Browse entries in the PDBbind-CN Database
HEADER 4X6P_COMPLEX COMPND 4X6P_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 236 ILE VAL GLY GLY THR ALA SER VAL ARG GLY GLU TRP PRO SEQRES 2 A 236 TRP GLN VAL THR LEU HIS THR THR SER PRO THR GLN ARG SEQRES 3 A 236 HIS LEU CYS GLY GLY SER ILE ILE GLY ASN GLN TRP ILE SEQRES 4 A 236 LEU THR ALA ALA HIS CYS PHE TYR GLY VAL GLU SER PRO SEQRES 5 A 236 LYS ILE LEU ARG VAL TYR SER GLY ILE LEU ASN GLN SER SEQRES 6 A 236 GLU ILE LYS GLU ASP THR SER PHE PHE GLY VAL GLN GLU SEQRES 7 A 236 ILE ILE ILE HIS ASP GLN TYR LYS MET ALA GLU SER GLY SEQRES 8 A 236 TYR ASP ILE ALA LEU LEU LYS LEU GLU THR THR VAL ASN SEQRES 9 A 236 TYR THR ASP SER GLN ARG PRO ILE SER LEU PRO SER LYS SEQRES 10 A 236 GLY ASP ARG ASN VAL ILE TYR THR ASP CYS TRP VAL THR SEQRES 11 A 236 GLY TRP GLY TYR ARG LYS LEU ARG ASP LYS ILE GLN ASN SEQRES 12 A 236 THR LEU GLN LYS ALA LYS ILE PRO LEU VAL THR ASN GLU SEQRES 13 A 236 GLU CYS GLN LYS ARG TYR ARG GLY HIS LYS ILE THR HIS SEQRES 14 A 236 LYS MET ILE CYS ALA GLY TYR ARG GLU GLY GLY LYS ASP SEQRES 15 A 236 ALA CYS LYS GLY ASP SER GLY GLY PRO LEU SER CYS LYS SEQRES 16 A 236 HIS ASN GLU VAL TRP HIS LEU VAL GLY ILE THR SER TRP SEQRES 17 A 236 GLY GLU GLY CYS ALA GLN ARG GLU ARG PRO GLY VAL TYR SEQRES 18 A 236 THR ASN VAL VAL GLU TYR VAL ASP TRP ILE LEU GLU LYS SEQRES 19 A 236 THR GLN HET UNN A 405 63 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 16.393 10.696 -35.000 1.00 16.44 N ATOM 2 CA ILE A 16 17.822 10.433 -34.850 1.00 16.07 C ATOM 3 C ILE A 16 18.188 9.172 -35.656 1.00 20.16 C ATOM 4 O ILE A 16 17.591 8.120 -35.424 1.00 18.81 O ATOM 5 CB ILE A 16 18.190 10.236 -33.345 1.00 18.29 C ATOM 6 CG1 ILE A 16 17.811 11.454 -32.438 1.00 18.35 C ATOM 7 CG2 ILE A 16 19.695 9.860 -33.183 1.00 18.76 C ATOM 8 CD1 ILE A 16 18.606 12.776 -32.671 1.00 16.29 C ATOM 9 HN3 ILE A 16 15.853 9.882 -34.643 1.00 0.00 H ATOM 10 HN2 ILE A 16 16.173 10.846 -36.005 1.00 0.00 H ATOM 11 HN1 ILE A 16 16.140 11.547 -34.458 1.00 0.00 H ATOM 12 N VAL A 17 19.175 9.275 -36.560 1.00 19.20 N ATOM 13 CA VAL A 17 19.696 8.150 -37.361 1.00 19.50 C ATOM 14 C VAL A 17 20.834 7.482 -36.581 1.00 22.62 C ATOM 15 O VAL A 17 21.685 8.177 -36.043 1.00 21.34 O ATOM 16 CB VAL A 17 20.201 8.590 -38.777 1.00 24.07 C ATOM 17 CG1 VAL A 17 20.598 7.372 -39.638 1.00 24.42 C ATOM 18 CG2 VAL A 17 19.164 9.432 -39.503 1.00 23.29 C ATOM 19 H VAL A 17 19.602 10.212 -36.706 1.00 0.00 H ATOM 20 N GLY A 18 20.843 6.144 -36.545 1.00 20.81 N ATOM 21 CA GLY A 18 21.897 5.351 -35.918 1.00 21.00 C ATOM 22 C GLY A 18 22.045 5.567 -34.425 1.00 26.31 C ATOM 23 O GLY A 18 23.125 5.362 -33.857 1.00 26.12 O ATOM 24 H GLY A 18 20.051 5.638 -36.991 1.00 0.00 H ATOM 25 N GLY A 19 20.956 5.985 -33.791 1.00 22.89 N ATOM 26 CA GLY A 19 20.955 6.223 -32.355 1.00 22.38 C ATOM 27 C GLY A 19 20.432 5.029 -31.585 1.00 26.46 C ATOM 28 O GLY A 19 20.177 3.960 -32.154 1.00 24.62 O ATOM 29 H GLY A 19 20.083 6.146 -34.333 1.00 0.00 H ATOM 30 N THR A 20 20.260 5.222 -30.284 1.00 21.74 N ATOM 31 CA THR A 20 19.772 4.185 -29.395 1.00 21.63 C ATOM 32 C THR A 20 18.736 4.811 -28.459 1.00 22.53 C ATOM 33 O THR A 20 18.704 6.029 -28.309 1.00 20.75 O ATOM 34 CB THR A 20 20.965 3.505 -28.675 1.00 29.86 C ATOM 35 OG1 THR A 20 20.527 2.283 -28.092 1.00 43.45 O ATOM 36 CG2 THR A 20 21.576 4.367 -27.604 1.00 22.29 C ATOM 37 HG1 THR A 20 21.287 1.847 -27.632 1.00 0.00 H ATOM 38 H THR A 20 20.484 6.156 -29.885 1.00 0.00 H ATOM 39 N ALA A 21 17.902 3.989 -27.839 1.00 19.57 N ATOM 40 CA ALA A 21 16.863 4.489 -26.944 1.00 20.06 C ATOM 41 C ALA A 21 17.449 5.098 -25.683 1.00 22.92 C ATOM 42 O ALA A 21 18.383 4.560 -25.096 1.00 23.22 O ATOM 43 CB ALA A 21 15.889 3.370 -26.576 1.00 20.84 C ATOM 44 H ALA A 21 17.990 2.964 -27.994 1.00 0.00 