.00 23.78 C ATOM 1274 C HIS A 133 -14.607 -18.008 4.481 1.00 24.27 C ATOM 1275 O HIS A 133 -14.703 -17.527 3.328 1.00 20.76 O ATOM 1276 CB HIS A 133 -16.090 -17.723 6.461 1.00 25.97 C ATOM 1277 CG HIS A 133 -16.134 -17.309 7.898 1.00 26.29 C ATOM 1278 ND1 HIS A 133 -17.254 -17.446 8.685 1.00 29.97 N ATOM 1279 CD2 HIS A 133 -15.183 -16.758 8.692 1.00 27.37 C ATOM 1280 CE1 HIS A 133 -16.988 -17.009 9.908 1.00 27.32 C ATOM 1281 NE2 HIS A 133 -15.740 -16.587 9.935 1.00 25.55 N ATOM 1282 H HIS A 133 -15.932 -15.395 5.178 1.00 0.00 H ATOM 1283 N ARG A 134 -14.230 -19.258 4.743 1.00 24.30 N ATOM 1284 CA ARG A 134 -14.160 -20.319 3.737 1.00 23.63 C ATOM 1285 C ARG A 134 -13.056 -20.098 2.701 1.00 24.32 C ATOM 1286 O ARG A 134 -13.182 -20.484 1.545 1.00 26.19 O ATOM 1287 CB ARG A 134 -15.527 -20.533 3.082 1.00 21.33 C ATOM 1288 CG ARG A 134 -16.653 -20.801 4.068 1.00 20.32 C ATOM 1289 CD ARG A 134 -17.793 -21.543 3.400 1.00 20.68 C ATOM 1290 NE ARG A 134 -19.011 -21.540 4.206 1.00 19.30 N ATOM 1291 CZ ARG A 134 -20.201 -21.853 3.734 1.00 21.06 C ATOM 1292 NH1 ARG A 134 -20.369 -22.208 2.448 1.00 21.50 N ATOM 1293 NH2 ARG A 134 -21.243 -21.787 4.535 1.00 20.86 N ATOM 1294 HE ARG A 134 -18.935 -21.276 5.209 1.00 0.00 H ATOM 1295 HH12 ARG A 134 -21.317 -22.451 2.095 1.00 0.00 H ATOM 1296 HH11 ARG A 134 -19.551 -22.239 1.806 1.00 0.00 H ATOM 1297 HH22 ARG A 134 -22.189 -22.031 4.179 1.00 0.00 H ATOM 1298 HH21 ARG A 134 -21.120 -21.491 5.524 1.00 0.00 H ATOM 1299 H ARG A 134 -13.970 -19.495 5.722 1.00 0.00 H ATOM 1300 N THR A 135 -11.954 -19.524 3.168 1.00 24.96 N ATOM 1301 CA THR A 135 -10.775 -19.257 2.348 1.00 22.43 C ATOM 1302 C THR A 135 -9.767 -20.386 2.427 1.00 23.49 C ATOM 1303 O THR A 135 -9.729 -21.146 3.385 1.00 24.13 O ATOM 1304 CB THR A 135 -10.081 -17.922 2.770 1.00 21.61 C ATOM 1305 OG1 THR A 135 -9.398 -18.062 4.044 1.00 21.31 O ATOM 1306 CG2 THR A 135 -11.098 -16.775 2.860 1.00 19.25 C ATOM 1307 HG1 THR A 135 -10.053 -18.311 4.743 1.00 0.00 H ATOM 1308 H THR A 135 -11.929 -19.250 4.171 1.00 0.00 H ATOM 1309 N MET A 136 -8.942 -20.474 1.392 1.00 24.53 N ATOM 1310 CA MET A 136 -7.757 -21.300 1.385 1.00 23.00 C ATOM 1311 C MET A 136 -6.536 -20.423 1.057 1.00 22.28 C ATOM 1312 O MET A 136 -6.672 -19.235 0.733 1.00 21.60 O ATOM 1313 CB MET A 136 -7.945 -22.476 0.398 1.00 25.04 C ATOM 1314 CG MET A 136 -9.080 -23.431 0.813 1.00 26.03 C ATOM 1315 SD MET A 136 -9.200 -24.926 -0.175 1.00 26.12 S ATOM 1316 CE MET A 136 -9.629 -24.251 -1.774 1.00 29.16 C ATOM 1317 H MET A 136 -9.160 -19.919 0.540 1.00 0.00 H ATOM 1318 N MET A 137 -5.342 -21.010 1.133 1.00 23.35 N ATOM 1319 CA MET A 137 -4.089 -20.259 1.165 1.00 24.85 C ATOM 1320 C MET A 137 -3.032 -21.008 0.394 1.00 23.96 C ATOM 1321 O MET A 137 -3.007 -22.257 0.392 1.00 23.41 O ATOM 1322 CB MET A 137 -3.635 -20.030 2.635 1.00 27.15 C ATOM 1323 CG MET A 137 -2.261 -19.379 2.797 1.00 27.47 C ATOM 1324 SD MET A 137 -0.847 -20.449 2.516 1.00 30.00 S ATOM 1325 CE MET A 137 -0.572 -20.930 4.245 1.00 29.86 C ATOM 1326 H MET A 137 -5.300 -22.048 1.171 1.00 0.00 H ATOM 1327 N TYR A 138 -2.184 -20.250 -0.309 1.00 23.65 N ATOM 1328 CA TYR A 138 -1.032 -20.796 -1.035 1.00 23.14 C ATOM 1329 C TYR A 138 0.146 -19.887 -0.722 1.00 25.91 C ATOM 1330 O TYR A 138 -0.006 -18.651 -0.668 1.00 24.75 O ATOM 1331 CB TYR A 138 -1.253 -20.880 -2.552 1.00 23.26 C ATOM 1332 CG TYR A 138 -2.428 -20.043 -3.048 1.00 24.68 C ATOM 1333 CD1 TYR A 138 -2.227 -18.860 -3.726 1.00 22.50 C ATOM 1334 CD2 TYR A 138 -3.772 -20.456 -2.825 1.00 23.37 C ATOM 1335 CE1 TYR A 138 -3.313 -18.098 -4.146 1.00 22.14 C ATOM 1336 CE2 TYR A 138 -4.843 -19.685 -3.249 1.00 22.49 C ATOM 1337 CZ TYR A 138 -4.606 -18.512 -3.907 1.00 21.40 C ATOM 1338 OH TYR A 138 -5.675 -17.768 -4.336 1.00 21.10 O ATOM 1339 HH TYR A 138 -5.347 -16.953 -4.792 1.00 0.00 H ATOM 1340 H TYR A 138 -2.349 -19.224 -0.343 1.00 0.00 H ATOM 1341 N ASN A 139 1.321 -20.474 -0.475 1.00 27.00 N ATOM 1342 CA ASN A 139 2.455 -19.649 -0.066 1.00 27.37 C ATOM 1343 C ASN A 139 3.116 -19.162 -1.340 1.00 27.83 C ATOM 1344 O ASN A 139 4.169 -19.649 -1.726 1.00 26.96 O ATOM 1345 CB ASN A 139 3.419 -20.413 0.861 1.00 27.98 C ATOM 1346 CG ASN A 139 2.858 -20.601 2.272 1.00 27.88 C ATOM 1347 OD1 ASN A 139 2.709 -21.720 2.738 1.00 32.69 O ATOM 1348 ND2 ASN A 139 2.587 -19.516 2.964 1.00 28.49 N ATOM 1349 HD22 ASN A 139 2.725 -18.578 2.536 1.00 0.00 H ATOM 1350 HD21 ASN A 139 2.234 -19.596 3.939 1.00 0.00 H ATOM 1351 H ASN A 139 1.427 -21.504 -0.573 1.00 0.00 H ATOM 1352 N PHE A 140 2.445 -18.215 -2.012 1.00 27.45 N ATOM 1353 CA PHE A 140 2.976 -17.567 -3.201 1.00 26.52 C ATOM 1354 C PHE A 140 2.696 -16.075 -3.043 1.00 25.99 C ATOM 1355 O PHE A 140 1.643 -15.702 -2.516 1.00 26.43 O ATOM 1356 CB PHE A 140 2.326 -18.090 -4.501 1.00 25.68 C ATOM 