Browse entries in the PDBbind-CN Database
HEADER 5Q0F_COMPLEX COMPND 5Q0F_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 238 ILE VAL GLY GLY THR ALA SER VAL ARG GLY GLU TRP PRO SEQRES 2 A 238 TRP GLN VAL THR LEU HIS THR THR SER PRO THR GLN ARG SEQRES 3 A 238 HIS LEU CYS GLY GLY SER ILE ILE GLY ASN GLN TRP ILE SEQRES 4 A 238 LEU THR ALA ALA HIS CYS PHE TYR GLY VAL GLU SER PRO SEQRES 5 A 238 LYS ILE LEU ARG VAL TYR SER GLY ILE LEU ASN GLN SER SEQRES 6 A 238 GLU ILE LYS GLU ASP THR SER PHE PHE GLY VAL GLN GLU SEQRES 7 A 238 ILE ILE ILE HIS ASP GLN TYR LYS MET ALA GLU SER GLY SEQRES 8 A 238 TYR ASP ILE ALA LEU LEU LYS LEU GLU THR THR VAL GLY SEQRES 9 A 238 TYR GLY ASP SER GLN ARG PRO ILE CYS LEU PRO SER LYS SEQRES 10 A 238 GLY ASP ARG ASN VAL ILE TYR THR ASP CYS TRP VAL THR SEQRES 11 A 238 GLY TRP GLY TYR ARG LYS LEU ARG ASP LYS ILE GLN ASN SEQRES 12 A 238 THR LEU GLN LYS ALA LYS ILE PRO LEU VAL THR ASN GLU SEQRES 13 A 238 GLU CYS GLN LYS ARG TYR ARG GLY HIS LYS ILE THR HIS SEQRES 14 A 238 LYS MET ILE CYS ALA GLY TYR ARG GLU GLY GLY LYS ASP SEQRES 15 A 238 ALA CYS LYS GLY ASP SER GLY GLY PRO LEU SER CYS LYS SEQRES 16 A 238 HIS ASN GLU VAL TRP HIS LEU VAL GLY ILE THR SER TRP SEQRES 17 A 238 GLY GLU GLY CYS ALA GLN ARG GLU ARG PRO GLY VAL TYR SEQRES 18 A 238 THR ASN VAL VAL GLU TYR VAL ASP TRP ILE LEU GLU LYS SEQRES 19 A 238 THR GLN ALA VAL HET UNN A 432 71 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 168 CYS A 182 SSBOND 3 CYS A 136 CYS A 201 SSBOND 4 CYS A 191 CYS A 219 ATOM 1 N ILE A 16 42.095 -11.607 33.968 1.00 18.20 N ATOM 2 CA ILE A 16 41.212 -10.432 34.053 1.00 18.15 C ATOM 3 C ILE A 16 41.939 -9.273 33.402 1.00 23.26 C ATOM 4 O ILE A 16 43.107 -9.031 33.720 1.00 21.05 O ATOM 5 CB ILE A 16 40.790 -10.075 35.528 1.00 20.46 C ATOM 6 CG1 ILE A 16 40.047 -11.248 36.255 1.00 21.01 C ATOM 7 CG2 ILE A 16 39.940 -8.749 35.614 1.00 20.14 C ATOM 8 CD1 ILE A 16 38.648 -11.640 35.672 1.00 15.03 C ATOM 9 HN3 ILE A 16 42.985 -11.407 34.468 1.00 0.00 H ATOM 10 HN2 ILE A 16 42.296 -11.817 32.969 1.00 0.00 H ATOM 11 HN1 ILE A 16 41.626 -12.424 34.407 1.00 0.00 H ATOM 12 N VAL A 17 41.252 -8.566 32.499 1.00 21.75 N ATOM 13 CA VAL A 17 41.805 -7.384 31.805 1.00 21.40 C ATOM 14 C VAL A 17 41.258 -6.141 32.530 1.00 24.67 C ATOM 15 O VAL A 17 40.072 -6.090 32.839 1.00 22.70 O ATOM 16 CB VAL A 17 41.398 -7.335 30.296 1.00 23.97 C ATOM 17 CG1 VAL A 17 42.089 -6.162 29.578 1.00 24.09 C ATOM 18 CG2 VAL A 17 41.683 -8.652 29.582 1.00 22.90 C ATOM 19 H VAL A 17 40.281 -8.862 32.274 1.00 0.00 H ATOM 20 N GLY A 18 42.117 -5.165 32.779 1.00 22.97 N ATOM 21 CA GLY A 18 41.718 -3.904 33.397 1.00 22.78 C ATOM 22 C GLY A 18 41.286 -4.040 34.836 1.00 25.54 C ATOM 23 O GLY A 18 40.561 -3.190 35.341 1.00 25.07 O ATOM 24 H GLY A 18 43.116 -5.302 32.524 1.00 0.00 H ATOM 25 N GLY A 19 41.746 -5.088 35.509 1.00 22.54 N ATOM 26 CA GLY A 19 41.366 -5.286 36.901 1.00 22.20 C ATOM 27 C GLY A 19 42.407 -4.793 37.887 1.00 26.61 C ATOM 28 O GLY A 19 43.405 -4.182 37.499 1.00 24.21 O ATOM 29 H GLY A 19 42.379 -5.768 35.042 1.00 0.00 H ATOM 30 N THR A 20 42.161 -5.030 39.178 1.00 23.94 N ATOM 31 CA THR A 20 43.102 -4.668 40.228 1.00 25.17 C ATOM 32 C THR A 20 43.177 -5.856 41.170 1.00 27.92 C ATOM 33 O THR A 20 42.297 -6.716 41.167 1.00 25.07 O ATOM 34 CB THR A 20 42.706 -3.377 40.975 1.00 38.58 C ATOM 35 OG1 THR A 20 41.405 -3.546 41.533 1.00 39.82 O ATOM 36 CG2 THR A 20 42.758 -2.121 40.092 1.00 43.49 C ATOM 37 HG1 THR A 20 41.144 -2.721 42.014 1.00 0.00 H ATOM 38 H THR A 20 41.266 -5.489 39.442 1.00 0.00 H ATOM 39 N ALA A 21 44.239 -5.897 41.966 1.00 25.30 N ATOM 40 CA ALA A 21 44.481 -6.935 42.943 1.00 24.76 C ATOM 41 C ALA A 21 43.336 -6.995 43.929 1.00 27.10 C ATOM 42 O ALA A 21 42.869 -5.967 44.410 1.00 26.35 O ATOM 43 CB ALA A 21 45.782 -6.635 43.693 1.00 25.64 C ATOM 44 H ALA A 21 44.941 -5.134 41.881 1.00 0.00 H ATOM 45 N SER A 22 42.884 -8.207 44.232 1.00 24.31 N ATOM 46 CA SER A 22 41.894 -8.421 45.274 1.00 23.76 C ATOM 47 C SER A 22 42.623 -8.380 46.625 1.00 27.02 C ATOM 48 O SER A 22 43.858 -8.460 46.696 1.00 24.95 O ATOM 49 CB SER A 22 41.226 -9.781 45.111 1.00 25.90 C ATOM 50 OG SER A 22 40.431 -9.766 43.938 1.00 31.94 O ATOM 51 HG SER A 22 41.006 -9.579 43.154 1.00 0.00 H ATOM 52 H SER A 22 43.250 -9.027 43.708 1.00 0.00 H ATOM 53 N VAL A 23 41.847 -8.246 47.677 1.00 25.69 N ATOM 54 CA VAL A 23 42.313 -8.270 49.058 1.00 27.78 C ATOM 55 C VAL A 23 42.017 -9.714 49.546 1.00 29.34 C ATOM 56 O VAL A 23 41.013 -10.310 49.123 1.00 27.80 O ATOM 57 CB VAL A 23 41.551 -7.167 49.866 1.00 33.56 C ATOM 58 CG1 VAL A 23 41.668 -7.367 51.373 1.00 34.56 C ATOM 59 CG2 VAL A 23 42.057 -5.774 49.479 1.00 33.69 C ATOM 60 H VAL A 23 40.829 -8.113 47.513 1.00 0.00 H ATOM 61 N ARG A 24 42.860 -10.262 50.446 1.00 24.38 N ATOM 62 CA ARG A 24 42.613 -11.596 50.962 1.00 23.47 C ATOM 63 C ARG A 24 41.241 -11.637 51.647 1.00 26.09 C ATOM 64 O ARG A 24 40.907 -10.732 52.414 1.00 25.62 O ATOM 65 CB ARG A 24 43.728 -12.047 51.909 1.00 23.04 C ATOM 66 CG ARG A 24 43.573 -13.518 52.338 1.00 24.95 C ATOM 67 CD ARG A 24 44.686 -13.998 53.270 1.00 23.98 C ATOM 68 NE ARG A 24 45.978 -13.893 52.596 1.00 24.33 N ATOM 69 CZ ARG A 24 46.458 -14.804 51.760 1.00 33.14 C ATOM 70 NH1 ARG A 24 45.796 -15.934 51.546 1.00 19.99 N ATOM 71 NH2 ARG A 24 47.601 -14.595 51.134 1.00 22.19 N ATOM 72 HE ARG A 24 46.558 -13.050 52.784 1.00 0.00 H ATOM 73 HH12 ARG A 24 46.178 -16.644 50.889 1.00 0.00 H ATOM 74 HH11 ARG A 24 44.895 -16.110 52.035 1.00 0.00 H ATOM 75 HH22 ARG A 24 47.974 -15.312 50.479 1.00 0.00 H ATOM 76 HH21 ARG A 24 48.129 -13.713 51.295 1.00 0.00 H ATOM 77 H ARG A 24 43.690 -9.726 50.771 1.00 0.00 H ATOM 78 N GLY A 25 40.452 -12.644 51.295 1.00 23.13 N ATOM 79 CA GLY A 25 39.114 -12.881 51.840 1.00 23.09 C ATOM 80 C GLY A 25 37.981 -12.163 51.151 1.00 26.70 C ATOM 81 O GLY A 25 36.818 -12.335 51.532 1.00 26.91 O ATOM 82 H GLY A 25 40.809 -13.312 50.582 1.00 0.00 H ATOM 83 N GLU A 26 38.300 -11.347 50.145 1.00 22.26 N ATOM 84 CA GLU A 26 37.311 -10.587 49.374 1.00 21.42 C ATOM 85 C GLU A 26 36.309 -11.473 48.610 1.00 25.86 C ATOM 86 O GLU A 26 35.116 -11.141 48.553 1.00 24.72 O ATOM 87 CB GLU A 26 38.023 -9.693 48.358 1.00 21.92 C ATOM 88 CG GLU A 26 37.362 -8.348 48.259 1.00 28.51 C ATOM 89 CD GLU A 26 38.004 -7.354 47.322 1.00 35.22 C ATOM 90 OE1 GLU A 26 39.226 -7.448 47.062 1.00 27.89 O ATOM 91 OE2 GLU A 26 37.271 -6.454 46.865 1.00 40.35 O ATOM 92 H GLU A 26 39.304 -11.244 49.894 1.00 0.00 H ATOM 93 N TRP A 27 36.798 -12.566 47.989 1.00 18.94 N ATOM 94 CA TRP A 27 35.956 -13.457 47.166 1.00 18.51 C ATOM 95 C TRP A 27 36.138 -14.871 47.727 1.00 21.59 C ATOM 96 O TRP A 27 36.831 -15.688 47.109 1.00 19.46 O ATOM 97 CB TRP A 27 36.431 -13.360 45.685 1.00 16.70 C ATOM 98 CG TRP A 27 36.595 -11.933 45.220 1.00 17.59 C ATOM 99 CD1 TRP A 27 37.768 -11.259 45.031 1.00 20.10 C ATOM 100 CD2 TRP A 27 35.537 -10.982 44.967 1.00 17.30 C ATOM 101 NE1 TRP A 27 37.508 -9.943 44.666 1.00 19.12 N ATOM 102 CE2 TRP A 27 36.149 -9.761 44.587 1.00 20.54 C ATOM 103 CE3 TRP A 27 34.127 -11.060 44.985 1.00 18.98 C ATOM 104 CZ2 TRP A 27 35.407 -8.626 44.236 1.00 19.82 C ATOM 105 CZ3 TRP A 27 33.391 -9.943 44.614 1.00 20.96 C ATOM 106 CH2 TRP A 27 34.029 -8.732 44.281 1.00 21.50 C ATOM 107 HE1 TRP A 27 38.227 -9.214 44.482 1.00 0.00 H ATOM 108 H TRP A 27 37.808 -12.790 48.094 1.00 0.00 H ATOM 109 N PRO A 28 35.646 -15.139 48.971 1.00 19.09 N ATOM 110 CA PRO A 28 35.965 -16.420 49.636 1.00 17.65 C ATOM 111 C PRO A 28 35.351 -17.676 49.003 1.00 22.94 C ATOM 112 O PRO A 28 35.753 -18.794 49.362 1.00 21.38 O ATOM 113 CB PRO A 28 35.487 -16.186 51.070 1.00 18.68 C ATOM 114 CG PRO A 28 34.401 -15.206 50.954 1.00 22.32 C ATOM 115 CD PRO A 28 34.848 -14.272 49.867 1.00 19.37 C ATOM 116 N TRP A 29 34.441 -17.502 48.019 1.00 18.96 N ATOM 117 CA TRP A 29 33.867 -18.619 47.252 1.00 18.82 C ATOM 118 C TRP A 29 34.744 -18.922 46.040 1.00 20.74 C ATOM 119 O TRP A 29 34.606 -19.984 45.459 1.00 17.91 O ATOM 120 CB TRP A 29 32.448 -18.296 46.783 1.00 18.11 C ATOM 121 CG TRP A 29 32.330 -16.916 46.202 1.00 20.03 C ATOM 122 CD1 TRP A 29 32.497 -16.556 44.898 1.00 22.58 C ATOM 123 CD2 TRP A 29 32.013 -15.712 46.916 1.00 20.76 C ATOM 124 NE1 TRP A 29 32.359 -15.198 44.762 1.00 22.59 N ATOM 125 CE2 TRP A 29 32.047 -14.652 45.982 1.00 24.03 C ATOM 126 CE3 TRP A 29 31.667 -15.430 48.256 1.00 22.13 C ATOM 127 CZ2 TRP A 29 31.679 -13.343 46.322 1.00 23.05 C ATOM 128 CZ3 TRP A 29 31.370 -14.117 48.604 1.00 23.75 C ATOM 129 CH2 TRP A 29 31.398 -13.089 47.647 1.00 24.36 C ATOM 130 HE1 TRP A 29 32.473 -14.667 43.875 1.00 0.00 H ATOM 131 H TRP A 29 34.132 -16.535 47.794 1.00 0.00 H ATOM 132 N GLN A 30 35.668 -18.010 45.671 1.00 18.73 N ATOM 133 CA GLN A 30 36.557 -18.232 44.522 1.00 17.12 C ATOM 134 C GLN A 30 37.550 -19.362 44.786 1.00 19.55 C ATOM 135 O GLN A 30 38.242 -19.343 45.798 1.00 16.98 O ATOM 136 CB GLN A 30 37.325 -16.937 44.139 1.00 17.85 C ATOM 137 CG GLN A 30 38.398 -17.176 43.015 1.00 19.08 C ATOM 138 CD GLN A 30 37.858 -17.041 41.611 1.00 20.80 C ATOM 139 OE1 GLN A 30 37.341 -15.996 41.250 1.00 19.83 O ATOM 140 NE2 GLN A 30 38.040 -18.047 40.741 1.00 13.74 N ATOM 141 HE22 GLN A 30 38.481 -18.934 41.057 1.00 0.00 H ATOM 142 HE21 GLN A 30 37.740 -17.939 39.751 1.00 0.00 H ATOM 143 H GLN A 30 35.753 -17.127 46.214 1.00 0.00 H ATOM 144 N VAL A 31 37.647 -20.333 43.847 1.00 15.79 N ATOM 145 CA VAL A 31 38.654 -21.379 43.930 1.00 13.75 C ATOM 146 C VAL A 31 39.529 -21.368 42.700 1.00 17.81 C ATOM 147 O VAL A 31 39.151 -20.845 41.656 1.00 17.01 O ATOM 148 CB VAL A 31 38.116 -22.817 44.224 1.00 17.37 C ATOM 149 CG1 VAL A 31 37.308 -22.862 45.514 1.00 16.79 C ATOM 150 CG2 VAL A 31 37.348 -23.411 43.035 1.00 17.15 C ATOM 151 H VAL A 31 36.984 -20.331 43.046 1.00 0.00 H ATOM 152 N THR A 32 40.696 -21.997 42.821 1.00 16.96 N ATOM 153 CA THR A 32 41.580 -22.269 41.704 1.00 17.70 C ATOM 154 C THR A 32 41.592 -23.772 41.528 1.00 22.26 C ATOM 155 O THR A 32 41.929 -24.519 42.463 1.00 19.12 O ATOM 156 CB THR A 32 42.975 -21.633 41.839 1.00 26.47 C ATOM 157 OG1 THR A 32 43.804 -22.135 40.794 1.00 23.84 O ATOM 158 CG2 THR A 32 43.624 -21.897 43.192 1.00 24.03 C ATOM 159 HG1 THR A 32 43.408 -21.899 39.918 1.00 0.00 H ATOM 160 H THR A 32 40.990 -22.310 43.768 1.00 0.00 H ATOM 161 N LEU A 33 41.165 -24.212 40.338 1.00 20.22 N ATOM 162 CA LEU A 33 41.172 -25.626 39.983 1.00 20.49 C ATOM 163 C LEU A 33 42.458 -25.899 39.216 1.00 22.37 C ATOM 164 O LEU A 33 42.763 -25.212 38.232 1.00 20.01 O ATOM 165 CB LEU A 33 39.900 -25.994 39.170 1.00 21.74 C ATOM 166 CG LEU A 33 39.851 -27.386 38.512 1.00 28.36 C ATOM 167 CD1 LEU A 33 39.667 -28.508 39.564 1.00 28.38 C ATOM 168 CD2 LEU A 33 38.705 -27.459 37.504 1.00 30.00 C ATOM 169 H LEU A 33 40.816 -23.521 39.643 1.00 0.00 H ATOM 170 N HIS A 34 43.254 -26.861 39.720 1.00 18.05 N ATOM 171 CA HIS A 34 44.502 -27.270 39.088 1.00 17.55 C ATOM 172 C HIS A 34 44.375 -28.660 38.509 1.00 24.17 C ATOM 173 O HIS A 34 43.562 -29.478 38.961 1.00 22.20 O ATOM 174 CB HIS A 34 45.676 -27.291 40.113 1.00 17.72 C ATOM 175 CG HIS A 34 46.232 -25.950 40.473 1.00 20.02 C ATOM 176 ND1 HIS A 34 47.584 -25.774 40.711 1.00 21.34 N ATOM 177 CD2 HIS A 34 45.597 -24.760 40.636 1.00 20.22 C ATOM 178 CE1 HIS A 34 47.738 -24.476 40.949 1.00 19.95 C ATOM 179 NE2 HIS A 34 46.562 -23.832 40.933 1.00 20.07 N ATOM 180 H HIS A 34 42.965 -27.334 40.600 1.00 0.00 H ATOM 181 N THR A 35 45.206 -28.929 37.502 1.00 23.16 N ATOM 182 CA THR A 35 45.353 -30.251 36.922 1.00 23.26 C ATOM 183 C THR A 35 46.789 -30.678 37.294 1.00 27.95 C ATOM 184 O THR A 35 47.654 -29.800 37.373 1.00 25.88 O ATOM 185 CB THR A 35 45.041 -30.257 35.400 1.00 28.99 C ATOM 186 OG1 THR A 35 45.172 -31.600 34.929 1.00 33.90 O ATOM 187 CG2 THR A 35 45.960 -29.353 34.575 1.00 22.90 C ATOM 188 HG1 THR A 35 44.977 -31.629 33.959 1.00 0.00 H ATOM 189 H THR A 35 45.778 -28.152 37.112 1.00 0.00 H ATOM 190 N THR A 36 47.050 -31.970 37.564 1.00 25.92 N ATOM 191 CA THR A 36 48.409 -32.475 37.846 1.00 27.84 C ATOM 192 C THR A 36 49.031 -33.117 36.594 1.00 35.89 C ATOM 193 O THR A 36 50.212 -33.430 36.628 1.00 35.50 O ATOM 194 CB THR A 36 48.214 -33.515 38.965 1.00 26.95 C ATOM 195 OG1 THR A 36 47.310 -34.515 38.533 1.00 31.12 O ATOM 196 CG2 THR A 36 47.770 -32.925 40.288 1.00 21.06 C ATOM 197 HG1 THR A 36 46.439 -34.099 38.315 1.00 0.00 H ATOM 198 H THR A 36 46.258 -32.644 37.575 1.00 0.00 H ATOM 199 N SER A 36A 48.267 -33.308 35.500 1.00 36.37 N ATOM 200 CA SER A 36A 48.699 -33.949 34.244 1.00 38.36 C ATOM 201 C SER A 36A 48.916 -32.997 33.062 1.00 43.37 C ATOM 202 O SER A 36A 47.992 -32.266 32.713 1.00 43.27 O ATOM 203 CB SER A 36A 47.586 -34.968 33.980 1.00 45.42 C ATOM 204 OG SER A 36A 47.880 -35.704 32.804 1.00 59.75 O ATOM 205 HG SER A 36A 47.158 -36.361 32.638 1.00 0.00 H ATOM 206 H SER A 36A 47.284 -32.973 35.546 1.00 0.00 H ATOM 207 N PRO A 36B 50.115 -32.967 32.421 1.00 40.59 N ATOM 208 CA PRO A 36B 51.325 -33.761 32.707 1.00 39.47 C ATOM 209 C PRO A 36B 52.090 -33.264 33.929 1.00 40.88 C ATOM 210 O PRO A 36B 52.741 -34.064 34.604 1.00 40.97 O ATOM 211 CB PRO A 36B 52.109 -33.689 31.388 1.00 41.29 C ATOM 212 CG PRO A 36B 51.750 -32.350 30.808 1.00 46.38 C ATOM 213 CD PRO A 36B 50.328 -32.049 31.278 1.00 42.24 C ATOM 214 N THR A 37 52.023 -31.941 34.204 1.00 33.97 N ATOM 215 CA THR A 37 52.613 -31.283 35.381 1.00 32.09 C ATOM 216 C THR A 37 51.517 -30.408 36.027 1.00 32.14 C ATOM 217 O THR A 37 50.495 -30.131 35.396 1.00 31.10 O ATOM 218 CB THR A 37 53.889 -30.483 35.040 1.00 41.93 C ATOM 219 OG1 THR A 37 53.544 -29.372 34.212 1.00 43.81 O ATOM 220 CG2 THR A 37 54.969 -31.336 34.378 1.00 41.12 C ATOM 221 HG1 THR A 37 54.362 -28.859 33.993 1.00 0.00 H ATOM 222 H THR A 37 51.512 -31.339 33.527 1.00 0.00 H ATOM 223 N GLN A 38 51.700 -30.021 37.281 1.00 27.76 N ATOM 224 CA GLN A 38 50.676 -29.250 37.958 1.00 26.06 C ATOM 225 C GLN A 38 50.626 -27.801 37.533 1.00 27.95 C ATOM 226 O GLN A 38 51.655 -27.099 37.540 1.00 25.99 O ATOM 227 CB GLN A 38 50.756 -29.365 39.477 1.00 27.31 C ATOM 228 CG GLN A 38 49.474 -28.798 40.140 1.00 24.55 C ATOM 229 CD GLN A 38 49.456 -28.912 41.640 1.00 36.38 C ATOM 230 OE1 GLN A 38 49.857 -29.923 42.195 1.00 32.72 O ATOM 231 NE2 GLN A 38 48.877 -27.923 42.322 1.00 23.91 N ATOM 232 HE22 GLN A 38 48.545 -27.073 41.824 1.00 0.00 H ATOM 233 HE21 GLN A 38 48.758 -28.002 43.352 1.00 0.00 H ATOM 234 H GLN A 38 52.578 -30.270 37.779 1.00 0.00 H ATOM 235 N ARG A 39 49.397 -27.347 37.173 1.00 22.32 N ATOM 236 CA ARG A 39 49.157 -25.967 36.742 1.00 21.40 C ATOM 237 C ARG A 39 47.707 -25.573 36.990 1.00 23.56 C ATOM 238 O ARG A 39 46.839 -26.446 37.003 1.00 23.07 O ATOM 239 CB ARG A 39 49.504 -25.791 35.237 1.00 22.63 C ATOM 240 CG ARG A 39 48.672 -26.659 34.274 1.00 31.60 C ATOM 241 CD ARG A 39 48.531 -26.078 32.875 1.00 47.61 C ATOM 242 NE ARG A 39 47.366 -26.646 32.185 1.00 54.40 N ATOM 243 CZ ARG A 39 46.886 -26.227 31.016 1.00 57.18 C ATOM 244 NH1 ARG A 39 47.468 -25.226 30.369 1.00 42.79 N ATOM 245 NH2 ARG A 39 45.819 -26.808 30.487 1.00 39.15 N ATOM 246 HE ARG A 39 46.877 -27.439 32.646 1.00 0.00 H ATOM 247 HH12 ARG A 39 47.086 -24.905 29.456 1.00 0.00 H ATOM 248 HH11 ARG A 39 48.306 -24.762 30.774 1.00 0.00 H ATOM 249 HH22 ARG A 39 45.447 -26.478 29.574 1.00 0.00 H ATOM 250 HH21 ARG A 39 45.354 -27.594 30.985 1.00 0.00 H ATOM 251 H ARG A 39 48.593 -28.006 37.205 1.00 0.00 H ATOM 252 N HIS A 40 47.444 -24.265 37.119 1.00 18.59 N ATOM 253 CA HIS A 40 46.096 -23.732 37.248 1.00 18.28 C ATOM 254 C HIS A 40 45.372 -24.110 35.915 1.00 22.82 C ATOM 255 O HIS A 40 45.965 -23.994 34.835 1.00 22.06 O ATOM 256 CB HIS A 40 46.167 -22.207 37.400 1.00 17.66 C ATOM 257 CG HIS A 40 44.856 -21.509 37.152 1.00 20.31 C ATOM 258 ND1 HIS A 40 43.939 -21.312 38.174 1.00 20.36 N ATOM 259 CD2 HIS A 40 44.376 -20.936 36.015 1.00 21.64 C ATOM 260 CE1 HIS A 40 42.909 -20.681 37.623 1.00 20.22 C ATOM 261 NE2 HIS A 40 43.121 -20.438 36.324 1.00 20.95 N ATOM 262 H HIS A 40 48.242 -23.598 37.127 1.00 0.00 H ATOM 263 N LEU A 41 44.139 -24.592 36.011 1.00 19.47 N ATOM 264 CA LEU A 41 43.316 -24.981 34.859 1.00 18.89 C ATOM 265 C LEU A 41 42.151 -24.010 34.656 1.00 23.68 C ATOM 266 O LEU A 41 41.915 -23.532 33.544 1.00 24.86 O ATOM 267 CB LEU A 41 42.757 -26.400 35.082 1.00 18.95 C ATOM 268 CG LEU A 41 41.893 -26.999 33.969 1.00 22.30 C ATOM 269 CD1 LEU A 41 42.763 -27.398 32.768 1.00 21.07 C ATOM 270 CD2 LEU A 41 41.058 -28.164 34.515 1.00 21.13 C ATOM 271 H LEU A 41 43.731 -24.701 36.961 1.00 0.00 H ATOM 272 N CYS A 42 41.411 -23.730 35.725 1.00 19.93 N ATOM 273 CA CYS A 42 40.186 -22.932 35.645 1.00 18.77 C ATOM 274 C CYS A 42 39.889 -22.356 37.009 1.00 20.58 C ATOM 275 O CYS A 42 40.418 -22.826 38.013 1.00 20.01 O ATOM 276 CB CYS A 42 39.026 -23.840 35.207 1.00 18.54 C ATOM 277 SG CYS A 42 38.820 -24.010 33.413 1.00 22.24 S ATOM 278 H CYS A 42 41.714 -24.091 36.652 1.00 0.00 H ATOM 279 N GLY A 43 38.970 -21.409 37.029 1.00 17.59 N ATOM 280 CA GLY A 43 38.369 -20.878 38.245 1.00 17.01 C ATOM 281 C GLY A 43 37.159 -21.736 38.581 1.00 19.30 C ATOM 282 O GLY A 43 36.779 -22.645 37.822 1.00 17.73 O ATOM 283 H GLY A 43 38.655 -21.017 36.119 1.00 0.00 H ATOM 284 N GLY A 44 36.572 -21.469 39.727 1.00 16.01 N ATOM 285 CA GLY A 44 35.379 -22.152 40.216 1.00 15.90 C ATOM 286 C GLY A 44 34.823 -21.417 41.418 1.00 20.77 C ATOM 287 O GLY A 44 35.484 -20.514 41.952 1.00 18.62 O ATOM 288 H GLY A 44 36.985 -20.723 40.323 1.00 0.00 H ATOM 289 N SER A 45 33.607 -21.795 41.849 1.00 17.72 N ATOM 290 CA SER A 45 32.957 -21.177 43.001 1.00 16.96 C ATOM 291 C SER A 45 32.442 -22.229 43.960 1.00 21.22 C ATOM 292 O SER A 45 31.792 -23.185 43.526 1.00 19.79 O ATOM 293 CB SER A 45 31.769 -20.316 42.565 1.00 18.76 C ATOM 294 OG SER A 45 32.129 -19.267 41.688 1.00 21.63 O ATOM 295 HG SER A 45 32.538 -19.647 40.870 1.00 0.00 H ATOM 296 H SER A 45 33.111 -22.556 41.343 1.00 0.00 H ATOM 297 N ILE A 46 32.689 -22.037 45.270 1.00 18.83 N ATOM 298 CA ILE A 46 32.121 -22.913 46.307 1.00 17.69 C ATOM 299 C ILE A 46 30.619 -22.599 46.365 1.00 20.52 C ATOM 300 O ILE A 46 30.252 -21.438 46.557 1.00 20.04 O ATOM 301 CB ILE A 46 32.764 -22.651 47.702 1.00 20.17 C ATOM 302 CG1 ILE A 46 34.280 -22.939 47.685 1.00 20.22 C ATOM 303 CG2 ILE A 46 32.029 -23.473 48.792 1.00 19.82 C ATOM 304 CD1 ILE A 46 35.098 -22.339 48.882 1.00 20.38 C ATOM 305 H ILE A 46 33.300 -21.246 45.557 1.00 0.00 H ATOM 306 N ILE A 47 29.752 -23.607 46.215 1.00 19.00 N ATOM 307 CA ILE A 47 28.306 -23.356 46.319 1.00 18.29 C ATOM 308 C ILE A 47 27.652 -24.203 47.447 1.00 23.16 C ATOM 309 O ILE A 47 26.490 -24.000 47.767 