H ATOM 45 N SER A 22 16.899 6.245 -25.281 1.00 16.92 N ATOM 46 CA SER A 22 17.295 6.895 -24.038 1.00 15.68 C ATOM 47 C SER A 22 16.544 6.189 -22.918 1.00 18.60 C ATOM 48 O SER A 22 15.636 5.398 -23.186 1.00 17.32 O ATOM 49 CB SER A 22 16.931 8.381 -24.064 1.00 18.05 C ATOM 50 OG SER A 22 17.691 9.053 -25.054 1.00 19.66 O ATOM 51 HG SER A 22 17.447 10.012 -25.061 1.00 0.00 H ATOM 52 H SER A 22 16.167 6.688 -25.872 1.00 0.00 H ATOM 53 N VAL A 23 16.924 6.436 -21.679 1.00 16.32 N ATOM 54 CA VAL A 23 16.190 5.835 -20.549 1.00 16.01 C ATOM 55 C VAL A 23 15.422 6.978 -19.933 1.00 19.10 C ATOM 56 O VAL A 23 15.795 8.141 -20.143 1.00 17.70 O ATOM 57 CB VAL A 23 17.079 5.089 -19.503 1.00 19.67 C ATOM 58 CG1 VAL A 23 17.821 3.912 -20.144 1.00 19.44 C ATOM 59 CG2 VAL A 23 18.060 6.036 -18.802 1.00 19.39 C ATOM 60 H VAL A 23 17.741 7.054 -21.499 1.00 0.00 H ATOM 61 N ARG A 24 14.368 6.677 -19.173 1.00 18.42 N ATOM 62 CA ARG A 24 13.598 7.719 -18.501 1.00 18.59 C ATOM 63 C ARG A 24 14.509 8.535 -17.573 1.00 22.67 C ATOM 64 O ARG A 24 15.340 7.954 -16.849 1.00 21.21 O ATOM 65 CB ARG A 24 12.409 7.095 -17.751 1.00 20.19 C ATOM 66 CG ARG A 24 11.437 8.117 -17.184 1.00 23.50 C ATOM 67 CD ARG A 24 10.171 7.489 -16.613 1.00 23.36 C ATOM 68 NE ARG A 24 9.347 6.804 -17.615 1.00 21.64 N ATOM 69 CZ ARG A 24 8.549 7.394 -18.501 1.00 33.26 C ATOM 70 NH1 ARG A 24 8.480 8.720 -18.570 1.00 19.60 N ATOM 71 NH2 ARG A 24 7.833 6.665 -19.340 1.00 26.71 N ATOM 72 HE ARG A 24 9.391 5.765 -17.634 1.00 0.00 H ATOM 73 HH12 ARG A 24 7.853 9.173 -19.266 1.00 0.00 H ATOM 74 HH11 ARG A 24 9.053 9.305 -17.928 1.00 0.00 H ATOM 75 HH22 ARG A 24 7.210 7.129 -20.031 1.00 0.00 H ATOM 76 HH21 ARG A 24 7.893 5.627 -19.309 1.00 0.00 H ATOM 77 H ARG A 24 14.090 5.682 -19.057 1.00 0.00 H ATOM 78 N GLY A 25 14.410 9.876 -17.686 1.00 20.13 N ATOM 79 CA GLY A 25 15.178 10.815 -16.871 1.00 19.04 C ATOM 80 C GLY A 25 16.600 11.074 -17.328 1.00 21.19 C ATOM 81 O GLY A 25 17.327 11.825 -16.678 1.00 21.76 O ATOM 82 H GLY A 25 13.751 10.262 -18.392 1.00 0.00 H ATOM 83 N GLU A 26 17.011 10.495 -18.454 1.00 18.00 N ATOM 84 CA GLU A 26 18.384 10.665 -18.957 1.00 16.88 C ATOM 85 C GLU A 26 18.680 12.077 -19.508 1.00 19.93 C ATOM 86 O GLU A 26 19.828 12.538 -19.430 1.00 17.49 O ATOM 87 CB GLU A 26 18.673 9.620 -20.029 1.00 17.79 C ATOM 88 CG GLU A 26 20.148 9.419 -20.314 1.00 21.50 C ATOM 89 CD GLU A 26 20.474 8.299 -21.282 1.00 24.14 C ATOM 90 OE1 GLU A 26 19.543 7.658 -21.814 1.00 21.14 O ATOM 91 OE2 GLU A 26 21.677 8.086 -21.534 1.00 28.52 O ATOM 92 H GLU A 26 16.344 9.907 -18.993 1.00 0.00 H ATOM 93 N TRP A 27 17.675 12.755 -20.063 1.00 16.47 N ATOM 94 CA TRP A 27 17.897 14.085 -20.680 1.00 15.12 C ATOM 95 C TRP A 27 16.777 15.001 -20.128 1.00 15.41 C ATOM 96 O TRP A 27 15.847 15.311 -20.867 1.00 14.66 O ATOM 97 CB TRP A 27 17.837 13.937 -22.238 1.00 13.71 C ATOM 98 CG TRP A 27 18.790 12.918 -22.788 1.00 14.35 C ATOM 99 CD1 TRP A 27 18.507 11.641 -23.165 1.00 17.37 C ATOM 100 CD2 TRP A 27 20.205 13.070 -22.919 1.00 14.16 C ATOM 101 NE1 TRP A 27 19.658 11.004 -23.587 1.00 17.04 N ATOM 102 CE2 TRP A 27 20.716 11.855 -23.431 1.00 17.87 C ATOM 103 CE3 TRP A 27 21.092 14.128 -22.679 1.00 14.83 C ATOM 104 CZ2 TRP A 27 22.081 11.669 -23.714 1.00 16.85 C ATOM 105 CZ3 TRP A 27 22.446 13.934 -22.947 1.00 15.61 C ATOM 106 CH2 TRP A 27 22.924 12.709 -23.431 1.00 16.19 C ATOM 107 HE1 TRP A 27 19.711 10.035 -23.962 1.00 0.00 H ATOM 108 H TRP A 27 16.720 12.344 -20.063 1.00 0.00 H ATOM 109 N PRO A 28 16.797 15.358 -18.811 1.00 11.28 N ATOM 110 CA PRO A 28 15.638 16.043 -18.210 1.00 12.17 C ATOM 111 C PRO A 28 15.352 17.461 -18.702 1.00 15.10 C ATOM 112 O PRO A 28 14.319 17.997 -18.358 1.00 15.85 O ATOM 113 CB PRO A 28 15.949 16.001 -16.700 1.00 13.52 C ATOM 114 CG PRO