Browse entries in the PDBbind-CN Database
HEADER 5V5E_COMPLEX COMPND 5V5E_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 16 GLY LEU TYR VAL GLY GLY PHE VAL ASP VAL VAL SER CYS SEQRES 2 A 16 PRO LYS LEU SEQRES 1 A 172 GLU LEU TYR LEU ASP PRO ASP GLN VAL THR ASP TYR LEU SEQRES 2 A 172 PRO VAL THR GLU PRO LEU PRO ILE THR ILE GLU HIS LEU SEQRES 3 A 172 PRO GLU THR GLU VAL GLY TRP THR LEU GLY LEU PHE GLN SEQRES 4 A 172 VAL SER HIS GLY ILE PHE CYS THR GLY ALA ILE THR SER SEQRES 5 A 172 PRO ALA PHE LEU GLU LEU ALA SER ARG LEU ALA ASP THR SEQRES 6 A 172 SER HIS VAL ALA ARG ALA PRO VAL LYS ASN LEU PRO LYS SEQRES 7 A 172 GLU PRO LEU LEU GLU ILE LEU HIS THR TRP LEU PRO GLY SEQRES 8 A 172 LEU SER LEU SER SER ILE HIS PRO ARG GLU LEU SER GLN SEQRES 9 A 172 THR PRO SER GLY PRO VAL PHE GLN HIS VAL SER LEU CYS SEQRES 10 A 172 ALA LEU GLY ARG ARG ARG GLY THR VAL ALA VAL TYR GLY SEQRES 11 A 172 HIS ASP ALA GLU TRP VAL VAL SER ARG PHE SER SER VAL SEQRES 12 A 172 SER LYS SER GLU ARG ALA HIS ILE LEU GLN HIS VAL SER SEQRES 13 A 172 SER CYS ARG LEU GLU ASP LEU SER THR PRO ASN PHE VAL SEQRES 14 A 172 SER PRO LEU HET UNN A 208 62 ATOM 1 N GLY A 4 -10.005 -18.025 -43.855 1.00 64.16 N ATOM 2 CA GLY A 4 -9.786 -16.844 -43.039 1.00 65.79 C ATOM 3 C GLY A 4 -10.505 -15.623 -43.580 1.00 67.50 C ATOM 4 O GLY A 4 -10.309 -15.238 -44.732 1.00 69.52 O ATOM 5 HN3 GLY A 4 -9.657 -17.848 -44.819 1.00 0.00 H ATOM 6 HN2 GLY A 4 -11.022 -18.239 -43.887 1.00 0.00 H ATOM 7 HN1 GLY A 4 -9.492 -18.830 -43.442 1.00 0.00 H ATOM 8 N LEU A 5 -11.337 -15.009 -42.742 1.00 63.30 N ATOM 9 CA LEU A 5 -12.145 -13.869 -43.152 1.00 59.42 C ATOM 10 C LEU A 5 -12.203 -12.865 -42.011 1.00 58.18 C ATOM 11 O LEU A 5 -12.409 -13.251 -40.856 1.00 60.05 O ATOM 12 CB LEU A 5 -13.558 -14.322 -43.542 1.00 56.93 C ATOM 13 CG LEU A 5 -14.236 -13.574 -44.689 1.00 57.07 C ATOM 14 CD1 LEU A 5 -13.500 -13.804 -46.002 1.00 62.21 C ATOM 15 CD2 LEU A 5 -15.689 -14.007 -44.806 1.00 53.33 C ATOM 16 H LEU A 5 -11.412 -15.354 -41.764 1.00 0.00 H ATOM 17 N TYR A 6 -12.019 -11.589 -42.331 1.00 53.37 N ATOM 18 CA TYR A 6 -12.056 -10.522 -41.342 1.00 52.88 C ATOM 19 C TYR A 6 -13.384 -9.777 -41.410 1.00 48.51 C ATOM 20 O TYR A 6 -14.023 -9.701 -42.463 1.00 45.46 O ATOM 21 CB TYR A 6 -10.903 -9.538 -41.555 1.00 60.38 C ATOM 22 CG TYR A 6 -9.534 -10.121 -41.290 1.00 69.58 C ATOM 23 CD1 TYR A 6 -9.053 -10.250 -39.994 1.00 74.02 C ATOM 24 CD2 TYR A 6 -8.720 -10.535 -42.335 1.00 75.72 C ATOM 25 CE1 TYR A 6 -7.803 -10.781 -39.747 1.00 79.36 C ATOM 26 CE2 TYR A 6 -7.468 -11.066 -42.097 1.00 80.93 C ATOM 27 CZ TYR A 6 -7.014 -11.186 -40.801 1.00 83.90 C ATOM 28 OH TYR A 6 -5.768 -11.714 -40.558 1.00 89.56 O ATOM 29 HH TYR A 6 -5.601 -11.728 -39.582 1.00 0.00 H ATOM 30 H TYR A 6 -11.842 -11.343 -43.326 1.00 0.00 H ATOM 31 N VAL A 7 -13.791 -9.223 -40.268 1.00 51.83 N ATOM 32 CA VAL A 7 -15.015 -8.438 -40.168 1.00 50.61 C ATOM 33 C VAL A 7 -14.736 -7.227 -39.289 1.00 52.07 C ATOM 34 O VAL A 7 -13.908 -7.277 -38.374 1.00 53.67 O ATOM 35 CB VAL A 7 -16.191 -9.270 -39.603 1.00 49.40 C ATOM 36 CG1 VAL A 7 -15.897 -9.733 -38.180 1.00 47.33 C ATOM 37 CG2 VAL A 7 -17.497 -8.479 -39.662 1.00 47.77 C ATOM 38 H VAL A 7 -13.212 -9.356 -39.414 1.00 0.00 H ATOM 39 N GLY A 8 -15.435 -6.131 -39.572 1.00 49.29 N ATOM 40 CA GLY A 8 -15.272 -4.920 -38.790 1.00 48.14 C ATOM 41 C GLY A 8 -16.477 -4.017 -38.904 1.00 46.54 C ATOM 42 O GLY A 8 -17.264 -4.109 -39.852 1.00 46.64 O ATOM 43 H GLY A 8 -16.108 -6.143 -40.365 1.00 0.00 H ATOM 44 N GLY A 9 -16.613 -3.138 -37.923 1.00 44.89 N ATOM 45 CA GLY A 9 -17.703 -2.184 -37.911 1.00 43.37 C ATOM 46 C GLY A 9 -17.989 -1.699 -36.511 1.00 43.93 C ATOM 47 O GLY A 9 -17.458 -2.208 -35.524 1.00 46.93 O ATOM 48 H GLY A 9 -15.923 -3.132 -37.145 1.00 0.00 H ATOM 49 N PHE A 10 -18.839 -0.679 -36.443 1.00 41.27 N ATOM 50 CA PHE A 10 -19.301 -0.166 -35.163 1.00 46.00 C ATOM 51 C PHE A 10 -20.443 -1.029 -34.641 1.00 46.66 C ATOM 52 O PHE A 10 -21.250 -1.560 -35.409 1.00 45.36 O ATOM 53 CB PHE A 10 -19.751 1.289 -35.293 1.00 51.08 C ATOM 54 CG PHE A 10 -18.620 2.253 -35.525 1.00 61.23 C ATOM 55 CD1 PHE A 10 -18.124 2.468 -36.800 1.00 67.03 C ATOM 56 CD2 PHE A 10 -18.054 2.944 -34.467 1.00 67.55 C ATOM 57 CE1 PHE A 10 -17.083 3.355 -37.015 1.00 72.84 C ATOM 58 CE2 PHE A 10 -17.013 3.831 -34.676 1.00 72.96 C ATOM 59 CZ PHE A 10 -16.528 4.037 -35.951 1.00 74.90 C ATOM 60 H PHE A 10 -19.180 -0.240 -37.322 1.00 0.00 H ATOM 61 N VAL A 11 -20.504 -1.166 -33.320 1.00 51.29 N ATOM 62 CA VAL A 11 -21.381 -2.136 -32.683 1.00 52.73 C ATOM 63 C VAL A 11 -22.522 -1.423 -31.972 1.00 54.60 C ATOM 64 O VAL A 11 -22.433 -0.249 -31.599 1.00 58.68 O ATOM 65 CB VAL A 11 -20.612 -3.034 -31.690 1.00 51.07 C ATOM 66 CG1 VAL A 11 -19.478 -3.760 -32.396 1.00 50.92 C ATOM 67 CG2 VAL A 11 -20.079 -2.213 -30.519 1.00 50.94 C ATOM 68 H VAL A 11 -19.906 -0.560 -32.723 1.00 0.00 H ATOM 69 N ASP A 12 -23.615 -2.158 -31.790 1.00 48.95 N ATOM 70 CA ASP A 12 -24.650 -1.812 -30.830 1.00 46.60 C ATOM 71 C ASP A 12 -24.421 -2.619 -29.558 1.00 45.99 C ATOM 72 O ASP A 12 -24.068 -3.801 -29.617 1.00 40.44 O ATOM 73 CB ASP A 12 -26.048 -2.097 -31.385 1.00 47.74 C ATOM 74 CG ASP A 12 -26.555 -0.992 -32.296 1.00 51.28 C ATOM 75 OD1 ASP A 12 -26.155 -0.958 -33.480 1.00 50.21 O ATOM 76 OD2 ASP A 12 -27.357 -0.158 -31.825 1.00 52.99 O ATOM 77 H ASP A 12 -23.735 -3.019 -32.360 1.00 0.00 H ATOM 78 N VAL A 13 -24.606 -1.974 -28.413 1.00 49.68 N ATOM 79 CA VAL A 13 -24.403 -2.603 -27.114 1.00 52.33 C ATOM 80 C VAL A 13 -25.777 -2.955 -26.559 1.00 56.49 C ATOM 81 O VAL A 13 -26.576 -2.067 -26.238 1.00 59.80 O ATOM 82 CB VAL A 13 -23.625 -1.689 -26.158 1.00 51.57 C ATOM 83 CG1 VAL A 13 -23.340 -2.405 -24.847 1.00 49.85 C ATOM 84 CG2 VAL A 13 -22.325 -1.224 -26.804 1.00 51.49 C ATOM 85 H VAL A 13 -24.908 -0.979 -28.444 1.00 0.00 H ATOM 86 N VAL A 14 -26.058 -4.253 -26.446 1.00 54.83 N ATOM 87 CA VAL A 14 -27.351 -4.736 -25.982 1.00 51.96 C ATOM 88 C VAL A 14 -27.144 -5.578 -24.732 1.00 54.19 C ATOM 89 O VAL A 14 -26.123 -6.255 -24.574 1.00 50.00 O ATOM 90 CB VAL A 14 -28.083 -5.549 -27.074 1.00 49.34 C ATOM 91 CG1 VAL A 14 -28.255 -4.710 -28.337 1.00 48.61 C ATOM 92 CG2 VAL A 14 -27.331 -6.842 -27.388 1.00 48.07 C ATOM 93 H VAL A 14 -25.326 -4.947 -26.699 1.00 0.00 H ATOM 94 N SER A 15 -28.128 -5.528 -23.837 1.00 60.56 N ATOM 95 CA SER A 15 -28.149 -6.346 -22.634 1.00 69.23 C ATOM 96 C SER A 15 -29.401 -7.210 -22.641 1.00 73.77 C ATOM 97 O SER A 15 -30.487 -6.740 -22.995 1.00 71.13 O ATOM 98 CB SER A 15 -28.116 -5.479 -21.373 1.00 77.32 C ATOM 99 OG SER A 15 -26.944 -4.686 -21.336 1.00 81.87 O ATOM 100 HG SER A 15 -26.148 -5.275 -21.339 1.00 0.00 H ATOM 101 H SER A 15 -28.919 -4.874 -24.005 1.00 0.00 H ATOM 102 N CYS A 16 -29.247 -8.470 -22.245 1.00 82.37 N ATOM 103 CA CYS A 16 -30.323 -9.451 -22.307 1.00 88.86 C ATOM 104 C CYS A 16 -30.940 -9.457 -23.708 1.00 88.39 C ATOM 105 O CYS A 16 -32.126 -9.164 -23.873 1.00 90.88 O ATOM 106 CB CYS A 16 -31.384 -9.171 -21.250 1.00 95.04 C ATOM 107 SG CYS A 16 -30.804 -9.384 -19.554 1.00 98.98 S ATOM 108 H CYS A 16 -28.321 -8.767 -21.876 1.00 0.00 H ATOM 109 N PRO A 17 -30.156 -9.787 -24.733 1.00 84.13 N ATOM 110 CA PRO A 17 -30.654 -9.669 -26.108 1.00 85.55 C ATOM 111 C PRO A 17 -31.743 -10.688 -26.408 1.00 89.04 C ATOM 112 O PRO A 17 -31.684 -11.840 -25.971 1.00 86.28 O ATOM 113 CB PRO A 17 -29.403 -9.917 -26.958 1.00 82.84 C ATOM 114 CG PRO A 17 -28.524 -10.759 -26.090 1.00 81.15 C ATOM 115 CD PRO A 17 -28.781 -10.313 -24.681 1.00 81.40 C ATOM 116 N LYS A 18 -32.745 -10.246 -27.170 1.00 99.87 N ATOM 117 CA LYS A 18 -33.876 -11.078 -27.575 1.00105.08 C ATOM 118 C LYS A 18 -34.637 -11.646 -26.378 1.00112.05 C ATOM 119 O LYS A 18 -35.348 -12.647 -26.511 1.00115.65 O ATOM 120 CB LYS A 18 -33.418 -12.208 -28.508 1.00100.57 C ATOM 121 CG LYS A 18 -33.118 -11.727 -29.928 1.00 94.06 C ATOM 122 CD LYS A 18 -31.782 -12.231 -30.471 1.00 86.71 C ATOM 123 CE LYS A 18 -31.924 -13.545 -31.222 1.00 81.09 C ATOM 124 NZ LYS A 18 -32.082 -14.720 -30.317 1.00 78.87 N ATOM 125 HZ1 LYS A 18 -31.248 -14.796 -29.701 1.00 0.00 H ATOM 126 HZ2 LYS A 18 -32.934 -14.595 -29.734 1.00 0.00 H ATOM 127 HZ3 LYS A 18 -32.174 -15.585 -30.887 1.00 0.00 H ATOM 128 H LYS A 18 -32.720 -9.258 -27.493 1.00 0.00 H ATOM 129 N LEU A 19 -34.509 -11.013 -25.215 1.00108.08 N ATOM 130 CA LEU A 19 -35.188 -11.451 -23.998 1.00106.31 C ATOM 131 C LEU A 19 -35.969 -10.303 -23.367 1.00106.16 C ATOM 132 O LEU A 19 -36.839 -9.707 -24.001 1.00105.66 O ATOM 133 CB LEU A 19 -34.175 -12.005 -22.991 1.00103.84 C ATOM 134 CG LEU A 19 -33.920 -13.517 -22.960 1.00101.05 C ATOM 135 CD1 LEU A 19 -33.968 -14.161 -24.342 1.00 99.51 C ATOM 136 CD2 LEU A 19 -32.584 -13.797 -22.286 1.00100.05 C ATOM 137 H LEU A 19 -33.900 -10.171 -25.170 1.00 0.00 H TER 138 LEU A 19 ATOM 139 N GLU A 22 -34.755 -6.930 -22.880 1.00 98.49 N ATOM 140 CA GLU A 22 -33.754 -6.366 -23.780 1.00 96.66 C ATOM 141 C GLU A 22 -33.624 -4.865 -23.554 1.00 93.92 C ATOM 142 O GLU A 22 -34.595 -4.198 -23.200 1.00 98.77 O ATOM 143 CB GLU A 22 -34.120 -6.655 -25.238 1.00 97.02 C ATOM 144 CG GLU A 22 -33.057 -6.230 -26.241 1.00 95.20 C ATOM 145 CD GLU A 22 -33.314 -6.780 -27.631 1.00 91.62 C ATOM 146 OE1 GLU A 22 -33.587 -7.993 -27.750 1.00 89.86 O ATOM 147 OE2 GLU A 22 -33.248 -5.999 -28.603 1.00 90.25 O ATOM 148 HN3 GLU A 22 -35.675 -6.479 -23.060 1.00 0.00 H ATOM 149 HN2 GLU A 22 -34.470 -6.758 -21.895 1.00 0.00 H ATOM 150 HN1 GLU A 22 -34.832 -7.954 -23.047 1.00 0.00 H ATOM 151 N LEU A 23 -32.420 -4.336 -23.763 1.00 82.23 N ATOM 152 CA LEU A 23 -32.152 -2.925 -23.496 1.00 79.08 C ATOM 153 C LEU A 23 -30.919 -2.503 -24.279 1.00 75.69 C ATOM 154 O LEU A 23 -29.828 -3.035 -24.048 1.00 71.83 O ATOM 155 CB LEU A 23 -31.951 -2.691 -21.996 1.00 81.42 C ATOM 156 CG LEU A 23 -31.556 -1.278 -21.559 1.00 84.70 C ATOM 157 CD1 LEU A 23 -32.654 -0.276 -21.880 1.00 86.96 C ATOM 158 CD2 LEU A 23 -31.219 -1.257 -20.074 1.00 86.07 C ATOM 159 H LEU A 23 -31.654 -4.940 -24.124 1.00 0.00 H ATOM 160 N TYR A 24 -31.089 -1.554 -25.198 1.00 80.87 N ATOM 161 CA TYR A 24 -29.964 -0.986 -25.929 1.00 81.70 C ATOM 162 C TYR A 24 -29.283 0.077 -25.077 1.00 84.37 C ATOM 163 O TYR A 24 -29.951 0.920 -24.470 1.00 87.07 O ATOM 164 CB TYR A 24 -30.433 -0.386 -27.254 1.00 78.53 C ATOM 165 CG TYR A 24 -30.633 -1.409 -28.348 1.00 73.61 C ATOM 166 CD1 TYR A 24 -31.673 -2.326 -28.286 1.00 71.12 C ATOM 167 CD2 TYR A 24 -29.782 -1.457 -29.443 1.00 71.23 C ATOM 168 CE1 TYR A 24 -31.858 -3.263 -29.282 1.00 68.52 C ATOM 169 CE2 TYR A 24 -29.960 -2.390 -30.445 1.00 69.23 C ATOM 170 CZ TYR A 24 -31.000 -3.290 -30.358 1.00 68.56 C ATOM 171 OH TYR A 24 -31.184 -4.223 -31.353 1.00 68.89 O ATOM 172 HH TYR A 24 -31.338 -3.759 -32.214 1.00 0.00 H ATOM 173 H TYR A 24 -32.050 -1.210 -25.399 1.00 0.00 H ATOM 174 N LEU A 25 -27.954 0.034 -25.031 1.00 80.15 N ATOM 175 CA LEU A 25 -27.171 0.889 -24.153 1.00 75.49 C ATOM 176 C LEU A 25 -26.417 1.942 -24.951 1.00 74.99 C ATOM 177 O LEU A 25 -26.068 1.737 -26.118 1.00 71.53 O ATOM 178 CB LEU A 25 -26.172 0.068 -23.331 1.00 70.43 C ATOM 179 CG LEU A 25 -26.727 -1.147 -22.587 1.00 66.96 C ATOM 180 CD1 LEU A 25 -25.707 -1.648 -21.573 1.00 62.88 C ATOM 181 CD2 LEU A 25 -28.049 -0.817 -21.913 1.00 68.51 C ATOM 182 H LEU A 25 -27.455 -0.638 -25.648 1.00 0.00 H ATOM 183 N ASP A 26 -26.168 3.073 -24.302 1.00 77.62 N ATOM 184 CA ASP A 26 -25.342 4.114 -24.892 1.00 82.29 C ATOM 185 C ASP A 26 -23.872 3.698 -24.827 1.00 71.36 C ATOM 186 O ASP A 26 -23.424 3.177 -23.803 1.00 66.50 O ATOM 187 CB ASP A 26 -25.545 5.437 -24.154 1.00100.31 C ATOM 188 CG ASP A 26 -24.728 6.568 -24.745 1.00115.97 C ATOM 189 OD1 ASP A 26 -25.089 7.059 -25.834 1.00121.28 O ATOM 190 OD2 ASP A 26 -23.726 6.968 -24.118 1.00121.92 O ATOM 191 H ASP A 26 -26.571 3.217 -23.354 1.00 0.00 H ATOM 192 N PRO A 27 -23.101 3.907 -25.898 1.00 69.08 N ATOM 193 CA PRO A 27 -21.690 3.485 -25.868 1.00 70.81 C ATOM 194 C PRO A 27 -20.928 3.975 -24.648 1.00 80.51 C ATOM 195 O PRO A 27 -20.025 3.276 -24.170 1.00 80.43 O ATOM 196 CB PRO A 27 -21.123 4.081 -27.163 1.00 67.90 C ATOM 197 CG PRO A 27 -22.293 4.190 -28.070 1.00 65.47 C ATOM 198 CD PRO A 27 -23.468 4.506 -27.193 1.00 66.16 C ATOM 199 N ASP A 28 -21.271 5.152 -24.119 1.00 90.89 N ATOM 200 CA ASP A 28 -20.535 5.711 -22.991 1.00 98.42 C ATOM 201 C ASP A 28 -20.760 4.933 -21.701 1.00 89.71 C ATOM 202 O ASP A 28 -19.939 5.034 -20.783 1.00 89.14 O ATOM 203 CB ASP A 28 -20.924 7.176 -22.784 1.00114.43 C ATOM 204 CG ASP A 28 -20.562 8.051 -23.970 1.00126.03 C ATOM 205 OD1 ASP A 28 -19.579 7.730 -24.670 1.00129.30 O ATOM 206 OD2 ASP A 28 -21.260 9.062 -24.200 1.00131.00 O ATOM 207 H ASP A 28 -22.075 5.678 -24.517 1.00 0.00 H ATOM 208 N GLN A 29 -21.845 4.163 -21.604 1.00 82.26 N ATOM 209 CA GLN A 29 -22.105 3.391 -20.395 1.00 79.03 C ATOM 210 C GLN A 29 -21.110 2.257 -20.194 1.00 74.99 C ATOM 211 O GLN A 29 -21.097 1.655 -19.114 1.00 74.21 O ATOM 212 CB GLN A 29 -23.524 2.819 -20.427 1.00 81.37 C ATOM 213 CG GLN A 29 -24.620 3.873 -20.438 1.00 86.00 C ATOM 214 CD GLN A 29 -26.011 3.267 -20.423 1.00 87.95 C ATOM 215 OE1 GLN A 29 -26.801 3.473 -21.344 1.00 90.62 O ATOM 216 NE2 GLN A 29 -26.318 2.517 -19.371 1.00 87.00 N ATOM 217 HE22 GLN A 29 -25.619 2.370 -18.615 1.00 0.00 H ATOM 218 HE21 GLN A 29 -27.258 2.077 -19.303 1.00 0.00 H ATOM 219 H GLN A 29 -22.513 4.113 -22.400 1.00 0.00 H ATOM 220 N VAL A 30 -20.281 1.952 -21.195 1.00 73.18 N ATOM 221 CA VAL A 30 -19.332 0.849 -21.113 1.00 70.98 C ATOM 222 C VAL A 30 -17.925 1.251 -21.525 1.00 72.53 C ATOM 223 O VAL A 30 -17.028 0.407 -21.523 1.00 72.82 O ATOM 224 CB VAL A 30 -19.807 -0.353 -21.957 1.00 65.12 C ATOM 225 CG1 VAL A 30 -21.172 -0.830 -21.480 1.00 64.52 C ATOM 226 CG2 VAL A 30 -19.855 0.011 -23.435 1.00 62.45 C ATOM 227 H VAL A 30 -20.314 2.522 -22.064 1.00 0.00 H ATOM 228 N THR A 31 -17.697 2.517 -21.884 1.00 71.65 N ATOM 229 CA THR A 31 -16.360 2.939 -22.290 1.00 74.65 C ATOM 230 C THR A 31 -15.339 2.706 -21.187 1.00 73.37 C ATOM 231 O THR A 31 -14.158 2.482 -21.473 1.00 72.04 O ATOM 232 CB THR A 31 -16.366 4.416 -22.689 1.00 81.36 C ATOM 233 OG1 THR A 31 -17.071 5.182 -21.702 1.00 86.90 O ATOM 234 CG2 THR A 31 -17.020 4.605 -24.052 1.00 80.77 C ATOM 235 HG1 THR A 31 -18.003 4.856 -21.637 1.00 0.00 H ATOM 236 H THR A 31 -18.476 3.206 -21.874 1.00 0.00 H ATOM 237 N ASP A 32 -15.770 2.751 -19.924 1.00 74.36 N ATOM 238 CA ASP A 32 -14.844 2.545 -18.817 1.00 81.48 C ATOM 239 C ASP A 32 -14.230 1.153 -18.829 1.00 76.43 C ATOM 240 O ASP A 32 -13.216 0.931 -18.158 1.00 76.48 O ATOM 241 CB ASP A 32 -15.559 2.783 -17.486 1.00 94.33 C ATOM 242 CG ASP A 32 -16.137 4.179 -17.376 1.00106.89 C ATOM 243 OD1 ASP A 32 -16.030 4.947 -18.355 1.00111.04 O ATOM 244 OD2 ASP A 32 -16.698 4.509 -16.310 1.00111.75 O ATOM 245 H ASP A 32 -16.775 2.935 -19.728 1.00 0.00 H ATOM 246 N TYR A 33 -14.813 0.212 -19.574 1.00 72.37 N ATOM 247 CA TYR A 33 -14.337 -1.165 -19.613 1.00 69.34 C ATOM 248 C TYR A 33 -13.710 -1.526 -20.957 1.00 65.70 C ATOM 249 O TYR A 33 -13.532 -2.711 -21.255 1.00 62.79 O ATOM 250 CB TYR A 33 -15.486 -2.117 -19.282 1.00 68.83 C ATOM 251 CG TYR A 33 -16.246 -1.716 -18.038 1.00 71.63 C ATOM 252 CD1 TYR A 33 -15.764 -2.029 -16.774 1.00 73.54 C ATOM 253 CD2 TYR A 33 -17.441 -1.013 -18.128 1.00 75.35 C ATOM 254 CE1 TYR A 33 -16.453 -1.660 -15.635 1.00 76.25 C ATOM 255 CE2 TYR A 33 -18.137 -0.640 -16.994 1.00 77.79 C ATOM 256 CZ TYR A 33 -17.639 -0.965 -15.751 1.00 79.05 C ATOM 257 OH TYR A 33 -18.328 -0.595 -14.620 1.00 82.33 O ATOM 258 HH TYR A 33 -17.835 -0.904 -13.819 1.00 0.00 H ATOM 259 H TYR A 33 -15.640 0.471 -20.149 1.00 0.00 H ATOM 260 N LEU A 34 -13.373 -0.529 -21.770 1.00 65.64 N ATOM 261 CA LEU A 34 -12.684 -0.718 -23.037 1.00 65.29 C ATOM 262 C LEU A 34 -11.250 -0.213 -22.937 1.00 73.11 C ATOM 263 O LEU A 34 -10.939 0.632 -22.091 1.00 77.34 O ATOM 264 CB LEU A 34 -13.413 0.026 -24.167 1.00 58.88 C ATOM 265 CG LEU A 34 -14.850 -0.416 -24.460 1.00 54.11 C ATOM 266 CD1 LEU A 34 -15.477 0.477 -25.518 1.00 52.10 C ATOM 267 CD2 LEU A 34 -14.894 -1.869 -24.902 1.00 51.62 C ATOM 268 H LEU A 34 -13.616 0.441 -21.484 1.00 0.00 H ATOM 269 N PRO A 35 -10.337 -0.709 -23.791 1.00 77.52 N ATOM 270 CA PRO A 35 -10.543 -1.712 -24.842 1.00 77.80 C ATOM 271 C PRO A 35 -10.608 -3.143 -24.316 1.00 76.38 C ATOM 272 O PRO A 35 -10.227 -3.403 -23.174 1.00 75.48 O ATOM 273 CB PRO A 35 -9.311 -1.539 -25.748 1.00 79.66 C ATOM 274 CG PRO A 35 -8.606 -0.303 -25.261 1.00 81.33 C ATOM 275 CD PRO A 35 -8.966 -0.177 -23.825 1.00 80.21 C ATOM 276 N VAL A 36 -11.087 -4.056 -25.155 1.00 75.92 N ATOM 277 CA VAL A 36 -11.132 -5.482 -24.847 1.00 77.33 C ATOM 278 C VAL A 36 -10.340 -6.184 -25.941 1.00 76.08 C ATOM 279 O VAL A 36 -10.833 -6.363 -27.061 1.00 81.06 O ATOM 280 CB VAL A 36 -12.567 -6.016 -24.766 1.00 77.61 C ATOM 281 CG1 VAL A 36 -12.568 -7.517 -24.483 1.00 75.38 C ATOM 282 CG2 VAL A 36 -13.353 -5.271 -23.699 1.00 80.76 C ATOM 283 H VAL A 36 -11.448 -3.738 -26.077 1.00 0.00 H ATOM 284 N THR A 37 -9.109 -6.580 -25.626 1.00 68.58 N ATOM 285 CA THR A 37 -8.253 -7.282 -26.571 1.00 65.61 C ATOM 286 C THR A 37 -8.279 -8.791 -26.377 1.00 58.51 C ATOM 287 O THR A 37 -7.661 -9.513 -27.165 1.00 54.49 O ATOM 288 CB THR A 37 -6.812 -6.777 -26.455 1.00 73.01 C ATOM 289 OG1 THR A 37 -6.351 -6.936 -25.107 1.00 76.79 O ATOM 290 CG2 THR A 37 -6.729 -5.310 -26.854 1.00 76.46 C ATOM 291 HG1 THR A 37 -5.419 -6.608 -25.037 1.00 0.00 H ATOM 292 H THR A 37 -8.746 -6.381 -24.672 1.00 0.00 H ATOM 293 N GLU A 38 -8.972 -9.286 -25.349 1.00 59.94 N ATOM 294 CA GLU A 38 -9.096 -10.725 -25.169 1.00 65.00 C ATOM 295 C GLU A 38 -10.124 -11.281 -26.156 1.00 59.97 C ATOM 296 O GLU A 38 -11.158 -10.650 -26.391 1.00 56.90 O ATOM 297 CB GLU A 38 -9.519 -11.059 -23.738 1.00 75.76 C ATOM 298 CG GLU A 38 -8.501 -10.666 -22.672 1.00 88.76 C ATOM 299 CD GLU A 38 -8.513 -9.180 -22.357 1.00 99.82 C ATOM 300 OE1 GLU A 38 -9.452 -8.481 -22.795 1.00103.25 O ATOM 301 OE2 GLU A 38 -7.582 -8.711 -21.668 1.00104.49 O ATOM 302 H GLU A 38 -9.426 -8.640 -24.673 1.00 0.00 H ATOM 303 N PRO A 39 -9.875 -12.447 -26.749 1.00 59.39 N ATOM 304 CA PRO A 39 -10.837 -12.982 -27.722 1.00 56.99 C ATOM 305 C PRO A 39 -12.196 -13.246 -27.089 1.00 52.51 C ATOM 306 O PRO A 39 -12.307 -13.942 -26.077 1.00 53.56 O ATOM 307 CB PRO A 39 -10.176 -14.280 -28.202 1.00 58.72 C ATOM 308 CG PRO A 39 -8.737 -14.123 -27.886 1.00 60.95 C ATOM 309 CD PRO A 39 -8.680 -13.300 -26.641 1.00 61.09 C ATOM 310 N LEU A 40 -13.234 -12.668 -27.692 1.00 47.98 N ATOM 311 CA LEU A 40 -14.609 -13.027 -27.394 1.00 44.34 C ATOM 312 C LEU A 40 -15.214 -13.767 -28.582 1.00 42.48 C ATOM 313 O LEU A 40 -14.845 -13.507 -29.731 1.00 39.57 O ATOM 314 CB LEU A 40 -15.470 -11.797 -27.081 1.00 45.00 C ATOM 315 CG LEU A 40 -15.158 -11.069 -25.774 1.00 49.79 C ATOM 316 CD1 LEU A 40 -15.956 -9.778 -25.691 1.00 48.44 C ATOM 317 CD2 LEU A 40 -15.455 -11.962 -24.577 1.00 53.14 C ATOM 318 H LEU A 40 -13.052 -11.931 -28.403 1.00 0.00 H ATOM 319 N PRO A 41 -16.142 -14.692 -28.346 1.00 46.07 N ATOM 320 CA PRO A 41 -16.673 -15.491 -29.456 1.00 47.56 C ATOM 321 C PRO A 41 -17.623 -14.692 -30.335 1.00 45.34 C ATOM 322 O PRO A 41 -18.414 -13.880 -29.851 1.00 50.56 O ATOM 323 CB PRO A 41 -17.402 -16.637 -28.746 1.00 50.18 C ATOM 324 CG PRO A 41 -17.810 -16.058 -27.436 1.00 49.41 C ATOM 325 CD PRO A 41 -16.728 -15.086 -27.052 1.00 46.39 C ATOM 326 N ILE A 42 -17.533 -14.918 -31.641 1.00 39.47 N ATOM 327 CA ILE A 42 -18.449 -14.311 -32.599 1.00 38.78 C ATOM 328 C ILE A 42 -19.505 -15.353 -32.944 1.00 36.55 C ATOM 329 O ILE A 42 -19.212 -16.361 -33.597 1.00 36.36 O ATOM 330 CB ILE A 42 -17.717 -13.807 -33.850 1.00 39.07 C ATOM 331 CG1 ILE A 42 -16.862 -12.591 -33.491 1.00 39.57 C ATOM 332 CG2 ILE A 42 -18.716 -13.439 -34.953 1.00 37.32 C ATOM 333 CD1 ILE A 42 -16.020 -12.057 -34.633 1.00 40.95 C ATOM 334 H ILE A 42 -16.784 -15.549 -31.992 1.00 0.00 H ATOM 335 N THR A 43 -20.735 -15.109 -32.508 1.00 35.77 N ATOM 336 CA THR A 43 -21.868 -15.989 -32.751 1.00 38.08 C ATOM 337 C THR A 43 -22.859 -15.297 -33.686 1.00 39.02 C ATOM 338 O THR A 43 -22.612 -14.198 -34.191 1.00 38.64 O ATOM 339 CB THR A 43 -22.521 -16.392 -31.427 1.00 39.59 C ATOM 340 OG1 THR A 43 -22.953 -15.222 -30.727 1.00 36.92 O ATOM 341 CG2 THR A 43 -21.533 -17.155 -30.560 1.00 40.88 C ATOM 342 HG1 THR A 43 -23.375 -15.488 -29.872 1.00 0.00 H ATOM 343 H THR A 43 -20.898 -14.239 -31.962 1.00 0.00 H ATOM 344 N ILE A 44 -23.990 -15.960 -33.924 1.00 40.86 N ATOM 345 CA ILE A 44 -25.003 -15.495 -34.868 1.00 40.01 C ATOM 346 C ILE A 44 -26.305 -15.287 -34.109 1.00 38.48 C ATOM 347 O ILE A 44 -26.852 -16.235 -33.530 1.00 40.62 O ATOM 348 CB ILE A 44 -25.194 -16.486 -36.028 1.00 40.98 C ATOM 349 CG1 ILE A 44 -23.914 -16.562 -36.866 1.00 41.79 C ATOM 350 CG2 ILE A 44 -26.371 -16.073 -36.908 1.00 40.79 C ATOM 351 CD1 ILE A 44 -23.885 -17.711 -37.844 1.00 42.89 C ATOM 352 H ILE A 44 -24.159 -16.850 -33.414 1.00 0.00 H ATOM 353 N GLU A 45 -26.803 -14.049 -34.114 1.00 36.61 N ATOM 354 CA GLU A 45 -28.083 -13.722 -33.488 1.00 36.05 C ATOM 355 C GLU A 45 -28.128 -14.205 -32.042 1.00 38.15 C ATOM 356 O GLU A 45 -29.133 -14.741 -31.571 1.00 39.18 O ATOM 357 CB GLU A 45 -29.246 -14.304 -34.294 1.00 35.01 C ATOM 358 CG GLU A 45 -29.544 -13.546 -35.574 1.00 37.43 C ATOM 359 CD GLU A 45 -30.143 -12.174 -35.312 1.00 41.71 C ATOM 360 OE1 GLU A 45 -30.636 -11.944 -34.187 1.00 43.06 O ATOM 361 OE2 GLU A 45 -30.122 -11.326 -36.230 1.00 42.89 O ATOM 362 H GLU A 45 -26.263 -13.292 -34.579 1.00 0.00 H ATOM 363 N HIS A 46 -27.017 -14.022 -31.331 1.00 39.87 N ATOM 364 CA HIS A 46 -26.926 -14.361 -29.912 1.00 40.24 C ATOM 365 C HIS A 46 -27.308 -15.816 -29.644 1.00 39.62 C ATOM 366 O HIS A 46 -27.659 -16.174 -28.515 1.00 40.98 O ATOM 367 CB HIS A 46 -27.796 -13.421 -29.073 1.00 41.66 C ATOM 368 CG HIS A 46 -27.639 -11.977 -29.434 1.00 44.21 C ATOM 369 ND1 HIS A 46 -26.607 -11.199 -28.958 1.00 45.33 N ATOM 370 CD2 HIS A 46 -28.380 -11.172 -30.231 1.00 45.33 C ATOM 371 CE1 HIS A 46 -26.720 -9.976 -29.444 1.00 46.09 C ATOM 372 NE2 HIS A 46 -27.788 -9.933 -30.219 1.00 45.58 N ATOM 373 H HIS A 46 -26.181 -13.622 -31.804 1.00 0.00 H ATOM 374 N LEU A 47 -27.240 -16.670 -30.667 1.00 37.26 N ATOM 375 CA LEU A 47 -27.625 -18.066 -30.489 1.00 40.15 C ATOM 376 C LEU A 47 -26.445 -18.883 -29.965 1.00 46.00 C ATOM 377 O LEU A 47 -25.307 -18.676 -30.395 1.00 37.67 O ATOM 378 CB LEU A 47 -28.105 -18.670 -31.806 1.00 38.96 C ATOM 379 CG LEU A 47 -29.317 -18.019 -32.473 1.00 39.09 C ATOM 380 CD1 LEU A 47 -29.593 -18.693 -33.807 1.00 36.49 C ATOM 381 CD2 LEU A 47 -30.541 -18.089 -31.571 1.00 40.94 C ATOM 382 H LEU A 47 -26.911 -16.339 -31.596 1.00 0.00 H ATOM 383 N PRO A 48 -26.672 -19.824 -29.050 1.00 65.35 N ATOM 384 CA PRO A 48 -25.578 -20.701 -28.625 1.00 71.62 C ATOM 385 C PRO A 48 -25.225 -21.704 -29.711 1.00 67.46 C ATOM 386 O PRO A 48 -26.049 -22.061 -30.556 1.00 64.00 O ATOM 387 CB PRO A 48 -26.144 -21.398 -27.383 1.00 77.04 C ATOM 388 CG PRO A 48 -27.614 -21.421 -27.617 1.00 78.32 C ATOM 389 CD PRO A 48 -27.935 -20.150 -28.363 1.00 74.12 C ATOM 390 N GLU A 49 -23.973 -22.154 -29.681 1.00 69.13 N ATOM 391 CA GLU A 49 -23.453 -23.151 -30.611 1.00 68.38 C ATOM 392 C GLU A 49 -23.389 -22.639 -32.045 1.00 58.56 C ATOM 393 O GLU A 49 -23.380 -23.438 -32.985 1.00 54.49 O ATOM 394 CB GLU A 49 -24.276 -24.445 -30.559 1.00 76.08 C ATOM 395 CG GLU A 49 -24.370 -25.059 -29.167 1.00 83.99 C ATOM 396 CD GLU A 49 -24.944 -26.465 -29.182 1.00 90.65 C ATOM 397 OE1 GLU A 49 -24.825 -27.149 -30.221 1.00 92.85 O ATOM 398 OE2 GLU A 49 -25.515 -26.887 -28.154 1.00 93.38 O ATOM 399 H GLU A 49 -23.331 -21.775 -28.956 1.00 0.00 H ATOM 400 N THR A 50 -23.344 -21.320 -32.237 1.00 49.37 N ATOM 401 CA THR A 50 -23.134 -20.725 -33.552 1.00 44.91 C ATOM 402 C THR A 50 -21.869 -19.873 -33.569 1.00 46.30 C ATOM 403 O THR A 50 -21.776 -18.902 -34.323 1.00 47.02 O ATOM 404 CB THR A 50 -24.341 -19.893 -33.983 1.00 40.29 C ATOM 405 OG1 THR A 50 -24.521 -18.789 -33.086 1.00 37.49 O ATOM 406 CG2 THR A 50 -25.602 -20.751 -34.007 1.00 38.83 C ATOM 407 HG1 THR A 50 -24.671 -19.131 -32.169 1.00 0.00 H ATOM 408 H THR A 50 -23.463 -20.691 -31.417 1.00 0.00 H ATOM 409 N GLU A 51 -20.894 -20.221 -32.732 1.00 45.77 N ATOM 410 CA GLU A 51 -19.594 -19.567 -32.782 1.00 46.00 C ATOM 411 C GLU A 51 -18.976 -19.764 -34.158 1.00 44.02 C ATOM 412 O GLU A 51 -18.731 -20.898 -34.580 1.00 47.38 O ATOM 413 CB GLU A 51 -18.670 -20.137 -31.707 1.00 48.13 C ATOM 414 CG GLU A 51 -19.133 -19.930 -30.276 1.00 49.19 C ATOM 415 CD GLU A 51 -18.248 -20.657 -29.276 1.00 49.23 C ATOM 416 OE1 GLU A 51 -17.386 -21.452 -29.710 1.00 48.57 O ATOM 417 OE2 GLU A 51 -18.414 -20.436 -28.059 1.00 48.99 O ATOM 418 H GLU A 51 -21.063 -20.971 -32.032 1.00 0.00 H ATOM 419 N VAL A 52 -18.724 -18.662 -34.859 1.00 39.07 N ATOM 420 CA VAL A 52 -18.085 -18.698 -36.169 1.00 36.09 C ATOM 421 C VAL A 52 -16.710 -18.059 -36.156 1.00 37.15 C ATOM 422 O VAL A 52 -16.020 -18.077 -37.185 1.00 40.78 O ATOM 423 CB VAL A 52 -18.972 -18.034 -37.240 1.00 35.14 C ATOM 424 CG1 VAL A 52 -20.266 -18.821 -37.421 1.00 33.05 C ATOM 425 CG2 VAL A 52 -19.267 -16.582 -36.871 1.00 35.16 C ATOM 426 H VAL A 52 -18.993 -17.741 -34.458 1.00 0.00 H ATOM 427 N GLY A 53 -16.285 -17.503 -35.029 1.00 35.50 N ATOM 428 CA GLY A 53 -15.006 -16.830 -34.970 1.00 36.96 C ATOM 429 C GLY A 53 -14.837 -16.124 -33.640 1.00 38.87 C ATOM 430 O GLY A 53 -15.586 -16.362 -32.691 1.00 38.57 O ATOM 431 H GLY A 53 -16.879 -17.552 -34.177 1.00 0.00 H ATOM 432 N TRP A 54 -13.843 -15.239 -33.596 1.00 41.69 N ATOM 433 CA TRP A 54 -13.457 -14.579 -32.359 1.00 42.98 C ATOM 434 C TRP A 54 -13.162 -13.110 -32.621 1.00 44.12 C ATOM 435 O TRP A 54 -12.687 -12.736 -33.696 1.00 43.58 O ATOM 436 CB TRP A 54 -12.229 -15.255 -31.736 1.00 44.37 C ATOM 437 CG TRP A 54 -12.420 -16.719 -31.530 1.00 44.50 C ATOM 438 CD1 TRP A 54 -12.119 -17.717 -32.410 1.00 44.72 C ATOM 439 CD2 TRP A 54 -12.968 -17.355 -30.371 1.00 46.56 C ATOM 440 NE1 TRP A 54 -12.442 -18.938 -31.868 1.00 46.96 N ATOM 441 CE2 TRP A 54 -12.965 -18.743 -30.617 1.00 48.51 C ATOM 442 CE3 TRP A 54 -13.459 -16.887 -29.149 1.00 47.02 C ATOM 443 CZ2 TRP A 54 -13.435 -19.665 -29.686 1.00 49.37 C ATOM 444 CZ3 TRP A 54 -13.924 -17.805 -28.226 1.00 47.54 C ATOM 445 CH2 TRP A 54 -13.909 -19.178 -28.499 1.00 47.88 C ATOM 446 HE1 TRP A 54 -12.311 -19.860 -32.332 1.00 0.00 H ATOM 447 H TRP A 54 -13.328 -15.013 -34.471 1.00 0.00 H ATOM 448 N THR A 55 -13.451 -12.280 -31.621 1.00 44.23 N ATOM 449 CA THR A 55 -13.094 -10.871 -31.689 1.00 46.13 C ATOM 450 C THR A 55 -11.584 -10.708 -31.579 1.00 51.55 C ATOM 451 O THR A 55 -10.912 -11.453 -30.860 1.00 51.73 O ATOM 452 CB THR A 55 -13.774 -10.084 -30.567 1.00 44.55 C ATOM 453 OG1 THR A 55 -13.432 -10.658 -29.300 1.00 42.12 O ATOM 454 CG2 THR A 55 -15.282 -10.088 -30.727 1.00 44.92 C ATOM 455 HG1 THR A 55 -12.450 -10.624 -29.178 1.00 0.00 H ATOM 456 H THR A 55 -13.939 -12.644 -30.778 1.00 0.00 H ATOM 457 N LEU A 56 -11.051 -9.724 -32.299 1.00 54.20 N ATOM 458 CA LEU A 56 -9.644 -9.366 -32.205 1.00 59.43 C ATOM 459 C LEU A 56 -9.429 -8.048 -31.479 1.00 65.10 C ATOM 460 O LEU A 56 -8.278 -7.660 -31.253 1.00 67.34 O ATOM 461 CB LEU A 56 -9.020 -9.292 -33.603 1.00 57.77 C ATOM 462 CG LEU A 56 -9.091 -10.568 -34.447 1.00 55.26 C ATOM 463 CD1 LEU A 56 -8.467 -10.326 -35.811 1.00 56.56 C ATOM 464 CD2 LEU A 56 -8.407 -11.732 -33.746 1.00 52.89 C ATOM 465 H LEU A 56 -11.662 -9.192 -32.952 1.00 0.00 H ATOM 466 N GLY A 57 -10.499 -7.351 -31.108 1.00 64.75 N ATOM 467 CA GLY A 57 -10.368 -6.107 -30.379 1.00 65.17 C ATOM 468 C GLY A 57 -11.616 -5.249 -30.412 1.00 62.10 C ATOM 469 O GLY A 57 -12.201 -5.025 -31.476 1.00 61.26 O ATOM 470 H GLY A 57 -11.447 -7.706 -31.346 1.00 0.00 H ATOM 471 N LEU A 58 -12.037 -4.775 -29.241 1.00 63.46 N ATOM 472 CA LEU A 58 -13.132 -3.820 -29.104 1.00 62.32 C ATOM 473 C LEU A 58 -12.534 -2.517 -28.586 1.00 62.24 C ATOM 474 O LEU A 58 -12.062 -2.457 -27.446 1.00 66.92 O ATOM 475 CB LEU A 58 -14.213 -4.341 -28.157 1.00 63.75 C ATOM 476 CG LEU A 58 -15.085 -5.527 -28.592 1.00 64.06 C ATOM 477 CD1 LEU A 58 -15.747 -5.261 -29.938 1.00 63.38 C ATOM 478 CD2 LEU A 58 -14.297 -6.832 -28.620 1.00 64.38 C ATOM 479 H LEU A 58 -11.560 -5.103 -28.377 1.00 0.00 H ATOM 480 N PHE A 59 -12.553 -1.480 -29.417 1.00 56.81 N ATOM 481 CA PHE A 59 -11.912 -0.213 -29.100 1.00 56.74 C ATOM 482 C PHE A 59 -12.932 0.915 -29.115 1.00 57.98 C ATOM 483 O PHE A 59 -13.796 0.973 -29.995 1.00 53.95 O ATOM 484 CB PHE A 59 -10.796 0.109 -30.096 1.00 59.23 C ATOM 485 CG PHE A 59 -9.791 -0.991 -30.255 1.00 62.99 C ATOM 486 CD1 PHE A 59 -10.003 -2.010 -31.168 1.00 64.66 C ATOM 487 CD2 PHE A 59 -8.634 -1.006 -29.495 1.00 67.69 C ATOM 488 CE1 PHE A 59 -9.081 -3.021 -31.322 1.00 67.95 C ATOM 489 CE2 PHE A 59 -7.707 -2.018 -29.643 1.00 70.62 C ATOM 490 CZ PHE A 59 -7.931 -3.028 -30.558 1.00 70.48 C ATOM 491 H PHE A 59 -13.045 -1.578 -30.328 1.00 0.00 H ATOM 492 N GLN A 60 -12.822 1.811 -28.140 1.00 63.61 N ATOM 493 CA GLN A 60 -13.582 3.054 -28.163 1.00 72.26 C ATOM 494 C GLN A 60 -12.858 4.051 -29.059 1.00 75.43 C ATOM 495 O GLN A 60 -11.693 4.381 -28.813 1.00 72.19 O ATOM 496 CB GLN A 60 -13.743 3.618 -26.754 1.00 77.80 C ATOM 497 CG GLN A 60 -14.546 4.912 -26.694 1.00 84.61 C ATOM 498 CD GLN A 60 -14.272 5.709 -25.438 1.00 91.45 C ATOM 499 OE1 GLN A 60 -13.742 5.185 -24.459 1.00 93.02 O ATOM 500 NE2 GLN A 60 -14.622 6.988 -25.463 1.00 95.57 N ATOM 501 HE22 GLN A 60 -15.068 7.389 -26.313 1.00 0.00 H ATOM 502 HE21 GLN A 60 -14.451 7.590 -24.633 1.00 0.00 H ATOM 503 H GLN A 60 -12.180 1.621 -27.344 1.00 0.00 H ATOM 504 N VAL A 61 -13.542 4.523 -30.099 1.00 87.38 N ATOM 505 CA VAL A 61 -12.975 5.510 -31.010 1.00 97.50 C ATOM 506 C VAL A 61 -13.870 6.742 -31.015 1.00108.28 C ATOM 507 O VAL A 61 -14.768 6.872 -30.176 1.00112.34 O ATOM 508 CB VAL A 61 -12.798 4.932 -32.428 1.00 94.97 C ATOM 509 CG1 VAL A 61 -11.701 3.877 -32.433 1.00 92.37 C ATOM 510 CG2 VAL A 61 -14.107 4.350 -32.941 1.00 93.62 C ATOM 511 H VAL A 61 -14.509 4.178 -30.266 1.00 0.00 H ATOM 512 N SER A 62 -13.628 7.654 -31.959 1.00113.68 N ATOM 513 CA SER A 62 -14.322 8.938 -31.958 1.00118.64 C ATOM 514 C SER A 62 -15.835 8.760 -31.925 1.00119.57 C ATOM 515 O SER A 62 -16.526 9.369 -31.100 1.00118.23 O ATOM 516 CB SER A 62 -13.908 9.751 -33.187 1.00121.90 C ATOM 517 OG SER A 62 -12.514 10.007 -33.184 1.00124.57 O ATOM 518 HG SER A 62 -12.022 9.148 -33.192 1.00 0.00 H ATOM 519 H SER A 62 -12.935 7.447 -32.706 1.00 0.00 H ATOM 520 N HIS A 63 -16.370 7.922 -32.814 1.00122.24 N ATOM 521 CA HIS A 63 -17.809 7.831 -33.027 1.00125.61 C ATOM 522 C HIS A 63 -18.398 6.507 -32.542 1.00105.62 C ATOM 523 O HIS A 63 -19.336 5.987 -33.149 1.00104.91 O ATOM 524 CB HIS A 63 -18.131 8.043 -34.506 1.00147.42 C ATOM 525 CG HIS A 63 -17.549 9.299 -35.077 1.00168.31 C ATOM 526 ND1 HIS A 63 -16.397 9.309 -35.833 1.00173.91 N ATOM 527 CD2 HIS A 63 -17.958 10.588 -34.997 1.00174.98 C ATOM 528 CE1 HIS A 63 -16.123 10.549 -36.198 1.00176.80 C ATOM 529 NE2 HIS A 63 -17.055 11.344 -35.704 1.00176.21 N ATOM 530 H HIS A 63 -15.739 7.313 -33.374 1.00 0.00 H ATOM 531 N GLY A 64 -17.865 5.951 -31.449 1.00 85.01 N ATOM 532 CA GLY A 64 -18.460 4.795 -30.819 1.00 70.78 C ATOM 533 C GLY A 64 -17.437 3.705 -30.583 1.00 62.98 C ATOM 534 O GLY A 64 -16.233 3.963 -30.479 1.00 58.63 O ATOM 535 H GLY A 64 -17.000 6.361 -31.042 1.00 0.00 H ATOM 536 N ILE A 65 -17.936 2.474 -30.505 1.00 63.80 N ATOM 537 CA ILE A 65 -17.131 1.297 -30.191 1.00 60.81 C ATOM 538 C ILE A 65 -16.947 0.500 -31.475 1.00 54.07 C ATOM 539 O ILE A 65 -17.923 0.003 -32.051 1.00 50.31 O ATOM 540 CB ILE A 65 -17.791 0.435 -29.102 1.00 63.11 C ATOM 541 CG1 ILE A 65 -18.099 1.282 -27.864 1.00 66.75 C ATOM 542 CG2 ILE A 65 -16.889 -0.739 -28.731 1.00 62.19 C ATOM 543 CD1 ILE A 65 -19.020 0.605 -26.873 1.00 68.47 C ATOM 544 H ILE A 65 -18.953 2.343 -30.677 1.00 0.00 H ATOM 545 N PHE A 66 -15.700 0.370 -31.917 1.00 51.76 N ATOM 546 CA PHE A 66 -15.379 -0.349 -33.140 1.00 51.59 C ATOM 547 C PHE A 66 -14.914 -1.760 -32.810 1.00 50.90 C ATOM 548 O PHE A 66 -14.178 -1.973 -31.841 1.00 49.68 O ATOM 549 CB PHE A 66 -14.297 0.382 -33.938 1.00 54.17 C ATOM 550 CG PHE A 66 -14.152 -0.113 -35.349 1.00 56.27 C ATOM 551 CD1 PHE A 66 -15.052 0.276 -36.328 1.00 57.25 C ATOM 552 CD2 PHE A 66 -13.121 -0.970 -35.698 1.00 55.21 C ATOM 553 CE1 PHE A 66 -14.925 -0.178 -37.627 1.00 55.64 C ATOM 554 CE2 PHE A 66 -12.990 -1.426 -36.997 1.00 52.30 C ATOM 555 CZ PHE A 66 -13.892 -1.029 -37.960 1.00 53.40 C ATOM 556 H PHE A 66 -14.926 0.798 -31.369 1.00 0.00 H ATOM 557 N CYS A 67 -15.345 -2.719 -33.624 1.00 49.72 N ATOM 558 CA CYS A 67 -15.006 -4.123 -33.447 1.00 51.42 C ATOM 559 C CYS A 67 -14.265 -4.634 -34.673 1.00 51.24 C ATOM 560 O CYS A 67 -14.609 -4.291 -35.807 1.00 52.72 O ATOM 561 CB CYS A 67 -16.262 -4.973 -33.218 1.00 49.42 C ATOM 562 SG CYS A 67 -15.937 -6.757 -33.087 1.00 50.37 S ATOM 563 H CYS A 67 -15.953 -2.453 -34.425 1.00 0.00 H ATOM 564 N THR A 68 -13.240 -5.448 -34.435 1.00 50.99 N ATOM 565 CA THR A 68 -12.542 -6.173 -35.487 1.00 51.70 C ATOM 566 C THR A 68 -12.417 -7.622 -35.050 1.00 50.50 C ATOM 567 O THR A 68 -11.924 -7.899 -33.952 1.00 48.71 O ATOM 568 CB THR A 68 -11.154 -5.584 -35.769 1.00 55.14 C ATOM 569 OG1 THR A 68 -10.393 -5.535 -34.555 1.00 60.88 O ATOM 570 CG2 THR A 68 -11.273 -4.186 -36.344 1.00 53.88 C ATOM 571 HG1 THR A 68 -10.294 -6.451 -34.192 1.00 0.00 H ATOM 572 H THR A 68 -12.923 -5.572 -33.452 1.00 0.00 H ATOM 573 N GLY A 69 -12.875 -8.542 -35.902 1.00 53.96 N ATOM 574 CA GLY A 69 -12.860 -9.949 -35.570 1.00 55.62 C ATOM 575 C GLY A 69 -12.517 -10.793 -36.780 1.00 55.92 C ATOM 576 O GLY A 69 -12.412 -10.298 -37.904 1.00 59.04 O ATOM 577 H GLY A 69 -13.250 -8.240 -36.824 1.00 0.00 H ATOM 578 N ALA A 70 -12.342 -12.086 -36.524 1.00 51.67 N ATOM 579 CA ALA A 70 -12.005 -13.057 -37.551 1.00 49.47 C ATOM 580 C ALA A 70 -13.071 -14.140 -37.597 1.00 46.55 C ATOM 581 O ALA A 70 -13.542 -14.602 -36.553 1.00 48.93 O ATOM 582 CB ALA A 70 -10.634 -13.688 -37.289 1.00 50.18 C ATOM 583 H ALA A 70 -12.451 -12.417 -35.544 1.00 0.00 H ATOM 584 N ILE A 71 -13.456 -14.529 -38.808 1.00 44.65 N ATOM 585 CA ILE A 71 -14.364 -15.647 -39.034 1.00 44.06 C ATOM 586 C ILE A 71 -13.497 -16.842 -39.411 1.00 45.92 C ATOM 587 O ILE A 71 -12.915 -16.879 -40.501 1.00 51.32 O ATOM 588 CB ILE A 71 -15.393 -15.335 -40.130 1.00 44.39 C ATOM 589 CG1 ILE A 71 -16.079 -13.984 -39.879 1.00 48.13 C ATOM 590 CG2 ILE A 71 -16.428 -16.445 -40.221 1.00 44.16 C ATOM 591 CD1 ILE A 71 -16.869 -13.906 -38.588 1.00 51.66 C ATOM 592 H ILE A 71 -13.092 -14.011 -39.634 1.00 0.00 H ATOM 593 N THR A 72 -13.399 -17.819 -38.510 1.00 40.35 N ATOM 594 CA THR A 72 -12.481 -18.935 -38.683 1.00 44.59 C ATOM 595 C THR A 72 -13.163 -20.287 -38.830 1.00 42.82 C ATOM 596 O THR A 72 -12.485 -21.261 -39.174 1.00 45.66 O ATOM 597 CB THR A 72 -11.504 -19.011 -37.497 1.00 50.35 C ATOM 598 OG1 THR A 72 -12.226 -19.295 -36.293 1.00 54.45 O ATOM 599 CG2 THR A 72 -10.748 -17.696 -37.335 1.00 52.73 C ATOM 600 HG1 THR A 72 -11.593 -19.343 -35.533 1.00 0.00 H ATOM 601 H THR A 72 -13.996 -17.783 -37.659 1.00 0.00 H ATOM 602 N SER A 73 -14.463 -20.383 -38.589 1.00 39.83 N ATOM 603 CA SER A 73 -15.141 -21.671 -38.644 1.00 40.95 C ATOM 604 C SER A 73 -15.080 -22.251 -40.054 1.00 47.67 C ATOM 605 O SER A 73 -15.654 -21.659 -40.982 1.00 49.08 O ATOM 606 CB SER A 73 -16.594 -21.531 -38.213 1.00 35.60 C ATOM 607 OG SER A 73 -17.286 -22.745 -38.435 1.00 33.69 O ATOM 608 HG SER A 73 -16.859 -23.468 -37.910 1.00 0.00 H ATOM 609 H SER A 73 -15.006 -19.527 -38.357 1.00 0.00 H ATOM 610 N PRO A 74 -14.417 -23.393 -40.266 1.00 48.10 N ATOM 611 CA PRO A 74 -14.447 -23.998 -41.610 1.00 46.50 C ATOM 612 C PRO A 74 -15.850 -24.352 -42.068 1.00 42.13 C ATOM 613 O PRO A 74 -16.208 -24.088 -43.223 1.00 44.63 O ATOM 614 CB PRO A 74 -13.564 -25.245 -41.454 1.00 48.73 C ATOM 615 CG PRO A 74 -12.736 -24.992 -40.240 1.00 49.29 C ATOM 616 CD PRO A 74 -13.589 -24.172 -39.331 1.00 49.69 C ATOM 617 N ALA A 75 -16.662 -24.942 -41.187 1.00 37.71 N ATOM 618 CA ALA A 75 -18.014 -25.332 -41.570 1.00 36.07 C ATOM 619 C ALA A 75 -18.826 -24.132 -42.047 1.00 37.53 C ATOM 620 O ALA A 75 -19.558 -24.224 -43.039 1.00 40.19 O ATOM 621 CB ALA A 75 -18.711 -26.016 -40.394 1.00 34.07 C ATOM 622 H ALA A 75 -16.327 -25.125 -40.219 1.00 0.00 H ATOM 623 N PHE A 76 -18.713 -22.997 -41.355 1.00 36.44 N ATOM 624 CA PHE A 76 -19.486 -21.820 -41.740 1.00 36.25 C ATOM 625 C PHE A 76 -18.989 -21.244 -43.060 1.00 38.11 C ATOM 626 O PHE A 76 -19.787 -20.939 -43.955 1.00 37.97 O ATOM 627 CB PHE A 76 -19.422 -20.763 -40.637 1.00 35.05 C ATOM 628 CG PHE A 76 -20.190 -19.509 -40.955 1.00 34.11 C ATOM 629 CD1 PHE A 76 -21.575 -19.516 -40.978 1.00 31.86 C ATOM 630 CD2 PHE A 76 -19.527 -18.322 -41.224 1.00 34.75 C ATOM 631 CE1 PHE A 76 -22.284 -18.366 -41.267 1.00 31.69 C ATOM 632 CE2 PHE A 76 -20.233 -17.166 -41.511 1.00 35.61 C ATOM 633 CZ PHE A 76 -21.612 -17.188 -41.532 1.00 32.63 C ATOM 634 H PHE A 76 -18.071 -22.951 -40.538 1.00 0.00 H ATOM 635 N LEU A 77 -17.672 -21.084 -43.201 1.00 39.15 N ATOM 636 CA LEU A 77 -17.123 -20.509 -44.425 1.00 41.43 C ATOM 637 C LEU A 77 -17.495 -21.350 -45.640 1.00 40.79 C ATOM 638 O LEU A 77 -17.905 -20.817 -46.678 1.00 41.24 O ATOM 639 CB LEU A 77 -15.604 -20.376 -44.306 1.00 45.87 C ATOM 640 CG LEU A 77 -15.095 -19.382 -43.260 1.00 51.69 C ATOM 641 CD1 LEU A 77 -13.591 -19.521 -43.086 1.00 57.75 C ATOM 642 CD2 LEU A 77 -15.455 -17.952 -43.637 1.00 51.99 C ATOM 643 H LEU A 77 -17.032 -21.371 -42.433 1.00 0.00 H ATOM 644 N GLU A 78 -17.363 -22.673 -45.530 1.00 38.65 N ATOM 645 CA GLU A 78 -17.687 -23.537 -46.660 1.00 43.39 C ATOM 646 C GLU A 78 -19.173 -23.478 -46.991 1.00 41.85 C ATOM 647 O GLU A 78 -19.551 -23.425 -48.168 1.00 42.52 O ATOM 648 CB GLU A 78 -17.256 -24.972 -46.361 1.00 54.07 C ATOM 649 CG GLU A 78 -15.752 -25.138 -46.210 1.00 68.75 C ATOM 650 CD GLU A 78 -15.350 -26.569 -45.909 1.00 83.47 C ATOM 651 OE1 GLU A 78 -16.202 -27.471 -46.056 1.00 88.37 O ATOM 652 OE2 GLU A 78 -14.182 -26.792 -45.523 1.00 89.52 O ATOM 653 H GLU A 78 -17.029 -23.089 -44.637 1.00 0.00 H ATOM 654 N LEU A 79 -20.031 -23.481 -45.970 1.00 41.46 N ATOM 655 CA LEU A 79 -21.466 -23.393 -46.213 1.00 38.94 C ATOM 656 C LEU A 79 -21.831 -22.055 -46.844 1.00 35.13 C ATOM 657 O LEU A 79 -22.553 -22.002 -47.847 1.00 36.05 O ATOM 658 CB LEU A 79 -22.230 -23.594 -44.904 1.00 41.95 C ATOM 659 CG LEU A 79 -23.755 -23.506 -44.994 1.00 45.67 C ATOM 660 CD1 LEU A 79 -24.308 -24.544 -45.963 1.00 46.66 C ATOM 661 CD2 LEU A 79 -24.367 -23.680 -43.618 1.00 46.03 C ATOM 662 H LEU A 79 -19.675 -23.546 -44.995 1.00 0.00 H ATOM 663 N ALA A 80 -21.344 -20.958 -46.263 1.00 30.02 N ATOM 664 CA ALA A 80 -21.634 -19.641 -46.817 1.00 28.12 C ATOM 665 C ALA A 80 -21.127 -19.525 -48.248 1.00 29.49 C ATOM 666 O ALA A 80 -21.811 -18.968 -49.113 1.00 26.79 O ATOM 667 CB ALA A 80 -21.015 -18.556 -45.937 1.00 26.93 C ATOM 668 H ALA A 80 -20.754 -21.042 -45.410 1.00 0.00 H ATOM 669 N SER A 81 -19.930 -20.052 -48.518 1.00 36.81 N ATOM 670 CA SER A 81 -19.380 -19.986 -49.869 1.00 42.92 C ATOM 671 C SER A 81 -20.252 -20.748 -50.856 1.00 38.87 C ATOM 672 O SER A 81 -20.490 -20.279 -51.976 1.00 38.66 O ATOM 673 CB SER A 81 -17.954 -20.535 -49.885 1.00 51.18 C ATOM 674 OG SER A 81 -17.096 -19.737 -49.089 1.00 55.44 O ATOM 675 HG SER A 81 -17.425 -19.731 -48.155 1.00 0.00 H ATOM 676 H SER A 81 -19.386 -20.513 -47.761 1.00 0.00 H ATOM 677 N ARG A 82 -20.741 -21.926 -50.460 1.00 33.74 N ATOM 678 CA ARG A 82 -21.597 -22.705 -51.349 1.00 34.96 C ATOM 679 C ARG A 82 -22.882 -21.950 -51.661 1.00 30.65 C ATOM 680 O ARG A 82 -23.303 -21.866 -52.820 1.00 31.07 O ATOM 681 CB ARG A 82 -21.908 -24.068 -50.724 1.00 36.87 C ATOM 682 CG ARG A 82 -22.699 -24.989 -51.644 1.00 42.33 C ATOM 683 CD ARG A 82 -22.735 -26.429 -51.146 1.00 47.77 C ATOM 684 NE ARG A 82 -23.773 -26.655 -50.141 1.00 53.61 N ATOM 685 CZ ARG A 82 -23.555 -26.853 -48.841 1.00 54.79 C ATOM 686 NH1 ARG A 82 -22.322 -26.864 -48.349 1.00 54.28 N ATOM 687 NH2 ARG A 82 -24.584 -27.050 -48.026 1.00 54.76 N ATOM 688 HE ARG A 82 -24.761 -26.662 -50.467 1.00 0.00 H ATOM 689 HH12 ARG A 82 -22.169 -27.020 -47.332 1.00 0.00 H ATOM 690 HH11 ARG A 82 -21.509 -26.717 -48.980 1.00 0.00 H ATOM 691 HH22 ARG A 82 -24.421 -27.205 -47.011 1.00 0.00 H ATOM 692 HH21 ARG A 82 -25.553 -27.049 -48.403 1.00 0.00 H ATOM 693 H ARG A 82 -20.511 -22.290 -49.513 1.00 0.00 H ATOM 694 N LEU A 83 -23.522 -21.388 -50.633 1.00 32.76 N ATOM 695 CA LEU A 83 -24.739 -20.620 -50.860 1.00 33.68 C ATOM 696 C LEU A 83 -24.463 -19.426 -51.758 1.00 33.04 C ATOM 697 O LEU A 83 -25.275 -19.090 -52.627 1.00 33.39 O ATOM 698 CB LEU A 83 -25.328 -20.161 -49.527 1.00 33.69 C ATOM 699 CG LEU A 83 -25.769 -21.279 -48.584 1.00 33.51 C ATOM 700 CD1 LEU A 83 -26.215 -20.686 -47.256 1.00 36.68 C ATOM 701 CD2 LEU A 83 -26.880 -22.106 -49.204 1.00 31.93 C ATOM 702 H LEU A 83 -23.151 -21.499 -49.668 1.00 0.00 H ATOM 703 N ALA A 84 -23.312 -18.783 -51.576 1.00 31.45 N ATOM 704 CA ALA A 84 -22.994 -17.612 -52.381 1.00 35.84 C ATOM 705 C ALA A 84 -22.809 -17.966 -53.850 1.00 36.88 C ATOM 706 O ALA A 84 -23.112 -17.147 -54.726 1.00 40.01 O ATOM 707 CB ALA A 84 -21.739 -16.931 -51.832 1.00 35.48 C ATOM 708 H ALA A 84 -22.639 -19.117 -50.858 1.00 0.00 H ATOM 709 N ASP A 85 -22.328 -19.172 -54.142 1.00 38.64 N ATOM 710 CA ASP A 85 -22.059 -19.574 -55.515 1.00 39.26 C ATOM 711 C ASP A 85 -23.225 -20.295 -56.176 1.00 35.58 C ATOM 712 O ASP A 85 -23.263 -20.369 -57.409 1.00 37.65 O ATOM 713 CB ASP A 85 -20.827 -20.485 -55.569 1.00 42.33 C ATOM 714 CG ASP A 85 -19.527 -19.731 -55.343 1.00 42.23 C ATOM 715 OD1 ASP A 85 -19.571 -18.492 -55.186 1.00 40.78 O ATOM 716 OD2 ASP A 85 -18.461 -20.383 -55.330 1.00 42.13 O ATOM 717 H ASP A 85 -22.140 -19.844 -53.371 1.00 0.00 H ATOM 718 N THR A 86 -24.175 -20.821 -55.400 1.00 30.09 N ATOM 719 CA THR A 86 -25.157 -21.755 -55.938 1.00 28.14 C ATOM 720 C THR A 86 -26.603 -21.440 -55.586 1.00 28.79 C ATOM 721 O THR A 86 -27.497 -22.094 -56.135 1.00 27.23 O ATOM 722 CB THR A 86 -24.850 -23.183 -55.459 1.00 27.85 C ATOM 723 OG1 THR A 86 -25.097 -23.284 -54.053 1.00 29.57 O ATOM 724 CG2 THR A 86 -23.404 -23.543 -55.738 1.00 26.91 C ATOM 725 HG1 THR A 86 -24.517 -22.644 -53.570 1.00 0.00 H ATOM 726 H THR A 86 -24.216 -20.560 -54.394 1.00 0.00 H ATOM 727 N SER A 87 -26.871 -20.472 -54.710 1.00 29.95 N ATOM 728 CA SER A 87 -28.220 -20.212 -54.212 1.00 30.02 C ATOM 729 C SER A 87 -28.767 -18.927 -54.823 1.00 34.28 C ATOM 730 O SER A 87 -28.254 -17.835 -54.552 1.00 32.48 O ATOM 731 CB SER A 87 -28.226 -20.119 -52.689 1.00 29.62 C ATOM 732 OG SER A 87 -29.520 -19.788 -52.217 1.00 28.27 O ATOM 733 HG SER A 87 -30.162 -20.487 -52.500 1.00 0.00 H ATOM 734 H SER A 87 -26.089 -19.878 -54.367 1.00 0.00 H ATOM 735 N HIS A 88 -29.815 -19.058 -55.642 1.00 33.77 N ATOM 736 CA HIS A 88 -30.496 -17.878 -56.163 1.00 34.30 C ATOM 737 C HIS A 88 -31.170 -17.086 -55.050 1.00 33.52 C ATOM 738 O HIS A 88 -31.287 -15.858 -55.147 1.00 31.56 O ATOM 739 CB HIS A 88 -31.529 -18.286 -57.213 1.00 33.06 C ATOM 740 CG HIS A 88 -32.367 -17.148 -57.709 1.00 32.46 C ATOM 741 ND1 HIS A 88 -31.949 -16.295 -58.707 1.00 32.84 N ATOM 742 CD2 HIS A 88 -33.597 -16.719 -57.339 1.00 31.66 C ATOM 743 CE1 HIS A 88 -32.886 -15.391 -58.933 1.00 31.46 C ATOM 744 NE2 HIS A 88 -33.896 -15.626 -58.115 1.00 31.73 N ATOM 745 H HIS A 88 -30.147 -20.007 -55.909 1.00 0.00 H ATOM 746 N VAL A 89 -31.617 -17.766 -53.992 1.00 39.12 N ATOM 747 CA VAL A 89 -32.285 -17.078 -52.891 1.00 39.99 C ATOM 748 C VAL A 89 -31.296 -16.208 -52.125 1.00 38.91 C ATOM 749 O VAL A 89 -31.599 -15.062 -51.770 1.00 38.75 O ATOM 750 CB VAL A 89 -32.966 -18.106 -51.968 1.00 40.10 C ATOM 751 CG1 VAL A 89 -33.627 -17.416 -50.779 1.00 36.62 C ATOM 752 CG2 VAL A 89 -33.986 -18.923 -52.747 1.00 40.32 C ATOM 753 H VAL A 89 -31.488 -18.797 -53.951 1.00 0.00 H ATOM 754 N ALA A 90 -30.106 -16.742 -51.843 1.00 32.86 N ATOM 755 CA ALA A 90 -29.100 -15.961 -51.136 1.00 33.26 C ATOM 756 C ALA A 90 -28.639 -14.767 -51.959 1.00 30.88 C ATOM 757 O ALA A 90 -28.255 -13.736 -51.396 1.00 32.02 O ATOM 758 CB ALA A 90 -27.909 -16.848 -50.779 1.00 31.08 C ATOM 759 H ALA A 90 -29.896 -17.720 -52.129 1.00 0.00 H ATOM 760 N ARG A 91 -28.676 -14.883 -53.284 1.00 31.79 N ATOM 761 CA ARG A 91 -28.201 -13.833 -54.175 1.00 34.94 C ATOM 762 C ARG A 91 -29.307 -12.880 -54.617 1.00 38.70 C ATOM 763 O ARG A 91 -29.021 -11.915 -55.333 1.00 39.36 O ATOM 764 CB ARG A 91 -27.540 -14.459 -55.410 1.00 35.01 C ATOM 765 CG ARG A 91 -26.297 -15.277 -55.102 1.00 38.49 C ATOM 766 CD ARG A 91 -25.891 -16.147 -56.288 1.00 41.64 C ATOM 767 NE ARG A 91 -25.439 -15.360 -57.436 1.00 40.55 N ATOM 768 CZ ARG A 91 -24.169 -15.078 -57.719 1.00 37.22 C ATOM 769 NH1 ARG A 91 -23.876 -14.357 -58.791 1.00 35.24 N ATOM 770 NH2 ARG A 91 -23.187 -15.513 -56.942 1.00 38.05 N ATOM 771 HE ARG A 91 -26.167 -14.992 -58.081 1.00 0.00 H ATOM 772 HH12 ARG A 91 -22.885 -14.136 -59.014 1.00 0.00 H ATOM 773 HH11 ARG A 91 -24.637 -14.012 -59.410 1.00 0.00 H ATOM 774 HH22 ARG A 91 -22.199 -15.285 -57.175 1.00 0.00 H ATOM 775 HH21 ARG A 91 -23.404 -16.082 -56.099 1.00 0.00 H ATOM 776 H ARG A 91 -29.059 -15.756 -53.699 1.00 0.00 H ATOM 777 N ALA A 92 -30.555 -13.123 -54.215 1.00 36.90 N ATOM 778 CA ALA A 92 -31.653 -12.266 -54.661 1.00 37.14 C ATOM 779 C ALA A 92 -31.496 -10.823 -54.199 1.00 32.47 C ATOM 780 O ALA A 92 -31.679 -9.912 -55.025 1.00 32.99 O ATOM 781 CB ALA A 92 -32.986 -12.858 -54.194 1.00 37.44 C ATOM 782 H ALA A 92 -30.748 -13.925 -53.582 1.00 0.00 H ATOM 783 N PRO A 93 -31.172 -10.535 -52.939 1.00 29.32 N ATOM 784 CA PRO A 93 -31.060 -9.137 -52.492 1.00 30.32 C ATOM 785 C PRO A 93 -29.709 -8.479 -52.740 1.00 32.75 C ATOM 786 O PRO A 93 -29.461 -7.410 -52.176 1.00 38.41 O ATOM 787 CB PRO A 93 -31.322 -9.259 -50.985 1.00 30.03 C ATOM 788 CG PRO A 93 -30.747 -10.593 -50.630 1.00 31.02 C ATOM 789 CD PRO A 93 -30.966 -11.484 -51.826 1.00 29.75 C ATOM 790 N VAL A 94 -28.843 -9.070 -53.556 1.00 33.09 N ATOM 791 CA VAL A 94 -27.531 -8.504 -53.837 1.00 35.72 C ATOM 792 C VAL A 94 -27.464 -8.146 -55.315 1.00 36.09 C ATOM 793 O VAL A 94 -28.157 -8.732 -56.155 1.00 32.52 O ATOM 794 CB VAL A 94 -26.387 -9.471 -53.447 1.00 37.58 C ATOM 795 CG1 VAL A 94 -26.468 -10.757 -54.238 1.00 36.89 C ATOM 796 CG2 VAL A 94 -25.029 -8.817 -53.629 1.00 39.38 C ATOM 797 H VAL A 94 -29.111 -9.967 -54.009 1.00 0.00 H ATOM 798 N LYS A 95 -26.631 -7.153 -55.627 1.00 42.89 N ATOM 799 CA LYS A 95 -26.443 -6.746 -57.011 1.00 46.14 C ATOM 800 C LYS A 95 -26.039 -7.947 -57.855 1.00 44.40 C ATOM 801 O LYS A 95 -25.451 -8.912 -57.358 1.00 42.24 O ATOM 802 CB LYS A 95 -25.379 -5.649 -57.110 1.00 53.69 C ATOM 803 CG LYS A 95 -24.001 -6.061 -56.610 1.00 64.43 C ATOM 804 CD LYS A 95 -22.938 -5.061 -57.036 1.00 77.18 C ATOM 805 CE LYS A 95 -21.543 -5.537 -56.661 1.00 86.58 C ATOM 806 NZ LYS A 95 -20.480 -4.698 -57.280 1.00 92.08 N ATOM 807 HZ1 LYS A 95 -20.569 -4.737 -58.315 1.00 0.00 H ATOM 808 HZ2 LYS A 95 -20.585 -3.715 -56.958 1.00 0.00 H ATOM 809 HZ3 LYS A 95 -19.547 -5.059 -56.997 1.00 0.00 H ATOM 810 H LYS A 95 -26.109 -6.664 -54.872 1.00 0.00 H ATOM 811 N ASN A 96 -26.357 -7.885 -59.145 1.00 46.44 N ATOM 812 CA ASN A 96 -26.082 -9.005 -60.033 1.00 49.30 C ATOM 813 C ASN A 96 -24.590 -9.129 -60.317 1.00 47.15 C ATOM 814 O ASN A 96 -23.888 -8.132 -60.509 1.00 46.36 O ATOM 815 CB ASN A 96 -26.850 -8.844 -61.345 1.00 53.49 C ATOM 816 CG ASN A 96 -28.307 -9.238 -61.219 1.00 55.30 C ATOM 817 OD1 ASN A 96 -28.693 -9.939 -60.284 1.00 58.59 O ATOM 818 ND2 ASN A 96 -29.123 -8.800 -62.171 1.00 54.00 N ATOM 819 HD22 ASN A 96 -28.752 -8.210 -62.943 1.00 0.00 H ATOM 820 HD21 ASN A 96 -30.133 -9.047 -62.145 1.00 0.00 H ATOM 821 H ASN A 96 -26.807 -7.027 -59.523 1.00 0.00 H ATOM 822 N LEU A 97 -24.109 -10.374 -60.331 1.00 42.64 N ATOM 823 CA LEU A 97 -22.757 -10.715 -60.757 1.00 39.00 C ATOM 824 C LEU A 97 -21.694 -9.963 -59.963 1.00 39.29 C ATOM 825 O LEU A 97 -20.849 -9.278 -60.555 1.00 39.73 O ATOM 826 CB LEU A 97 -22.598 -10.427 -62.251 1.00 36.27 C ATOM 827 CG LEU A 97 -23.683 -11.037 -63.144 1.00 38.24 C ATOM 828 CD1 LEU A 97 -23.473 -10.649 -64.598 1.00 38.45 C ATOM 829 CD2 LEU A 97 -23.719 -12.548 -63.000 1.00 39.37 C ATOM 830 H LEU A 97 -24.734 -11.145 -60.020 1.00 0.00 H ATOM 831 N PRO A 98 -21.686 -10.072 -58.638 1.00 40.64 N ATOM 832 CA PRO A 98 -20.604 -9.465 -57.860 1.00 43.50 C ATOM 833 C PRO A 98 -19.331 -10.293 -57.931 1.00 45.25 C ATOM 834 O PRO A 98 -19.359 -11.517 -58.079 1.00 44.03 O ATOM 835 CB PRO A 98 -21.170 -9.437 -56.436 1.00 43.28 C ATOM 836 CG PRO A 98 -22.100 -10.596 -56.390 1.00 41.81 C ATOM 837 CD PRO A 98 -22.684 -10.727 -57.774 1.00 39.91 C ATOM 838 N LYS A 99 -18.198 -9.597 -57.826 1.00 50.22 N ATOM 839 CA LYS A 99 -16.907 -10.275 -57.886 1.00 56.32 C ATOM 840 C LYS A 99 -16.697 -11.173 -56.673 1.00 53.85 C ATOM 841 O LYS A 99 -16.140 -12.270 -56.796 1.00 57.45 O ATOM 842 CB LYS A 99 -15.783 -9.243 -57.999 1.00 68.51 C ATOM 843 CG LYS A 99 -14.379 -9.795 -57.768 1.00 82.83 C ATOM 844 CD LYS A 99 -14.057 -10.965 -58.687 1.00 96.40 C ATOM 845 CE LYS A 99 -12.676 -11.526 -58.390 1.00107.38 C ATOM 846 NZ LYS A 99 -11.591 -10.668 -58.938 1.00113.91 N ATOM 847 HZ1 LYS A 99 -11.696 -10.596 -59.970 1.00 0.00 H ATOM 848 HZ2 LYS A 99 -11.653 -9.720 -58.515 1.00 0.00 H ATOM 849 HZ3 LYS A 99 -10.668 -11.091 -58.711 1.00 0.00 H ATOM 850 H LYS A 99 -18.235 -8.565 -57.701 1.00 0.00 H ATOM 851 N GLU A 100 -17.139 -10.730 -55.494 1.00 48.76 N ATOM 852 CA GLU A 100 -16.957 -11.461 -54.242 1.00 52.40 C ATOM 853 C GLU A 100 -18.334 -11.804 -53.687 1.00 47.99 C ATOM 854 O GLU A 100 -18.808 -11.164 -52.737 1.00 49.52 O ATOM 855 CB GLU A 100 -16.151 -10.641 -53.235 1.00 62.74 C ATOM 856 CG GLU A 100 -14.736 -10.315 -53.690 1.00 74.45 C ATOM 857 CD GLU A 100 -13.744 -11.408 -53.341 1.00 83.00 C ATOM 858 OE1 GLU A 100 -12.956 -11.214 -52.393 1.00 86.01 O ATOM 859 OE2 GLU A 100 -13.759 -12.464 -54.008 1.00 85.69 O ATOM 860 H GLU A 100 -17.638 -9.818 -55.465 1.00 0.00 H ATOM 861 N PRO A 101 -19.008 -12.809 -54.251 1.00 43.03 N ATOM 862 CA PRO A 101 -20.366 -13.119 -53.775 1.00 39.42 C ATOM 863 C PRO A 101 -20.416 -13.471 -52.299 1.00 40.22 C ATOM 864 O PRO A 101 -21.402 -13.144 -51.628 1.00 41.93 O ATOM 865 CB PRO A 101 -20.789 -14.299 -54.664 1.00 39.95 C ATOM 866 CG PRO A 101 -19.518 -14.892 -55.157 1.00 42.04 C ATOM 867 CD PRO A 101 -18.557 -13.750 -55.290 1.00 43.29 C ATOM 868 N LEU A 102 -19.375 -14.116 -51.769 1.00 37.08 N ATOM 869 CA LEU A 102 -19.344 -14.434 -50.345 1.00 35.63 C ATOM 870 C LEU A 102 -19.386 -13.169 -49.498 1.00 34.91 C ATOM 871 O LEU A 102 -20.189 -13.057 -48.564 1.00 30.17 O ATOM 872 CB LEU A 102 -18.092 -15.249 -50.015 1.00 37.01 C ATOM 873 CG LEU A 102 -17.781 -15.409 -48.523 1.00 38.58 C ATOM 874 CD1 LEU A 102 -18.961 -16.026 -47.781 1.00 39.96 C ATOM 875 CD2 LEU A 102 -16.528 -16.246 -48.329 1.00 40.61 C ATOM 876 H LEU A 102 -18.578 -14.395 -52.376 1.00 0.00 H ATOM 877 N LEU A 103 -18.514 -12.207 -49.800 1.00 37.71 N ATOM 878 CA LEU A 103 -18.457 -10.983 -49.008 1.00 38.83 C ATOM 879 C LEU A 103 -19.760 -10.203 -49.118 1.00 38.14 C ATOM 880 O LEU A 103 -20.311 -9.743 -48.112 1.00 36.33 O ATOM 881 CB LEU A 103 -17.276 -10.125 -49.461 1.00 41.14 C ATOM 882 CG LEU A 103 -15.903 -10.799 -49.445 1.00 42.10 C ATOM 883 CD1 LEU A 103 -14.832 -9.803 -49.854 1.00 39.92 C ATOM 884 CD2 LEU A 103 -15.585 -11.388 -48.078 1.00 42.68 C ATOM 885 H LEU A 103 -17.869 -12.330 -50.607 1.00 0.00 H ATOM 886 N GLU A 104 -20.272 -10.049 -50.341 1.00 41.98 N ATOM 887 CA GLU A 104 -21.498 -9.287 -50.544 1.00 45.61 C ATOM 888 C GLU A 104 -22.682 -9.928 -49.839 1.00 41.40 C ATOM 889 O GLU A 104 -23.579 -9.224 -49.363 1.00 39.48 O ATOM 890 CB GLU A 104 -21.790 -9.156 -52.038 1.00 52.94 C ATOM 891 CG GLU A 104 -20.896 -8.165 -52.758 1.00 61.67 C ATOM 892 CD GLU A 104 -21.200 -6.733 -52.373 1.00 69.15 C ATOM 893 OE1 GLU A 104 -22.219 -6.503 -51.688 1.00 71.87 O ATOM 894 OE2 GLU A 104 -20.419 -5.838 -52.756 1.00 74.24 O ATOM 895 H GLU A 104 -19.791 -10.477 -51.158 1.00 0.00 H ATOM 896 N ILE A 105 -22.707 -11.256 -49.763 1.00 37.23 N ATOM 897 CA ILE A 105 -23.837 -11.931 -49.139 1.00 33.65 C ATOM 898 C ILE A 105 -23.782 -11.795 -47.625 1.00 33.79 C ATOM 899 O ILE A 105 -24.806 -11.545 -46.980 1.00 36.19 O ATOM 900 CB ILE A 105 -23.876 -13.399 -49.597 1.00 32.54 C ATOM 901 CG1 ILE A 105 -24.668 -13.475 -50.901 1.00 36.92 C ATOM 902 CG2 ILE A 105 -24.485 -14.307 -48.529 1.00 29.74 C ATOM 903 CD1 ILE A 105 -24.459 -14.727 -51.660 1.00 41.62 C ATOM 904 H ILE A 105 -21.919 -11.813 -50.150 1.00 0.00 H ATOM 905 N LEU A 106 -22.598 -11.956 -47.031 1.00 30.26 N ATOM 906 CA LEU A 106 -22.454 -11.662 -45.609 1.00 31.53 C ATOM 907 C LEU A 106 -22.746 -10.193 -45.336 1.00 33.08 C ATOM 908 O LEU A 106 -23.412 -9.852 -44.352 1.00 29.17 O ATOM 909 CB LEU A 106 -21.047 -12.030 -45.139 1.00 32.13 C ATOM 910 CG LEU A 106 -20.660 -13.505 -45.263 1.00 34.18 C ATOM 911 CD1 LEU A 106 -19.195 -13.711 -44.901 1.00 36.82 C ATOM 912 CD2 LEU A 106 -21.550 -14.370 -44.388 1.00 33.40 C ATOM 913 H LEU A 106 -21.780 -12.290 -47.580 1.00 0.00 H ATOM 914 N HIS A 107 -22.265 -9.312 -46.216 1.00 37.81 N ATOM 915 CA HIS A 107 -22.510 -7.881 -46.073 1.00 46.48 C ATOM 916 C HIS A 107 -24.002 -7.575 -46.078 1.00 41.40 C ATOM 917 O HIS A 107 -24.467 -6.694 -45.346 1.00 36.62 O ATOM 918 CB HIS A 107 -21.795 -7.136 -47.203 1.00 58.45 C ATOM 919 CG HIS A 107 -21.902 -5.646 -47.123 1.00 70.31 C ATOM 920 ND1 HIS A 107 -21.416 -4.919 -46.058 1.00 74.35 N ATOM 921 CD2 HIS A 107 -22.419 -4.743 -47.990 1.00 74.19 C ATOM 922 CE1 HIS A 107 -21.639 -3.634 -46.267 1.00 75.72 C ATOM 923 NE2 HIS A 107 -22.246 -3.500 -47.432 1.00 74.22 N ATOM 924 H HIS A 107 -21.703 -9.653 -47.022 1.00 0.00 H ATOM 925 N THR A 108 -24.771 -8.303 -46.886 1.00 43.11 N ATOM 926 CA THR A 108 -26.193 -8.027 -47.048 1.00 41.74 C ATOM 927 C THR A 108 -27.051 -8.758 -46.022 1.00 37.63 C ATOM 928 O THR A 108 -28.018 -8.187 -45.507 1.00 35.53 O ATOM 929 CB THR A 108 -26.640 -8.408 -48.465 1.00 43.86 C ATOM 930 OG1 THR A 108 -25.937 -7.602 -49.420 1.00 43.82 O ATOM 931 CG2 THR A 108 -28.143 -8.200 -48.650 1.00 45.22 C ATOM 932 HG1 THR A 108 -24.964 -7.756 -49.327 1.00 0.00 H ATOM 933 H THR A 108 -24.345 -9.090 -47.416 1.00 0.00 H ATOM 934 N TRP A 109 -26.719 -10.010 -45.712 1.00 33.85 N ATOM 935 CA TRP A 109 -27.564 -10.827 -44.852 1.00 31.72 C ATOM 936 C TRP A 109 -27.240 -10.693 -43.369 1.00 31.20 C ATOM 937 O TRP A 109 -28.115 -10.957 -42.536 1.00 31.78 O ATOM 938 CB TRP A 109 -27.454 -12.297 -45.264 1.00 31.25 C ATOM 939 CG TRP A 109 -28.221 -12.618 -46.508 1.00 27.74 C ATOM 940 CD1 TRP A 109 -27.762 -12.573 -47.792 1.00 