1.00 21.96 O ATOM 310 CB ILE A 47 27.555 -23.487 44.972 1.00 20.71 C ATOM 311 CG1 ILE A 47 27.680 -24.911 44.384 1.00 20.35 C ATOM 312 CG2 ILE A 47 27.983 -22.384 43.973 1.00 21.43 C ATOM 313 CD1 ILE A 47 26.550 -25.291 43.469 1.00 22.00 C ATOM 314 H ILE A 47 30.100 -24.568 46.025 1.00 0.00 H ATOM 315 N GLY A 48 28.409 -25.140 48.002 1.00 20.69 N ATOM 316 CA GLY A 48 27.975 -26.070 49.048 1.00 19.97 C ATOM 317 C GLY A 48 29.218 -26.680 49.659 1.00 25.18 C ATOM 318 O GLY A 48 30.322 -26.477 49.132 1.00 21.41 O ATOM 319 H GLY A 48 29.390 -25.221 47.668 1.00 0.00 H ATOM 320 N ASN A 49 29.080 -27.441 50.773 1.00 25.00 N ATOM 321 CA ASN A 49 30.302 -27.888 51.470 1.00 25.50 C ATOM 322 C ASN A 49 31.029 -29.032 50.778 1.00 27.53 C ATOM 323 O ASN A 49 32.166 -29.299 51.143 1.00 25.32 O ATOM 324 CB ASN A 49 30.095 -28.152 52.960 1.00 26.87 C ATOM 325 CG ASN A 49 29.227 -29.307 53.349 1.00 50.50 C ATOM 326 OD1 ASN A 49 28.668 -30.039 52.517 1.00 39.39 O ATOM 327 ND2 ASN A 49 29.113 -29.489 54.658 1.00 47.70 N ATOM 328 HD22 ASN A 49 29.601 -28.849 55.316 1.00 0.00 H ATOM 329 HD21 ASN A 49 28.536 -30.272 55.026 1.00 0.00 H ATOM 330 H ASN A 49 28.138 -27.703 51.127 1.00 0.00 H ATOM 331 N GLN A 50 30.480 -29.576 49.677 1.00 22.85 N ATOM 332 CA GLN A 50 31.267 -30.547 48.908 1.00 22.49 C ATOM 333 C GLN A 50 31.106 -30.229 47.416 1.00 24.07 C ATOM 334 O GLN A 50 31.318 -31.087 46.572 1.00 23.59 O ATOM 335 CB GLN A 50 30.883 -32.005 49.283 1.00 23.20 C ATOM 336 CG GLN A 50 29.445 -32.396 48.922 1.00 40.09 C ATOM 337 CD GLN A 50 29.079 -33.837 49.265 1.00 59.83 C ATOM 338 OE1 GLN A 50 29.936 -34.704 49.525 1.00 50.83 O ATOM 339 NE2 GLN A 50 27.775 -34.116 49.275 1.00 50.40 N ATOM 340 HE22 GLN A 50 27.082 -33.372 49.054 1.00 0.00 H ATOM 341 HE21 GLN A 50 27.451 -35.077 49.504 1.00 0.00 H ATOM 342 H GLN A 50 29.519 -29.314 49.377 1.00 0.00 H ATOM 343 N TRP A 51 30.726 -28.987 47.106 1.00 21.30 N ATOM 344 CA TRP A 51 30.368 -28.589 45.752 1.00 22.02 C ATOM 345 C TRP A 51 31.021 -27.327 45.210 1.00 22.26 C ATOM 346 O TRP A 51 30.877 -26.229 45.769 1.00 18.34 O ATOM 347 CB TRP A 51 28.834 -28.431 45.650 1.00 21.84 C ATOM 348 CG TRP A 51 28.066 -29.692 45.938 1.00 23.70 C ATOM 349 CD1 TRP A 51 27.344 -29.975 47.065 1.00 26.72 C ATOM 350 CD2 TRP A 51 27.938 -30.837 45.076 1.00 23.23 C ATOM 351 NE1 TRP A 51 26.783 -31.228 46.962 1.00 26.67 N ATOM 352 CE2 TRP A 51 27.142 -31.786 45.756 1.00 27.70 C ATOM 353 CE3 TRP A 51 28.400 -31.141 43.779 1.00 24.39 C ATOM 354 CZ2 TRP A 51 26.779 -33.017 45.176 1.00 27.10 C ATOM 355 CZ3 TRP A 51 28.046 -32.362 43.204 1.00 25.56 C ATOM 356 CH2 TRP A 51 27.247 -33.285 43.899 1.00 26.18 C ATOM 357 HE1 TRP A 51 26.183 -31.681 47.681 1.00 0.00 H ATOM 358 H TRP A 51 30.684 -28.275 47.863 1.00 0.00 H ATOM 359 N ILE A 52 31.627 -27.491 44.033 1.00 18.80 N ATOM 360 CA ILE A 52 32.235 -26.422 43.230 1.00 17.20 C ATOM 361 C ILE A 52 31.449 -26.289 41.935 1.00 20.74 C ATOM 362 O ILE A 52 31.243 -27.294 41.232 1.00 20.39 O ATOM 363 CB ILE A 52 33.733 -26.698 42.915 1.00 18.53 C ATOM 364 CG1 ILE A 52 34.542 -26.947 44.215 1.00 18.58 C ATOM 365 CG2 ILE A 52 34.332 -25.555 42.012 1.00 15.58 C ATOM 366 CD1 ILE A 52 34.499 -25.751 45.259 1.00 18.91 C ATOM 367 H ILE A 52 31.673 -28.458 43.652 1.00 0.00 H ATOM 368 N LEU A 53 30.994 -25.058 41.625 1.00 17.07 N ATOM 369 CA LEU A 53 30.303 -24.804 40.359 1.00 15.47 C ATOM 370 C LEU A 53 31.350 -24.167 39.439 1.00 20.08 C ATOM 371 O LEU A 53 32.075 -23.248 39.856 1.00 19.71 O ATOM 372 CB LEU A 53 29.101 -23.887 40.527 1.00 14.57 C ATOM 373 CG LEU A 53 28.156 -23.804 39.309 1.00 18.37 C ATOM 374 CD1 LEU A 53 27.480 -25.147 39.037 1.00 16.84 C ATOM 375 CD2 LEU A 53 27.118 -22.711 39.507 1.00 19.39 C ATOM 376 H LEU A 53 31.136 -24.276 42.296 1.00 0.00 H ATOM 377 N THR A 54 31.449 -24.677 38.214 1.00 16.49 N ATOM 378 CA THR A 54 32.459 -24.243 37.247 1.00 16.59 C ATOM 379 C THR A 54 31.943 -24.420 35.820 1.00 19.11 C ATOM 380 O THR A 54 30.744 -24.668 35.626 1.00 16.93 O ATOM 381 CB THR A 54 33.813 -24.947 37.541 1.00 20.55 C ATOM 382 OG1 THR A 54 34.854 -24.375 36.740 1.00 17.62 O ATOM 383 CG2 THR A 54 33.752 -26.469 37.332 1.00 17.34 C ATOM 384 HG1 THR A 54 34.938 -23.411 36.949 1.00 0.00 H ATOM 385 H THR A 54 30.777 -25.419 37.930 1.00 0.00 H ATOM 386 N ALA A 55 32.832 -24.239 34.823 1.00 15.78 N ATOM 387 CA ALA A 55 32.432 -24.360 33.422 1.00 16.47 C ATOM 388 C ALA A 55 32.704 -25.781 32.904 1.00 20.21 C ATOM 389 O ALA A 55 33.747 -26.357 33.198 1.00 19.94 O ATOM 390 CB ALA A 55 33.162 -23.313 32.563 1.00 16.96 C ATOM 391 H ALA A 55 33.820 -24.009 35.054 1.00 0.00 H ATOM 392 N ALA A 56 31.767 -26.331 32.120 1.00 16.62 N ATOM 393 CA ALA A 56 31.921 -27.650 31.507 1.00 17.09 C ATOM 394 C ALA A 56 33.122 -27.697 30.567 1.00 19.99 C ATOM 395 O ALA A 56 33.817 -28.714 30.534 1.00 20.64 O ATOM 396 CB ALA A 56 30.650 -28.012 30.738 1.00 17.73 C ATOM 397 H ALA A 56 30.893 -25.797 31.940 1.00 0.00 H ATOM 398 N HIS A 57 33.409 -26.603 29.822 1.00 16.00 N ATOM 399 CA HIS A 57 34.534 -26.619 28.857 1.00 16.14 C ATOM 400 C HIS A 57 35.914 -26.818 29.508 1.00 19.48 C ATOM 401 O HIS A 57 36.867 -27.209 28.825 1.00 18.62 O ATOM 402 CB HIS A 57 34.537 -25.398 27.941 1.00 16.57 C ATOM 403 CG HIS A 57 35.094 -24.168 28.581 1.00 18.70 C ATOM 404 ND1 HIS A 57 34.284 -23.123 28.928 1.00 19.80 N ATOM 405 CD2 HIS A 57 36.370 -23.860 28.901 1.00 19.55 C ATOM 406 CE1 HIS A 57 35.080 -22.188 29.416 1.00 19.02 C ATOM 407 NE2 HIS A 57 36.343 -22.604 29.458 1.00 19.54 N ATOM 408 H HIS A 57 32.834 -25.743 29.928 1.00 0.00 H ATOM 409 N CYS A 58 36.010 -26.587 30.825 1.00 17.11 N ATOM 410 CA CYS A 58 37.252 -26.801 31.585 1.00 17.79 C ATOM 411 C CYS A 58 37.736 -28.259 31.539 1.00 22.38 C ATOM 412 O CYS A 58 38.915 -28.519 31.784 1.00 22.34 O ATOM 413 CB CYS A 58 37.033 -26.365 33.027 1.00 18.01 C ATOM 414 SG CYS A 58 36.880 -24.577 33.221 1.00 21.53 S ATOM 415 H CYS A 58 35.170 -26.241 31.332 1.00 0.00 H ATOM 416 N PHE A 58A 36.815 -29.207 31.297 1.00 17.96 N ATOM 417 CA PHE A 58A 37.168 -30.626 31.359 1.00 18.03 C ATOM 418 C PHE A 58A 37.464 -31.266 29.999 1.00 23.81 C ATOM 419 O PHE A 58A 37.600 -32.497 29.914 1.00 22.71 O ATOM 420 CB PHE A 58A 36.108 -31.393 32.150 1.00 19.12 C ATOM 421 CG PHE A 58A 35.943 -30.697 33.481 1.00 20.76 C ATOM 422 CD1 PHE A 58A 36.913 -30.820 34.471 1.00 23.94 C ATOM 423 CD2 PHE A 58A 34.867 -29.835 33.707 1.00 20.84 C ATOM 424 CE1 PHE A 58A 36.816 -30.095 35.661 1.00 24.43 C ATOM 425 CE2 PHE A 58A 34.760 -29.128 34.901 1.00 23.77 C ATOM 426 CZ PHE A 58A 35.723 -29.274 35.879 1.00 22.39 C ATOM 427 H PHE A 58A 35.840 -28.929 31.063 1.00 0.00 H ATOM 428 N TYR A 58B 37.663 -30.429 28.959 1.00 22.79 N ATOM 429 CA TYR A 58B 38.035 -30.918 27.636 1.00 22.48 C ATOM 430 C TYR A 58B 39.324 -31.745 27.793 1.00 30.15 C ATOM 431 O TYR A 58B 40.311 -31.252 28.343 1.00 30.08 O ATOM 432 CB TYR A 58B 38.237 -29.738 26.669 1.00 23.16 C ATOM 433 CG TYR A 58B 38.607 -30.206 25.278 1.00 24.60 C ATOM 434 CD1 TYR A 58B 37.622 -30.620 24.379 1.00 26.00 C ATOM 435 CD2 TYR A 58B 39.942 -30.368 24.907 1.00 24.84 C ATOM 436 CE1 TYR A 58B 37.954 -31.143 23.132 1.00 26.55 C ATOM 437 CE2 TYR A 58B 40.289 -30.869 23.649 1.00 26.52 C ATOM 438 CZ TYR A 58B 39.285 -31.246 22.762 1.00 32.04 C ATOM 439 OH TYR A 58B 39.579 -31.745 21.521 1.00 32.11 O ATOM 440 HH TYR A 58B 38.738 -31.953 21.043 1.00 0.00 H ATOM 441 H TYR A 58B 37.548 -29.406 29.105 1.00 0.00 H ATOM 442 N GLY A 59 39.271 -33.010 27.395 1.00 29.77 N ATOM 443 CA GLY A 59 40.414 -33.921 27.516 1.00 31.22 C ATOM 444 C GLY A 59 40.687 -34.497 28.910 1.00 38.24 C ATOM 445 O GLY A 59 41.621 -35.291 29.070 1.00 37.69 O ATOM 446 H GLY A 59 38.386 -33.368 26.982 1.00 0.00 H ATOM 447 N VAL A 60 39.906 -34.097 29.952 1.00 33.51 N ATOM 448 CA VAL A 60 40.101 -34.621 31.319 1.00 31.45 C ATOM 449 C VAL A 60 39.396 -35.975 31.359 1.00 37.89 C ATOM 450 O VAL A 60 38.174 -36.054 31.240 1.00 38.07 O ATOM 451 CB VAL A 60 39.623 -33.612 32.418 1.00 31.92 C ATOM 452 CG1 VAL A 60 39.632 -34.231 33.817 1.00 30.35 C ATOM 453 CG2 VAL A 60 40.465 -32.335 32.393 1.00 30.70 C ATOM 454 H VAL A 60 39.151 -33.403 29.780 1.00 0.00 H ATOM 455 N GLU A 61 40.172 -37.042 31.433 1.00 37.51 N ATOM 456 CA GLU A 61 39.621 -38.405 31.409 1.00 38.52 C ATOM 457 C GLU A 61 39.276 -38.934 32.794 1.00 41.79 C ATOM 458 O GLU A 61 38.522 -39.901 32.906 1.00 43.22 O ATOM 459 CB GLU A 61 40.587 -39.365 30.679 1.00 40.25 C ATOM 460 H GLU A 61 41.201 -36.914 31.510 1.00 0.00 H ATOM 461 N SER A 62 39.814 -38.307 33.854 1.00 35.23 N ATOM 462 CA SER A 62 39.558 -38.756 35.221 1.00 33.15 C ATOM 463 C SER A 62 39.556 -37.599 36.235 1.00 31.44 C ATOM 464 O SER A 62 40.393 -36.709 36.124 1.00 28.71 O ATOM 465 CB SER A 62 40.617 -39.785 35.626 1.00 35.87 C ATOM 466 OG SER A 62 40.624 -40.017 37.021 1.00 42.37 O ATOM 467 HG SER A 62 41.320 -40.686 37.240 1.00 0.00 H ATOM 468 H SER A 62 40.428 -37.482 33.698 1.00 0.00 H ATOM 469 N PRO A 63 38.730 -37.659 37.304 1.00 27.63 N ATOM 470 CA PRO A 63 38.800 -36.591 38.332 1.00 26.98 C ATOM 471 C PRO A 63 40.069 -36.699 39.192 1.00 29.21 C ATOM 472 O PRO A 63 40.383 -35.770 39.919 1.00 26.50 O ATOM 473 CB PRO A 63 37.526 -36.800 39.167 1.00 28.39 C ATOM 474 CG PRO A 63 37.162 -38.249 38.981 1.00 33.31 C ATOM 475 CD PRO A 63 37.680 -38.661 37.614 1.00 29.24 C ATOM 476 N LYS A 64 40.790 -37.840 39.110 1.00 27.12 N ATOM 477 CA LYS A 64 42.029 -38.108 39.867 1.00 28.00 C ATOM 478 C LYS A 64 43.140 -37.112 39.600 1.00 29.97 C ATOM 479 O LYS A 64 43.999 -36.944 40.447 1.00 30.05 O ATOM 480 CB LYS A 64 42.540 -39.547 39.640 1.00 31.46 C ATOM 481 CG LYS A 64 41.630 -40.612 40.259 1.00 48.92 C ATOM 482 CD LYS A 64 42.176 -42.018 40.042 1.00 63.85 C ATOM 483 CE LYS A 64 41.197 -43.088 40.460 1.00 82.76 C ATOM 484 NZ LYS A 64 41.789 -44.449 40.333 1.00 96.11 N ATOM 485 HZ1 LYS A 64 42.059 -44.617 39.343 1.00 0.00 H ATOM 486 HZ2 LYS A 64 42.631 -44.517 40.939 1.00 0.00 H ATOM 487 HZ3 LYS A 64 41.089 -45.159 40.628 1.00 0.00 H ATOM 488 H LYS A 64 40.447 -38.582 38.467 1.00 0.00 H ATOM 489 N ILE A 65 43.126 -36.443 38.443 1.00 26.20 N ATOM 490 CA ILE A 65 44.159 -35.449 38.113 1.00 26.36 C ATOM 491 C ILE A 65 43.820 -34.038 38.628 1.00 27.12 C ATOM 492 O ILE A 65 44.627 -33.145 38.466 1.00 26.61 O ATOM 493 CB ILE A 65 44.473 -35.428 36.595 1.00 29.95 C ATOM 494 CG1 ILE A 65 43.231 -34.973 35.777 1.00 30.22 C ATOM 495 CG2 ILE A 65 45.040 -36.811 36.149 1.00 32.08 C ATOM 496 CD1 ILE A 65 43.494 -34.418 34.355 1.00 32.76 C ATOM 497 H ILE A 65 42.366 -36.630 37.759 1.00 0.00 H ATOM 498 N LEU A 65A 42.636 -33.842 39.220 1.00 22.55 N ATOM 499 CA LEU A 65A 42.170 -32.517 39.668 1.00 21.77 C ATOM 500 C LEU A 65A 42.464 -32.201 41.138 1.00 25.36 C ATOM 501 O LEU A 65A 42.370 -33.085 41.984 1.00 24.42 O ATOM 502 CB LEU A 65A 40.644 -32.403 39.435 1.00 21.00 C ATOM 503 CG LEU A 65A 40.128 -32.538 37.989 1.00 23.48 C ATOM 504 CD1 LEU A 65A 38.636 -32.333 37.957 1.00 22.06 C ATOM 505 CD2 LEU A 65A 40.785 -31.499 37.058 1.00 23.45 C ATOM 506 H LEU A 65A 42.016 -34.663 39.371 1.00 0.00 H ATOM 507 N ARG A 65B 42.801 -30.929 41.433 1.00 21.89 N ATOM 508 CA ARG A 65B 43.023 -30.426 42.789 1.00 20.86 C ATOM 509 C ARG A 65B 42.318 -29.101 42.917 1.00 23.20 C ATOM 510 O ARG A 65B 42.505 -28.198 42.091 1.00 22.77 O ATOM 511 CB ARG A 65B 44.512 -30.244 43.126 1.00 19.62 C ATOM 512 CG ARG A 65B 45.262 -31.530 43.225 1.00 23.09 C ATOM 513 CD ARG A 65B 46.726 -31.295 43.485 1.00 25.37 C ATOM 514 NE ARG A 65B 47.352 -32.571 43.804 1.00 29.03 N ATOM 515 CZ ARG A 65B 48.501 -32.703 44.455 1.00 43.14 C ATOM 516 NH1 ARG A 65B 49.198 -31.630 44.816 1.00 28.71 N ATOM 517 NH2 ARG A 65B 48.954 -33.903 44.764 1.00 27.76 N ATOM 518 HE ARG A 65B 46.865 -33.438 43.501 1.00 0.00 H ATOM 519 HH12 ARG A 65B 50.098 -31.742 45.326 1.00 0.00 H ATOM 520 HH11 ARG A 65B 48.844 -30.679 44.589 1.00 0.00 H ATOM 521 HH22 ARG A 65B 49.855 -34.003 45.274 1.00 0.00 H ATOM 522 HH21 ARG A 65B 48.410 -34.749 44.497 1.00 0.00 H ATOM 523 H ARG A 65B 42.910 -30.261 40.644 1.00 0.00 H ATOM 524 N VAL A 66 41.494 -28.984 43.944 1.00 19.40 N ATOM 525 CA VAL A 66 40.739 -27.751 44.198 1.00 17.25 C ATOM 526 C VAL A 66 41.397 -27.019 45.340 1.00 20.21 C ATOM 527 O VAL A 66 41.465 -27.551 46.443 1.00 19.23 O ATOM 528 CB VAL A 66 39.225 -28.035 44.455 1.00 19.57 C ATOM 529 CG1 VAL A 66 38.491 -26.771 44.897 1.00 19.22 C ATOM 530 CG2 VAL A 66 38.563 -28.616 43.203 1.00 19.65 C ATOM 531 H VAL A 66 41.377 -29.790 44.591 1.00 0.00 H ATOM 532 N TYR A 67 41.817 -25.777 45.115 1.00 17.94 N ATOM 533 CA TYR A 67 42.392 -24.990 46.211 1.00 17.05 C ATOM 534 C TYR A 67 41.481 -23.849 46.541 1.00 20.50 C ATOM 535 O TYR A 67 41.106 -23.074 45.648 1.00 19.42 O ATOM 536 CB TYR A 67 43.780 -24.447 45.842 1.00 18.39 C ATOM 537 CG TYR A 67 44.813 -25.530 45.618 1.00 16.54 C ATOM 538 CD1 TYR A 67 45.592 -26.002 46.669 1.00 17.27 C ATOM 539 CD2 TYR A 67 45.066 -26.026 44.340 1.00 16.07 C ATOM 540 CE1 TYR A 67 46.589 -26.956 46.461 1.00 18.15 C ATOM 541 CE2 TYR A 67 46.040 -27.006 44.122 1.00 16.26 C ATOM 542 CZ TYR A 67 46.796 -27.471 45.189 1.00 23.49 C ATOM 543 OH TYR A 67 47.786 -28.407 44.997 1.00 21.77 O ATOM 544 HH TYR A 67 48.214 -28.616 45.865 1.00 0.00 H ATOM 545 H TYR A 67 41.738 -25.365 44.164 1.00 0.00 H ATOM 546 N SER A 68 41.073 -23.774 47.819 1.00 17.60 N ATOM 547 CA SER A 68 40.223 -22.707 48.334 1.00 18.39 C ATOM 548 C SER A 68 41.076 -21.853 49.275 1.00 21.63 C ATOM 549 O SER A 68 42.147 -22.300 49.689 1.00 18.74 O ATOM 550 CB SER A 68 39.030 -23.287 49.097 1.00 19.48 C ATOM 551 OG SER A 68 39.494 -24.103 50.155 1.00 28.50 O ATOM 552 HG SER A 68 40.046 -23.560 50.771 1.00 0.00 H ATOM 553 H SER A 68 41.380 -24.518 48.477 1.00 0.00 H ATOM 554 N GLY A 69 40.581 -20.670 49.631 1.00 17.97 N ATOM 555 CA GLY A 69 41.285 -19.762 50.535 1.00 18.75 C ATOM 556 C GLY A 69 42.609 -19.255 49.985 1.00 24.58 C ATOM 557 O GLY A 69 43.537 -19.002 50.742 1.00 23.81 O ATOM 558 H GLY A 69 39.657 -20.380 49.251 1.00 0.00 H ATOM 559 N ILE A 70 42.721 -19.126 48.661 1.00 21.59 N ATOM 560 CA ILE A 70 43.949 -18.672 48.018 1.00 20.60 C ATOM 561 C ILE A 70 43.781 -17.256 47.513 1.00 23.98 C ATOM 562 O ILE A 70 42.823 -16.996 46.788 1.00 24.12 O ATOM 563 CB ILE A 70 44.355 -19.629 46.845 1.00 23.62 C ATOM 564 CG1 ILE A 70 44.523 -21.099 47.303 1.00 24.00 C ATOM 565 CG2 ILE A 70 45.622 -19.127 46.065 1.00 21.46 C ATOM 566 CD1 ILE A 70 45.705 -21.427 48.358 1.00 26.09 C ATOM 567 H ILE A 70 41.901 -19.358 48.065 1.00 0.00 H ATOM 568 N LEU A 71 44.739 -16.357 47.841 1.00 18.35 N ATOM 569 CA LEU A 71 44.802 -15.043 47.234 1.00 18.53 C ATOM 570 C LEU A 71 45.833 -15.131 46.092 1.00 22.12 C ATOM 571 O LEU A 71 45.563 -14.700 44.968 1.00 20.50 O ATOM 572 CB LEU A 71 45.220 -13.923 48.243 1.00 18.69 C ATOM 573 CG LEU A 71 45.424 -12.507 47.635 1.00 22.86 C ATOM 574 CD1 LEU A 71 44.149 -11.999 46.917 1.00 23.46 C ATOM 575 CD2 LEU A 71 45.925 -11.477 48.684 1.00 19.68 C ATOM 576 H LEU A 71 45.452 -16.618 48.551 1.00 0.00 H ATOM 577 N ASN A 72 47.020 -15.685 46.408 1.00 18.41 N ATOM 578 CA ASN A 72 48.183 -15.777 45.530 1.00 17.79 C ATOM 579 C ASN A 72 48.490 -17.184 45.113 1.00 22.49 C ATOM 580 O ASN A 72 48.537 -18.067 45.959 1.00 22.46 O ATOM 581 CB ASN A 72 49.420 -15.151 46.242 1.00 14.38 C ATOM 582 CG ASN A 72 49.253 -13.656 46.434 1.00 31.84 C ATOM 583 OD1 ASN A 72 48.948 -12.934 45.498 1.00 24.30 O ATOM 584 ND2 ASN A 72 49.454 -13.139 47.637 1.00 17.76 N ATOM 585 HD22 ASN A 72 49.714 -13.757 48.432 1.00 0.00 H ATOM 586 HD21 ASN A 72 49.352 -12.115 47.787 1.00 0.00 H ATOM 587 H ASN A 72 47.117 -16.083 47.364 1.00 0.00 H ATOM 588 N GLN A 73 48.752 -17.404 43.822 1.00 20.20 N ATOM 589 CA GLN A 73 49.100 -18.736 43.330 1.00 21.34 C ATOM 590 C GLN A 73 50.374 -19.266 44.033 1.00 25.13 C ATOM 591 O GLN A 73 50.506 -20.469 44.214 1.00 24.15 O ATOM 592 CB GLN A 73 49.268 -18.717 41.791 1.00 22.84 C ATOM 593 CG GLN A 73 47.931 -18.606 41.005 1.00 22.69 C ATOM 594 CD GLN A 73 47.092 -19.866 41.038 1.00 28.90 C ATOM 595 OE1 GLN A 73 47.597 -20.978 41.180 1.00 25.48 O ATOM 596 NE2 GLN A 73 45.789 -19.735 40.841 1.00 18.70 N ATOM 597 HE22 GLN A 73 45.374 -18.789 40.722 1.00 0.00 H ATOM 598 HE21 GLN A 73 45.181 -20.578 40.805 1.00 0.00 H ATOM 599 H GLN A 73 48.707 -16.610 43.152 1.00 0.00 H ATOM 600 N SER A 74 51.274 -18.362 44.480 1.00 23.26 N ATOM 601 CA SER A 74 52.519 -18.736 45.193 1.00 23.87 C ATOM 602 C SER A 74 52.254 -19.402 46.571 1.00 28.38 C ATOM 603 O SER A 74 53.152 -20.043 47.107 1.00 29.63 O ATOM 604 CB SER A 74 53.436 -17.528 45.341 1.00 25.93 C ATOM 605 OG SER A 74 52.757 -16.506 46.055 1.00 34.99 O ATOM 606 HG SER A 74 53.352 -15.721 46.151 1.00 0.00 H ATOM 607 H SER A 74 51.084 -17.353 44.315 1.00 0.00 H ATOM 608 N GLU A 75 50.998 -19.337 47.096 1.00 24.34 N ATOM 609 CA GLU A 75 50.615 -20.039 48.335 1.00 24.03 C ATOM 610 C GLU A 75 50.540 -21.545 48.062 1.00 27.66 C ATOM 611 O GLU A 75 50.578 -22.348 49.001 1.00 29.45 O ATOM 612 CB GLU A 75 49.237 -19.579 48.827 1.00 24.89 C ATOM 613 CG GLU A 75 49.156 -18.111 49.172 1.00 20.51 C ATOM 614 CD GLU A 75 47.757 -17.676 49.551 1.00 20.62 C ATOM 615 OE1 GLU A 75 47.316 -16.621 49.042 1.00 24.80 O ATOM 616 OE2 GLU A 75 47.089 -18.397 50.328 1.00 28.76 O ATOM 617 H GLU A 75 50.280 -18.769 46.603 1.00 0.00 H ATOM 618 N ILE A 76 50.431 -21.926 46.774 1.00 22.45 N ATOM 619 CA ILE A 76 50.324 -23.316 46.346 1.00 21.48 C ATOM 620 C ILE A 76 51.700 -23.956 46.080 1.00 26.22 C ATOM 621 O ILE A 76 52.391 -23.587 45.127 1.00 23.64 O ATOM 622 CB ILE A 76 49.359 -23.484 45.144 1.00 23.97 C ATOM 623 CG1 ILE A 76 47.985 -22.799 45.436 1.00 23.36 C ATOM 624 CG2 ILE A 76 49.247 -24.980 44.730 1.00 21.65 C ATOM 625 CD1 ILE A 76 47.006 -22.701 44.260 1.00 22.58 C ATOM 626 H ILE A 76 50.423 -21.186 46.043 1.00 0.00 H ATOM 627 N LYS A 77 52.075 -24.918 46.944 1.00 23.03 N ATOM 628 CA LYS A 77 53.290 -25.724 46.820 1.00 23.56 C ATOM 629 C LYS A 77 52.843 -27.164 47.032 1.00 27.21 C ATOM 630 O LYS A 77 51.648 -27.397 47.251 1.00 25.23 O ATOM 631 CB LYS A 77 54.343 -25.324 47.881 1.00 25.24 C ATOM 632 CG LYS A 77 54.856 -23.909 47.725 1.00 31.85 C ATOM 633 CD LYS A 77 55.831 -23.573 48.853 1.00 48.46 C ATOM 634 CE LYS A 77 57.250 -23.423 48.373 1.00 62.68 C ATOM 635 NZ LYS A 77 58.106 -24.541 48.849 1.00 77.29 N ATOM 636 HZ1 LYS A 77 58.109 -24.555 49.889 1.00 0.00 H ATOM 637 HZ2 LYS A 77 57.729 -25.441 48.490 1.00 0.00 H ATOM 638 HZ3 LYS A 77 59.076 -24.406 48.500 1.00 0.00 H ATOM 639 H LYS A 77 51.456 -25.102 47.759 1.00 0.00 H ATOM 640 N GLU A 78 53.788 -28.136 46.959 1.00 24.46 N ATOM 641 CA GLU A 78 53.503 -29.554 47.178 