A 28 17.462 15.956 -16.632 1.00 17.77 C ATOM 115 CD PRO A 28 17.812 15.037 -17.772 1.00 13.86 C ATOM 116 N TRP A 29 16.239 18.042 -19.508 1.00 11.20 N ATOM 117 CA TRP A 29 16.010 19.350 -20.134 1.00 12.56 C ATOM 118 C TRP A 29 15.271 19.173 -21.470 1.00 16.28 C ATOM 119 O TRP A 29 14.745 20.143 -22.002 1.00 16.66 O ATOM 120 CB TRP A 29 17.338 20.104 -20.355 1.00 12.38 C ATOM 121 CG TRP A 29 18.440 19.262 -20.942 1.00 14.50 C ATOM 122 CD1 TRP A 29 18.762 19.136 -22.263 1.00 17.48 C ATOM 123 CD2 TRP A 29 19.414 18.498 -20.216 1.00 15.45 C ATOM 124 NE1 TRP A 29 19.852 18.307 -22.411 1.00 16.83 N ATOM 125 CE2 TRP A 29 20.269 17.893 -21.171 1.00 18.61 C ATOM 126 CE3 TRP A 29 19.655 18.270 -18.845 1.00 17.32 C ATOM 127 CZ2 TRP A 29 21.368 17.114 -20.802 1.00 18.70 C ATOM 128 CZ3 TRP A 29 20.710 17.440 -18.483 1.00 19.18 C ATOM 129 CH2 TRP A 29 21.561 16.888 -19.450 1.00 20.11 C ATOM 130 HE1 TRP A 29 20.288 18.038 -23.316 1.00 0.00 H ATOM 131 H TRP A 29 17.133 17.547 -19.702 1.00 0.00 H ATOM 132 N GLN A 30 15.232 17.962 -22.015 1.00 11.97 N ATOM 133 CA GLN A 30 14.559 17.704 -23.307 1.00 10.49 C ATOM 134 C GLN A 30 13.036 17.839 -23.190 1.00 15.86 C ATOM 135 O GLN A 30 12.410 17.180 -22.356 1.00 15.64 O ATOM 136 CB GLN A 30 14.894 16.298 -23.854 1.00 11.47 C ATOM 137 CG GLN A 30 14.084 15.911 -25.126 1.00 11.28 C ATOM 138 CD GLN A 30 14.755 16.364 -26.396 1.00 18.47 C ATOM 139 OE1 GLN A 30 15.908 16.032 -26.645 1.00 16.02 O ATOM 140 NE2 GLN A 30 14.058 17.157 -27.222 1.00 14.77 N ATOM 141 HE22 GLN A 30 13.081 17.423 -26.986 1.00 0.00 H ATOM 142 HE21 GLN A 30 14.494 17.506 -28.099 1.00 0.00 H ATOM 143 H GLN A 30 15.689 17.171 -21.518 1.00 0.00 H ATOM 144 N VAL A 31 12.440 18.602 -24.101 1.00 11.30 N ATOM 145 CA VAL A 31 10.981 18.693 -24.173 1.00 9.68 C ATOM 146 C VAL A 31 10.510 18.291 -25.578 1.00 13.87 C ATOM 147 O VAL A 31 11.290 18.344 -26.538 1.00 12.49 O ATOM 148 CB VAL A 31 10.388 20.083 -23.761 1.00 14.03 C ATOM 149 CG1 VAL A 31 10.694 20.411 -22.297 1.00 14.10 C ATOM 150 CG2 VAL A 31 10.860 21.213 -24.681 1.00 13.98 C ATOM 151 H VAL A 31 13.020 19.143 -24.774 1.00 0.00 H ATOM 152 N THR A 32 9.223 17.903 -25.679 1.00 11.04 N ATOM 153 CA THR A 32 8.543 17.681 -26.942 1.00 11.88 C ATOM 154 C THR A 32 7.505 18.793 -27.026 1.00 15.31 C ATOM 155 O THR A 32 6.679 18.986 -26.102 1.00 15.32 O ATOM 156 CB THR A 32 7.964 16.240 -27.116 1.00 14.76 C ATOM 157 OG1 THR A 32 7.132 16.233 -28.284 1.00 15.03 O ATOM 158 CG2 THR A 32 7.147 15.765 -25.926 1.00 13.95 C ATOM 159 HG1 THR A 32 7.673 16.482 -29.075 1.00 0.00 H ATOM 160 H THR A 32 8.686 17.754 -24.801 1.00 0.00 H ATOM 161 N LEU A 33 7.610 19.566 -28.099 1.00 12.59 N ATOM 162 CA LEU A 33 6.699 20.667 -28.361 1.00 13.81 C ATOM 163 C LEU A 33 5.615 20.160 -29.300 1.00 15.26 C ATOM 164 O LEU A 33 5.926 19.688 -30.386 1.00 15.02 O ATOM 165 CB LEU A 33 7.463 21.854 -28.983 1.00 15.29 C ATOM 166 CG LEU A 33 6.608 23.019 -29.497 1.00 21.44 C ATOM 167 CD1 LEU A 33 5.953 23.790 -28.346 1.00 22.56 C ATOM 168 CD2 LEU A 33 7.426 23.933 -30.374 1.00 24.00 C ATOM 169 H LEU A 33 8.374 19.377 -28.779 1.00 0.00 H ATOM 170 N HIS A 34 4.357 20.199 -28.855 1.00 12.24 N ATOM 171 CA HIS A 34 3.227 19.739 -29.658 1.00 12.45 C ATOM 172 C HIS A 34 2.365 20.901 -30.150 1.00 18.51 C ATOM 173 O HIS A 34 2.223 21.905 -29.456 1.00 16.88 O ATOM 174 CB HIS A 34 2.300 18.831 -28.801 1.00 12.76 C ATOM 175 CG HIS A 34 2.809 17.444 -28.576 1.00 15.26 C ATOM 176 ND1 HIS A 34 1.930 16.384 -28.380 1.00 16.09 N ATOM 177 CD2 HIS A 34 4.078 16.977 -28.528 1.00 15.87 C ATOM 178 CE1 HIS A 34 2.684 15.313 -28.243 1.00 15.47 C ATOM 179 NE2 HIS A 34 3.983 15.612 -28.334 1.00 15.52 N ATOM 180 H HIS A 34 4.175 20.571 -27.901 1.00 0.00 H ATOM 181 N THR A 35 1.770 20.744 -31.354 1.00 15.60 N ATOM 182 