26.28 C ATOM 941 CD2 TRP A 109 -29.589 -13.034 -46.584 1.00 25.53 C ATOM 942 NE1 TRP A 109 -28.761 -12.936 -48.665 1.00 24.91 N ATOM 943 CE2 TRP A 109 -29.892 -13.224 -47.946 1.00 23.31 C ATOM 944 CE3 TRP A 109 -30.586 -13.264 -45.632 1.00 27.13 C ATOM 945 CZ2 TRP A 109 -31.150 -13.634 -48.379 1.00 24.53 C ATOM 946 CZ3 TRP A 109 -31.833 -13.673 -46.064 1.00 26.94 C ATOM 947 CH2 TRP A 109 -32.104 -13.853 -47.424 1.00 26.34 C ATOM 948 HE1 TRP A 109 -28.673 -12.984 -49.700 1.00 0.00 H ATOM 949 H TRP A 109 -25.838 -10.412 -46.092 1.00 0.00 H ATOM 950 N LEU A 110 -26.019 -10.300 -43.015 1.00 30.67 N ATOM 951 CA LEU A 110 -25.614 -10.125 -41.619 1.00 28.55 C ATOM 952 C LEU A 110 -24.960 -8.759 -41.462 1.00 30.44 C ATOM 953 O LEU A 110 -23.747 -8.649 -41.244 1.00 30.52 O ATOM 954 CB LEU A 110 -24.674 -11.248 -41.180 1.00 27.84 C ATOM 955 CG LEU A 110 -25.319 -12.638 -41.148 1.00 30.70 C ATOM 956 CD1 LEU A 110 -24.266 -13.712 -40.934 1.00 32.93 C ATOM 957 CD2 LEU A 110 -26.391 -12.713 -40.066 1.00 29.67 C ATOM 958 H LEU A 110 -25.322 -10.109 -43.763 1.00 0.00 H ATOM 959 N PRO A 111 -25.749 -7.685 -41.558 1.00 31.39 N ATOM 960 CA PRO A 111 -25.163 -6.340 -41.507 1.00 34.96 C ATOM 961 C PRO A 111 -24.854 -5.840 -40.107 1.00 39.22 C ATOM 962 O PRO A 111 -24.081 -4.882 -39.975 1.00 45.30 O ATOM 963 CB PRO A 111 -26.240 -5.471 -42.169 1.00 33.42 C ATOM 964 CG PRO A 111 -27.520 -6.170 -41.837 1.00 31.29 C ATOM 965 CD PRO A 111 -27.199 -7.649 -41.817 1.00 31.88 C ATOM 966 N GLY A 112 -25.416 -6.444 -39.066 1.00 36.28 N ATOM 967 CA GLY A 112 -25.329 -5.905 -37.719 1.00 37.41 C ATOM 968 C GLY A 112 -24.306 -6.632 -36.861 1.00 37.59 C ATOM 969 O GLY A 112 -24.203 -7.859 -36.898 1.00 36.98 O ATOM 970 H GLY A 112 -25.935 -7.332 -39.220 1.00 0.00 H ATOM 971 N LEU A 113 -23.555 -5.850 -36.087 1.00 35.70 N ATOM 972 CA LEU A 113 -22.653 -6.363 -35.062 1.00 36.87 C ATOM 973 C LEU A 113 -23.220 -5.957 -33.706 1.00 41.71 C ATOM 974 O LEU A 113 -23.187 -4.777 -33.343 1.00 42.71 O ATOM 975 CB LEU A 113 -21.237 -5.821 -35.247 1.00 38.38 C ATOM 976 CG LEU A 113 -20.519 -6.164 -36.552 1.00 42.67 C ATOM 977 CD1 LEU A 113 -19.202 -5.399 -36.653 1.00 43.62 C ATOM 978 CD2 LEU A 113 -20.277 -7.661 -36.651 1.00 43.59 C ATOM 979 H LEU A 113 -23.615 -4.820 -36.221 1.00 0.00 H ATOM 980 N SER A 114 -23.740 -6.929 -32.964 1.00 44.27 N ATOM 981 CA SER A 114 -24.380 -6.682 -31.678 1.00 49.33 C ATOM 982 C SER A 114 -23.453 -7.150 -30.564 1.00 54.17 C ATOM 983 O SER A 114 -23.089 -8.330 -30.510 1.00 55.88 O ATOM 984 CB SER A 114 -25.728 -7.397 -31.597 1.00 47.66 C ATOM 985 OG SER A 114 -26.416 -7.059 -30.407 1.00 49.79 O ATOM 986 HG SER A 114 -27.283 -7.536 -30.382 1.00 0.00 H ATOM 987 H SER A 114 -23.688 -7.906 -33.315 1.00 0.00 H ATOM 988 N LEU A 115 -23.075 -6.227 -29.682 1.00 53.87 N ATOM 989 CA LEU A 115 -22.208 -6.537 -28.553 1.00 53.80 C ATOM 990 C LEU A 115 -23.067 -6.848 -27.334 1.00 50.41 C ATOM 991 O LEU A 115 -23.865 -6.010 -26.900 1.00 48.56 O ATOM 992 CB LEU A 115 -21.258 -5.374 -28.265 1.00 55.22 C ATOM 993 CG LEU A 115 -20.309 -5.518 -27.069 1.00 53.11 C ATOM 994 CD1 LEU A 115 -19.414 -6.744 -27.204 1.00 51.25 C ATOM 995 CD2 LEU A 115 -19.466 -4.264 -26.923 1.00 52.22 C ATOM 996 H LEU A 115 -23.411 -5.250 -29.803 1.00 0.00 H ATOM 997 N SER A 116 -22.903 -8.051 -26.790 1.00 49.18 N ATOM 998 CA SER A 116 -23.659 -8.473 -25.621 1.00 51.56 C ATOM 999 C SER A 116 -23.014 -7.930 -24.353 1.00 52.72 C ATOM 1000 O SER A 116 -21.788 -7.913 -24.220 1.00 54.44 O ATOM 1001 CB SER A 116 -23.734 -10.000 -25.558 1.00 53.51 C ATOM 1002 OG SER A 116 -24.536 -10.428 -24.472 1.00 55.14 O ATOM 1003 HG SER A 116 -24.147 -10.095 -23.625 1.00 0.00 H ATOM 1004 H SER A 116 -22.216 -8.708 -27.212 1.00 0.00 H ATOM 1005 N SER A 117 -23.851 -7.492 -23.415 1.00 50.10 N ATOM 1006 CA SER A 117 -23.367 -6.870 -22.192 1.00 52.48 C ATOM 1007 C SER A 117 -24.298 -7.232 -21.045 1.00 50.65 C ATOM 1008 O SER A 117 -25.431 -7.675 -21.253 1.00 46.16 O ATOM 1009 CB SER A 117 -23.270 -5.346 -22.346 1.00 57.04 C ATOM 1010 OG SER A 117 -22.776 -4.735 -21.166 1.00 61.67 O ATOM 1011 HG SER A 117 -23.385 -4.936 -20.412 1.00 0.00 H ATOM 1012 H SER A 117 -24.875 -7.597 -23.560 1.00 0.00 H ATOM 1013 N ILE A 118 -23.796 -7.046 -19.824 1.00 52.89 N ATOM 1014 CA ILE A 118 -24.602 -7.223 -18.620 1.00 57.78 C ATOM 1015 C ILE A 118 -25.528 -6.024 -18.469 1.00 61.92 C ATOM 1016 O ILE A 118 -25.392 -5.028 -19.189 1.00 60.42 O ATOM 1017 CB ILE A 118 -23.726 -7.405 -17.365 1.00 59.18 C ATOM 1018 CG1 ILE A 118 -22.726 -6.248 -17.229 1.00 60.84 C ATOM 1019 CG2 ILE A 118 -23.012 -8.748 -17.413 1.00 56.27 C ATOM 1020 CD1 ILE A 118 -21.926 -6.270 -15.947 1.00 62.07 C ATOM 1021 H ILE A 118 -22.799 -6.766 -19.726 1.00 0.00 H ATOM 1022 N HIS A 119 -26.473 -6.113 -17.536 1.00 68.57 N ATOM 1023 CA HIS A 119 -27.444 -5.047 -17.357 1.00 74.66 C ATOM 1024 C HIS A 119 -26.749 -3.777 -16.860 1.00 74.39 C ATOM 1025 O HIS A 119 -25.771 -3.850 -16.111 1.00 71.22 O ATOM 1026 CB HIS A 119 -28.523 -5.472 -16.364 1.00 84.35 C ATOM 1027 CG HIS A 119 -29.825 -4.756 -16.544 1.00 95.71 C ATOM 1028 ND1 HIS A 119 -30.124 -3.579 -15.892 1.00100.13 N ATOM 1029 CD2 HIS A 119 -30.906 -5.051 -17.304 1.00 98.34 C ATOM 1030 CE1 HIS A 119 -31.334 -3.180 -16.242 1.00101.43 C ATOM 1031 NE2 HIS A 119 -31.830 -4.055 -17.098 1.00 99.51 N ATOM 1032 H HIS A 119 -26.517 -6.956 -16.928 1.00 0.00 H ATOM 1033 N PRO A 120 -27.231 -2.596 -17.263 1.00 82.05 N ATOM 1034 CA PRO A 120 -26.585 -1.357 -16.797 1.00 88.70 C ATOM 1035 C PRO A 120 -26.605 -1.181 -15.289 1.00 98.74 C ATOM 1036 O PRO A 120 -25.686 -0.561 -14.739 1.00100.81 O ATOM 1037 CB PRO A 120 -27.393 -0.258 -17.498 1.00 86.73 C ATOM 1038 CG PRO A 120 -27.959 -0.916 -18.685 1.00 83.11 C ATOM 1039 CD PRO A 120 -28.268 -2.316 -18.271 1.00 81.17 C ATOM 1040 N ARG A 121 -27.626 -1.696 -14.599 1.00105.99 N ATOM 1041 CA ARG A 121 -27.681 -1.554 -13.149 1.00114.08 C ATOM 1042 C ARG A 121 -26.454 -2.146 -12.471 1.00117.06 C ATOM 1043 O ARG A 121 -26.141 -1.766 -11.337 1.00119.10 O ATOM 1044 CB ARG A 121 -28.948 -2.213 -12.598 1.00118.31 C ATOM 1045 CG ARG A 121 -28.985 -3.728 -12.737 1.00121.71 C ATOM 1046 CD ARG A 121 -30.222 -4.310 -12.073 1.00127.83 C ATOM 1047 NE ARG A 121 -31.071 -5.033 -13.016 1.00132.56 N ATOM 1048 CZ ARG A 121 -32.192 -5.665 -12.681 1.00137.81 C ATOM 1049 NH1 ARG A 121 -32.607 -5.668 -11.420 1.00141.53 N ATOM 1050 NH2 ARG A 121 -32.899 -6.296 -13.607 1.00138.15 N ATOM 1051 HE ARG A 121 -30.780 -5.055 -14.014 1.00 0.00 H ATOM 1052 HH12 ARG A 121 -33.484 -6.164 -11.162 1.00 0.00 H ATOM 1053 HH11 ARG A 121 -32.055 -5.175 -10.690 1.00 0.00 H ATOM 1054 HH22 ARG A 121 -33.776 -6.790 -13.345 1.00 0.00 H ATOM 1055 HH21 ARG A 121 -32.577 -6.297 -14.596 1.00 0.00 H ATOM 1056 H ARG A 121 -28.386 -2.201 -15.099 1.00 0.00 H ATOM 1057 N GLU A 122 -25.757 -3.064 -13.136 1.00113.41 N ATOM 1058 CA GLU A 122 -24.543 -3.666 -12.607 1.00112.84 C ATOM 1059 C GLU A 122 -23.280 -2.948 -13.067 1.00113.02 C ATOM 1060 O GLU A 122 -22.180 -3.353 -12.678 1.00112.70 O ATOM 1061 CB GLU A 122 -24.473 -5.141 -13.016 1.00110.56 C ATOM 1062 CG GLU A 122 -25.746 -5.921 -12.723 1.00111.79 C ATOM 1063 CD GLU A 122 -25.668 -7.361 -13.184 1.00112.40 C ATOM 1064 OE1 GLU A 122 -24.556 -7.820 -13.523 1.00112.45 O ATOM 1065 OE2 GLU A 122 -26.720 -8.033 -13.210 1.00113.67 O ATOM 1066 H GLU A 122 -26.094 -3.364 -14.073 1.00 0.00 H ATOM 1067 N LEU A 123 -23.410 -1.902 -13.884 1.00120.31 N ATOM 1068 CA LEU A 123 -22.270 -1.121 -14.352 1.00123.63 C ATOM 1069 C LEU A 123 -22.065 0.161 -13.558 1.00146.02 C ATOM 1070 O LEU A 123 -20.920 0.573 -13.344 1.00145.92 O ATOM 1071 CB LEU A 123 -22.441 -0.773 -15.835 1.00107.04 C ATOM 1072 CG LEU A 123 -22.529 -1.955 -16.802 1.00 92.69 C ATOM 1073 CD1 LEU A 123 -22.740 -1.458 -18.225 1.00 89.05 C ATOM 1074 CD2 LEU A 123 -21.283 -2.822 -16.718 1.00 86.02 C ATOM 1075 H LEU A 123 -24.363 -1.632 -14.201 1.00 0.00 H ATOM 1076 N SER A 124 -23.147 0.811 -13.123 1.00167.15 N ATOM 1077 CA SER A 124 -23.004 1.988 -12.272 1.00180.87 C ATOM 1078 C SER A 124 -22.210 1.655 -11.016 1.00179.75 C ATOM 1079 O SER A 124 -21.402 2.465 -10.548 1.00190.26 O ATOM 1080 CB SER A 124 -24.381 2.544 -11.909 1.00187.34 C ATOM 1081 OG SER A 124 -25.162 1.574 -11.234 1.00183.65 O ATOM 1082 HG SER A 124 -24.701 1.302 -10.401 1.00 0.00 H ATOM 1083 H SER A 124 -24.095 0.478 -13.391 1.00 0.00 H ATOM 1084 N GLN A 125 -22.428 0.464 -10.458 1.00162.47 N ATOM 1085 CA GLN A 125 -21.617 -0.027 -9.352 1.00143.83 C ATOM 1086 C GLN A 125 -20.363 -0.687 -9.911 1.00122.70 C ATOM 1087 O GLN A 125 -20.014 -0.473 -11.076 1.00117.83 O ATOM 1088 CB GLN A 125 -22.411 -1.013 -8.488 1.00147.76 C ATOM 1089 CG GLN A 125 -23.642 -0.419 -7.815 1.00155.75 C ATOM 1090 CD GLN A 125 -24.794 -0.198 -8.776 1.00164.42 C ATOM 1091 OE1 GLN A 125 -24.592 -0.025 -9.977 1.00174.87 O ATOM 1092 NE2 GLN A 125 -26.013 -0.208 -8.250 1.00163.83 N ATOM 1093 HE22 GLN A 125 -26.137 -0.358 -7.228 1.00 0.00 H ATOM 1094 HE21 GLN A 125 -26.844 -0.066 -8.860 1.00 0.00 H ATOM 1095 H GLN A 125 -23.199 -0.131 -10.823 1.00 0.00 H ATOM 1096 N THR A 126 -19.676 -1.485 -9.098 1.00106.74 N ATOM 1097 CA THR A 126 -18.498 -2.206 -9.562 1.00 94.75 C ATOM 1098 C THR A 126 -18.911 -3.603 -10.010 1.00 81.63 C ATOM 1099 O THR A 126 -19.399 -4.384 -9.182 1.00 78.44 O ATOM 1100 CB THR A 126 -17.456 -2.300 -8.461 1.00 95.85 C ATOM 1101 OG1 THR A 126 -17.155 -0.984 -7.977 1.00 97.83 O ATOM 1102 CG2 THR A 126 -16.178 -2.943 -8.986 1.00 95.22 C ATOM 1103 HG1 THR A 126 -16.476 -1.045 -7.259 1.00 0.00 H ATOM 1104 H THR A 126 -19.986 -1.596 -8.112 1.00 0.00 H ATOM 1105 N PRO A 127 -18.741 -3.963 -11.283 1.00 73.01 N ATOM 1106 CA PRO A 127 -19.198 -5.283 -11.731 1.00 66.21 C ATOM 1107 C PRO A 127 -18.338 -6.396 -11.156 1.00 59.56 C ATOM 1108 O PRO A 127 -17.123 -6.254 -11.001 1.00 55.37 O ATOM 1109 CB PRO A 127 -19.073 -5.204 -13.257 1.00 67.26 C ATOM 1110 CG PRO A 127 -17.989 -4.216 -13.486 1.00 69.37 C ATOM 1111 CD PRO A 127 -18.096 -3.208 -12.372 1.00 72.37 C ATOM 1112 N SER A 128 -18.986 -7.517 -10.841 1.00 62.23 N ATOM 1113 CA SER A 128 -18.276 -8.644 -10.252 1.00 64.38 C ATOM 1114 C SER A 128 -17.549 -9.466 -11.309 1.00 67.13 C ATOM 1115 O SER A 128 -16.428 -9.930 -11.073 1.00 67.35 O ATOM 1116 CB SER A 128 -19.254 -9.524 -9.476 1.00 64.98 C ATOM 1117 OG SER A 128 -20.030 -8.752 -8.576 1.00 67.58 O ATOM 1118 HG SER A 128 -20.654 -9.345 -8.087 1.00 0.00 H ATOM 1119 H SER A 128 -20.008 -7.588 -11.017 1.00 0.00 H ATOM 1120 N GLY A 129 -18.166 -9.651 -12.475 1.00 71.43 N ATOM 1121 CA GLY A 129 -17.597 -10.463 -13.524 1.00 70.51 C ATOM 1122 C GLY A 129 -17.427 -9.706 -14.826 1.00 66.94 C ATOM 1123 O GLY A 129 -17.600 -8.485 -14.892 1.00 71.59 O ATOM 1124 H GLY A 129 -19.087 -9.196 -12.635 1.00 0.00 H ATOM 1125 N PRO A 130 -17.077 -10.426 -15.891 1.00 53.53 N ATOM 1126 CA PRO A 130 -16.863 -9.771 -17.187 1.00 50.62 C ATOM 1127 C PRO A 130 -18.111 -9.040 -17.658 1.00 52.74 C ATOM 1128 O PRO A 130 -19.236 -9.509 -17.478 1.00 50.80 O ATOM 1129 CB PRO A 130 -16.505 -10.934 -18.119 1.00 46.37 C ATOM 1130 CG PRO A 130 -15.991 -12.004 -17.217 1.00 44.37 C ATOM 1131 CD PRO A 130 -16.754 -11.861 -15.935 1.00 47.28 C ATOM 1132 N VAL A 131 -17.895 -7.878 -18.276 1.00 57.39 N ATOM 1133 CA VAL A 131 -19.006 -7.041 -18.716 1.00 61.93 C ATOM 1134 C VAL A 131 -19.587 -7.553 -20.028 1.00 53.92 C ATOM 1135 O VAL A 131 -20.801 -7.477 -20.251 1.00 52.56 O ATOM 1136 CB VAL A 131 -18.537 -5.579 -18.836 1.00 72.97 C ATOM 1137 CG1 VAL A 131 -19.630 -4.706 -19.447 1.00 76.19 C ATOM 1138 CG2 VAL A 131 -18.124 -5.045 -17.472 1.00 77.52 C ATOM 1139 H VAL A 131 -16.919 -7.563 -18.447 1.00 0.00 H ATOM 1140 N PHE A 132 -18.740 -8.070 -20.913 1.00 49.24 N ATOM 1141 CA PHE A 132 -19.159 -8.509 -22.234 1.00 48.14 C ATOM 1142 C PHE A 132 -19.077 -10.026 -22.334 1.00 46.99 C ATOM 1143 O PHE A 132 -18.205 -10.661 -21.734 1.00 46.13 O ATOM 1144 CB PHE A 132 -18.295 -7.868 -23.324 1.00 49.67 C ATOM 1145 CG PHE A 132 -18.195 -6.371 -23.215 1.00 54.57 C ATOM 1146 CD1 PHE A 132 -19.306 -5.572 -23.423 1.00 57.79 C ATOM 1147 CD2 PHE A 132 -16.988 -5.766 -22.908 1.00 57.23 C ATOM 1148 CE1 PHE A 132 -19.217 -4.195 -23.322 1.00 61.18 C ATOM 1149 CE2 PHE A 132 -16.891 -4.391 -22.806 1.00 60.86 C ATOM 1150 CZ PHE A 132 -18.007 -3.604 -23.014 1.00 61.97 C ATOM 1151 H PHE A 132 -17.738 -8.164 -20.650 1.00 0.00 H ATOM 1152 N GLN A 133 -19.999 -10.599 -23.103 1.00 45.50 N ATOM 1153 CA GLN A 133 -20.087 -12.041 -23.291 1.00 45.98 C ATOM 1154 C GLN A 133 -19.686 -12.488 -24.686 1.00 42.72 C ATOM 1155 O GLN A 133 -18.997 -13.500 -24.831 1.00 40.72 O ATOM 1156 CB GLN A 133 -21.513 -12.528 -23.006 1.00 51.85 C ATOM 1157 CG GLN A 133 -21.997 -12.265 -21.589 1.00 60.35 C ATOM 1158 CD GLN A 133 -22.366 -10.813 -21.357 1.00 70.78 C ATOM 1159 OE1 GLN A 133 -23.134 -10.226 -22.119 1.00 72.94 O ATOM 1160 NE2 GLN A 133 -21.813 -10.223 -20.303 1.00 75.16 N ATOM 1161 HE22 GLN A 133 -21.169 -10.758 -19.686 1.00 0.00 H ATOM 1162 HE21 GLN A 133 -22.024 -9.226 -20.095 1.00 0.00 H ATOM 1163 H GLN A 133 -20.687 -9.991 -23.591 1.00 0.00 H ATOM 1164 N HIS A 134 -20.095 -11.758 -25.717 1.00 40.01 N ATOM 1165 CA HIS A 134 -19.824 -12.157 -27.091 1.00 38.27 C ATOM 1166 C HIS A 134 -20.233 -11.015 -28.009 1.00 40.07 C ATOM 1167 O HIS A 134 -20.889 -10.058 -27.591 1.00 39.67 O ATOM 1168 CB HIS A 134 -20.583 -13.432 -27.458 1.00 34.34 C ATOM 1169 CG HIS A 134 -22.071 -13.273 -27.420 1.00 33.48 C ATOM 1170 ND1 HIS A 134 -22.849 -13.795 -26.409 1.00 32.56 N ATOM 1171 CD2 HIS A 134 -22.922 -12.639 -28.261 1.00 34.04 C ATOM 1172 CE1 HIS A 134 -24.116 -13.495 -26.634 1.00 33.49 C ATOM 1173 NE2 HIS A 134 -24.187 -12.792 -27.751 1.00 34.99 N ATOM 1174 