1.00 24.30 C ATOM 642 C GLU A 78 52.875 -29.836 48.550 1.00 25.36 C ATOM 643 O GLU A 78 52.115 -30.784 48.693 1.00 25.46 O ATOM 644 CB GLU A 78 54.791 -30.393 46.990 1.00 26.09 C ATOM 645 H GLU A 78 54.765 -27.858 46.736 1.00 0.00 H ATOM 646 N ASP A 79 53.185 -29.027 49.561 1.00 22.47 N ATOM 647 CA ASP A 79 52.669 -29.240 50.935 1.00 22.11 C ATOM 648 C ASP A 79 51.330 -28.484 51.225 1.00 24.94 C ATOM 649 O ASP A 79 50.840 -28.544 52.348 1.00 23.18 O ATOM 650 CB ASP A 79 53.759 -28.847 51.970 1.00 23.48 C ATOM 651 CG ASP A 79 54.110 -27.363 52.008 1.00 28.04 C ATOM 652 OD1 ASP A 79 53.621 -26.605 51.131 1.00 29.11 O ATOM 653 OD2 ASP A 79 54.903 -26.965 52.882 1.00 28.87 O ATOM 654 H ASP A 79 53.811 -28.217 49.381 1.00 0.00 H ATOM 655 N THR A 80 50.775 -27.749 50.229 1.00 21.84 N ATOM 656 CA THR A 80 49.531 -26.989 50.384 1.00 20.46 C ATOM 657 C THR A 80 48.348 -27.934 50.321 1.00 23.26 C ATOM 658 O THR A 80 48.280 -28.751 49.411 1.00 22.80 O ATOM 659 CB THR A 80 49.426 -25.877 49.314 1.00 21.87 C ATOM 660 OG1 THR A 80 50.577 -25.060 49.408 1.00 21.20 O ATOM 661 CG2 THR A 80 48.185 -24.995 49.492 1.00 17.15 C ATOM 662 HG1 THR A 80 50.527 -24.341 48.729 1.00 0.00 H ATOM 663 H THR A 80 51.257 -27.723 49.308 1.00 0.00 H ATOM 664 N SER A 81 47.404 -27.826 51.282 1.00 19.59 N ATOM 665 CA SER A 81 46.218 -28.680 51.300 1.00 18.54 C ATOM 666 C SER A 81 45.281 -28.291 50.170 1.00 22.51 C ATOM 667 O SER A 81 45.160 -27.108 49.843 1.00 21.20 O ATOM 668 CB SER A 81 45.498 -28.609 52.648 1.00 20.61 C ATOM 669 OG SER A 81 44.822 -27.375 52.841 1.00 25.88 O ATOM 670 HG SER A 81 44.146 -27.255 52.128 1.00 0.00 H ATOM 671 H SER A 81 47.525 -27.114 52.031 1.00 0.00 H ATOM 672 N PHE A 82 44.609 -29.289 49.592 1.00 20.96 N ATOM 673 CA PHE A 82 43.654 -29.132 48.509 1.00 20.94 C ATOM 674 C PHE A 82 42.501 -30.112 48.771 1.00 24.51 C ATOM 675 O PHE A 82 42.581 -30.943 49.676 1.00 22.52 O ATOM 676 CB PHE A 82 44.330 -29.421 47.153 1.00 22.35 C ATOM 677 CG PHE A 82 44.888 -30.827 47.015 1.00 23.73 C ATOM 678 CD1 PHE A 82 44.092 -31.863 46.536 1.00 26.98 C ATOM 679 CD2 PHE A 82 46.158 -31.133 47.474 1.00 26.48 C ATOM 680 CE1 PHE A 82 44.580 -33.176 46.468 1.00 28.38 C ATOM 681 CE2 PHE A 82 46.653 -32.445 47.399 1.00 30.18 C ATOM 682 CZ PHE A 82 45.863 -33.454 46.884 1.00 28.22 C ATOM 683 H PHE A 82 44.782 -30.252 49.944 1.00 0.00 H ATOM 684 N PHE A 83 41.444 -30.009 47.964 1.00 21.17 N ATOM 685 CA PHE A 83 40.328 -30.936 47.978 1.00 20.20 C ATOM 686 C PHE A 83 40.461 -31.781 46.730 1.00 23.78 C ATOM 687 O PHE A 83 40.647 -31.254 45.613 1.00 20.31 O ATOM 688 CB PHE A 83 38.960 -30.192 47.980 1.00 21.09 C ATOM 689 CG PHE A 83 38.748 -29.405 49.248 1.00 21.82 C ATOM 690 CD1 PHE A 83 38.219 -30.015 50.386 1.00 23.67 C ATOM 691 CD2 PHE A 83 39.129 -28.072 49.327 1.00 23.54 C ATOM 692 CE1 PHE A 83 38.095 -29.309 51.586 1.00 23.89 C ATOM 693 CE2 PHE A 83 39.025 -27.368 50.534 1.00 26.37 C ATOM 694 CZ PHE A 83 38.499 -27.990 51.652 1.00 24.17 C ATOM 695 H PHE A 83 41.418 -29.220 47.287 1.00 0.00 H ATOM 696 N GLY A 84 40.360 -33.090 46.924 1.00 22.43 N ATOM 697 CA GLY A 84 40.333 -34.035 45.816 1.00 21.72 C ATOM 698 C GLY A 84 38.936 -34.002 45.216 1.00 24.36 C ATOM 699 O GLY A 84 37.979 -33.583 45.876 1.00 23.41 O ATOM 700 H GLY A 84 40.298 -33.452 47.897 1.00 0.00 H ATOM 701 N VAL A 85 38.805 -34.432 43.976 1.00 20.72 N ATOM 702 CA VAL A 85 37.510 -34.450 43.289 1.00 19.80 C ATOM 703 C VAL A 85 37.021 -35.904 43.168 1.00 25.85 C ATOM 704 O VAL A 85 37.699 -36.740 42.582 1.00 25.97 O ATOM 705 CB VAL A 85 37.554 -33.723 41.906 1.00 22.12 C ATOM 706 CG1 VAL A 85 36.212 -33.866 41.178 1.00 21.74 C ATOM 707 CG2 VAL A 85 37.923 -32.233 42.061 1.00 21.34 C ATOM 708 H VAL A 85 39.648 -34.769 43.469 1.00 0.00 H ATOM 709 N GLN A 86 35.843 -36.180 43.726 1.00 23.27 N ATOM 710 CA GLN A 86 35.190 -37.476 43.702 1.00 24.47 C ATOM 711 C GLN A 86 34.527 -37.679 42.328 1.00 29.26 C ATOM 712 O GLN A 86 34.571 -38.773 41.773 1.00 29.66 O ATOM 713 CB GLN A 86 34.096 -37.473 44.787 1.00 26.18 C ATOM 714 CG GLN A 86 33.571 -38.829 45.177 1.00 38.22 C ATOM 715 CD GLN A 86 32.603 -38.681 46.310 1.00 57.36 C ATOM 716 OE1 GLN A 86 31.402 -38.861 46.138 1.00 60.84 O ATOM 717 NE2 GLN A 86 33.086 -38.274 47.473 1.00 50.83 N ATOM 718 HE22 GLN A 86 34.109 -38.130 47.589 1.00 0.00 H ATOM 719 HE21 GLN A 86 32.442 -38.098 48.271 1.00 0.00 H ATOM 720 H GLN A 86 35.353 -35.406 44.218 1.00 0.00 H ATOM 721 N GLU A 87 33.896 -36.624 41.802 1.00 23.51 N ATOM 722 CA GLU A 87 33.112 -36.711 40.577 1.00 22.98 C ATOM 723 C GLU A 87 33.027 -35.404 39.813 1.00 24.90 C ATOM 724 O GLU A 87 32.869 -34.337 40.416 1.00 24.33 O ATOM 725 CB GLU A 87 31.663 -37.122 40.977 1.00 23.95 C ATOM 726 CG GLU A 87 30.838 -37.734 39.856 1.00 35.55 C ATOM 727 CD GLU A 87 29.361 -37.946 40.156 1.00 54.02 C ATOM 728 OE1 GLU A 87 28.935 -37.705 41.309 1.00 40.64 O ATOM 729 OE2 GLU A 87 28.622 -38.335 39.222 1.00 51.53 O ATOM 730 H GLU A 87 33.968 -35.706 42.286 1.00 0.00 H ATOM 731 N ILE A 88 33.041 -35.512 38.480 1.00 21.93 N ATOM 732 CA ILE A 88 32.846 -34.389 37.558 1.00 21.19 C ATOM 733 C ILE A 88 31.452 -34.569 36.963 1.00 24.46 C ATOM 734 O ILE A 88 31.199 -35.586 36.338 1.00 25.99 O ATOM 735 CB ILE A 88 33.922 -34.292 36.438 1.00 23.37 C ATOM 736 CG1 ILE A 88 35.352 -34.208 37.020 1.00 22.78 C ATOM 737 CG2 ILE A 88 33.617 -33.055 35.524 1.00 24.64 C ATOM 738 CD1 ILE A 88 36.412 -34.675 36.016 1.00 24.65 C ATOM 739 H ILE A 88 33.201 -36.455 38.071 1.00 0.00 H ATOM 740 N ILE A 89 30.564 -33.603 37.157 1.00 19.83 N ATOM 741 CA ILE A 89 29.216 -33.656 36.622 1.00 19.72 C ATOM 742 C ILE A 89 29.074 -32.539 35.571 1.00 22.47 C ATOM 743 O ILE A 89 29.019 -31.374 35.922 1.00 21.27 O ATOM 744 CB ILE A 89 28.110 -33.571 37.722 1.00 22.80 C ATOM 745 CG1 ILE A 89 28.311 -34.644 38.839 1.00 23.00 C ATOM 746 CG2 ILE A 89 26.700 -33.661 37.093 1.00 20.12 C ATOM 747 CD1 ILE A 89 27.410 -34.435 40.085 1.00 26.00 C ATOM 748 H ILE A 89 30.846 -32.773 37.716 1.00 0.00 H ATOM 749 N ILE A 90 28.991 -32.914 34.297 1.00 19.30 N ATOM 750 CA ILE A 90 28.851 -31.991 33.170 1.00 18.26 C ATOM 751 C ILE A 90 27.408 -32.006 32.704 1.00 22.07 C ATOM 752 O ILE A 90 26.834 -33.085 32.573 1.00 23.29 O ATOM 753 CB ILE A 90 29.851 -32.418 32.042 1.00 21.15 C ATOM 754 CG1 ILE A 90 31.315 -32.035 32.472 1.00 22.02 C ATOM 755 CG2 ILE A 90 29.490 -31.769 30.688 1.00 20.34 C ATOM 756 CD1 ILE A 90 32.347 -32.908 31.810 1.00 29.23 C ATOM 757 H ILE A 90 29.028 -33.932 34.088 1.00 0.00 H ATOM 758 N HIS A 91 26.824 -30.825 32.430 1.00 17.85 N ATOM 759 CA HIS A 91 25.462 -30.765 31.922 1.00 17.63 C ATOM 760 C HIS A 91 25.347 -31.664 30.675 1.00 24.51 C ATOM 761 O HIS A 91 26.225 -31.619 29.813 1.00 23.75 O ATOM 762 CB HIS A 91 25.088 -29.320 31.573 1.00 16.80 C ATOM 763 CG HIS A 91 23.613 -29.123 31.421 1.00 19.00 C ATOM 764 ND1 HIS A 91 22.912 -29.687 30.367 1.00 19.40 N ATOM 765 CD2 HIS A 91 22.749 -28.461 32.219 1.00 19.96 C ATOM 766 CE1 HIS A 91 21.663 -29.310 30.537 1.00 19.27 C ATOM 767 NE2 HIS A 91 21.508 -28.597 31.653 1.00 19.38 N ATOM 768 H HIS A 91 27.353 -29.943 32.583 1.00 0.00 H ATOM 769 N ASP A 92 24.298 -32.514 30.621 1.00 22.51 N ATOM 770 CA ASP A 92 24.030 -33.460 29.530 1.00 23.79 C ATOM 771 C ASP A 92 23.922 -32.825 28.161 1.00 24.52 C ATOM 772 O ASP A 92 24.161 -33.511 27.173 1.00 23.96 O ATOM 773 CB ASP A 92 22.689 -34.203 29.777 1.00 26.83 C ATOM 774 CG ASP A 92 22.833 -35.360 30.713 1.00 40.05 C ATOM 775 OD1 ASP A 92 23.989 -35.789 30.952 1.00 42.99 O ATOM 776 OD2 ASP A 92 21.800 -35.859 31.187 1.00 43.18 O ATOM 777 H ASP A 92 23.627 -32.497 31.415 1.00 0.00 H ATOM 778 N GLN A 93 23.459 -31.575 28.097 1.00 20.16 N ATOM 779 CA GLN A 93 23.249 -30.919 26.812 1.00 20.89 C ATOM 780 C GLN A 93 24.479 -30.162 26.350 1.00 24.20 C ATOM 781 O GLN A 93 24.468 -29.629 25.247 1.00 25.20 O ATOM 782 CB GLN A 93 22.024 -30.004 26.856 1.00 21.26 C ATOM 783 CG GLN A 93 20.711 -30.775 26.899 1.00 20.87 C ATOM 784 CD GLN A 93 19.570 -29.838 27.138 1.00 23.15 C ATOM 785 OE1 GLN A 93 19.256 -29.477 28.281 1.00 19.45 O ATOM 786 NE2 GLN A 93 18.992 -29.344 26.076 1.00 19.00 N ATOM 787 HE22 GLN A 93 19.278 -29.668 25.130 1.00 0.00 H ATOM 788 HE21 GLN A 93 18.246 -28.627 26.176 1.00 0.00 H ATOM 789 H GLN A 93 23.245 -31.062 28.976 1.00 0.00 H ATOM 790 N TYR A 94 25.535 -30.121 27.172 1.00 20.26 N ATOM 791 CA TYR A 94 26.759 -29.386 26.817 1.00 18.65 C ATOM 792 C TYR A 94 27.475 -29.968 25.598 1.00 20.69 C ATOM 793 O TYR A 94 27.803 -31.147 25.598 1.00 20.60 O ATOM 794 CB TYR A 94 27.730 -29.304 28.012 1.00 18.67 C ATOM 795 CG TYR A 94 29.085 -28.777 27.592 1.00 17.90 C ATOM 796 CD1 TYR A 94 29.286 -27.416 27.365 1.00 18.06 C ATOM 797 CD2 TYR A 94 30.144 -29.645 27.338 1.00 19.59 C ATOM 798 CE1 TYR A 94 30.537 -26.923 26.989 1.00 15.69 C ATOM 799 CE2 TYR A 94 31.387 -29.168 26.899 1.00 20.51 C ATOM 800 CZ TYR A 94 31.568 -27.807 26.706 1.00 23.80 C ATOM 801 OH TYR A 94 32.759 -27.338 26.225 1.00 20.96 O ATOM 802 HH TYR A 94 32.717 -26.352 26.149 1.00 0.00 H ATOM 803 H TYR A 94 25.489 -30.621 28.083 1.00 0.00 H ATOM 804 N LYS A 95 27.756 -29.140 24.600 1.00 17.42 N ATOM 805 CA LYS A 95 28.546 -29.525 23.427 1.00 18.05 C ATOM 806 C LYS A 95 29.792 -28.638 23.431 1.00 21.46 C ATOM 807 O LYS A 95 30.910 -29.130 23.297 1.00 19.34 O ATOM 808 CB LYS A 95 27.762 -29.246 22.123 1.00 22.21 C ATOM 809 CG LYS A 95 27.207 -30.474 21.439 1.00 55.29 C ATOM 810 CD LYS A 95 26.047 -30.090 20.496 1.00 74.28 C ATOM 811 CE LYS A 95 25.494 -31.264 19.711 1.00 83.34 C ATOM 812 NZ LYS A 95 24.315 -30.883 18.883 1.00 88.97 N ATOM 813 HZ1 LYS A 95 23.560 -30.523 19.501 1.00 0.00 H ATOM 814 HZ2 LYS A 95 24.592 -30.143 18.206 1.00 0.00 H ATOM 815 HZ3 LYS A 95 23.972 -31.717 18.365 1.00 0.00 H ATOM 816 H LYS A 95 27.396 -28.166 24.653 1.00 0.00 H ATOM 817 N MET A 96 29.590 -27.303 23.548 1.00 17.94 N ATOM 818 CA MET A 96 30.704 -26.348 23.526 1.00 18.16 C ATOM 819 C MET A 96 30.281 -25.063 24.193 1.00 20.87 C ATOM 820 O MET A 96 29.090 -24.788 24.250 1.00 19.37 O ATOM 821 CB MET A 96 31.135 -26.068 22.085 1.00 20.32 C ATOM 822 CG MET A 96 30.022 -25.450 21.242 1.00 24.80 C ATOM 823 SD MET A 96 30.160 -25.890 19.501 1.00 30.80 S ATOM 824 CE MET A 96 31.640 -25.126 19.169 1.00 26.34 C ATOM 825 H MET A 96 28.619 -26.946 23.656 1.00 0.00 H ATOM 826 N ALA A 97 31.252 -24.265 24.663 1.00 18.24 N ATOM 827 CA ALA A 97 30.988 -22.991 25.364 1.00 17.51 C ATOM 828 C ALA A 97 30.069 -22.076 24.570 1.00 20.91 C ATOM 829 O ALA A 97 29.079 -21.583 25.111 1.00 20.14 O ATOM 830 CB ALA A 97 32.306 -22.275 25.696 1.00 17.74 C ATOM 831 H ALA A 97 32.241 -24.558 24.527 1.00 0.00 H ATOM 832 N GLU A 98 30.351 -21.909 23.270 1.00 18.05 N ATOM 833 CA GLU A 98 29.594 -20.997 22.397 1.00 17.50 C ATOM 834 C GLU A 98 28.141 -21.414 22.158 1.00 21.81 C ATOM 835 O GLU A 98 27.334 -20.581 21.742 1.00 22.11 O ATOM 836 CB GLU A 98 30.324 -20.786 21.077 1.00 18.07 C ATOM 837 CG GLU A 98 31.556 -19.902 21.188 1.00 23.39 C ATOM 838 CD GLU A 98 32.450 -20.053 19.974 1.00 36.81 C ATOM 839 OE1 GLU A 98 33.215 -21.037 19.924 1.00 29.50 O ATOM 840 OE2 GLU A 98 32.279 -19.280 19.009 1.00 24.62 O ATOM 841 H GLU A 98 31.140 -22.448 22.860 1.00 0.00 H ATOM 842 N SER A 99 27.791 -22.678 22.452 1.00 17.34 N ATOM 843 CA SER A 99 26.406 -23.139 22.289 1.00 17.87 C ATOM 844 C SER A 99 25.619 -23.174 23.616 1.00 24.33 C ATOM 845 O SER A 99 24.455 -23.545 23.617 1.00 26.04 O ATOM 846 CB SER A 99 26.380 -24.499 21.602 1.00 20.92 C ATOM 847 OG SER A 99 26.846 -24.312 20.283 1.00 25.00 O ATOM 848 HG SER A 99 26.842 -25.180 19.807 1.00 0.00 H ATOM 849 H SER A 99 28.513 -23.341 22.801 1.00 0.00 H ATOM 850 N GLY A 100 26.260 -22.811 24.726 1.00 20.65 N ATOM 851 CA GLY A 100 25.612 -22.795 26.034 1.00 19.29 C ATOM 852 C GLY A 100 25.770 -24.081 26.816 1.00 20.27 C ATOM 853 O GLY A 100 26.575 -24.958 26.449 1.00 18.51 O ATOM 854 H GLY A 100 27.259 -22.529 24.658 1.00 0.00 H ATOM 855 N TYR A 101 24.964 -24.212 27.901 1.00 16.65 N ATOM 856 CA TYR A 101 25.011 -25.328 28.849 1.00 16.06 C ATOM 857 C TYR A 101 26.442 -25.488 29.381 1.00 20.45 C ATOM 858 O TYR A 101 26.838 -26.589 29.755 1.00 18.48 O ATOM 859 CB TYR A 101 24.482 -26.644 28.223 1.00 18.03 C ATOM 860 CG TYR A 101 23.104 -26.496 27.608 1.00 21.51 C ATOM 861 CD1 TYR A 101 21.961 -26.479 28.403 1.00 23.62 C ATOM 862 CD2 TYR A 101 22.948 -26.326 26.237 1.00 23.72 C ATOM 863 CE1 TYR A 101 20.691 -26.322 27.843 1.00 24.34 C ATOM 864 CE2 TYR A 101 21.687 -26.159 25.668 1.00 26.12 C ATOM 865 CZ TYR A 101 20.563 -26.158 26.475 1.00 35.05 C ATOM 866 OH TYR A 101 19.326 -26.011 25.902 1.00 45.21 O ATOM 867 HH TYR A 101 18.632 -26.031 26.608 1.00 0.00 H ATOM 868 H TYR A 101 24.261 -23.465 28.072 1.00 0.00 H ATOM 869 N ASP A 102 27.230 -24.375 29.413 1.00 15.87 N ATOM 870 CA ASP A 102 28.626 -24.479 29.853 1.00 15.68 C ATOM 871 C ASP A 102 28.663 -24.432 31.378 1.00 20.35 C ATOM 872 O ASP A 102 28.941 -23.402 31.994 1.00 19.91 O ATOM 873 CB ASP A 102 29.478 -23.380 29.182 1.00 16.04 C ATOM 874 CG ASP A 102 30.956 -23.569 29.321 1.00 18.93 C ATOM 875 OD1 ASP A 102 31.376 -24.655 29.772 1.00 19.41 O ATOM 876 OD2 ASP A 102 31.700 -22.617 29.017 1.00 19.65 O ATOM 877 H ASP A 102 26.842 -23.454 29.126 1.00 0.00 H ATOM 878 N ILE A 103 28.286 -25.551 31.982 1.00 17.46 N ATOM 879 CA ILE A 103 28.177 -25.652 33.423 1.00 16.12 C ATOM 880 C ILE A 103 28.546 -27.055 33.865 1.00 20.56 C ATOM 881 O ILE A 103 28.169 -28.049 33.229 1.00 18.12 O ATOM 882 CB ILE A 103 26.751 -25.211 33.892 1.00 18.05 C ATOM 883 CG1 ILE A 103 26.665 -25.119 35.431 1.00 18.35 C ATOM 884 CG2 ILE A 103 25.614 -26.117 33.311 1.00 16.06 C ATOM 885 CD1 ILE A 103 25.423 -24.277 35.918 1.00 21.42 C ATOM 886 H ILE A 103 28.061 -26.384 31.401 1.00 0.00 H ATOM 887 N ALA A 104 29.289 -27.120 34.975 1.00 17.26 N ATOM 888 CA ALA A 104 29.691 -28.366 35.574 1.00 16.83 C ATOM 889 C ALA A 104 29.764 -28.209 37.080 1.00 20.85 C ATOM 890 O ALA A 104 29.957 -27.099 37.595 1.00 20.03 O ATOM 891 CB ALA A 104 31.039 -28.818 35.021 1.00 17.59 C ATOM 892 H ALA A 104 29.590 -26.232 35.425 1.00 0.00 H ATOM 893 N LEU A 105 29.595 -29.335 37.778 1.00 17.23 N ATOM 894 CA LEU A 105 29.753 -29.464 39.216 1.00 17.86 C ATOM 895 C LEU A 105 30.904 -30.395 39.525 1.00 20.85 C ATOM 896 O LEU A 105 31.084 -31.409 38.857 1.00 20.50 O ATOM 897 CB LEU A 105 28.474 -30.020 39.885 1.00 17.84 C ATOM 898 CG LEU A 105 27.334 -29.033 40.045 1.00 21.40 C ATOM 899 CD1 LEU A 105 25.975 -29.751 40.044 1.00 20.39 C ATOM 900 CD2 LEU A 105 27.531 -28.140 41.274 1.00 20.69 C ATOM 901 H LEU A 105 29.328 -30.189 37.248 1.00 0.00 H ATOM 902 N LEU A 106 31.686 -30.053 40.544 1.00 17.83 N ATOM 903 CA LEU A 106 32.716 -30.937 41.067 1.00 16.71 C ATOM 904 C LEU A 106 32.222 -31.367 42.431 1.00 22.01 C ATOM 905 O LEU A 106 31.917 -30.508 43.279 1.00 19.69 O ATOM 906 CB LEU A 106 34.101 -30.264 41.208 1.00 16.26 C ATOM 907 CG LEU A 106 34.708 -29.673 39.918 1.00 19.39 C ATOM 908 CD1 LEU A 106 36.032 -29.016 40.214 1.00 18.12 C ATOM 909 CD2 LEU A 106 34.851 -30.736 38.846 1.00 21.08 C ATOM 910 H LEU A 106 31.557 -29.119 40.983 1.00 0.00 H ATOM 911 N LYS A 107 32.139 -32.692 42.650 1.00 19.66 N ATOM 912 CA LYS A 107 31.785 -33.219 43.968 1.00 19.93 C ATOM 913 C LYS A 107 33.106 -33.511 44.623 1.00 22.84 C ATOM 914 O LYS A 107 33.906 -34.274 44.085 1.00 20.79 O ATOM 915 CB LYS A 107 30.919 -34.487 43.888 1.00 23.21 C ATOM 916 CG LYS A 107 30.290 -34.812 45.231 1.00 28.33 C ATOM 917 CD LYS A 107 29.626 -36.168 45.184 1.00 32.53 C ATOM 918 CE LYS A 107 28.970 -36.484 46.511 1.00 45.91 C ATOM 919 NZ LYS A 107 28.473 -37.885 46.545 1.00 58.13 N ATOM 920 HZ1 LYS A 107 27.774 -38.022 45.788 1.00 0.00 H ATOM 921 HZ2 LYS A 107 29.270 -38.538 46.405 1.00 0.00 H ATOM 922 HZ3 LYS A 107 28.029 -38.072 47.467 1.00 0.00 H ATOM 923 H LYS A 107 32.330 -33.352 41.869 1.00 0.00 H ATOM 924 N LEU A 108 33.362 -32.856 45.754 1.00 19.74 N ATOM 925 CA LEU A 108 34.630 -32.980 46.454 1.00 19.96 C ATOM 926 C LEU A 108 34.672 -34.263 47.288 1.00 24.57 C ATOM 927 O LEU A 108 33.645 -34.720 47.767 1.00 25.12 O ATOM 928 CB LEU A 108 34.918 -31.712 47.324 1.00 19.06 C ATOM 929 CG LEU A 108 34.926 -30.339 46.578 1.00 22.03 C ATOM 930 CD1 LEU A 108 35.171 -29.192 47.558 1.00 20.09 C ATOM 931 CD2 LEU A 108 35.958 -30.316 45.429 1.00 20.70 C ATOM 932 H LEU A 108 32.629 -32.234 46.150 1.00 0.00 H ATOM 933 N GLU A 109 35.861 -34.841 47.425 1.00 21.45 N ATOM 934 CA GLU A 109 36.095 -36.066 48.189 1.00 22.55 C ATOM 935 C GLU A 109 35.888 -35.848 49.683 1.00 27.54 C ATOM 936 O GLU A 109 35.515 -36.781 50.386 1.00 29.24 O ATOM 937 CB GLU A 109 37.496 -36.608 47.908 1.00 23.89 C ATOM 938 CG GLU A 109 37.532 -37.525 46.697 1.00 39.73 C ATOM 939 CD GLU A 109 38.912 -38.010 46.284 1.00 67.90 C ATOM 940 OE1 GLU A 109 39.916 -37.496 46.833 1.00 65.03 O ATOM 941 OE2 GLU A 109 38.992 -38.880 45.385 1.00 57.44 O ATOM 942 H GLU A 109 36.677 -34.394 46.960 1.00 0.00 H ATOM 943 N THR A 110 36.148 -34.634 50.167 1.00 23.89 N ATOM 944 CA THR A 110 35.954 -34.243 51.570 1.00 24.42 C ATOM 945 C THR A 110 35.165 -32.943 51.617 1.00 29.69 C ATOM 946 O THR A 110 35.041 -32.272 50.590 1.00 29.68 O ATOM 947 CB THR A 110 37.304 -34.161 52.337 1.00 31.84 C ATOM 948 OG1 THR A 110 38.248 -33.383 51.587 1.00 33.48 O ATOM 949 CG2 THR A 110 37.897 -35.546 52.622 1.00 29.58 C ATOM 950 HG1 THR A 110 38.399 -33.809 50.706 1.00 0.00 H ATOM 951 H THR A 110 36.512 -33.916 49.508 1.00 0.00 H ATOM 952 N THR A 111 34.631 -32.576 52.796 1.00 27.54 N ATOM 953 CA THR A 111 33.866 -31.346 52.907 1.00 27.52 C ATOM 954 C THR A 111 34.761 -30.157 53.236 1.00 29.68 C ATOM 955 O THR A 111 35.791 -30.295 53.899 1.00 25.41 O ATOM 956 CB THR A 111 32.659 -31.456 53.864 1.00 40.02 C ATOM 957 OG1 THR A 111 33.109 -31.517 55.204 1.00 41.14 O ATOM 958 CG2 THR A 111 31.744 -32.626 53.550 1.00 37.92 C ATOM 959 HG1 THR A 111 32.329 -31.587 55.810 1.00 0.00 H ATOM 960 H THR A 111 34.767 -33.177 53.634 1.00 0.00 H ATOM 961 N VAL A 112 34.357 -28.987 52.749 1.00 26.76 N ATOM 962 CA VAL A 112 35.032 -27.726 53.015 1.00 25.29 C ATOM 963 C VAL A 112 34.552 -27.287 54.377 1.00 28.21 C ATOM 964 O VAL A 112 33.350 -27.265 54.611 1.00 27.54 O ATOM 965 CB VAL A 112 34.637 -26.645 51.957 1.00 27.99 C ATOM 966 CG1 VAL A 112 35.281 -25.290 52.265 1.00 26.70 C ATOM 967 CG2 VAL A 112 34.950 -27.104 50.541 1.00 27.28 C ATOM 968 H VAL A 112 33.511 -28.973 52.144 1.00 0.00 H ATOM 969 N GLY A 113 35.479 -26.875 55.232 1.00 25.43 N ATOM 970 CA GLY A 113 35.149 -26.280 56.518 1.00 23.97 C ATOM 971 C GLY A 113 35.046 -24.785 56.268 1.00 27.75 C ATOM 972 O GLY A 113 36.034 -24.154 55.876 