CA THR A 35 0.728 21.635 -31.878 1.00 16.32 C ATOM 183 C THR A 35 -0.599 20.886 -31.615 1.00 20.24 C ATOM 184 O THR A 35 -0.587 19.654 -31.608 1.00 17.53 O ATOM 185 CB THR A 35 0.901 21.976 -33.360 1.00 19.51 C ATOM 186 OG1 THR A 35 1.151 20.781 -34.118 1.00 17.41 O ATOM 187 CG2 THR A 35 2.005 22.929 -33.585 1.00 19.93 C ATOM 188 HG1 THR A 35 0.387 20.160 -34.015 1.00 0.00 H ATOM 189 H THR A 35 2.069 19.942 -31.945 1.00 0.00 H ATOM 190 N THR A 36 -1.715 21.584 -31.324 1.00 17.30 N ATOM 191 CA THR A 36 -3.015 20.924 -31.035 1.00 17.38 C ATOM 192 C THR A 36 -4.032 21.042 -32.175 1.00 22.24 C ATOM 193 O THR A 36 -5.115 20.438 -32.095 1.00 21.08 O ATOM 194 CB THR A 36 -3.529 21.641 -29.779 1.00 21.29 C ATOM 195 OG1 THR A 36 -3.700 23.031 -30.045 1.00 22.31 O ATOM 196 CG2 THR A 36 -2.690 21.386 -28.547 1.00 20.60 C ATOM 197 HG1 THR A 36 -4.355 23.147 -30.778 1.00 0.00 H ATOM 198 H THR A 36 -1.664 22.623 -31.301 1.00 0.00 H ATOM 199 N SER A 36A -3.718 21.805 -33.212 1.00 19.02 N ATOM 200 CA SER A 36A -4.607 22.055 -34.340 1.00 20.12 C ATOM 201 C SER A 36A -4.123 21.482 -35.679 1.00 22.55 C ATOM 202 O SER A 36A -2.968 21.698 -36.065 1.00 20.99 O ATOM 203 CB SER A 36A -4.729 23.588 -34.339 1.00 26.73 C ATOM 204 OG SER A 36A -5.692 24.014 -35.289 1.00 34.06 O ATOM 205 HG SER A 36A -5.755 25.002 -35.273 1.00 0.00 H ATOM 206 H SER A 36A -2.780 22.253 -33.222 1.00 0.00 H ATOM 207 N PRO A 36B -5.002 20.765 -36.427 1.00 20.72 N ATOM 208 CA PRO A 36B -6.379 20.347 -36.073 1.00 20.25 C ATOM 209 C PRO A 36B -6.397 19.189 -35.061 1.00 22.98 C ATOM 210 O PRO A 36B -7.424 18.918 -34.450 1.00 22.39 O ATOM 211 CB PRO A 36B -6.966 19.913 -37.425 1.00 22.44 C ATOM 212 CG PRO A 36B -5.783 19.416 -38.210 1.00 26.87 C ATOM 213 CD PRO A 36B -4.587 20.225 -37.746 1.00 23.08 C ATOM 214 N THR A 37 -5.264 18.496 -34.905 1.00 18.09 N ATOM 215 CA THR A 37 -5.106 17.364 -33.990 1.00 17.89 C ATOM 216 C THR A 37 -3.759 17.519 -33.282 1.00 20.77 C ATOM 217 O THR A 37 -2.899 18.233 -33.793 1.00 18.52 O ATOM 218 CB THR A 37 -5.289 16.007 -34.735 1.00 23.82 C ATOM 219 OG1 THR A 37 -5.476 14.986 -33.777 1.00 31.06 O ATOM 220 CG2 THR A 37 -4.101 15.625 -35.587 1.00 20.86 C ATOM 221 HG1 THR A 37 -6.282 15.185 -33.237 1.00 0.00 H ATOM 222 H THR A 37 -4.440 18.780 -35.472 1.00 0.00 H ATOM 223 N GLN A 38 -3.572 16.857 -32.137 1.00 16.74 N ATOM 224 CA GLN A 38 -2.329 17.003 -31.378 1.00 16.33 C ATOM 225 C GLN A 38 -1.193 16.147 -31.935 1.00 17.79 C ATOM 226 O GLN A 38 -1.322 14.934 -32.071 1.00 14.42 O ATOM 227 CB GLN A 38 -2.565 16.742 -29.888 1.00 17.98 C ATOM 228 CG GLN A 38 -1.348 17.147 -29.050 1.00 18.01 C ATOM 229 CD GLN A 38 -1.596 17.054 -27.571 1.00 24.33 C ATOM 230 OE1 GLN A 38 -2.686 17.350 -27.062 1.00 20.07 O ATOM 231 NE2 GLN A 38 -0.564 16.695 -26.838 1.00 18.74 N ATOM 232 HE22 GLN A 38 0.339 16.452 -27.294 1.00 0.00 H ATOM 233 HE21 GLN A 38 -0.651 16.654 -25.802 1.00 0.00 H ATOM 234 H GLN A 38 -4.320 16.229 -31.780 1.00 0.00 H ATOM 235 N ARG A 39 -0.058 16.785 -32.248 1.00 16.17 N ATOM 236 CA ARG A 39 1.106 16.086 -32.798 1.00 16.22 C ATOM 237 C ARG A 39 2.380 16.754 -32.329 1.00 17.67 C ATOM 238 O ARG A 39 2.417 17.978 -32.207 1.00 13.08 O ATOM 239 CB ARG A 39 1.133 16.169 -34.341 1.00 19.69 C ATOM 240 CG ARG A 39 -0.085 15.611 -35.054 1.00 35.43 C ATOM 241 CD ARG A 39 0.038 15.776 -36.561 1.00 42.90 C ATOM 242 NE ARG A 39 -1.048 15.155 -37.316 1.00 46.27 N ATOM 243 CZ ARG A 39 -1.226 13.848 -37.513 1.00 60.05 C ATOM 244 NH1 ARG A 39 -0.343 12.970 -37.044 1.00 46.87 N ATOM 245 NH2 ARG A 39 -2.278 13.412 -38.198 1.00 40.50 N ATOM 246 HE ARG A 39 -1.750 15.794 -37.741 1.00 0.00 H ATOM 247 HH12 ARG A 39 -0.488 11.952 -37.201 1.00 0.00 H ATOM 248 HH11 ARG A 39 0.492 13.302 -36.520 1.00 0.00 H ATOM 249 HH22 ARG A 39 -2.413 