H HIS A 134 -20.622 -10.879 -25.539 1.00 0.00 H ATOM 1175 N VAL A 135 -19.838 -11.137 -29.273 1.00 39.91 N ATOM 1176 CA VAL A 135 -20.347 -10.301 -30.352 1.00 42.54 C ATOM 1177 C VAL A 135 -21.130 -11.199 -31.298 1.00 44.90 C ATOM 1178 O VAL A 135 -20.764 -12.360 -31.511 1.00 41.72 O ATOM 1179 CB VAL A 135 -19.214 -9.567 -31.097 1.00 40.89 C ATOM 1180 CG1 VAL A 135 -19.783 -8.694 -32.205 1.00 38.81 C ATOM 1181 CG2 VAL A 135 -18.395 -8.731 -30.127 1.00 40.20 C ATOM 1182 H VAL A 135 -19.131 -11.865 -29.502 1.00 0.00 H ATOM 1183 N SER A 136 -22.210 -10.666 -31.857 1.00 50.50 N ATOM 1184 CA SER A 136 -23.094 -11.432 -32.721 1.00 50.94 C ATOM 1185 C SER A 136 -23.227 -10.762 -34.080 1.00 49.27 C ATOM 1186 O SER A 136 -23.381 -9.539 -34.170 1.00 49.73 O ATOM 1187 CB SER A 136 -24.482 -11.590 -32.091 1.00 51.68 C ATOM 1188 OG SER A 136 -24.460 -12.577 -31.078 1.00 49.23 O ATOM 1189 HG SER A 136 -24.184 -13.444 -31.469 1.00 0.00 H ATOM 1190 H SER A 136 -22.431 -9.667 -31.671 1.00 0.00 H ATOM 1191 N LEU A 137 -23.156 -11.573 -35.133 1.00 44.45 N ATOM 1192 CA LEU A 137 -23.598 -11.148 -36.452 1.00 40.65 C ATOM 1193 C LEU A 137 -25.116 -11.248 -36.503 1.00 41.07 C ATOM 1194 O LEU A 137 -25.684 -12.304 -36.207 1.00 42.12 O ATOM 1195 CB LEU A 137 -22.965 -12.015 -37.538 1.00 35.99 C ATOM 1196 CG LEU A 137 -21.448 -12.196 -37.459 1.00 35.99 C ATOM 1197 CD1 LEU A 137 -20.969 -13.087 -38.589 1.00 36.06 C ATOM 1198 CD2 LEU A 137 -20.727 -10.855 -37.488 1.00 38.43 C ATOM 1199 H LEU A 137 -22.776 -12.533 -35.010 1.00 0.00 H ATOM 1200 N CYS A 138 -25.774 -10.150 -36.865 1.00 43.67 N ATOM 1201 CA CYS A 138 -27.224 -10.057 -36.774 1.00 44.32 C ATOM 1202 C CYS A 138 -27.818 -9.615 -38.101 1.00 44.24 C ATOM 1203 O CYS A 138 -27.247 -8.774 -38.801 1.00 47.21 O ATOM 1204 CB CYS A 138 -27.641 -9.081 -35.674 1.00 46.80 C ATOM 1205 SG CYS A 138 -27.156 -9.612 -34.026 1.00 48.34 S ATOM 1206 H CYS A 138 -25.237 -9.335 -37.223 1.00 0.00 H ATOM 1207 N ALA A 139 -28.971 -10.192 -38.436 1.00 37.55 N ATOM 1208 CA ALA A 139 -29.739 -9.773 -39.596 1.00 38.64 C ATOM 1209 C ALA A 139 -30.672 -8.614 -39.290 1.00 43.37 C ATOM 1210 O ALA A 139 -31.102 -7.921 -40.218 1.00 42.25 O ATOM 1211 CB ALA A 139 -30.558 -10.946 -40.140 1.00 37.46 C ATOM 1212 H ALA A 139 -29.334 -10.969 -37.847 1.00 0.00 H ATOM 1213 N LEU A 140 -30.991 -8.391 -38.016 1.00 53.55 N ATOM 1214 CA LEU A 140 -31.892 -7.326 -37.605 1.00 64.10 C ATOM 1215 C LEU A 140 -31.370 -6.694 -36.322 1.00 67.58 C ATOM 1216 O LEU A 140 -30.509 -7.251 -35.635 1.00 72.87 O ATOM 1217 CB LEU A 140 -33.319 -7.847 -37.381 1.00 68.59 C ATOM 1218 CG LEU A 140 -34.017 -8.518 -38.565 1.00 70.44 C ATOM 1219 CD1 LEU A 140 -35.317 -9.160 -38.108 1.00 69.60 C ATOM 1220 CD2 LEU A 140 -34.277 -7.518 -39.682 1.00 72.81 C ATOM 1221 H LEU A 140 -30.578 -9.004 -37.284 1.00 0.00 H ATOM 1222 N GLY A 141 -31.909 -5.518 -36.004 1.00 59.93 N ATOM 1223 CA GLY A 141 -31.624 -4.850 -34.751 1.00 55.02 C ATOM 1224 C GLY A 141 -30.535 -3.801 -34.800 1.00 53.39 C ATOM 1225 O GLY A 141 -30.198 -3.239 -33.750 1.00 52.90 O ATOM 1226 H GLY A 141 -32.557 -5.064 -36.679 1.00 0.00 H ATOM 1227 N ARG A 142 -29.976 -3.514 -35.973 1.00 54.33 N ATOM 1228 CA ARG A 142 -28.914 -2.519 -36.077 1.00 56.05 C ATOM 1229 C ARG A 142 -29.492 -1.122 -35.881 1.00 61.07 C ATOM 1230 O ARG A 142 -30.406 -0.713 -36.605 1.00 59.70 O ATOM 1231 CB ARG A 142 -28.220 -2.627 -37.433 1.00 54.59 C ATOM 1232 CG ARG A 142 -27.008 -1.718 -37.577 1.00 56.20 C ATOM 1233 CD ARG A 142 -26.336 -1.888 -38.930 1.00 60.88 C ATOM 1234 NE ARG A 142 -27.198 -1.462 -40.029 1.00 67.76 N ATOM 1235 CZ ARG A 142 -27.303 -0.208 -40.463 1.00 75.07 C ATOM 1236 NH1 ARG A 142 -26.602 0.763 -39.891 1.00 76.32 N ATOM 1237 NH2 ARG A 142 -28.116 0.077 -41.472 1.00 78.44 N ATOM 1238 HE ARG A 142 -27.769 -2.189 -40.506 1.00 0.00 H ATOM 1239 HH12 ARG A 142 -26.690 1.740 -40.236 1.00 0.00 H ATOM 1240 HH11 ARG A 142 -25.965 0.547 -39.098 1.00 0.00 H ATOM 1241 HH22 ARG A 142 -28.199 1.056 -41.812 1.00 0.00 H ATOM 1242 HH21 ARG A 142 -28.670 -0.679 -41.923 1.00 0.00 H ATOM 1243 H ARG A 142 -30.301 -4.007 -36.829 1.00 0.00 H ATOM 1244 N ARG A 143 -28.961 -0.391 -34.899 1.00 65.87 N ATOM 1245 CA ARG A 143 -29.384 0.980 -34.641 1.00 74.01 C ATOM 1246 C ARG A 143 -28.220 1.945 -34.841 1.00 78.93 C ATOM 1247 O ARG A 143 -28.041 2.489 -35.936 1.00 81.27 O ATOM 1248 CB ARG A 143 -29.950 1.115 -33.225 1.00 78.77 C ATOM 1249 CG ARG A 143 -31.159 0.243 -32.944 1.00 84.01 C ATOM 1250 CD ARG A 143 -31.771 0.596 -31.600 1.00 92.02 C ATOM 1251 NE ARG A 143 -32.833 -0.327 -31.211 1.00 98.61 N ATOM 1252 CZ ARG A 143 -33.564 -0.204 -30.107 1.00104.91 C ATOM 1253 NH1 ARG A 143 -33.353 0.807 -29.274 1.00108.14 N ATOM 1254 NH2 ARG A 143 -34.509 -1.093 -29.835 1.00105.95 N ATOM 1255 HE ARG A 143 -33.031 -1.133 -31.838 1.00 0.00 H ATOM 1256 HH12 ARG A 143 -33.927 0.899 -28.412 1.00 0.00 H ATOM 1257 HH11 ARG A 143 -32.613 1.507 -29.483 1.00 0.00 H ATOM 1258 HH22 ARG A 143 -35.081 -0.997 -28.972 1.00 0.00 H ATOM 1259 HH21 ARG A 143 -34.679 -1.887 -30.485 1.00 0.00 H ATOM 1260 H ARG A 143 -28.223 -0.812 -34.299 1.00 0.00 H ATOM 1261 N ARG A 144 -27.423 2.163 -33.791 1.00 81.64 N ATOM 1262 CA ARG A 144 -26.274 3.056 -33.903 1.00 85.97 C ATOM 1263 C ARG A 144 -25.144 2.425 -34.706 1.00 77.89 C ATOM 1264 O ARG A 144 -24.366 3.140 -35.347 1.00 75.25 O ATOM 1265 CB ARG A 144 -25.763 3.443 -32.515 1.00 98.38 C ATOM 1266 CG ARG A 144 -26.631 4.440 -31.767 1.00110.33 C ATOM 1267 CD ARG A 144 -25.851 5.070 -30.621 1.00119.82 C ATOM 1268 NE ARG A 144 -26.643 6.040 -29.870 1.00127.68 N ATOM 1269 CZ ARG A 144 -27.311 5.771 -28.751 1.00131.90 C ATOM 1270 NH1 ARG A 144 -27.295 4.551 -28.229 1.00130.22 N ATOM 1271 NH2 ARG A 144 -28.000 6.730 -28.147 1.00136.09 N ATOM 1272 HE ARG A 144 -26.688 7.012 -30.236 1.00 0.00 H ATOM 1273 HH12 ARG A 144 -27.821 4.353 -27.354 1.00 0.00 H ATOM 1274 HH11 ARG A 144 -26.756 3.793 -28.695 1.00 0.00 H ATOM 1275 HH22 ARG A 144 -28.523 6.523 -27.272 1.00 0.00 H ATOM 1276 HH21 ARG A 144 -28.017 7.689 -28.548 1.00 0.00 H ATOM 1277 H ARG A 144 -27.623 1.692 -32.886 1.00 0.00 H ATOM 1278 N GLY A 145 -25.030 1.100 -34.676 1.00 73.05 N ATOM 1279 CA GLY A 145 -23.941 0.440 -35.364 1.00 69.42 C ATOM 1280 C GLY A 145 -23.985 0.666 -36.862 1.00 67.01 C ATOM 1281 O GLY A 145 -24.995 1.078 -37.438 1.00 67.12 O ATOM 1282 H GLY A 145 -25.729 0.534 -34.154 1.00 0.00 H ATOM 1283 N THR A 146 -22.852 0.392 -37.498 1.00 66.25 N ATOM 1284 CA THR A 146 -22.719 0.484 -38.943 1.00 65.50 C ATOM 1285 C THR A 146 -22.831 -0.901 -39.568 1.00 63.25 C ATOM 1286 O THR A 146 -22.663 -1.927 -38.903 1.00 65.37 O ATOM 1287 CB THR A 146 -21.381 1.119 -39.330 1.00 66.67 C ATOM 1288 OG1 THR A 146 -20.305 0.322 -38.817 1.00 65.35 O ATOM 1289 CG2 THR A 146 -21.278 2.535 -38.778 1.00 68.77 C ATOM 1290 HG1 THR A 146 -19.441 0.735 -39.069 1.00 0.00 H ATOM 1291 H THR A 146 -22.025 0.099 -36.939 1.00 0.00 H ATOM 1292 N VAL A 147 -23.123 -0.918 -40.869 1.00 57.80 N ATOM 1293 CA VAL A 147 -23.187 -2.178 -41.593 1.00 55.10 C ATOM 1294 C VAL A 147 -21.823 -2.848 -41.535 1.00 54.02 C ATOM 1295 O VAL A 147 -20.802 -2.250 -41.898 1.00 54.43 O ATOM 1296 CB VAL A 147 -23.641 -1.945 -43.041 1.00 53.04 C ATOM 1297 CG1 VAL A 147 -23.731 -3.270 -43.791 1.00 52.28 C ATOM 1298 CG2 VAL A 147 -24.984 -1.225 -43.068 1.00 51.03 C ATOM 1299 H VAL A 147 -23.306 -0.025 -41.369 1.00 0.00 H ATOM 1300 N ALA A 148 -21.800 -4.093 -41.066 1.00 54.21 N ATOM 1301 CA ALA A 148 -20.547 -4.824 -40.957 1.00 53.36 C ATOM 1302 C ALA A 148 -19.880 -4.944 -42.322 1.00 51.91 C ATOM 1303 O ALA A 148 -20.545 -5.135 -43.345 1.00 47.64 O ATOM 1304 CB ALA A 148 -20.794 -6.213 -40.367 1.00 51.40 C ATOM 1305 H ALA A 148 -22.688 -4.549 -40.774 1.00 0.00 H ATOM 1306 N VAL A 149 -18.556 -4.828 -42.331 1.00 53.71 N ATOM 1307 CA VAL A 149 -17.752 -4.966 -43.540 1.00 54.33 C ATOM 1308 C VAL A 149 -16.939 -6.247 -43.429 1.00 49.06 C ATOM 1309 O VAL A 149 -16.216 -6.450 -42.445 1.00 47.11 O ATOM 1310 CB VAL A 149 -16.836 -3.749 -43.748 1.00 57.31 C ATOM 1311 CG1 VAL A 149 -15.926 -3.959 -44.952 1.00 57.82 C ATOM 1312 CG2 VAL A 149 -17.671 -2.492 -43.920 1.00 59.39 C ATOM 1313 H VAL A 149 -18.070 -4.629 -41.433 1.00 0.00 H ATOM 1314 N TYR A 150 -17.054 -7.104 -44.438 1.00 48.24 N ATOM 1315 CA TYR A 150 -16.323 -8.360 -44.496 1.00 46.76 C ATOM 1316 C TYR A 150 -15.277 -8.290 -45.600 1.00 46.47 C ATOM 1317 O TYR A 150 -15.557 -7.813 -46.704 1.00 47.99 O ATOM 1318 CB TYR A 150 -17.273 -9.534 -44.747 1.00 44.44 C ATOM 1319 CG TYR A 150 -18.392 -9.650 -43.733 1.00 41.33 C ATOM 1320 CD1 TYR A 150 -19.551 -8.896 -43.858 1.00 39.33 C ATOM 1321 CD2 TYR A 150 -18.292 -10.520 -42.656 1.00 38.82 C ATOM 1322 CE1 TYR A 150 -20.577 -9.003 -42.937 1.00 37.93 C ATOM 1323 CE2 TYR A 150 -19.314 -10.634 -41.729 1.00 36.46 C ATOM 1324 CZ TYR A 150 -20.453 -9.872 -41.875 1.00 37.31 C ATOM 1325 OH TYR A 150 -21.472 -9.979 -40.958 1.00 37.27 O ATOM 1326 HH TYR A 150 -22.208 -9.367 -41.211 1.00 0.00 H ATOM 1327 H TYR A 150 -17.695 -6.866 -45.221 1.00 0.00 H ATOM 1328 N GLY A 151 -14.073 -8.765 -45.298 1.00 44.98 N ATOM 1329 CA GLY A 151 -12.996 -8.746 -46.267 1.00 48.28 C ATOM 1330 C GLY A 151 -11.925 -9.746 -45.891 1.00 53.19 C ATOM 1331 O GLY A 151 -12.023 -10.449 -44.884 1.00 51.38 O ATOM 1332 H GLY A 151 -13.901 -9.157 -44.350 1.00 0.00 H ATOM 1333 N HIS A 152 -10.885 -9.794 -46.723 1.00 64.42 N ATOM 1334 CA HIS A 152 -9.778 -10.719 -46.522 1.00 70.29 C ATOM 1335 C HIS A 152 -8.568 -10.076 -45.858 1.00 76.80 C ATOM 1336 O HIS A 152 -7.718 -10.799 -45.328 1.00 73.09 O ATOM 1337 CB HIS A 152 -9.348 -11.322 -47.864 1.00 69.01 C ATOM 1338 CG HIS A 152 -10.449 -12.037 -48.583 1.00 66.57 C ATOM 1339 ND1 HIS A 152 -10.960 -13.242 -48.152 1.00 64.76 N ATOM 1340 CD2 HIS A 152 -11.137 -11.716 -49.704 1.00 67.06 C ATOM 1341 CE1 HIS A 152 -11.915 -13.633 -48.976 1.00 64.43 C ATOM 1342 NE2 HIS A 152 -12.043 -12.725 -49.927 1.00 65.83 N ATOM 1343 H HIS A 152 -10.863 -9.152 -47.541 1.00 0.00 H ATOM 1344 N ASP A 153 -8.471 -8.749 -45.875 1.00 86.07 N ATOM 1345 CA ASP A 153 -7.366 -8.026 -45.260 1.00 96.50 C ATOM 1346 C ASP A 153 -7.909 -7.141 -44.149 1.00 92.86 C ATOM 1347 O ASP A 153 -8.829 -6.347 -44.376 1.00 96.91 O ATOM 1348 CB ASP A 153 -6.617 -7.181 -46.294 1.00110.61 C ATOM 1349 CG ASP A 153 -5.986 -8.021 -47.386 1.00119.75 C ATOM 1350 OD1 ASP A 153 -6.059 -9.265 -47.299 1.00121.82 O ATOM 1351 OD2 ASP A 153 -5.418 -7.437 -48.333 1.00124.10 O ATOM 1352 H ASP A 153 -9.218 -8.203 -46.349 1.00 0.00 H ATOM 1353 N ALA A 154 -7.337 -7.279 -42.950 1.00 80.83 N ATOM 1354 CA ALA A 154 -7.785 -6.473 -41.819 1.00 71.82 C ATOM 1355 C ALA A 154 -7.642 -4.984 -42.111 1.00 70.11 C ATOM 1356 O ALA A 154 -8.516 -4.186 -41.752 1.00 66.41 O ATOM 1357 CB ALA A 154 -7.000 -6.852 -40.564 1.00 67.11 C ATOM 1358 H ALA A 154 -6.567 -7.966 -42.821 1.00 0.00 H ATOM 1359 N GLU A 155 -6.544 -4.590 -42.761 1.00 79.85 N ATOM 1360 CA GLU A 155 -6.359 -3.185 -43.108 1.00 91.19 C ATOM 1361 C GLU A 155 -7.450 -2.709 -44.058 1.00 88.13 C ATOM 1362 O GLU A 155 -7.958 -1.590 -43.923 1.00 86.96 O ATOM 1363 CB GLU A 155 -4.979 -2.975 -43.730 1.00108.26 C ATOM 1364 CG GLU A 155 -4.647 -1.518 -44.030 1.00126.21 C ATOM 1365 CD GLU A 155 -3.293 -1.352 -44.693 1.00140.15 C ATOM 1366 OE1 GLU A 155 -2.640 -2.378 -44.979 1.00143.75 O ATOM 1367 OE2 GLU A 155 -2.882 -0.196 -44.928 1.00146.19 O ATOM 1368 H GLU A 155 -5.818 -5.288 -43.021 1.00 0.00 H ATOM 1369 N TRP A 156 -7.826 -3.548 -45.026 1.00 86.35 N ATOM 1370 CA TRP A 156 -8.864 -3.164 -45.977 1.00 89.57 C ATOM 1371 C TRP A 156 -10.191 -2.914 -45.272 1.00 91.08 C ATOM 1372 O TRP A 156 -10.898 -1.950 -45.588 1.00 96.66 O ATOM 1373 CB TRP A 156 -9.017 -4.247 -47.045 1.00 89.19 C ATOM 1374 CG TRP A 156 -10.023 -3.912 -48.107 1.00 88.21 C ATOM 1375 CD1 TRP A 156 -9.838 -3.094 -49.184 1.00 89.23 C ATOM 1376 CD2 TRP A 156 -11.370 -4.394 -48.198 1.00 85.26 C ATOM 1377 NE1 TRP A 156 -10.986 -3.034 -49.936 1.00 88.08 N ATOM 1378 CE2 TRP A 156 -11.941 -3.823 -49.352 1.00 85.00 C ATOM 1379 CE3 TRP A 156 -12.148 -5.251 -47.413 1.00 82.33 C ATOM 1380 CZ2 TRP A 156 -13.253 -4.082 -49.741 1.00 82.00 C ATOM 1381 CZ3 TRP A 156 -13.451 -5.506 -47.802 1.00 80.14 C ATOM 1382 CH2 TRP A 156 -13.990 -4.924 -48.955 1.00 80.22 C ATOM 1383 HE1 TRP A 156 -11.110 -2.480 -50.807 1.00 0.00 H ATOM 1384 H TRP A 156 -7.376 -4.482 -45.103 1.00 0.00 H ATOM 1385 N VAL A 157 -10.546 -3.770 -44.310 1.00 84.58 N ATOM 1386 CA VAL A 157 -11.806 -3.606 -43.587 1.00 75.57 C ATOM 1387 C VAL A 157 -11.832 -2.263 -42.868 1.00 73.05 C ATOM 1388 O VAL A 157 -12.773 -1.474 -43.019 1.00 74.76 O ATOM 1389 CB VAL A 157 -12.016 -4.775 -42.607 1.00 69.09 C ATOM 1390 CG1 VAL A 157 -13.208 -4.513 -41.682 1.00 67.14 C ATOM 1391 CG2 VAL A 157 -12.215 -6.077 -43.374 1.00 66.56 C ATOM 1392 H VAL A 157 -9.918 -4.564 -44.072 1.00 0.00 H ATOM 1393 N VAL A 158 -10.801 -1.984 -42.068 1.00 66.61 N ATOM 1394 CA VAL A 158 -10.773 -0.740 -41.306 1.00 68.42 C ATOM 1395 C VAL A 158 -10.744 0.461 -42.241 1.00 74.79 C ATOM 1396 O VAL A 158 -11.214 1.548 -41.883 1.00 74.46 O ATOM 1397 CB VAL A 158 -9.570 -0.731 -40.341 1.00 66.00 C ATOM 1398 CG1 VAL A 158 -9.583 0.527 -39.480 1.00 67.80 C ATOM 1399 CG2 VAL A 158 -9.580 -1.974 -39.462 1.00 62.64 C ATOM 1400 H VAL A 158 -10.013 -2.657 -41.987 1.00 0.00 H ATOM 1401 N SER A 159 -10.202 0.290 -43.449 1.00 86.62 N ATOM 1402 CA SER A 159 -10.124 1.399 -44.395 1.00 96.52 C ATOM 1403 C SER A 159 -11.502 1.834 -44.876 1.00100.45 C ATOM 1404 O SER A 159 -11.708 3.017 -45.169 1.00104.66 O ATOM 1405 CB SER A 159 -9.253 1.009 -45.589 1.00100.43 C ATOM 1406 OG SER A 159 -7.948 0.641 -45.176 1.00101.64 O ATOM 1407 HG SER A 159 -8.004 -0.132 -44.560 1.00 0.00 H ATOM 1408 H SER A 159 -9.831 -0.643 -43.719 1.00 0.00 H ATOM 1409 N ARG A 160 -12.454 0.902 -44.962 1.00 93.73 N ATOM 1410 CA ARG A 160 -13.780 1.216 -45.483 1.00 91.76 C ATOM 1411 C ARG A 160 -14.563 2.173 -44.593 1.00 94.11 C ATOM 1412 O ARG A 160 -15.640 2.622 -45.001 1.00 95.26 O ATOM 1413 CB ARG A 160 -14.593 -0.067 -45.666 1.00 86.97 C ATOM 1414 CG ARG A 160 -13.946 -1.116 -46.556 1.00 86.60 C ATOM 1415 CD ARG A 160 -13.660 -0.590 -47.952 1.00 91.54 C ATOM 1416 NE ARG A 160 -12.302 -0.071 -48.080 1.00 97.76 N ATOM 1417 CZ ARG A 160 -11.745 0.294 -49.230 1.00103.63 C ATOM 1418 NH1 ARG A 160 -12.428 0.200 -50.364 1.00107.18 N ATOM 1419 NH2 ARG A 160 -10.501 0.752 -49.249 1.00104.61 N ATOM 1420 HE ARG A 160 -11.733 0.019 -47.214 1.00 0.00 H ATOM 1421 HH12 ARG A 160 -11.988 0.487 -51.261 1.00 0.00 H ATOM 1422 HH11 ARG A 160 -13.403 -0.161 -50.355 1.00 0.00 H ATOM 1423 HH22 ARG A 160 -10.066 1.037 -50.149 1.00 0.00 H ATOM 1424 HH21 ARG A 160 -9.960 0.826 -48.364 1.00 0.00 H ATOM 1425 H ARG A 160 -12.246 -0.068 -44.651 1.00 0.00 H ATOM 1426 N PHE A 161 -14.065 2.491 -43.399 1.00 96.33 N ATOM 1427 CA PHE A 161 -14.781 3.332 -42.445 1.00 94.88 C ATOM 1428 C PHE A 161 -14.107 4.697 -42.387 1.00 99.60 C ATOM 1429 O PHE A 161 -13.004 4.829 -41.845 1.00105.35 O ATOM 1430 CB PHE A 161 -14.814 2.677 -41.066 1.00 85.23 C ATOM 1431 CG PHE A 161 -15.492 1.340 -41.050 1.00 75.85 C ATOM 1432 CD1 PHE A 161 -16.867 1.249 -40.920 1.00 71.64 C ATOM 1433 CD2 PHE A 161 -14.756 0.173 -41.168 1.00 72.95 C ATOM 1434 CE1 PHE A 161 -17.495 0.018 -40.907 1.00 69.53 C ATOM 1435 CE2 PHE A 161 -15.378 -1.059 -41.155 1.00 70.51 C ATOM 1436 CZ PHE A 161 -16.749 -1.137 -41.026 1.00 69.41 C ATOM 1437 H PHE A 161 -13.128 2.125 -43.136 1.00 0.00 H ATOM 1438 N SER A 162 -14.773 5.709 -42.948 1.00 96.02 N ATOM 1439 CA SER A 162 -14.282 7.076 -42.837 1.00 92.83 C ATOM 1440 C SER A 162 -14.447 7.628 -41.428 1.00 95.39 C ATOM 1441 O SER A 162 -13.799 8.622 -41.085 1.00 93.53 O ATOM 1442 CB SER A 162 -15.010 7.979 -43.833 1.00 87.83 C ATOM 1443 OG SER A 162 -16.404 7.993 -43.582 1.00 84.76 O ATOM 1444 HG SER A 162 -16.851 8.584 -44.239 1.00 0.00 H ATOM 1445 H SER A 162 -15.652 5.519 -43.470 1.00 0.00 H ATOM 1446 N SER A 163 -15.294 7.008 -40.606 1.00 99.82 N ATOM 1447 CA SER A 163 -15.499 7.460 -39.235 1.00 98.44 C ATOM 1448 C SER A 163 -14.336 7.112 -38.316 1.00 97.93 C ATOM 1449 O SER A 163 -14.430 7.369 -37.110 1.00 96.89 O ATOM 1450 CB SER A 163 -16.791 6.859 -38.679 1.00 99.77 C ATOM 1451 OG SER A 163 -17.049 7.327 -37.366 1.00100.10 O ATOM 1452 HG SER A 163 -16.299 7.071 -36.772 1.00 0.00 H ATOM 1453 H SER A 163 -15.822 6.181 -40.951 1.00 0.00 H ATOM 1454 N VAL A 164 -13.256 6.541 -38.843 1.00 91.82 N ATOM 1455 CA VAL A 164 -12.086 6.168 -38.057 1.00 85.56 C ATOM 1456 C VAL A 164 -10.885 6.896 -38.644 1.00 91.65 C ATOM 1457 O VAL A 164 -10.523 6.671 -39.806 1.00 91.84 O ATOM 1458 CB VAL A 164 -11.859 4.647 -38.055 1.00 75.11 C ATOM 1459 CG1 VAL A 164 -10.722 4.274 -37.109 1.00 72.40 C ATOM 1460 CG2 VAL A 164 -13.141 3.914 -37.672 1.00 71.10 C ATOM 1461 H VAL A 164 -13.246 6.351 -39.866 1.00 0.00 H ATOM 1462 N SER A 165 -10.273 7.766 -37.845 1.00 98.20 N ATOM 1463 CA SER A 165 -9.117 8.521 -38.298 1.00102.92 C ATOM 1464 C SER A 165 -7.925 7.589 -38.513 1.00105.43 C ATOM 1465 O SER A 165 -7.964 6.395 -38.201 1.00104.53 O ATOM 1466 CB SER A 165 -8.762 9.612 -37.289 1.00103.19 C ATOM 1467 OG SER A 165 -8.440 9.053 -36.028 1.00101.89 O ATOM 1468 HG SER A 165 -9.217 8.544 -35.686 1.00 0.00 H ATOM 1469 H SER A 165 -10.629 7.908 -36.878 1.00 0.00 H ATOM 1470 N LYS A 166 -6.846 8.157 -39.058 1.00109.31 N ATOM 1471 CA LYS A 166 -5.645 7.368 -39.310 1.00114.59 C ATOM 1472 C LYS A 166 -5.006 6.914 -38.004 1.00112.47 C ATOM 1473 O LYS A 166 -4.631 5.745 -37.858 1.00107.38 O ATOM 1474 CB LYS A 166 -4.650 8.177 -40.141 1.00125.94 C ATOM 1475 CG LYS A 166 -3.423 7.384 -40.576 1.00136.43 C ATOM 1476 CD LYS A 166 -2.430 8.251 -41.334 1.00146.41 C ATOM 1477 CE LYS A 166 -1.268 7.428 -41.871 1.00151.96 C ATOM 1478 NZ LYS A 166 -0.533 6.711 -40.792 1.00153.88 N ATOM 1479 HZ1 LYS A 166 -0.152 7.403 -40.115 1.00 0.00 H ATOM 1480 HZ2 LYS A 166 -1.184 6.066 -40.300 1.00 0.00 H ATOM 1481 HZ3 LYS A 166 0.248 6.166 -41.209 1.00 0.00 H ATOM 1482 H LYS A 166 -6.862 9.167 -39.304 1.00 0.00 H ATOM 1483 N SER A 167 -4.871 7.828 -37.041 1.00119.17 N ATOM 1484 CA SER A 167 -4.283 7.469 -35.754 1.00122.61 C ATOM 1485 C SER A 167 -5.065 6.339 -35.097 1.00115.17 C ATOM 1486 O SER A 167 -4.482 5.359 -34.619 1.00116.50 O ATOM 1487 CB SER A 167 -4.232 8.695 -34.842 1.00129.87 C ATOM 1488 OG SER A 167 -5.523 9.250 -34.655 1.00132.81 O ATOM 1489 HG SER A 167 -5.459 10.040 -34.062 1.00 0.00 H ATOM 1490 H SER A 167 -5.187 8.804 -37.209 1.00 0.00 H ATOM 1491 N GLU A 168 -6.393 6.459 -35.064 1.00104.58 N ATOM 1492 CA GLU A 168 -7.224 5.376 -34.552 1.00 95.47 C ATOM 1493 C GLU A 168 -6.956 4.087 -35.318 1.00 95.41 C ATOM 1494 O GLU A 168 -6.602 3.059 -34.731 1.00 92.91 O ATOM 1495 CB GLU A 168 -8.701 5.762 -34.644 1.00 88.89 C ATOM 1496 CG GLU A 168 -9.093 6.927 -33.754 1.00 84.98 C ATOM 1497 CD GLU A 168 -10.528 7.368 -33.968 1.00 81.52 C ATOM 1498 OE1 GLU A 168 -11.086 7.083 -35.049 1.00 80.58 O ATOM 1499 OE2 GLU A 168 -11.098 7.997 -33.052 1.00 80.27 O ATOM 1500 H GLU A 168 -6.840 7.333 -35.407 1.00 0.00 H ATOM 1501 N ARG A 169 -7.109 4.135 -36.644 1.00101.39 N ATOM 1502 CA ARG A 169 -6.868 2.961 -37.479 1.00107.48 C ATOM 1503 C ARG A 169 -5.538 2.296 -37.143 1.00103.02 C ATOM 1504 O ARG A 169 -5.449 1.064 -37.084 1.00102.41 O ATOM 1505 CB ARG A 169 -6.914 3.366 -38.954 1.00119.44 C ATOM 1506 CG ARG A 169 -6.078 2.498 -39.885 1.00130.55 C ATOM 1507 CD ARG A 169 -6.257 2.921 -41.330 1.00142.11 C ATOM 1508 NE ARG A 169 -5.224 2.357 -42.193 1.00152.53 N ATOM 1509 CZ ARG A 169 -5.087 2.643 -43.484 1.00162.07 C ATOM 1510 NH1 ARG A 169 -5.920 3.491 -44.072 1.00165.67 N ATOM 1511 NH2 ARG A 169 -4.115 2.080 -44.188 1.00165.51 N ATOM 1512 HE ARG A 169 -4.550 1.687 -41.770 1.00 0.00 H ATOM 1513 HH12 ARG A 169 -5.810 3.712 -45.082 1.00 0.00 H ATOM 1514 HH11 ARG A 169 -6.684 3.935 -43.523 1.00 0.00 H ATOM 1515 HH22 ARG A 169 -4.008 2.304 -45.198 1.00 0.00 H ATOM 1516 HH21 ARG A 169 -3.460 1.415 -43.730 1.00 0.00 H ATOM 1517 H ARG A 169 -7.406 5.026 -37.091 1.00 0.00 H ATOM 1518 N ALA A 170 -4.491 3.095 -36.925 1.00 98.37 N ATOM 1519 CA ALA A 170 -3.195 2.528 -36.567 1.00 95.53 C ATOM 1520 C ALA A 170 -3.265 1.797 -35.233 1.00 94.36 C ATOM 1521 O ALA A 170 -2.694 0.711 -35.079 1.00 89.23 O ATOM 1522 CB ALA A 170 -2.136 3.629 -36.521 1.00 94.90 C ATOM 1523 H ALA A 170 -4.599 4.126 -37.011 1.00 0.00 H ATOM 1524 N HIS A 171 -3.963 2.379 -34.254 1.00 99.54 N ATOM 1525 CA HIS A 171 -4.113 1.723 -32.959 1.00102.28 C ATOM 1526 C HIS A 171 -4.835 0.389 -33.099 1.00 97.62 C ATOM 1527 O HIS A 171 -4.521 -0.573 -32.388 1.00 95.90 O ATOM 1528 CB HIS A 171 -4.863 2.642 -31.993 1.00106.93 C ATOM 1529 CG HIS A 171 -5.130 2.026 -30.654 1.00108.78 C ATOM 1530 ND1 HIS A 171 -4.423 0.944 -30.176 1.00109.13 N ATOM 1531 CD2 HIS A 171 -6.031 2.341 -29.693 1.00108.98 C ATOM 1532 CE1 HIS A 171 -4.875 0.619 -28.978 1.00109.13 C ATOM 1533 NE2 HIS A 171 -5.851 1.451 -28.661 1.00109.00 N ATOM 1534 H HIS A 171 -4.403 3.307 -34.416 1.00 0.00 H ATOM 1535 N ILE A 172 -5.805 0.309 -34.012 1.00 93.63 N ATOM 1536 CA ILE A 172 -6.549 -0.933 -34.203 1.00 90.08 C ATOM 1537 C ILE A 172 -5.634 -2.011 -34.772 1.00 93.04 C ATOM 1538 O ILE A 172 -5.491 -3.097 -34.200 1.00 93.12 O ATOM 1539 CB ILE A 172 -7.771 -0.705 -35.112 1.00 84.12 C ATOM 1540 CG1 ILE A 172 -8.561 0.539 -34.688 1.00 80.37 C ATOM 1541 CG2 ILE A 172 -8.678 -1.928 -35.096 1.00 82.23 C ATOM 1542 CD1 ILE A 172 -8.931 0.585 -33.221 1.00 77.36 C ATOM 1543 H ILE A 172 -6.034 1.140 -34.594 1.00 0.00 H ATOM 1544 N LEU A 173 -4.996 -1.720 -35.908 1.00 94.94 N ATOM 1545 CA LEU A 173 -4.164 -2.714 -36.575 1.00 95.67 C ATOM 1546 C LEU A 173 -2.983 -3.153 -35.719 1.00102.23 C ATOM 1547 O LEU A 173 -2.455 -4.250 -35.933 1.00100.50 O ATOM 1548 CB LEU A 173 -3.664 -2.164 -37.911 1.00 91.78 C ATOM 1549 CG LEU A 173 -4.750 -1.808 -38.931 1.00 89.13 C ATOM 1550 CD1 LEU A 173 -4.129 -1.200 -40.179 1.00 90.53 C ATOM 1551 CD2 LEU A 173 -5.586 -3.027 -39.295 1.00 86.05 C ATOM 1552 H LEU A 173 -5.094 -0.771 -36.323 1.00 0.00 H ATOM 1553 N GLN A 174 -2.554 -2.330 -34.760 1.00112.24 N ATOM 1554 CA GLN A 174 -1.476 -2.747 -33.870 1.00123.04 C ATOM 1555 C GLN A 174 -1.885 -3.971 -33.060 1.00120.21 C ATOM 1556 O GLN A 174 -1.103 -4.918 -32.915 1.00120.11 O ATOM 1557 CB GLN A 174 -1.080 -1.595 -32.944 1.00136.24 C ATOM 1558 CG GLN A 174 0.284 -1.770 -32.276 1.00148.30 C ATOM 1559 CD GLN A 174 0.288 -2.845 -31.205 1.00156.51 C ATOM 1560 OE1 GLN A 174 -0.706 -3.048 -30.509 1.00158.83 O ATOM 1561 NE2 GLN A 174 1.408 -3.545 -31.074 1.00159.80 N ATOM 1562 HE22 GLN A 174 2.224 -3.339 -31.684 1.00 0.00 H ATOM 1563 HE21 GLN A 174 1.469 -4.300 -30.361 1.00 0.00 H ATOM 1564 H GLN A 174 -2.988 -1.392 -34.647 1.00 0.00 H ATOM 1565 N HIS A 175 -3.108 -3.971 -32.527 1.00116.71 N ATOM 1566 CA HIS A 175 -3.602 -5.114 -31.771 1.00114.25 C ATOM 1567 C HIS A 175 -4.147 -6.218 -32.667 1.00104.88 C ATOM 1568 O HIS A 175 -4.185 -7.377 -32.242 1.00100.48 O ATOM 1569 CB HIS A 175 -4.691 -4.669 -30.793 1.00121.09 C ATOM 1570 CG HIS A 175 -4.177 -3.851 -29.650 1.00129.44 C ATOM 1571 ND1 HIS A 175 -3.892 -4.394 -28.415 1.00131.89 N ATOM 1572 CD2 HIS A 175 -3.895 -2.530 -29.554 1.00132.56 C ATOM 1573 CE1 HIS A 175 -3.458 -3.442 -27.608 1.00133.27 C ATOM 1574 NE2 HIS A 175 -3.450 -2.302 -28.275 1.00133.09 N ATOM 1575 H HIS A 175 -3.720 -3.140 -32.654 1.00 0.00 H ATOM 1576 N VAL A 176 -4.570 -5.889 -33.887 1.00102.81 N ATOM 1577 CA VAL A 176 -5.059 -6.910 -34.809 1.00102.19 C ATOM 1578 C VAL A 176 -3.893 -7.661 -35.439 1.00106.83 C ATOM 1579 O VAL A 176 -3.904 -8.894 -35.528 1.00105.71 O ATOM 1580 CB VAL A 176 -5.966 -6.272 -35.879 1.00 98.73 C ATOM 1581 CG1 VAL A 176 -6.390 -7.306 -36.919 1.00 97.02 C ATOM 1582 CG2 VAL A 176 -7.191 -5.645 -35.228 1.00 96.95 C ATOM 1583 H VAL A 176 -4.552 -4.893 -34.186 1.00 0.00 H ATOM 1584 N SER A 177 -2.872 -6.929 -35.889 1.00114.62 N ATOM 1585 CA SER A 177 -1.714 -7.565 -36.506 1.00121.17 C ATOM 1586 C SER A 177 -0.951 -8.447 -35.527 1.00120.99 C ATOM 1587 O SER A 177 -0.237 -9.359 -35.960 1.00121.27 O ATOM 1588 CB SER A 177 -0.782 -6.499 -37.082 1.00127.62 C ATOM 1589 OG SER A 177 0.361 -7.089 -37.675 1.00131.29 O ATOM 1590 HG SER A 177 0.855 -7.607 -36.992 1.00 0.00 H ATOM 1591 H SER A 177 -2.903 -5.893 -35.799 1.00 0.00 H ATOM 1592 N SER A 178 -1.085 -8.203 -34.224 1.00118.80 N ATOM 1593 CA SER A 178 -0.376 -8.980 -33.216 1.00117.30 C ATOM 1594 C SER A 178 -1.072 -10.291 -32.873 1.00117.77 C ATOM 1595 O SER A 178 -0.533 -11.067 -32.077 1.00117.25 O ATOM 1596 CB SER A 178 -0.204 -8.149 -31.940 1.00114.40 C ATOM 1597 OG SER A 178 -1.454 -7.910 -31.316 1.00111.75 O ATOM 1598 HG SER A 178 -2.044 -7.416 -31.939 1.00 0.00 H ATOM 1599 H SER A 178 -1.715 -7.434 -33.917 1.00 0.00 H ATOM 1600 N CYS A 179 -2.245 -10.557 -33.444 1.00119.35 N ATOM 1601 CA CYS A 179 -2.994 -11.781 -33.186 1.00118.23 C ATOM 1602 C CYS A 179 -2.896 -12.685 -34.407 1.00117.68 C ATOM 1603 O CYS A 179 -3.268 -12.280 -35.514 1.00117.10 O ATOM 1604 CB CYS A 179 -4.457 -11.473 -32.867 1.00117.07 C ATOM 1605 SG CYS A 179 -4.723 -10.580 -31.318 1.00116.89 S ATOM 1606 H CYS A 179 -2.645 -9.860 -34.104 1.00 0.00 H ATOM 1607 N ARG A 180 -2.397 -13.901 -34.204 1.00115.98 N ATOM 1608 CA ARG A 180 -2.343 -14.903 -35.261 1.00116.04 C ATOM 1609 C ARG A 180 -3.615 -15.741 -35.210 1.00105.91 C ATOM 1610 O ARG A 180 -3.942 -16.321 -34.168 1.00101.22 O ATOM 1611 CB ARG A 180 -1.107 -15.788 -35.116 1.00127.29 C ATOM 1612 CG ARG A 180 0.207 -15.058 -35.343 1.00139.74 C ATOM 1613 CD ARG A 180 1.340 -16.033 -35.621 1.00151.72 C ATOM 1614 NE ARG A 180 2.614 -15.352 -35.834 1.00162.60 N ATOM 1615 CZ ARG A 180 3.734 -15.958 -36.219 1.00170.92 C ATOM 1616 NH1 ARG A 180 3.745 -17.266 -36.442 1.00173.23 N ATOM 1617 NH2 ARG A 180 4.845 -15.254 -36.385 1.00174.53 N ATOM 1618 HE ARG A 180 2.648 -14.325 -35.674 1.00 0.00 H ATOM 1619 HH12 ARG A 180 4.623 -17.735 -36.743 1.00 0.00 H ATOM 1620 HH11 ARG A 180 2.875 -17.822 -36.316 1.00 0.00 H ATOM 1621 HH22 ARG A 180 5.721 -15.728 -36.686 1.00 0.00 H ATOM 1622 HH21 ARG A 180 4.841 -14.228 -36.214 1.00 0.00 H ATOM 1623 H ARG A 180 -2.034 -14.145 -33.261 1.00 0.00 H ATOM 1624 N LEU A 181 -4.329 -15.803 -36.335 1.00104.00 N ATOM 1625 CA LEU A 181 -5.604 -16.508 -36.376 1.00102.75 C ATOM 1626 C LEU A 181 -5.456 -17.995 -36.088 1.00105.85 C ATOM 1627 O LEU A 181 -6.446 -18.648 -35.739 1.00106.13 O ATOM 1628 CB LEU A 181 -6.267 -16.311 -37.741 1.00 99.05 C ATOM 1629 CG LEU A 181 -6.344 -14.873 -38.261 1.00 96.53 C ATOM 1630 CD1 LEU A 181 -7.066 -14.833 -39.598 1.00 95.82 C ATOM 1631 CD2 LEU A 181 -7.026 -13.958 -37.255 1.00 94.78 C ATOM 1632 H LEU A 181 -3.971 -15.342 -37.195 1.00 0.00 H ATOM 1633 N GLU A 182 -4.248 -18.547 -36.225 1.00111.37 N ATOM 1634 CA GLU A 182 -4.052 -19.975 -36.005 1.00115.81 C ATOM 1635 C GLU A 182 -4.069 -20.333 -34.524 1.00109.88 C ATOM 1636 O GLU A 182 -4.475 -21.444 -34.166 1.00108.80 O ATOM 1637 CB GLU A 182 -2.735 -20.429 -36.638 1.00128.01 C ATOM 1638 CG GLU A 182 -1.495 -19.774 -36.045 1.00140.04 C ATOM 1639 CD GLU A 182 -0.215 -20.239 -36.713 1.00150.16 C ATOM 1640 OE1 GLU A 182 -0.302 -20.945 -37.740 1.00153.37 O ATOM 1641 OE2 GLU A 182 0.876 -19.899 -36.210 1.00154.10 O ATOM 1642 H GLU A 182 -3.438 -17.952 -36.492 1.00 0.00 H ATOM 1643 N ASP A 183 -3.640 -19.419 -33.657 1.00104.59 N ATOM 1644 CA ASP A 183 -3.631 -19.671 -32.221 1.00101.09 C