Browse entries in the PDBbind-CN Database
HEADER 5CSD_COMPLEX COMPND 5CSD_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 158 THR LYS VAL LYS ARG ASP ILE SER ALA PHE GLN LYS VAL SEQRES 2 A 158 ILE GLN ASP ILE SER LEU ALA VAL ASN LYS PHE ASN VAL SEQRES 3 A 158 ASP ILE GLU ARG TYR VAL GLY GLY ASP ALA SER HIS LEU SEQRES 4 A 158 LEU ALA ASP GLY ASN VAL LEU ILE LYS ALA THR LEU ASP SEQRES 5 A 158 GLY VAL GLN SER LEU GLN ASN GLU PRO PRO LEU SER SER SEQRES 6 A 158 MET GLU ALA LEU ALA LEU VAL GLY PRO VAL GLN ASP LEU SEQRES 7 A 158 SER ASN GLN ILE LEU LEU ALA ILE GLN ASN LEU ILE ASP SEQRES 8 A 158 LYS LYS GLU PRO LEU VAL GLN ALA GLY PHE GLY GLY LYS SEQRES 9 A 158 VAL GLU ASN ASN LEU ARG GLN GLN GLU GLU ALA ALA GLN SEQRES 10 A 158 LYS LEU SER GLU LEU VAL SER THR LYS VAL PRO HIS GLU SEQRES 11 A 158 LEU ALA ASP ILE SER ARG GLN LEU SER ASP GLY ILE ALA SEQRES 12 A 158 ALA GLY ILE LYS LYS GLY ILE ASP ALA PHE ALA GLY THR SEQRES 13 A 158 GLY PRO HET ACD A 318 53 ATOM 1 N THR A 2 -49.127 4.861 13.452 1.00 39.20 N ATOM 2 CA THR A 2 -48.707 6.077 12.682 1.00 38.80 C ATOM 3 C THR A 2 -48.348 5.684 11.231 1.00 36.90 C ATOM 4 O THR A 2 -47.728 4.624 10.979 1.00 35.48 O ATOM 5 CB THR A 2 -47.529 6.900 13.339 1.00 38.86 C ATOM 6 OG1 THR A 2 -47.332 8.121 12.605 1.00 39.76 O ATOM 7 CG2 THR A 2 -46.198 6.143 13.379 1.00 38.05 C ATOM 8 HG1 THR A 2 -46.594 8.637 13.017 1.00 0.00 H ATOM 9 HN3 THR A 2 -48.346 4.174 13.466 1.00 0.00 H ATOM 10 HN2 THR A 2 -49.959 4.434 12.996 1.00 0.00 H ATOM 11 HN1 THR A 2 -49.366 5.135 14.426 1.00 0.00 H ATOM 12 N LYS A 3 -48.721 6.537 10.283 1.00 35.66 N ATOM 13 CA LYS A 3 -48.312 6.331 8.883 1.00 34.88 C ATOM 14 C LYS A 3 -46.871 6.775 8.642 1.00 33.82 C ATOM 15 O LYS A 3 -46.323 6.473 7.590 1.00 32.94 O ATOM 16 CB LYS A 3 -49.206 7.037 7.858 1.00 35.49 C ATOM 17 CG LYS A 3 -50.687 6.677 7.828 1.00 36.77 C ATOM 18 CD LYS A 3 -51.381 7.555 6.797 1.00 38.55 C ATOM 19 CE LYS A 3 -52.812 7.141 6.527 1.00 40.00 C ATOM 20 NZ LYS A 3 -53.357 7.891 5.356 1.00 41.40 N ATOM 21 HZ1 LYS A 3 -53.330 8.911 5.556 1.00 0.00 H ATOM 22 HZ2 LYS A 3 -52.780 7.686 4.516 1.00 0.00 H ATOM 23 HZ3 LYS A 3 -54.339 7.596 5.184 1.00 0.00 H ATOM 24 H LYS A 3 -49.308 7.359 10.532 1.00 0.00 H ATOM 25 N VAL A 4 -46.237 7.469 9.586 1.00 33.98 N ATOM 26 CA VAL A 4 -44.824 7.869 9.417 1.00 33.78 C ATOM 27 C VAL A 4 -43.996 6.593 9.454 1.00 33.95 C ATOM 28 O VAL A 4 -44.124 5.811 10.392 1.00 34.28 O ATOM 29 CB VAL A 4 -44.335 8.835 10.521 1.00 33.68 C ATOM 30 CG1 VAL A 4 -42.827 9.068 10.417 1.00 32.88 C ATOM 31 CG2 VAL A 4 -45.054 10.176 10.422 1.00 34.48 C ATOM 32 H VAL A 4 -46.744 7.733 10.455 1.00 0.00 H ATOM 33 N LYS A 5 -43.219 6.364 8.399 1.00 34.60 N ATOM 34 CA LYS A 5 -42.359 5.194 8.283 1.00 34.70 C ATOM 35 C LYS A 5 -40.897 5.560 8.549 1.00 34.35 C ATOM 36 O LYS A 5 -40.286 6.294 7.783 1.00 33.91 O ATOM 37 CB LYS A 5 -42.562 4.601 6.881 1.00 36.12 C ATOM 38 CG LYS A 5 -42.157 3.145 6.768 1.00 36.72 C ATOM 39 CD LYS A 5 -42.737 2.521 5.512 1.00 38.56 C ATOM 40 CE LYS A 5 -42.375 1.086 5.341 1.00 38.18 C ATOM 41 NZ LYS A 5 -40.930 0.777 5.463 1.00 38.13 N ATOM 42 HZ1 LYS A 5 -40.402 1.303 4.738 1.00 0.00 H ATOM 43 HZ2 LYS A 5 -40.596 1.055 6.408 1.00 0.00 H ATOM 44 HZ3 LYS A 5 -40.782 -0.244 5.329 1.00 0.00 H ATOM 45 H LYS A 5 -43.226 7.053 7.620 1.00 0.00 H ATOM 46 N ARG A 6 -40.338 5.078 9.667 1.00 33.90 N ATOM 47 CA ARG A 6 -38.902 5.218 9.927 1.00 34.47 C ATOM 48 C ARG A 6 -38.104 4.516 8.833 1.00 33.35 C ATOM 49 O ARG A 6 -38.533 3.482 8.321 1.00 32.29 O ATOM 50 CB ARG A 6 -38.534 4.586 11.260 1.00 34.52 C ATOM 51 CG ARG A 6 -37.113 4.927 11.769 1.00 34.81 C ATOM 52 CD ARG A 6 -36.711 3.897 12.778 1.00 33.87 C ATOM 53 NE ARG A 6 -35.296 3.736 13.091 1.00 32.79 N ATOM 54 CZ ARG A 6 -34.853 3.348 14.291 1.00 31.44 C ATOM 55 NH1 ARG A 6 -35.696 3.171 15.311 1.00 31.34 N ATOM 56 NH2 ARG A 6 -33.559 3.159 14.484 1.00 30.91 N ATOM 57 HE ARG A 6 -34.598 3.932 12.345 1.00 0.00 H ATOM 58 HH12 ARG A 6 -35.334 2.869 16.238 1.00 0.00 H ATOM 59 HH11 ARG A 6 -36.714 3.335 15.178 1.00 0.00 H ATOM 60 HH22 ARG A 6 -33.211 2.857 15.416 1.00 0.00 H ATOM 61 HH21 ARG A 6 -32.889 3.312 13.703 1.00 0.00 H ATOM 62 H ARG A 6 -40.936 4.594 10.366 1.00 0.00 H ATOM 63 N ASP A 7 -36.952 5.104 8.502 1.00 33.72 N ATOM 64 CA ASP A 7 -35.998 4.490 7.616 1.00 33.58 C ATOM 65 C ASP A 7 -35.300 3.429 8.506 1.00 30.81 C ATOM 66 O ASP A 7 -34.425 3.745 9.332 1.00 30.67 O ATOM 67 CB ASP A 7 -34.984 5.492 7.072 1.00 34.66 C ATOM 68 CG ASP A 7 -34.014 4.857 6.095 1.00 36.17 C ATOM 69 OD1 ASP A 7 -34.169 3.658 5.777 1.00 36.59 O ATOM 70 OD2 ASP A 7 -33.083 5.542 5.644 1.00 37.86 O ATOM 71 H ASP A 7 -36.736 6.041 8.899 1.00 0.00 H ATOM 72 N ILE A 8 -35.801 2.208 8.391 1.00 30.19 N ATOM 73 CA ILE A 8 -35.204 1.020 9.020 1.00 28.45 C ATOM 74 C ILE A 8 -34.367 0.214 8.029 1.00 27.59 C ATOM 75 O ILE A 8 -34.058 -0.954 8.319 1.00 25.66 O ATOM 76 CB ILE A 8 -36.291 0.128 9.671 1.00 28.58 C ATOM 77 CG1 ILE A 8 -37.297 -0.376 8.628 1.00 29.03 C ATOM 78 CG2 ILE A 8 -36.977 0.879 10.819 1.00 28.69 C ATOM 79 CD1 ILE A 8 -38.179 -1.493 9.110 1.00 29.41 C ATOM 80 H ILE A 8 -36.664 2.083 7.825 1.00 0.00 H ATOM 81 N SER A 9 -33.950 0.815 6.906 1.00 27.54 N ATOM 82 CA SER A 9 -33.151 0.122 5.893 1.00 27.89 C ATOM 83 C SER A 9 -31.860 -0.450 6.469 1.00 25.55 C ATOM 84 O SER A 9 -31.448 -1.510 6.026 1.00 25.17 O ATOM 85 CB SER A 9 -32.839 1.029 4.685 1.00 29.20 C ATOM 86 OG SER A 9 -32.011 2.121 5.067 1.00 30.23 O ATOM 87 HG SER A 9 -32.474 2.659 5.757 1.00 0.00 H ATOM 88 H SER A 9 -34.203 1.811 6.748 1.00 0.00 H ATOM 89 N ALA A 10 -31.260 0.185 7.483 1.00 23.65 N ATOM 90 CA ALA A 10 -30.032 -0.367 8.053 1.00 22.42 C ATOM 91 C ALA A 10 -30.282 -1.738 8.659 1.00 20.49 C ATOM 92 O ALA A 10 -29.460 -2.661 8.515 1.00 19.73 O ATOM 93 CB ALA A 10 -29.448 0.544 9.115 1.00 22.39 C ATOM 94 H ALA A 10 -31.664 1.065 7.863 1.00 0.00 H ATOM 95 N PHE A 11 -31.415 -1.896 9.321 1.00 19.36 N ATOM 96 CA PHE A 11 -31.780 -3.194 9.937 1.00 18.43 C ATOM 97 C PHE A 11 -32.088 -4.207 8.870 1.00 18.53 C ATOM 98 O PHE A 11 -31.637 -5.351 8.945 1.00 16.88 O ATOM 99 CB PHE A 11 -32.982 -3.045 10.883 1.00 18.34 C ATOM 100 CG PHE A 11 -32.669 -2.266 12.140 1.00 17.98 C ATOM 101 CD1 PHE A 11 -32.822 -0.869 12.192 1.00 18.88 C ATOM 102 CD2 PHE A 11 -32.255 -2.939 13.286 1.00 17.96 C ATOM 103 CE1 PHE A 11 -32.498 -0.199 13.369 1.00 18.78 C ATOM 104 CE2 PHE A 11 -31.956 -2.271 14.458 1.00 17.91 C ATOM 105 CZ PHE A 11 -32.084 -0.900 14.494 1.00 18.32 C ATOM 106 H PHE A 11 -32.066 -1.090 9.412 1.00 0.00 H ATOM 107 N GLN A 12 -32.866 -3.806 7.872 1.00 20.06 N ATOM 108 CA GLN A 12 -33.175 -4.682 6.740 1.00 21.05 C ATOM 109 C GLN A 12 -31.935 -5.176 6.012 1.00 20.08 C ATOM 110 O GLN A 12 -31.865 -6.353 5.637 1.00 18.66 O ATOM 111 CB GLN A 12 -34.097 -3.980 5.737 1.00 23.45 C ATOM 112 CG GLN A 12 -35.491 -3.759 6.290 1.00 25.47 C ATOM 113 CD GLN A 12 -36.315 -2.774 5.478 1.00 27.73 C ATOM 114 OE1 GLN A 12 -35.831 -1.717 5.088 1.00 29.48 O ATOM 115 NE2 GLN A 12 -37.576 -3.108 5.245 1.00 29.83 N ATOM 116 HE22 GLN A 12 -37.947 -4.015 5.594 1.00 0.00 H ATOM 117 HE21 GLN A 12 -38.195 -2.463 4.713 1.00 0.00 H ATOM 118 H GLN A 12 -33.266 -2.846 7.895 1.00 0.00 H ATOM 119 N LYS A 13 -30.967 -4.293 5.824 1.00 20.12 N ATOM 120 CA LYS A 13 -29.734 -4.643 5.129 1.00 20.41 C ATOM 121 C LYS A 13 -28.954 -5.665 5.894 1.00 18.43 C ATOM 122 O LYS A 13 -28.420 -6.611 5.318 1.00 17.50 O ATOM 123 CB LYS A 13 -28.887 -3.388 4.913 1.00 22.37 C ATOM 124 CG LYS A 13 -27.543 -3.591 4.256 1.00 24.63 C ATOM 125 CD LYS A 13 -27.675 -4.142 2.856 1.00 27.03 C ATOM 126 CE LYS A 13 -26.374 -3.857 2.135 1.00 29.24 C ATOM 127 NZ LYS A 13 -26.328 -4.243 0.711 1.00 31.52 N ATOM 128 HZ1 LYS A 13 -26.489 -5.267 0.625 1.00 0.00 H ATOM 129 HZ2 LYS A 13 -27.067 -3.730 0.190 1.00 0.00 H ATOM 130 HZ3 LYS A 13 -25.395 -4.004 0.318 1.00 0.00 H ATOM 131 H LYS A 13 -31.089 -3.324 6.181 1.00 0.00 H ATOM 132 N VAL A 14 -28.872 -5.512 7.208 1.00 17.05 N ATOM 133 CA VAL A 14 -28.154 -6.491 8.020 1.00 16.03 C ATOM 134 C VAL A 14 -28.819 -7.864 7.943 1.00 15.69 C ATOM 135 O VAL A 14 -28.134 -8.880 7.763 1.00 14.99 O ATOM 136 CB VAL A 14 -28.013 -6.001 9.481 1.00 15.66 C ATOM 137 CG1 VAL A 14 -27.456 -7.097 10.387 1.00 15.34 C ATOM 138 CG2 VAL A 14 -27.098 -4.780 9.541 1.00 15.71 C ATOM 139 H VAL A 14 -29.321 -4.691 7.663 1.00 0.00 H ATOM 140 N ILE A 15 -30.144 -7.901 8.064 1.00 15.97 N ATOM 141 CA ILE A 15 -30.856 -9.136 7.961 1.00 16.41 C ATOM 142 C ILE A 15 -30.599 -9.759 6.594 1.00 16.30 C ATOM 143 O ILE A 15 -30.274 -10.939 6.534 1.00 15.73 O ATOM 144 CB ILE A 15 -32.364 -8.935 8.180 1.00 17.58 C ATOM 145 CG1 ILE A 15 -32.628 -8.533 9.627 1.00 18.15 C ATOM 146 CG2 ILE A 15 -33.114 -10.226 7.907 1.00 17.62 C ATOM 147 CD1 ILE A 15 -34.027 -7.982 9.852 1.00 19.46 C ATOM 148 H ILE A 15 -30.668 -7.019 8.236 1.00 0.00 H ATOM 149 N GLN A 16 -30.685 -8.983 5.521 1.00 16.94 N ATOM 150 CA GLN A 16 -30.467 -9.499 4.177 1.00 17.72 C ATOM 151 C GLN A 16 -29.035 -10.039 3.995 1.00 16.45 C ATOM 152 O GLN A 16 -28.845 -11.120 3.429 1.00 15.76 O ATOM 153 CB GLN A 16 -30.773 -8.467 3.093 1.00 20.21 C ATOM 154 CG GLN A 16 -30.613 -9.088 1.696 1.00 23.64 C ATOM 155 CD GLN A 16 -31.442 -8.460 0.634 1.00 27.01 C ATOM 156 OE1 GLN A 16 -32.652 -8.447 0.781 1.00 31.23 O ATOM 157 NE2 GLN A 16 -30.854 -8.082 -0.490 1.00 29.41 N ATOM 158 HE22 GLN A 16 -29.817 -8.110 -0.570 1.00 0.00 H ATOM 159 HE21 GLN A 16 -31.429 -7.757 -1.294 1.00 0.00 H ATOM 160 H GLN A 16 -30.915 -7.976 5.644 1.00 0.00 H ATOM 161 N ASP A 17 -28.040 -9.294 4.457 1.00 15.62 N ATOM 162 CA ASP A 17 -26.635 -9.712 4.297 1.00 15.72 C ATOM 163 C ASP A 17 -26.369 -11.015 5.032 1.00 13.64 C ATOM 164 O ASP A 17 -25.703 -11.916 4.512 1.00 13.10 O ATOM 165 CB ASP A 17 -25.643 -8.666 4.827 1.00 17.35 C ATOM 166 CG ASP A 17 -25.585 -7.434 4.006 1.00 21.00 C ATOM 167 OD1 ASP A 17 -26.123 -7.410 2.885 1.00 24.38 O ATOM 168 OD2 ASP A 17 -24.962 -6.476 4.509 1.00 24.50 O ATOM 169 H ASP A 17 -28.254 -8.399 4.941 1.00 0.00 H ATOM 170 N ILE A 18 -26.867 -11.127 6.268 1.00 12.43 N ATOM 171 CA ILE A 18 -26.703 -12.340 7.030 1.00 11.97 C ATOM 172 C ILE A 18 -27.484 -13.485 6.388 1.00 11.69 C ATOM 173 O ILE A 18 -26.958 -14.582 6.257 1.00 10.74 O ATOM 174 CB ILE A 18 -27.091 -12.128 8.510 1.00 12.15 C ATOM 175 CG1 ILE A 18 -26.126 -11.107 9.151 1.00 12.25 C ATOM 176 CG2 ILE A 18 -27.022 -13.450 9.251 1.00 12.22 C ATOM 177 CD1 ILE A 18 -26.459 -10.683 10.558 1.00 12.62 C ATOM 178 H ILE A 18 -27.381 -10.326 6.687 1.00 0.00 H ATOM 179 N SER A 19 -28.707 -13.214 5.967 1.00 12.15 N ATOM 180 CA SER A 19 -29.521 -14.196 5.260 1.00 12.36 C ATOM 181 C SER A 19 -28.818 -14.765 4.041 1.00 12.42 C ATOM 182 O SER A 19 -28.786 -15.981 3.834 1.00 11.91 O ATOM 183 CB SER A 19 -30.873 -13.549 4.813 1.00 13.08 C ATOM 184 OG SER A 19 -31.685 -13.395 5.956 1.00 13.48 O ATOM 185 HG SER A 19 -31.226 -12.810 6.609 1.00 0.00 H ATOM 186 H SER A 19 -29.102 -12.269 6.146 1.00 0.00 H ATOM 187 N LEU A 20 -28.264 -13.893 3.218 1.00 12.73 N ATOM 188 CA LEU A 20 -27.571 -14.356 2.015 1.00 13.28 C ATOM 189 C LEU A 20 -26.429 -15.265 2.394 1.00 12.18 C ATOM 190 O LEU A 20 -26.235 -16.305 1.763 1.00 11.85 O ATOM 191 CB LEU A 20 -26.990 -13.199 1.233 1.00 14.90 C ATOM 192 CG LEU A 20 -26.410 -13.529 -0.116 1.00 16.52 C ATOM 193 CD1 LEU A 20 -27.430 -14.171 -1.042 1.00 17.77 C ATOM 194 CD2 LEU A 20 -25.807 -12.286 -0.744 1.00 17.74 C ATOM 195 H LEU A 20 -28.320 -12.875 3.425 1.00 0.00 H ATOM 196 N ALA A 21 -25.674 -14.929 3.438 1.00 11.41 N ATOM 197 CA ALA A 21 -24.531 -15.742 3.815 1.00 11.02 C ATOM 198 C ALA A 21 -24.972 -17.073 4.367 1.00 10.80 C ATOM 199 O ALA A 21 -24.353 -18.092 4.068 1.00 10.04 O ATOM 200 CB ALA A 21 -23.681 -14.967 4.835 1.00 11.16 C ATOM 201 H ALA A 21 -25.905 -14.077 3.988 1.00 0.00 H ATOM 202 N VAL A 22 -26.009 -17.082 5.207 1.00 10.91 N ATOM 203 CA VAL A 22 -26.488 -18.325 5.800 1.00 10.86 C ATOM 204 C VAL A 22 -27.068 -19.225 4.723 1.00 11.13 C ATOM 205 O VAL A 22 -26.831 -20.447 4.707 1.00 10.82 O ATOM 206 CB VAL A 22 -27.604 -18.032 6.865 1.00 10.90 C ATOM 207 CG1 VAL A 22 -28.329 -19.310 7.309 1.00 10.71 C ATOM 208 CG2 VAL A 22 -27.004 -17.360 8.069 1.00 11.08 C ATOM 209 H VAL