1357 CG PHE A 140 3.029 -17.629 -5.766 1.00 27.20 C ATOM 1358 CD1 PHE A 140 4.045 -18.366 -6.308 1.00 26.14 C ATOM 1359 CD2 PHE A 140 2.669 -16.431 -6.395 1.00 29.25 C ATOM 1360 CE1 PHE A 140 4.690 -17.956 -7.450 1.00 27.97 C ATOM 1361 CE2 PHE A 140 3.313 -16.001 -7.541 1.00 26.72 C ATOM 1362 CZ PHE A 140 4.339 -16.764 -8.061 1.00 27.77 C ATOM 1363 H PHE A 140 1.505 -17.932 -1.668 1.00 0.00 H ATOM 1364 N PRO A 141 3.617 -15.213 -3.523 1.00 25.19 N ATOM 1365 CA PRO A 141 3.342 -13.793 -3.301 1.00 24.79 C ATOM 1366 C PRO A 141 2.535 -13.226 -4.473 1.00 24.02 C ATOM 1367 O PRO A 141 3.088 -12.588 -5.357 1.00 23.97 O ATOM 1368 CB PRO A 141 4.726 -13.196 -3.192 1.00 24.36 C ATOM 1369 CG PRO A 141 5.566 -14.053 -4.078 1.00 26.73 C ATOM 1370 CD PRO A 141 4.931 -15.425 -4.140 1.00 24.94 C ATOM 1371 N THR A 142 1.228 -13.471 -4.449 1.00 23.97 N ATOM 1372 CA THR A 142 0.311 -12.952 -5.443 1.00 22.80 C ATOM 1373 C THR A 142 0.281 -11.424 -5.324 1.00 25.01 C ATOM 1374 O THR A 142 0.828 -10.872 -4.331 1.00 22.75 O ATOM 1375 CB THR A 142 -1.089 -13.559 -5.262 1.00 23.89 C ATOM 1376 OG1 THR A 142 -1.540 -13.393 -3.902 1.00 22.82 O ATOM 1377 CG2 THR A 142 -1.074 -15.065 -5.642 1.00 23.87 C ATOM 1378 HG1 THR A 142 -1.577 -12.428 -3.683 1.00 0.00 H ATOM 1379 H THR A 142 0.847 -14.062 -3.682 1.00 0.00 H ATOM 1380 N LYS A 143 -0.314 -10.751 -6.330 1.00 22.16 N ATOM 1381 CA LYS A 143 -0.356 -9.271 -6.362 1.00 22.47 C ATOM 1382 C LYS A 143 -1.653 -8.649 -6.827 1.00 20.35 C ATOM 1383 O LYS A 143 -2.536 -9.337 -7.326 1.00 19.33 O ATOM 1384 CB LYS A 143 0.797 -8.744 -7.221 1.00 25.42 C ATOM 1385 CG LYS A 143 0.816 -9.222 -8.641 1.00 26.61 C ATOM 1386 CD LYS A 143 2.138 -8.819 -9.296 1.00 29.57 C ATOM 1387 CE LYS A 143 2.014 -7.679 -10.283 1.00 32.36 C ATOM 1388 NZ LYS A 143 1.972 -8.228 -11.680 1.00 37.10 N ATOM 1389 HZ1 LYS A 143 2.847 -8.758 -11.870 1.00 0.00 H ATOM 1390 HZ2 LYS A 143 1.153 -8.862 -11.778 1.00 0.00 H ATOM 1391 HZ3 LYS A 143 1.887 -7.443 -12.357 1.00 0.00 H ATOM 1392 H LYS A 143 -0.756 -11.286 -7.105 1.00 0.00 H ATOM 1393 N ALA A 144 -1.760 -7.321 -6.674 1.00 22.02 N ATOM 1394 CA ALA A 144 -2.867 -6.568 -7.240 1.00 21.48 C ATOM 1395 C ALA A 144 -3.048 -6.914 -8.715 1.00 20.08 C ATOM 1396 O ALA A 144 -2.084 -7.171 -9.453 1.00 20.20 O ATOM 1397 CB ALA A 144 -2.684 -5.049 -7.064 1.00 22.65 C ATOM 1398 H ALA A 144 -1.029 -6.815 -6.134 1.00 0.00 H ATOM 1399 N GLY A 145 -4.314 -6.960 -9.125 1.00 19.96 N ATOM 1400 CA GLY A 145 -4.660 -7.262 -10.489 1.00 18.91 C ATOM 1401 C GLY A 145 -4.941 -8.735 -10.690 1.00 18.28 C ATOM 1402 O GLY A 145 -5.350 -9.115 -11.770 1.00 17.35 O ATOM 1403 H GLY A 145 -5.074 -6.772 -8.440 1.00 0.00 H ATOM 1404 N GLN A 146 -4.727 -9.568 -9.662 1.00 16.54 N ATOM 1405 CA GLN A 146 -4.904 -10.993 -9.806 1.00 16.87 C ATOM 1406 C GLN A 146 -6.192 -11.539 -9.189 1.00 16.89 C ATOM 1407 O GLN A 146 -6.435 -12.715 -9.285 1.00 20.08 O ATOM 1408 CB GLN A 146 -3.659 -11.737 -9.319 1.00 17.42 C ATOM 1409 CG GLN A 146 -2.460 -11.500 -10.268 1.00 16.90 C ATOM 1410 CD GLN A 146 -1.155 -12.128 -9.806 1.00 17.48 C ATOM 1411 OE1 GLN A 146 -0.958 -12.402 -8.631 1.00 16.77 O ATOM 1412 NE2 GLN A 146 -0.248 -12.361 -10.757 1.00 19.53 N ATOM 1413 HE22 GLN A 146 -0.455 -12.113 -11.745 1.00 0.00 H ATOM 1414 HE21 GLN A 146 0.666 -12.791 -10.510 1.00 0.00 H ATOM 1415 H GLN A 146 -4.428 -9.181 -8.744 1.00 0.00 H ATOM 1416 N CYS A 147 -7.011 -10.690 -8.593 1.00 18.18 N ATOM 1417 CA CYS A 147 -8.295 -11.102 -8.000 1.00 18.78 C ATOM 1418 C CYS A 147 -9.257 -11.586 -9.091 1.00 18.41 C ATOM 1419 O CYS A 147 -9.285 -11.006 -10.174 1.00 17.59 O ATOM 1420 CB CYS A 147 -8.913 -9.985 -7.182 1.00 19.78 C ATOM 1421 SG CYS A 147 -7.986 -9.784 -5.665 1.00 20.92 S ATOM 1422 H CYS A 147 -6.737 -9.688 -8.540 1.00 0.00 H ATOM 1423 N GLY A 148 -9.900 -12.727 -8.836 1.00 16.86 N ATOM 1424 CA GLY A 148 -10.773 -13.370 -9.788 1.00 17.51 C ATOM 1425 C GLY A 148 -10.074 -14.555 -10.396 1.00 17.10 C ATOM 1426 O GLY A 148 -10.718 -15.438 -10.940 1.00 16.78 O ATOM 1427 H GLY A 148 -9.766 -13.174 -7.907 1.00 0.00 H ATOM 1428 N GLY A 149 -8.747 -14.570 -10.316 1.00 16.84 N ATOM 1429 CA GLY A 149 -7.964 -15.688 -10.822 1.00 15.98 C ATOM 1430 C GLY A 149 -8.488 -17.025 -10.332 1.00 15.99 C ATOM 1431 O GLY A 149 -8.975 -17.157 -9.202 1.00 16.20 O ATOM 1432 H GLY A 149 -8.256 -13.763 -9.881 1.00 0.00 H ATOM 1433 N VAL A 150 -8.456 -18.013 -11.209 1.00 16.15 N ATOM 1434 CA VAL A 150 -9.069 -19.296 -10.900 1.00 17.64 C ATOM 1435 C VAL A 150 -8.013 -20.295 -10.463 1.00 17.52 C ATOM 1436 O VAL A 150 -7.051 -20.599 -11.209 1.00 16.42 O ATOM 1437 CB VAL A 150 -9.867 -19.827 -12.091 1.00 17.80 C ATOM 1438 CG1 VAL A 150 -10.606 -21.093 -11.745 1.00 18.83 C ATOM 1439 CG2 VAL A 150 -10.860 -18.793 -12.561 1.00 18.59 C ATOM 1440 H VAL A 