12.392 -38.350 1.00 0.00 H ATOM 250 HH21 ARG A 39 -2.966 14.091 -38.582 1.00 0.00 H ATOM 251 H ARG A 39 -0.001 17.812 -32.095 1.00 0.00 H ATOM 252 N HIS A 40 3.455 15.962 -32.244 1.00 14.91 N ATOM 253 CA HIS A 40 4.803 16.468 -31.989 1.00 14.19 C ATOM 254 C HIS A 40 5.177 17.351 -33.195 1.00 17.91 C ATOM 255 O HIS A 40 4.927 17.000 -34.350 1.00 15.24 O ATOM 256 CB HIS A 40 5.772 15.272 -31.898 1.00 13.94 C ATOM 257 CG HIS A 40 7.223 15.644 -31.990 1.00 15.92 C ATOM 258 ND1 HIS A 40 7.938 16.010 -30.872 1.00 17.18 N ATOM 259 CD2 HIS A 40 8.047 15.669 -33.071 1.00 16.82 C ATOM 260 CE1 HIS A 40 9.164 16.270 -31.292 1.00 16.27 C ATOM 261 NE2 HIS A 40 9.286 16.064 -32.609 1.00 16.47 N ATOM 262 H HIS A 40 3.326 14.937 -32.365 1.00 0.00 H ATOM 263 N LEU A 41 5.767 18.506 -32.907 1.00 13.72 N ATOM 264 CA LEU A 41 6.214 19.436 -33.909 1.00 12.89 C ATOM 265 C LEU A 41 7.746 19.538 -33.896 1.00 16.15 C ATOM 266 O LEU A 41 8.387 19.434 -34.947 1.00 14.93 O ATOM 267 CB LEU A 41 5.603 20.820 -33.588 1.00 13.20 C ATOM 268 CG LEU A 41 6.139 22.022 -34.405 1.00 18.45 C ATOM 269 CD1 LEU A 41 5.826 21.872 -35.895 1.00 19.15 C ATOM 270 CD2 LEU A 41 5.599 23.342 -33.866 1.00 18.54 C ATOM 271 H LEU A 41 5.913 18.750 -31.907 1.00 0.00 H ATOM 272 N CYS A 42 8.332 19.748 -32.684 1.00 14.37 N ATOM 273 CA CYS A 42 9.766 20.015 -32.536 1.00 15.15 C ATOM 274 C CYS A 42 10.262 19.618 -31.166 1.00 16.75 C ATOM 275 O CYS A 42 9.482 19.468 -30.212 1.00 15.36 O ATOM 276 CB CYS A 42 10.036 21.507 -32.776 1.00 16.57 C ATOM 277 SG CYS A 42 10.241 21.971 -34.513 1.00 21.92 S ATOM 278 H CYS A 42 7.739 19.718 -31.830 1.00 0.00 H ATOM 279 N GLY A 43 11.579 19.542 -31.057 1.00 13.50 N ATOM 280 CA GLY A 43 12.247 19.355 -29.781 1.00 12.52 C ATOM 281 C GLY A 43 12.496 20.740 -29.200 1.00 15.46 C ATOM 282 O GLY A 43 12.272 21.766 -29.866 1.00 13.28 O ATOM 283 H GLY A 43 12.157 19.619 -31.918 1.00 0.00 H ATOM 284 N GLY A 44 12.967 20.774 -27.962 1.00 12.86 N ATOM 285 CA GLY A 44 13.309 22.021 -27.272 1.00 13.24 C ATOM 286 C GLY A 44 14.086 21.677 -26.016 1.00 14.48 C ATOM 287 O GLY A 44 14.139 20.503 -25.629 1.00 12.88 O ATOM 288 H GLY A 44 13.100 19.875 -27.457 1.00 0.00 H ATOM 289 N SER A 45 14.639 22.692 -25.343 1.00 10.58 N ATOM 290 CA SER A 45 15.431 22.518 -24.110 1.00 10.62 C ATOM 291 C SER A 45 14.981 23.477 -23.027 1.00 16.47 C ATOM 292 O SER A 45 14.872 24.695 -23.282 1.00 12.57 O ATOM 293 CB SER A 45 16.907 22.796 -24.377 1.00 12.80 C ATOM 294 OG SER A 45 17.433 21.900 -25.335 1.00 16.20 O ATOM 295 HG SER A 45 16.935 21.998 -26.185 1.00 0.00 H ATOM 296 H SER A 45 14.503 23.656 -25.708 1.00 0.00 H ATOM 297 N ILE A 46 14.815 22.961 -21.790 1.00 14.29 N ATOM 298 CA ILE A 46 14.512 23.832 -20.649 1.00 12.87 C ATOM 299 C ILE A 46 15.823 24.562 -20.310 1.00 15.56 C ATOM 300 O ILE A 46 16.842 23.911 -20.047 1.00 14.03 O ATOM 301 CB ILE A 46 14.010 23.015 -19.422 1.00 15.04 C ATOM 302 CG1 ILE A 46 12.694 22.244 -19.750 1.00 15.02 C ATOM 303 CG2 ILE A 46 13.826 23.944 -18.174 1.00 12.68 C ATOM 304 CD1 ILE A 46 12.325 21.139 -18.689 1.00 18.37 C ATOM 305 H ILE A 46 14.903 21.935 -21.645 1.00 0.00 H ATOM 306 N ILE A 47 15.802 25.897 -20.312 1.00 13.91 N ATOM 307 CA ILE A 47 17.001 26.676 -19.951 1.00 14.81 C ATOM 308 C ILE A 47 16.762 27.555 -18.717 1.00 19.53 C ATOM 309 O ILE A 47 17.700 28.151 -18.192 1.00 19.53 O ATOM 310 CB ILE A 47 17.618 27.489 -21.133 1.00 17.13 C ATOM 311 CG1 ILE A 47 16.618 28.549 -21.696 1.00 17.10 C ATOM 312 CG2 ILE A 47 18.176 26.550 -22.221 1.00 17.42 C ATOM 313 CD1 ILE A 47 17.280 29.686 -22.513 1.00 18.42 C ATOM 314 H ILE A 47 14.927 26.395 -20.572 1.00 0.00 H ATOM 315 N GLY A 48 15.523 27.625 -18.284 1.00 17.28 N ATOM 316 CA GLY A 48 15.129 28.429 -17.136 1.00 17.69 C ATOM 317 C GLY A 48 13.775 28.000 -16.644 