ATOM 1645 C ASP A 183 -5.019 -19.601 -31.598 1.00 88.32 C ATOM 1646 O ASP A 183 -5.158 -19.888 -30.404 1.00 83.91 O ATOM 1647 CB ASP A 183 -2.704 -18.672 -31.523 1.00110.00 C ATOM 1648 CG ASP A 183 -1.265 -18.791 -31.985 1.00117.27 C ATOM 1649 OD1 ASP A 183 -0.825 -19.922 -32.283 1.00119.43 O ATOM 1650 OD2 ASP A 183 -0.573 -17.753 -32.053 1.00119.75 O ATOM 1651 H ASP A 183 -3.303 -18.502 -34.013 1.00 0.00 H ATOM 1652 N LEU A 184 -6.039 -19.231 -32.366 1.00 81.14 N ATOM 1653 CA LEU A 184 -7.393 -19.144 -31.843 1.00 75.49 C ATOM 1654 C LEU A 184 -8.034 -20.524 -31.780 1.00 72.60 C ATOM 1655 O LEU A 184 -7.698 -21.428 -32.551 1.00 74.30 O ATOM 1656 CB LEU A 184 -8.244 -18.217 -32.714 1.00 73.97 C ATOM 1657 CG LEU A 184 -7.824 -16.745 -32.732 1.00 74.02 C ATOM 1658 CD1 LEU A 184 -8.563 -15.990 -33.824 1.00 72.65 C ATOM 1659 CD2 LEU A 184 -8.072 -16.098 -31.379 1.00 73.44 C ATOM 1660 H LEU A 184 -5.864 -18.998 -33.364 1.00 0.00 H ATOM 1661 N SER A 185 -8.967 -20.679 -30.846 1.00 68.67 N ATOM 1662 CA SER A 185 -9.676 -21.939 -30.699 1.00 64.11 C ATOM 1663 C SER A 185 -10.630 -22.156 -31.869 1.00 60.83 C ATOM 1664 O SER A 185 -11.034 -21.221 -32.566 1.00 60.19 O ATOM 1665 CB SER A 185 -10.457 -21.967 -29.387 1.00 62.74 C ATOM 1666 OG SER A 185 -9.629 -21.628 -28.292 1.00 62.49 O ATOM 1667 HG SER A 185 -10.161 -21.654 -27.457 1.00 0.00 H ATOM 1668 H SER A 185 -9.193 -19.887 -30.211 1.00 0.00 H ATOM 1669 N THR A 186 -10.996 -23.414 -32.073 1.00 60.20 N ATOM 1670 CA THR A 186 -11.911 -23.765 -33.149 1.00 58.90 C ATOM 1671 C THR A 186 -13.341 -23.448 -32.725 1.00 54.86 C ATOM 1672 O THR A 186 -13.798 -23.967 -31.700 1.00 56.12 O ATOM 1673 CB THR A 186 -11.783 -25.243 -33.497 1.00 62.08 C ATOM 1674 OG1 THR A 186 -10.424 -25.530 -33.852 1.00 62.17 O ATOM 1675 CG2 THR A 186 -12.694 -25.606 -34.666 1.00 64.03 C ATOM 1676 HG1 THR A 186 -10.339 -26.490 -34.078 1.00 0.00 H ATOM 1677 H THR A 186 -10.623 -24.162 -31.454 1.00 0.00 H ATOM 1678 N PRO A 187 -14.075 -22.611 -33.462 1.00 45.91 N ATOM 1679 CA PRO A 187 -15.466 -22.331 -33.085 1.00 42.30 C ATOM 1680 C PRO A 187 -16.334 -23.579 -33.168 1.00 42.60 C ATOM 1681 O PRO A 187 -16.012 -24.548 -33.858 1.00 46.01 O ATOM 1682 CB PRO A 187 -15.908 -21.273 -34.104 1.00 40.43 C ATOM 1683 CG PRO A 187 -14.647 -20.692 -34.638 1.00 41.56 C ATOM 1684 CD PRO A 187 -13.646 -21.797 -34.611 1.00 43.06 C ATOM 1685 N ASN A 188 -17.463 -23.537 -32.457 1.00 42.04 N ATOM 1686 CA ASN A 188 -18.338 -24.693 -32.303 1.00 44.21 C ATOM 1687 C ASN A 188 -19.502 -24.709 -33.289 1.00 49.26 C ATOM 1688 O ASN A 188 -20.397 -25.550 -33.152 1.00 57.05 O ATOM 1689 CB ASN A 188 -18.883 -24.750 -30.873 1.00 44.42 C ATOM 1690 CG ASN A 188 -19.771 -23.560 -30.528 1.00 47.13 C ATOM 1691 OD1 ASN A 188 -20.220 -22.819 -31.406 1.00 44.07 O ATOM 1692 ND2 ASN A 188 -20.031 -23.379 -29.240 1.00 48.68 N ATOM 1693 HD22 ASN A 188 -19.631 -24.028 -28.533 1.00 0.00 H ATOM 1694 HD21 ASN A 188 -20.634 -22.588 -28.937 1.00 0.00 H ATOM 1695 H ASN A 188 -17.729 -22.644 -31.995 1.00 0.00 H ATOM 1696 N PHE A 189 -19.518 -23.808 -34.269 1.00 44.15 N ATOM 1697 CA PHE A 189 -20.627 -23.757 -35.213 1.00 42.48 C ATOM 1698 C PHE A 189 -20.826 -25.107 -35.889 1.00 41.84 C ATOM 1699 O PHE A 189 -19.866 -25.766 -36.301 1.00 40.19 O ATOM 1700 CB PHE A 189 -20.380 -22.680 -36.271 1.00 44.98 C ATOM 1701 CG PHE A 189 -21.402 -22.668 -37.377 1.00 47.71 C ATOM 1702 CD1 PHE A 189 -21.271 -23.500 -38.477 1.00 49.78 C ATOM 1703 CD2 PHE A 189 -22.491 -21.815 -37.318 1.00 50.00 C ATOM 1704 CE1 PHE A 189 -22.209 -23.489 -39.489 1.00 51.10 C ATOM 1705 CE2 PHE A 189 -23.433 -21.799 -38.330 1.00 51.40 C ATOM 1706 CZ PHE A 189 -23.290 -22.636 -39.417 1.00 52.08 C ATOM 1707 H PHE A 189 -18.731 -23.134 -34.362 1.00 0.00 H ATOM 1708 N VAL A 190 -22.087 -25.513 -36.007 1.00 42.01 N ATOM 1709 CA VAL A 190 -22.473 -26.684 -36.782 1.00 45.62 C ATOM 1710 C VAL A 190 -23.615 -26.285 -37.703 1.00 50.56 C ATOM 1711 O VAL A 190 -24.487 -25.497 -37.320 1.00 49.32 O ATOM 1712 CB VAL A 190 -22.886 -27.866 -35.880 1.00 46.22 C ATOM 1713 CG1 VAL A 190 -21.714 -28.300 -35.015 1.00 45.78 C ATOM 1714 CG2 VAL A 190 -24.086 -27.494 -35.018 1.00 45.75 C ATOM 1715 H VAL A 190 -22.831 -24.970 -35.524 1.00 0.00 H ATOM 1716 N SER A 191 -23.604 -26.821 -38.914 1.00 60.08 N ATOM 1717 CA SER A 191 -24.640 -26.494 -39.884 1.00 66.17 C ATOM 1718 C SER A 191 -25.990 -27.003 -39.388 1.00 68.68 C ATOM 1719 O SER A 191 -26.105 -28.180 -39.028 1.00 69.48 O ATOM 1720 CB SER A 191 -24.308 -27.115 -41.237 1.00 70.08 C ATOM 1721 OG SER A 191 -25.305 -26.811 -42.192 1.00 73.96 O ATOM 1722 HG SER A 191 -25.067 -27.225 -43.059 1.00 0.00 H ATOM 1723 H SER A 191 -22.846 -27.484 -39.176 1.00 0.00 H ATOM 1724 N PRO A 192 -27.034 -26.160 -39.350 1.00 70.51 N ATOM 1725 CA PRO A 192 -28.351 -26.648 -38.919 1.00 74.87 C ATOM 1726 C PRO A 192 -29.138 -27.308 -40.042 1.00 83.01 C ATOM 1727 O PRO A 192 -30.362 -27.445 -39.948 1.00 86.97 O ATOM 1728 CB PRO A 192 -29.044 -25.374 -38.424 1.00 73.13 C ATOM 1729 CG PRO A 192 -28.466 -24.299 -39.270 1.00 71.79 C ATOM 1730 CD PRO A 192 -27.034 -24.701 -39.557 1.00 70.89 C ATOM 1731 N LEU A 193 -28.454 -27.719 -41.106 1.00 87.10 N ATOM 1732 CA LEU A 193 -29.113 -28.366 -42.234 1.00 90.29 C ATOM 1733 C LEU A 193 -29.278 -29.863 -41.980 1.00 88.25 C ATOM 1734 O LEU A 193 -28.520 -30.681 -42.501 1.00 87.09 O ATOM 1735 CB LEU A 193 -28.321 -28.134 -43.523 1.00 95.31 C ATOM 1736 CG LEU A 193 -27.967 -26.680 -43.858 1.00 98.40 C ATOM 1737 CD1 LEU A 193 -27.349 -26.598 -45.248 1.00 98.81 C ATOM 1738 CD2 LEU A 193 -29.176 -25.759 -43.750 1.00100.85 C ATOM 1739 H LEU A 193 -27.424 -27.575 -41.134 1.00 0.00 H TER 1740 LEU A 193 HETATM 1741 O HOH 1 -30.156 -15.990 -60.122 1.00 58.57 O HETATM 1742 O HOH 2 -29.724 -9.689 -57.614 1.00 26.40 O HETATM 1743 O HOH 3 -20.511 -19.389 -27.447 1.00 52.73 O HETATM 1744 O HOH 4 -29.671 -21.379 -57.115 1.00 48.36 O HETATM 1745 O HOH 5 -17.534 -24.448 -36.603 1.00 44.58 O HETATM 1746 O HOH 6 -30.860 -9.526 -33.479 1.00 40.20 O HETATM 1747 O HOH 7 -30.692 -22.066 -52.738 1.00 50.12 O HETATM 1748 O HOH 8 -21.854 -15.497 -24.652 1.00 39.50 O HETATM 1749 O HOH 9 -24.440 -15.868 -28.617 1.00 39.67 O HETATM 1750 O HOH 10 -11.447 -8.706 -28.199 1.00 47.98 O HETATM 1751 O HOH 11 -29.454 -8.240 -31.442 1.00 39.32 O HETATM 1752 O HOH 12 -32.585 -7.379 -55.388 1.00 57.32 O HETATM 1753 O HOH 13 -28.014 -5.465 -45.574 1.00 47.28 O HETATM 1754 O HOH 14 -27.118 -11.071 -57.410 1.00 41.22 O HETATM 1755 O HOH 15 -30.527 -14.244 -57.550 1.00 42.33 O HETATM 1756 O HOH 16 -21.229 -13.591 -58.949 1.00 30.11 O HETATM 1757 O HOH 17 -9.701 -20.071 -35.411 1.00 54.30 O HETATM 1758 O HOH 18 -24.490 -5.703 -53.243 1.00 50.49 O HETATM 1759 O HOH 19 -28.113 -15.054 -58.820 1.00 41.10 O HETATM 1760 C10 UNN A 20 -27.564 -16.392 -45.656 1.00 -0.05 C HETATM 1761 C09 UNN A 20 -28.218 -16.434 -44.286 1.00 -0.05 C HETATM 1762 C08 UNN A 20 -27.248 -15.961 -43.211 1.00 -0.03 C HETATM 1763 C13 UNN A 20 -26.011 -16.822 -43.257 1.00 -0.05 C HETATM 1764 C12 UNN A 20 -25.340 -16.623 -44.586 1.00 -0.05 C HETATM 1765 C11 UNN A 20 -26.246 -17.144 -45.667 1.00 -0.05 C HETATM 1766 H16 UNN A 20 -25.759 -17.010 -46.644 1.00 0.03 H HETATM 1767 H17 UNN A 20 -26.437 -18.214 -45.496 1.00 0.03 H HETATM 1768 H18 UNN A 20 -24.387 -17.172 -44.605 1.00 0.03 H HETATM 1769 H19 UNN A 20 -25.149 -15.552 -44.748 1.00 0.03 H HETATM 1770 H3 UNN A 20 -26.290 -17.879 -43.137 1.00 0.03 H HETATM 1771 H4 UNN A 20 -25.325 -16.530 -42.448 1.00 0.03 H HETATM 1772 C07 UNN A 20 -27.836 -16.043 -41.813 1.00 0.00 C HETATM 1773 C04 UNN A 20 -29.351 -15.829 -41.801 1.00 0.03 C HETATM 1774 C03 UNN A 20 -29.919 -14.577 -42.019 1.00 -0.03 C HETATM 1775 C02 UNN A 20 -31.289 -14.430 -41.999 1.00 -0.04 C HETATM 1776 C01 UNN A 20 -32.099 -15.518 -41.761 1.00 -0.02 C HETATM 1777 C06 UNN A 20 -31.523 -16.762 -41.546 1.00 0.12 C HETATM 1778 N05 UNN A 20 -30.160 -16.900 -41.568 1.00 -0.28 N HETATM 1779 C14 UNN A 20 -32.338 -18.024 -41.267 1.00 0.25 C HETATM 1780 O15 UNN A 20 -33.555 -18.042 -41.303 1.00 -0.37 O HETATM 1781 N16 UNN A 20 -31.536 -19.175 -40.953 1.00 -0.23 N HETATM 1782 C17 UNN A 20 -32.053 -20.482 -40.655 1.00 0.09 C HETATM 1783 C22 UNN A 20 -32.993 -21.065 -41.487 1.00 -0.05 C HETATM 1784 C21 UNN A 20 -33.484 -22.337 -41.203 1.00 -0.07 C HETATM 1785 C20 UNN A 20 -33.028 -23.024 -40.092 1.00 -0.02 C HETATM 1786 C19 UNN A 20 -32.083 -22.446 -39.264 1.00 -0.04 C HETATM 1787 C18 UNN A 20 -31.576 -21.181 -39.550 1.00 0.09 C HETATM 1788 N26 UNN A 20 -30.618 -20.616 -38.656 1.00 -0.28 N HETATM 1789 C27 UNN A 20 -29.259 -20.325 -38.976 1.00 0.05 C HETATM 1790 C28 UNN A 20 -28.386 -20.080 -37.922 1.00 -0.05 C HETATM 1791 C29 UNN A 20 -27.056 -19.783 -38.163 1.00 -0.08 C HETATM 1792 C30 UNN A 20 -26.583 -19.726 -39.471 1.00 -0.05 C HETATM 1793 C31 UNN A 20 -27.448 -19.970 -40.529 1.00 0.09 C HETATM 1794 C32 UNN A 20 -28.779 -20.270 -40.284 1.00 -0.01 C HETATM 1795 H25 UNN A 20 -29.450 -20.463 -41.113 1.00 0.04 H HETATM 1796 O33 UNN A 20 -26.958 -19.903 -41.855 1.00 -0.23 O HETATM 1797 C34 UNN A 20 -26.362 -21.089 -42.327 1.00 0.55 C HETATM 1798 F35 UNN A 20 -27.007 -22.155 -41.828 1.00 -0.14 F HETATM 1799 F36 UNN A 20 -26.425 -21.109 -43.660 1.00 -0.14 F HETATM 1800 F37 UNN A 20 -25.079 -21.106 -41.932 1.00 -0.14 F HETATM 1801 H24 UNN A 20 -25.542 -19.492 -39.663 1.00 0.04 H HETATM 1802 H23 UNN A 20 -26.383 -19.595 -37.334 1.00 0.06 H HETATM 1803 H7 UNN A 20 -28.750 -20.122 -36.902 1.00 0.04 H HETATM 1804 H22 UNN A 20 -30.934 -20.400 -37.700 1.00 0.20 H HETATM 1805 H21 UNN A 20 -31.735 -22.981 -38.388 1.00 0.05 H HETATM 1806 C23 UNN A 20 -33.561 -24.413 -39.776 1.00 0.05 C HETATM 1807 O24 UNN A 20 -32.909 -25.435 -40.126 1.00 -0.56 O HETATM 1808 O25 UNN A 20 -34.650 -24.544 -39.164 1.00 -0.56 O HETATM 1809 H5 UNN A 20 -34.224 -22.789 -41.853 1.00 0.05 H HETATM 1810 H6 UNN A 20 -33.348 -20.531 -42.361 1.00 0.05 H HETATM 1811 H20 UNN A 20 -30.543 -19.057 -40.941 1.00 0.22 H HETATM 1812 H8 UNN A 20 -33.177 -15.404 -41.742 1.00 0.07 H HETATM 1813 H9 UNN A 20 -31.730 -13.455 -42.171 1.00 0.07 H HETATM 1814 H10 UNN A 20 -29.284 -13.718 -42.204 1.00 0.07 H HETATM 1815 H11 UNN A 20 -27.617 -17.037 -41.396 1.00 0.05 H HETATM 1816 H12 UNN A 20 -27.366 -15.271 -41.187 1.00 0.05 H HETATM 1817 H13 UNN A 20 -26.976 -14.916 -43.419 1.00 0.03 H HETATM 1818 H14 UNN A 20 -28.527 -17.466 -44.065 1.00 0.03 H HETATM 1819 H15 UNN A 20 -29.102 -15.779 -44.288 1.00 0.03 H HETATM 1820 H1 UNN A 20 -27.379 -15.343 -45.932 1.00 0.03 H HETATM 1821 H2 UNN A 20 -28.243 -16.850 -46.390 1.00 0.03 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 139 140 148 149 150 CONECT 148 139 CONECT 149 139 CONECT 150 139 CONECT 1760 1761 1765 1820 1821 CONECT 1761 1760 1762 1818 1819 CONECT 1762 1761 1763 1772 1817 CONECT 1763 1762 1764 1770 1771 CONECT 1764 1763 1765 1768 1769 CONECT 1765 1760 1764 1766 1767 CONECT 1766 1765 CONECT 1767 1765 CONECT 1768 1764 CONECT 1769 1764 CONECT 1770 1763 CONECT 1771 1763 CONECT 1772 1762 1773 1815 1816 CONECT 1773 1772 1774 1778 CONECT 1774 1773 1775 1814 CONECT 1775 1774 1776 1813 CONECT 1776 1775 1777 1812 CONECT 1777 1776 1778 1779 CONECT 1778 1773 1777 CONECT 1779 1777 1780 1781 CONECT 1780 1779 CONECT 1781 1779 1782 1811 CONECT 1782 1781 1783 1787 CONECT 1783 1782 1784 1810 CONECT 1784 1783 1785 1809 CONECT 1785 1784 1786 1806 CONECT 1786 1785 1787 1805 CONECT 1787 1782 1786 1788 CONECT 1788 1787 1789 1804 CONECT 1789 1788 1790 1794 CONECT 1790 1789 1791 1803 CONECT 1791 1790 1792 1802 CONECT 1792 1791 1793 1801 CONECT 1793 1792 1794 1796 CONECT 1794 1789 1793 1795 CONECT 1795 1794 CONECT 1796 1793 1797 CONECT 1797 1796 1798 1799 1800 CONECT 1798 1797 CONECT 1799 1797 CONECT 1800 1797 CONECT 1801 1792 CONECT 1802 1791 CONECT 1803 1790 CONECT 1804 1788 CONECT 1805 1786 CONECT 1806 1785 1807 1808 CONECT 1807 1806 CONECT 1808 1806 CONECT 1809 1784 CONECT 1810 1783 CONECT 1811 1781 CONECT 1812 1776 CONECT 1813 1775 CONECT 1814 1774 CONECT 1815 1772 CONECT 1816 1772 CONECT 1817 1762 CONECT 1818 1761 CONECT 1819 1761 CONECT 1820 1760 CONECT 1821 1760 MASTER 0 0 0 0 0 0 0 0 1819 2 70 16 END
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Structure:
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Related entries of code: 5v5e
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3njq
RCSB PDB
PDBbind
193aa, >3NJQ_2|Chain... at 100%
4p2t
RCSB PDB
PDBbind
194aa, >4P2T_1|Chains... *
4p3h
RCSB PDB
PDBbind
193aa, >4P3H_1|Chains... at 100%
5v5d
RCSB PDB
PDBbind
193aa, >5V5D_1|Chains... at 100%
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
5v5e
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Kaposi's sarcoma-associated herpesvirus protease
Ligand Name
8N4
EC.Number
E.C.-.-.-.-
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
IC50=3uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Am. Chem. Soc. Vol. 139: pp. 11650-11653
Ligand Properties
Formula
C
2
7
H
2
6
F
3
N
3
O
4
Molecular Weight
513.508
Exact Mass
513.188
No. of atoms
63
No. of bonds
66
Polar Surface Area
100.55
LOGP Value
8.39 (
Computed with XLOGP3
)
6.94 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
Canonical SMILES
O=C(c1cccc(n1)CC1CCCCC1)Nc1ccc(cc1Nc1cccc(c1)OC(F)(F)F)C(=O)O
InChI String
InChI=1S/C27H26F3N3O4/c28-27(29,30)37-21-10-4-8-20(16-21)32-24-15-18(26(35)36)12-13-22(24)33-25(34)23-11-5-9-19(31-23)14-17-6-2-1-3-7-17/h4-5,8-13,15-17,32H,1-3,6-7,14H2,(H,33,34)(H,35,36)
Links to External Databases
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PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O40922
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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