150 -7.989 -17.872 -12.128 1.00 0.00 H ATOM 1441 N VAL A 151 -8.188 -20.750 -9.220 1.00 18.83 N ATOM 1442 CA VAL A 151 -7.327 -21.764 -8.607 1.00 19.36 C ATOM 1443 C VAL A 151 -7.672 -23.165 -9.165 1.00 20.06 C ATOM 1444 O VAL A 151 -8.778 -23.648 -9.008 1.00 18.47 O ATOM 1445 CB VAL A 151 -7.399 -21.731 -7.050 1.00 19.16 C ATOM 1446 CG1 VAL A 151 -6.377 -22.658 -6.456 1.00 19.48 C ATOM 1447 CG2 VAL A 151 -7.121 -20.329 -6.493 1.00 18.93 C ATOM 1448 H VAL A 151 -8.975 -20.365 -8.659 1.00 0.00 H ATOM 1449 N THR A 152 -6.711 -23.822 -9.804 1.00 22.01 N ATOM 1450 CA THR A 152 -6.968 -25.137 -10.425 1.00 24.94 C ATOM 1451 C THR A 152 -5.901 -26.233 -10.273 1.00 27.62 C ATOM 1452 O THR A 152 -4.684 -25.953 -10.187 1.00 27.71 O ATOM 1453 CB THR A 152 -7.184 -24.995 -11.926 1.00 25.93 C ATOM 1454 OG1 THR A 152 -5.988 -24.456 -12.512 1.00 26.81 O ATOM 1455 CG2 THR A 152 -8.356 -24.083 -12.215 1.00 27.60 C ATOM 1456 HG1 THR A 152 -5.797 -23.570 -12.113 1.00 0.00 H ATOM 1457 H THR A 152 -5.761 -23.403 -9.868 1.00 0.00 H ATOM 1458 N SER A 153 -6.374 -27.490 -10.301 1.00 29.09 N ATOM 1459 CA SER A 153 -5.501 -28.657 -10.114 1.00 31.45 C ATOM 1460 C SER A 153 -6.154 -29.960 -10.550 1.00 34.51 C ATOM 1461 O SER A 153 -7.226 -30.315 -10.036 1.00 34.95 O ATOM 1462 CB SER A 153 -5.129 -28.777 -8.633 1.00 33.11 C ATOM 1463 OG SER A 153 -4.378 -29.951 -8.368 1.00 37.67 O ATOM 1464 HG SER A 153 -4.159 -29.990 -7.403 1.00 0.00 H ATOM 1465 H SER A 153 -7.390 -27.642 -10.460 1.00 0.00 H ATOM 1466 N VAL A 154 -5.478 -30.680 -11.454 1.00 34.52 N ATOM 1467 CA VAL A 154 -5.914 -32.002 -11.976 1.00 35.00 C ATOM 1468 C VAL A 154 -7.412 -32.068 -12.370 1.00 31.05 C ATOM 1469 O VAL A 154 -8.081 -33.007 -12.001 1.00 31.15 O ATOM 1470 CB VAL A 154 -5.527 -33.219 -11.046 1.00 33.99 C ATOM 1471 CG1 VAL A 154 -4.018 -33.334 -10.845 1.00 34.38 C ATOM 1472 CG2 VAL A 154 -6.208 -33.166 -9.686 1.00 33.74 C ATOM 1473 H VAL A 154 -4.586 -30.287 -11.816 1.00 0.00 H ATOM 1474 N GLY A 155 -7.881 -31.079 -13.143 1.00 29.02 N ATOM 1475 CA GLY A 155 -9.216 -31.043 -13.716 1.00 26.11 C ATOM 1476 C GLY A 155 -10.256 -30.623 -12.712 1.00 28.87 C ATOM 1477 O GLY A 155 -11.431 -30.986 -12.842 1.00 30.96 O ATOM 1478 H GLY A 155 -7.245 -30.282 -13.347 1.00 0.00 H ATOM 1479 N LYS A 156 -9.826 -29.885 -11.685 1.00 25.94 N ATOM 1480 CA LYS A 156 -10.731 -29.365 -10.681 1.00 25.66 C ATOM 1481 C LYS A 156 -10.563 -27.847 -10.524 1.00 23.79 C ATOM 1482 O LYS A 156 -9.445 -27.325 -10.591 1.00 23.38 O ATOM 1483 CB LYS A 156 -10.510 -30.068 -9.358 1.00 30.00 C ATOM 1484 CG LYS A 156 -11.130 -31.460 -9.279 1.00 33.30 C ATOM 1485 CD LYS A 156 -11.892 -31.626 -7.959 1.00 35.57 C ATOM 1486 CE LYS A 156 -12.326 -33.068 -7.697 1.00 37.43 C ATOM 1487 NZ LYS A 156 -11.226 -34.039 -7.991 1.00 40.05 N ATOM 1488 HZ1 LYS A 156 -10.950 -33.956 -8.990 1.00 0.00 H ATOM 1489 HZ2 LYS A 156 -10.408 -33.828 -7.385 1.00 0.00 H ATOM 1490 HZ3 LYS A 156 -11.559 -35.006 -7.801 1.00 0.00 H ATOM 1491 H LYS A 156 -8.810 -29.677 -11.604 1.00 0.00 H ATOM 1492 N VAL A 157 -11.693 -27.172 -10.326 1.00 21.85 N ATOM 1493 CA VAL A 157 -11.810 -25.718 -10.140 1.00 20.08 C ATOM 1494 C VAL A 157 -12.228 -25.463 -8.702 1.00 20.45 C ATOM 1495 O VAL A 157 -13.358 -25.715 -8.317 1.00 19.25 O ATOM 1496 CB VAL A 157 -12.856 -25.171 -11.137 1.00 20.28 C ATOM 1497 CG1 VAL A 157 -13.006 -23.651 -11.021 1.00 19.34 C ATOM 1498 CG2 VAL A 157 -12.418 -25.548 -12.565 1.00 20.49 C ATOM 1499 H VAL A 157 -12.574 -27.724 -10.300 1.00 0.00 H ATOM 1500 N ILE A 158 -11.303 -24.988 -7.890 1.00 21.64 N ATOM 1501 CA ILE A 158 -11.481 -25.045 -6.435 1.00 20.72 C ATOM 1502 C ILE A 158 -11.571 -23.707 -5.737 1.00 19.23 C ATOM 1503 O ILE A 158 -11.989 -23.652 -4.598 1.00 18.83 O ATOM 1504 CB ILE A 158 -10.360 -25.878 -5.749 1.00 22.75 C ATOM 1505 CG1 ILE A 158 -8.976 -25.244 -5.924 1.00 22.66 C ATOM 1506 CG2 ILE A 158 -10.329 -27.280 -6.309 1.00 22.00 C ATOM 1507 CD1 ILE A 158 -7.895 -25.922 -5.127 1.00 23.75 C ATOM 1508 H ILE A 158 -10.438 -24.568 -8.286 1.00 0.00 H ATOM 1509 N GLY A 159 -11.169 -22.630 -6.399 1.00 18.39 N ATOM 1510 CA GLY A 159 -11.272 -21.326 -5.796 1.00 18.17 C ATOM 1511 C GLY A 159 -11.117 -20.165 -6.724 1.00 17.54 C ATOM 1512 O GLY A 159 -10.716 -20.325 -7.879 1.00 17.02 O ATOM 1513 H GLY A 159 -10.778 -22.728 -7.358 1.00 0.00 H ATOM 1514 N ILE A 160 -11.461 -18.999 -6.179 1.00 17.42 N ATOM 1515 CA ILE A 160 -11.312 -17.675 -6.810 1.00 17.81 C ATOM 1516 C ILE A 160 -10.397 -16.735 -5.984 1.00 18.35 C ATOM 1517 O ILE A 160 -10.637 -16.478 -4.802 1.00 15.52 O ATOM 1518 CB ILE A 160 -12.690 -17.009 -6.874 1.00 18.44 C ATOM 1519 CG1 ILE A 160 -13.602 -17.826 -7.796 1.00 20.02 C ATOM 1520 CG2 ILE A 160 -12.624 -15.548 -7.319 1.00 20.12 C ATOM 1521 CD1 ILE A 160 -13.045 -18.078 -9.191 1.00 