A 22 -26.484 -16.187 5.443 1.00 0.00 H ATOM 210 N ASN A 23 -27.840 -18.623 3.823 1.00 11.81 N ATOM 211 CA ASN A 23 -28.464 -19.436 2.739 1.00 12.59 C ATOM 212 C ASN A 23 -27.398 -20.045 1.834 1.00 11.91 C ATOM 213 O ASN A 23 -27.484 -21.217 1.467 1.00 11.61 O ATOM 214 CB ASN A 23 -29.488 -18.624 1.960 1.00 14.52 C ATOM 215 CG ASN A 23 -30.875 -18.581 2.756 1.00 16.40 C ATOM 216 OD1 ASN A 23 -31.132 -17.765 3.609 1.00 19.81 O ATOM 217 ND2 ASN A 23 -31.714 -19.575 2.502 1.00 18.41 N ATOM 218 HD22 ASN A 23 -31.485 -20.273 1.766 1.00 0.00 H ATOM 219 HD21 ASN A 23 -32.601 -19.657 3.039 1.00 0.00 H ATOM 220 H ASN A 23 -28.007 -17.598 3.874 1.00 0.00 H ATOM 221 N LYS A 24 -26.361 -19.286 1.470 1.00 11.74 N ATOM 222 CA LYS A 24 -25.293 -19.834 0.663 1.00 12.30 C ATOM 223 C LYS A 24 -24.618 -21.007 1.392 1.00 11.00 C ATOM 224 O LYS A 24 -24.292 -22.053 0.766 1.00 10.48 O ATOM 225 CB LYS A 24 -24.248 -18.760 0.334 1.00 14.12 C ATOM 226 CG LYS A 24 -23.089 -19.204 -0.512 1.00 16.60 C ATOM 227 CD LYS A 24 -23.403 -19.979 -1.775 1.00 19.00 C ATOM 228 CE LYS A 24 -22.052 -20.414 -2.521 1.00 21.41 C ATOM 229 NZ LYS A 24 -22.103 -20.642 -3.991 1.00 24.83 N ATOM 230 HZ1 LYS A 24 -22.782 -21.402 -4.199 1.00 0.00 H ATOM 231 HZ2 LYS A 24 -22.403 -19.767 -4.466 1.00 0.00 H ATOM 232 HZ3 LYS A 24 -21.159 -20.916 -4.331 1.00 0.00 H ATOM 233 H LYS A 24 -26.321 -18.291 1.770 1.00 0.00 H ATOM 234 N PHE A 25 -24.327 -20.841 2.695 1.00 9.99 N ATOM 235 CA PHE A 25 -23.768 -21.938 3.436 1.00 9.80 C ATOM 236 C PHE A 25 -24.668 -23.168 3.386 1.00 9.23 C ATOM 237 O PHE A 25 -24.195 -24.250 3.168 1.00 9.38 O ATOM 238 CB PHE A 25 -23.557 -21.547 4.904 1.00 10.20 C ATOM 239 CG PHE A 25 -23.099 -22.750 5.697 1.00 11.02 C ATOM 240 CD1 PHE A 25 -21.791 -23.243 5.598 1.00 11.42 C ATOM 241 CD2 PHE A 25 -24.006 -23.474 6.438 1.00 11.76 C ATOM 242 CE1 PHE A 25 -21.437 -24.402 6.294 1.00 11.89 C ATOM 243 CE2 PHE A 25 -23.654 -24.609 7.150 1.00 12.21 C ATOM 244 CZ PHE A 25 -22.362 -25.084 7.049 1.00 12.12 C ATOM 245 H PHE A 25 -24.505 -19.928 3.161 1.00 0.00 H ATOM 246 N ASN A 26 -25.977 -22.962 3.567 1.00 9.14 N ATOM 247 CA ASN A 26 -26.942 -24.092 3.538 1.00 9.28 C ATOM 248 C ASN A 26 -26.986 -24.764 2.168 1.00 9.17 C ATOM 249 O ASN A 26 -27.026 -25.997 2.099 1.00 9.03 O ATOM 250 CB ASN A 26 -28.338 -23.649 3.983 1.00 9.76 C ATOM 251 CG ASN A 26 -28.513 -23.670 5.476 1.00 10.52 C ATOM 252 OD1 ASN A 26 -27.924 -24.511 6.133 1.00 11.21 O ATOM 253 ND2 ASN A 26 -29.297 -22.758 5.989 1.00 11.21 N ATOM 254 HD22 ASN A 26 -29.769 -22.070 5.369 1.00 0.00 H ATOM 255 HD21 ASN A 26 -29.448 -22.721 7.017 1.00 0.00 H ATOM 256 H ASN A 26 -26.325 -21.996 3.731 1.00 0.00 H ATOM 257 N VAL A 27 -26.873 -24.023 1.085 1.00 9.04 N ATOM 258 CA VAL A 27 -26.832 -24.597 -0.232 1.00 9.20 C ATOM 259 C VAL A 27 -25.633 -25.564 -0.310 1.00 8.89 C ATOM 260 O VAL A 27 -25.726 -26.695 -0.798 1.00 9.29 O ATOM 261 CB VAL A 27 -26.751 -23.531 -1.359 1.00 9.41 C ATOM 262 CG1 VAL A 27 -26.472 -24.190 -2.684 1.00 9.76 C ATOM 263 CG2 VAL A 27 -28.061 -22.747 -1.414 1.00 9.68 C ATOM 264 H VAL A 27 -26.811 -22.990 1.186 1.00 0.00 H ATOM 265 N ASP A 28 -24.464 -25.081 0.094 1.00 8.81 N ATOM 266 CA ASP A 28 -23.259 -25.875 -0.044 1.00 9.12 C ATOM 267 C ASP A 28 -23.199 -27.020 0.928 1.00 8.92 C ATOM 268 O ASP A 28 -22.778 -28.128 0.537 1.00 8.75 O ATOM 269 CB ASP A 28 -22.037 -24.964 0.135 1.00 9.26 C ATOM 270 CG ASP A 28 -21.775 -24.067 -1.043 1.00 10.33 C ATOM 271 OD1 ASP A 28 -22.258 -24.325 -2.161 1.00 11.47 O ATOM 272 OD2 ASP A 28 -21.093 -23.028 -0.877 1.00 11.52 O ATOM 273 H ASP A 28 -24.413 -24.130 0.511 1.00 0.00 H ATOM 274 N ILE A 29 -23.630 -26.842 2.170 1.00 8.74 N ATOM 275 CA ILE A 29 -23.569 -27.965 3.110 1.00 9.10 C ATOM 276 C ILE A 29 -24.491 -29.067 2.731 1.00 9.26 C ATOM 277 O ILE A 29 -24.124 -30.234 2.849 1.00 9.47 O ATOM 278 CB ILE A 29 -23.783 -27.537 4.548 1.00 9.29 C ATOM 279 CG1 ILE A 29 -23.331 -28.631 5.537 1.00 9.61 C ATOM 280 CG2 ILE A 29 -25.151 -27.049 4.839 1.00 9.66 C ATOM 281 CD1 ILE A 29 -21.837 -28.900 5.560 1.00 10.16 C ATOM 282 H ILE A 29 -24.005 -25.920 2.472 1.00 0.00 H ATOM 283 N GLU A 30 -25.687 -28.730 2.249 1.00 9.52 N ATOM 284 CA GLU A 30 -26.678 -29.765 1.928 1.00 9.75 C ATOM 285 C GLU A 30 -26.257 -30.626 0.788 1.00 10.35 C ATOM 286 O GLU A 30 -26.579 -31.826 0.804 1.00 11.68 O ATOM 287 CB GLU A 30 -28.062 -29.121 1.689 1.00 9.75 C ATOM 288 CG GLU A 30 -28.697 -28.609 2.961 1.00 9.82 C ATOM 289 CD GLU A 30 -30.013 -27.865 2.719 1.00 10.11 C ATOM 290 OE1 GLU A 30 -30.488 -27.867 1.527 1.00 10.18 O ATOM 291 OE2 GLU A 30 -30.513 -27.253 3.629 1.00 11.00 O ATOM 292 H GLU A 30 -25.920 -27.728 2.099 1.00 0.00 H ATOM 293 N ARG A 31 -25.478 -30.094 -0.149 1.00 10.20 N ATOM 294 CA ARG A 31 -24.945 -30.889 -1.263 1.00 10.68 C ATOM 295 C ARG A 31 -23.555 -31.474 -1.021 1.00 10.43 C ATOM 296 O ARG A 31 -23.044 -32.229 -1.834 1.00 11.01 O ATOM 297 CB ARG A 31 -25.048 -30.126 -2.589 1.00 11.47 C ATOM 298 CG ARG A 31 -24.116 -28.927 -2.714 1.00 12.07 C ATOM 299 CD ARG A 31 -24.580 -28.043 -3.831 1.00 13.31 C ATOM 300 NE ARG A 31 -24.535 -28.695 -5.121 1.00 14.71 N ATOM 301 CZ ARG A 31 -23.517 -28.687 -5.980 1.00 15.61 C ATOM 302 NH1 ARG A 31 -22.386 -28.012 -5.744 1.00 16.29 N ATOM 303 NH2 ARG A 31 -23.644 -29.359 -7.111 1.00 17.02 N ATOM 304 HE ARG A 31 -25.384 -29.224 -5.407 1.00 0.00 H ATOM 305 HH12 ARG A 31 -21.614 -28.031 -6.441 1.00 0.00 H ATOM 306 HH11 ARG A 31 -22.279 -27.468 -4.864 1.00 0.00 H ATOM 307 HH22 ARG A 31 -22.865 -29.370 -7.800 1.00 0.00 H ATOM 308 HH21 ARG A 31 -24.523 -29.877 -7.312 1.00 0.00 H ATOM 309 H ARG A 31 -25.239 -29.084 -0.091 1.00 0.00 H ATOM 310 N TYR A 32 -22.951 -31.136 0.097 1.00 9.72 N ATOM 311 CA TYR A 32 -21.619 -31.670 0.460 1.00 9.29 C ATOM 312 C TYR A 32 -21.788 -33.095 0.893 1.00 9.61 C ATOM 313 O TYR A 32 -22.576 -33.375 1.781 1.00 9.98 O ATOM 314 CB TYR A 32 -21.024 -30.820 1.625 1.00 8.97 C ATOM 315 CG TYR A 32 -19.691 -31.369 2.098 1.00 8.64 C ATOM 316 CD1 TYR A 32 -18.534 -31.232 1.352 1.00 8.65 C ATOM 317 CD2 TYR A 32 -19.602 -31.992 3.353 1.00 8.57 C ATOM 318 CE1 TYR A 32 -17.302 -31.730 1.815 1.00 8.80 C ATOM 319 CE2 TYR A 32 -18.394 -32.469 3.810 1.00 8.76 C ATOM 320 CZ TYR A 32 -17.265 -32.325 3.048 1.00 8.90 C ATOM 321 OH TYR A 32 -16.064 -32.835 3.551 1.00 9.52 O ATOM 322 HH TYR A 32 -15.336 -32.663 2.902 1.00 0.00 H ATOM 323 H TYR A 32 -23.423 -30.474 0.745 1.00 0.00 H ATOM 324 N VAL A 33 -20.959 -33.979 0.352 1.00 9.72 N ATOM 325 CA VAL A 33 -20.967 -35.419 0.734 1.00 10.27 C ATOM 326 C VAL A 33 -19.598 -35.927 1.079 1.00 10.26 C ATOM 327 O VAL A 33 -19.438 -37.133 1.271 1.00 11.36 O ATOM 328 CB VAL A 33 -21.622 -36.301 -0.349 1.00 10.82 C ATOM 329 CG1 VAL A 33 -23.081 -35.884 -0.528 1.00 11.30 C ATOM 330 CG2 VAL A 33 -20.833 -36.266 -1.647 1.00 10.99 C ATOM 331 H VAL A 33 -20.279 -33.655 -0.365 1.00 0.00 H ATOM 332 N GLY A 34 -18.593 -35.055 1.119 1.00 9.94 N ATOM 333 CA GLY A 34 -17.211 -35.454 1.366 1.00 10.26 C ATOM 334 C GLY A 34 -16.242 -34.763 0.469 1.00 10.44 C ATOM 335 O GLY A 34 -16.594 -34.209 -0.571 1.00 10.72 O ATOM 336 H GLY A 34 -18.801 -34.047 0.968 1.00 0.00 H ATOM 337 N GLY A 35 -14.995 -34.833 0.875 1.00 10.62 N ATOM 338 CA GLY A 35 -13.917 -34.133 0.183 1.00 10.99 C ATOM 339 C GLY A 35 -13.590 -32.804 0.787 1.00 11.07 C ATOM 340 O GLY A 35 -13.981 -32.463 1.919 1.00 10.56 O ATOM 341 H GLY A 35 -14.769 -35.404 1.714 1.00 0.00 H ATOM 342 N ASP A 36 -12.766 -32.089 0.036 1.00 11.83 N ATOM 343 CA ASP A 36 -12.293 -30.787 0.513 1.00 12.22 C ATOM 344 C ASP A 36 -13.459 -29.881 0.894 1.00 11.54 C ATOM 345 O ASP A 36 -14.449 -29.804 0.169 1.00 11.47 O ATOM 346 CB ASP A 36 -11.420 -30.115 -0.529 1.00 13.60 C ATOM 347 CG ASP A 36 -10.657 -28.934 0.045 1.00 15.25 C ATOM 348 OD1 ASP A 36 -11.250 -27.906 0.094 1.00 16.28 O ATOM 349 OD2 ASP A 36 -9.500 -29.083 0.515 1.00 18.32 O ATOM 350 H ASP A 36 -12.456 -32.450 -0.889 1.00 0.00 H ATOM 351 N ALA A 37 -13.317 -29.269 2.069 1.00 10.94 N ATOM 352 CA ALA A 37 -14.363 -28.414 2.626 1.00 10.53 C ATOM 353 C ALA A 37 -13.962 -26.938 2.747 1.00 10.58 C ATOM 354 O ALA A 37 -14.617 -26.204 3.471 1.00 10.22 O ATOM 355 CB ALA A 37 -14.816 -28.948 3.980 1.00 10.60 C ATOM 356 H ALA A 37 -12.436 -29.404 2.605 1.00 0.00 H ATOM 357 N SER A 38 -12.929 -26.552 1.988 1.00 11.26 N ATOM 358 CA SER A 38 -12.456 -25.168 2.057 1.00 11.87 C ATOM 359 C SER A 38 -13.547 -24.189 1.679 1.00 11.16 C ATOM 360 O SER A 38 -13.640 -23.086 2.237 1.00 11.14 O ATOM 361 CB SER A 38 -11.265 -24.925 1.148 1.00 13.20 C ATOM 362 OG SER A 38 -10.205 -25.807 1.464 1.00 15.70 O ATOM 363 HG SER A 38 -10.510 -26.742 1.349 1.00 0.00 H ATOM 364 H SER A 38 -12.465 -27.232 1.352 1.00 0.00 H ATOM 365 N HIS A 39 -14.408 -24.577 0.744 1.00 10.83 N ATOM 366 CA HIS A 39 -15.498 -23.711 0.320 1.00 10.67 C ATOM 367 C HIS A 39 -16.523 -23.485 1.422 1.00 10.02 C ATOM 368 O HIS A 39 -17.183 -22.429 1.502 1.00 10.01 O ATOM 369 CB HIS A 39 -16.179 -24.242 -0.954 1.00 10.88 C ATOM 370 CG HIS A 39 -16.856 -25.567 -0.781 1.00 10.68 C ATOM 371 ND1 HIS A 39 -16.165 -26.720 -0.489 1.00 10.94 N ATOM 372 CD2 HIS A 39 -18.159 -25.927 -0.891 1.00 10.82 C ATOM 373 CE1 HIS A 39 -17.013 -27.734 -0.413 1.00 10.86 C ATOM 374 NE2 HIS A 39 -18.222 -27.284 -0.675 1.00 11.08 N ATOM 375 H HIS A 39 -14.301 -25.515 0.308 1.00 0.00 H ATOM 376 N LEU A 40 -16.709 -24.494 2.263 1.00 9.60 N ATOM 377 CA LEU A 40 -17.591 -24.379 3.428 1.00 9.41 C ATOM 378 C LEU A 40 -17.042 -23.431 4.489 1.00 9.57 C ATOM 379 O LEU A 40 -17.789 -22.628 5.068 1.00 9.42 O ATOM 380 CB LEU A 40 -17.906 -25.755 4.047 1.00 9.58 C ATOM 381 CG LEU A 40 -18.670 -26.716 3.139 1.00 9.89 C ATOM 382 CD1 LEU A 40 -18.779 -28.077 3.758 1.00 10.37 C ATOM 383 CD2 LEU A 40 -20.036 -26.253 2.731 1.00 10.06 C ATOM 384 H LEU A 40 -16.215 -25.393 2.091 1.00 0.00 H ATOM 385 N LEU A 41 -15.726 -23.482 4.694 1.00 9.55 N ATOM 386 CA LEU A 41 -15.067 -22.562 5.613 1.00 9.93 C ATOM 387 C LEU A 41 -15.167 -21.140 5.058 1.00 9.53 C ATOM 388 O LEU A 41 -15.479 -20.208 5.810 1.00 9.46 O ATOM 389 CB LEU A 41 -13.623 -22.923 5.803 1.00 10.73 C ATOM 390 CG LEU A 41 -13.315 -24.218 6.530 1.00 11.43 C ATOM 391 CD1 LEU A 41 -11.801 -24.473 6.485 1.00 12.48 C ATOM 392 CD2 LEU A 41 -13.836 -24.180 7.950 1.00 11.83 C ATOM 393 H LEU A 41 -15.158 -24.192 4.189 1.00 0.00 H ATOM 394 N ALA A 42 -14.994 -21.011 3.746 1.00 9.58 N ATOM 395 CA ALA A 42 -15.168 -19.682 3.130 1.00 9.67 C ATOM 396 C ALA A 42 -16.575 -19.152 3.319 1.00 9.28 C ATOM 397 O ALA A 42 -16.759 -17.985 3.664 1.00 9.53 O ATOM 398 CB ALA A 42 -14.792 -19.731 1.657 1.00 10.14 C ATOM 399 H ALA A 42 -14.740 -21.834 3.163 1.00 0.00 H ATOM 400 N ASP A 43 -17.598 -20.017 3.176 1.00 8.87 N ATOM 401 CA ASP A 43 -18.972 -19.627 3.405 1.00 8.86 C ATOM 402 C ASP A 43 -19.125 -19.183 4.877 1.00 8.56 C ATOM 403 O ASP A 43 -19.792 -18.195 5.155 1.00 8.70 O ATOM 404 CB ASP A 43 -19.959 -20.792 3.143 1.00 9.19 C ATOM 405 CG ASP A 43 -20.058 -21.172 1.709 1.00 9.87 C ATOM 406 OD1 ASP A 43 -19.695 -20.457 0.814 1.00 11.14 O ATOM 407 OD2 ASP A 43 -20.577 -22.342 1.511 1.00 10.21 O ATOM 408 H ASP A 43 -17.393 -20.996 2.892 1.00 0.00 H ATOM 409 N GLY A 44 -18.556 -19.936 5.819 1.00 8.67 N ATOM 410 CA GLY A 44 -18.558 -19.558 7.228 1.00 8.81 C ATOM 411 C GLY A 44 -17.945 -18.185 7.460 1.00 9.31 C ATOM 412 O GLY A 44 -18.463 -17.389 8.227 1.00 9.30 O ATOM 413 H GLY A 44 -18.094 -20.825 5.539 1.00 0.00 H ATOM 414 N ASN A 45 -16.820 -17.944 6.806 1.00 9.85 N ATOM 415 CA ASN A 45 -16.162 -16.631 6.921 1.00 10.65 C ATOM 416 C ASN A 45 -17.034 -15.520 6.389 1.00 10.01 C ATOM 417 O ASN A 45 -17.068 -14.412 6.993 1.00 9.62 O ATOM 418 CB ASN A 45 -14.862 -16.611 6.228 1.00 12.23 C ATOM 419 CG ASN A 45 -13.887 -17.536 6.839 1.00 13.96 C ATOM 420 OD1 ASN A 45 -14.047 -17.889 8.008 1.00 16.93 O ATOM 421 ND2 ASN A 45 -12.900 -17.961 6.062 1.00 15.61 N ATOM 422 HD22 ASN A 45 -12.826 -17.620 5.082 1.00 0.00 H ATOM 423 HD21 ASN A 45 -12.200 -18.635 6.432 1.00 0.00 H ATOM 424 H ASN A 45 -16.399 -18.684 6.209 1.00 0.00 H ATOM 425 N VAL A 46 -17.757 -15.722 5.288 1.00 9.70 N ATOM 426 CA VAL A 46 -18.664 -14.684 4.793 1.00 10.03 C ATOM 427 C VAL A 46 -19.730 -14.374 5.859 1.00 9.76 C ATOM 428 O VAL A 46 -20.109 -13.245 6.101 1.00 9.78 O ATOM 429 CB VAL A 46 -19.289 -15.093 3.428 1.00 10.46 C ATOM 430 CG1 VAL A 46 -20.354 -14.098 2.994 1.00 10.86 C ATOM 431 CG2 VAL A 46 -18.210 -15.189 2.373 1.00 10.98 C ATOM 432 H VAL A 46 -17.677 -16.624 4.776 1.00 0.00 H ATOM 433 N LEU A 47 -20.221 -15.409 6.510 1.00 9.32 N ATOM 434 CA LEU A 47 -21.234 -15.266 7.529 1.00 9.83 C ATOM 435 C LEU A 47 -20.704 -14.509 8.746 1.00 9.80 C ATOM 436 O LEU A 47 -21.387 -13.610 9.252 1.00 9.89 O ATOM 437 CB LEU A 47 -21.781 -16.630 7.906 1.00 10.06 C ATOM 438 CG LEU A 47 -22.837 -16.700 8.996 1.00 10.61 C ATOM 439 CD1 LEU A 47 -24.023 -15.796 8.780 1.00 10.84 C ATOM 440 CD2 LEU A 47 -23.330 -18.132 9.194 1.00 11.01 C ATOM 441 H LEU A 47 -19.867 -16.360 6.282 1.00 0.00 H ATOM 442 N ILE A 48 -19.504 -14.831 9.194 1.00 9.66 N ATOM 443 CA ILE A 48 -18.898 -14.077 10.325 1.00 10.01 C ATOM 444 C ILE A 48 -18.750 -12.629 9.918 1.00 10.43 C ATOM 445 O ILE A 48 -19.067 -11.743 10.735 1.00 10.59 O ATOM 446 CB ILE A 48 -17.543 -14.671 10.725 1.00 10.20 C ATOM 447 CG1 ILE A 48 -17.747 -16.065 11.319 1.00 10.22 C ATOM 448 CG2 ILE A 48 -16.795 -13.766 11.718 1.00 10.53 C ATOM 449 CD1 ILE A 48 -16.516 -16.946 11.278 1.00 10.58 C ATOM 450 H ILE A 48 -18.980 -15.615 8.755 1.00 0.00 H ATOM 451 N LYS A 49 -18.253 -12.351 8.723 1.00 10.58 N ATOM 452 CA LYS A 49 -18.057 -10.948 8.297 1.00 11.36 C ATOM 453 C LYS A 49 -19.378 -10.222 8.236 1.00 11.25 C ATOM 454 O LYS A 49 -19.460 -9.055 8.634 1.00 11.38 O ATOM 455 CB LYS A 49 -17.334 -10.896 6.996 1.00 12.26 C ATOM 456 CG LYS A 49 -15.868 -11.300 7.123 1.00 13.16 C ATOM 457 CD LYS A 49 -15.159 -11.184 5.770 1.00 14.74 C ATOM 458 CE LYS A 49 -15.660 -12.192 4.726 1.00 15.99 C ATOM 459 NZ LYS A 49 -14.724 -12.138 3.586 1.00 18.35 N ATOM 460 HZ1 LYS A 49 -14.715 -11.176 3.192 1.00 0.00 H ATOM 461 HZ2 LYS A 49 -13.769 -12.390 3.911 1.00 0.00 H ATOM 462 HZ3 LYS A 49 -15.031 -12.810 2.854 1.00 0.00 H ATOM 463 H LYS A 49 -17.998 -13.126 8.078 1.00 0.00 H ATOM 464 N ALA A 50 -20.458 -10.850 7.771 1.00 10.95 N ATOM 465 CA ALA A 50 -21.765 -10.201 7.738 1.00 11.53 C ATOM 466 C ALA A 50 -22.261 -9.887 9.148 1.00 11.70 C ATOM 467 O ALA A 50 -22.917 -8.870 9.392 1.00 12.03 O ATOM 468 CB ALA A 50 -22.770 -11.078 6.998 1.00 11.59 C ATOM 469 H ALA A 50 -20.367 -11.826 7.423 1.00 0.00 H ATOM 470 N THR A 51 -22.004 -10.788 10.066 1.00 11.59 N ATOM 471 CA THR A 51 -22.402 -10.612 11.460 1.00 12.34 C ATOM 472 C THR A 51 -21.663 -9.436 12.101 1.00 12.88 C ATOM 473 O THR A 51 -22.326 -8.555 12.728 1.00 13.52 O ATOM 474 CB THR A 51 -22.224 -11.915 12.222 1.00 12.55 C ATOM 475 OG1 THR A 51 -22.954 -12.966 11.551 1.00 12.81 O ATOM 476 CG2 THR A 51 -22.736 -11.836 13.647 1.00 12.48 C ATOM 477 HG1 THR A 51 -22.607 -13.071 10.630 1.00 0.00 H ATOM 478 H THR A 51 -21.500 -11.656 9.792 1.00 0.00 H ATOM 479 N LEU A 52 -20.355 -9.365 11.891 1.00 13.03 N ATOM 480 CA LEU A 52 -19.553 -8.282 12.423 1.00 14.22 C ATOM 481 C LEU A 52 -19.932 -6.983 11.764 1.00 14.01 C ATOM 482 O LEU A 52 -19.961 -5.932 12.429 1.00 13.72 O ATOM 483 CB LEU A 52 -18.087 -8.582 12.273 1.00 15.20 C ATOM 484 CG LEU A 52 -17.680 -9.797 13.135 1.00 16.10 C ATOM 485 CD1 LEU A 52 -16.241 -10.145 12.888 1.00 17.11 C ATOM 486 CD2 LEU A 52 -17.932 -9.612 14.638 1.00 16.51 C ATOM 487 H LEU A 52 -19.892 -10.108 11.329 1.00 0.00 H ATOM 488 N ASP A 53 -20.251 -7.003 10.474 1.00 14.46 N ATOM 489 CA ASP A 53 -20.685 -5.813 9.790 1.00 15.84 C ATOM 490 C ASP A 53 -21.990 -5.318 10.390 1.00 15.05 C ATOM 491 O ASP A 53 -22.205 -4.105 10.514 1.00 14.42 O ATOM 492 CB ASP A 53 -20.892 -6.072 8.309 1.00 18.04 C ATOM 493 CG ASP A 53 -20.738 -4.841 7.478 1.00 21.78 C ATOM 494 OD1 ASP A 53 -19.677 -4.158 7.564 1.00 24.76 O ATOM 495 OD2 ASP A 53 -21.744 -4.512 6.772 1.00 25.78 O ATOM 496 H ASP A 53 -20.186 -7.897 9.947 1.00 0.00 H ATOM 497 N GLY A 54 -22.856 -6.213 10.835 1.00 13.64 N ATOM 498 CA GLY A 54 -24.120 -5.770 11.451 1.00 14.25 C ATOM 499 C GLY A 54 -23.925 -5.043 12.753 1.00 14.12 C ATOM 500 O GLY A 54 -24.619 -4.068 13.085 1.00 14.13 O ATOM 501 H GLY A 54 -22.646 -7.228 10.751 1.00 0.00 H ATOM 502 N VAL A 55 -22.926 -5.453 13.510 1.00 14.23 N ATOM 503 CA VAL A 55 -22.606 -4.775 14.755 1.00 15.29 C ATOM 504 C VAL A 55 -22.167 -3.337 14.397 1.00 15.33 C ATOM 505 O VAL A 55 -22.627 -2.368 15.014 1.00 15.48 O ATOM 506 CB VAL A 55 -21.510 -5.546 15.557 1.00 15.82 C ATOM 507 CG1 VAL A 55 -21.095 -4.719 16.768 1.00 16.80 C ATOM 508 CG2 VAL A 55 -21.965 -6.953 15.955 1.00 16.26 C ATOM 509 H VAL A 55 -22.359 -6.273 13.212 1.00 0.00 H ATOM 510 N GLN A 56 -21.307 -3.171 13.379 1.00 14.59 N ATOM 511 CA GLN A 56 -20.817 -1.863 12.996 1.00 15.56 C ATOM 512 C GLN A 56 -21.919 -0.970 12.414 1.00 16.30 C ATOM 513 O GLN A 56 -21.942 0.247 12.692 1.00 17.36 O ATOM 514 CB GLN A 56 -19.656 -1.968 12.003 1.00 15.75 C ATOM 515 CG GLN A 56 -18.440 -2.780 12.389 1.00 15.54 C ATOM 516 CD GLN A 56 -17.633 -3.192 11.120 1.00 15.66 C ATOM 517 OE1 GLN A 56 -17.552 -2.432 10.150 1.00 16.42 O ATOM 518 NE2 GLN A 56 -17.087 -4.379 11.116 1.00 16.77 N ATOM 519 HE22 GLN A 56 -17.174 -4.994 11.950 1.00 0.00 H ATOM 520 HE21 GLN A 56 -16.565 -4.709 10.279 1.00 0.00 H ATOM 521 H GLN A 56 -20.983 -4.006 12.850 1.00 0.00 H ATOM 522 N SER A 57 -22.844 -1.538 11.648 1.00 16.54 N ATOM 523 CA SER A 57 -23.932 -0.804 11.007 1.00 17.65 C ATOM 524 C SER A 57 -24.991 -0.356 11.980 1.00 16.82 C ATOM 525 O SER A 57 -25.570 0.733 11.809 1.00 17.62 O ATOM 526 CB SER A 57 -24.631 -1.651 9.933 1.00 18.83 C ATOM 527 OG SER A 57 -23.731 -2.025 8.903 1.00 21.03 O ATOM 528 HG SER A 57 -23.366 -1.211 8.474 1.00 0.00 H ATOM 529 H SER A 57 -22.790 -2.565 11.496 1.00 0.00 H ATOM 530 N LEU A 58 -25.248 -1.144 13.017 1.00 15.98 N ATOM 531 CA LEU A 58 -26.386 -0.867 13.883 1.00 15.99 C ATOM 532 C LEU A 58 -26.059 -0.200 15.187 1.00 16.66 C ATOM 533 O LEU A 58 -27.001 0.278 15.840 1.00 16.46 O ATOM 534 CB LEU A 58 -27.182 -2.145 14.146 1.00 15.50 C ATOM 535 CG LEU A 58 -27.715 -2.851 12.915 1.00 15.54 C ATOM 536 CD1 LEU A 58 -28.398 -4.145 13.292 1.00 15.66 C ATOM 537 CD2 LEU A 58 -28.685 -1.960 12.131 1.00 16.22 C ATOM 538 H LEU A 58 -24.635 -1.961 13.212 1.00 0.00 H ATOM 539 N GLN A 59 -24.760 -0.099 15.510 1.00 17.77 N ATOM 540 CA GLN A 59 -24.303 0.408 16.807 1.00 20.15 C ATOM 541 C GLN A 59 -25.006 1.687 17.202 1.00 20.89 C ATOM 542 O GLN A 59 -25.520 1.809 18.326 1.00 21.79 O ATOM 543 CB GLN A 59 -22.785 0.627 16.789 1.00 21.78 C ATOM 544 CG GLN A 59 -22.159 0.888 18.147 1.00 23.74 C ATOM 545 CD GLN A 59 -22.062 -0.332 19.029 1.00 25.33 C ATOM 546 OE1 GLN A 59 -21.678 -1.448 18.601 1.00 26.72 O ATOM 547 NE2 GLN A 59 -22.474 -0.151 20.278 1.00 27.99 N ATOM 548 HE22 GLN A 59 -22.784 0.791 20.592 1.00 0.00 H ATOM 549 HE21 GLN A 59 -22.487 -0.951 20.942 1.00 0.00 H ATOM 550 H GLN A 59 -24.048 -0.393 14.811 1.00 0.00 H ATOM 551 N ASN A 60 -25.087 2.624 16.270 1.00 21.89 N ATOM 552 CA ASN A 60 -25.587 3.958 16.598 1.00 23.23 C ATOM 553 C ASN A 60 -27.039 4.228 16.193 1.00 23.28 C ATOM 554 O ASN A 60 -27.527 5.341 16.312 1.00 24.51 O ATOM 555 CB ASN A 60 -24.589 4.983 16.056 1.00 24.74 C ATOM 556 CG ASN A 60 -23.190 4.769 16.662 1.00 26.50 C ATOM 557 OD1 ASN A 60 -23.041 4.600 17.899 1.00 27.61 O ATOM 558 ND2 ASN A 60 -22.178 4.661 15.814 1.00 27.15 N ATOM 559 HD22 ASN A 60 -22.335 4.807 14.796 1.00 0.00 H ATOM 560 HD21 ASN A 60 -21.227 4.430 16.166 1.00 0.00 H ATOM 561 H ASN A 60 -24.792 2.409 15.296 1.00 0.00 H ATOM 562 N GLU A 61 -27.767 3.184 15.803 1.00 22.37 N ATOM 563 CA GLU A 61 -29.169 3.329 15.439 1.00 23.12 C ATOM 564 C GLU A 61 -29.993 3.480 16.649 1.00 23.23 C ATOM 565 O GLU A 61 -29.782 2.769 17.593 1.00 22.14 O ATOM 566 CB GLU A 61 -29.723 2.073 14.818 1.00 23.80 C ATOM 567 CG GLU A 61 -29.310 1.917 13.400 1.00 25.29 C ATOM 568 CD GLU A 61 -30.064 2.842 12.454 1.00 27.74 C ATOM 569 OE1 GLU A 61 -31.209 3.291 12.770 1.00 30.21 O ATOM 570 OE2 GLU A 61 -29.485 3.083 11.376 1.00 30.51 O ATOM 571 H GLU A 61 -27.324 2.244 15.757 1.00 0.00 H ATOM 572 N PRO A 62 -30.980 4.375 16.621 1.00 23.40 N ATOM 573 CA PRO A 62 -31.839 4.432 17.795 1.00 23.68 C ATOM 574 C PRO A 62 -32.656 3.153 17.991 1.00 23.19 C ATOM 575 O PRO A 62 -32.882 2.424 17.046 1.00 22.32 O ATOM 576 CB PRO A 62 -32.743 5.654 17.551 1.00 24.86 C ATOM 577 CG PRO A 62 -32.280 6.288 16.288 1.00 25.02 C ATOM 578 CD PRO A 62 -31.266 5.421 15.628 1.00 24.21 C ATOM 579 N PRO A 63 -33.094 2.885 19.215 1.00 24.29 N ATOM 580 CA PRO A 63 -33.991 1.742 19.409 1.00 24.55 C ATOM 581 C PRO A 63 -35.253 1.732 18.535 1.00 24.34 C ATOM 582 O PRO A 63 -35.757 2.784 18.121 1.00 23.56 O ATOM 583 CB PRO A 63 -34.400 1.837 20.882 1.00 25.75 C ATOM 584 CG PRO A 63 -33.828 3.083 21.430 1.00 27.03 C ATOM 585 CD PRO A 63 -33.132 3.841 20.338 1.00 26.27 C ATOM 586 N LEU A 64 -35.730 0.537 18.241 1.00 23.70 N ATOM 587 CA LEU A 64 -36.913 0.329 17.434 1.00 24.53 C ATOM 588 C LEU A 64 -38.138 0.518 18.300 1.00 25.30 C ATOM 589 O LEU A 64 -38.175 0.076 19.438 1.00 23.93 O ATOM 590 CB LEU A 64 -36.912 -1.089 16.866 1.00 24.75 C ATOM 591 CG LEU A 64 -35.765 -1.456 15.922 1.00 25.61 C ATOM 592 CD1 LEU A 64 -35.611 -2.960 15.789 1.00 25.36 C ATOM 593 CD2 LEU A 64 -35.939 -0.830 14.549 1.00 26.48 C ATOM 594 H LEU A 64 -35.230 -0.298 18.608 1.00 0.00 H ATOM 595 N SER A 65 -39.140 1.180 17.745 1.00 26.11 N ATOM 596 CA SER A 65 -40.461 1.188 18.337 1.00 27.54 C ATOM 597 C SER A 65 -41.090 -0.190 18.162 1.00 27.72 C ATOM 598 O SER A 65 -40.664 -0.973 17.319 1.00 25.14 O ATOM 599 CB SER A 65 -41.327 2.254 17.648 1.00 28.65 C ATOM 600 OG SER A 65 -41.624 1.885 16.299 1.00 30.37 O ATOM 601 HG SER A 65 -40.780 1.786 15.792 1.00 0.00 H ATOM 602 H SER A 65 -38.975 1.707 16.863 1.00 0.00 H ATOM 603 N SER A 66 -42.170 -0.444 18.906 1.00 29.44 N ATOM 604 CA SER A 66 -42.956 -1.661 18.673 1.00 31.00 C ATOM 605 C SER A 66 -43.437 -1.787 17.230 1.00 31.50 C ATOM 606 O SER A 66 -43.352 -2.845 16.652 1.00 28.82 O ATOM 607 CB SER A 66 -44.152 -1.763 19.604 1.00 33.60 C ATOM 608 OG SER A 66 -43.848 -2.584 20.705 1.00 35.65 O ATOM 609 HG SER A 66 -43.084 -2.198 21.202 1.00 0.00 H ATOM 610 H SER A 66 -42.454 0.222 19.652 1.00 0.00 H ATOM 611 N MET A 67 -43.939 -0.705 16.642 1.00 33.41 N ATOM 612 CA MET A 67 -44.361 -0.780 15.231 1.00 36.57 C ATOM 613 C MET A 67 -43.226 -1.095 14.273 1.00 36.53 C ATOM 614 O MET A 67 -43.387 -1.909 13.374 1.00 37.74 O ATOM 615 CB MET A 67 -45.051 0.489 14.775 1.00 39.40 C ATOM 616 CG MET A 67 -46.055 0.348 13.630 1.00 41.49 C ATOM 617 SD MET A 67 -46.888 1.908 13.160 1.00 45.56 S ATOM 618 CE MET A 67 -47.122 2.811 14.709 1.00 44.77 C ATOM 619 H MET A 67 -44.033 0.185 17.172 1.00 0.00 H ATOM 620 N GLU A 68 -42.068 -0.461 14.466 1.00 36.02 N ATOM 621 CA GLU A 68 -40.901 -0.760 13.617 1.00 36.08 C ATOM 622 C GLU A 68 -40.414 -2.186 13.785 1.00 34.01 C ATOM 623 O GLU A 68 -40.115 -2.917 12.798 1.00 36.34 O ATOM 624 CB GLU A 68 -39.764 0.211 13.924 1.00 36.87 C ATOM 625 CG GLU A 68 -40.088 1.634 13.493 1.00 39.20 C ATOM 626 CD GLU A 68 -39.380 2.706 14.295 1.00 40.05 C ATOM 627 OE1 GLU A 68 -39.754 3.890 14.146 1.00 42.69 O ATOM 628 OE2 GLU A 68 -38.433 2.389 15.048 1.00 40.45 O ATOM 629 H GLU A 68 -41.988 0.250 15.221 1.00 0.00 H ATOM 630 N ALA A 69 -40.321 -2.609 15.039 1.00 31.91 N ATOM 631 CA ALA A 69 -39.919 -3.976 15.334 1.00 28.95 C ATOM 632 C ALA A 69 -40.910 -4.952 14.717 1.00 28.92 C ATOM 633 O ALA A 69 -40.525 -5.992 14.221 1.00 27.60 O ATOM 634 CB ALA A 69 -39.775 -4.214 16.831 1.00 28.17 C ATOM 635 H ALA A 69 -40.538 -1.957 15.819 1.00 0.00 H ATOM 636 N LEU A 70 -42.201 -4.641 14.755 1.00 29.11 N ATOM 637 CA LEU A 70 -43.168 -5.602 14.209 1.00 30.05 C ATOM 638 C LEU A 70 -42.945 -5.997 12.743 1.00 29.31 C ATOM 639 O LEU A 70 -43.153 -7.152 12.396 1.00 30.11 O ATOM 640 CB LEU A 70 -44.600 -5.121 14.465 1.00 31.66 C ATOM 641 CG LEU A 70 -45.251 -5.568 15.784 1.00 32.91 C ATOM 642 CD1 LEU A 70 -46.737 -5.219 15.776 1.00 34.18 C ATOM 643 CD2 LEU A 70 -45.091 -7.050 16.035 1.00 32.82 C ATOM 644 H LEU A 70 -42.519 -3.738 15.162 1.00 0.00 H ATOM 645 N ALA A 71 -42.512 -5.051 11.918 1.00 28.68 N ATOM 646 CA ALA A 71 -42.214 -5.307 10.510 1.00 29.10 C ATOM 647 C ALA A 71 -40.978 -6.200 10.324 1.00 28.07 C ATOM 648 O ALA A 71 -40.852 -6.879 9.317 1.00 27.87 O ATOM 649 CB ALA A 71 -41.980 -4.001 9.794 1.00 29.94 C ATOM 650 H ALA A 71 -42.379 -4.088 12.289 1.00 0.00 H ATOM 651 N LEU A 72 -40.094 -6.204 11.304 1.00 26.66 N ATOM 652 CA LEU A 72 -38.892 -7.035 11.229 1.00 25.28 C ATOM 653 C LEU A 72 -39.053 -8.410 11.848 1.00 24.93 C ATOM 654 O LEU A 72 -38.187 -9.259 11.665 1.00 23.16 O ATOM 655 CB LEU A 72 -37.727 -6.297 11.882 1.00 24.94 C ATOM 656 CG LEU A 72 -37.356 -4.957 11.238 1.00 25.31 C ATOM 657 CD1 LEU A 72 -36.400 -4.184 12.121 1.00 24.80 C ATOM 658 CD2 LEU A 72 -36.772 -5.133 9.849 1.00 25.59 C ATOM 659 H LEU A 72 -40.254 -5.608 12.141 1.00 0.00 H ATOM 660 N VAL A 73 -40.150 -8.660 12.561 1.00 25.15 N ATOM 661 CA VAL A 73 -40.351 -9.916 13.273 1.00 25.96 C ATOM 662 C VAL A 73 -40.289 -11.151 12.374 1.00 26.09 C ATOM 663 O VAL A 73 -39.584 -12.117 12.699 1.00 24.86 O ATOM 664 CB VAL A 73 -41.713 -9.881 14.005 1.00 27.61 C ATOM 665 CG1 VAL A 73 -42.194 -11.266 14.374 1.00 29.09 C ATOM 666 CG2 VAL A 73 -41.589 -9.029 15.241 1.00 27.75 C ATOM 667 H VAL A 73 -40.891 -7.932 12.612 1.00 0.00 H ATOM 668 N GLY A 74 -41.040 -11.109 11.271 1.00 25.75 N ATOM 669 CA GLY A 74 -41.075 -12.217 10.327 1.00 26.12 C ATOM 670 C GLY A 74 -39.705 -12.488 9.730 1.00 25.32 C ATOM 671 O GLY A 74 -39.232 -13.614 9.829 1.00 25.37 O ATOM 672 H GLY A 74 -41.615 -10.263 11.081 1.00 0.00 H ATOM 673 N PRO A 75 -39.054 -11.452 9.158 1.00 24.92 N ATOM 674 CA PRO A 75 -37.684 -11.573 8.656 1.00 24.06 C ATOM 675 C PRO A 75 -36.697 -12.152 9.669 1.00 22.68 C ATOM 676 O PRO A 75 -35.890 -13.027 9.314 1.00 21.18 O ATOM 677 CB PRO A 75 -37.327 -10.138 8.305 1.00 24.55 C ATOM 678 CG PRO A 75 -38.645 -9.583 7.802 1.00 25.51 C ATOM 679 CD PRO A 75 -39.646 -10.153 8.765 1.00 25.60 C ATOM 680 N VAL A 76 -36.764 -11.718 10.921 1.00 21.63 N ATOM 681 CA VAL A 76 -35.888 -12.243 11.985 1.00 21.20 C ATOM 682 C VAL A 76 -36.193 -13.696 12.307 1.00 20.36 C ATOM 683 O VAL A 76 -35.293 -14.516 12.492 1.00 18.99 O ATOM 684 CB VAL A 76 -35.912 -11.378 13.278 1.00 22.12 C ATOM 685 CG1 VAL A 76 -35.143 -12.036 14.424 1.00 22.92 C ATOM 686 CG2 VAL A 76 -35.290 -10.024 12.978 1.00 22.30 C ATOM 687 H VAL A 76 -37.459 -10.982 11.160 1.00 0.00 H ATOM 688 N GLN A 77 -37.477 -14.032 12.411 1.00 20.82 N ATOM 689 CA GLN A 77 -37.848 -15.403 12.679 1.00 20.89 C ATOM 690 C GLN A 77 -37.365 -16.319 11.559 1.00 20.29 C ATOM 691 O GLN A 77 -36.792 -17.390 11.836 1.00 19.61 O ATOM 692 CB GLN A 77 -39.352 -15.507 12.803 1.00 22.25 C ATOM 693 CG GLN A 77 -39.852 -16.924 12.934 1.00 22.97 C ATOM 694 CD GLN A 77 -41.370 -16.975 12.933 1.00 24.82 C ATOM 695 OE1 GLN A 77 -42.064 -16.094 12.375 1.00 26.78 O ATOM 696 NE2 GLN A 77 -41.899 -17.986 13.547 1.00 26.03 N ATOM 697 HE22 GLN A 77 -41.289 -18.697 13.999 1.00 0.00 H ATOM 698 HE21 GLN A 77 -42.933 -18.086 13.588 1.00 0.00 H ATOM 699 H GLN A 77 -38.214 -13.307 12.299 1.00 0.00 H ATOM 700 N ASP A 78 -37.541 -15.889 10.310 1.00 20.29 N ATOM 701 CA ASP A 78 -37.086 -16.691 9.168 1.00 20.82 C ATOM 702 C ASP A 78 -35.571 -16.888 9.255 1.00 18.93 C ATOM 703 O ASP A 78 -35.068 -17.982 9.041 1.00 17.57 O ATOM 704 CB ASP A 78 -37.442 -16.032 7.829 1.00 23.13 C ATOM 705 CG ASP A 78 -38.935 -16.109 7.493 1.00 26.87 C ATOM 706 OD1 ASP A 78 -39.640 -16.981 8.061 1.00 29.91 O ATOM 707 OD2 ASP A 78 -39.380 -15.295 6.638 1.00 29.63 O ATOM 708 H ASP A 78 -38.006 -14.974 10.142 1.00 0.00 H ATOM 709 N LEU A 79 -34.851 -15.821 9.532 1.00 17.52 N ATOM 710 CA LEU A 79 -33.388 -15.900 9.654 1.00 17.07 C ATOM 711 C LEU A 79 -32.951 -16.818 10.794 1.00 16.90 C ATOM 712 O LEU A 79 -32.045 -17.649 10.602 1.00 15.09 O ATOM 713 CB LEU A 79 -32.802 -14.504 9.844 1.00 17.15 C ATOM 714 CG LEU A 79 -31.284 -14.421 9.979 1.00 16.93 C ATOM 715 CD1 LEU A 79 -30.548 -15.084 8.829 1.00 17.00 C ATOM 716 CD2 LEU A 79 -30.845 -12.970 10.119 1.00 17.55 C ATOM 717 H LEU A 79 -35.326 -14.906 9.667 1.00 0.00 H ATOM 718 N SER A 80 -33.615 -16.752 11.949 1.00 16.95 N ATOM 719 CA SER A 80 -33.359 -17.703 13.050 1.00 18.12 C ATOM 720 C SER A 80 -33.525 -19.139 12.573 1.00 17.43 C ATOM 721 O SER A 80 -32.679 -20.036 12.789 1.00 17.40 O ATOM 722 CB SER A 80 -34.330 -17.477 14.248 1.00 20.00 C ATOM 723 OG SER A 80 -34.206 -18.588 15.188 1.00 21.77 O ATOM 724 HG SER A 80 -34.823 -18.445 15.949 1.00 0.00 H ATOM 725 H SER A 80 -34.333 -16.011 12.078 1.00 0.00 H ATOM 726 N ASN A 81 -34.631 -19.390 11.903 1.00 17.96 N ATOM 727 CA ASN A 81 -34.895 -20.722 11.363 1.00 18.47 C ATOM 728 C ASN A 81 -33.774 -21.190 10.427 1.00 16.97 C ATOM 729 O ASN A 81 -33.349 -22.351 10.444 1.00 16.26 O ATOM 730 CB ASN A 81 -36.229 -20.782 10.582 1.00 20.49 C ATOM 731 CG ASN A 81 -37.439 -20.710 11.464 1.00 23.42 C ATOM 732 OD1 ASN A 81 -37.353 -20.932 12.654 1.00 23.79 O ATOM 733 ND2 ASN A 81 -38.582 -20.376 10.868 1.00 25.56 N ATOM 734 HD22 ASN A 81 -38.601 -20.196 9.844 1.00 0.00 H ATOM 735 HD21 ASN A 81 -39.455 -20.295 11.427 1.00 0.00 H ATOM 736 H ASN A 81 -35.326 -18.630 11.756 1.00 0.00 H ATOM 737 N GLN A 82 -33.306 -20.293 9.582 1.00 16.02 N ATOM 738 CA GLN A 82 -32.224 -20.657 8.635 1.00 15.21 C ATOM 739 C GLN A 82 -30.887 -20.909 9.331 1.00 13.79 C ATOM 740 O GLN A 82 -30.120 -21.777 8.937 1.00 12.85 O ATOM 741 CB GLN A 82 -32.059 -19.574 7.558 1.00 16.25 C ATOM 742 CG GLN A 82 -33.323 -19.366 6.727 1.00 17.64 C ATOM 743 CD GLN A 82 -34.125 -20.612 6.341 1.00 19.56 C ATOM 744 OE1 GLN A 82 -35.347 -20.694 6.619 1.00 23.84 O ATOM 745 NE2 GLN A 82 -33.487 -21.581 5.696 1.00 20.05 N ATOM 746 HE22 GLN A 82 -32.474 -21.483 5.480 1.00 0.00 H ATOM 747 HE21 GLN A 82 -34.000 -22.438 5.406 1.00 0.00 H ATOM 748 H GLN A 82 -33.696 -19.329 9.579 1.00 0.00 H ATOM 749 N ILE A 83 -30.590 -20.137 10.357 1.00 13.57 N ATOM 750 CA ILE A 83 -29.374 -20.363 11.145 1.00 13.38 C ATOM 751 C ILE A 83 -29.418 -21.689 11.911 1.00 13.56 C ATOM 752 O ILE A 83 -28.446 -22.464 11.907 1.00 13.64 O ATOM 753 CB ILE A 83 -29.181 -19.221 12.141 1.00 13.84 C ATOM 754 CG1 ILE A 83 -28.870 -17.925 11.393 1.00 13.81 C ATOM 755 CG2 ILE A 83 -28.076 -19.541 13.139 1.00 14.01 C ATOM 756 CD1 ILE A 83 -29.058 -16.693 12.243 1.00 13.99 C ATOM 757 H ILE A 83 -31.228 -19.356 10.612 1.00 0.00 H ATOM 758 N LEU A 84 -30.560 -21.999 12.490 1.00 14.02 N ATOM 759 CA LEU A 84 -30.672 -23.284 13.186 1.00 14.42 C ATOM 760 C LEU A 84 -30.596 -24.454 12.212 1.00 13.80 C ATOM 761 O LEU A 84 -29.985 -25.478 12.524 1.00 14.53 O ATOM 762 CB LEU A 84 -31.968 -23.360 13.987 1.00 15.68 C ATOM 763 CG LEU A 84 -32.097 -22.309 15.095 1.00 16.41 C ATOM 764 CD1 LEU A 84 -33.466 -22.390 15.722 1.00 17.57 C ATOM 765 CD2 LEU A 84 -31.017 -22.534 16.146 1.00 16.62 C ATOM 766 H LEU A 84 -31.367 -21.344 12.454 1.00 0.00 H ATOM 767 N LEU A 85 -31.167 -24.293 11.016 1.00 12.87 N ATOM 768 CA LEU A 85 -30.983 -25.283 9.957 1.00 12.54 C ATOM 769 C LEU A 85 -29.509 -25.443 9.585 1.00 11.65 C ATOM 770 O LEU A 85 -29.019 -26.562 9.432 1.00 11.47 O ATOM 771 CB LEU A 85 -31.815 -24.889 8.757 1.00 12.76 C ATOM 772 CG LEU A 85 -31.663 -25.775 7.512 1.00 12.58 C ATOM 773 CD1 LEU A 85 -32.055 -27.223 7.752 1.00 12.95 C ATOM 774 CD2 LEU A 85 -32.500 -25.214 6.380 1.00 12.93 C ATOM 775 H LEU A 85 -31.751 -23.451 10.836 1.00 0.00 H ATOM 776 N ALA A 86 -28.802 -24.332 9.422 1.00 11.15 N ATOM 777 CA ALA A 86 -27.391 -24.380 9.116 1.00 11.32 C ATOM 778 C ALA A 86 -26.577 -25.200 10.106 1.00 11.54 C ATOM 779 O ALA A 86 -25.725 -26.003 9.727 1.00 10.89 O ATOM 780 CB ALA A 86 -26.837 -22.996 8.925 1.00 11.33 C ATOM 781 H ALA A 86 -29.273 -23.409 9.516 1.00 0.00 H ATOM 782 N ILE A 87 -26.832 -24.942 11.398 1.00 12.73 N ATOM 783 CA ILE A 87 -26.083 -25.668 12.428 1.00 13.45 C ATOM 784 C ILE A 87 -26.398 -27.170 12.388 1.00 13.18 C ATOM 785 O ILE A 87 -25.468 -28.015 12.418 1.00 13.01 O ATOM 786 CB ILE A 87 -26.364 -25.098 13.835 1.00 15.25 C ATOM 787 CG1 ILE A 87 -25.962 -23.642 14.001 1.00 15.99 C ATOM 788 CG2 ILE A 87 -25.663 -25.950 14.885 1.00 16.39 C ATOM 789 CD1 ILE A 87 -26.731 -22.894 15.050 1.00 17.42 C ATOM 790 H ILE A 87 -27.550 -24.238 11.664 1.00 0.00 H ATOM 791 N GLN A 88 -27.676 -27.518 12.255 1.00 13.36 N ATOM 792 CA GLN A 88 -28.055 -28.910 12.193 1.00 13.91 C ATOM 793 C GLN A 88 -27.491 -29.569 10.934 1.00 12.95 C ATOM 794 O GLN A 88 -26.978 -30.673 10.982 1.00 12.81 O ATOM 795 CB GLN A 88 -29.562 -29.086 12.214 1.00 15.51 C ATOM 796 CG GLN A 88 -29.953 -30.547 12.408 1.00 17.26 C ATOM 797 CD GLN A 88 -29.355 -31.134 13.695 1.00 18.62 C ATOM 798 OE1 GLN A 88 -29.561 -30.586 14.784 1.00 21.42 O ATOM 799 NE2 GLN A 88 -28.509 -32.173 13.545 1.00 19.34 N ATOM 800 HE22 GLN A 88 -28.370 -32.599 12.607 1.00 0.00 H ATOM 801 HE21 GLN A 88 -27.995 -32.548 14.368 1.00 0.00 H ATOM 802 H GLN A 88 -28.408 -26.781 12.195 1.00 0.00 H ATOM 803 N ASN A 89 -27.514 -28.858 9.793 1.00 12.08 N ATOM 804 CA ASN A 89 -26.931 -29.407 8.560 1.00 11.77 C ATOM 805 C ASN A 89 -25.436 -29.684 8.707 1.00 11.52 C ATOM 806 O ASN A 89 -24.936 -30.649 8.166 1.00 10.93 O ATOM 807 CB ASN A 89 -27.081 -28.416 7.358 1.00 11.84 C ATOM 808 CG ASN A 89 -28.465 -28.446 6.725 1.00 12.51 C ATOM 809 OD1 ASN A 89 -29.181 -29.446 6.801 1.00 13.02 O ATOM 810 ND2 ASN A 89 -28.836 -27.330 6.065 1.00 12.45 N ATOM 811 HD22 ASN A 89 -28.197 -26.511 6.029 1.00 0.00 H ATOM 812 HD21 ASN A 89 -29.761 -27.289 5.592 1.00 0.00 H ATOM 813 H ASN A 89 -27.947 -27.913 9.783 1.00 0.00 H ATOM 814 N LEU A 90 -24.754 -28.792 9.431 1.00 11.55 N ATOM 815 CA LEU A 90 -23.327 -28.941 9.649 1.00 11.92 C ATOM 816 C LEU A 90 -23.037 -30.180 10.497 1.00 11.89 C ATOM 817 O LEU A 90 -22.213 -31.003 10.133 1.00 11.39 O ATOM 818 CB LEU A 90 -22.781 -27.683 10.290 1.00 12.55 C ATOM 819 CG LEU A 90 -21.300 -27.667 10.568 1.00 13.26 C ATOM 820 CD1 LEU A 90 -20.548 -27.527 9.257 1.00 13.69 C ATOM 821 CD2 LEU A 90 -20.949 -26.507 11.455 1.00 14.00 C ATOM 822 H LEU A 90 -25.253 -27.979 9.845 1.00 0.00 H ATOM 823 N ILE A 91 -23.791 -30.311 11.585 1.00 12.48 N ATOM 824 CA ILE A 91 -23.651 -31.448 12.468 1.00 13.27 C ATOM 825 C ILE A 91 -23.945 -32.737 11.730 1.00 13.46 C ATOM 826 O ILE A 91 -23.211 -33.723 11.869 1.00 14.42 O ATOM 827 CB ILE A 91 -24.541 -31.281 13.714 1.00 13.78 C ATOM 828 CG1 ILE A 91 -24.004 -30.150 14.587 1.00 14.11 C ATOM 829 CG2 ILE A 91 -24.553 -32.576 14.503 1.00 14.59 C ATOM 830 CD1 ILE A 91 -24.932 -29.733 15.710 1.00 14.67 C ATOM 831 H ILE A 91 -24.497 -29.580 11.806 1.00 0.00 H ATOM 832 N ASP A 92 -24.952 -32.695 10.853 1.00 13.73 N ATOM 833 CA ASP A 92 -25.314 -33.854 10.041 1.00 14.14 C ATOM 834 C ASP A 92 -24.189 -34.307 9.126 1.00 13.28 C ATOM 835 O ASP A 92 -24.112 -35.462 8.725 1.00 13.69 O ATOM 836 CB ASP A 92 -26.532 -33.584 9.153 1.00 15.31 C ATOM 837 CG ASP A 92 -27.824 -33.481 9.916 1.00 17.21 C ATOM 838 OD1 ASP A 92 -27.873 -33.813 11.117 1.00 18.39 O ATOM 839 OD2 ASP A 92 -28.788 -33.005 9.241 1.00 19.95 O ATOM 840 H ASP A 92 -25.493 -31.813 10.746 1.00 0.00 H ATOM 841 N LYS A 93 -23.310 -33.376 8.751 1.00 12.24 N ATOM 842 CA LYS A 93 -22.152 -33.684 7.932 1.00 11.84 C ATOM 843 C LYS A 93 -20.846 -33.832 8.683 1.00 11.65 C ATOM 844 O LYS A 93 -19.761 -33.849 8.077 1.00 11.64 O ATOM 845 CB LYS A 93 -22.012 -32.622 6.810 1.00 11.66 C ATOM 846 CG LYS A 93 -23.171 -32.646 5.806 1.00 12.27 C ATOM 847 CD LYS A 93 -23.196 -33.868 4.940 1.00 12.55 C ATOM 848 CE LYS A 93 -24.513 -34.054 4.221 1.00 12.88 C ATOM 849 NZ LYS A 93 -24.911 -32.893 3.370 1.00 12.88 N ATOM 850 HZ1 LYS A 93 -25.003 -32.044 3.964 1.00 0.00 H ATOM 851 HZ2 LYS A 93 -24.184 -32.732 2.643 1.00 0.00 H ATOM 852 HZ3 LYS A 93 -25.822 -33.097 2.912 1.00 0.00 H ATOM 853 H LYS A 93 -23.460 -32.393 9.057 1.00 0.00 H ATOM 854 N LYS A 94 -20.920 -34.100 9.975 1.00 11.76 N ATOM 855 CA LYS A 94 -19.710 -34.298 10.754 1.00 12.33 C ATOM 856 C LYS A 94 -18.796 -35.370 10.178 1.00 12.61 C ATOM 857 O LYS A 94 -17.583 -35.205 10.092 1.00 12.26 O ATOM 858 CB LYS A 94 -20.072 -34.640 12.207 1.00 13.47 C ATOM 859 CG LYS A 94 -18.863 -34.994 13.070 1.00 14.66 C ATOM 860 CD LYS A 94 -19.279 -35.296 14.504 1.00 15.86 C ATOM 861 CE LYS A 94 -18.120 -35.803 15.329 1.00 17.30 C ATOM 862 NZ LYS A 94 -18.441 -35.835 16.792 1.00 18.52 N ATOM 863 HZ1 LYS A 94 -18.674 -34.875 17.116 1.00 0.00 H ATOM 864 HZ2 LYS A 94 -19.254 -36.463 16.954 1.00 