1.00 21.77 C ATOM 318 O GLY A 48 13.085 27.237 -17.323 1.00 20.45 O ATOM 319 H GLY A 48 14.791 27.081 -18.784 1.00 0.00 H ATOM 320 N ASN A 49 13.371 28.523 -15.474 1.00 20.85 N ATOM 321 CA ASN A 49 12.122 28.129 -14.831 1.00 20.75 C ATOM 322 C ASN A 49 10.885 28.512 -15.636 1.00 22.14 C ATOM 323 O ASN A 49 9.833 27.964 -15.363 1.00 22.30 O ATOM 324 CB ASN A 49 12.051 28.613 -13.359 1.00 22.46 C ATOM 325 CG ASN A 49 11.681 30.045 -13.127 1.00 32.08 C ATOM 326 OD1 ASN A 49 11.876 30.925 -13.960 1.00 26.56 O ATOM 327 ND2 ASN A 49 11.170 30.307 -11.950 1.00 26.74 N ATOM 328 HD22 ASN A 49 11.017 29.538 -11.267 1.00 0.00 H ATOM 329 HD21 ASN A 49 10.917 31.284 -11.699 1.00 0.00 H ATOM 330 H ASN A 49 13.971 29.235 -15.010 1.00 0.00 H ATOM 331 N GLN A 50 11.004 29.390 -16.655 1.00 15.80 N ATOM 332 CA GLN A 50 9.848 29.752 -17.493 1.00 15.91 C ATOM 333 C GLN A 50 10.258 29.823 -18.974 1.00 16.51 C ATOM 334 O GLN A 50 9.599 30.481 -19.762 1.00 16.14 O ATOM 335 CB GLN A 50 9.297 31.116 -17.043 1.00 17.29 C ATOM 336 CG GLN A 50 7.819 31.281 -17.361 1.00 36.42 C ATOM 337 CD GLN A 50 7.131 32.354 -16.549 1.00 43.22 C ATOM 338 OE1 GLN A 50 7.778 33.260 -16.001 1.00 25.08 O ATOM 339 NE2 GLN A 50 5.790 32.252 -16.451 1.00 35.53 N ATOM 340 HE22 GLN A 50 5.291 31.474 -16.929 1.00 0.00 H ATOM 341 HE21 GLN A 50 5.254 32.951 -15.898 1.00 0.00 H ATOM 342 H GLN A 50 11.931 29.819 -16.852 1.00 0.00 H ATOM 343 N TRP A 51 11.380 29.221 -19.323 1.00 15.41 N ATOM 344 CA TRP A 51 11.956 29.392 -20.644 1.00 16.88 C ATOM 345 C TRP A 51 12.398 28.127 -21.351 1.00 16.99 C ATOM 346 O TRP A 51 13.150 27.343 -20.785 1.00 14.28 O ATOM 347 CB TRP A 51 13.160 30.341 -20.545 1.00 16.60 C ATOM 348 CG TRP A 51 12.791 31.730 -20.110 1.00 18.17 C ATOM 349 CD1 TRP A 51 12.896 32.251 -18.850 1.00 20.82 C ATOM 350 CD2 TRP A 51 12.173 32.741 -20.917 1.00 17.82 C ATOM 351 NE1 TRP A 51 12.422 33.545 -18.838 1.00 20.34 N ATOM 352 CE2 TRP A 51 11.954 33.865 -20.089 1.00 22.21 C ATOM 353 CE3 TRP A 51 11.781 32.807 -22.265 1.00 19.20 C ATOM 354 CZ2 TRP A 51 11.362 35.049 -20.569 1.00 21.20 C ATOM 355 CZ3 TRP A 51 11.240 33.993 -22.749 1.00 20.71 C ATOM 356 CH2 TRP A 51 11.030 35.093 -21.905 1.00 20.82 C ATOM 357 HE1 TRP A 51 12.419 34.178 -18.013 1.00 0.00 H ATOM 358 H TRP A 51 11.863 28.609 -18.634 1.00 0.00 H ATOM 359 N ILE A 52 11.971 27.988 -22.620 1.00 13.23 N ATOM 360 CA ILE A 52 12.373 26.887 -23.518 1.00 13.50 C ATOM 361 C ILE A 52 13.210 27.498 -24.642 1.00 16.64 C ATOM 362 O ILE A 52 12.791 28.499 -25.234 1.00 16.29 O ATOM 363 CB ILE A 52 11.159 26.104 -24.140 1.00 15.63 C ATOM 364 CG1 ILE A 52 10.181 25.530 -23.058 1.00 16.10 C ATOM 365 CG2 ILE A 52 11.624 24.988 -25.116 1.00 13.77 C ATOM 366 CD1 ILE A 52 10.855 24.577 -21.942 1.00 16.69 C ATOM 367 H ILE A 52 11.315 28.703 -22.993 1.00 0.00 H ATOM 368 N LEU A 53 14.368 26.892 -24.950 1.00 12.15 N ATOM 369 CA LEU A 53 15.179 27.312 -26.097 1.00 11.46 C ATOM 370 C LEU A 53 14.950 26.305 -27.220 1.00 16.40 C ATOM 371 O LEU A 53 15.077 25.085 -27.009 1.00 14.14 O ATOM 372 CB LEU A 53 16.675 27.435 -25.749 1.00 11.60 C ATOM 373 CG LEU A 53 17.520 28.163 -26.815 1.00 15.27 C ATOM 374 CD1 LEU A 53 17.098 29.633 -26.928 1.00 14.49 C ATOM 375 CD2 LEU A 53 19.029 28.083 -26.470 1.00 16.60 C ATOM 376 H LEU A 53 14.699 26.103 -24.359 1.00 0.00 H ATOM 377 N THR A 54 14.600 26.807 -28.428 1.00 12.62 N ATOM 378 CA THR A 54 14.274 25.948 -29.569 1.00 12.62 C ATOM 379 C THR A 54 14.676 26.612 -30.905 1.00 14.87 C ATOM 380 O THR A 54 15.395 27.602 -30.881 1.00 14.39 O ATOM 381 CB THR A 54 12.771 25.543 -29.466 1.00 18.13 C ATOM 382 OG1 THR A 54 12.455 24.548 -30.443 1.00 14.70 O ATOM 383 CG2 THR A 54 11.823 26.756 -29.588 1.00 15.88 C ATOM 384 HG1 THR A 54 13.017 23.747 -30.290 1.00 0.00 H ATOM 385 H