19.47 C ATOM 1522 H ILE A 160 -11.871 -19.025 -5.224 1.00 0.00 H ATOM 1523 N HIS A 161 -9.399 -16.172 -6.632 1.00 18.09 N ATOM 1524 CA HIS A 161 -8.408 -15.413 -5.940 1.00 19.47 C ATOM 1525 C HIS A 161 -8.969 -14.138 -5.436 1.00 19.36 C ATOM 1526 O HIS A 161 -9.613 -13.441 -6.180 1.00 18.90 O ATOM 1527 CB HIS A 161 -7.171 -15.147 -6.825 1.00 19.10 C ATOM 1528 CG HIS A 161 -6.072 -14.480 -6.072 1.00 18.98 C ATOM 1529 ND1 HIS A 161 -5.275 -15.170 -5.186 1.00 20.97 N ATOM 1530 CD2 HIS A 161 -5.712 -13.176 -5.966 1.00 19.06 C ATOM 1531 CE1 HIS A 161 -4.435 -14.331 -4.598 1.00 19.76 C ATOM 1532 NE2 HIS A 161 -4.678 -13.114 -5.048 1.00 19.60 N ATOM 1533 H HIS A 161 -9.332 -16.282 -7.664 1.00 0.00 H ATOM 1534 N ILE A 162 -8.755 -13.864 -4.134 1.00 18.13 N ATOM 1535 CA ILE A 162 -9.341 -12.717 -3.447 1.00 19.58 C ATOM 1536 C ILE A 162 -8.392 -11.800 -2.666 1.00 19.98 C ATOM 1537 O ILE A 162 -8.806 -10.707 -2.274 1.00 19.24 O ATOM 1538 CB ILE A 162 -10.466 -13.105 -2.437 1.00 20.48 C ATOM 1539 CG1 ILE A 162 -9.940 -14.025 -1.339 1.00 21.29 C ATOM 1540 CG2 ILE A 162 -11.706 -13.673 -3.169 1.00 22.04 C ATOM 1541 CD1 ILE A 162 -10.911 -14.189 -0.182 1.00 23.08 C ATOM 1542 H ILE A 162 -8.140 -14.503 -3.590 1.00 0.00 H ATOM 1543 N GLY A 163 -7.158 -12.227 -2.400 1.00 21.00 N ATOM 1544 CA GLY A 163 -6.299 -11.396 -1.570 1.00 22.16 C ATOM 1545 C GLY A 163 -4.937 -11.956 -1.322 1.00 23.32 C ATOM 1546 O GLY A 163 -4.651 -13.100 -1.677 1.00 23.09 O ATOM 1547 H GLY A 163 -6.816 -13.134 -2.777 1.00 0.00 H ATOM 1548 N GLY A 164 -4.094 -11.139 -0.696 1.00 24.14 N ATOM 1549 CA GLY A 164 -2.753 -11.544 -0.412 1.00 23.56 C ATOM 1550 C GLY A 164 -2.083 -10.587 0.539 1.00 23.89 C ATOM 1551 O GLY A 164 -2.573 -9.487 0.781 1.00 23.49 O ATOM 1552 H GLY A 164 -4.415 -10.192 -0.409 1.00 0.00 H ATOM 1553 N ASN A 165 -0.950 -11.014 1.078 1.00 24.68 N ATOM 1554 CA ASN A 165 -0.240 -10.211 2.066 1.00 22.65 C ATOM 1555 C ASN A 165 1.197 -9.969 1.728 1.00 21.65 C ATOM 1556 O ASN A 165 1.956 -9.518 2.578 1.00 24.32 O ATOM 1557 CB ASN A 165 -0.337 -10.895 3.433 1.00 23.06 C ATOM 1558 CG ASN A 165 0.380 -12.238 3.468 1.00 20.80 C ATOM 1559 OD1 ASN A 165 1.226 -12.570 2.609 1.00 20.44 O ATOM 1560 ND2 ASN A 165 0.023 -13.022 4.426 1.00 20.62 N ATOM 1561 HD22 ASN A 165 -0.684 -12.706 5.120 1.00 0.00 H ATOM 1562 HD21 ASN A 165 0.442 -13.970 4.505 1.00 0.00 H ATOM 1563 H ASN A 165 -0.562 -11.935 0.792 1.00 0.00 H ATOM 1564 N GLY A 166 1.583 -10.244 0.495 1.00 20.56 N ATOM 1565 CA GLY A 166 2.902 -9.965 0.019 1.00 20.30 C ATOM 1566 C GLY A 166 3.756 -11.211 -0.030 1.00 21.36 C ATOM 1567 O GLY A 166 4.794 -11.209 -0.663 1.00 24.06 O ATOM 1568 H GLY A 166 0.900 -10.681 -0.156 1.00 0.00 H ATOM 1569 N ARG A 167 3.329 -12.252 0.675 1.00 22.73 N ATOM 1570 CA ARG A 167 4.085 -13.503 0.861 1.00 23.84 C ATOM 1571 C ARG A 167 3.238 -14.713 0.497 1.00 23.55 C ATOM 1572 O ARG A 167 3.717 -15.706 -0.052 1.00 25.74 O ATOM 1573 CB ARG A 167 4.527 -13.627 2.327 1.00 24.32 C ATOM 1574 CG ARG A 167 5.497 -12.534 2.742 1.00 25.21 C ATOM 1575 CD ARG A 167 5.826 -12.675 4.226 1.00 25.85 C ATOM 1576 NE ARG A 167 4.590 -12.704 5.002 1.00 24.91 N ATOM 1577 CZ ARG A 167 3.905 -11.640 5.385 1.00 23.70 C ATOM 1578 NH1 ARG A 167 4.329 -10.431 5.116 1.00 25.03 N ATOM 1579 NH2 ARG A 167 2.790 -11.789 6.085 1.00 26.21 N ATOM 1580 HE ARG A 167 4.219 -13.636 5.275 1.00 0.00 H ATOM 1581 HH12 ARG A 167 3.777 -9.606 5.425 1.00 0.00 H ATOM 1582 HH11 ARG A 167 5.218 -10.296 4.593 1.00 0.00 H ATOM 1583 HH22 ARG A 167 2.250 -10.953 6.387 1.00 0.00 H ATOM 1584 HH21 ARG A 167 2.455 -12.742 6.332 1.00 0.00 H ATOM 1585 H ARG A 167 2.396 -12.179 1.128 1.00 0.00 H ATOM 1586 N GLN A 168 1.963 -14.593 0.814 1.00 24.65 N ATOM 1587 CA GLN A 168 0.998 -15.626 0.625 1.00 26.09 C ATOM 1588 C GLN A 168 -0.163 -15.043 -0.176 1.00 25.01 C ATOM 1589 O GLN A 168 -0.377 -13.852 -0.176 1.00 23.96 O ATOM 1590 CB GLN A 168 0.439 -16.049 1.994 1.00 23.44 C ATOM 1591 CG GLN A 168 1.438 -16.748 2.879 1.00 25.01 C ATOM 1592 CD GLN A 168 0.982 -16.822 4.326 1.00 23.11 C ATOM 1593 OE1 GLN A 168 0.768 -15.796 4.991 1.00 19.95 O ATOM 1594 NE2 GLN A 168 0.820 -18.045 4.816 1.00 22.64 N ATOM 1595 HE22 GLN A 168 1.012 -18.874 4.219 1.00 0.00 H ATOM 1596 HE21 GLN A 168 0.501 -18.174 5.797 1.00 0.00 H ATOM 1597 H GLN A 168 1.643 -13.693 1.226 1.00 0.00 H ATOM 1598 N GLY A 169 -0.957 -15.931 -0.756 1.00 26.30 N ATOM 1599 CA GLY A 169 -2.232 -15.581 -1.387 1.00 22.80 C ATOM 1600 C GLY A 169 -3.391 -16.413 -0.894 1.00 23.50 C ATOM 1601 O GLY A 169 -3.216 -17.523 -0.344 1.00 23.57 O ATOM 1602 H GLY A 169 -0.660 -16.928 -0.764 1.00 0.00 H ATOM 1603 N PHE A 170 -4.586 -15.861 -1.082 1.00 21.72 N ATOM 1604 CA PHE A 170 -5.775 -16.452 -0.570 1.00 23.03 C ATOM 1605 C PHE A 170 -6.870 -16.496 -1.619 1.00 