1.00 28.47 O ATOM 973 H GLY A 113 36.481 -26.981 54.973 1.00 0.00 H ATOM 974 N TYR A 114 33.850 -24.220 56.431 1.00 22.45 N ATOM 975 CA TYR A 114 33.602 -22.799 56.208 1.00 22.02 C ATOM 976 C TYR A 114 34.290 -21.923 57.251 1.00 27.11 C ATOM 977 O TYR A 114 34.311 -22.255 58.436 1.00 25.35 O ATOM 978 CB TYR A 114 32.095 -22.476 56.196 1.00 22.97 C ATOM 979 CG TYR A 114 31.299 -23.141 55.090 1.00 24.93 C ATOM 980 CD1 TYR A 114 31.927 -23.606 53.931 1.00 26.95 C ATOM 981 CD2 TYR A 114 29.910 -23.247 55.169 1.00 25.30 C ATOM 982 CE1 TYR A 114 31.207 -24.243 52.922 1.00 25.63 C ATOM 983 CE2 TYR A 114 29.176 -23.876 54.164 1.00 26.52 C ATOM 984 CZ TYR A 114 29.833 -24.375 53.042 1.00 34.94 C ATOM 985 OH TYR A 114 29.135 -24.950 52.012 1.00 34.46 O ATOM 986 HH TYR A 114 28.503 -24.289 51.634 1.00 0.00 H ATOM 987 H TYR A 114 33.056 -24.820 56.731 1.00 0.00 H ATOM 988 N GLY A 115 34.788 -20.784 56.798 1.00 24.20 N ATOM 989 CA GLY A 115 35.411 -19.778 57.646 1.00 23.75 C ATOM 990 C GLY A 115 35.534 -18.503 56.856 1.00 28.72 C ATOM 991 O GLY A 115 35.077 -18.435 55.706 1.00 28.96 O ATOM 992 H GLY A 115 34.731 -20.596 55.777 1.00 0.00 H ATOM 993 N ASP A 116 36.220 -17.515 57.419 1.00 25.35 N ATOM 994 CA ASP A 116 36.391 -16.210 56.758 1.00 25.03 C ATOM 995 C ASP A 116 37.240 -16.284 55.470 1.00 29.12 C ATOM 996 O ASP A 116 37.098 -15.419 54.599 1.00 30.22 O ATOM 997 CB ASP A 116 36.915 -15.175 57.758 1.00 26.24 C ATOM 998 CG ASP A 116 35.921 -14.894 58.887 1.00 34.61 C ATOM 999 OD1 ASP A 116 34.814 -14.406 58.585 1.00 29.81 O ATOM 1000 OD2 ASP A 116 36.267 -15.173 60.098 1.00 40.48 O ATOM 1001 H ASP A 116 36.649 -17.667 58.354 1.00 0.00 H ATOM 1002 N SER A 117 38.016 -17.366 55.289 1.00 24.55 N ATOM 1003 CA SER A 117 38.829 -17.572 54.069 1.00 24.22 C ATOM 1004 C SER A 117 38.132 -18.389 52.966 1.00 29.13 C ATOM 1005 O SER A 117 38.586 -18.377 51.821 1.00 31.33 O ATOM 1006 CB SER A 117 40.173 -18.208 54.422 1.00 25.13 C ATOM 1007 OG SER A 117 40.082 -19.622 54.470 1.00 31.20 O ATOM 1008 HG SER A 117 39.420 -19.886 55.157 1.00 0.00 H ATOM 1009 H SER A 117 38.047 -18.088 56.037 1.00 0.00 H ATOM 1010 N GLN A 118 37.070 -19.133 53.309 1.00 23.15 N ATOM 1011 CA GLN A 118 36.397 -20.035 52.370 1.00 21.29 C ATOM 1012 C GLN A 118 34.989 -20.304 52.790 1.00 24.98 C ATOM 1013 O GLN A 118 34.736 -20.893 53.842 1.00 22.81 O ATOM 1014 CB GLN A 118 37.181 -21.335 52.187 1.00 22.48 C ATOM 1015 CG GLN A 118 37.485 -22.090 53.492 1.00 23.80 C ATOM 1016 CD GLN A 118 38.522 -23.133 53.266 1.00 31.13 C ATOM 1017 OE1 GLN A 118 39.468 -22.922 52.523 1.00 26.36 O ATOM 1018 NE2 GLN A 118 38.409 -24.254 53.959 1.00 28.44 N ATOM 1019 HE22 GLN A 118 37.589 -24.400 54.582 1.00 0.00 H ATOM 1020 HE21 GLN A 118 39.140 -24.990 53.881 1.00 0.00 H ATOM 1021 H GLN A 118 36.709 -19.067 54.282 1.00 0.00 H ATOM 1022 N ARG A 119 34.062 -19.842 51.979 1.00 23.22 N ATOM 1023 CA ARG A 119 32.640 -19.966 52.257 1.00 23.56 C ATOM 1024 C ARG A 119 31.824 -19.936 50.967 1.00 26.47 C ATOM 1025 O ARG A 119 32.353 -19.489 49.954 1.00 26.03 O ATOM 1026 CB ARG A 119 32.161 -18.916 53.281 1.00 22.52 C ATOM 1027 CG ARG A 119 32.578 -17.517 53.027 1.00 30.32 C ATOM 1028 CD ARG A 119 32.366 -16.719 54.306 1.00 44.10 C ATOM 1029 NE ARG A 119 32.726 -15.306 54.185 1.00 57.34 N ATOM 1030 CZ ARG A 119 32.042 -14.414 53.475 1.00 71.05 C ATOM 1031 NH1 ARG A 119 30.982 -14.791 52.761 1.00 54.31 N ATOM 1032 NH2 ARG A 119 32.442 -13.150 53.428 1.00 59.45 N ATOM 1033 HE ARG A 119 33.574 -14.977 54.689 1.00 0.00 H ATOM 1034 HH12 ARG A 119 30.451 -14.088 52.208 1.00 0.00 H ATOM 1035 HH11 ARG A 119 30.686 -15.788 52.757 1.00 0.00 H ATOM 1036 HH22 ARG A 119 31.905 -12.455 52.872 1.00 0.00 H ATOM 1037 HH21 ARG A 119 33.293 -12.854 53.948 1.00 0.00 H ATOM 1038 H ARG A 119 34.359 -19.368 51.102 1.00 0.00 H ATOM 1039 N PRO A 120 30.547 -20.377 50.981 1.00 22.23 N ATOM 1040 CA PRO A 120 29.788 -20.448 49.719 1.00 21.56 C ATOM 1041 C PRO A 120 29.159 -19.147 49.263 1.00 24.91 C ATOM 1042 O PRO A 120 28.878 -18.267 50.068 1.00 22.79 O ATOM 1043 CB PRO A 120 28.708 -21.495 50.017 1.00 23.03 C ATOM 1044 CG PRO A 120 28.457 -21.373 51.479 1.00 27.40 C ATOM 1045 CD PRO A 120 29.767 -20.932 52.114 1.00 23.53 C ATOM 1046 N ILE A 121 28.939 -19.032 47.953 1.00 19.63 N ATOM 1047 CA ILE A 121 28.222 -17.882 47.419 1.00 18.54 C ATOM 1048 C ILE A 121 26.795 -18.395 47.202 1.00 24.84 C ATOM 1049 O ILE A 121 26.619 -19.562 46.819 1.00 20.89 O ATOM 1050 CB ILE A 121 28.863 -17.292 46.121 1.00 20.67 C ATOM 1051 CG1 ILE A 121 28.039 -16.078 45.571 1.00 20.85 C ATOM 1052 CG2 ILE A 121 29.105 -18.373 45.039 1.00 18.31 C ATOM 1053 CD1 ILE A 121 28.812 -15.179 44.606 1.00 21.66 C ATOM 1054 H ILE A 121 29.283 -19.770 47.306 1.00 0.00 H ATOM 1055 N CYS A 122 25.792 -17.538 47.476 1.00 26.66 N ATOM 1056 CA CYS A 122 24.377 -17.820 47.252 1.00 30.99 C ATOM 1057 C CYS A 122 24.112 -17.961 45.762 1.00 28.69 C ATOM 1058 O CYS A 122 24.610 -17.180 44.949 1.00 22.95 O ATOM 1059 CB CYS A 122 23.504 -16.709 47.838 1.00 36.52 C ATOM 1060 SG CYS A 122 23.655 -16.500 49.630 1.00 44.33 S ATOM 1061 H CYS A 122 26.043 -16.611 47.875 1.00 0.00 H ATOM 1062 N LEU A 123 23.268 -18.910 45.418 1.00 25.00 N ATOM 1063 CA LEU A 123 22.824 -19.069 44.050 1.00 25.76 C ATOM 1064 C LEU A 123 21.733 -18.025 43.859 1.00 32.80 C ATOM 1065 O LEU A 123 21.127 -17.631 44.857 1.00 32.66 O ATOM 1066 CB LEU A 123 22.244 -20.481 43.835 1.00 25.62 C ATOM 1067 CG LEU A 123 23.285 -21.607 43.788 1.00 29.47 C ATOM 1068 CD1 LEU A 123 22.608 -22.939 43.511 1.00 30.09 C ATOM 1069 CD2 LEU A 123 24.349 -21.332 42.725 1.00 27.35 C ATOM 1070 H LEU A 123 22.912 -19.561 46.146 1.00 0.00 H ATOM 1071 N PRO A 124 21.460 -17.527 42.634 1.00 32.45 N ATOM 1072 CA PRO A 124 20.341 -16.576 42.479 1.00 33.86 C ATOM 1073 C PRO A 124 18.993 -17.262 42.718 1.00 40.87 C ATOM 1074 O PRO A 124 18.875 -18.476 42.550 1.00 36.73 O ATOM 1075 CB PRO A 124 20.436 -16.116 41.017 1.00 35.24 C ATOM 1076 CG PRO A 124 21.649 -16.739 40.456 1.00 39.06 C ATOM 1077 CD PRO A 124 22.045 -17.885 41.329 1.00 34.10 C ATOM 1078 N SER A 125 17.995 -16.489 43.146 1.00 44.37 N ATOM 1079 CA SER A 125 16.641 -17.013 43.363 1.00 48.19 C ATOM 1080 C SER A 125 15.846 -16.854 42.071 1.00 57.77 C ATOM 1081 O SER A 125 16.149 -15.954 41.282 1.00 56.30 O ATOM 1082 CB SER A 125 15.939 -16.247 44.483 1.00 53.79 C ATOM 1083 OG SER A 125 16.762 -16.162 45.636 1.00 67.64 O ATOM 1084 HG SER A 125 16.285 -15.662 46.345 1.00 0.00 H ATOM 1085 H SER A 125 18.181 -15.483 43.332 1.00 0.00 H ATOM 1086 N LYS A 126 14.815 -17.709 41.864 1.00 60.07 N ATOM 1087 CA LYS A 126 13.912 -17.647 40.703 1.00 61.84 C ATOM 1088 C LYS A 126 13.169 -16.297 40.681 1.00 70.05 C ATOM 1089 O LYS A 126 12.865 -15.786 39.600 1.00 70.15 O ATOM 1090 CB LYS A 126 12.921 -18.819 40.715 1.00 64.47 C ATOM 1091 H LYS A 126 14.652 -18.456 42.569 1.00 0.00 H ATOM 1092 N GLY A 127 12.940 -15.724 41.874 1.00 68.94 N ATOM 1093 CA GLY A 127 12.330 -14.410 42.063 1.00 70.14 C ATOM 1094 C GLY A 127 13.264 -13.285 41.652 1.00 77.98 C ATOM 1095 O GLY A 127 12.812 -12.221 41.212 1.00 78.34 O ATOM 1096 H GLY A 127 13.217 -16.254 42.725 1.00 0.00 H ATOM 1097 N ASP A 128 14.585 -13.533 41.772 1.00 76.73 N ATOM 1098 CA ASP A 128 15.666 -12.617 41.399 1.00 77.37 C ATOM 1099 C ASP A 128 15.966 -12.635 39.874 1.00 80.89 C ATOM 1100 O ASP A 128 16.808 -11.863 39.408 1.00 80.96 O ATOM 1101 CB ASP A 128 16.938 -12.908 42.236 1.00 79.75 C ATOM 1102 CG ASP A 128 16.897 -12.439 43.685 1.00 93.65 C ATOM 1103 OD1 ASP A 128 15.890 -11.795 44.080 1.00 95.15 O ATOM 1104 OD2 ASP A 128 17.879 -12.699 44.422 1.00 99.27 O ATOM 1105 H ASP A 128 14.860 -14.456 42.164 1.00 0.00 H ATOM 1106 N ARG A 129 15.250 -13.483 39.096 1.00 76.25 N ATOM 1107 CA ARG A 129 15.382 -13.573 37.633 1.00 75.47 C ATOM 1108 C ARG A 129 14.989 -12.222 36.988 1.00 78.76 C ATOM 1109 O ARG A 129 15.475 -11.890 35.901 1.00 78.18 O ATOM 1110 CB ARG A 129 14.492 -14.707 37.096 1.00 74.66 C ATOM 1111 CG ARG A 129 14.832 -15.188 35.690 1.00 81.42 C ATOM 1112 CD ARG A 129 13.707 -16.051 35.148 1.00 87.07 C ATOM 1113 NE ARG A 129 14.114 -17.438 34.911 1.00 89.21 N ATOM 1114 CZ ARG A 129 14.077 -18.404 35.824 1.00101.98 C ATOM 1115 NH1 ARG A 129 13.671 -18.144 37.062 1.00 88.59 N ATOM 1116 NH2 ARG A 129 14.459 -19.635 35.511 1.00 89.84 N ATOM 1117 HE ARG A 129 14.456 -17.685 33.961 1.00 0.00 H ATOM 1118 HH12 ARG A 129 13.645 -18.904 37.771 1.00 0.00 H ATOM 1119 HH11 ARG A 129 13.380 -17.180 37.322 1.00 0.00 H ATOM 1120 HH22 ARG A 129 14.428 -20.387 36.228 1.00 0.00 H ATOM 1121 HH21 ARG A 129 14.789 -19.848 34.548 1.00 0.00 H ATOM 1122 H ARG A 129 14.564 -14.110 39.563 1.00 0.00 H ATOM 1123 N ASN A 130 14.136 -11.440 37.700 1.00 74.74 N ATOM 1124 CA ASN A 130 13.622 -10.125 37.315 1.00 73.96 C ATOM 1125 C ASN A 130 14.471 -8.941 37.820 1.00 75.73 C ATOM 1126 O ASN A 130 14.385 -7.855 37.234 1.00 75.70 O ATOM 1127 CB ASN A 130 12.177 -9.973 37.799 1.00 75.91 C ATOM 1128 H ASN A 130 13.814 -11.816 38.615 1.00 0.00 H ATOM 1129 N VAL A 131 15.276 -9.133 38.900 1.00 69.51 N ATOM 1130 CA VAL A 131 16.089 -8.049 39.486 1.00 67.44 C ATOM 1131 C VAL A 131 17.206 -7.588 38.532 1.00 67.31 C ATOM 1132 O VAL A 131 17.718 -8.377 37.729 1.00 66.64 O ATOM 1133 CB VAL A 131 16.628 -8.313 40.927 1.00 70.95 C ATOM 1134 CG1 VAL A 131 15.531 -8.805 41.868 1.00 70.86 C ATOM 1135 CG2 VAL A 131 17.817 -9.257 40.939 1.00 70.57 C ATOM 1136 H VAL A 131 15.320 -10.079 39.329 1.00 0.00 H ATOM 1137 N ILE A 132 17.541 -6.290 38.608 1.00 60.86 N ATOM 1138 CA ILE A 132 18.595 -5.679 37.799 1.00 58.91 C ATOM 1139 C ILE A 132 19.803 -5.485 38.698 1.00 56.31 C ATOM 1140 O ILE A 132 19.741 -4.742 39.685 1.00 56.09 O ATOM 1141 CB ILE A 132 18.176 -4.358 37.098 1.00 62.52 C ATOM 1142 CG1 ILE A 132 16.692 -4.352 36.671 1.00 63.15 C ATOM 1143 CG2 ILE A 132 19.104 -4.057 35.916 1.00 63.63 C ATOM 1144 CD1 ILE A 132 15.809 -3.513 37.575 1.00 71.72 C ATOM 1145 H ILE A 132 17.023 -5.687 39.278 1.00 0.00 H ATOM 1146 N TYR A 133 20.880 -6.204 38.386 1.00 46.78 N ATOM 1147 CA TYR A 133 22.110 -6.148 39.162 1.00 43.16 C ATOM 1148 C TYR A 133 22.988 -5.048 38.601 1.00 43.59 C ATOM 1149 O TYR A 133 23.224 -4.994 37.389 1.00 43.31 O ATOM 1150 CB TYR A 133 22.844 -7.488 39.126 1.00 42.06 C ATOM 1151 CG TYR A 133 22.089 -8.659 39.708 1.00 40.82 C ATOM 1152 CD1 TYR A 133 22.131 -8.932 41.074 1.00 42.49 C ATOM 1153 CD2 TYR A 133 21.435 -9.567 38.883 1.00 40.90 C ATOM 1154 CE1 TYR A 133 21.517 -10.066 41.606 1.00 41.82 C ATOM 1155 CE2 TYR A 133 20.801 -10.691 39.402 1.00 42.05 C ATOM 1156 CZ TYR A 133 20.855 -10.946 40.764 1.00 52.15 C ATOM 1157 OH TYR A 133 20.220 -12.058 41.273 1.00 55.90 O ATOM 1158 HH TYR A 133 20.354 -12.093 42.253 1.00 0.00 H ATOM 1159 H TYR A 133 20.840 -6.829 37.556 1.00 0.00 H ATOM 1160 N THR A 134 23.464 -4.171 39.487 1.00 36.96 N ATOM 1161 CA THR A 134 24.284 -3.006 39.152 1.00 35.89 C ATOM 1162 C THR A 134 25.687 -3.058 39.780 1.00 37.25 C ATOM 1163 O THR A 134 26.503 -2.168 39.536 1.00 39.02 O ATOM 1164 CB THR A 134 23.533 -1.729 39.600 1.00 45.43 C ATOM 1165 OG1 THR A 134 23.344 -1.791 41.018 1.00 42.40 O ATOM 1166 CG2 THR A 134 22.178 -1.549 38.883 1.00 40.58 C ATOM 1167 HG1 THR A 134 22.864 -0.980 41.322 1.00 0.00 H ATOM 1168 H THR A 134 23.235 -4.327 40.490 1.00 0.00 H ATOM 1169 N ASP A 135 25.954 -4.057 40.623 1.00 29.29 N ATOM 1170 CA ASP A 135 27.253 -4.175 41.278 1.00 28.01 C ATOM 1171 C ASP A 135 27.821 -5.604 41.049 1.00 29.18 C ATOM 1172 O ASP A 135 27.775 -6.446 41.944 1.00 28.41 O ATOM 1173 CB ASP A 135 27.088 -3.836 42.768 1.00 28.68 C ATOM 1174 CG ASP A 135 28.374 -3.696 43.543 1.00 37.19 C ATOM 1175 OD1 ASP A 135 29.445 -3.587 42.909 1.00 37.83 O ATOM 1176 OD2 ASP A 135 28.310 -3.673 44.788 1.00 46.79 O ATOM 1177 H ASP A 135 25.220 -4.768 40.818 1.00 0.00 H ATOM 1178 N CYS A 136 28.340 -5.846 39.835 1.00 24.40 N ATOM 1179 CA CYS A 136 28.856 -7.136 39.350 1.00 22.77 C ATOM 1180 C CYS A 136 30.337 -7.101 39.125 1.00 23.87 C ATOM 1181 O CYS A 136 30.857 -6.160 38.520 1.00 21.78 O ATOM 1182 CB CYS A 136 28.125 -7.567 38.081 1.00 22.49 C ATOM 1183 SG CYS A 136 26.344 -7.788 38.287 1.00 26.17 S ATOM 1184 H CYS A 136 28.381 -5.045 39.173 1.00 0.00 H ATOM 1185 N TRP A 137 31.018 -8.160 39.573 1.00 17.62 N ATOM 1186 CA TRP A 137 32.464 -8.267 39.496 1.00 18.11 C ATOM 1187 C TRP A 137 32.888 -9.641 38.954 1.00 21.45 C ATOM 1188 O TRP A 137 32.359 -10.673 39.383 1.00 19.65 O ATOM 1189 CB TRP A 137 33.061 -8.093 40.904 1.00 18.53 C ATOM 1190 CG TRP A 137 32.819 -6.734 41.522 1.00 19.92 C ATOM 1191 CD1 TRP A 137 31.660 -6.266 42.073 1.00 22.66 C ATOM 1192 CD2 TRP A 137 33.797 -5.708 41.709 1.00 19.98 C ATOM 1193 NE1 TRP A 137 31.846 -4.981 42.543 1.00 22.23 N ATOM 1194 CE2 TRP A 137 33.141 -4.606 42.308 1.00 23.96 C ATOM 1195 CE3 TRP A 137 35.154 -5.582 41.361 1.00 21.16 C ATOM 1196 CZ2 TRP A 137 33.800 -3.402 42.577 1.00 23.71 C ATOM 1197 CZ3 TRP A 137 35.813 -4.397 41.657 1.00 22.95 C ATOM 1198 CH2 TRP A 137 35.145 -3.334 42.281 1.00 23.57 C ATOM 1199 HE1 TRP A 137 31.120 -4.394 43.001 1.00 0.00 H ATOM 1200 H TRP A 137 30.486 -8.946 39.998 1.00 0.00 H ATOM 1201 N VAL A 138 33.866 -9.635 38.032 1.00 18.49 N ATOM 1202 CA VAL A 138 34.480 -10.830 37.451 1.00 17.86 C ATOM 1203 C VAL A 138 35.857 -10.958 38.085 1.00 20.73 C ATOM 1204 O VAL A 138 36.581 -9.964 38.182 1.00 19.27 O ATOM 1205 CB VAL A 138 34.476 -10.871 35.890 1.00 21.27 C ATOM 1206 CG1 VAL A 138 35.292 -9.737 35.254 1.00 20.50 C ATOM 1207 CG2 VAL A 138 34.922 -12.230 35.378 1.00 21.12 C ATOM 1208 H VAL A 138 34.213 -8.710 37.706 1.00 0.00 H ATOM 1209 N THR A 139 36.186 -12.160 38.592 1.00 16.20 N ATOM 1210 CA THR A 139 37.435 -12.409 39.306 1.00 15.45 C ATOM 1211 C THR A 139 38.185 -13.587 38.729 1.00 19.82 C ATOM 1212 O THR A 139 37.573 -14.521 38.200 1.00 18.87 O ATOM 1213 CB THR A 139 37.140 -12.656 40.815 1.00 18.96 C ATOM 1214 OG1 THR A 139 36.096 -13.635 40.933 1.00 22.34 O ATOM 1215 CG2 THR A 139 36.706 -11.384 41.547 1.00 17.76 C ATOM 1216 HG1 THR A 139 36.387 -14.480 40.507 1.00 0.00 H ATOM 1217 H THR A 139 35.519 -12.949 38.470 1.00 0.00 H ATOM 1218 N GLY A 140 39.499 -13.570 38.882 1.00 15.74 N ATOM 1219 CA GLY A 140 40.299 -14.690 38.412 1.00 16.22 C ATOM 1220 C GLY A 140 41.787 -14.441 38.376 1.00 20.62 C ATOM 1221 O GLY A 140 42.247 -13.303 38.557 1.00 18.89 O ATOM 1222 H GLY A 140 39.959 -12.757 39.338 1.00 0.00 H ATOM 1223 N TRP A 141 42.556 -15.528 38.134 1.00 18.02 N ATOM 1224 CA TRP A 141 44.013 -15.427 37.989 1.00 18.29 C ATOM 1225 C TRP A 141 44.432 -15.414 36.495 1.00 21.28 C ATOM 1226 O TRP A 141 45.598 -15.596 36.201 1.00 19.70 O ATOM 1227 CB TRP A 141 44.715 -16.586 38.707 1.00 17.04 C ATOM 1228 CG TRP A 141 44.617 -16.524 40.199 1.00 17.90 C ATOM 1229 CD1 TRP A 141 45.507 -15.949 41.063 1.00 20.64 C ATOM 1230 CD2 TRP A 141 43.587 -17.114 41.007 1.00 17.15 C ATOM 1231 NE1 TRP A 141 45.082 -16.127 42.368 1.00 19.93 N ATOM 1232 CE2 TRP A 141 43.904 -16.836 42.361 1.00 20.36 C ATOM 1233 CE3 TRP A 141 42.449 -17.901 40.719 1.00 17.86 C ATOM 1234 CZ2 TRP A 141 43.140 -17.339 43.425 1.00 18.81 C ATOM 1235 CZ3 TRP A 141 41.648 -18.331 41.772 1.00 18.37 C ATOM 1236 CH2 TRP A 141 42.010 -18.070 43.111 1.00 18.43 C ATOM 1237 HE1 TRP A 141 45.574 -15.781 43.216 1.00 0.00 H ATOM 1238 H TRP A 141 42.102 -16.460 38.048 1.00 0.00 H ATOM 1239 N GLY A 142 43.476 -15.253 35.580 1.00 18.61 N ATOM 1240 CA GLY A 142 43.752 -15.275 34.146 1.00 18.85 C ATOM 1241 C GLY A 142 44.602 -14.122 33.630 1.00 24.85 C ATOM 1242 O GLY A 142 44.956 -13.195 34.374 1.00 22.31 O ATOM 1243 H GLY A 142 42.497 -15.106 35.899 1.00 0.00 H ATOM 1244 N TYR A 143 44.925 -14.183 32.329 1.00 22.74 N ATOM 1245 CA TYR A 143 45.753 -13.217 31.591 1.00 22.31 C ATOM 1246 C TYR A 143 45.163 -11.810 31.694 1.00 26.89 C ATOM 1247 O TYR A 143 43.955 -11.668 31.885 1.00 24.38 O ATOM 1248 CB TYR A 143 45.753 -13.606 30.107 1.00 21.46 C ATOM 1249 CG TYR A 143 46.523 -14.845 29.704 1.00 21.92 C ATOM 1250 CD1 TYR A 143 46.870 -15.816 30.641 1.00 22.77 C ATOM 1251 CD2 TYR A 143 46.837 -15.088 28.366 1.00 21.92 C ATOM 1252 CE1 TYR A 143 47.508 -16.992 30.260 1.00 22.06 C ATOM 1253 CE2 TYR A 143 47.454 -16.275 27.969 1.00 21.06 C ATOM 1254 CZ TYR A 143 47.793 -17.218 28.921 1.00 25.99 C ATOM 1255 OH TYR A 143 48.465 -18.348 28.542 1.00 26.42 O ATOM 1256 HH TYR A 143 48.630 -18.915 29.337 1.00 0.00 H ATOM 1257 H TYR A 143 44.554 -14.992 31.790 1.00 0.00 H ATOM 1258 N ARG A 145 45.999 -10.791 31.511 1.00 25.92 N ATOM 1259 CA ARG A 145 45.589 -9.380 31.505 1.00 27.53 C ATOM 1260 C ARG A 145 45.403 -8.909 30.071 1.00 32.08 C ATOM 1261 O ARG A 145 44.943 -7.795 29.854 1.00 31.62 O ATOM 1262 CB ARG A 145 46.627 -8.493 32.208 1.00 28.39 C ATOM 1263 CG ARG A 145 46.770 -8.735 33.707 1.00 29.63 C ATOM 1264 CD ARG A 145 48.118 -8.193 34.160 1.00 36.86 C ATOM 1265 NE ARG A 145 49.209 -8.842 33.415 1.00 51.35 N ATOM 1266 CZ ARG A 145 50.508 -8.676 33.649 1.00 70.91 C ATOM 1267 NH1 ARG A 145 50.919 -7.857 34.611 1.00 60.07 N ATOM 1268 NH2 ARG A 145 51.406 -9.331 32.926 1.00 59.90 N ATOM 1269 HE ARG A 145 48.942 -9.484 32.641 1.00 0.00 H ATOM 1270 HH12 ARG A 145 51.936 -7.732 34.788 1.00 0.00 H ATOM 1271 HH11 ARG A 145 50.224 -7.341 35.187 1.00 0.00 H ATOM 1272 HH22 ARG A 145 52.421 -9.198 33.112 1.00 0.00 H ATOM 1273 HH21 ARG A 145 51.096 -9.977 32.173 1.00 0.00 H ATOM 1274 H ARG A 145 47.006 -11.007 31.363 1.00 0.00 H ATOM 1275 N LYS A 146 45.768 -9.767 29.096 1.00 30.04 N ATOM 1276 CA LYS A 146 45.636 -9.555 27.646 1.00 30.46 C ATOM 1277 C LYS A 146 45.770 -10.902 26.955 1.00 33.24 C ATOM 1278 O LYS A 146 46.203 -11.861 27.599 1.00 30.46 O ATOM 1279 CB LYS A 146 46.650 -8.526 27.104 1.00 33.95 C ATOM 1280 CG LYS A 146 48.110 -8.834 27.430 1.00 48.63 C ATOM 1281 CD LYS A 146 49.017 -7.691 27.012 1.00 59.39 C ATOM 1282 CE LYS A 146 50.466 -8.105 26.937 1.00 71.09 C ATOM 1283 NZ LYS A 146 51.006 -8.517 28.262 1.00 81.60 N ATOM 1284 HZ1 LYS A 146 50.932 -7.721 28.928 1.00 0.00 H ATOM 1285 HZ2 LYS A 146 50.458 -9.324 28.622 1.00 0.00 H ATOM 1286 HZ3 LYS A 146 52.004 -8.792 28.158 1.00 0.00 H ATOM 1287 H LYS A 146 46.185 -10.670 29.400 1.00 0.00 H ATOM 1288 N LEU A 147 45.406 -10.985 25.657 1.00 31.47 N ATOM 1289 CA LEU A 147 45.438 -12.243 24.898 1.00 33.35 C ATOM 1290 C LEU A 147 46.740 -13.011 25.018 1.00 37.69 C ATOM 1291 O LEU A 147 46.697 -14.225 25.201 1.00 38.97 O ATOM 1292 CB LEU A 147 45.076 -12.022 23.413 1.00 33.77 C ATOM 1293 CG LEU A 147 43.984 -12.894 22.783 1.00 38.32 C ATOM 1294 CD1 LEU A 147 43.029 -13.490 23.794 1.00 37.89 C ATOM 1295 CD2 LEU A 147 43.199 -12.109 21.764 1.00 40.71 C ATOM 1296 H LEU