THR A 54 14.561 27.839 -28.550 1.00 0.00 H ATOM 386 N ALA A 55 14.275 26.023 -32.066 1.00 12.34 N ATOM 387 CA ALA A 55 14.622 26.583 -33.378 1.00 11.88 C ATOM 388 C ALA A 55 13.510 27.542 -33.839 1.00 16.88 C ATOM 389 O ALA A 55 12.312 27.263 -33.654 1.00 17.88 O ATOM 390 CB ALA A 55 14.812 25.478 -34.410 1.00 12.12 C ATOM 391 H ALA A 55 13.707 25.153 -32.022 1.00 0.00 H ATOM 392 N ALA A 56 13.915 28.643 -34.451 1.00 12.67 N ATOM 393 CA ALA A 56 12.979 29.637 -35.025 1.00 14.15 C ATOM 394 C ALA A 56 12.139 29.008 -36.167 1.00 19.14 C ATOM 395 O ALA A 56 10.950 29.336 -36.322 1.00 16.84 O ATOM 396 CB ALA A 56 13.773 30.831 -35.558 1.00 15.45 C ATOM 397 H ALA A 56 14.937 28.818 -34.533 1.00 0.00 H ATOM 398 N HIS A 57 12.743 28.076 -36.942 1.00 17.72 N ATOM 399 CA HIS A 57 12.042 27.454 -38.082 1.00 17.01 C ATOM 400 C HIS A 57 10.836 26.610 -37.692 1.00 21.51 C ATOM 401 O HIS A 57 9.981 26.367 -38.545 1.00 21.99 O ATOM 402 CB HIS A 57 12.992 26.652 -39.002 1.00 17.35 C ATOM 403 CG HIS A 57 13.405 25.323 -38.467 1.00 20.15 C ATOM 404 ND1 HIS A 57 14.721 25.064 -38.142 1.00 21.20 N ATOM 405 CD2 HIS A 57 12.664 24.215 -38.226 1.00 20.52 C ATOM 406 CE1 HIS A 57 14.747 23.809 -37.735 1.00 19.72 C ATOM 407 NE2 HIS A 57 13.528 23.264 -37.754 1.00 20.00 N ATOM 408 H HIS A 57 13.721 27.793 -36.729 1.00 0.00 H ATOM 409 N CYS A 58 10.744 26.179 -36.414 1.00 17.29 N ATOM 410 CA CYS A 58 9.607 25.395 -35.912 1.00 18.26 C ATOM 411 C CYS A 58 8.286 26.142 -36.012 1.00 23.10 C ATOM 412 O CYS A 58 7.237 25.510 -36.044 1.00 20.83 O ATOM 413 CB CYS A 58 9.878 24.941 -34.480 1.00 18.04 C ATOM 414 SG CYS A 58 11.222 23.735 -34.370 1.00 21.69 S ATOM 415 H CYS A 58 11.514 26.413 -35.755 1.00 0.00 H ATOM 416 N PHE A 58A 8.346 27.475 -36.092 1.00 20.84 N ATOM 417 CA PHE A 58A 7.133 28.277 -36.066 1.00 21.87 C ATOM 418 C PHE A 58A 6.684 28.747 -37.457 1.00 30.49 C ATOM 419 O PHE A 58A 5.819 29.611 -37.564 1.00 32.14 O ATOM 420 CB PHE A 58A 7.328 29.427 -35.049 1.00 22.39 C ATOM 421 CG PHE A 58A 7.750 28.799 -33.737 1.00 22.85 C ATOM 422 CD1 PHE A 58A 6.856 28.032 -32.998 1.00 24.98 C ATOM 423 CD2 PHE A 58A 9.080 28.844 -33.319 1.00 24.11 C ATOM 424 CE1 PHE A 58A 7.271 27.355 -31.854 1.00 25.74 C ATOM 425 CE2 PHE A 58A 9.487 28.178 -32.157 1.00 26.12 C ATOM 426 CZ PHE A 58A 8.589 27.419 -31.451 1.00 24.32 C ATOM 427 H PHE A 58A 9.271 27.944 -36.174 1.00 0.00 H ATOM 428 N TYR A 58B 7.203 28.109 -38.509 1.00 29.68 N ATOM 429 CA TYR A 58B 6.872 28.454 -39.896 1.00 32.14 C ATOM 430 C TYR A 58B 5.348 28.388 -40.172 1.00 41.12 C ATOM 431 O TYR A 58B 4.801 29.295 -40.797 1.00 41.17 O ATOM 432 CB TYR A 58B 7.646 27.552 -40.857 1.00 33.37 C ATOM 433 CG TYR A 58B 7.451 27.874 -42.324 1.00 36.19 C ATOM 434 CD1 TYR A 58B 7.936 29.060 -42.866 1.00 38.06 C ATOM 435 CD2 TYR A 58B 6.860 26.955 -43.188 1.00 37.16 C ATOM 436 CE1 TYR A 58B 7.803 29.341 -44.223 1.00 39.94 C ATOM 437 CE2 TYR A 58B 6.717 27.229 -44.548 1.00 38.40 C ATOM 438 CZ TYR A 58B 7.186 28.425 -45.060 1.00 47.30 C ATOM 439 OH TYR A 58B 7.037 28.696 -46.400 1.00 53.02 O ATOM 440 HH TYR A 58B 7.423 29.585 -46.601 1.00 0.00 H ATOM 441 H TYR A 58B 7.873 27.332 -38.337 1.00 0.00 H ATOM 442 N GLY A 59 4.688 27.355 -39.658 1.00 40.87 N ATOM 443 CA GLY A 59 3.239 27.208 -39.777 1.00 43.50 C ATOM 444 C GLY A 59 2.491 27.561 -38.496 1.00 51.59 C ATOM 445 O GLY A 59 1.429 26.986 -38.220 1.00 52.90 O ATOM 446 H GLY A 59 5.224 26.622 -39.151 1.00 0.00 H ATOM 447 N VAL A 60 3.035 28.508 -37.693 1.00 47.96 N ATOM 448 CA VAL A 60 2.462 28.914 -36.401 1.00 47.01 C ATOM 449 C VAL A 60 2.245 30.436 -36.336 1.00 50.35 C ATOM 450 O VAL A 60 3.207 31.209 -36.352 1.00 49.71 O ATOM 451 CB VAL A 60 3.297 28.365 -35.201 1.00 50.84 C ATOM 452 CG1 VAL A 60 2.776 28.858 -33.847 1.00 50.34 C ATOM 453 