21.66 C ATOM 1606 O PHE A 170 -7.032 -15.541 -2.378 1.00 22.72 O ATOM 1607 CB PHE A 170 -6.262 -15.681 0.642 1.00 25.26 C ATOM 1608 CG PHE A 170 -5.184 -15.496 1.684 1.00 27.56 C ATOM 1609 CD1 PHE A 170 -4.812 -16.569 2.505 1.00 30.20 C ATOM 1610 CD2 PHE A 170 -4.497 -14.303 1.792 1.00 25.78 C ATOM 1611 CE1 PHE A 170 -3.795 -16.425 3.432 1.00 29.03 C ATOM 1612 CE2 PHE A 170 -3.470 -14.164 2.721 1.00 28.70 C ATOM 1613 CZ PHE A 170 -3.124 -15.224 3.532 1.00 28.11 C ATOM 1614 H PHE A 170 -4.654 -14.972 -1.618 1.00 0.00 H ATOM 1615 N CYS A 171 -7.608 -17.597 -1.626 1.00 20.49 N ATOM 1616 CA CYS A 171 -8.800 -17.734 -2.473 1.00 20.51 C ATOM 1617 C CYS A 171 -10.001 -17.975 -1.616 1.00 20.64 C ATOM 1618 O CYS A 171 -9.882 -18.445 -0.472 1.00 22.48 O ATOM 1619 CB CYS A 171 -8.661 -18.851 -3.498 1.00 18.93 C ATOM 1620 SG CYS A 171 -8.517 -20.556 -2.882 1.00 20.94 S ATOM 1621 H CYS A 171 -7.334 -18.390 -1.011 1.00 0.00 H ATOM 1622 N ALA A 172 -11.147 -17.579 -2.151 1.00 20.56 N ATOM 1623 CA ALA A 172 -12.433 -17.988 -1.628 1.00 21.82 C ATOM 1624 C ALA A 172 -12.629 -19.373 -2.198 1.00 22.38 C ATOM 1625 O ALA A 172 -12.432 -19.559 -3.375 1.00 24.75 O ATOM 1626 CB ALA A 172 -13.552 -17.054 -2.095 1.00 23.67 C ATOM 1627 H ALA A 172 -11.121 -16.950 -2.979 1.00 0.00 H ATOM 1628 N GLY A 173 -12.953 -20.348 -1.353 1.00 20.21 N ATOM 1629 CA GLY A 173 -13.192 -21.717 -1.801 1.00 20.10 C ATOM 1630 C GLY A 173 -14.472 -21.897 -2.624 1.00 19.68 C ATOM 1631 O GLY A 173 -15.511 -21.356 -2.289 1.00 19.73 O ATOM 1632 H GLY A 173 -13.039 -20.128 -0.340 1.00 0.00 H ATOM 1633 N LEU A 174 -14.403 -22.696 -3.683 1.00 18.30 N ATOM 1634 CA LEU A 174 -15.634 -23.031 -4.410 1.00 19.24 C ATOM 1635 C LEU A 174 -16.278 -24.358 -3.952 1.00 18.58 C ATOM 1636 O LEU A 174 -15.591 -25.370 -3.678 1.00 17.89 O ATOM 1637 CB LEU A 174 -15.386 -23.040 -5.937 1.00 18.75 C ATOM 1638 CG LEU A 174 -14.807 -21.762 -6.523 1.00 18.72 C ATOM 1639 CD1 LEU A 174 -14.726 -21.817 -8.049 1.00 17.74 C ATOM 1640 CD2 LEU A 174 -15.638 -20.580 -6.082 1.00 19.47 C ATOM 1641 H LEU A 174 -13.488 -23.080 -3.994 1.00 0.00 H ATOM 1642 N LYS A 175 -17.604 -24.315 -3.868 1.00 18.00 N ATOM 1643 CA LYS A 175 -18.411 -25.503 -3.775 1.00 19.29 C ATOM 1644 C LYS A 175 -19.572 -25.488 -4.789 1.00 17.76 C ATOM 1645 O LYS A 175 -20.085 -24.440 -5.187 1.00 14.89 O ATOM 1646 CB LYS A 175 -18.927 -25.734 -2.338 1.00 22.49 C ATOM 1647 CG LYS A 175 -20.110 -24.884 -1.911 1.00 24.33 C ATOM 1648 CD LYS A 175 -20.212 -24.764 -0.401 1.00 25.09 C ATOM 1649 CE LYS A 175 -20.552 -26.089 0.243 1.00 27.02 C ATOM 1650 NZ LYS A 175 -21.253 -25.820 1.528 1.00 29.69 N ATOM 1651 HZ1 LYS A 175 -20.630 -25.269 2.153 1.00 0.00 H ATOM 1652 HZ2 LYS A 175 -22.123 -25.281 1.341 1.00 0.00 H ATOM 1653 HZ3 LYS A 175 -21.495 -26.722 1.985 1.00 0.00 H ATOM 1654 H LYS A 175 -18.076 -23.388 -3.870 1.00 0.00 H ATOM 1655 N ARG A 176 -19.954 -26.700 -5.177 1.00 19.06 N ATOM 1656 CA ARG A 176 -20.775 -26.905 -6.344 1.00 20.51 C ATOM 1657 C ARG A 176 -22.125 -26.315 -6.077 1.00 20.78 C ATOM 1658 O ARG A 176 -22.744 -25.718 -6.976 1.00 20.57 O ATOM 1659 CB ARG A 176 -20.828 -28.385 -6.770 1.00 21.36 C ATOM 1660 CG ARG A 176 -21.304 -28.590 -8.220 1.00 21.54 C ATOM 1661 CD ARG A 176 -21.381 -30.076 -8.601 1.00 24.21 C ATOM 1662 NE ARG A 176 -20.058 -30.675 -8.501 1.00 26.16 N ATOM 1663 CZ ARG A 176 -19.797 -31.965 -8.305 1.00 29.26 C ATOM 1664 NH1 ARG A 176 -20.766 -32.878 -8.177 1.00 29.30 N ATOM 1665 NH2 ARG A 176 -18.528 -32.334 -8.204 1.00 30.53 N ATOM 1666 HE ARG A 176 -19.242 -30.036 -8.591 1.00 0.00 H ATOM 1667 HH12 ARG A 176 -20.522 -33.877 -8.025 1.00 0.00 H ATOM 1668 HH11 ARG A 176 -21.764 -32.588 -8.230 1.00 0.00 H ATOM 1669 HH22 ARG A 176 -18.288 -33.334 -8.051 1.00 0.00 H ATOM 1670 HH21 ARG A 176 -17.772 -31.623 -8.278 1.00 0.00 H ATOM 1671 H ARG A 176 -19.652 -27.526 -4.622 1.00 0.00 H ATOM 1672 N SER A 177 -22.565 -26.384 -4.823 1.00 20.26 N ATOM 1673 CA SER A 177 -23.904 -25.941 -4.489 1.00 20.15 C ATOM 1674 C SER A 177 -24.141 -24.440 -4.687 1.00 19.60 C ATOM 1675 O SER A 177 -25.298 -24.032 -4.881 1.00 20.94 O ATOM 1676 CB SER A 177 -24.257 -26.351 -3.055 1.00 21.55 C ATOM 1677 OG SER A 177 -23.631 -25.489 -2.151 1.00 23.40 O ATOM 1678 HG SER A 177 -23.939 -24.562 -2.313 1.00 0.00 H ATOM 1679 H SER A 177 -21.944 -26.758 -4.078 1.00 0.00 H ATOM 1680 N TYR A 178 -23.088 -23.613 -4.645 1.00 17.83 N ATOM 1681 CA TYR A 178 -23.215 -22.185 -4.975 1.00 17.35 C ATOM 1682 C TYR A 178 -23.811 -21.973 -6.352 1.00 19.09 C ATOM 1683 O TYR A 178 -24.496 -20.973 -6.607 1.00 19.39 O ATOM 1684 CB TYR A 178 -21.864 -21.483 -4.974 1.00 17.48 C ATOM 1685 CG TYR A 178 -21.088 -21.425 -3.654 1.00 17.85 C ATOM 1686 CD1 TYR A 178 -21.737 -21.489 -2.411 1.00 17.81 C ATOM 1687 CD2 TYR A 178 -19.692 -21.247 -3.663 1.00 16.45 C ATOM 1688 CE1 TYR A 178 -21.013 -21.403 -1.228 1.00 17.78 C ATOM 1689 CE2 TYR A 178 -18.980 -21.139 -2.500 1.00 16.68 C ATOM 1690 CZ TYR A 178 -19.645 -21.255 -1.280 1.00 17.48 C ATOM 1691 OH TYR A 178 -18.913 -21.170 -0.102 1.00 18.24 O ATOM 1692 HH TYR A 178 -18.463 -20.289 -0.057 1.00 0.00 H ATOM 1693 H TYR A 178 -22.158 -23.990 -4.372 1.00 0.00 H ATOM 1694 N PHE A 179 -23.520 -22.912 -7.246 1.00 20.42 N ATOM 1695 CA PHE A 179 -23.890 -22.803 -8.655 1.00 22.49 C ATOM 1696 C PHE A 179 -25.058 -23.718 -9.028 1.00 24.15 C ATOM 1697 O PHE A 179 -25.402 -23.776 -10.198 1.00 24.50 O ATOM 1698 CB PHE A 179 -22.648 -23.047 -9.529 1.00 20.84 C ATOM 1699 CG PHE A 179 -21.480 -22.227 -9.120 1.00 19.72 C ATOM 1700 CD1 PHE A 179 -21.427 -20.891 -9.428 1.00 20.57 C ATOM 1701 CD2 PHE A 179 -20.482 -22.763 -8.347 1.00 20.77 C ATOM 1702 CE1 PHE A 179 -20.382 -20.109 -8.991 1.00 20.58 C ATOM 1703 CE2 PHE A 179 -19.423 -22.006 -7.937 1.00 19.46 C ATOM 1704 CZ PHE A 179 -19.363 -20.669 -8.267 1.00 19.80 C ATOM 1705 H PHE A 179 -23.008 -23.760 -6.929 1.00 0.00 H ATOM 1706 N ALA A 180 -25.684 -24.382 -8.030 1.00 24.61 N ATOM 1707 CA ALA A 180 -26.918 -25.139 -8.233 1.00 25.91 C ATOM 1708 C ALA A 180 -28.087 -24.244 -8.600 1.00 27.43 C ATOM 1709 O ALA A 180 -28.947 -24.695 -9.366 1.00 34.33 O ATOM 1710 CB ALA A 180 -27.277 -25.957 -6.990 1.00 27.41 C ATOM 1711 H ALA A 180 -25.270 -24.353 -7.077 1.00 0.00 H TER 1712 ALA A 180 HETATM 1713 O HOH 1 -2.106 -31.675 -1.675 1.00 26.02 O HETATM 1714 O HOH 2 -17.645 -10.342 6.961 1.00 27.72 O HETATM 1715 O HOH 3 -21.444 -12.012 -27.652 1.00 28.29 O HETATM 1716 O HOH 4 -5.415 -13.762 -23.245 1.00 32.29 O HETATM 1717 O HOH 5 -7.363 -26.666 -24.334 1.00 28.12 O HETATM 1718 O HOH 6 -24.666 -5.791 -10.223 1.00 27.66 O HETATM 1719 O HOH 7 1.354 -24.715 -11.066 1.00 33.14 O HETATM 1720 O HOH 8 7.197 -11.733 -0.073 1.00 22.02 O HETATM 1721 O HOH 9 -7.483 -23.379 -26.530 1.00 32.45 O HETATM 1722 O HOH 10 -7.298 -8.258 -24.130 1.00 27.78 O HETATM 1723 O HOH 11 -25.694 -10.871 0.498 1.00 19.02 O HETATM 1724 O HOH 12 -23.188 -16.818 -20.731 1.00 22.53 O HETATM 1725 O HOH 13 -2.769 -29.698 -12.963 1.00 19.12 O HETATM 1726 O HOH 14 -20.636 -5.897 -0.234 1.00 32.51 O HETATM 1727 O HOH 15 -20.202 -7.603 -5.166 1.00 24.28 O HETATM 1728 O HOH 16 -16.718 -19.766 -0.218 1.00 20.13 O HETATM 1729 O HOH 17 -18.720 -20.297 6.799 1.00 32.46 O HETATM 1730 O HOH 18 -14.723 -17.759 0.721 1.00 17.99 O HETATM 1731 O HOH 19 -8.310 -2.719 1.121 1.00 41.49 O HETATM 1732 O HOH 20 -11.071 -26.650 -19.569 1.00 32.18 O HETATM 1733 O HOH 21 -23.114 -32.362 -9.289 1.00 32.95 O HETATM 1734 O HOH 22 -26.039 -7.574 -22.370 1.00 17.21 O HETATM 1735 O HOH 23 -17.584 -2.019 -16.160 1.00 26.32 O HETATM 1736 O HOH 24 -15.755 -13.287 -25.018 1.00 43.98 O HETATM 1737 O HOH 25 -18.258 -21.349 -22.755 1.00 28.83 O HETATM 1738 O HOH 26 -26.701 -20.853 -8.114 1.00 30.30 O HETATM 1739 O HOH 27 -7.338 -10.982 -12.244 1.00 15.83 O HETATM 1740 O HOH 28 0.000 -12.137 -19.037 1.00 21.20 O HETATM 1741 O HOH 29 -28.634 -3.918 -15.317 1.00 32.89 O HETATM 1742 O HOH 30 -24.253 -24.039 -19.588 1.00 21.33 O HETATM 1743 O HOH 31 -6.986 -31.767 -15.606 1.00 52.62 O HETATM 1744 O HOH 32 -9.651 -6.836 -17.509 1.00 19.31 O HETATM 1745 O HOH 33 -4.673 -31.551 -6.197 1.00 35.89 O HETATM 1746 O HOH 34 0.833 -11.787 -1.765 1.00 30.18 O HETATM 1747 O HOH 35 1.277 -6.685 -16.965 1.00 33.26 O HETATM 1748 O HOH 36 -25.094 -28.310 -14.072 1.00 36.26 O HETATM 1749 O HOH 37 -12.839 -25.920 -3.312 1.00 24.38 O HETATM 1750 O HOH 38 -5.147 -28.482 -15.497 1.00 52.36 O HETATM 1751 O HOH 39 -11.031 -5.722 -19.920 1.00 16.00 O HETATM 1752 O HOH 40 -3.997 -17.495 -24.552 1.00 27.67 O HETATM 1753 O HOH 41 -19.560 -12.152 -1.049 1.00 21.81 O HETATM 1754 O HOH 42 -21.457 1.362 -10.820 1.00 30.90 O HETATM 1755 O HOH 43 3.487 -10.526 -11.980 1.00 24.43 O HETATM 1756 O HOH 44 -5.408 -28.035 4.479 1.00 31.03 O HETATM 1757 O HOH 45 -11.712 -15.680 -22.426 1.00 30.15 O HETATM 1758 O HOH 46 -0.288 -23.439 0.877 1.00 35.24 O HETATM 1759 O HOH 47 -4.966 -7.236 -13.793 1.00 24.63 O HETATM 1760 O HOH 48 -28.680 -5.625 -12.019 1.00 29.41 O HETATM 1761 O HOH 49 -18.417 -14.256 -21.912 1.00 24.58 O HETATM 1762 O HOH 50 2.452 -13.019 -10.417 1.00 25.55 O HETATM 1763 O HOH 51 -22.613 -9.314 0.973 1.00 25.26 O HETATM 1764 O HOH 52 3.408 -11.923 -8.063 1.00 33.72 O HETATM 1765 O HOH 53 -22.019 -26.983 -21.428 1.00 23.88 O HETATM 1766 O HOH 54 -19.275 -3.555 -13.328 1.00 28.17 O HETATM 1767 O HOH 55 -13.702 -14.713 -10.707 1.00 23.20 O HETATM 1768 O HOH 56 -26.802 -14.048 -9.916 1.00 16.73 O HETATM 1769 O HOH 57 -30.154 -12.893 -21.423 1.00 34.52 O HETATM 1770 O HOH 58 -7.639 -32.876 -2.586 1.00 24.57 O HETATM 1771 O HOH 59 5.704 -9.645 -2.883 1.00 