A 147 45.089 -10.121 25.173 1.00 0.00 H ATOM 1297 N ARG A 148 47.886 -12.329 24.927 1.00 33.41 N ATOM 1298 CA ARG A 148 49.181 -13.013 25.041 1.00 33.63 C ATOM 1299 C ARG A 148 49.803 -12.538 26.340 1.00 35.46 C ATOM 1300 O ARG A 148 50.282 -11.404 26.443 1.00 35.55 O ATOM 1301 CB ARG A 148 50.085 -12.718 23.819 1.00 35.19 C ATOM 1302 H ARG A 148 47.860 -11.301 24.773 1.00 0.00 H ATOM 1303 N ASP A 149 49.683 -13.371 27.363 1.00 29.20 N ATOM 1304 CA ASP A 149 50.134 -13.045 28.702 1.00 27.58 C ATOM 1305 C ASP A 149 50.419 -14.333 29.459 1.00 31.07 C ATOM 1306 O ASP A 149 50.818 -15.338 28.869 1.00 29.27 O ATOM 1307 CB ASP A 149 49.056 -12.179 29.411 1.00 28.60 C ATOM 1308 CG ASP A 149 49.561 -11.327 30.565 1.00 32.64 C ATOM 1309 OD1 ASP A 149 50.763 -10.973 30.565 1.00 31.60 O ATOM 1310 OD2 ASP A 149 48.756 -11.021 31.470 1.00 29.90 O ATOM 1311 H ASP A 149 49.246 -14.300 27.198 1.00 0.00 H ATOM 1312 N LYS A 150 50.236 -14.290 30.776 1.00 28.54 N ATOM 1313 CA LYS A 150 50.491 -15.407 31.666 1.00 27.23 C ATOM 1314 C LYS A 150 49.521 -15.303 32.828 1.00 28.00 C ATOM 1315 O LYS A 150 48.963 -14.232 33.085 1.00 27.23 O ATOM 1316 CB LYS A 150 51.966 -15.371 32.158 1.00 29.85 C ATOM 1317 CG LYS A 150 52.375 -14.066 32.846 1.00 43.16 C ATOM 1318 CD LYS A 150 53.749 -14.152 33.515 1.00 65.08 C ATOM 1319 CE LYS A 150 54.912 -13.753 32.624 1.00 89.06 C ATOM 1320 NZ LYS A 150 54.951 -12.286 32.349 1.00 99.09 N ATOM 1321 HZ1 LYS A 150 54.072 -12.000 31.873 1.00 0.00 H ATOM 1322 HZ2 LYS A 150 55.045 -11.769 33.246 1.00 0.00 H ATOM 1323 HZ3 LYS A 150 55.764 -12.071 31.737 1.00 0.00 H ATOM 1324 H LYS A 150 49.889 -13.402 31.193 1.00 0.00 H ATOM 1325 N ILE A 151 49.325 -16.411 33.530 1.00 24.28 N ATOM 1326 CA ILE A 151 48.483 -16.492 34.732 1.00 22.88 C ATOM 1327 C ILE A 151 49.046 -15.490 35.761 1.00 27.08 C ATOM 1328 O ILE A 151 50.270 -15.331 35.854 1.00 27.37 O ATOM 1329 CB ILE A 151 48.470 -17.971 35.231 1.00 25.12 C ATOM 1330 CG1 ILE A 151 47.564 -18.851 34.329 1.00 24.93 C ATOM 1331 CG2 ILE A 151 48.140 -18.149 36.745 1.00 25.92 C ATOM 1332 CD1 ILE A 151 46.125 -18.358 34.072 1.00 28.12 C ATOM 1333 H ILE A 151 49.798 -17.280 33.209 1.00 0.00 H ATOM 1334 N GLN A 152 48.167 -14.763 36.454 1.00 21.84 N ATOM 1335 CA GLN A 152 48.576 -13.786 37.454 1.00 22.19 C ATOM 1336 C GLN A 152 48.680 -14.443 38.819 1.00 27.44 C ATOM 1337 O GLN A 152 47.884 -15.334 39.148 1.00 27.63 O ATOM 1338 CB GLN A 152 47.586 -12.607 37.486 1.00 23.81 C ATOM 1339 CG GLN A 152 47.460 -11.886 36.141 1.00 28.45 C ATOM 1340 CD GLN A 152 48.797 -11.346 35.711 1.00 39.56 C ATOM 1341 OE1 GLN A 152 49.319 -10.422 36.330 1.00 35.36 O ATOM 1342 NE2 GLN A 152 49.404 -11.946 34.680 1.00 27.23 N ATOM 1343 HE22 GLN A 152 48.931 -12.725 34.180 1.00 0.00 H ATOM 1344 HE21 GLN A 152 50.349 -11.633 34.379 1.00 0.00 H ATOM 1345 H GLN A 152 47.152 -14.899 36.273 1.00 0.00 H ATOM 1346 N ASN A 153 49.675 -14.034 39.601 1.00 22.78 N ATOM 1347 CA ASN A 153 49.875 -14.579 40.942 1.00 22.09 C ATOM 1348 C ASN A 153 48.710 -14.212 41.865 1.00 22.43 C ATOM 1349 O ASN A 153 48.148 -15.088 42.511 1.00 20.55 O ATOM 1350 CB ASN A 153 51.219 -14.092 41.535 1.00 22.05 C ATOM 1351 CG ASN A 153 51.581 -14.729 42.856 1.00 26.58 C ATOM 1352 OD1 ASN A 153 51.323 -15.910 43.097 1.00 26.63 O ATOM 1353 ND2 ASN A 153 52.219 -13.964 43.733 1.00 22.71 N ATOM 1354 HD22 ASN A 153 52.424 -12.970 43.504 1.00 0.00 H ATOM 1355 HD21 ASN A 153 52.514 -14.358 44.649 1.00 0.00 H ATOM 1356 H ASN A 153 50.329 -13.306 39.248 1.00 0.00 H ATOM 1357 N THR A 154 48.334 -12.929 41.901 1.00 19.21 N ATOM 1358 CA THR A 154 47.279 -12.403 42.766 1.00 19.18 C ATOM 1359 C THR A 154 45.927 -12.410 42.084 1.00 23.70 C ATOM 1360 O THR A 154 45.806 -11.917 40.946 1.00 22.59 O ATOM 1361 CB THR A 154 47.634 -10.964 43.261 1.00 26.50 C ATOM 1362 OG1 THR A 154 48.967 -10.932 43.790 1.00 26.00 O ATOM 1363 CG2 THR A 154 46.661 -10.454 44.319 1.00 24.39 C ATOM 1364 HG1 THR A 154 49.034 -11.561 44.551 1.00 0.00 H ATOM 1365 H THR A 154 48.824 -12.261 41.272 1.00 0.00 H ATOM 1366 N LEU A 155 44.888 -12.910 42.804 1.00 19.30 N ATOM 1367 CA LEU A 155 43.525 -12.890 42.282 1.00 18.72 C ATOM 1368 C LEU A 155 43.151 -11.450 41.877 1.00 24.74 C ATOM 1369 O LEU A 155 43.273 -10.534 42.700 1.00 25.44 O ATOM 1370 CB LEU A 155 42.544 -13.422 43.343 1.00 17.82 C ATOM 1371 CG LEU A 155 41.078 -13.572 42.943 1.00 19.63 C ATOM 1372 CD1 LEU A 155 40.906 -14.609 41.858 1.00 18.11 C ATOM 1373 CD2 LEU A 155 40.229 -13.981 44.160 1.00 20.10 C ATOM 1374 H LEU A 155 45.068 -13.315 43.745 1.00 0.00 H ATOM 1375 N GLN A 156 42.673 -11.261 40.626 1.00 19.63 N ATOM 1376 CA GLN A 156 42.278 -9.922 40.154 1.00 19.55 C ATOM 1377 C GLN A 156 40.790 -9.801 40.150 1.00 21.37 C ATOM 1378 O GLN A 156 40.111 -10.810 40.099 1.00 19.73 O ATOM 1379 CB GLN A 156 42.805 -9.678 38.736 1.00 20.68 C ATOM 1380 CG GLN A 156 44.327 -9.871 38.647 1.00 20.87 C ATOM 1381 CD GLN A 156 45.067 -8.651 39.112 1.00 32.07 C ATOM 1382 OE1 GLN A 156 44.857 -7.546 38.606 1.00 31.18 O ATOM 1383 NE2 GLN A 156 45.935 -8.829 40.100 1.00 28.24 N ATOM 1384 HE22 GLN A 156 46.082 -9.778 40.498 1.00 0.00 H ATOM 1385 HE21 GLN A 156 46.468 -8.019 40.476 1.00 0.00 H ATOM 1386 H GLN A 156 42.583 -12.075 39.986 1.00 0.00 H ATOM 1387 N LYS A 157 40.280 -8.564 40.195 1.00 18.90 N ATOM 1388 CA LYS A 157 38.855 -8.263 40.124 1.00 18.15 C ATOM 1389 C LYS A 157 38.617 -7.118 39.161 1.00 23.70 C ATOM 1390 O LYS A 157 39.462 -6.224 39.038 1.00 24.18 O ATOM 1391 CB LYS A 157 38.303 -7.906 41.518 1.00 20.17 C ATOM 1392 CG LYS A 157 39.051 -6.736 42.179 1.00 26.29 C ATOM 1393 CD LYS A 157 38.552 -6.418 43.549 1.00 26.75 C ATOM 1394 CE LYS A 157 39.193 -5.131 44.008 1.00 30.81 C ATOM 1395 NZ LYS A 157 38.542 -4.647 45.241 1.00 39.40 N ATOM 1396 HZ1 LYS A 157 37.533 -4.477 45.055 1.00 0.00 H ATOM 1397 HZ2 LYS A 157 38.642 -5.363 45.989 1.00 0.00 H ATOM 1398 HZ3 LYS A 157 38.993 -3.761 45.545 1.00 0.00 H ATOM 1399 H LYS A 157 40.942 -7.767 40.286 1.00 0.00 H ATOM 1400 N ALA A 158 37.449 -7.118 38.510 1.00 20.04 N ATOM 1401 CA ALA A 158 37.036 -6.039 37.618 1.00 20.21 C ATOM 1402 C ALA A 158 35.534 -5.916 37.728 1.00 23.17 C ATOM 1403 O ALA A 158 34.816 -6.919 37.693 1.00 20.07 O ATOM 1404 CB ALA A 158 37.434 -6.329 36.174 1.00 19.92 C ATOM 1405 H ALA A 158 36.805 -7.924 38.645 1.00 0.00 H ATOM 1406 N LYS A 159 35.066 -4.697 37.926 1.00 21.04 N ATOM 1407 CA LYS A 159 33.628 -4.416 38.005 1.00 21.24 C ATOM 1408 C LYS A 159 33.149 -4.206 36.584 1.00 24.62 C ATOM 1409 O LYS A 159 33.757 -3.426 35.850 1.00 23.65 O ATOM 1410 CB LYS A 159 33.350 -3.172 38.852 1.00 23.69 C ATOM 1411 CG LYS A 159 31.863 -2.903 39.054 1.00 26.04 C ATOM 1412 CD LYS A 159 31.679 -1.745 40.023 1.00 32.23 C ATOM 1413 CE LYS A 159 30.230 -1.346 40.106 1.00 41.90 C ATOM 1414 NZ LYS A 159 30.010 -0.329 41.169 1.00 48.86 N ATOM 1415 HZ1 LYS A 159 30.299 -0.721 42.088 1.00 0.00 H ATOM 1416 HZ2 LYS A 159 30.576 0.518 40.959 1.00 0.00 H ATOM 1417 HZ3 LYS A 159 29.002 -0.075 41.201 1.00 0.00 H ATOM 1418 H LYS A 159 35.739 -3.911 38.029 1.00 0.00 H ATOM 1419 N ILE A 160 32.092 -4.918 36.176 1.00 22.82 N ATOM 1420 CA ILE A 160 31.627 -4.829 34.790 1.00 24.17 C ATOM 1421 C ILE A 160 30.125 -4.725 34.751 1.00 27.40 C ATOM 1422 O ILE A 160 29.475 -5.388 35.552 1.00 28.99 O ATOM 1423 CB ILE A 160 32.141 -6.034 33.929 1.00 28.87 C ATOM 1424 CG1 ILE A 160 31.859 -7.390 34.638 1.00 30.89 C ATOM 1425 CG2 ILE A 160 33.635 -5.901 33.554 1.00 31.25 C ATOM 1426 CD1 ILE A 160 32.125 -8.584 33.800 1.00 44.05 C ATOM 1427 H ILE A 160 31.597 -5.539 36.848 1.00 0.00 H ATOM 1428 N PRO A 161 29.520 -3.940 33.832 1.00 21.38 N ATOM 1429 CA PRO A 161 28.046 -3.882 33.818 1.00 21.17 C ATOM 1430 C PRO A 161 27.462 -5.064 33.061 1.00 24.45 C ATOM 1431 O PRO A 161 28.052 -5.505 32.080 1.00 24.11 O ATOM 1432 CB PRO A 161 27.742 -2.552 33.096 1.00 22.39 C ATOM 1433 CG PRO A 161 28.920 -2.348 32.176 1.00 26.06 C ATOM 1434 CD PRO A 161 30.120 -3.031 32.829 1.00 22.02 C ATOM 1435 N LEU A 162 26.284 -5.527 33.475 1.00 21.64 N ATOM 1436 CA LEU A 162 25.543 -6.547 32.743 1.00 22.80 C ATOM 1437 C LEU A 162 24.976 -5.889 31.482 1.00 28.86 C ATOM 1438 O LEU A 162 24.670 -4.692 31.471 1.00 29.56 O ATOM 1439 CB LEU A 162 24.378 -7.112 33.575 1.00 22.62 C ATOM 1440 CG LEU A 162 24.751 -7.874 34.851 1.00 27.91 C ATOM 1441 CD1 LEU A 162 23.501 -8.505 35.471 1.00 27.46 C ATOM 1442 CD2 LEU A 162 25.799 -8.988 34.562 1.00 29.94 C ATOM 1443 H LEU A 162 25.877 -5.147 34.353 1.00 0.00 H ATOM 1444 N VAL A 163 24.842 -6.679 30.434 1.00 26.10 N ATOM 1445 CA VAL A 163 24.362 -6.257 29.117 1.00 26.21 C ATOM 1446 C VAL A 163 23.098 -7.065 28.808 1.00 29.33 C ATOM 1447 O VAL A 163 23.037 -8.243 29.159 1.00 29.33 O ATOM 1448 CB VAL A 163 25.515 -6.514 28.110 1.00 29.97 C ATOM 1449 CG1 VAL A 163 25.047 -6.469 26.666 1.00 29.39 C ATOM 1450 CG2 VAL A 163 26.664 -5.537 28.345 1.00 29.71 C ATOM 1451 H VAL A 163 25.097 -7.680 30.553 1.00 0.00 H ATOM 1452 N THR A 164 22.058 -6.431 28.222 1.00 24.70 N ATOM 1453 CA THR A 164 20.839 -7.176 27.890 1.00 23.67 C ATOM 1454 C THR A 164 21.160 -8.225 26.810 1.00 24.75 C ATOM 1455 O THR A 164 22.094 -8.062 26.030 1.00 22.84 O ATOM 1456 CB THR A 164 19.707 -6.248 27.378 1.00 28.71 C ATOM 1457 OG1 THR A 164 20.131 -5.674 26.144 1.00 28.62 O ATOM 1458 CG2 THR A 164 19.309 -5.140 28.394 1.00 26.91 C ATOM 1459 HG1 THR A 164 19.421 -5.076 25.798 1.00 0.00 H ATOM 1460 H THR A 164 22.122 -5.416 28.007 1.00 0.00 H ATOM 1461 N ASN A 165 20.346 -9.265 26.748 1.00 23.86 N ATOM 1462 CA ASN A 165 20.429 -10.322 25.754 1.00 24.64 C ATOM 1463 C ASN A 165 20.361 -9.703 24.339 1.00 28.07 C ATOM 1464 O ASN A 165 21.107 -10.124 23.465 1.00 24.37 O ATOM 1465 CB ASN A 165 19.249 -11.286 25.970 1.00 25.95 C ATOM 1466 CG ASN A 165 19.152 -12.346 24.927 1.00 43.70 C ATOM 1467 OD1 ASN A 165 18.376 -12.234 23.974 1.00 37.76 O ATOM 1468 ND2 ASN A 165 19.950 -13.385 25.071 1.00 37.05 N ATOM 1469 HD22 ASN A 165 20.589 -13.440 25.890 1.00 0.00 H ATOM 1470 HD21 ASN A 165 19.940 -14.150 24.366 1.00 0.00 H ATOM 1471 H ASN A 165 19.592 -9.331 27.462 1.00 0.00 H ATOM 1472 N GLU A 166 19.435 -8.730 24.124 1.00 25.77 N ATOM 1473 CA GLU A 166 19.241 -8.026 22.841 1.00 25.66 C ATOM 1474 C GLU A 166 20.507 -7.341 22.393 1.00 26.68 C ATOM 1475 O GLU A 166 20.912 -7.500 21.248 1.00 25.97 O ATOM 1476 CB GLU A 166 18.082 -7.008 22.955 1.00 27.16 C ATOM 1477 CG GLU A 166 17.908 -6.075 21.768 1.00 43.63 C ATOM 1478 CD GLU A 166 16.622 -5.264 21.752 1.00 71.41 C ATOM 1479 OE1 GLU A 166 16.043 -5.018 22.837 1.00 63.44 O ATOM 1480 OE2 GLU A 166 16.188 -4.881 20.642 1.00 72.56 O ATOM 1481 H GLU A 166 18.820 -8.463 24.919 1.00 0.00 H ATOM 1482 N GLU A 167 21.128 -6.569 23.287 1.00 24.79 N ATOM 1483 CA GLU A 167 22.386 -5.892 22.998 1.00 25.28 C ATOM 1484 C GLU A 167 23.535 -6.905 22.763 1.00 27.42 C ATOM 1485 O GLU A 167 24.367 -6.698 21.874 1.00 25.05 O ATOM 1486 CB GLU A 167 22.729 -4.926 24.133 1.00 27.32 C ATOM 1487 CG GLU A 167 24.119 -4.324 24.011 1.00 41.05 C ATOM 1488 CD GLU A 167 24.217 -2.857 23.669 1.00 68.84 C ATOM 1489 OE1 GLU A 167 23.515 -2.405 22.734 1.00 83.56 O ATOM 1490 OE2 GLU A 167 25.059 -2.174 24.293 1.00 53.92 O ATOM 1491 H GLU A 167 20.698 -6.446 24.226 1.00 0.00 H ATOM 1492 N CYS A 168 23.577 -7.991 23.556 1.00 23.65 N ATOM 1493 CA CYS A 168 24.633 -8.998 23.393 1.00 21.91 C ATOM 1494 C CYS A 168 24.485 -9.733 22.090 1.00 23.98 C ATOM 1495 O CYS A 168 25.491 -10.026 21.447 1.00 21.43 O ATOM 1496 CB CYS A 168 24.676 -9.959 24.573 1.00 21.44 C ATOM 1497 SG CYS A 168 26.143 -11.030 24.598 1.00 23.97 S ATOM 1498 H CYS A 168 22.854 -8.119 24.292 1.00 0.00 H ATOM 1499 N GLN A 168A 23.234 -9.993 21.664 1.00 22.96 N ATOM 1500 CA GLN A 168A 23.004 -10.660 20.384 1.00 23.27 C ATOM 1501 C GLN A 168A 23.498 -9.788 19.216 1.00 27.40 C ATOM 1502 O GLN A 168A 24.148 -10.313 18.310 1.00 26.14 O ATOM 1503 CB GLN A 168A 21.530 -11.082 20.192 1.00 24.66 C ATOM 1504 CG GLN A 168A 21.282 -11.697 18.791 1.00 25.83 C ATOM 1505 CD GLN A 168A 22.016 -13.017 18.640 1.00 33.48 C ATOM 1506 OE1 GLN A 168A 21.606 -14.012 19.219 1.00 24.00 O ATOM 1507 NE2 GLN A 168A 23.158 -13.043 17.917 1.00 21.65 N ATOM 1508 HE22 GLN A 168A 23.487 -12.183 17.433 1.00 0.00 H ATOM 1509 HE21 GLN A 168A 23.708 -13.923 17.845 1.00 0.00 H ATOM 1510 H GLN A 168A 22.423 -9.716 22.253 1.00 0.00 H ATOM 1511 N LYS A 169 23.269 -8.462 19.262 1.00 26.08 N ATOM 1512 CA LYS A 169 23.761 -7.617 18.160 1.00 26.87 C ATOM 1513 C LYS A 169 25.287 -7.526 18.136 1.00 29.31 C ATOM 1514 O LYS A 169 25.842 -7.312 17.064 1.00 30.27 O ATOM 1515 CB LYS A 169 23.090 -6.216 18.077 1.00 30.50 C ATOM 1516 CG LYS A 169 23.258 -5.285 19.237 1.00 48.40 C ATOM 1517 CD LYS A 169 21.928 -4.559 19.503 1.00 63.14 C ATOM 1518 CE LYS A 169 21.874 -3.143 18.984 1.00 67.71 C ATOM 1519 NZ LYS A 169 20.642 -2.446 19.442 1.00 75.27 N ATOM 1520 HZ1 LYS A 169 19.806 -2.958 19.095 1.00 0.00 H ATOM 1521 HZ2 LYS A 169 20.627 -2.419 20.482 1.00 0.00 H ATOM 1522 HZ3 LYS A 169 20.635 -1.475 19.068 1.00 0.00 H ATOM 1523 H LYS A 169 22.754 -8.042 20.062 1.00 0.00 H ATOM 1524 N ARG A 170 25.963 -7.799 19.278 1.00 22.87 N ATOM 1525 CA ARG A 170 27.428 -7.786 19.362 1.00 22.08 C ATOM 1526 C ARG A 170 28.046 -9.073 18.846 1.00 24.46 C ATOM 1527 O ARG A 170 29.228 -9.103 18.532 1.00 24.61 O ATOM 1528 CB ARG A 170 27.906 -7.553 20.808 1.00 22.51 C ATOM 1529 CG ARG A 170 27.425 -6.268 21.452 1.00 29.68 C ATOM 1530 CD ARG A 170 27.797 -5.035 20.671 1.00 35.21 C ATOM 1531 NE ARG A 170 27.160 -3.846 21.223 1.00 35.77 N ATOM 1532 CZ ARG A 170 26.587 -2.902 20.491 1.00 49.98 C ATOM 1533 NH1 ARG A 170 26.031 -1.852 21.074 1.00 40.43 N ATOM 1534 NH2 ARG A 170 26.573 -2.996 19.163 1.00 32.73 N ATOM 1535 HE ARG A 170 27.155 -3.731 22.257 1.00 0.00 H ATOM 1536 HH12 ARG A 170 25.582 -1.113 20.496 1.00 0.00 H ATOM 1537 HH11 ARG A 170 26.043 -1.766 22.110 1.00 0.00 H ATOM 1538 HH22 ARG A 170 26.122 -2.252 18.594 1.00 0.00 H ATOM 1539 HH21 ARG A 170 27.013 -3.814 18.695 1.00 0.00 H ATOM 1540 H ARG A 170 25.419 -8.028 20.134 1.00 0.00 H ATOM 1541 N TYR A 171 27.257 -10.137 18.775 1.00 21.34 N ATOM 1542 CA TYR A 171 27.716 -11.453 18.339 1.00 19.96 C ATOM 1543 C TYR A 171 26.877 -11.960 17.196 1.00 23.51 C ATOM 1544 O TYR A 171 26.092 -12.900 17.352 1.00 22.48 O ATOM 1545 CB TYR A 171 27.755 -12.441 19.535 1.00 19.36 C ATOM 1546 CG TYR A 171 28.921 -12.171 20.460 1.00 19.38 C ATOM 1547 CD1 TYR A 171 30.210 -12.564 20.117 1.00 19.80 C ATOM 1548 CD2 TYR A 171 28.734 -11.531 21.685 1.00 19.98 C ATOM 1549 CE1 TYR A 171 31.287 -12.314 20.957 1.00 20.42 C ATOM 1550 CE2 TYR A 171 29.804 -11.309 22.554 1.00 19.87 C ATOM 1551 CZ TYR A 171 31.075 -11.712 22.186 1.00 25.79 C ATOM 1552 OH TYR A 171 32.146 -11.480 22.996 1.00 19.80 O ATOM 1553 HH TYR A 171 32.004 -11.930 23.866 1.00 0.00 H ATOM 1554 H TYR A 171 26.258 -10.028 19.044 1.00 0.00 H ATOM 1555 N ARG A 172 26.997 -11.281 16.057 1.00 23.83 N ATOM 1556 CA ARG A 172 26.334 -11.664 14.805 1.00 27.27 C ATOM 1557 C ARG A 172 26.918 -13.037 14.408 1.00 31.89 C ATOM 1558 O ARG A 172 28.137 -13.246 14.468 1.00 32.56 O ATOM 1559 CB ARG A 172 26.646 -10.615 13.704 1.00 33.63 C ATOM 1560 CG ARG A 172 25.790 -10.742 12.451 1.00 52.42 C ATOM 1561 H ARG A 172 27.595 -10.430 16.054 1.00 0.00 H ATOM 1562 N GLY A 173 26.064 -13.982 14.079 1.00 27.97 N ATOM 1563 CA GLY A 173 26.577 -15.301 13.720 1.00 26.45 C ATOM 1564 C GLY A 173 26.520 -16.291 14.856 1.00 27.82 C ATOM 1565 O GLY A 173 26.707 -17.484 14.628 1.00 27.92 O ATOM 1566 H GLY A 173 25.041 -13.793 14.075 1.00 0.00 H ATOM 1567 N HIS A 174 26.281 -15.818 16.090 1.00 23.16 N ATOM 1568 CA HIS A 174 26.097 -16.726 17.246 1.00 22.60 C ATOM 1569 C HIS A 174 24.646 -16.637 17.643 1.00 26.89 C ATOM 1570 O HIS A 174 23.994 -15.649 17.332 1.00 27.57 O ATOM 1571 CB HIS A 174 26.919 -16.265 18.457 1.00 23.00 C ATOM 1572 CG HIS A 174 28.352 -16.645 18.386 1.00 25.43 C ATOM 1573 ND1 HIS A 174 29.283 -15.822 17.785 1.00 27.45 N ATOM 1574 CD2 HIS A 174 28.967 -17.752 18.836 1.00 26.05 C ATOM 1575 CE1 HIS A 174 30.437 -16.450 17.895 1.00 26.15 C ATOM 1576 NE2 HIS A 174 30.289 -17.623 18.504 1.00 26.19 N ATOM 1577 H HIS A 174 26.224 -14.790 16.238 1.00 0.00 H ATOM 1578 N LYS A 175 24.151 -17.617 18.371 1.00 25.41 N ATOM 1579 CA LYS A 175 22.825 -17.526 18.946 1.00 25.71 C ATOM 1580 C LYS A 175 23.042 -17.284 20.448 1.00 29.05 C ATOM 1581 O LYS A 175 23.467 -18.203 21.160 1.00 29.17 O ATOM 1582 CB LYS A 175 21.977 -18.796 18.664 1.00 28.39 C ATOM 1583 CG LYS A 175 20.567 -18.758 19.285 1.00 51.05 C ATOM 1584 CD LYS A 175 19.735 -17.511 18.891 1.00 56.13 C ATOM 1585 CE LYS A 175 18.630 -17.200 19.871 1.00 60.07 C ATOM 1586 NZ LYS A 175 18.425 -15.727 20.017 1.00 67.62 N ATOM 1587 HZ1 LYS A 175 19.303 -15.288 20.361 1.00 0.00 H ATOM 1588 HZ2 LYS A 175 18.171 -15.320 19.094 1.00 0.00 H ATOM 1589 HZ3 LYS A 175 17.659 -15.551 20.698 1.00 0.00 H ATOM 1590 H LYS A 175 24.722 -18.470 18.536 1.00 0.00 H ATOM 1591 N ILE A 176 22.816 -16.034 20.911 1.00 23.84 N ATOM 1592 CA ILE A 176 22.932 -15.676 22.333 1.00 22.24 C ATOM 1593 C ILE A 176 21.560 -15.950 22.987 1.00 27.55 C ATOM 1594 O ILE A 176 20.587 -15.228 22.761 1.00 27.66 O ATOM 1595 CB ILE A 176 23.485 -14.238 22.607 1.00 23.12 C ATOM 1596 CG1 ILE A 176 24.795 -13.943 21.782 1.00 22.91 C ATOM 1597 CG2 ILE A 176 23.721 -14.036 24.117 1.00 21.24 C ATOM 1598 CD1 ILE A 176 26.117 -14.882 22.156 1.00 18.70 C ATOM 1599 H ILE A 176 22.548 -15.293 20.232 1.00 0.00 H ATOM 1600 N THR A 177 21.485 -17.034 23.735 1.00 25.41 N ATOM 1601 CA THR A 177 20.240 -17.489 24.365 1.00 24.89 C ATOM 1602 C THR A 177 20.087 -16.843 25.725 1.00 28.84 C ATOM 1603 O THR A 177 21.067 -16.326 26.258 1.00 25.97 O ATOM 1604 CB THR A 177 20.289 -19.010 24.522 1.00 34.20 C ATOM 1605 OG1 THR A 177 21.274 -19.313 25.522 1.00 35.89 O ATOM 1606 CG2 THR A 177 20.620 -19.742 23.192 1.00 28.20 C ATOM 1607 HG1 THR A 177 21.017 -18.886 26.377 1.00 0.00 H ATOM 1608 H THR A 177 22.349 -17.593 23.885 1.00 0.00 H ATOM 1609 N HIS A 178 18.880 -16.955 26.334 1.00 28.27 N ATOM 1610 CA HIS A 178 18.617 -16.441 27.677 1.00 28.90 C ATOM 1611 C HIS A 178 19.302 -17.292 28.774 1.00 28.40 C ATOM 1612 O HIS A 178 19.300 -16.905 29.943 1.00 26.28 O ATOM 1613 CB HIS A 178 17.115 -16.253 27.908 1.00 31.81 C ATOM 1614 CG HIS A 178 16.602 -14.992 27.274 1.00 36.99 C ATOM 1615 ND1 HIS A 178 16.004 -15.004 26.021 1.00 39.80 N ATOM 1616 CD2 HIS A 178 16.677 -13.711 27.710 1.00 39.50 C ATOM 1617 CE1 HIS A 178 15.696 -13.741 25.760 1.00 39.66 C ATOM 1618 NE2 HIS A 178 16.074 -12.928 26.750 1.00 39.90 N ATOM 1619 H HIS A 178 18.107 -17.428 25.823 1.00 0.00 H