0.00 H ATOM 865 HZ3 LYS A 94 -17.617 -36.189 17.319 1.00 0.00 H ATOM 866 H LYS A 94 -21.849 -34.170 10.436 1.00 0.00 H ATOM 867 N GLU A 95 -19.361 -36.509 9.808 1.00 12.73 N ATOM 868 CA GLU A 95 -18.523 -37.625 9.347 1.00 13.42 C ATOM 869 C GLU A 95 -17.670 -37.258 8.111 1.00 12.01 C ATOM 870 O GLU A 95 -16.452 -37.414 8.173 1.00 12.00 O ATOM 871 CB GLU A 95 -19.374 -38.867 9.091 1.00 15.04 C ATOM 872 CG GLU A 95 -20.008 -39.391 10.375 1.00 17.10 C ATOM 873 CD GLU A 95 -21.263 -40.247 10.197 1.00 19.01 C ATOM 874 OE1 GLU A 95 -22.281 -39.761 9.636 1.00 21.37 O ATOM 875 OE2 GLU A 95 -21.292 -41.437 10.639 1.00 21.39 O ATOM 876 H GLU A 95 -20.395 -36.614 9.844 1.00 0.00 H ATOM 877 N PRO A 96 -18.275 -36.752 7.012 1.00 11.40 N ATOM 878 CA PRO A 96 -17.406 -36.399 5.892 1.00 10.83 C ATOM 879 C PRO A 96 -16.419 -35.283 6.212 1.00 10.66 C ATOM 880 O PRO A 96 -15.290 -35.309 5.750 1.00 10.15 O ATOM 881 CB PRO A 96 -18.381 -36.006 4.788 1.00 10.81 C ATOM 882 CG PRO A 96 -19.683 -35.783 5.428 1.00 10.77 C ATOM 883 CD PRO A 96 -19.689 -36.721 6.612 1.00 11.07 C ATOM 884 N LEU A 97 -16.847 -34.324 7.027 1.00 10.68 N ATOM 885 CA LEU A 97 -15.949 -33.245 7.398 1.00 10.69 C ATOM 886 C LEU A 97 -14.746 -33.721 8.172 1.00 11.38 C ATOM 887 O LEU A 97 -13.608 -33.301 7.914 1.00 11.20 O ATOM 888 CB LEU A 97 -16.695 -32.175 8.172 1.00 10.34 C ATOM 889 CG LEU A 97 -17.693 -31.352 7.341 1.00 9.97 C ATOM 890 CD1 LEU A 97 -18.632 -30.593 8.219 1.00 9.88 C ATOM 891 CD2 LEU A 97 -16.973 -30.381 6.397 1.00 9.81 C ATOM 892 H LEU A 97 -17.819 -34.346 7.397 1.00 0.00 H ATOM 893 N VAL A 98 -14.986 -34.605 9.131 1.00 12.20 N ATOM 894 CA VAL A 98 -13.895 -35.152 9.921 1.00 13.17 C ATOM 895 C VAL A 98 -13.003 -36.065 9.066 1.00 13.77 C ATOM 896 O VAL A 98 -11.770 -35.983 9.148 1.00 14.88 O ATOM 897 CB VAL A 98 -14.431 -35.861 11.169 1.00 13.95 C ATOM 898 CG1 VAL A 98 -13.329 -36.628 11.895 1.00 14.84 C ATOM 899 CG2 VAL A 98 -15.060 -34.874 12.140 1.00 13.79 C ATOM 900 H VAL A 98 -15.962 -34.909 9.319 1.00 0.00 H ATOM 901 N GLN A 99 -13.621 -36.869 8.226 1.00 13.55 N ATOM 902 CA GLN A 99 -12.860 -37.734 7.304 1.00 14.22 C ATOM 903 C GLN A 99 -11.905 -36.954 6.418 1.00 13.75 C ATOM 904 O GLN A 99 -10.797 -37.420 6.122 1.00 14.53 O ATOM 905 CB GLN A 99 -13.845 -38.485 6.400 1.00 14.34 C ATOM 906 CG GLN A 99 -13.240 -39.495 5.440 1.00 15.35 C ATOM 907 CD GLN A 99 -12.988 -40.806 6.132 1.00 17.00 C ATOM 908 OE1 GLN A 99 -13.919 -41.579 6.427 1.00 18.36 O ATOM 909 NE2 GLN A 99 -11.737 -41.102 6.358 1.00 17.96 N ATOM 910 HE22 GLN A 99 -10.988 -40.429 6.097 1.00 0.00 H ATOM 911 HE21 GLN A 99 -11.489 -42.011 6.799 1.00 0.00 H ATOM 912 H GLN A 99 -14.661 -36.895 8.212 1.00 0.00 H ATOM 913 N ALA A 100 -12.314 -35.746 6.032 1.00 13.15 N ATOM 914 CA ALA A 100 -11.540 -34.892 5.156 1.00 13.15 C ATOM 915 C ALA A 100 -10.440 -34.120 5.895 1.00 13.58 C ATOM 916 O ALA A 100 -9.673 -33.453 5.236 1.00 14.05 O ATOM 917 CB ALA A 100 -12.465 -33.945 4.399 1.00 13.01 C ATOM 918 H ALA A 100 -13.233 -35.400 6.376 1.00 0.00 H ATOM 919 N GLY A 101 -10.402 -34.229 7.206 1.00 13.83 N ATOM 920 CA GLY A 101 -9.390 -33.537 8.035 1.00 14.34 C ATOM 921 C GLY A 101 -9.791 -32.118 8.359 1.00 14.20 C ATOM 922 O GLY A 101 -8.926 -31.276 8.686 1.00 15.52 O ATOM 923 H GLY A 101 -11.111 -34.825 7.678 1.00 0.00 H ATOM 924 N PHE A 102 -11.086 -31.816 8.292 1.00 13.16 N ATOM 925 CA PHE A 102 -11.579 -30.454 8.524 1.00 12.81 C ATOM 926 C PHE A 102 -12.243 -30.273 9.863 1.00 12.83 C ATOM 927 O PHE A 102 -12.753 -29.172 10.089 1.00 12.28 O ATOM 928 CB PHE A 102 -12.507 -30.007 7.374 1.00 12.35 C ATOM 929 CG PHE A 102 -11.773 -29.544 6.146 1.00 12.84 C ATOM 930 CD1 PHE A 102 -11.237 -30.446 5.273 1.00 13.32 C ATOM 931 CD2 PHE A 102 -11.553 -28.192 5.897 1.00 12.92 C ATOM 932 CE1 PHE A 102 -10.489 -30.015 4.167 1.00 13.82 C ATOM 933 CE2 PHE A 102 -10.865 -27.768 4.779 1.00 13.50 C ATOM 934 CZ PHE A 102 -10.311 -28.677 3.916 1.00 14.08 C ATOM 935 H PHE A 102 -11.768 -32.568 8.068 1.00 0.00 H ATOM 936 N GLY A 103 -12.255 -31.251 10.749 1.00 13.32 N ATOM 937 CA GLY A 103 -12.987 -31.108 11.998 1.00 13.69 C ATOM 938 C GLY A 103 -12.485 -30.009 12.908 1.00 13.94 C ATOM 939 O GLY A 103 -13.286 -29.277 13.472 1.00 13.46 O ATOM 940 H GLY A 103 -11.737 -32.131 10.553 1.00 0.00 H ATOM 941 N GLY A 104 -11.175 -29.857 12.995 1.00 14.27 N ATOM 942 CA GLY A 104 -10.592 -28.768 13.766 1.00 14.64 C ATOM 943 C GLY A 104 -10.840 -27.401 13.151 1.00 14.04 C ATOM 944 O GLY A 104 -11.131 -26.426 13.856 1.00 13.97 O ATOM 945 H GLY A 104 -10.549 -30.527 12.504 1.00 0.00 H ATOM 946 N LYS A 105 -10.753 -27.324 11.819 1.00 13.77 N ATOM 947 CA LYS A 105 -11.025 -26.074 11.146 1.00 13.73 C ATOM 948 C LYS A 105 -12.484 -25.644 11.348 1.00 12.49 C ATOM 949 O LYS A 105 -12.799 -24.471 11.497 1.00 11.70 O ATOM 950 CB LYS A 105 -10.656 -26.176 9.668 1.00 15.12 C ATOM 951 CG LYS A 105 -9.144 -26.247 9.461 1.00 17.27 C ATOM 952 CD LYS A 105 -8.768 -26.421 7.997 1.00 19.01 C ATOM 953 CE LYS A 105 -7.260 -26.404 7.809 1.00 21.31 C ATOM 954 NZ LYS A 105 -6.951 -26.882 6.441 1.00 22.95 N ATOM 955 HZ1 LYS A 105 -7.313 -27.850 6.323 1.00 0.00 H ATOM 956 HZ2 LYS A 105 -7.403 -26.255 5.746 1.00 0.00 H ATOM 957 HZ3 LYS A 105 -5.921 -26.876 6.297 1.00 0.00 H ATOM 958 H LYS A 105 -10.489 -28.165 11.266 1.00 0.00 H ATOM 959 N VAL A 106 -13.410 -26.607 11.300 1.00 11.97 N ATOM 960 CA VAL A 106 -14.811 -26.317 11.542 1.00 11.92 C ATOM 961 C VAL A 106 -15.017 -25.854 12.994 1.00 12.57 C ATOM 962 O VAL A 106 -15.735 -24.861 13.229 1.00 12.33 O ATOM 963 CB VAL A 106 -15.685 -27.555 11.203 1.00 12.01 C ATOM 964 CG1 VAL A 106 -17.120 -27.380 11.682 1.00 12.04 C ATOM 965 CG2 VAL A 106 -15.683 -27.785 9.683 1.00 12.04 C ATOM 966 H VAL A 106 -13.121 -27.583 11.085 1.00 0.00 H ATOM 967 N GLU A 107 -14.373 -26.524 13.936 1.00 13.59 N ATOM 968 CA GLU A 107 -14.444 -26.107 15.335 1.00 14.87 C ATOM 969 C GLU A 107 -13.990 -24.666 15.492 1.00 14.47 C ATOM 970 O GLU A 107 -14.728 -23.871 16.086 1.00 14.92 O ATOM 971 CB GLU A 107 -13.586 -27.018 16.174 1.00 16.61 C ATOM 972 CG GLU A 107 -13.725 -26.755 17.673 1.00 18.99 C ATOM 973 CD GLU A 107 -12.577 -27.286 18.482 1.00 21.54 C ATOM 974 OE1 GLU A 107 -11.788 -28.100 17.954 1.00 23.68 O ATOM 975 OE2 GLU A 107 -12.469 -26.844 19.658 1.00 25.21 O ATOM 976 H GLU A 107 -13.809 -27.358 13.677 1.00 0.00 H ATOM 977 N ASN A 108 -12.846 -24.356 14.897 1.00 13.99 N ATOM 978 CA ASN A 108 -12.285 -23.004 14.968 1.00 13.87 C ATOM 979 C ASN A 108 -13.239 -21.973 14.351 1.00 13.02 C ATOM 980 O ASN A 108 -13.407 -20.853 14.900 1.00 13.13 O ATOM 981 CB ASN A 108 -10.953 -22.913 14.237 1.00 14.68 C ATOM 982 CG ASN A 108 -9.835 -23.735 14.870 1.00 16.14 C ATOM 983 OD1 ASN A 108 -9.930 -24.144 16.010 1.00 17.88 O ATOM 984 ND2 ASN A 108 -8.760 -23.897 14.134 1.00 17.45 N ATOM 985 HD22 ASN A 108 -8.734 -23.526 13.163 1.00 0.00 H ATOM 986 HD21 ASN A 108 -7.935 -24.397 14.522 1.00 0.00 H ATOM 987 H ASN A 108 -12.335 -25.090 14.367 1.00 0.00 H ATOM 988 N ASN A 109 -13.820 -22.275 13.188 1.00 12.30 N ATOM 989 CA ASN A 109 -14.755 -21.366 12.584 1.00 12.00 C ATOM 990 C ASN A 109 -15.984 -21.143 13.456 1.00 11.74 C ATOM 991 O ASN A 109 -16.474 -20.028 13.625 1.00 11.40 O ATOM 992 CB ASN A 109 -15.163 -21.903 11.222 1.00 12.12 C ATOM 993 CG ASN A 109 -15.861 -20.852 10.416 1.00 12.80 C ATOM 994 OD1 ASN A 109 -17.062 -20.742 10.468 1.00 13.35 O ATOM 995 ND2 ASN A 109 -15.127 -20.204 9.541 1.00 13.59 N ATOM 996 HD22 ASN A 109 -14.095 -20.330 9.533 1.00 0.00 H ATOM 997 HD21 ASN A 109 -15.578 -19.565 8.856 1.00 0.00 H ATOM 998 H ASN A 109 -13.595 -23.174 12.716 1.00 0.00 H ATOM 999 N LEU A 110 -16.515 -22.216 14.031 1.00 12.09 N ATOM 1000 CA LEU A 110 -17.682 -22.135 14.934 1.00 12.66 C ATOM 1001 C LEU A 110 -17.406 -21.317 16.193 1.00 12.57 C ATOM 1002 O LEU A 110 -18.300 -20.597 16.635 1.00 12.83 O ATOM 1003 CB LEU A 110 -18.175 -23.533 15.347 1.00 12.98 C ATOM 1004 CG LEU A 110 -18.885 -24.330 14.236 1.00 13.13 C ATOM 1005 CD1 LEU A 110 -19.025 -25.792 14.635 1.00 13.88 C ATOM 1006 CD2 LEU A 110 -20.210 -23.701 13.849 1.00 13.61 C ATOM 1007 H LEU A 110 -16.094 -23.147 13.839 1.00 0.00 H ATOM 1008 N ARG A 111 -16.183 -21.353 16.693 1.00 12.90 N ATOM 1009 CA ARG A 111 -15.847 -20.552 17.870 1.00 13.71 C ATOM 1010 C ARG A 111 -15.893 -19.077 17.493 1.00 13.45 C ATOM 1011 O ARG A 111 -16.339 -18.251 18.269 1.00 13.58 O ATOM 1012 CB ARG A 111 -14.479 -20.951 18.420 1.00 15.17 C ATOM 1013 CG ARG A 111 -14.491 -22.317 19.120 1.00 17.06 C ATOM 1014 CD ARG A 111 -13.143 -22.727 19.704 1.00 19.53 C ATOM 1015 NE ARG A 111 -13.235 -24.069 20.270 1.00 22.01 N ATOM 1016 CZ ARG A 111 -13.811 -24.411 21.426 1.00 24.38 C ATOM 1017 NH1 ARG A 111 -14.319 -23.506 22.258 1.00 25.81 N ATOM 1018 NH2 ARG A 111 -13.853 -25.702 21.762 1.00 25.80 N ATOM 1019 HE ARG A 111 -12.808 -24.839 19.716 1.00 0.00 H ATOM 1020 HH12 ARG A 111 -14.760 -23.809 23.150 1.00 0.00 H ATOM 1021 HH11 ARG A 111 -14.275 -22.495 22.017 1.00 0.00 H ATOM 1022 HH22 ARG A 111 -14.296 -25.992 22.657 1.00 0.00 H ATOM 1023 HH21 ARG A 111 -13.442 -26.418 21.129 1.00 0.00 H ATOM 1024 H ARG A 111 -15.458 -21.952 16.249 1.00 0.00 H ATOM 1025 N GLN A 112 -15.505 -18.751 16.260 1.00 12.67 N ATOM 1026 CA GLN A 112 -15.608 -17.357 15.778 1.00 12.66 C ATOM 1027 C GLN A 112 -17.046 -16.950 15.512 1.00 12.27 C ATOM 1028 O GLN A 112 -17.437 -15.801 15.785 1.00 12.63 O ATOM 1029 CB GLN A 112 -14.699 -17.172 14.560 1.00 12.94 C ATOM 1030 CG GLN A 112 -13.225 -17.344 14.874 1.00 14.07 C ATOM 1031 CD GLN A 112 -12.363 -17.440 13.609 1.00 15.14 C ATOM 1032 OE1 GLN A 112 -12.147 -16.436 12.990 1.00 17.40 O ATOM 1033 NE2 GLN A 112 -11.949 -18.632 13.188 1.00 15.73 N ATOM 1034 HE22 GLN A 112 -12.154 -19.482 13.751 1.00 0.00 H ATOM 1035 HE21 GLN A 112 -11.420 -18.714 12.296 1.00 0.00 H ATOM 1036 H GLN A 112 -15.125 -19.486 15.630 1.00 0.00 H ATOM 1037 N GLN A 113 -17.844 -17.866 14.992 1.00 12.12 N ATOM 1038 CA GLN A 113 -19.271 -17.605 14.820 1.00 12.28 C ATOM 1039 C GLN A 113 -19.897 -17.295 16.159 1.00 12.52 C ATOM 1040 O GLN A 113 -20.706 -16.374 16.262 1.00 12.61 O ATOM 1041 CB GLN A 113 -19.995 -18.817 14.243 1.00 13.02 C ATOM 1042 CG GLN A 113 -19.476 -19.366 12.909 1.00 13.19 C ATOM 1043 CD GLN A 113 -19.887 -18.591 11.686 1.00 13.54 C ATOM 1044 OE1 GLN A 113 -19.379 -18.898 10.580 1.00 14.65 O ATOM 1045 NE2 GLN A 113 -20.739 -17.605 11.814 1.00 13.30 N ATOM 1046 HE22 GLN A 113 -21.139 -17.381 12.748 1.00 0.00 H ATOM 1047 HE21 GLN A 113 -21.016 -17.046 10.982 1.00 0.00 H ATOM 1048 H GLN A 113 -17.451 -18.784 14.702 1.00 0.00 H ATOM 1049 N GLU A 114 -19.547 -18.077 17.166 1.00 12.52 N ATOM 1050 CA GLU A 114 -20.076 -17.878 18.521 1.00 13.27 C ATOM 1051 C GLU A 114 -19.762 -16.475 19.023 1.00 13.12 C ATOM 1052 O GLU A 114 -20.663 -15.792 19.534 1.00 12.68 O ATOM 1053 CB GLU A 114 -19.506 -18.943 19.466 1.00 14.08 C ATOM 1054 CG GLU A 114 -20.098 -18.911 20.848 1.00 15.49 C ATOM 1055 CD GLU A 114 -19.567 -20.002 21.738 1.00 16.90 C ATOM 1056 OE1 GLU A 114 -18.324 -20.114 21.890 1.00 17.96 O ATOM 1057 OE2 GLU A 114 -20.386 -20.666 22.401 1.00 17.58 O ATOM 1058 H GLU A 114 -18.878 -18.855 16.993 1.00 0.00 H ATOM 1059 N GLU A 115 -18.514 -16.040 18.888 1.00 13.26 N ATOM 1060 CA GLU A 115 -18.097 -14.701 19.370 1.00 14.40 C ATOM 1061 C GLU A 115 -18.809 -13.583 18.597 1.00 13.80 C ATOM 1062 O GLU A 115 -19.304 -12.615 19.190 1.00 13.80 O ATOM 1063 CB GLU A 115 -16.555 -14.574 19.286 1.00 16.40 C ATOM 1064 CG GLU A 115 -15.840 -15.312 20.406 1.00 19.45 C ATOM 1065 CD GLU A 115 -14.342 -15.147 20.480 1.00 23.08 C ATOM 1066 OE1 GLU A 115 -13.722 -15.889 21.279 1.00 26.48 O ATOM 1067 OE2 GLU A 115 -13.804 -14.265 19.793 1.00 25.73 O ATOM 1068 H GLU A 115 -17.810 -16.655 18.432 1.00 0.00 H ATOM 1069 N ALA A 116 -18.912 -13.724 17.282 1.00 13.15 N ATOM 1070 CA ALA A 116 -19.578 -12.686 16.489 1.00 13.23 C ATOM 1071 C ALA A 116 -21.054 -12.629 16.789 1.00 13.18 C ATOM 1072 O ALA A 116 -21.659 -11.536 16.884 1.00 13.47 O ATOM 1073 CB ALA A 116 -19.373 -12.978 14.996 1.00 13.35 C ATOM 1074 H ALA A 116 -18.522 -14.568 16.815 1.00 0.00 H ATOM 1075 N ALA A 117 -21.692 -13.778 16.930 1.00 13.55 N ATOM 1076 CA ALA A 117 -23.124 -13.845 17.215 1.00 14.07 