25.47 O HETATM 1772 O HOH 60 -30.575 -14.729 -11.699 1.00 36.52 O HETATM 1773 O HOH 61 -20.403 -29.727 -15.701 1.00 23.00 O HETATM 1774 O HOH 62 -28.048 -17.420 11.467 1.00 27.08 O HETATM 1775 O HOH 63 -14.499 -33.092 -10.517 1.00 34.43 O HETATM 1776 O HOH 64 -25.620 -15.437 0.288 1.00 25.59 O HETATM 1777 O HOH 65 0.619 -6.064 -5.497 1.00 28.98 O HETATM 1778 O HOH 66 -23.270 -30.397 -4.533 1.00 34.88 O HETATM 1779 O HOH 67 -7.587 -7.908 -9.375 1.00 17.47 O HETATM 1780 O HOH 68 -16.544 -0.900 -4.299 1.00 39.27 O HETATM 1781 O HOH 69 -7.023 -3.047 -11.776 1.00 32.09 O HETATM 1782 O HOH 70 -24.684 -17.997 0.392 1.00 22.25 O HETATM 1783 O HOH 71 -17.897 -10.686 -24.003 1.00 23.84 O HETATM 1784 O HOH 72 -28.492 -18.273 -16.257 1.00 19.95 O HETATM 1785 O HOH 73 -20.369 -2.190 -25.713 1.00 30.04 O HETATM 1786 O HOH 74 -28.859 -7.281 -8.581 1.00 26.94 O HETATM 1787 O HOH 75 -24.812 -22.695 -2.023 1.00 37.56 O HETATM 1788 O HOH 76 -16.469 -33.381 -4.716 1.00 29.53 O HETATM 1789 O HOH 77 -17.210 -20.914 10.993 1.00 34.79 O HETATM 1790 O HOH 78 -13.924 -20.684 7.497 1.00 23.74 O HETATM 1791 O HOH 79 -15.075 -4.108 -0.776 1.00 17.73 O HETATM 1792 O HOH 80 0.000 -31.389 -19.037 1.00 14.07 O HETATM 1793 O HOH 81 -31.894 -26.014 -9.160 1.00 44.37 O HETATM 1794 O HOH 82 -29.969 -15.031 -18.561 1.00 26.37 O HETATM 1795 O HOH 83 -5.919 -25.178 -26.570 1.00 33.20 O HETATM 1796 O HOH 84 -24.841 -28.868 -6.421 1.00 34.82 O HETATM 1797 O HOH 85 -27.033 -5.766 -10.354 1.00 28.38 O HETATM 1798 O HOH 86 -4.743 -4.397 -13.130 1.00 26.15 O HETATM 1799 O HOH 87 -27.832 -16.224 -8.441 1.00 17.87 O HETATM 1800 C2 UNN A 88 -7.873 -7.197 -1.380 1.00 0.07 C HETATM 1801 C3 UNN A 88 -9.096 -6.386 -1.779 1.00 0.00 C HETATM 1802 C4 UNN A 88 -10.277 -6.413 -0.824 1.00 -0.04 C HETATM 1803 C5 UNN A 88 -10.603 -5.263 -0.098 1.00 -0.06 C HETATM 1804 C6 UNN A 88 -11.684 -5.247 0.773 1.00 -0.03 C HETATM 1805 C7 UNN A 88 -12.463 -6.388 0.946 1.00 0.12 C HETATM 1806 C8 UNN A 88 -12.153 -7.539 0.199 1.00 -0.03 C HETATM 1807 C9 UNN A 88 -11.062 -7.538 -0.682 1.00 -0.06 C HETATM 1808 H39 UNN A 88 -10.834 -8.429 -1.256 1.00 0.05 H HETATM 1809 H6 UNN A 88 -12.760 -8.431 0.305 1.00 0.06 H HETATM 1810 F1 UNN A 88 -13.530 -6.373 1.784 1.00 -0.19 F HETATM 1811 H5 UNN A 88 -11.922 -4.342 1.321 1.00 0.06 H HETATM 1812 H4 UNN A 88 -10.002 -4.369 -0.217 1.00 0.05 H HETATM 1813 H2 UNN A 88 -9.445 -6.766 -2.751 1.00 0.04 H HETATM 1814 H3 UNN A 88 -8.780 -5.338 -1.887 1.00 0.04 H HETATM 1815 C17 UNN A 88 -6.935 -7.120 -2.571 1.00 0.18 C HETATM 1816 N UNN A 88 -6.959 -8.144 -3.449 1.00 -0.28 N HETATM 1817 C10 UNN A 88 -6.048 -8.125 -4.630 1.00 0.05 C HETATM 1818 C14 UNN A 88 -6.964 -8.351 -5.834 1.00 -0.01 C HETATM 1819 C15 UNN A 88 -7.838 -7.116 -5.993 1.00 0.05 C HETATM 1820 C16 UNN A 88 -7.033 -5.879 -6.319 1.00 0.23 C HETATM 1821 O3 UNN A 88 -6.128 -5.860 -7.141 1.00 -0.37 O HETATM 1822 O2 UNN A 88 -7.359 -4.645 -5.659 1.00 -0.28 O HETATM 1823 C18 UNN A 88 -7.366 -3.523 -6.534 1.00 0.07 C HETATM 1824 C19 UNN A 88 -8.522 -3.685 -7.515 1.00 -0.04 C HETATM 1825 H14 UNN A 88 -8.544 -2.825 -8.201 1.00 0.03 H HETATM 1826 H15 UNN A 88 -9.470 -3.735 -6.960 1.00 0.03 H HETATM 1827 H16 UNN A 88 -8.386 -4.612 -8.092 1.00 0.03 H HETATM 1828 H12 UNN A 88 -6.415 -3.476 -7.085 1.00 0.06 H HETATM 1829 H13 UNN A 88 -7.499 -2.599 -5.952 1.00 0.06 H HETATM 1830 H17 UNN A 88 -8.557 -7.294 -6.806 1.00 0.05 H HETATM 1831 H18 UNN A 88 -8.383 -6.945 -5.053 1.00 0.05 H HETATM 1832 H19 UNN A 88 -6.360 -8.501 -6.741 1.00 0.03 H HETATM 1833 H20 UNN A 88 -7.595 -9.236 -5.663 1.00 0.03 H HETATM 1834 C11 UNN A 88 -4.958 -9.152 -4.525 1.00 -0.01 C HETATM 1835 C12 UNN A 88 -3.955 -8.904 -3.370 1.00 0.05 C HETATM 1836 C26 UNN A 88 -3.206 -7.577 -3.408 1.00 -0.01 C HETATM 1837 C25 UNN A 88 -1.765 -7.860 -2.931 1.00 0.03 C HETATM 1838 N1 UNN A 88 -1.664 -9.309 -3.047 1.00 -0.29 N HETATM 1839 C13 UNN A 88 -2.829 -9.896 -3.409 1.00 0.18 C HETATM 1840 O1 UNN A 88 -2.993 -11.065 -3.779 1.00 -0.40 O HETATM 1841 H7 UNN A 88 -0.820 -9.818 -2.877 1.00 0.19 H HETATM 1842 H27 UNN A 88 -1.029 -7.359 -3.576 1.00 0.05 H HETATM 1843 H28 UNN A 88 -1.621 -7.535 -1.890 1.00 0.05 H HETATM 1844 H25 UNN A 88 -3.690 -6.851 -2.739 1.00 0.03 H HETATM 1845 H26 UNN A 88 -3.193 -7.179 -4.434 1.00 0.03 H HETATM 1846 H24 UNN A 88 -4.508 -8.986 -2.423 1.00 0.05 H HETATM 1847 H22 UNN A 88 -4.398 -9.158 -5.472 1.00 0.03 H HETATM 1848 H23 UNN A 88 -5.426 -10.136 -4.370 1.00 0.03 H HETATM 1849 H21 UNN A 88 -5.574 -7.136 -4.712 1.00 0.06 H HETATM 1850 H11 UNN A 88 -7.584 -8.912 -3.309 1.00 0.19 H HETATM 1851 O4 UNN A 88 -6.168 -6.162 -2.682 1.00 -0.40 O HETATM 1852 C21 UNN A 88 -7.221 -6.748 -0.040 1.00 0.05 C HETATM 1853 C UNN A 88 -5.932 -7.466 0.374 1.00 0.16 C HETATM 1854 O UNN A 88 -5.404 -8.368 -0.283 1.00 -0.39 O HETATM 1855 C20 UNN A 88 -5.211 -7.014 1.652 1.00 0.05 C HETATM 1856 N2 UNN A 88 -4.103 -7.942 2.056 1.00 0.24 N HETATM 1857 H8 UNN A 88 -4.471 -8.873 2.175 1.00 0.20 H HETATM 1858 H9 UNN A 88 -3.700 -7.626 2.924 1.00 0.20 H HETATM 1859 H10 UNN A 88 -3.394 -7.950 1.340 1.00 0.20 H HETATM 1860 C22 UNN A 88 -4.636 -5.595 1.473 1.00 0.01 C HETATM 1861 C24 UNN A 88 -3.755 -5.491 0.227 1.00 -0.06 C HETATM 1862 H33 UNN A 88 -3.366 -4.466 0.137 1.00 0.02 H HETATM 1863 H34 UNN A 88 -4.350 -5.737 -0.665 1.00 0.02 H HETATM 1864 H35 UNN A 88 -2.914 -6.195 0.312 1.00 0.02 H HETATM 1865 C23 UNN A 88 -3.865 -5.147 2.706 1.00 -0.06 C HETATM 1866 H36 UNN A 88 -4.512 -5.228 3.592 1.00 0.02 H HETATM 1867 H37 UNN A 88 -3.546 -4.102 2.579 1.00 0.02 H HETATM 1868 H38 UNN A 88 -2.980 -5.787 2.838 1.00 0.02 H HETATM 1869 H32 UNN A 88 -5.485 -4.909 1.340 1.00 0.04 H HETATM 1870 H31 UNN A 88 -5.951 -6.992 2.465 1.00 0.11 H HETATM 1871 H29 UNN A 88 -7.961 -6.904 0.759 1.00 0.05 H HETATM 1872 H30 UNN A 88 -6.992 -5.675 -0.124 1.00 0.05 H HETATM 1873 H1 UNN A 88 -8.181 -8.245 -1.247 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1800 1801 1815 1852 1873 CONECT 1801 1800 1802 1813 1814 CONECT 1802 1801 1803 1807 CONECT 1803 1802 1804 1812 CONECT 1804 1803 1805 1811 CONECT 1805 1804 1806 1810 CONECT 1806 1805 1807 1809 CONECT 1807 1802 1806 1808 CONECT 1808 1807 CONECT 1809 1806 CONECT 1810 1805 CONECT 1811 1804 CONECT 1812 1803 CONECT 1813 1801 CONECT 1814 1801 CONECT 1815 1800 1816 1851 CONECT 1816 1815 1817 1850 CONECT 1817 1816 1818 1834 1849 CONECT 1818 1817 1819 1832 1833 CONECT 1819 1818 1820 1830 1831 CONECT 1820 1819 1821 1822 CONECT 1821 1820 CONECT 1822 1820 1823 CONECT 1823 1822 1824 1828 1829 CONECT 1824 1823 1825 1826 1827 CONECT 1825 1824 CONECT 1826 1824 CONECT 1827 1824 CONECT 1828 1823 CONECT 1829 1823 CONECT 1830 1819 CONECT 1831 1819 CONECT 1832 1818 CONECT 1833 1818 CONECT 1834 1817 1835 1847 1848 CONECT 1835 1834 1836 1839 1846 CONECT 1836 1835 1837 1844 1845 CONECT 1837 1836 1838 1842 1843 CONECT 1838 1837 1839 1841 CONECT 1839 1835 1838 1840 CONECT 1840 1839 CONECT 1841 1838 CONECT 1842 1837 CONECT 1843 1837 CONECT 1844 1836 CONECT 1845 1836 CONECT 1846 1835 CONECT 1847 1834 CONECT 1848 1834 CONECT 1849 1817 CONECT 1850 1816 CONECT 1851 1815 CONECT 1852 1800 1853 1871 1872 CONECT 1853 1852 1854 1855 CONECT 1854 1853 CONECT 1855 1853 1856 1860 1870 CONECT 1856 1855 1857 1858 1859 CONECT 1857 1856 CONECT 1858 1856 CONECT 1859 1856 CONECT 1860 1855 1861 1865 1869 CONECT 1861 1860 1862 1863 1864 CONECT 1862 1861 CONECT 1863 1861 CONECT 1864 1861 CONECT 1865 1860 1866 1867 1868 CONECT 1866 1865 CONECT 1867 1865 CONECT 1868 1865 CONECT 1869 1860 CONECT 1870 1855 CONECT 1871 1852 CONECT 1872 1852 CONECT 1873 1800 MASTER 0 0 0 0 0 0 0 0 1872 1 78 14 END
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Related entries of code: 5dp5
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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5c1y
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PDBbind
192aa, >5C1Y_1|Chain... at 94%
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PDBbind
192aa, >5C20_1|Chain... at 94%
5dp4
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PDBbind
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RCSB PDB
PDBbind
192aa, >5DP6_1|Chains... at 94%
5dp7
RCSB PDB
PDBbind
192aa, >5DP7_1|Chain... at 94%
5dp8
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PDBbind
192aa, >5DP8_1|Chain... at 94%
5dp9
RCSB PDB
PDBbind
192aa, >5DP9_1|Chain... at 94%
5dpa
RCSB PDB
PDBbind
192aa, >5DPA_1|Chain... at 94%
5gso
RCSB PDB
PDBbind
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5dp5
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
EV71 3C Proteinase
Ligand Name
5E9
EC.Number
E.C.-.-.-.-
Resolution
2.03(Å)
Affinity (Kd/Ki/IC50)
IC50=18.70uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Biochim.Biophys.Acta Vol. 1860: pp. 1299-1307
Ligand Properties
Formula
C
2
6
H
3
9
FN
3
O
5
Molecular Weight
492.603
Exact Mass
492.287
No. of atoms
74
No. of bonds
75
Polar Surface Area
129.21
LOGP Value
2.06 (
Computed with XLOGP3
)
2.28 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 16
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 2
Canonical SMILES
CCOC(=O)CC[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](Cc1ccc(cc1)F)CC(=O)[C@H](C(C)C)[NH3+]
InChI String
InChI=1S/C26H38FN3O5/c1-4-35-23(32)10-9-21(14-18-11-12-29-25(18)33)30-26(34)19(15-22(31)24(28)16(2)3)13-17-5-7-20(27)8-6-17/h5-8,16,18-19,21,24H,4,9-15,28H2,1-3H3,(H,29,33)(H,30,34)/p+1/t18-,19+,21+,24-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A9XG43
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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