ATOM 1620 N LYS A 179 19.936 -18.421 28.374 1.00 23.80 N ATOM 1621 CA LYS A 179 20.733 -19.276 29.267 1.00 23.14 C ATOM 1622 C LYS A 179 22.182 -18.741 29.380 1.00 23.04 C ATOM 1623 O LYS A 179 23.019 -19.275 30.121 1.00 22.08 O ATOM 1624 CB LYS A 179 20.663 -20.747 28.846 1.00 26.89 C ATOM 1625 CG LYS A 179 19.283 -21.362 29.152 1.00 31.89 C ATOM 1626 CD LYS A 179 19.328 -22.879 29.138 1.00 35.77 C ATOM 1627 CE LYS A 179 18.291 -23.493 30.035 1.00 45.92 C ATOM 1628 NZ LYS A 179 16.924 -23.324 29.495 1.00 56.98 N ATOM 1629 HZ1 LYS A 179 16.713 -22.310 29.399 1.00 0.00 H ATOM 1630 HZ2 LYS A 179 16.862 -23.782 28.563 1.00 0.00 H ATOM 1631 HZ3 LYS A 179 16.240 -23.762 30.144 1.00 0.00 H ATOM 1632 H LYS A 179 19.854 -18.700 27.375 1.00 0.00 H ATOM 1633 N MET A 180 22.451 -17.668 28.639 1.00 18.85 N ATOM 1634 CA MET A 180 23.701 -16.905 28.661 1.00 18.74 C ATOM 1635 C MET A 180 23.408 -15.512 29.209 1.00 22.69 C ATOM 1636 O MET A 180 22.298 -15.008 29.050 1.00 21.34 O ATOM 1637 CB MET A 180 24.289 -16.748 27.249 1.00 20.41 C ATOM 1638 CG MET A 180 24.739 -18.061 26.639 1.00 22.89 C ATOM 1639 SD MET A 180 25.017 -17.842 24.883 1.00 25.58 S ATOM 1640 CE MET A 180 25.457 -19.469 24.447 1.00 22.14 C ATOM 1641 H MET A 180 21.708 -17.343 27.987 1.00 0.00 H ATOM 1642 N ILE A 181 24.393 -14.906 29.874 1.00 18.78 N ATOM 1643 CA ILE A 181 24.286 -13.546 30.344 1.00 19.48 C ATOM 1644 C ILE A 181 25.612 -12.871 29.967 1.00 23.20 C ATOM 1645 O ILE A 181 26.681 -13.474 30.127 1.00 19.72 O ATOM 1646 CB ILE A 181 23.912 -13.445 31.848 1.00 23.00 C ATOM 1647 CG1 ILE A 181 23.541 -11.980 32.230 1.00 24.15 C ATOM 1648 CG2 ILE A 181 25.007 -14.066 32.775 1.00 22.84 C ATOM 1649 CD1 ILE A 181 22.840 -11.815 33.558 1.00 31.38 C ATOM 1650 H ILE A 181 25.270 -15.433 30.060 1.00 0.00 H ATOM 1651 N CYS A 182 25.534 -11.652 29.394 1.00 19.48 N ATOM 1652 CA CYS A 182 26.735 -10.962 28.964 1.00 19.44 C ATOM 1653 C CYS A 182 27.059 -9.800 29.831 1.00 22.68 C ATOM 1654 O CYS A 182 26.160 -9.210 30.420 1.00 21.84 O ATOM 1655 CB CYS A 182 26.617 -10.552 27.505 1.00 20.09 C ATOM 1656 SG CYS A 182 25.975 -11.862 26.441 1.00 24.24 S ATOM 1657 H CYS A 182 24.605 -11.204 29.260 1.00 0.00 H ATOM 1658 N ALA A 183 28.341 -9.431 29.870 1.00 19.13 N ATOM 1659 CA ALA A 183 28.812 -8.301 30.666 1.00 19.48 C ATOM 1660 C ALA A 183 30.037 -7.662 30.037 1.00 26.01 C ATOM 1661 O ALA A 183 30.963 -8.347 29.591 1.00 26.41 O ATOM 1662 CB ALA A 183 29.105 -8.735 32.106 1.00 19.34 C ATOM 1663 H ALA A 183 29.033 -9.970 29.311 1.00 0.00 H ATOM 1664 N GLY A 184 30.012 -6.346 29.977 1.00 23.88 N ATOM 1665 CA GLY A 184 31.125 -5.572 29.448 1.00 23.46 C ATOM 1666 C GLY A 184 30.746 -4.147 29.132 1.00 26.27 C ATOM 1667 O GLY A 184 29.559 -3.820 29.066 1.00 25.32 O ATOM 1668 H GLY A 184 29.168 -5.843 30.319 1.00 0.00 H ATOM 1669 N TYR A 184A 31.760 -3.291 29.002 1.00 23.21 N ATOM 1670 CA TYR A 184A 31.599 -1.890 28.639 1.00 23.81 C ATOM 1671 C TYR A 184A 31.581 -1.835 27.113 1.00 27.57 C ATOM 1672 O TYR A 184A 32.381 -2.530 26.467 1.00 24.65 O ATOM 1673 CB TYR A 184A 32.777 -1.046 29.148 1.00 24.36 C ATOM 1674 CG TYR A 184A 32.867 -0.997 30.654 1.00 27.53 C ATOM 1675 CD1 TYR A 184A 32.167 -0.036 31.386 1.00 29.07 C ATOM 1676 CD2 TYR A 184A 33.647 -1.915 31.354 1.00 28.02 C ATOM 1677 CE1 TYR A 184A 32.255 0.014 32.782 1.00 30.93 C ATOM 1678 CE2 TYR A 184A 33.741 -1.875 32.744 1.00 28.90 C ATOM 1679 CZ TYR A 184A 33.033 -0.920 33.456 1.00 35.27 C ATOM 1680 OH TYR A 184A 33.119 -0.925 34.831 1.00 36.01 O ATOM 1681 HH TYR A 184A 32.792 -1.793 35.178 1.00 0.00 H ATOM 1682 H TYR A 184A 32.723 -3.645 29.170 1.00 0.00 H ATOM 1683 N ARG A 184B 30.712 -0.981 26.543 1.00 24.49 N ATOM 1684 CA ARG A 184B 30.631 -0.803 25.091 1.00 25.24 C ATOM 1685 C ARG A 184B 32.009 -0.492 24.510 1.00 26.96 C ATOM 1686 O ARG A 184B 32.357 -1.016 23.462 1.00 24.91 O ATOM 1687 CB ARG A 184B 29.632 0.307 24.706 1.00 27.26 C ATOM 1688 CG ARG A 184B 29.166 0.186 23.252 1.00 40.13 C ATOM 1689 CD ARG A 184B 28.359 1.386 22.761 1.00 46.37 C ATOM 1690 NE ARG A 184B 27.718 1.112 21.470 1.00 54.39 N ATOM 1691 CZ ARG A 184B 28.303 1.262 20.281 1.00 71.02 C ATOM 1692 NH1 ARG A 184B 29.554 1.707 20.197 1.00 65.05 N ATOM 1693 NH2 ARG A 184B 27.641 0.969 19.169 1.00 48.40 N ATOM 1694 HE ARG A 184B 26.734 0.776 21.483 1.00 0.00 H ATOM 1695 HH12 ARG A 184B 30.004 1.822 19.266 1.00 0.00 H ATOM 1696 HH11 ARG A 184B 30.082 1.940 21.062 1.00 0.00 H ATOM 1697 HH22 ARG A 184B 28.101 1.087 18.244 1.00 0.00 H ATOM 1698 HH21 ARG A 184B 26.662 0.621 19.223 1.00 0.00 H ATOM 1699 H ARG A 184B 30.076 -0.429 27.153 1.00 0.00 H ATOM 1700 N GLU A 185 32.810 0.302 25.232 1.00 23.16 N ATOM 1701 CA GLU A 185 34.142 0.708 24.797 1.00 23.23 C ATOM 1702 C GLU A 185 35.206 -0.371 25.066 1.00 25.92 C ATOM 1703 O GLU A 185 36.361 -0.209 24.656 1.00 24.56 O ATOM 1704 CB GLU A 185 34.509 2.052 25.498 1.00 25.81 C ATOM 1705 CG GLU A 185 34.544 1.984 27.042 1.00 43.83 C ATOM 1706 CD GLU A 185 33.296 2.319 27.857 1.00 63.45 C ATOM 1707 OE1 GLU A 185 32.157 2.087 27.383 1.00 30.33 O ATOM 1708 OE2 GLU A 185 33.473 2.793 29.004 1.00 65.64 O ATOM 1709 H GLU A 185 32.465 0.647 26.150 1.00 0.00 H ATOM 1710 N GLY A 186 34.824 -1.442 25.789 1.00 22.86 N ATOM 1711 CA GLY A 186 35.746 -2.516 26.164 1.00 21.54 C ATOM 1712 C GLY A 186 36.638 -2.080 27.312 1.00 25.47 C ATOM 1713 O GLY A 186 36.324 -1.117 28.005 1.00 26.05 O ATOM 1714 H GLY A 186 33.832 -1.509 26.094 1.00 0.00 H ATOM 1715 N GLY A 187 37.756 -2.761 27.506 1.00 22.80 N ATOM 1716 CA GLY A 187 38.706 -2.384 28.544 1.00 23.61 C ATOM 1717 C GLY A 187 38.725 -3.249 29.789 1.00 26.41 C ATOM 1718 O GLY A 187 39.764 -3.359 30.424 1.00 26.04 O ATOM 1719 H GLY A 187 37.961 -3.584 26.904 1.00 0.00 H ATOM 1720 N LYS A 188 37.576 -3.802 30.193 1.00 22.21 N ATOM 1721 CA LYS A 188 37.498 -4.659 31.390 1.00 21.32 C ATOM 1722 C LYS A 188 36.775 -5.947 31.033 1.00 22.77 C ATOM 1723 O LYS A 188 35.700 -5.899 30.456 1.00 22.44 O ATOM 1724 CB LYS A 188 36.825 -3.946 32.571 1.00 21.46 C ATOM 1725 CG LYS A 188 37.659 -2.824 33.133 1.00 27.11 C ATOM 1726 CD LYS A 188 37.023 -2.168 34.322 1.00 34.15 C ATOM 1727 CE LYS A 188 37.840 -0.956 34.721 1.00 43.27 C ATOM 1728 NZ LYS A 188 37.729 -0.687 36.172 1.00 62.36 N ATOM 1729 HZ1 LYS A 188 36.733 -0.510 36.415 1.00 0.00 H ATOM 1730 HZ2 LYS A 188 38.076 -1.511 36.704 1.00 0.00 H ATOM 1731 HZ3 LYS A 188 38.299 0.148 36.413 1.00 0.00 H ATOM 1732 H LYS A 188 36.710 -3.622 29.645 1.00 0.00 H ATOM 1733 N ASP A 189 37.353 -7.092 31.366 1.00 18.79 N ATOM 1734 CA ASP A 189 36.732 -8.372 30.988 1.00 18.07 C ATOM 1735 C ASP A 189 37.492 -9.511 31.613 1.00 20.88 C ATOM 1736 O ASP A 189 38.601 -9.326 32.122 1.00 20.10 O ATOM 1737 CB ASP A 189 36.894 -8.548 29.437 1.00 19.02 C ATOM 1738 CG ASP A 189 36.033 -9.590 28.724 1.00 28.14 C ATOM 1739 OD1 ASP A 189 35.114 -10.163 29.374 1.00 26.98 O ATOM 1740 OD2 ASP A 189 36.243 -9.795 27.507 1.00 28.26 O ATOM 1741 H ASP A 189 38.248 -7.086 31.896 1.00 0.00 H ATOM 1742 N ALA A 190 36.959 -10.717 31.433 1.00 17.20 N ATOM 1743 CA ALA A 190 37.689 -11.938 31.754 1.00 17.74 C ATOM 1744 C ALA A 190 38.629 -12.192 30.587 1.00 19.42 C ATOM 1745 O ALA A 190 38.452 -11.614 29.504 1.00 18.86 O ATOM 1746 CB ALA A 190 36.715 -13.097 31.861 1.00 17.91 C ATOM 1747 H ALA A 190 35.994 -10.791 31.052 1.00 0.00 H ATOM 1748 N CYS A 191 39.616 -13.058 30.795 1.00 18.03 N ATOM 1749 CA CYS A 191 40.533 -13.471 29.737 1.00 18.17 C ATOM 1750 C CYS A 191 41.012 -14.913 30.001 1.00 21.34 C ATOM 1751 O CYS A 191 40.473 -15.590 30.889 1.00 18.53 O ATOM 1752 CB CYS A 191 41.686 -12.480 29.537 1.00 18.74 C ATOM 1753 SG CYS A 191 42.413 -12.512 27.864 1.00 22.60 S ATOM 1754 H CYS A 191 39.739 -13.456 31.748 1.00 0.00 H ATOM 1755 N LYS A 192 41.931 -15.428 29.196 1.00 16.71 N ATOM 1756 CA LYS A 192 42.415 -16.807 29.331 1.00 14.54 C ATOM 1757 C LYS A 192 42.826 -17.185 30.760 1.00 20.12 C ATOM 1758 O LYS A 192 43.656 -16.517 31.357 1.00 20.40 O ATOM 1759 CB LYS A 192 43.581 -17.024 28.385 1.00 14.25 C ATOM 1760 CG LYS A 192 43.158 -16.960 26.936 1.00 17.54 C ATOM 1761 CD LYS A 192 44.389 -17.128 26.006 1.00 22.05 C ATOM 1762 CE LYS A 192 43.963 -17.140 24.553 1.00 29.19 C ATOM 1763 NZ LYS A 192 44.809 -18.057 23.747 1.00 42.07 N ATOM 1764 HZ1 LYS A 192 45.800 -17.747 23.798 1.00 0.00 H ATOM 1765 HZ2 LYS A 192 44.727 -19.023 24.123 1.00 0.00 H ATOM 1766 HZ3 LYS A 192 44.490 -18.041 22.757 1.00 0.00 H ATOM 1767 H LYS A 192 42.324 -14.832 28.440 1.00 0.00 H ATOM 1768 N GLY A 193 42.234 -18.245 31.297 1.00 18.68 N ATOM 1769 CA GLY A 193 42.537 -18.714 32.653 1.00 19.13 C ATOM 1770 C GLY A 193 41.494 -18.315 33.672 1.00 22.26 C ATOM 1771 O GLY A 193 41.515 -18.798 34.808 1.00 21.65 O ATOM 1772 H GLY A 193 41.529 -18.762 30.735 1.00 0.00 H ATOM 1773 N ASP A 194 40.556 -17.454 33.264 1.00 17.61 N ATOM 1774 CA ASP A 194 39.483 -16.992 34.148 1.00 17.20 C ATOM 1775 C ASP A 194 38.232 -17.864 34.099 1.00 20.65 C ATOM 1776 O ASP A 194 37.409 -17.821 35.031 1.00 16.84 O ATOM 1777 CB ASP A 194 39.111 -15.544 33.847 1.00 16.82 C ATOM 1778 CG ASP A 194 40.186 -14.551 34.232 1.00 20.91 C ATOM 1779 OD1 ASP A 194 40.757 -14.688 35.340 1.00 18.43 O ATOM 1780 OD2 ASP A 194 40.413 -13.601 33.456 1.00 21.44 O ATOM 1781 H ASP A 194 40.589 -17.100 32.286 1.00 0.00 H ATOM 1782 N SER A 195 38.075 -18.639 33.002 1.00 17.14 N ATOM 1783 CA SER A 195 36.853 -19.411 32.782 1.00 15.77 C ATOM 1784 C SER A 195 36.550 -20.375 33.901 1.00 18.14 C ATOM 1785 O SER A 195 37.460 -20.889 34.586 1.00 17.26 O ATOM 1786 CB SER A 195 36.850 -20.096 31.418 1.00 16.62 C ATOM 1787 OG SER A 195 37.755 -21.187 31.404 1.00 22.32 O ATOM 1788 HG SER A 195 38.669 -20.859 31.596 1.00 0.00 H ATOM 1789 H SER A 195 38.840 -18.687 32.299 1.00 0.00 H ATOM 1790 N GLY A 196 35.257 -20.509 34.165 1.00 13.60 N ATOM 1791 CA GLY A 196 34.803 -21.367 35.255 1.00 13.52 C ATOM 1792 C GLY A 196 34.596 -20.598 36.540 1.00 18.85 C ATOM 1793 O GLY A 196 33.859 -21.029 37.427 1.00 19.91 O ATOM 1794 H GLY A 196 34.559 -19.997 33.589 1.00 0.00 H ATOM 1795 N GLY A 197 35.215 -19.425 36.616 1.00 15.87 N ATOM 1796 CA GLY A 197 35.149 -18.581 37.788 1.00 13.85 C ATOM 1797 C GLY A 197 33.832 -17.832 37.848 1.00 18.67 C ATOM 1798 O GLY A 197 33.023 -17.873 36.916 1.00 15.45 O ATOM 1799 H GLY A 197 35.770 -19.100 35.799 1.00 0.00 H ATOM 1800 N PRO A 198 33.623 -17.087 38.946 1.00 16.85 N ATOM 1801 CA PRO A 198 32.343 -16.400 39.123 1.00 15.67 C ATOM 1802 C PRO A 198 32.250 -15.030 38.478 1.00 19.30 C ATOM 1803 O PRO A 198 33.256 -14.343 38.271 1.00 18.29 O ATOM 1804 CB PRO A 198 32.273 -16.234 40.649 1.00 16.12 C ATOM 1805 CG PRO A 198 33.657 -16.108 41.086 1.00 19.21 C ATOM 1806 CD PRO A 198 34.486 -16.944 40.142 1.00 16.73 C ATOM 1807 N LEU A 199 31.008 -14.632 38.224 1.00 18.51 N ATOM 1808 CA LEU A 199 30.568 -13.273 37.942 1.00 18.54 C ATOM 1809 C LEU A 199 29.641 -13.060 39.166 1.00 22.38 C ATOM 1810 O LEU A 199 28.535 -13.627 39.232 1.00 19.54 O ATOM 1811 CB LEU A 199 29.803 -13.124 36.615 1.00 18.78 C ATOM 1812 CG LEU A 199 29.139 -11.728 36.406 1.00 22.09 C ATOM 1813 CD1 LEU A 199 30.211 -10.615 36.333 1.00 20.43 C ATOM 1814 CD2 LEU A 199 28.336 -11.691 35.111 1.00 20.21 C ATOM 1815 H LEU A 199 30.273 -15.368 38.227 1.00 0.00 H ATOM 1816 N SER A 200 30.152 -12.342 40.183 1.00 19.82 N ATOM 1817 CA SER A 200 29.441 -12.148 41.454 1.00 20.25 C ATOM 1818 C SER A 200 28.776 -10.776 41.509 1.00 24.11 C ATOM 1819 O SER A 200 29.440 -9.769 41.277 1.00 24.35 O ATOM 1820 CB SER A 200 30.398 -12.304 42.637 1.00 20.27 C ATOM 1821 OG SER A 200 31.193 -13.471 42.497 1.00 21.39 O ATOM 1822 HG SER A 200 31.724 -13.409 41.664 1.00 0.00 H ATOM 1823 H SER A 200 31.089 -11.906 40.064 1.00 0.00 H ATOM 1824 N CYS A 201 27.491 -10.744 41.833 1.00 20.43 N ATOM 1825 CA CYS A 201 26.722 -9.492 41.894 1.00 22.90 C ATOM 1826 C CYS A 201 26.148 -9.323 43.305 1.00 29.08 C ATOM 1827 O CYS A 201 25.551 -10.257 43.841 1.00 27.93 O ATOM 1828 CB CYS A 201 25.613 -9.449 40.837 1.00 22.88 C ATOM 1829 SG CYS A 201 26.180 -9.659 39.126 1.00 26.70 S ATOM 1830 H CYS A 201 27.008 -11.639 42.052 1.00 0.00 H ATOM 1831 N LYS A 202 26.346 -8.140 43.894 1.00 28.42 N ATOM 1832 CA LYS A 202 25.876 -7.804 45.241 1.00 29.96 C ATOM 1833 C LYS A 202 24.494 -7.171 45.127 1.00 39.48 C ATOM 1834 O LYS A 202 24.329 -6.179 44.428 1.00 39.59 O ATOM 1835 CB LYS A 202 26.861 -6.839 45.937 1.00 31.48 C ATOM 1836 CG LYS A 202 26.632 -6.647 47.439 1.00 35.91 C ATOM 1837 CD LYS A 202 27.588 -5.592 47.987 1.00 40.88 C ATOM 1838 CE LYS A 202 27.485 -5.404 49.479 1.00 61.67 C ATOM 1839 NZ LYS A 202 28.026 -6.564 50.238 1.00 75.04 N ATOM 1840 HZ1 LYS A 202 27.494 -7.421 49.985 1.00 0.00 H ATOM 1841 HZ2 LYS A 202 29.030 -6.695 50.000 1.00 0.00 H ATOM 1842 HZ3 LYS A 202 27.931 -6.384 51.258 1.00 0.00 H ATOM 1843 H LYS A 202 26.866 -7.412 43.363 1.00 0.00 H ATOM 1844 N HIS A 203 23.501 -7.766 45.784 1.00 40.94 N ATOM 1845 CA HIS A 203 22.132 -7.274 45.768 1.00 43.00 C ATOM 1846 C HIS A 203 21.512 -7.418 47.152 1.00 45.87 C ATOM 1847 O HIS A 203 21.460 -8.524 47.691 1.00 43.46 O ATOM 1848 CB HIS A 203 21.313 -7.983 44.687 1.00 45.53 C ATOM 1849 CG HIS A 203 19.844 -7.724 44.777 1.00 50.53 C ATOM 1850 ND1 HIS A 203 18.957 -8.730 45.123 1.00 53.04 N ATOM 1851 CD2 HIS A 203 19.158 -6.569 44.598 1.00 53.37 C ATOM 1852 CE1 HIS A 203 17.760 -8.167 45.115 1.00 53.10 C ATOM 1853 NE2 HIS A 203 17.831 -6.864 44.817 1.00 53.56 N ATOM 1854 H HIS A 203 23.714 -8.622 46.334 1.00 0.00 H ATOM 1855 N ASN A 204 21.057 -6.276 47.729 1.00 44.56 N ATOM 1856 CA ASN A 204 20.472 -6.170 49.080 1.00 44.24 C ATOM 1857 C ASN A 204 21.477 -6.710 50.097 1.00 46.69 C ATOM 1858 O ASN A 204 21.138 -7.557 50.917 1.00 46.90 O ATOM 1859 CB ASN A 204 19.110 -6.898 49.194 1.00 46.95 C ATOM 1860 CG ASN A 204 17.992 -6.382 48.310 1.00 70.60 C ATOM 1861 OD1 ASN A 204 17.993 -5.240 47.830 1.00 64.32 O ATOM 1862 ND2 ASN A 204 16.987 -7.221 48.104 1.00 62.50 N ATOM 1863 HD22 ASN A 204 17.012 -8.174 48.519 1.00 0.00 H ATOM 1864 HD21 ASN A 204 16.173 -6.926 47.527 1.00 0.00 H ATOM 1865 H ASN A 204 21.127 -5.401 47.171 1.00 0.00 H ATOM 1866 N GLU A 205 22.739 -6.264 49.969 1.00 42.69 N ATOM 1867 CA GLU A 205 23.899 -6.610 50.798 1.00 42.96 C ATOM 1868 C GLU A 205 24.323 -8.109 50.751 1.00 43.41 C ATOM 1869 O GLU A 205 25.185 -8.514 51.536 1.00 44.85 O ATOM 1870 CB GLU A 205 23.708 -6.127 52.254 1.00 45.05 C ATOM 1871 CG GLU A 205 23.676 -4.607 52.390 1.00 59.99 C ATOM 1872 CD GLU A 205 24.829 -3.860 51.743 1.00 90.93 C ATOM 1873 OE1 GLU A 205 25.979 -4.009 52.217 1.00 86.79 O ATOM 1874 OE2 GLU A 205 24.583 -3.142 50.745 1.00 91.40 O ATOM 1875 H GLU A 205 22.913 -5.596 49.191 1.00 0.00 H ATOM 1876 N VAL A 206 23.783 -8.898 49.799 1.00 35.22 N ATOM 1877 CA VAL A 206 24.089 -10.326 49.627 1.00 32.92 C ATOM 1878 C VAL A 206 24.716 -10.558 48.250 1.00 32.41 C ATOM 1879 O VAL A 206 24.196 -10.081 47.232 1.00 30.91 O ATOM 1880 CB VAL A 206 22.823 -11.232 49.855 1.00 35.96 C ATOM 1881 CG1 VAL A 206 23.122 -12.708 49.589 1.00 34.77 C ATOM 1882 CG2 VAL A 206 22.267 -11.062 51.274 1.00 35.54 C ATOM 1883 H VAL A 206 23.103 -8.466 49.141 1.00 0.00 H ATOM 1884 N TRP A 207 25.811 -11.318 48.215 1.00 27.03 N ATOM 1885 CA TRP A 207 26.457 -11.660 46.955 1.00 26.15 C ATOM 1886 C TRP A 207 25.763 -12.856 46.326 1.00 29.20 C ATOM 1887 O TRP A 207 25.445 -13.829 47.013 1.00 30.30 O ATOM 1888 CB TRP A 207 27.942 -11.938 47.159 1.00 24.76 C ATOM 1889 CG TRP A 207 28.728 -10.693 47.415 1.00 26.22 C ATOM 1890 CD1 TRP A 207 29.047 -10.158 48.631 1.00 29.07 C ATOM 1891 CD2 TRP A 207 29.255 -9.794 46.427 1.00 26.06 C ATOM 1892 NE1 TRP A 207 29.813 -9.026 48.461 1.00 28.84 N ATOM 1893 CE2 TRP A 207 29.926 -8.758 47.118 1.00 29.87 C ATOM 1894 CE3 TRP A 207 29.216 -9.757 45.017 1.00 27.27 C ATOM 1895 CZ2 TRP A 207 30.556 -7.698 46.454 1.00 28.93 C ATOM 1896 CZ3 TRP A 207 29.821 -8.691 44.354 1.00 28.51 C ATOM 1897 CH2 TRP A 207 30.475 -7.672 45.070 1.00 29.37 C ATOM 1898 HE1 TRP A 207 30.238 -8.464 49.226 1.00 0.00 H ATOM 1899 H TRP A 207 26.212 -11.674 49.106 1.00 0.00 H ATOM 1900 N HIS A 208 25.513 -12.786 45.027 1.00 24.53 N ATOM 1901 CA HIS A 208 24.873 -13.887 44.304 1.00 24.11 C ATOM 1902 C HIS A 208 25.738 -14.302 43.140 1.00 24.56 C ATOM 1903 O HIS A 208 26.333 -13.446 42.475 1.00 22.51 O ATOM 1904 CB HIS A 208 23.474 -13.483 43.780 1.00 25.77 C ATOM 1905 CG HIS A 208 22.481 -13.243 44.872 1.00 30.61 C ATOM 1906 ND1 HIS A 208 22.317 -11.987 45.434 1.00 33.18 N ATOM 1907 CD2 HIS A 208 21.670 -14.119 45.512 1.00 33.70 C ATOM 1908 CE1 HIS A 208 21.408 -12.134 46.383 1.00 32.91 C ATOM 1909 NE2 HIS A 208 20.982 -13.392 46.465 1.00 33.53 N ATOM 1910 H HIS A 208 25.778 -11.926 44.506 1.00 0.00 H ATOM 1911 N LEU A 209 25.760 -15.608 42.854 1.00 19.54 N ATOM 1912 CA LEU A 209 26.498 -16.145 41.708 1.00 18.49 C ATOM 1913 C LEU A 209 25.625 -15.992 40.461 1.00 22.32 C ATOM 1914 O LEU A 209 24.807 -16.854 40.138 1.00 19.86 O ATOM 1915 CB LEU A 209 26.853 -17.614 41.978 1.00 18.09 C ATOM 1916 CG LEU A 209 27.809 -18.287 40.979 1.00 21.62 C ATOM 1917 CD1 LEU A 209 29.056 -17.474 40.780 1.00 19.74 C ATOM 1918 CD2 LEU A 209 28.123 -19.708 41.425 1.00 20.08 C ATOM 1919 H LEU A 209 25.235 -16.265 43.466 1.00 0.00 H ATOM 1920 N VAL A 210 25.777 -14.870 39.787 1.00 19.95 N ATOM 1921 CA VAL A 210 24.956 -14.546 38.619 1.00 19.80 C ATOM 1922 C VAL A 210 25.452 -15.256 37.359 1.00 23.86 C ATOM 1923 O VAL A 210 24.623 -15.767 36.585 1.00 23.92 O ATOM 1924 CB VAL A 210 24.819 -13.001 38.454 1.00 22.31 C ATOM 1925 CG1 VAL A 210 24.214 -12.622 37.090 1.00 21.65 C ATOM 1926 CG2 VAL A 210 23.949 -12.446 39.586 1.00 21.14 C ATOM 1927 H VAL A 210 26.504 -14.193 40.095 1.00 0.00 H ATOM 1928 N GLY A 211 26.778 -15.344 37.201 1.00 18.04 N ATOM 1929 CA GLY A 211 27.345 -15.981 36.027 1.00 17.13 C ATOM 1930 C GLY A 211 28.566 -16.839 36.261 1.00 20.22 C ATOM 1931 O GLY A 211 29.209 -16.752 37.313 1.00 19.44 O ATOM 1932 H GLY A 211 27.409 -14.951 37.928 1.00 0.00 H ATOM 1933 N ILE A 212 28.883 -17.682 35.253 1.00 16.28 N ATOM 1934 CA ILE A 212 30.100 -18.502 35.226 1.00 15.60 C ATOM 1935 C ILE A 212 30.842 -18.031 33.978 1.00 20.02 C ATOM 1936 O ILE A 212 30.279 -18.139 32.895 1.00 19.35 O ATOM 1937 CB ILE A 212 29.840 -20.038 35.151 1.00 17.52 C ATOM 1938 CG1 ILE A 212 28.978 -20.562 36.308 1.00 17.87 C ATOM 1939 CG2 ILE A 212 31.148 -20.801 35.054 1.00 17.10 C ATOM 1940 CD1 ILE A 212 28.370 -21.947 35.994 1.00 17.90 C ATOM 1941 H ILE A 212 28.226 -17.754 34.450 1.00 0.00 H ATOM 1942 N THR A 213 32.094 -17.533 34.120 1.00 17.24 N ATOM 1943 CA THR A 213 32.937 -17.074 32.999 1.00 16.91 C ATOM 1944 C THR A 