C ATOM 1077 C ALA A 117 -23.406 -13.182 18.574 1.00 14.39 C ATOM 1078 O ALA A 117 -24.391 -12.478 18.736 1.00 14.56 O ATOM 1079 CB ALA A 117 -23.615 -15.269 17.226 1.00 14.29 C ATOM 1080 H ALA A 117 -21.157 -14.665 16.835 1.00 0.00 H ATOM 1081 N GLN A 118 -22.531 -13.441 19.547 1.00 14.42 N ATOM 1082 CA GLN A 118 -22.702 -12.868 20.884 1.00 15.57 C ATOM 1083 C GLN A 118 -22.665 -11.345 20.819 1.00 15.22 C ATOM 1084 O GLN A 118 -23.482 -10.675 21.448 1.00 14.37 O ATOM 1085 CB GLN A 118 -21.613 -13.416 21.801 1.00 17.16 C ATOM 1086 CG GLN A 118 -21.698 -13.056 23.282 1.00 19.62 C ATOM 1087 CD GLN A 118 -21.333 -11.642 23.625 1.00 21.12 C ATOM 1088 OE1 GLN A 118 -21.912 -11.085 24.551 1.00 25.61 O ATOM 1089 NE2 GLN A 118 -20.337 -11.071 22.951 1.00 22.33 N ATOM 1090 HE22 GLN A 118 -19.876 -11.583 22.172 1.00 0.00 H ATOM 1091 HE21 GLN A 118 -20.020 -10.113 23.203 1.00 0.00 H ATOM 1092 H GLN A 118 -21.716 -14.058 19.354 1.00 0.00 H ATOM 1093 N LYS A 119 -21.736 -10.810 20.022 1.00 15.08 N ATOM 1094 CA LYS A 119 -21.622 -9.360 19.885 1.00 15.82 C ATOM 1095 C LYS A 119 -22.870 -8.784 19.274 1.00 15.11 C ATOM 1096 O LYS A 119 -23.386 -7.752 19.724 1.00 14.80 O ATOM 1097 CB LYS A 119 -20.405 -9.032 19.031 1.00 17.67 C ATOM 1098 CG LYS A 119 -19.183 -9.167 19.843 1.00 20.83 C ATOM 1099 CD LYS A 119 -17.977 -9.088 18.993 1.00 23.59 C ATOM 1100 CE LYS A 119 -16.868 -8.854 19.988 1.00 26.34 C ATOM 1101 NZ LYS A 119 -16.630 -7.408 20.026 1.00 27.41 N ATOM 1102 HZ1 LYS A 119 -16.353 -7.079 19.079 1.00 0.00 H ATOM 1103 HZ2 LYS A 119 -17.501 -6.922 20.322 1.00 0.00 H ATOM 1104 HZ3 LYS A 119 -15.869 -7.201 20.703 1.00 0.00 H ATOM 1105 H LYS A 119 -21.089 -11.431 19.495 1.00 0.00 H ATOM 1106 N LEU A 120 -23.371 -9.407 18.231 1.00 14.69 N ATOM 1107 CA LEU A 120 -24.555 -8.898 17.587 1.00 15.35 C ATOM 1108 C LEU A 120 -25.799 -9.036 18.490 1.00 16.18 C ATOM 1109 O LEU A 120 -26.637 -8.151 18.529 1.00 16.29 O ATOM 1110 CB LEU A 120 -24.776 -9.552 16.220 1.00 15.50 C ATOM 1111 CG LEU A 120 -25.912 -8.957 15.360 1.00 15.64 C ATOM 1112 CD1 LEU A 120 -25.834 -7.440 15.170 1.00 16.03 C ATOM 1113 CD2 LEU A 120 -25.989 -9.650 13.992 1.00 15.97 C ATOM 1114 H LEU A 120 -22.913 -10.268 17.870 1.00 0.00 H ATOM 1115 N SER A 121 -25.930 -10.171 19.171 1.00 16.68 N ATOM 1116 CA SER A 121 -27.054 -10.427 20.072 1.00 18.34 C ATOM 1117 C SER A 121 -27.106 -9.392 21.177 1.00 18.18 C ATOM 1118 O SER A 121 -28.174 -8.877 21.495 1.00 17.22 O ATOM 1119 CB SER A 121 -26.952 -11.817 20.684 1.00 20.02 C ATOM 1120 OG SER A 121 -27.164 -12.811 19.701 1.00 23.53 O ATOM 1121 HG SER A 121 -27.094 -13.706 20.118 1.00 0.00 H ATOM 1122 H SER A 121 -25.204 -10.907 19.058 1.00 0.00 H ATOM 1123 N GLU A 122 -25.939 -9.072 21.727 1.00 17.26 N ATOM 1124 CA GLU A 122 -25.872 -8.069 22.794 1.00 18.54 C ATOM 1125 C GLU A 122 -26.339 -6.721 22.230 1.00 17.53 C ATOM 1126 O GLU A 122 -27.179 -6.018 22.841 1.00 17.23 O ATOM 1127 CB GLU A 122 -24.441 -7.944 23.338 1.00 20.83 C ATOM 1128 CG GLU A 122 -24.012 -8.956 24.386 1.00 24.34 C ATOM 1129 CD GLU A 122 -23.004 -8.358 25.344 1.00 28.50 C ATOM 1130 OE1 GLU A 122 -23.432 -8.008 26.466 1.00 33.83 O ATOM 1131 OE2 GLU A 122 -21.823 -8.216 24.979 1.00 30.59 O ATOM 1132 H GLU A 122 -25.068 -9.536 21.398 1.00 0.00 H ATOM 1133 N LEU A 123 -25.887 -6.368 21.039 1.00 15.98 N ATOM 1134 CA LEU A 123 -26.316 -5.110 20.429 1.00 16.56 C ATOM 1135 C LEU A 123 -27.815 -5.103 20.140 1.00 16.58 C ATOM 1136 O LEU A 123 -28.507 -4.123 20.471 1.00 16.14 O ATOM 1137 CB LEU A 123 -25.541 -4.822 19.133 1.00 16.76 C ATOM 1138 CG LEU A 123 -25.853 -3.457 18.541 1.00 17.06 C ATOM 1139 CD1 LEU A 123 -25.450 -2.318 19.491 1.00 17.39 C ATOM 1140 CD2 LEU A 123 -25.098 -3.339 17.228 1.00 17.24 C ATOM 1141 H LEU A 123 -25.223 -6.988 20.533 1.00 0.00 H ATOM 1142 N VAL A 124 -28.338 -6.157 19.540 1.00 17.19 N ATOM 1143 CA VAL A 124 -29.774 -6.243 19.223 1.00 18.38 C ATOM 1144 C VAL A 124 -30.633 -6.087 20.476 1.00 18.80 C ATOM 1145 O VAL A 124 -31.662 -5.389 20.456 1.00 18.43 O ATOM 1146 CB VAL A 124 -30.121 -7.559 18.527 1.00 19.27 C ATOM 1147 CG1 VAL A 124 -31.646 -7.822 18.480 1.00 19.94 C ATOM 1148 CG2 VAL A 124 -29.546 -7.549 17.133 1.00 19.57 C ATOM 1149 H VAL A 124 -27.717 -6.951 19.283 1.00 0.00 H ATOM 1150 N SER A 125 -30.216 -6.692 21.579 1.00 18.65 N ATOM 1151 CA SER A 125 -30.965 -6.517 22.836 1.00 19.48 C ATOM 1152 C SER A 125 -31.124 -5.070 23.271 1.00 19.49 C ATOM 1153 O SER A 125 -32.086 -4.737 23.977 1.00 20.73 O ATOM 1154 CB SER A 125 -30.329 -7.290 23.989 1.00 20.21 C ATOM 1155 OG SER A 125 -29.151 -6.647 24.452 1.00 21.38 O ATOM 1156 HG SER A 125 -28.496 -6.588 23.712 1.00 0.00 H ATOM 1157 H SER A 125 -29.364 -7.288 21.558 1.00 0.00 H ATOM 1158 N THR A 126 -30.217 -4.192 22.855 1.00 18.45 N ATOM 1159 CA THR A 126 -30.367 -2.774 23.185 1.00 18.94 C ATOM 1160 C THR A 126 -31.300 -2.023 22.245 1.00 18.88 C ATOM 1161 O THR A 126 -31.565 -0.860 22.487 1.00 19.42 O ATOM 1162 CB THR A 126 -28.993 -2.021 23.223 1.00 19.04 C ATOM 1163 OG1 THR A 126 -28.457 -1.825 21.898 1.00 19.24 O ATOM 1164 CG2 THR A 126 -27.979 -2.759 24.083 1.00 19.32 C ATOM 1165 HG1 THR A 126 -28.320 -2.705 21.465 1.00 0.00 H ATOM 1166 H THR A 126 -29.401 -4.512 22.295 1.00 0.00 H ATOM 1167 N LYS A 127 -31.712 -2.623 21.142 1.00 18.24 N ATOM 1168 CA LYS A 127 -32.547 -1.953 20.144 1.00 18.62 C ATOM 1169 C LYS A 127 -33.989 -2.441 20.135 1.00 19.36 C ATOM 1170 O LYS A 127 -34.854 -1.777 19.578 1.00 20.06 O ATOM 1171 CB LYS A 127 -31.990 -2.159 18.716 1.00 18.23 C ATOM 1172 CG LYS A 127 -30.525 -1.821 18.511 1.00 18.37 C ATOM 1173 CD LYS A 127 -30.149 -0.406 18.908 1.00 18.81 C ATOM 1174 CE LYS A 127 -28.660 -0.179 18.712 1.00 19.42 C ATOM 1175 NZ LYS A 127 -28.252 1.168 19.131 1.00 20.10 N ATOM 1176 HZ1 LYS A 127 -28.767 1.875 18.569 1.00 0.00 H ATOM 1177 HZ2 LYS A 127 -28.472 1.298 20.139 1.00 0.00 H ATOM 1178 HZ3 LYS A 127 -27.229 1.282 18.981 1.00 0.00 H ATOM 1179 H LYS A 127 -31.432 -3.611 20.976 1.00 0.00 H ATOM 1180 N VAL A 128 -34.253 -3.582 20.727 1.00 19.24 N ATOM 1181 CA VAL A 128 -35.590 -4.164 20.649 1.00 20.04 C ATOM 1182 C VAL A 128 -36.471 -3.545 21.725 1.00 20.79 C ATOM 1183 O VAL A 128 -36.021 -3.329 22.860 1.00 20.97 O ATOM 1184 CB VAL A 128 -35.478 -5.677 20.816 1.00 19.77 C ATOM 1185 CG1 VAL A 128 -36.851 -6.325 20.991 1.00 20.18 C ATOM 1186 CG2 VAL A 128 -34.755 -6.270 19.612 1.00 19.48 C ATOM 1187 H VAL A 128 -33.505 -4.075 21.255 1.00 0.00 H ATOM 1188 N PRO A 129 -37.740 -3.257 21.382 1.00 21.63 N ATOM 1189 CA PRO A 129 -38.605 -2.676 22.400 1.00 22.02 C ATOM 1190 C PRO A 129 -39.040 -3.713 23.413 1.00 22.04 C ATOM 1191 O PRO A 129 -39.011 -4.897 23.145 1.00 21.04 O ATOM 1192 CB PRO A 129 -39.800 -2.153 21.591 1.00 22.82 C ATOM 1193 CG PRO A 129 -39.855 -3.049 20.433 1.00 23.08 C ATOM 1194 CD PRO A 129 -38.414 -3.314 20.086 1.00 21.95 C ATOM 1195 N HIS A 130 -39.430 -3.256 24.590 1.00 23.22 N ATOM 1196 CA HIS A 130 -39.752 -4.152 25.684 1.00 24.05 C ATOM 1197 C HIS A 130 -40.803 -5.221 25.329 1.00 23.73 C ATOM 1198 O HIS A 130 -40.685 -6.348 25.741 1.00 22.91 O ATOM 1199 CB HIS A 130 -40.203 -3.340 26.911 1.00 26.50 C ATOM 1200 CG HIS A 130 -40.479 -4.197 28.094 1.00 29.04 C ATOM 1201 ND1 HIS A 130 -41.756 -4.527 28.491 1.00 31.60 N ATOM 1202 CD2 HIS A 130 -39.638 -4.897 28.889 1.00 30.38 C ATOM 1203 CE1 HIS A 130 -41.688 -5.365 29.514 1.00 32.88 C ATOM 1204 NE2 HIS A 130 -40.411 -5.579 29.790 1.00 32.30 N ATOM 1205 H HIS A 130 -39.508 -2.229 24.735 1.00 0.00 H ATOM 1206 N GLU A 131 -41.756 -4.858 24.488 1.00 23.40 N ATOM 1207 CA GLU A 131 -42.820 -5.760 24.058 1.00 24.04 C ATOM 1208 C GLU A 131 -42.314 -6.982 23.327 1.00 23.06 C ATOM 1209 O GLU A 131 -42.985 -8.020 23.296 1.00 23.24 O ATOM 1210 CB GLU A 131 -43.799 -5.023 23.161 1.00 24.80 C ATOM 1211 CG GLU A 131 -44.643 -4.006 23.872 1.00 26.30 C ATOM 1212 CD GLU A 131 -44.044 -2.615 23.939 1.00 26.47 C ATOM 1213 OE1 GLU A 131 -42.833 -2.430 23.646 1.00 25.71 O ATOM 1214 OE2 GLU A 131 -44.784 -1.687 24.315 1.00 28.31 O ATOM 1215 H GLU A 131 -41.747 -3.887 24.116 1.00 0.00 H ATOM 1216 N LEU A 132 -41.129 -6.879 22.709 1.00 22.01 N ATOM 1217 CA LEU A 132 -40.526 -7.994 22.000 1.00 21.36 C ATOM 1218 C LEU A 132 -39.250 -8.508 22.643 1.00 20.08 C ATOM 1219 O LEU A 132 -38.581 -9.326 22.058 1.00 19.24 O ATOM 1220 CB LEU A 132 -40.278 -7.615 20.524 1.00 21.23 C ATOM 1221 CG LEU A 132 -41.576 -7.489 19.741 1.00 22.49 C ATOM 1222 CD1 LEU A 132 -41.265 -6.765 18.438 1.00 22.71 C ATOM 1223 CD2 LEU A 132 -42.263 -8.816 19.484 1.00 22.74 C ATOM 1224 H LEU A 132 -40.624 -5.970 22.738 1.00 0.00 H ATOM 1225 N ALA A 133 -38.939 -8.048 23.853 1.00 20.20 N ATOM 1226 CA ALA A 133 -37.659 -8.372 24.488 1.00 20.34 C ATOM 1227 C ALA A 133 -37.544 -9.843 24.826 1.00 20.43 C ATOM 1228 O ALA A 133 -36.502 -10.445 24.576 1.00 19.86 O ATOM 1229 CB ALA A 133 -37.454 -7.530 25.746 1.00 20.65 C ATOM 1230 H ALA A 133 -39.619 -7.446 24.359 1.00 0.00 H ATOM 1231 N ASP A 134 -38.615 -10.455 25.333 1.00 21.70 N ATOM 1232 CA ASP A 134 -38.570 -11.878 25.703 1.00 22.77 C ATOM 1233 C ASP A 134 -38.419 -12.779 24.488 1.00 21.63 C ATOM 1234 O ASP A 134 -37.574 -13.672 24.493 1.00 21.14 O ATOM 1235 CB ASP A 134 -39.807 -12.282 26.527 1.00 25.14 C ATOM 1236 CG ASP A 134 -39.778 -11.731 27.950 1.00 26.97 C ATOM 1237 OD1 ASP A 134 -38.809 -11.037 28.356 1.00 28.44 O ATOM 1238 OD2 ASP A 134 -40.776 -11.940 28.673 1.00 29.21 O ATOM 1239 H ASP A 134 -39.495 -9.918 25.469 1.00 0.00 H ATOM 1240 N ILE A 135 -39.241 -12.565 23.465 1.00 20.95 N ATOM 1241 CA ILE A 135 -39.152 -13.363 22.247 1.00 20.80 C ATOM 1242 C ILE A 135 -37.799 -13.154 21.529 1.00 19.61 C ATOM 1243 O ILE A 135 -37.184 -14.116 21.109 1.00 18.96 O ATOM 1244 CB ILE A 135 -40.382 -13.226 21.321 1.00 21.54 C ATOM 1245 CG1 ILE A 135 -40.460 -14.325 20.216 1.00 21.58 C ATOM 1246 CG2 ILE A 135 -40.517 -11.864 20.670 1.00 21.59 C ATOM 1247 CD1 ILE A 135 -40.237 -15.775 20.585 1.00 21.84 C ATOM 1248 H ILE A 135 -39.959 -11.816 23.534 1.00 0.00 H ATOM 1249 N SER A 136 -37.292 -11.928 21.498 1.00 19.71 N ATOM 1250 CA SER A 136 -35.979 -11.685 20.880 1.00 19.65 C ATOM 1251 C SER A 136 -34.881 -12.412 21.642 1.00 19.42 C ATOM 1252 O SER A 136 -33.982 -12.981 21.021 1.00 18.35 O ATOM 1253 CB SER A 136 -35.699 -10.196 20.826 1.00 20.38 C ATOM 1254 OG SER A 136 -34.499 -9.925 20.098 1.00 20.77 O ATOM 1255 HG SER A 136 -33.737 -10.376 20.541 1.00 0.00 H ATOM 1256 H SER A 136 -37.824 -11.136 21.912 1.00 0.00 H ATOM 1257 N ARG A 137 -34.933 -12.376 22.972 1.00 20.31 N ATOM 1258 CA ARG A 137 -33.938 -13.060 23.801 1.00 21.14 C ATOM 1259 C ARG A 137 -34.004 -14.562 23.581 1.00 21.05 C ATOM 1260 O ARG A 137 -32.978 -15.218 23.472 1.00 20.28 O ATOM 1261 CB ARG A 137 -34.144 -12.721 25.279 1.00 22.86 C ATOM 1262 CG ARG A 137 -33.161 -13.364 26.249 1.00 23.97 C ATOM 1263 CD ARG A 137 -33.459 -12.960 27.700 1.00 25.60 C ATOM 1264 NE ARG A 137 -33.914 -11.572 27.836 1.00 26.53 N ATOM 1265 CZ ARG A 137 -35.158 -11.205 28.154 1.00 27.61 C ATOM 1266 NH1 ARG A 137 -36.107 -12.114 28.385 1.00 28.64 N ATOM 1267 NH2 ARG A 137 -35.465 -9.926 28.232 1.00 27.90 N ATOM 1268 HE ARG A 137 -33.216 -10.818 27.673 1.00 0.00 H ATOM 1269 HH12 ARG A 137 -37.070 -11.809 28.631 1.00 0.00 H ATOM 1270 HH11 ARG A 137 -35.883 -13.128 28.319 1.00 0.00 H ATOM 1271 HH22 ARG A 137 -36.433 -9.638 28.479 1.00 0.00 H ATOM 1272 HH21 ARG A 137 -34.739 -9.205 28.046 1.00 0.00 H ATOM 1273 H ARG A 137 -35.701 -11.848 23.434 1.00 0.00 H ATOM 1274 N GLN A 138 -35.220 -15.094 23.507 1.00 20.75 N ATOM 1275 CA GLN A 138 -35.381 -16.533 23.229 1.00 21.46 C ATOM 1276 C GLN A 138 -34.798 -16.949 21.864 1.00 20.12 C ATOM 1277 O GLN A 138 -34.120 -17.983 21.781 1.00 19.83 O ATOM 1278 CB GLN A 138 -36.841 -16.956 23.356 1.00 23.32 C ATOM 1279 CG GLN A 138 -37.311 -16.917 24.802 1.00 26.13 C ATOM 1280 CD GLN A 138 -38.797 -17.217 24.941 1.00 28.49 C ATOM 1281 OE1 GLN A 138 -39.483 -17.531 23.959 1.00 32.19 O ATOM 1282 NE2 GLN A 138 -39.301 -17.095 26.156 1.00 30.22 N ATOM 1283 HE22 GLN A 138 -38.685 -16.829 26.950 1.00 0.00 H ATOM 1284 HE21 GLN A 138 -40.314 -17.265 26.318 1.00 0.00 H ATOM 1285 H GLN A 138 -36.059 -14.495 23.645 1.00 0.00 H ATOM 1286 N LEU A 139 -35.038 -16.135 20.831 1.00 19.84 N ATOM 1287 CA LEU A 139 -34.474 -16.421 19.488 1.00 20.00 C ATOM 1288 C LEU A 139 -32.941 -16.342 19.566 1.00 18.97 C ATOM 1289 O LEU A 139 -32.241 -17.210 19.068 1.00 17.89 O ATOM 1290 CB LEU A 139 -34.983 -15.445 18.431 1.00 21.17 C ATOM 1291 CG LEU A 139 -36.449 -15.646 18.067 1.00 22.66 C ATOM 1292 CD1 LEU A 139 -37.029 -14.423 17.372 1.00 24.14 C ATOM 1293 CD2 LEU A 139 -36.656 -16.891 17.255 1.00 23.72 C ATOM 1294 H LEU A 139 -35.628 -15.290 20.970 1.00 0.00 H ATOM 1295 N SER A 140 -32.423 -15.327 20.249 1.00 18.70 N ATOM 1296 CA SER A 140 -30.966 -15.171 20.397 1.00 18.77 C ATOM 1297 C SER A 140 -30.355 -16.364 21.146 1.00 18.37 C ATOM 1298 O SER A 140 -29.306 -16.891 20.755 1.00 17.85 O ATOM 1299 CB SER A 140 -30.613 -13.840 21.095 1.00 19.32 C ATOM 1300 OG SER A 140 -30.858 -12.743 20.267 1.00 20.36 O ATOM 1301 HG SER A 140 -30.309 -12.821 19.447 1.00 0.00 H ATOM 1302 H SER A 140 -33.058 -14.630 20.687 1.00 0.00 H ATOM 1303 N ASP A 141 -30.996 -16.778 22.235 1.00 18.77 N ATOM 1304 CA ASP A 141 -30.508 -17.874 23.060 1.00 19.31 C ATOM 1305 C ASP A 141 -30.514 -19.194 22.274 1.00 18.90 C ATOM 1306 O ASP A 141 -29.612 -20.028 22.419 1.00 18.77 O ATOM 1307 CB ASP A 141 -31.348 -18.048 24.343 1.00 21.34 C ATOM 1308 CG ASP A 141 -31.132 -16.959 25.362 1.00 22.97 C ATOM 1309 OD1 ASP A 141 -30.174 -16.159 25.265 1.00 24.39 O ATOM 1310 OD2 ASP A 141 -31.976 -16.921 26.279 1.00 24.85 O ATOM 1311 H ASP A 141 -31.879 -16.301 22.508 1.00 0.00 H ATOM 1312 N GLY A 142 -31.550 -19.396 21.459 1.00 18.42 N ATOM 1313 CA GLY A 142 -31.636 -20.572 20.629 1.00 18.21 C ATOM 1314 C GLY A 142 -30.457 -20.668 19.661 1.00 16.88 C ATOM 1315 O GLY A 142 -29.861 -21.732 19.517 1.00 16.91 O ATOM 1316 H GLY A 142 -32.313 -18.690 21.421 1.00 0.00 H ATOM 1317 N ILE A 143 -30.119 -19.542 19.044 1.00 16.67 N ATOM 1318 CA ILE A 143 -28.963 -19.455 18.131 1.00 16.29 C ATOM 1319 C ILE A 143 -27.667 -19.758 18.892 1.00 16.26 C ATOM 1320 O ILE A 143 -26.862 -20.549 18.448 1.00 16.03 O ATOM 1321 CB ILE A 143 -28.921 -18.100 17.391 1.00 16.58 C ATOM 1322 CG1 ILE A 143 -30.052 -18.037 16.349 1.00 17.12 C ATOM 1323 CG2 ILE A 143 -27.577 -17.918 16.668 1.00 16.00 C ATOM 1324 CD1 ILE A 143 -30.419 -16.667 15.879 1.00 17.91 C ATOM 1325 H ILE A 143 -30.691 -18.689 19.210 1.00 0.00 H ATOM 1326 N ALA A 144 -27.468 -19.103 20.023 1.00 16.60 N ATOM 1327 CA ALA A 144 -26.255 -19.284 20.825 1.00 16.69 C ATOM 1328 C ALA A 144 -26.081 -20.732 21.271 1.00 16.77 C ATOM 1329 O ALA A 144 -25.008 -21.340 21.132 1.00 16.20 O ATOM 1330 CB ALA A 144 -26.298 -18.351 22.021 1.00 17.35 C ATOM 1331 H ALA A 144 -28.196 -18.438 20.354 1.00 0.00 H ATOM 1332 N ALA A 145 -27.176 -21.328 21.748 1.00 17.07 N ATOM 1333 CA ALA A 145 -27.152 -22.702 22.170 1.00 17.38 C ATOM 1334 C ALA A 145 -26.879 -23.653 21.001 1.00 16.49 C ATOM 1335 O ALA A 145 -26.133 -24.626 21.121 1.00 16.52 O ATOM 1336 CB ALA A 145 -28.487 -23.081 22.806 1.00 18.39 C ATOM 1337 H ALA A 145 -28.063 -20.789 21.816 1.00 0.00 H ATOM 1338 N GLY A 146 -27.447 -23.356 19.838 1.00 15.62 N ATOM 1339 CA GLY A 146 -27.205 -24.154 18.642 1.00 15.14 C ATOM 1340 C GLY A 146 -25.757 -24.116 18.232 1.00 14.46 C ATOM 1341 O GLY A 146 -25.156 -25.130 17.935 1.00 14.45 O ATOM 1342 H GLY A 146 -28.081 -22.533 19.779 1.00 0.00 H ATOM 1343 N ILE A 147 -25.162 -22.920 18.200 1.00 14.11 N ATOM 1344 CA ILE A 147 -23.764 -22.806 17.830 1.00 14.04 C ATOM 1345 C ILE A 147 -22.919 -23.615 18.755 1.00 14.15 C ATOM 1346 O ILE A 147 -21.983 -24.304 18.322 1.00 14.15 O ATOM 1347 CB ILE A 147 -23.264 -21.335 17.782 1.00 13.76 C ATOM 1348 CG1 ILE A 147 -23.984 -20.536 16.690 1.00 13.75 C ATOM 1349 CG2 ILE A 147 -21.755 -21.273 17.492 1.00 14.03 C ATOM 1350 CD1 ILE A 147 -23.816 -19.035 16.793 1.00 13.73 C ATOM 1351 H ILE A 147 -25.704 -22.066 18.442 1.00 0.00 H ATOM 1352 N LYS A 148 -23.218 -23.571 20.047 1.00 14.74 N ATOM 1353 CA LYS A 148 -22.468 -24.354 20.994 1.00 15.57 C ATOM 1354 C LYS A 148 -22.620 -25.865 20.803 1.00 16.31 C ATOM 1355 O LYS A 148 -21.668 -26.596 20.929 1.00 16.16 O ATOM 1356 CB LYS A 148 -22.851 -23.900 22.419 1.00 16.56 C ATOM 1357 CG LYS A 148 -22.068 -24.589 23.486 1.00 17.69 C ATOM 1358 CD LYS A 148 -20.549 -24.568 23.277 1.00 18.10 C ATOM 1359 CE LYS A 148 -19.775 -24.870 24.556 1.00 19.53 C ATOM 1360 NZ LYS A 148 -20.166 -26.150 25.205 1.00 20.52 N ATOM 1361 HZ1 LYS A 148 -21.175 -26.117 25.454 1.00 0.00 H ATOM 1362 HZ2 LYS A 148 -19.996 -26.937 24.547 1.00 0.00 H ATOM 1363 HZ3 LYS A 148 -19.599 -26.288 26.066 1.00 0.00 H ATOM 1364 H LYS A 148 -23.998 -22.968 20.377 1.00 0.00 H ATOM 1365 N LYS A 149 -23.807 -26.309 20.448 1.00 16.49 N ATOM 1366 CA LYS A 149 -23.968 -27.727 20.076 1.00 17.33 C ATOM 1367 C LYS A 149 -23.082 -28.113 18.879 1.00 16.50 C ATOM 1368 O LYS A 149 -22.526 -29.197 18.824 1.00 16.46 O ATOM 1369 CB LYS A 149 -25.420 -28.050 19.816 1.00 18.54 C ATOM 1370 CG LYS A 149 -26.217 -28.066 21.082 1.00 20.90 C ATOM 1371 CD LYS A 149 -27.639 -28.385 20.744 1.00 22.72 C ATOM 1372 CE LYS A 149 -28.563 -28.081 21.872 1.00 24.92 C ATOM 1373 NZ LYS A 149 -30.016 -27.925 21.533 1.00 25.78 N ATOM 1374 HZ1 LYS A 149 -30.131 -27.144 20.856 1.00 0.00 H ATOM 1375 HZ2 LYS A 149 -30.369 -28.807 21.110 1.00 0.00 H ATOM 1376 HZ3 LYS A 149 -30.552 -27.716 22.399 1.00 0.00 H ATOM 1377 H LYS A 149 -24.624 -25.666 20.430 1.00 0.00 H ATOM 1378 N GLY A 150 -22.927 -27.203 17.930 1.00 15.38 N ATOM 1379 CA GLY A 150 -21.986 -27.440 16.832 1.00 14.14 C ATOM 1380 C GLY A 150 -20.550 -27.522 17.308 1.00 14.50 C ATOM 1381 O GLY A 150 -19.795 -28.399 16.914 1.00 13.69 O ATOM 1382 H GLY A 150 -23.474 -26.319 17.964 1.00 0.00 H ATOM 1383 N ILE A 151 -20.151 -26.596 18.180 1.00 14.74 N ATOM 1384 CA ILE A 151 -18.799 -26.644 18.748 1.00 15.50 C ATOM 1385 C ILE A 151 -18.556 -27.985 19.446 1.00 16.60 C ATOM 1386 O ILE A 151 -17.521 -28.613 19.215 1.00 16.92 O ATOM 1387 CB ILE A 151 -18.554 -25.440 19.704 1.00 15.95 C ATOM 1388 CG1 ILE A 151 -18.547 -24.110 18.908 1.00 15.60 C ATOM 1389 CG2 ILE A 151 -17.236 -25.594 20.452 1.00 16.60 C ATOM 1390 CD1 ILE A 151 -18.641 -22.853 19.771 1.00 15.67 C ATOM 1391 H ILE A 151 -20.802 -25.835 18.459 1.00 0.00 H ATOM 1392 N ASP A 152 -19.531 -28.415 20.252 1.00 17.30 N ATOM 1393 CA ASP A 152 -19.446 -29.672 20.983 1.00 18.50 C ATOM 1394 C ASP A 152 -19.284 -30.842 20.018 1.00 17.56 C ATOM 1395 O ASP A 152 -18.478 -31.744 20.255 1.00 18.94 O ATOM 1396 CB ASP A 152 -20.708 -29.915 21.825 1.00 19.77 C ATOM 1397 CG ASP A 152 -20.954 -28.870 22.932 1.00 20.81 C ATOM 1398 OD1 ASP A 152 -19.995 -28.170 23.374 1.00 22.20 O ATOM 1399 OD2 ASP A 152 -22.169 -28.817 23.347 1.00 21.25 O ATOM 1400 H ASP A 152 -20.384 -27.830 20.362 1.00 0.00 H ATOM 1401 N ALA A 153 -20.015 -30.806 18.917 1.00 16.14 N ATOM 1402 CA ALA A 153 -19.929 -31.875 17.932 1.00 15.57 C ATOM 1403 C ALA A 153 -18.555 -31.986 17.269 1.00 15.18 C ATOM 1404 O ALA A 153 -18.136 -33.096 16.943 1.00 15.96 O ATOM 1405 CB ALA A 153 -21.001 -31.712 16.860 1.00 15.16 C ATOM 1406 H ALA A 153 -20.658 -30.006 18.753 1.00 0.00 H ATOM 1407 N PHE A 154 -17.859 -30.878 17.061 1.00 14.77 N ATOM 1408 CA PHE A 154 -16.569 -30.905 16.381 1.00 15.06 C ATOM 1409 C PHE A 154 -15.338 -30.796 17.252 1.00 17.01 C ATOM 1410 O PHE A 154 -14.219 -30.898 16.754 1.00 17.66 O ATOM 1411 CB PHE A 154 -16.530 -29.826 15.273 1.00 13.45 C ATOM 1412 CG PHE A 154 -17.443 -30.134 14.124 1.00 12.29 C ATOM 1413 CD1 PHE A 154 -17.004 -30.929 13.090 1.00 12.10 C ATOM 1414 CD2 PHE A 154 -18.762 -29.707 14.128 1.00 11.77 C ATOM 1415 CE1 PHE A 154 -17.848 -31.243 12.059 1.00 11.39 C ATOM 1416 CE2 PHE A 154 -19.613 -30.032 13.087 1.00 11.33 C ATOM 1417 CZ PHE A 154 -19.153 -30.769 12.036 1.00 11.01 C ATOM 1418 H PHE A 154 -18.241 -29.968 17.390 1.00 0.00 H ATOM 1419 N ALA A 155 -15.548 -30.562 18.545 1.00 19.51 N ATOM 1420 CA ALA A 155 -14.441 -30.317 19.461 1.00 22.03 C ATOM 1421 C ALA A 155 -13.493 -31.490 19.473 1.00 24.51 C ATOM 1422 O ALA A 155 -13.914 -32.625 19.569 1.00 24.40 O ATOM 1423 CB ALA A 155 -14.971 -30.046 20.862 1.00 22.79 C ATOM 1424 H ALA A 155 -16.522 -30.554 18.909 1.00 0.00 H ATOM 1425 N GLY A 156 -12.219 -31.191 19.257 1.00 27.81 N ATOM 1426 CA GLY A 156 -11.179 -32.195 19.240 1.00 29.66 C ATOM 1427 C GLY A 156 -11.111 -33.174 18.065 1.00 30.28 C ATOM 1428 O GLY A 156 -10.343 -34.120 18.114 1.00 32.67 O ATOM 1429 H GLY A 156 -11.959 -30.197 19.094 1.00 0.00 H ATOM 1430 N THR A 157 -11.859 -32.936 16.989 1.00 28.41 N ATOM 1431 CA THR A 157 -11.916 -33.861 15.844 1.00 28.15 C ATOM 1432 C THR A 157 -10.890 -33.574 14.746 1.00 29.51 C ATOM 1433 O THR A 157 -10.885 -34.265 13.727 1.00 29.45 O ATOM 1434 CB THR A 157 -13.313 -33.859 15.194 1.00 26.41 C ATOM 1435 OG1 THR A 157 -13.599 -32.559 14.686 1.00 25.24 O ATOM 1436 CG2 THR A 157 -14.369 -34.248 16.193 1.00 26.55 C ATOM 1437 HG1 THR A 157 -13.579 -31.904 15.428 1.00 0.00 H ATOM 1438 H THR A 157 -12.424 -32.064 16.956 1.00 0.00 H ATOM 1439 N GLY A 158 -10.022 -32.575 14.929 1.00 31.76 N ATOM 1440 CA GLY A 158 -9.021 -32.246 13.921 1.00 34.06 C ATOM 1441 C GLY A 158 -7.849 -33.199 13.884 1.00 38.63 C ATOM 1442 O GLY A 158 -7.731 -34.062 14.757 1.00 39.92 O ATOM 1443 H GLY A 158 -10.061 -32.021 15.808 1.00 0.00 H ATOM 1444 N PRO A 159 -6.988 -33.061 12.855 1.00 42.21 N ATOM 1445 CA PRO A 159 -5.791 -33.916 12.770 1.00 43.68 C ATOM 1446 C PRO A 159 -4.773 -33.607 13.867 1.00 44.89 C ATOM 1447 O PRO A 159 -4.805 -32.533 14.455 1.00 45.35 O ATOM 1448 CB PRO A 159 -5.210 -33.616 11.381 1.00 43.91 C ATOM 1449 CG PRO A 159 -6.146 -32.667 10.697 1.00 42.80 C ATOM 1450 CD PRO A 159 -7.174 -32.195 11.668 1.00 41.79 C TER 1451 PRO A 159 HETATM 1452 O HOH 1 -38.761 -19.796 8.394 1.00 39.40 O HETATM 1453 O HOH 2 -24.083 -4.714 7.772 1.00 28.82 O HETATM 1454 O HOH 3 -7.958 -27.005 1.296 1.00 31.12 O HETATM 1455 O HOH 4 -28.073 0.856 21.661 1.00 34.53 O HETATM 1456 O HOH 5 -8.230 -31.271 0.913 1.00 30.83 O HETATM 1457 O HOH 6 -13.522 -14.842 17.279 1.00 17.72 O HETATM 1458 O HOH 7 -22.179 -37.167 9.692 1.00 16.85 O HETATM 1459 O HOH 8 -17.467 -28.693 23.713 1.00 35.12 O HETATM 1460 O HOH 9 -30.460 -10.548 21.614 1.00 24.73 O HETATM 1461 O HOH 10 -32.846 -9.286 22.015 1.00 23.47 O HETATM 1462 O HOH 11 -22.644 -7.305 5.426 1.00 32.84 O HETATM 1463 O HOH 12 -31.763 -29.281 15.386 1.00 31.34 O HETATM 1464 O HOH 13 -30.083 -26.489 19.319 1.00 33.68 O HETATM 1465 O HOH 14 -19.645 -20.373 -4.924 1.00 35.74 O HETATM 1466 O HOH 15 -36.492 -19.915 15.273 1.00 35.54 O HETATM 1467 O HOH 16 -42.283 -15.653 9.776 1.00 32.74 O HETATM 1468 O HOH 17 -23.342 -1.468 22.403 1.00 44.71 O HETATM 1469 O HOH 18 -22.989 -20.129 22.597 1.00 18.48 O HETATM 1470 O HOH 19 -31.433 -30.136 5.544 1.00 17.60 O HETATM 1471 O HOH 20 -31.094 -21.087 4.618 1.00 19.94 O HETATM 1472 O HOH 21 -23.503 -33.201 -4.289 1.00 26.75 O HETATM 1473 O HOH 22 -21.566 -0.946 7.749 1.00 39.84 O HETATM 1474 O HOH 23 -15.355 -31.375 -1.808 1.00 22.68 O HETATM 1475 O HOH 24 -27.611 -16.369 24.493 1.00 34.16 O HETATM 1476 O HOH 25 -23.743 -31.478 19.604 1.00 26.40 O HETATM 1477 O HOH 26 -19.133 -22.082 -2.479 1.00 24.33 O HETATM 1478 O HOH 27 -43.246 -9.626 10.760 1.00 25.75 O HETATM 1479 O HOH 28 -41.866 0.025 24.256 1.00 32.67 O HETATM 1480 O HOH 29 -45.448 -9.139 23.463 1.00 16.44 O HETATM 1481 O HOH 30 -22.169 -5.753 21.121 1.00 20.95 O HETATM 1482 O HOH 31 -21.786 -17.931 3.166 1.00 9.83 O HETATM 1483 O HOH 32 -20.641 -6.286 23.454 1.00 40.70 O HETATM 1484 O HOH 33 -27.453 -15.446 19.049 1.00 24.20 O HETATM 1485 O HOH 34 -39.686 5.376 5.277 1.00 25.62 O HETATM 1486 O HOH 35 -31.275 -24.070 19.653 1.00 25.12 O HETATM 1487 O HOH 36 -16.000 -18.922 21.071 1.00 24.37 O HETATM 1488 O HOH 37 -20.746 -28.452 -1.269 1.00 11.27 O HETATM 1489 O HOH 38 -23.915 -30.910 23.086 1.00 29.54 O HETATM 1490 O HOH 39 -24.812 2.816 13.547 1.00 31.99 O HETATM 1491 O HOH 40 -10.853 -33.740 11.032 1.00 17.17 O HETATM 1492 O HOH 41 -31.925 2.737 8.772 1.00 28.93 O HETATM 1493 O HOH 42 -18.293 -27.032 27.020 1.00 25.18 O HETATM 1494 O HOH 43 -35.336 -23.280 4.566 1.00 29.05 O HETATM 1495 O HOH 44 -30.374 -30.572 9.013 1.00 20.82 O HETATM 1496 O HOH 45 -33.444 -19.398 17.718 1.00 19.49 O HETATM 1497 O HOH 46 -24.612 -7.371 7.802 1.00 18.83 O HETATM 1498 O HOH 47 -41.060 -9.066 26.141 1.00 24.65 O HETATM 1499 O HOH 48 -9.623 -33.031 2.495 1.00 25.32 O HETATM 1500 O HOH 49 -7.183 -29.642 6.262 1.00 37.88 O HETATM 1501 O HOH 50 -23.483 -35.802 13.696 1.00 27.89 O HETATM 1502 O HOH 51 -36.499 7.658 9.506 1.00 39.51 O HETATM 1503 O HOH 52 -23.141 -16.803 20.307 1.00 15.32 O HETATM 1504 O HOH 53 -23.499 -11.533 2.848 1.00 22.64 O HETATM 1505 O HOH 54 -34.062 -9.087 24.500 1.00 21.41 O HETATM 1506 O HOH 55 -25.803 -25.359 23.810 1.00 21.20 O HETATM 1507 O HOH 56 -28.838 -14.226 23.631 1.00 29.90 O HETATM 1508 O HOH 57 -34.675 -20.340 23.205 1.00 35.59 O HETATM 1509 O HOH 58 -18.990 -33.183 -1.627 1.00 10.51 O HETATM 1510 O HOH 59 -12.529 -16.788 3.531 1.00 30.26 O HETATM 1511 O HOH 60 -9.153 -29.538 10.891 1.00 15.97 O HETATM 1512 O HOH 61 -13.556 -27.056 -1.499 1.00 18.95 O HETATM 1513 O HOH 62 -33.903 -6.420 25.331 1.00 26.23 O HETATM 1514 O HOH 63 -19.989 -11.042 4.331 1.00 23.99 O HETATM 1515 O HOH 64 -29.970 -26.320 15.236 1.00 21.44 O HETATM 1516 O HOH 65 -34.743 -24.643 11.377 1.00 20.85 O HETATM 1517 O HOH 66 -15.515 -13.708 15.690 1.00 20.52 O HETATM 1518 O HOH 67 -34.236 -7.812 5.044 1.00 31.51 O HETATM 1519 O HOH 68 -46.727 4.303 5.791 1.00 26.49 O HETATM 1520 O HOH 69 -28.485 -29.752 17.286 1.00 26.16 O HETATM 1521 O HOH 70 -21.315 -26.703 -3.414 1.00 15.23 O HETATM 1522 O HOH 71 -26.995 -1.620 7.530 1.00 34.81 O HETATM 1523 O HOH 72 -20.819 -3.646 20.202 1.00 33.19 O HETATM 1524 O HOH 73 -9.342 -40.357 5.001 1.00 29.12 O HETATM 1525 O HOH 74 -17.255 -20.799 -0.845 1.00 16.27 O HETATM 1526 O HOH 75 -16.123 -37.154 17.866 1.00 44.77 O HETATM 1527 O HOH 76 -10.977 -22.685 10.160 1.00 18.47 O HETATM 1528 O HOH 77 -19.327 -1.433 16.934 1.00 33.95 O HETATM 1529 O HOH 78 -51.297 4.067 11.725 1.00 31.33 O HETATM 1530 O HOH 79 -24.134 -27.267 24.783 1.00 20.69 O HETATM 1531 O HOH 80 -26.149 -31.238 5.387 1.00 14.52 O HETATM 1532 O HOH 81 -29.540 -5.013 26.804 1.00 36.76 O HETATM 1533 O HOH 82 -17.083 -22.470 23.017 1.00 31.56 O HETATM 1534 O HOH 83 -40.409 1.306 8.682 1.00 39.18 O HETATM 1535 O HOH 84 -39.050 2.743 4.448 1.00 34.44 O HETATM 1536 O HOH 85 -9.244 -30.593 16.913 1.00 44.31 O HETATM 1537 O HOH 86 -35.990 -4.446 25.556 1.00 38.54 O HETATM 1538 O HOH 87 -34.625 -0.835 23.451 1.00 31.38 O HETATM 1539 O HOH 88 -30.006 -30.845 21.414 1.00 35.55 O HETATM 1540 O HOH 89 -9.149 -26.913 16.540 1.00 33.40 O HETATM 1541 O HOH 90 -37.231 0.370 22.192 1.00 35.75 O HETATM 1542 O HOH 91 -27.140 -34.382 2.195 1.00 35.74 O HETATM 1543 O HOH 92 -35.156 -13.240 6.486 1.00 28.07 O HETATM 1544 O HOH 93 -11.202 -21.640 2.981 1.00 28.09 O HETATM 1545 O HOH 94 -16.552 -33.906 19.780 1.00 30.71 O HETATM 1546 O HOH 95 -22.714 -25.789 26.618 1.00 18.25 O HETATM 1547 O HOH 96 -12.078 -18.329 21.390 1.00 33.34 O HETATM 1548 O HOH 97 -25.323 -15.008 20.467 1.00 19.54 O HETATM 1549 O HOH 98 -8.302 -25.023 4.556 1.00 43.24 O HETATM 1550 O HOH 99 -8.551 -22.724 11.392 1.00 29.79 O HETATM 1551 O HOH 100 -12.493 -13.726 4.802 1.00 22.80 O HETATM 1552 O HOH 101 -39.048 -0.268 24.734 1.00 26.29 O HETATM 1553 O HOH 102 -19.852 -27.751 -7.395 1.00 50.17 O HETATM 1554 O HOH 103 -15.212 -13.621 0.977 1.00 37.12 O HETATM 1555 O HOH 104 -9.758 -38.470 3.463 1.00 28.24 O HETATM 1556 O HOH 105 -10.828 -14.898 19.734 1.00 30.58 O HETATM 1557 O HOH 106 -10.897 -20.126 6.884 1.00 27.35 O HETATM 1558 O HOH 107 -25.526 -30.653 -9.155 1.00 31.07 O HETATM 1559 O HOH 108 -21.866 -37.873 3.001 1.00 24.93 O HETATM 1560 O HOH 109 -6.052 -25.345 14.506 1.00 30.23 O HETATM 1561 O HOH 110 -14.908 -15.676 2.760 1.00 34.08 O HETATM 1562 O HOH 111 -26.364 -37.513 9.320 1.00 38.33 O HETATM 1563 O HOH 112 -42.397 1.171 21.547 1.00 39.40 O HETATM 1564 O HOH 113 -17.955 -18.003 -0.015 1.00 23.04 O HETATM 1565 O HOH 114 -29.553 -32.644 1.323 1.00 31.93 O HETATM 1566 O HOH 115 -55.999 7.088 6.870 1.00 40.22 O HETATM 1567 O HOH 116 -26.575 -34.458 -0.950 1.00 30.75 O HETATM 1568 O HOH 117 -28.485 -32.732 6.077 1.00 29.35 O HETATM 1569 O HOH 118 -1.659 -32.267 15.016 1.00 35.46 O HETATM 1570 O HOH 119 -22.536 -38.154 12.423 1.00 34.15 O HETATM 1571 O HOH 120 -25.396 -11.813 23.821 1.00 32.22 O HETATM 1572 O HOH 121 -25.186 0.829 21.801 1.00 46.66 O HETATM 1573 O HOH 122 -20.676 -17.338 0.722 1.00 17.07 O HETATM 1574 O HOH 123 -38.309 4.871 18.072 1.00 44.79 O HETATM 1575 O HOH 124 -21.149 -31.058 -5.122 1.00 36.23 O HETATM 1576 O HOH 125 -33.090 -26.983 12.154 1.00 28.59 O HETATM 1577 O HOH 126 -25.162 -20.270 24.446 1.00 22.38 O HETATM 1578 O HOH 127 -12.655 -22.254 -1.267 1.00 28.24 O HETATM 1579 O HOH 128 -20.388 -33.450 -3.962 1.00 18.77 O HETATM 1580 O HOH 129 -36.593 -24.063 7.050 1.00 48.71 O HETATM 1581 O HOH 130 -20.492 -8.450 4.973 1.00 32.12 O HETATM 1582 O HOH 131 -18.079 -11.079 2.464 1.00 26.30 O HETATM 1583 O HOH 132 -38.845 -1.176 2.301 1.00 37.20 O HETATM 1584 O HOH 133 -10.742 -35.039 1.294 1.00 29.65 O HETATM 1585 O HOH 134 -30.891 -2.348 26.707 1.00 40.00 O HETATM 1586 O HOH 135 -49.298 11.159 13.843 1.00 45.68 O HETATM 1587 O HOH 136 -22.995 -37.606 5.737 1.00 41.33 O HETATM 1588 O HOH 137 -26.011 -14.392 23.098 1.00 23.53 O HETATM 1589 O HOH 138 -12.753 -24.659 -2.908 1.00 31.43 O HETATM 1590 O HOH 139 -18.776 -26.463 -4.599 1.00 34.68 O HETATM 1591 O HOH 140 -32.914 -26.877 14.942 1.00 39.59 O HETATM 1592 O HOH 141 -22.505 -35.194 16.487 1.00 32.14 O HETATM 1593 O HOH 142 -6.756 -28.508 11.549 1.00 30.38 O HETATM 1594 O HOH 143 -25.919 -32.635 -5.593 1.00 38.10 O HETATM 1595 O HOH 144 -15.735 -16.273 -0.062 1.00 33.20 O HETATM 1596 O HOH 145 -40.937 -22.663 14.205 1.00 29.93 O HETATM 1597 O HOH 146 -35.104 -21.164 19.054 1.00 26.48 O HETATM 1598 O HOH 147 -30.570 -32.035 3.507 1.00 38.00 O HETATM 1599 O HOH 148 -5.365 -25.300 11.641 1.00 45.14 O HETATM 1600 O HOH 149 -9.423 -15.167 22.125 1.00 28.67 O HETATM 1601 O HOH 150 -27.623 -35.740 5.448 1.00 39.11 O HETATM 1602 O HOH 151 -14.906 -20.762 -2.155 1.00 24.02 O HETATM 1603 O HOH 152 -26.558 -31.694 18.642 1.00 25.56 O HETATM 1604 O HOH 153 -22.659 -12.761 0.475 1.00 29.34 O HETATM 1605 O HOH 154 -34.066 -23.950 19.111 1.00 37.15 O HETATM 1606 O HOH 155 -26.026 -35.753 15.534 1.00 38.68 O HETATM 1607 O HOH 156 -24.281 -33.756 18.061 1.00 39.87 O HETATM 1608 O HOH 157 -27.564 -32.498 21.144 1.00 44.12 O HETATM 1609 O HOH 158 -20.916 -14.935 -0.598 1.00 35.10 O HETATM 1610 O HOH 159 -13.854 -17.830 -1.540 1.00 33.08 O HETATM 1611 C1 ACD A 160 -29.190 -12.112 17.749 1.00 0.03 C HETATM 1612 C2 ACD A 160 -28.030 -11.911 16.809 1.00 0.00 C HETATM 1613 C3 ACD A 160 -27.314 -13.240 16.570 1.00 -0.03 C HETATM 1614 C4 ACD A 160 -26.258 -13.138 15.503 1.00 -0.03 C HETATM 1615 C5 ACD A 160 -26.949 -13.156 14.168 1.00 -0.10 C HETATM 1616 C6 ACD A 160 -26.599 -13.939 13.162 1.00 -0.09 C HETATM 1617 C7 ACD A 160 -25.457 -14.921 13.235 1.00 -0.02 C HETATM 1618 C8 ACD A 160 -25.665 -15.915 12.133 1.00 -0.09 C HETATM 1619 C9 ACD A 160 -25.078 -17.101 12.083 1.00 -0.09 C HETATM 1620 C10 ACD A 160 -24.100 -17.666 13.086 1.00 -0.02 C HETATM 1621 C11 ACD A 160 -24.698 -18.977 13.516 1.00 -0.09 C HETATM 1622 C12 ACD A 160 -24.356 -20.193 13.085 1.00 -0.09 C HETATM 1623 C13 ACD A 160 -23.285 -20.544 12.079 1.00 -0.02 C HETATM 1624 C14 ACD A 160 -23.819 -21.669 11.210 1.00 -0.09 C HETATM 1625 C15 ACD A 160 -23.159 -22.203 10.177 1.00 -0.10 C HETATM 1626 C16 ACD A 160 -21.798 -21.760 9.700 1.00 -0.04 C HETATM 1627 C17 ACD A 160 -20.762 -22.773 10.165 1.00 -0.05 C HETATM 1628 C18 ACD A 160 -19.558 -22.830 9.254 1.00 -0.05 C HETATM 1629 C19 ACD A 160 -18.490 -23.710 9.885 1.00 -0.06 C HETATM 1630 C20 ACD A 160 -17.499 -24.109 8.825 1.00 -0.07 C HETATM 1631 H29 ACD A 160 -16.721 -24.746 9.271 1.00 0.02 H HETATM 1632 H30 ACD A 160 -17.034 -23.207 8.399 1.00 0.02 H HETATM 1633 H31 ACD A 160 -18.017 -24.665 8.030 1.00 0.02 H HETATM 1634 H27 ACD A 160 -18.957 -24.610 10.311 1.00 0.03 H HETATM 1635 H28 ACD A 160 -17.975 -23.152 10.681 1.00 0.03 H HETATM 1636 H25 ACD A 160 -19.159 -21.815 9.109 1.00 0.03 H HETATM 1637 H26 ACD A 160 -19.853 -23.251 8.281 1.00 0.03 H HETATM 1638 H23 ACD A 160 -21.230 -23.768 10.194 1.00 0.03 H HETATM 1639 H24 ACD A 160 -20.427 -22.496 11.175 1.00 0.03 H HETATM 1640 H21 ACD A 160 -21.563 -20.771 10.120 1.00 0.04 H HETATM 1641 H22 ACD A 160 -21.792 -21.703 8.601 1.00 0.04 H HETATM 1642 H20 ACD A 160 -23.640 -23.019 9.640 1.00 0.05 H HETATM 1643 H19 ACD A 160 -24.805 -22.067 11.444 1.00 0.05 H HETATM 1644 H17 ACD A 160 -22.374 -20.874 12.601 1.00 0.05 H HETATM 1645 H18 ACD A 160 -23.054 -19.667 11.456 1.00 0.05 H HETATM 1646 H16 ACD A 160 -24.913 -21.028 13.507 1.00 0.05 H HETATM 1647 H15 ACD A 160 -25.494 -18.929 14.257 1.00 0.05 H HETATM 1648 H13 ACD A 160 -23.994 -16.989 13.946 1.00 0.05 H HETATM 1649 H14 ACD A 160 -23.116 -17.824 12.620 1.00 0.05 H HETATM 1650 H12 ACD A 160 -25.326 -17.734 11.232 1.00 0.05 H HETATM 1651 H11 ACD A 160 -26.341 -15.645 11.323 1.00 0.05 H HETATM 1652 H9 ACD A 160 -25.459 -15.431 14.210 1.00 0.05 H HETATM 1653 H10 ACD A 160 -24.499 -14.398 13.097 1.00 0.05 H HETATM 1654 H8 ACD A 160 -27.164 -13.871 12.233 1.00 0.05 H HETATM 1655 H7 ACD A 160 -27.791 -12.481 14.020 1.00 0.05 H HETATM 1656 H5 ACD A 160 -25.567 -13.991 15.578 1.00 0.04 H HETATM 1657 H6 ACD A 160 -25.697 -12.199 15.621 1.00 0.04 H HETATM 1658 H3 ACD A 160 -28.056 -13.991 16.262 1.00 0.03 H HETATM 1659 H4 ACD A 160 -26.838 -13.559 17.509 1.00 0.03 H HETATM 1660 H1 ACD A 160 -27.325 -11.191 17.250 1.00 0.04 H HETATM 1661 H2 ACD A 160 -28.402 -11.520 15.850 1.00 0.04 H HETATM 1662 O1 ACD A 160 -29.451 -13.270 18.141 1.00 -0.57 O HETATM 1663 O2 ACD A 160 -29.852 -11.119 18.112 1.00 -0.57 O CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1611 1612 1662 1663 CONECT 1612 1611 1613 1660 1661 CONECT 1613 1612 1614 1658 1659 CONECT 1614 1613 1615 1656 1657 CONECT 1615 1614 1616 1655 CONECT 1616 1615 1617 1654 CONECT 1617 1616 1618 1652 1653 CONECT 1618 1617 1619 1651 CONECT 1619 1618 1620 1650 CONECT 1620 1619 1621 1648 1649 CONECT 1621 1620 1622 1647 CONECT 1622 1621 1623 1646 CONECT 1623 1622 1624 1644 1645 CONECT 1624 1623 1625 1643 CONECT 1625 1624 1626 1642 CONECT 1626 1625 1627 1640 1641 CONECT 1627 1626 1628 1638 1639 CONECT 1628 1627 1629 1636 1637 CONECT 1629 1628 1630 1634 1635 CONECT 1630 1629 1631 1632 1633 CONECT 1631 1630 CONECT 1632 1630 CONECT 1633 1630 CONECT 1634 1629 CONECT 1635 1629 CONECT 1636 1628 CONECT 1637 1628 CONECT 1638 1627 CONECT 1639 1627 CONECT 1640 1626 CONECT 1641 1626 CONECT 1642 1625 CONECT 1643 1624 CONECT 1644 1623 CONECT 1645 1623 CONECT 1646 1622 CONECT 1647 1621 CONECT 1648 1620 CONECT 1649 1620 CONECT 1650 1619 CONECT 1651 1618 CONECT 1652 1617 CONECT 1653 1617 CONECT 1654 1616 CONECT 1655 1615 CONECT 1656 1614 CONECT 1657 1614 CONECT 1658 1613 CONECT 1659 1613 CONECT 1660 1612 CONECT 1661 1612 CONECT 1662 1611 CONECT 1663 1611 MASTER 0 0 0 0 0 0 0 0 1662 1 57 13 END
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Structure:
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Related entries of code: 5csd
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3l1n
RCSB PDB
PDBbind
194aa, >3L1N_1|Chain... *
5fb7
RCSB PDB
PDBbind
155aa, >5FB7_1|Chains... at 94%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1adl
RCSB PDB
PDBbind
ACD
1gnj
RCSB PDB
PDBbind
ACD
1vyg
RCSB PDB
PDBbind
ACD
2lbv
RCSB PDB
PDBbind
ACD
5fb7
RCSB PDB
PDBbind
ACD
Entry Information
PDB ID
5csd
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Mp1p ligand binding domain
Ligand Name
ACD
EC.Number
E.C.-.-.-.-
Resolution
1.45(Å)
Affinity (Kd/Ki/IC50)
Kd=13nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Cell Chem Biol Vol. 24: pp. 182-194
Ligand Properties
Formula
C
2
0
H
3
2
O
2
Molecular Weight
304.467
Exact Mass
304.240
No. of atoms
54
No. of bonds
53
Polar Surface Area
37.3
LOGP Value
7.73 (
Computed with XLOGP3
)
6.22 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 0
Canonical SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O
InChI String
InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A0A093VKV7
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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