213 33.030 -18.165 31.921 1.00 20.99 C ATOM 1945 O THR A 213 33.477 -19.277 32.204 1.00 19.32 O ATOM 1946 CB THR A 213 34.299 -16.621 33.517 1.00 22.00 C ATOM 1947 OG1 THR A 213 34.084 -15.613 34.514 1.00 18.46 O ATOM 1948 CG2 THR A 213 35.242 -16.092 32.373 1.00 14.81 C ATOM 1949 HG1 THR A 213 34.957 -15.305 34.864 1.00 0.00 H ATOM 1950 H THR A 213 32.486 -17.470 35.081 1.00 0.00 H ATOM 1951 N SER A 214 32.579 -17.850 30.704 1.00 17.86 N ATOM 1952 CA SER A 214 32.519 -18.863 29.648 1.00 18.11 C ATOM 1953 C SER A 214 33.369 -18.523 28.436 1.00 20.74 C ATOM 1954 O SER A 214 34.404 -19.166 28.210 1.00 17.97 O ATOM 1955 CB SER A 214 31.059 -19.144 29.265 1.00 19.44 C ATOM 1956 OG SER A 214 30.923 -20.213 28.341 1.00 19.96 O ATOM 1957 HG SER A 214 29.965 -20.347 28.132 1.00 0.00 H ATOM 1958 H SER A 214 32.268 -16.878 30.505 1.00 0.00 H ATOM 1959 N TRP A 215 32.954 -17.520 27.657 1.00 17.97 N ATOM 1960 CA TRP A 215 33.707 -17.196 26.431 1.00 18.47 C ATOM 1961 C TRP A 215 33.515 -15.728 25.975 1.00 19.81 C ATOM 1962 O TRP A 215 32.666 -15.012 26.494 1.00 16.48 O ATOM 1963 CB TRP A 215 33.306 -18.186 25.301 1.00 16.36 C ATOM 1964 CG TRP A 215 31.883 -18.019 24.839 1.00 17.37 C ATOM 1965 CD1 TRP A 215 30.768 -18.557 25.409 1.00 19.81 C ATOM 1966 CD2 TRP A 215 31.429 -17.256 23.698 1.00 17.66 C ATOM 1967 NE1 TRP A 215 29.646 -18.173 24.709 1.00 19.78 N ATOM 1968 CE2 TRP A 215 30.024 -17.392 23.639 1.00 21.56 C ATOM 1969 CE3 TRP A 215 32.083 -16.497 22.701 1.00 19.04 C ATOM 1970 CZ2 TRP A 215 29.248 -16.768 22.640 1.00 20.53 C ATOM 1971 CZ3 TRP A 215 31.313 -15.843 21.736 1.00 19.51 C ATOM 1972 CH2 TRP A 215 29.917 -16.020 21.688 1.00 19.99 C ATOM 1973 HE1 TRP A 215 28.668 -18.432 24.950 1.00 0.00 H ATOM 1974 H TRP A 215 32.108 -16.973 27.913 1.00 0.00 H ATOM 1975 N GLY A 216 34.313 -15.317 25.007 1.00 17.26 N ATOM 1976 CA GLY A 216 34.222 -14.009 24.354 1.00 16.72 C ATOM 1977 C GLY A 216 35.047 -14.018 23.077 1.00 21.76 C ATOM 1978 O GLY A 216 35.912 -14.894 22.907 1.00 20.31 O ATOM 1979 H GLY A 216 35.058 -15.967 24.686 1.00 0.00 H ATOM 1980 N GLU A 217 34.824 -13.035 22.179 1.00 17.26 N ATOM 1981 CA GLU A 217 35.674 -12.929 20.992 1.00 16.92 C ATOM 1982 C GLU A 217 36.809 -11.988 21.419 1.00 21.66 C ATOM 1983 O GLU A 217 36.596 -10.772 21.563 1.00 20.27 O ATOM 1984 CB GLU A 217 34.901 -12.381 19.759 1.00 17.45 C ATOM 1985 CG GLU A 217 35.807 -12.237 18.535 1.00 19.45 C ATOM 1986 CD GLU A 217 36.591 -13.485 18.181 1.00 28.22 C ATOM 1987 OE1 GLU A 217 35.959 -14.556 18.079 1.00 26.10 O ATOM 1988 OE2 GLU A 217 37.835 -13.416 18.068 1.00 26.96 O ATOM 1989 H GLU A 217 34.051 -12.356 22.330 1.00 0.00 H ATOM 1990 N GLY A 218 37.972 -12.570 21.691 1.00 18.39 N ATOM 1991 CA GLY A 218 39.122 -11.854 22.244 1.00 18.67 C ATOM 1992 C GLY A 218 38.828 -11.472 23.695 1.00 22.72 C ATOM 1993 O GLY A 218 37.875 -11.997 24.294 1.00 21.16 O ATOM 1994 H GLY A 218 38.070 -13.588 21.501 1.00 0.00 H ATOM 1995 N CYS A 219 39.606 -10.544 24.266 1.00 20.12 N ATOM 1996 CA CYS A 219 39.432 -10.096 25.660 1.00 20.05 C ATOM 1997 C CYS A 219 39.264 -8.599 25.734 1.00 25.28 C ATOM 1998 O CYS A 219 40.090 -7.889 25.162 1.00 25.35 O ATOM 1999 CB CYS A 219 40.601 -10.541 26.535 1.00 19.05 C ATOM 2000 SG CYS A 219 40.963 -12.306 26.456 1.00 22.19 S ATOM 2001 H CYS A 219 40.368 -10.119 23.700 1.00 0.00 H ATOM 2002 N ALA A 220 38.239 -8.125 26.440 1.00 22.37 N ATOM 2003 CA ALA A 220 37.956 -6.713 26.684 1.00 22.72 C ATOM 2004 C ALA A 220 37.898 -5.880 25.423 1.00 26.83 C ATOM 2005 O ALA A 220 38.291 -4.706 25.448 1.00 25.35 O ATOM 2006 CB ALA A 220 38.991 -6.134 27.648 1.00 22.98 C ATOM 2007 H ALA A 220 37.584 -8.820 26.853 1.00 0.00 H ATOM 2008 N GLN A 221 37.463 -6.480 24.304 1.00 22.16 N ATOM 2009 CA GLN A 221 37.397 -5.685 23.083 1.00 22.20 C ATOM 2010 C GLN A 221 36.127 -4.833 23.115 1.00 24.23 C ATOM 2011 O GLN A 221 35.104 -5.211 23.715 1.00 21.42 O ATOM 2012 CB GLN A 221 37.416 -6.564 21.818 1.00 23.05 C ATOM 2013 CG GLN A 221 38.696 -7.397 21.657 1.00 25.52 C ATOM 2014 CD GLN A 221 38.847 -7.856 20.233 1.00 31.94 C ATOM 2015 OE1 GLN A 221 39.519 -7.217 19.433 1.00 27.04 O ATOM 2016 NE2 GLN A 221 38.171 -8.935 19.863 1.00 22.07 N ATOM 2017 HE22 GLN A 221 37.608 -9.461 20.562 1.00 0.00 H ATOM 2018 HE21 GLN A 221 38.204 -9.256 18.874 1.00 0.00 H ATOM 2019 H GLN A 221 37.182 -7.481 24.307 1.00 0.00 H ATOM 2020 N ARG A 222 36.206 -3.689 22.460 1.00 20.01 N ATOM 2021 CA ARG A 222 35.080 -2.789 22.265 1.00 20.67 C ATOM 2022 C ARG A 222 33.938 -3.595 21.604 1.00 23.56 C ATOM 2023 O ARG A 222 34.177 -4.342 20.648 1.00 22.85 O ATOM 2024 CB ARG A 222 35.557 -1.689 21.293 1.00 23.95 C ATOM 2025 CG ARG A 222 34.469 -0.800 20.759 1.00 29.63 C ATOM 2026 CD ARG A 222 35.021 0.095 19.680 1.00 30.13 C ATOM 2027 NE ARG A 222 33.975 0.999 19.227 1.00 26.15 N ATOM 2028 CZ ARG A 222 34.187 2.171 18.628 1.00 43.36 C ATOM 2029 NH1 ARG A 222 33.164 2.946 18.298 1.00 27.36 N ATOM 2030 NH2 ARG A 222 35.426 2.582 18.372 1.00 24.80 N ATOM 2031 HE ARG A 222 32.988 0.709 19.382 1.00 0.00 H ATOM 2032 HH12 ARG A 222 33.333 3.860 17.831 1.00 0.00 H ATOM 2033 HH11 ARG A 222 32.192 2.641 18.506 1.00 0.00 H ATOM 2034 HH22 ARG A 222 35.584 3.497 17.904 1.00 0.00 H ATOM 2035 HH21 ARG A 222 36.237 1.988 18.639 1.00 0.00 H ATOM 2036 H ARG A 222 37.127 -3.416 22.060 1.00 0.00 H ATOM 2037 N GLU A 223 32.714 -3.445 22.127 1.00 20.29 N ATOM 2038 CA GLU A 223 31.503 -4.065 21.605 1.00 20.73 C ATOM 2039 C GLU A 223 31.566 -5.598 21.520 1.00 24.56 C ATOM 2040 O GLU A 223 30.908 -6.194 20.669 1.00 23.43 O ATOM 2041 CB GLU A 223 31.114 -3.437 20.245 1.00 21.74 C ATOM 2042 CG GLU A 223 30.590 -2.029 20.419 1.00 31.57 C ATOM 2043 CD GLU A 223 30.688 -1.202 19.158 1.00 51.29 C ATOM 2044 OE1 GLU A 223 29.964 -1.515 18.191 1.00 33.61 O ATOM 2045 OE2 GLU A 223 31.512 -0.262 19.124 1.00 56.03 O ATOM 2046 H GLU A 223 32.621 -2.841 22.968 1.00 0.00 H ATOM 2047 N ARG A 224 32.338 -6.232 22.418 1.00 22.01 N ATOM 2048 CA ARG A 224 32.441 -7.695 22.525 1.00 20.90 C ATOM 2049 C ARG A 224 32.311 -8.035 24.007 1.00 23.81 C ATOM 2050 O ARG A 224 33.332 -8.185 24.697 1.00 22.27 O ATOM 2051 CB ARG A 224 33.756 -8.240 21.936 1.00 19.76 C ATOM 2052 CG ARG A 224 33.885 -8.140 20.412 1.00 24.70 C ATOM 2053 CD ARG A 224 32.837 -8.923 19.622 1.00 23.92 C ATOM 2054 NE ARG A 224 33.273 -9.102 18.229 1.00 23.03 N ATOM 2055 CZ ARG A 224 32.740 -9.978 17.388 1.00 30.46 C ATOM 2056 NH1 ARG A 224 31.727 -10.740 17.769 1.00 21.74 N ATOM 2057 NH2 ARG A 224 33.220 -10.104 16.159 1.00 23.26 N ATOM 2058 HE ARG A 224 34.049 -8.503 17.881 1.00 0.00 H ATOM 2059 HH12 ARG A 224 31.313 -11.425 17.105 1.00 0.00 H ATOM 2060 HH11 ARG A 224 31.345 -10.654 18.732 1.00 0.00 H ATOM 2061 HH22 ARG A 224 32.798 -10.793 15.504 1.00 0.00 H ATOM 2062 HH21 ARG A 224 34.019 -9.514 15.850 1.00 0.00 H ATOM 2063 H ARG A 224 32.897 -5.653 23.077 1.00 0.00 H ATOM 2064 N PRO A 225 31.067 -8.042 24.546 1.00 20.77 N ATOM 2065 CA PRO A 225 30.904 -8.384 25.980 1.00 20.80 C ATOM 2066 C PRO A 225 31.354 -9.812 26.268 1.00 22.52 C ATOM 2067 O PRO A 225 31.297 -10.654 25.379 1.00 19.54 O ATOM 2068 CB PRO A 225 29.393 -8.244 26.227 1.00 22.02 C ATOM 2069 CG PRO A 225 28.802 -7.715 24.976 1.00 25.92 C ATOM 2070 CD PRO A 225 29.760 -7.916 23.870 1.00 21.08 C ATOM 2071 N GLY A 226 31.792 -10.062 27.508 1.00 19.58 N ATOM 2072 CA GLY A 226 32.154 -11.392 27.956 1.00 18.36 C ATOM 2073 C GLY A 226 30.837 -12.151 28.042 1.00 20.45 C ATOM 2074 O GLY A 226 29.809 -11.536 28.300 1.00 17.99 O ATOM 2075 H GLY A 226 31.876 -9.270 28.177 1.00 0.00 H ATOM 2076 N VAL A 227 30.829 -13.449 27.717 1.00 16.66 N ATOM 2077 CA VAL A 227 29.614 -14.297 27.744 1.00 14.99 C ATOM 2078 C VAL A 227 29.768 -15.271 28.888 1.00 19.29 C ATOM 2079 O VAL A 227 30.803 -15.941 29.005 1.00 17.96 O ATOM 2080 CB VAL A 227 29.327 -14.996 26.394 1.00 17.52 C ATOM 2081 CG1 VAL A 227 27.973 -15.740 26.427 1.00 16.37 C ATOM 2082 CG2 VAL A 227 29.378 -13.986 25.225 1.00 16.68 C ATOM 2083 H VAL A 227 31.727 -13.888 27.429 1.00 0.00 H ATOM 2084 N TYR A 228 28.746 -15.310 29.752 1.00 16.50 N ATOM 2085 CA TYR A 228 28.709 -16.086 30.975 1.00 16.27 C ATOM 2086 C TYR A 228 27.525 -17.013 30.978 1.00 20.89 C ATOM 2087 O TYR A 228 26.488 -16.670 30.420 1.00 20.24 O ATOM 2088 CB TYR A 228 28.583 -15.123 32.193 1.00 16.33 C ATOM 2089 CG TYR A 228 29.745 -14.151 32.326 1.00 17.58 C ATOM 2090 CD1 TYR A 228 29.828 -13.012 31.523 1.00 17.05 C ATOM 2091 CD2 TYR A 228 30.758 -14.367 33.260 1.00 17.46 C ATOM 2092 CE1 TYR A 228 30.915 -12.141 31.614 1.00 18.18 C ATOM 2093 CE2 TYR A 228 31.845 -13.499 33.365 1.00 17.12 C ATOM 2094 CZ TYR A 228 31.920 -12.388 32.539 1.00 20.61 C ATOM 2095 OH TYR A 228 32.983 -11.523 32.672 1.00 17.89 O ATOM 2096 HH TYR A 228 32.892 -10.787 32.016 1.00 0.00 H ATOM 2097 H TYR A 228 27.909 -14.735 29.527 1.00 0.00 H ATOM 2098 N THR A 229 27.650 -18.168 31.655 1.00 17.70 N ATOM 2099 CA THR A 229 26.508 -19.061 31.848 1.00 17.97 C ATOM 2100 C THR A 229 25.583 -18.317 32.835 1.00 20.68 C ATOM 2101 O THR A 229 26.055 -17.880 33.886 1.00 18.52 O ATOM 2102 CB THR A 229 26.965 -20.406 32.427 1.00 22.52 C ATOM 2103 OG1 THR A 229 27.942 -20.962 31.551 1.00 17.59 O ATOM 2104 CG2 THR A 229 25.791 -21.400 32.614 1.00 19.68 C ATOM 2105 HG1 THR A 229 28.249 -21.832 31.910 1.00 0.00 H ATOM 2106 H THR A 229 28.576 -18.431 32.049 1.00 0.00 H ATOM 2107 N ASN A 230 24.298 -18.131 32.468 1.00 17.12 N ATOM 2108 CA ASN A 230 23.322 -17.420 33.294 1.00 17.05 C ATOM 2109 C ASN A 230 22.831 -18.381 34.368 1.00 19.95 C ATOM 2110 O ASN A 230 21.910 -19.163 34.137 1.00 21.13 O ATOM 2111 CB ASN A 230 22.178 -16.883 32.396 1.00 18.86 C ATOM 2112 CG ASN A 230 21.170 -16.006 33.073 1.00 27.39 C ATOM 2113 OD1 ASN A 230 21.350 -15.553 34.202 1.00 28.06 O ATOM 2114 ND2 ASN A 230 20.100 -15.695 32.359 1.00 19.73 N ATOM 2115 HD22 ASN A 230 19.976 -16.094 31.407 1.00 0.00 H ATOM 2116 HD21 ASN A 230 19.383 -15.051 32.750 1.00 0.00 H ATOM 2117 H ASN A 230 23.986 -18.512 31.552 1.00 0.00 H ATOM 2118 N VAL A 231 23.491 -18.352 35.534 1.00 18.32 N ATOM 2119 CA VAL A 231 23.300 -19.304 36.645 1.00 17.95 C ATOM 2120 C VAL A 231 21.816 -19.466 37.073 1.00 22.97 C ATOM 2121 O VAL A 231 21.388 -20.604 37.286 1.00 21.72 O ATOM 2122 CB VAL A 231 24.240 -19.028 37.849 1.00 20.62 C ATOM 2123 CG1 VAL A 231 23.927 -19.943 39.039 1.00 20.20 C ATOM 2124 CG2 VAL A 231 25.715 -19.199 37.443 1.00 19.34 C ATOM 2125 H VAL A 231 24.195 -17.598 35.666 1.00 0.00 H ATOM 2126 N VAL A 232 21.034 -18.378 37.123 1.00 21.22 N ATOM 2127 CA VAL A 232 19.609 -18.441 37.526 1.00 21.69 C ATOM 2128 C VAL A 232 18.832 -19.478 36.681 1.00 25.74 C ATOM 2129 O VAL A 232 17.970 -20.165 37.217 1.00 26.77 O ATOM 2130 CB VAL A 232 18.923 -17.030 37.558 1.00 25.34 C ATOM 2131 CG1 VAL A 232 18.646 -16.485 36.142 1.00 24.92 C ATOM 2132 CG2 VAL A 232 17.636 -17.052 38.385 1.00 25.11 C ATOM 2133 H VAL A 232 21.442 -17.456 36.870 1.00 0.00 H ATOM 2134 N GLU A 233 19.208 -19.657 35.393 1.00 21.97 N ATOM 2135 CA GLU A 233 18.535 -20.605 34.485 1.00 20.78 C ATOM 2136 C GLU A 233 18.902 -22.050 34.759 1.00 25.85 C ATOM 2137 O GLU A 233 18.341 -22.949 34.142 1.00 26.80 O ATOM 2138 CB GLU A 233 18.796 -20.230 33.010 1.00 21.49 C ATOM 2139 CG GLU A 233 18.261 -18.855 32.605 1.00 27.00 C ATOM 2140 CD GLU A 233 16.767 -18.635 32.808 1.00 46.47 C ATOM 2141 OE1 GLU A 233 15.979 -19.566 32.529 1.00 36.94 O ATOM 2142 OE2 GLU A 233 16.384 -17.538 33.272 1.00 38.07 O ATOM 2143 H GLU A 233 20.007 -19.101 35.027 1.00 0.00 H ATOM 2144 N TYR A 234 19.858 -22.282 35.676 1.00 20.58 N ATOM 2145 CA TYR A 234 20.331 -23.608 36.017 1.00 18.73 C ATOM 2146 C TYR A 234 20.165 -23.989 37.483 1.00 21.75 C ATOM 2147 O TYR A 234 20.683 -25.028 37.900 1.00 21.65 O ATOM 2148 CB TYR A 234 21.800 -23.718 35.626 1.00 19.37 C ATOM 2149 CG TYR A 234 21.997 -23.631 34.139 1.00 19.84 C ATOM 2150 CD1 TYR A 234 21.878 -24.760 33.338 1.00 20.75 C ATOM 2151 CD2 TYR A 234 22.317 -22.416 33.526 1.00 19.57 C ATOM 2152 CE1 TYR A 234 22.095 -24.695 31.964 1.00 22.80 C ATOM 2153 CE2 TYR A 234 22.509 -22.335 32.147 1.00 19.55 C ATOM 2154 CZ TYR A 234 22.436 -23.486 31.379 1.00 22.35 C ATOM 2155 OH TYR A 234 22.617 -23.430 30.026 1.00 22.79 O ATOM 2156 HH TYR A 234 23.519 -23.073 29.829 1.00 0.00 H ATOM 2157 H TYR A 234 20.280 -21.467 36.166 1.00 0.00 H ATOM 2158 N VAL A 235 19.439 -23.192 38.254 1.00 19.65 N ATOM 2159 CA VAL A 235 19.233 -23.481 39.677 1.00 20.51 C ATOM 2160 C VAL A 235 18.599 -24.861 39.888 1.00 23.99 C ATOM 2161 O VAL A 235 19.074 -25.605 40.741 1.00 24.24 O ATOM 2162 CB VAL A 235 18.462 -22.345 40.385 1.00 26.03 C ATOM 2163 CG1 VAL A 235 17.974 -22.780 41.772 1.00 26.74 C ATOM 2164 CG2 VAL A 235 19.330 -21.075 40.475 1.00 26.05 C ATOM 2165 H VAL A 235 19.005 -22.342 37.840 1.00 0.00 H ATOM 2166 N ASP A 236 17.551 -25.214 39.113 1.00 21.43 N ATOM 2167 CA ASP A 236 16.915 -26.525 39.251 1.00 21.01 C ATOM 2168 C ASP A 236 17.864 -27.644 38.866 1.00 22.20 C ATOM 2169 O ASP A 236 17.893 -28.666 39.535 1.00 22.37 O ATOM 2170 CB ASP A 236 15.569 -26.587 38.492 1.00 22.82 C ATOM 2171 CG ASP A 236 14.490 -25.672 39.103 1.00 36.33 C ATOM 2172 OD1 ASP A 236 14.616 -25.300 40.305 1.00 34.78 O ATOM 2173 OD2 ASP A 236 13.527 -25.343 38.394 1.00 48.26 O ATOM 2174 H ASP A 236 17.190 -24.543 38.406 1.00 0.00 H ATOM 2175 N TRP A 237 18.686 -27.435 37.830 1.00 19.55 N ATOM 2176 CA TRP A 237 19.685 -28.431 37.426 1.00 18.75 C ATOM 2177 C TRP A 237 20.706 -28.646 38.555 1.00 23.34 C ATOM 2178 O TRP A 237 21.055 -29.796 38.847 1.00 23.39 O ATOM 2179 CB TRP A 237 20.391 -27.995 36.129 1.00 17.27 C ATOM 2180 CG TRP A 237 21.477 -28.938 35.703 1.00 17.75 C ATOM 2181 CD1 TRP A 237 21.323 -30.088 34.984 1.00 20.46 C ATOM 2182 CD2 TRP A 237 22.864 -28.866 36.054 1.00 17.35 C ATOM 2183 NE1 TRP A 237 22.536 -30.722 34.835 1.00 19.64 N ATOM 2184 CE2 TRP A 237 23.502 -29.993 35.480 1.00 20.57 C ATOM 2185 CE3 TRP A 237 23.646 -27.935 36.770 1.00 18.42 C ATOM 2186 CZ2 TRP A 237 24.876 -30.227 35.611 1.00 19.31 C ATOM 2187 CZ3 TRP A 237 25.024 -28.150 36.862 1.00 19.20 C ATOM 2188 CH2 TRP A 237 25.622 -29.283 36.295 1.00 19.44 C ATOM 2189 HE1 TRP A 237 22.694 -31.610 34.317 1.00 0.00 H ATOM 2190 H TRP A 237 18.615 -26.544 37.298 1.00 0.00 H ATOM 2191 N ILE A 238 21.186 -27.548 39.192 1.00 21.15 N ATOM 2192 CA ILE A 238 22.190 -27.642 40.285 1.00 20.65 C ATOM 2193 C ILE A 238 21.559 -28.415 41.470 1.00 25.55 C ATOM 2194 O ILE A 238 22.172 -29.346 41.993 1.00 24.68 O ATOM 2195 CB ILE A 238 22.663 -26.223 40.725 1.00 22.87 C ATOM 2196 CG1 ILE A 238 23.473 -25.509 39.604 1.00 22.56 C ATOM 2197 CG2 ILE A 238 23.478 -26.313 42.013 1.00 23.08 C ATOM 2198 CD1 ILE A 238 23.616 -23.995 39.809 1.00 24.05 C ATOM 2199 H ILE A 238 20.840 -26.610 38.906 1.00 0.00 H ATOM 2200 N LEU A 239 20.329 -28.034 41.856 1.00 23.38 N ATOM 2201 CA LEU A 239 19.580 -28.697 42.929 1.00 24.69 C ATOM 2202 C LEU A 239 19.331 -30.172 42.615 1.00 26.89 C ATOM 2203 O LEU A 239 19.474 -30.994 43.502 1.00 27.81 O ATOM 2204 CB LEU A 239 18.262 -27.954 43.211 1.00 25.51 C ATOM 2205 CG LEU A 239 18.387 -26.611 43.941 1.00 30.56 C ATOM 2206 CD1 LEU A 239 17.061 -25.871 43.934 1.00 31.00 C ATOM 2207 CD2 LEU A 239 18.818 -26.804 45.376 1.00 34.27 C ATOM 2208 H LEU A 239 19.886 -27.229 41.369 1.00 0.00 H ATOM 2209 N GLU A 240 19.049 -30.527 41.343 1.00 22.68 N ATOM 2210 CA GLU A 240 18.872 -31.936 40.922 1.00 21.99 C ATOM 2211 C GLU A 240 20.126 -32.760 41.230 1.00 25.82 C ATOM 2212 O GLU A 240 20.057 -33.874 41.766 1.00 23.29 O ATOM 2213 CB GLU A 240 18.564 -31.992 39.419 1.00 23.29 C ATOM 2214 CG GLU A 240 18.489 -33.385 38.806 1.00 26.79 C ATOM 2215 CD GLU A 240 18.581 -33.400 37.292 1.00 35.22 C ATOM 2216 OE1 GLU A 240 18.436 -32.333 36.650 1.00 23.65 O ATOM 2217 OE2 GLU A 240 18.822 -34.495 36.745 1.00 30.30 O ATOM 2218 H GLU A 240 18.952 -29.778 40.628 1.00 0.00 H ATOM 2219 N LYS A 241 21.278 -32.199 40.888 1.00 24.35 N ATOM 2220 CA LYS A 241 22.559 -32.882 41.051 1.00 24.11 C ATOM 2221 C LYS A 241 23.068 -32.891 42.494 1.00 30.23 C ATOM 2222 O LYS A 241 23.551 -33.923 42.925 1.00 32.28 O ATOM 2223 CB LYS A 241 23.605 -32.309 40.078 1.00 25.50 C ATOM 2224 CG LYS A 241 23.206 -32.311 38.585 1.00 23.74 C ATOM 2225 CD LYS A 241 22.857 -33.700 38.090 1.00 28.19 C ATOM 2226 CE LYS A 241 22.436 -33.743 36.651 1.00 35.76 C ATOM 2227 NZ LYS A 241 22.520 -35.138 36.123 1.00 38.68 N ATOM 2228 HZ1 LYS A 241 23.500 -35.478 36.199 1.00 0.00 H ATOM 2229 HZ2 LYS A 241 21.893 -35.756 36.678 1.00 0.00 H ATOM 2230 HZ3 LYS A 241 22.225 -35.148 35.126 1.00 0.00 H ATOM 2231 H LYS A 241 21.269 -31.238 40.489 1.00 0.00 H ATOM 2232 N THR A 242 22.958 -31.763 43.231 1.00 27.78 N ATOM 2233 CA THR A 242 23.451 -31.612 44.616 1.00 27.79 C ATOM 2234 C THR A 242 22.483 -32.159 45.693 1.00 33.14 C ATOM 2235 O THR A 242 22.931 -32.512 46.784 1.00 30.95 O ATOM 2236 CB THR A 242 23.849 -30.146 44.933 1.00 27.80 C ATOM 2237 OG1 THR A 242 22.684 -29.333 45.060 1.00 29.34 O ATOM 2238 CG2 THR A 242 24.801 -29.541 43.902 1.00 19.70 C ATOM 2239 HG1 THR A 242 22.174 -29.354 44.211 1.00 0.00 H ATOM 2240 H THR A 242 22.493 -30.943 42.792 1.00 0.00 H ATOM 2241 N GLN A 243 21.159 -32.186 45.405 1.00 31.50 N ATOM 2242 CA GLN A 243 20.153 -32.642 46.368 1.00 31.23 C ATOM 2243 C GLN A 243 19.570 -33.997 45.985 1.00 34.95 C ATOM 2244 O GLN A 243 18.453 -34.308 46.393 1.00 33.25 O ATOM 2245 CB GLN A 243 19.019 -31.601 46.554 1.00 32.06 C ATOM 2246 CG GLN A 243 19.454 -30.148 46.708 1.00 44.20 C ATOM 2247 CD GLN A 243 20.150 -29.893 48.000 1.00 63.52 C ATOM 2248 OE1 GLN A 243 19.519 -29.757 49.044 1.00 62.59 O ATOM 2249 NE2 GLN A 243 21.467 -29.821 47.953 1.00 58.86 N ATOM 2250 HE22 GLN A 243 21.962 -29.942 47.047 1.00 0.00 H ATOM 2251 HE21 GLN A 243 22.009 -29.643 48.822 1.00 0.00 H ATOM 2252 H GLN A 243 20.845 -31.871 44.465 1.00 0.00 H ATOM 2253 N ALA A 244 20.306 -34.796 45.203 1.00 33.24 N ATOM 2254 CA ALA A 244 19.826 -36.113 44.773 1.00 35.26 C ATOM 2255 C ALA A 244 19.558 -37.015 45.994 1.00 43.94 C ATOM 2256 O ALA A 244 20.376 -37.049 46.924 1.00 43.70 O ATOM 2257 CB ALA A 244 20.841 -36.769 43.846 1.00 35.86 C ATOM 2258 H ALA A 244 21.245 -34.474 44.892 1.00 0.00 H ATOM 2259 N VAL A 245 18.425 -37.743 45.989 1.00 42.44 N ATOM 2260 CA VAL A 245 18.074 -38.622 47.120 1.00 47.16 C ATOM 2261 C VAL A 245 18.942 -39.909 47.138 1.00 58.72 C ATOM 2262 O VAL A 245 19.243 -40.462 46.057 1.00 60.61 O ATOM 2263 CB VAL A 245 16.548 -38.922 47.248 1.00 50.68 C ATOM 2264 CG1 VAL A 245 15.740 -37.637 47.383 1.00 49.83 C ATOM 2265 CG2 VAL A 245 16.039 -39.762 46.088 1.00 50.58 C ATOM 2266 H VAL A 245 17.785 -37.684 45.171 1.00 0.00 H TER 2267 VAL A 245 HETATM 2268 O HOH 1 33.174 -9.462 30.884 1.00 27.09 O HETATM 2269 O HOH 2 34.550 -4.561 28.547 1.00 23.51 O HETATM 2270 O HOH 3 29.815 -13.273 16.456 1.00 20.30 O HETATM 2271 O HOH 4 17.611 -28.207 29.853 1.00 19.60 O HETATM 2272 O HOH 5 33.535 -15.402 17.528 1.00 34.52 O HETATM 2273 O HOH 6 35.766 -13.297 53.802 1.00 31.25 O HETATM 2274 O HOH 7 21.795 -36.448 33.754 1.00 37.89 O HETATM 2275 O HOH 8 51.769 -29.377 43.960 1.00 40.23 O HETATM 2276 O HOH 9 18.274 -25.308 32.948 1.00 34.35 O HETATM 2277 O HOH 10 39.507 -16.711 49.614 1.00 43.53 O HETATM 2278 O HOH 11 49.472 -28.999 46.973 1.00 19.02 O HETATM 2279 O HOH 12 41.412 -15.749 51.229 1.00 44.77 O HETATM 2280 O HOH 13 33.680 -8.984 47.928 1.00 39.44 O HETATM 2281 O HOH 14 41.015 -35.307 42.565 1.00 23.12 O HETATM 2282 O HOH 15 41.006 -29.733 30.422 1.00 21.94 O HETATM 2283 O HOH 16 48.805 -28.510 54.167 1.00 27.93 O HETATM 2284 O HOH 17 35.994 -4.756 18.736 1.00 18.83 O HETATM 2285 O HOH 18 34.885 -10.690 25.389 1.00 22.31 O HETATM 2286 O HOH 19 39.924 -34.031 49.609 1.00 26.02 O HETATM 2287 O HOH 20 17.259 -36.500 37.573 1.00 22.38 O HETATM 2288 O HOH 21 25.473 -4.358 36.084 1.00 36.12 O HETATM 2289 O HOH 22 36.604 -17.441 24.681 1.00 15.97 O HETATM 2290 O HOH 23 43.662 -12.016 36.401 1.00 19.95 O HETATM 2291 O HOH 24 22.926 -10.829 28.463 1.00 28.75 O HETATM 2292 O HOH 25 40.555 -21.373 32.003 1.00 15.60 O HETATM 2293 O HOH 26 31.378 -31.700 23.903 1.00 40.71 O HETATM 2294 O HOH 27 43.354 -17.067 52.594 1.00 27.02 O HETATM 2295 O HOH 28 35.354 -15.463 36.883 1.00 20.32 O HETATM 2296 O HOH 29 46.188 -7.604 47.742 1.00 50.01 O HETATM 2297 O HOH 30 34.534 -6.282 26.181 1.00 24.11 O HETATM 2298 O HOH 31 32.148 -5.155 25.891 1.00 28.02 O HETATM 2299 O HOH 32 39.908 -32.026 53.227 1.00 35.99 O HETATM 2300 O HOH 33 25.077 -34.618 33.933 1.00 34.33 O HETATM 2301 O HOH 34 42.168 -2.278 29.841 1.00 32.31 O HETATM 2302 O HOH 35 19.545 -8.131 19.004 1.00 33.96 O HETATM 2303 O HOH 36 21.936 -15.630 36.855 1.00 19.06 O HETATM 2304 O HOH 37 23.564 -5.220 42.018 1.00 57.33 O HETATM 2305 O HOH 38 24.127 -21.472 28.929 1.00 20.58 O HETATM 2306 O HOH 39 26.458 -24.675 52.288 1.00 37.39 O HETATM 2307 O HOH 40 25.097 -21.689 47.568 1.00 27.16 O HETATM 2308 O HOH 41 50.004 -22.033 40.532 1.00 45.08 O HETATM 2309 O HOH 42 26.529 -37.497 42.532 1.00 42.62 O HETATM 2310 O HOH 43 38.580 -19.883 56.707 1.00 33.42 O HETATM 2311 O HOH 44 40.820 -19.104 46.593 1.00 36.12 O HETATM 2312 O HOH 45 39.751 -23.884 21.753 1.00 40.57 O HETATM 2313 O HOH 46 46.194 -23.160 28.104 1.00 43.40 O HETATM 2314 O HOH 47 26.641 -15.072 49.104 1.00 27.13 O HETATM 2315 O HOH 48 28.328 -4.052 37.615 1.00 28.10 O HETATM 2316 O HOH 49 28.390 -20.154 27.313 1.00 15.92 O HETATM 2317 O HOH 50 32.018 -23.673 59.666 1.00 44.09 O HETATM 2318 O HOH 51 42.094 -9.593 54.574 1.00 39.88 O HETATM 2319 O HOH 52 43.250 -3.778 45.973 1.00 54.37 O HETATM 2320 O HOH 53 36.866 -40.570 45.307 1.00 52.41 O HETATM 2321 O HOH 54 50.711 -18.763 32.352 1.00 29.68 O HETATM 2322 O HOH 55 37.325 -17.671 59.932 1.00 24.68 O HETATM 2323 O HOH 56 33.420 -12.530 41.247 1.00 26.35 O HETATM 2324 O HOH 57 51.003 -32.329 46.744 1.00 34.46 O HETATM 2325 O HOH 58 27.058 -30.069 50.319 1.00 49.93 O HETATM 2326 O HOH 59 20.858 -2.749 22.231 1.00 52.01 O HETATM 2327 O HOH 60 26.245 -19.438 19.519 1.00 36.20 O HETATM 2328 O HOH 61 36.513 -19.596 26.535 1.00 15.25 O HETATM 2329 O HOH 62 39.578 -38.715 42.476 1.00 43.27 O HETATM 2330 O HOH 63 18.954 -3.590 24.831 1.00 47.59 O HETATM 2331 O HOH 64 16.750 -30.194 36.856 1.00 35.96 O HETATM 2332 O HOH 65 34.196 -30.801 28.810 1.00 36.75 O HETATM 2333 O HOH 66 57.164 -25.593 52.189 1.00 32.39 O HETATM 2334 O HOH 67 46.022 -20.179 52.106 1.00 33.65 O HETATM 2335 O HOH 68 27.662 -1.870 28.787 1.00 31.68 O HETATM 2336 O HOH 69 42.037 -30.683 52.344 1.00 42.40 O HETATM 2337 O HOH 70 38.761 -9.063 52.739 1.00 38.77 O HETATM 2338 O HOH 71 36.440 -9.173 23.781 1.00 21.83 O HETATM 2339 O HOH 72 26.716 -26.590 24.254 1.00 21.38 O HETATM 2340 O HOH 73 50.837 -21.425 51.571 1.00 24.11 O HETATM 2341 O HOH 74 26.821 -21.381 29.081 1.00 16.83 O HETATM 2342 O HOH 75 54.360 -27.439 37.867 1.00 49.72 O HETATM 2343 O HOH 76 38.022 -20.046 48.454 1.00 19.41 O HETATM 2344 O HOH 77 21.645 -12.965 27.319 1.00 35.77 O HETATM 2345 O HOH 78 30.727 -0.905 43.768 1.00 51.21 O HETATM 2346 O HOH 79 35.374 -21.660 60.913 1.00 36.45 O HETATM 2347 O HOH 80 18.419 -12.633 21.242 1.00 54.76 O HETATM 2348 O HOH 81 18.966 -27.738 32.307 1.00 25.96 O HETATM 2349 O HOH 82 17.419 -14.976 33.280 1.00 47.17 O HETATM 2350 O HOH 83 37.222 1.491 22.655 1.00 41.44 O HETATM 2351 O HOH 84 24.957 -32.669 48.661 1.00 50.56 O HETATM 2352 O HOH 85 23.550 -20.969 21.199 1.00 41.21 O HETATM 2353 O HOH 86 30.482 -6.702 17.943 1.00 32.55 O HETATM 2354 O HOH 87 24.491 -36.072 41.434 1.00 42.67 O HETATM 2355 O HOH 88 35.878 -41.121 42.488 1.00 46.62 O HETATM 2356 O HOH 89 42.682 -20.519 54.026 1.00 41.45 O HETATM 2357 O HOH 90 38.313 -17.354 37.626 1.00 18.67 O HETATM 2358 O HOH 91 43.541 -17.032 21.252 1.00 40.94 O HETATM 2359 O HOH 92 50.601 -10.772 50.078 1.00 49.81 O HETATM 2360 O HOH 93 39.598 -2.003 37.796 1.00 41.57 O HETATM 2361 O HOH 94 45.211 -8.908 51.156 1.00 33.08 O HETATM 2362 O HOH 95 32.839 -22.902 21.992 1.00 23.47 O HETATM 2363 O HOH 96 43.940 -22.188 51.851 1.00 34.38 O HETATM 2364 O HOH 97 23.665 -4.232 48.258 1.00 52.72 O HETATM 2365 O HOH 98 36.935 -2.439 38.230 1.00 25.66 O HETATM 2366 O HOH 99 30.632 -3.317 46.348 1.00 50.53 O HETATM 2367 O HOH 100 48.008 -29.301 31.483 1.00 49.72 O HETATM 2368 O HOH 101 53.406 -11.838 30.031 1.00 54.79 O HETATM 2369 O HOH 102 45.171 -32.257 32.185 1.00 47.49 O HETATM 2370 O HOH 103 31.690 -20.536 39.177 1.00 16.69 O HETATM 2371 O HOH 104 42.110 -27.130 52.060 1.00 49.41 O HETATM 2372 O HOH 105 54.356 -14.166 46.169 1.00 38.52 O HETATM 2373 O HOH 106 49.732 -22.685 37.716 1.00 23.99 O HETATM 2374 O HOH 107 35.273 -34.126 29.754 1.00 53.38 O HETATM 2375 O HOH 108 29.223 -37.746 36.502 1.00 40.48 O HETATM 2376 O HOH 109 31.064 -11.019 14.535 1.00 29.67 O HETATM 2377 O HOH 110 27.364 -35.146 30.673 1.00 42.84 O HETATM 2378 O HOH 111 43.358 -20.680 23.146 1.00 51.20 O HETATM 2379 O HOH 112 43.795 -7.090 35.713 1.00 34.04 O HETATM 2380 O HOH 113 29.071 -9.206 15.668 1.00 29.43 O HETATM 2381 O HOH 114 20.224 -29.788 23.522 1.00 33.75 O HETATM 2382 O HOH 115 20.578 -3.878 46.220 1.00 60.05 O HETATM 2383 O HOH 116 56.482 -27.425 46.207 1.00 35.06 O HETATM 2384 O HOH 117 38.785 -3.039 21.339 1.00 27.83 O HETATM 2385 O HOH 118 44.854 -5.240 31.852 1.00 29.62 O HETATM 2386 O HOH 119 37.761 -16.406 16.756 1.00 43.87 O HETATM 2387 O HOH 120 35.471 -35.869 32.283 1.00 61.59 O HETATM 2388 O HOH 121 25.138 -2.206 30.030 1.00 53.35 O HETATM 2389 O HOH 122 42.633 -25.670 49.670 1.00 25.30 O HETATM 2390 O HOH 123 40.936 -17.869 37.518 1.00 14.77 O HETATM 2391 O HOH 124 60.336 -26.332 48.294 1.00 41.56 O HETATM 2392 O HOH 125 41.494 -5.800 23.693 1.00 49.26 O HETATM 2393 O HOH 126 37.747 -26.260 26.202 1.00 23.76 O HETATM 2394 O HOH 127 27.591 -33.252 27.620 1.00 36.68 O HETATM 2395 O HOH 128 48.153 -7.113 40.951 1.00 50.27 O HETATM 2396 O HOH 129 51.618 -12.006 38.727 1.00 42.59 O HETATM 2397 O HOH 130 52.117 -22.270 42.508 1.00 39.90 O HETATM 2398 O HOH 131 34.278 -10.889 52.010 1.00 47.36 O HETATM 2399 O HOH 132 53.760 -31.106 39.129 1.00 40.46 O HETATM 2400 O HOH 133 33.632 -38.164 37.258 1.00 35.04 O HETATM 2401 O HOH 134 31.774 -11.276 51.203 1.00 48.63 O HETATM 2402 O HOH 135 26.339 -27.288 51.954 1.00 41.31 O HETATM 2403 O HOH 136 44.624 -7.957 53.614 1.00 58.86 O HETATM 2404 O HOH 137 30.485 -0.152 36.034 1.00 53.25 O HETATM 2405 O HOH 138 46.020 -35.185 43.169 1.00 33.09 O HETATM 2406 O HOH 139 20.938 -8.557 31.697 1.00 47.15 O HETATM 2407 O HOH 140 43.026 -33.902 49.929 1.00 47.44 O HETATM 2408 O HOH 141 40.770 -26.073 54.355 1.00 56.54 O HETATM 2409 O HOH 142 41.619 -9.031 22.623 1.00 30.62 O HETATM 2410 O HOH 143 22.650 -25.601 22.367 1.00 47.67 O HETATM 2411 O HOH 144 30.057 -8.082 51.867 1.00 58.14 O HETATM 2412 O HOH 145 40.852 -3.111 25.486 1.00 51.11 O HETATM 2413 O HOH 146 18.113 -9.432 28.930 1.00 35.63 O HETATM 2414 O HOH 147 27.029 -12.600 50.666 1.00 29.58 O HETATM 2415 O HOH 148 40.036 1.260 36.333 1.00 51.31 O HETATM 2416 O HOH 149 25.375 0.585 25.491 1.00 57.78 O HETATM 2417 O HOH 150 46.329 -3.749 41.555 1.00 41.12 O HETATM 2418 O HOH 151 41.474 -37.662 44.143 1.00 50.18 O HETATM 2419 O HOH 152 22.485 -3.498 27.559 1.00 35.96 O HETATM 2420 O HOH 153 28.757 -35.878 33.661 1.00 31.80 O HETATM 2421 O HOH 154 24.423 -27.478 23.097 1.00 26.77 O HETATM 2422 O HOH 155 29.007 0.594 28.509 1.00 38.76 O HETATM 2423 O HOH 156 17.530 -25.691 35.616 1.00 26.25 O HETATM 2424 O HOH 157 36.720 -34.311 26.340 1.00 49.18 O HETATM 2425 O HOH 158 55.612 -21.047 45.588 1.00 34.92 O HETATM 2426 O HOH 159 47.986 -9.539 23.661 1.00 42.38 O HETATM 2427 O HOH 160 38.511 -27.333 55.317 1.00 33.94 O HETATM 2428 O HOH 161 43.923 -8.530 24.486 1.00 39.13 O HETATM 2429 O HOH 162 16.141 -23.155 37.247 1.00 37.39 O HETATM 2430 O HOH 163 34.255 -24.841 24.044 1.00 22.87 O HETATM 2431 O HOH 164 49.780 -10.631 40.306 1.00 28.56 O HETATM 2432 O HOH 165 16.848 -8.188 25.877 1.00 37.98 O HETATM 2433 O HOH 166 45.440 -32.057 50.907 1.00 25.17 O HETATM 2434 O HOH 167 24.987 -36.952 37.018 1.00 51.90 O HETATM 2435 O HOH 168 28.470 -1.495 37.098 1.00 50.04 O HETATM 2436 O HOH 169 31.223 -6.365 50.088 1.00 48.76 O HETATM 2437 O HOH 170 28.753 -4.403 17.259 1.00 42.59 O HETATM 2438 O HOH 171 49.504 -9.924 47.783 1.00 43.94 O HETATM 2439 O HOH 172 38.445 -19.922 20.375 1.00 47.04 O HETATM 2440 O HOH 173 23.780 -2.772 33.990 1.00 53.48 O HETATM 2441 O HOH 174 49.018 -18.578 25.300 1.00 48.82 O HETATM 2442 O HOH 175 38.633 -4.082 18.815 1.00 34.76 O HETATM 2443 O HOH 176 50.438 -16.272 25.641 1.00 50.04 O HETATM 2444 O HOH 177 35.054 -35.095 55.022 1.00 39.08 O HETATM 2445 O HOH 178 49.405 -31.723 50.630 1.00 45.85 O HETATM 2446 O HOH 179 20.021 -13.724 38.227 1.00 40.77 O HETATM 2447 O HOH 180 46.474 -20.165 26.060 1.00 58.71 O HETATM 2448 O HOH 181 16.180 -28.025 35.333 1.00 39.73 O HETATM 2449 O HOH 182 44.387 -2.685 31.288 1.00 57.96 O HETATM 2450 O HOH 183 58.227 -28.206 48.235 1.00 44.59 O HETATM 2451 O HOH 184 54.298 -13.926 28.501 1.00 52.18 O HETATM 2452 O HOH 185 32.985 -22.962 62.083 1.00 38.71 O HETATM 2453 O HOH 186 37.501 -24.044 24.790 1.00 44.83 O HETATM 2454 O HOH 187 19.676 -12.160 35.639 1.00 56.89 O HETATM 2455 O HOH 188 35.863 -0.255 39.805 1.00 48.89 O HETATM 2456 O HOH 189 45.982 -5.374 34.477 1.00 47.30 O HETATM 2457 O HOH 190 24.935 -21.682 50.848 1.00 50.24 O HETATM 2458 O HOH 191 43.605 -30.550 30.915 1.00 41.61 O HETATM 2459 O HOH 192 36.506 -21.524 24.736 1.00 30.43 O HETATM 2460 O HOH 193 22.461 -21.026 47.301 1.00 27.97 O HETATM 2461 C13 UNN A 194 37.756 -16.993 28.038 1.00 -0.04 C HETATM 2462 C6 UNN A 194 37.018 -15.729 27.869 1.00 0.03 C HETATM 2463 C5 UNN A 194 35.893 -15.513 28.684 1.00 -0.04 C HETATM 2464 C4 UNN A 194 35.220 -14.308 28.618 1.00 0.04 C HETATM 2465 CL1 UNN A 194 33.807 -14.065 29.616 1.00 -0.08 CL HETATM 2466 C3 UNN A 194 35.629 -13.299 27.768 1.00 -0.05 C HETATM 2467 C2 UNN A 194 36.746 -13.495 26.967 1.00 -0.02 C HETATM 2468 C7 UNN A 194 37.433 -14.706 26.997 1.00 0.14 C HETATM 2469 N8 UNN A 194 38.523 -14.903 26.094 1.00 -0.09 N HETATM 2470 C9 UNN A 194 38.590 -14.904 24.758 1.00 0.17 C HETATM 2471 N10 UNN A 194 39.791 -15.242 24.377 1.00 -0.21 N HETATM 2472 N11 UNN A 194 40.494 -15.435 25.520 1.00 -0.14 N HETATM 2473 N12 UNN A 194 39.747 -15.241 26.563 1.00 -0.05 N HETATM 2474 H15 UNN A 194 37.766 -14.659 24.089 1.00 0.14 H HETATM 2475 H12 UNN A 194 37.086 -12.700 26.314 1.00 0.06 H HETATM 2476 H13 UNN A 194 35.083 -12.363 27.727 1.00 0.06 H HETATM 2477 H14 UNN A 194 35.555 -16.289 29.361 1.00 0.06 H HETATM 2478 C14 UNN A 194 38.298 -17.426 29.182 1.00 0.01 C HETATM 2479 C15 UNN A 194 39.037 -18.687 29.425 1.00 0.19 C HETATM 2480 O16 UNN A 194 39.656 -18.890 30.477 1.00 -0.39 O HETATM 2481 N43 UNN A 194 39.036 -19.582 28.413 1.00 -0.27 N HETATM 2482 C17 UNN A 194 39.691 -20.887 28.560 1.00 0.12 C HETATM 2483 C18 UNN A 194 41.188 -20.775 28.638 1.00 0.14 C HETATM 2484 N26 UNN A 194 41.971 -20.452 27.586 1.00 -0.26 N HETATM 2485 C27 UNN A 194 43.266 -20.519 28.002 1.00 0.03 C HETATM 2486 C28 UNN A 194 43.229 -20.889 29.315 1.00 -0.00 C HETATM 2487 C20 UNN A 194 44.299 -21.234 30.264 1.00 -0.02 C HETATM 2488 C21 UNN A 194 45.411 -20.391 30.371 1.00 -0.08 C HETATM 2489 C22 UNN A 194 46.436 -20.673 31.258 1.00 -0.06 C HETATM 2490 C23 UNN A 194 46.353 -21.785 32.096 1.00 0.05 C HETATM 2491 C24 UNN A 194 45.259 -22.642 31.989 1.00 -0.02 C HETATM 2492 C25 UNN A 194 44.242 -22.389 31.076 1.00 0.06 C HETATM 2493 N30 UNN A 194 43.177 -23.312 30.927 1.00 -0.24 N HETATM 2494 C35 UNN A 194 43.037 -24.100 29.843 1.00 0.21 C HETATM 2495 C34 UNN A 194 41.982 -25.181 29.967 1.00 0.05 C HETATM 2496 C33 UNN A 194 41.030 -25.218 28.754 1.00 -0.01 C HETATM 2497 C32 UNN A 194 40.207 -23.960 28.659 1.00 -0.09 C HETATM 2498 C31 UNN A 194 40.059 -23.212 27.573 1.00 -0.09 C HETATM 2499 C19 UNN A 194 39.283 -21.910 27.487 1.00 0.00 C HETATM 2500 H3 UNN A 194 39.457 -21.465 26.496 1.00 0.04 H HETATM 2501 H4 UNN A 194 38.212 -22.133 27.606 1.00 0.04 H HETATM 2502 H19 UNN A 194 40.538 -23.564 26.660 1.00 0.05 H HETATM 2503 H20 UNN A 194 39.688 -23.636 29.560 1.00 0.05 H HETATM 2504 C42 UNN A 194 40.185 -26.493 28.787 1.00 -0.05 C HETATM 2505 H25 UNN A 194 39.511 -26.509 27.918 1.00 0.03 H HETATM 2506 H26 UNN A 194 39.591 -26.515 29.713 1.00 0.03 H HETATM 2507 H27 UNN A 194 40.846 -27.372 28.754 1.00 0.03 H HETATM 2508 H11 UNN A 194 41.651 -25.263 27.847 1.00 0.04 H HETATM 2509 H8 UNN A 194 42.484 -26.156 30.052 1.00 0.05 H HETATM 2510 H9 UNN A 194 41.390 -24.994 30.875 1.00 0.05 H HETATM 2511 O41 UNN A 194 43.707 -23.965 28.819 1.00 -0.38 O HETATM 2512 H18 UNN A 194 42.499 -23.382 31.659 1.00 0.23 H HETATM 2513 H7 UNN A 194 45.201 -23.517 32.626 1.00 0.04 H HETATM 2514 N36 UNN A 194 47.357 -22.182 33.019 1.00 -0.21 N HETATM 2515 C37 UNN A 194 48.639 -21.728 33.098 1.00 0.35 C HETATM 2516 O38 UNN A 194 49.224 -22.214 34.214 1.00 -0.26 O HETATM 2517 C40 UNN A 194 50.667 -22.047 34.316 1.00 0.07 C HETATM 2518 H22 UNN A 194 51.020 -22.481 35.263 1.00 0.06 H HETATM 2519 H23 UNN A 194 50.915 -20.976 34.289 1.00 0.06 H HETATM 2520 H24 UNN A 194 51.156 -22.558 33.473 1.00 0.06 H HETATM 2521 O39 UNN A 194 49.198 -21.019 32.287 1.00 -0.37 O HETATM 2522 H21 UNN A 194 47.092 -22.876 33.689 1.00 0.23 H HETATM 2523 H6 UNN A 194 47.306 -20.027 31.301 1.00 0.04 H HETATM 2524 H5 UNN A 194 45.471 -19.504 29.750 1.00 0.05 H HETATM 2525 N29 UNN A 194 41.904 -21.038 29.711 1.00 -0.33 N HETATM 2526 H10 UNN A 194 44.154 -20.317 27.405 1.00 0.08 H HETATM 2527 H17 UNN A 194 41.648 -20.201 26.641 1.00 0.24 H HETATM 2528 H2 UNN A 194 39.352 -21.293 29.525 1.00 0.08 H HETATM 2529 H28 UNN A 194 38.583 -19.352 27.552 1.00 0.19 H HETATM 2530 H16 UNN A 194 38.181 -16.769 30.043 1.00 0.06 H HETATM 2531 H1 UNN A 194 37.870 -17.627 27.160 1.00 0.07 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 277 276 414 CONECT 414 277 413 CONECT 1183 1182 1829 CONECT 1497 1496 1656 CONECT 1656 1497 1655 CONECT 1753 1752 2000 CONECT 1829 1183 1828 CONECT 2000 1753 1999 CONECT 2461 2462 2478 2531 CONECT 2462 2461 2463 2468 CONECT 2463 2462 2464 2477 CONECT 2464 2463 2465 2466 CONECT 2465 2464 CONECT 2466 2464 2467 2476 CONECT 2467 2466 2468 2475 CONECT 2468 2462 2467 2469 CONECT 2469 2468 2470 2473 CONECT 2470 2469 2471 2474 CONECT 2471 2470 2472 CONECT 2472 2471 2473 CONECT 2473 2469 2472 CONECT 2474 2470 CONECT 2475 2467 CONECT 2476 2466 CONECT 2477 2463 CONECT 2478 2461 2479 2530 CONECT 2479 2478 2480 2481 CONECT 2480 2479 CONECT 2481 2479 2482 2529 CONECT 2482 2481 2483 2499 2528 CONECT 2483 2482 2484 2525 CONECT 2484 2483 2485 2527 CONECT 2485 2484 2486 2526 CONECT 2486 2485 2487 2525 CONECT 2487 2486 2488 2492 CONECT 2488 2487 2489 2524 CONECT 2489 2488 2490 2523 CONECT 2490 2489 2491 2514 CONECT 2491 2490 2492 2513 CONECT 2492 2487 2491 2493 CONECT 2493 2492 2494 2512 CONECT 2494 2493 2495 2511 CONECT 2495 2494 2496 2509 2510 CONECT 2496 2495 2497 2504 2508 CONECT 2497 2496 2498 2503 CONECT 2498 2497 2499 2502 CONECT 2499 2482 2498 2500 2501 CONECT 2500 2499 CONECT 2501 2499 CONECT 2502 2498 CONECT 2503 2497 CONECT 2504 2496 2505 2506 2507 CONECT 2505 2504 CONECT 2506 2504 CONECT 2507 2504 CONECT 2508 2496 CONECT 2509 2495 CONECT 2510 2495 CONECT 2511 2494 CONECT 2512 2493 CONECT 2513 2491 CONECT 2514 2490 2515 2522 CONECT 2515 2514 2516 2521 CONECT 2516 2515 2517 CONECT 2517 2516 2518 2519 2520 CONECT 2518 2517 CONECT 2519 2517 CONECT 2520 2517 CONECT 2521 2515 CONECT 2522 2514 CONECT 2523 2489 CONECT 2524 2488 CONECT 2525 2483 2486 CONECT 2526 2485 CONECT 2527 2484 CONECT 2528 2482 CONECT 2529 2481 CONECT 2530 2478 CONECT 2531 2461 MASTER 0 0 0 0 0 0 0 0 2530 1 83 19 END
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Structure:
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Related entries of code: 5q0f
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4ty6
RCSB PDB
PDBbind
18aa, >4TY6_2|Chain... *
4x6n
RCSB PDB
PDBbind
18aa, >4X6N_2|Chain... at 100%
5qtu
RCSB PDB
PDBbind
18aa, >5QTU_2|Chain... at 100%
5qqo
RCSB PDB
PDBbind
18aa, >5QQO_2|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5q0f
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Coagulation factor XI
Ligand Name
9FA
EC.Number
E.C.3.4.21.27
Resolution
2.12(Å)
Affinity (Kd/Ki/IC50)
Ki=0.13nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Bioorg. Med. Chem. Lett. Vol. 27: pp. 3833-3839
Ligand Properties
Formula
C
2
9
H
2
8
ClN
9
O
4
Molecular Weight
602.044
Exact Mass
601.195
No. of atoms
71
No. of bonds
75
Polar Surface Area
168.81
LOGP Value
2.60 (
Computed with XLOGP3
)
5.28 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 13
No. of Rings: 5
Canonical SMILES
COC(=O)Nc1ccc2c(c1)NC(=O)C[C@@H](C)/C=C/C[C@@H](c1nc2c[nH]1)NC(=O)/C=C/c1cc(Cl)ccc1n1cnnn1
InChI String
InChI=1S/C29H28ClN9O4/c1-17-4-3-5-22(34-26(40)11-6-18-13-19(30)7-10-25(18)39-16-32-37-38-39)28-31-15-24(36-28)21-9-8-20(33-29(42)43-2)14-23(21)35-27(41)12-17/h3-4,6-11,13-17,22H,5,12H2,1-2H3,(H,31,36)(H,33,42)(H,34,40)(H,35,41)/b4-3+,11-6+/t17-,22-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P03951
Entrez Gene ID
NCBI Entrez Gene ID:
2160
ASD
Information of known allosteric effects of PDB entries
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