CG2 VAL A 60 3.352 26.841 -35.228 1.00 50.84 C ATOM 454 H VAL A 60 3.909 28.975 -38.009 1.00 0.00 H ATOM 455 N GLU A 61 0.962 30.849 -36.232 1.00 46.45 N ATOM 456 CA GLU A 61 0.542 32.248 -36.156 1.00 45.62 C ATOM 457 C GLU A 61 0.397 32.771 -34.716 1.00 45.13 C ATOM 458 O GLU A 61 0.448 33.983 -34.502 1.00 45.57 O ATOM 459 CB GLU A 61 -0.774 32.440 -36.930 1.00 47.24 C ATOM 460 H GLU A 61 0.221 30.120 -36.204 1.00 0.00 H ATOM 461 N SER A 62 0.191 31.862 -33.743 1.00 36.99 N ATOM 462 CA SER A 62 -0.021 32.215 -32.343 1.00 34.30 C ATOM 463 C SER A 62 0.489 31.107 -31.405 1.00 34.64 C ATOM 464 O SER A 62 0.348 29.930 -31.751 1.00 33.94 O ATOM 465 CB SER A 62 -1.515 32.449 -32.109 1.00 35.64 C ATOM 466 OG SER A 62 -1.914 32.374 -30.752 1.00 43.29 O ATOM 467 HG SER A 62 -2.888 32.536 -30.686 1.00 0.00 H ATOM 468 H SER A 62 0.183 30.855 -34.004 1.00 0.00 H ATOM 469 N PRO A 63 0.947 31.449 -30.165 1.00 29.17 N ATOM 470 CA PRO A 63 1.342 30.388 -29.214 1.00 28.21 C ATOM 471 C PRO A 63 0.159 29.595 -28.618 1.00 31.63 C ATOM 472 O PRO A 63 0.393 28.614 -27.906 1.00 29.83 O ATOM 473 CB PRO A 63 2.107 31.163 -28.126 1.00 30.02 C ATOM 474 CG PRO A 63 1.474 32.512 -28.120 1.00 34.52 C ATOM 475 CD PRO A 63 1.158 32.795 -29.578 1.00 29.85 C ATOM 476 N LYS A 64 -1.114 30.004 -28.899 1.00 28.50 N ATOM 477 CA LYS A 64 -2.297 29.331 -28.331 1.00 28.01 C ATOM 478 C LYS A 64 -2.413 27.855 -28.732 1.00 28.60 C ATOM 479 O LYS A 64 -2.945 27.075 -27.965 1.00 28.58 O ATOM 480 CB LYS A 64 -3.628 30.090 -28.608 1.00 31.05 C ATOM 481 CG LYS A 64 -4.112 30.063 -30.056 1.00 46.60 C ATOM 482 H LYS A 64 -1.253 30.816 -29.534 1.00 0.00 H ATOM 483 N ILE A 65 -1.858 27.464 -29.872 1.00 24.79 N ATOM 484 CA ILE A 65 -1.918 26.054 -30.312 1.00 24.17 C ATOM 485 C ILE A 65 -0.744 25.192 -29.798 1.00 24.49 C ATOM 486 O ILE A 65 -0.631 24.030 -30.193 1.00 22.86 O ATOM 487 CB ILE A 65 -2.062 25.965 -31.852 1.00 28.28 C ATOM 488 CG1 ILE A 65 -0.939 26.773 -32.563 1.00 29.92 C ATOM 489 CG2 ILE A 65 -3.433 26.475 -32.270 1.00 30.48 C ATOM 490 CD1 ILE A 65 0.102 25.964 -33.199 1.00 38.95 C ATOM 491 H ILE A 65 -1.371 28.164 -30.468 1.00 0.00 H ATOM 492 N LEU A 65A 0.124 25.748 -28.945 1.00 19.26 N ATOM 493 CA LEU A 65A 1.288 24.987 -28.467 1.00 16.51 C ATOM 494 C LEU A 65A 1.103 24.391 -27.094 1.00 19.02 C ATOM 495 O LEU A 65A 0.488 25.014 -26.222 1.00 16.42 O ATOM 496 CB LEU A 65A 2.567 25.864 -28.472 1.00 16.32 C ATOM 497 CG LEU A 65A 3.016 26.529 -29.777 1.00 18.97 C ATOM 498 CD1 LEU A 65A 4.249 27.453 -29.509 1.00 18.93 C ATOM 499 CD2 LEU A 65A 3.327 25.495 -30.864 1.00 22.98 C ATOM 500 H LEU A 65A -0.025 26.724 -28.618 1.00 0.00 H ATOM 501 N ARG A 65B 1.695 23.191 -26.882 1.00 15.73 N ATOM 502 CA ARG A 65B 1.795 22.518 -25.576 1.00 14.75 C ATOM 503 C ARG A 65B 3.256 22.052 -25.432 1.00 16.42 C ATOM 504 O ARG A 65B 3.802 21.485 -26.367 1.00 17.75 O ATOM 505 CB ARG A 65B 0.879 21.290 -25.472 1.00 16.30 C ATOM 506 CG ARG A 65B -0.614 21.640 -25.426 1.00 20.80 C ATOM 507 CD ARG A 65B -1.438 20.379 -25.182 1.00 19.28 C ATOM 508 NE ARG A 65B -2.846 20.718 -24.923 1.00 17.77 N ATOM 509 CZ ARG A 65B -3.732 19.894 -24.385 1.00 23.83 C ATOM 510 NH1 ARG A 65B -3.389 18.652 -24.073 1.00 16.73 N ATOM 511 NH2 ARG A 65B -4.983 20.298 -24.176 1.00 18.13 N ATOM 512 HE ARG A 65B -3.168 21.673 -25.181 1.00 0.00 H ATOM 513 HH12 ARG A 65B -4.089 18.010 -23.651 1.00 0.00 H ATOM 514 HH11 ARG A 65B -2.420 18.320 -24.251 1.00 0.00 H ATOM 515 HH22 ARG A 65B -5.676 19.648 -23.753 1.00 0.00 H ATOM 516 HH21 ARG A 65B -5.268 21.264 -24.435 1.00 0.00 H ATOM 517 H ARG A 65B 2.110 22.708 -27.704 1.00 0.00 H ATOM 518 N VAL A 66 3.869 22.296 -24.282 1.00 11.83 N ATOM 519 CA VAL A 66 5.237 21.836 -23.974 1.00 11.43 C ATOM 520 C VAL A 66 5.148 20.709 -22.953 1.00 15.21 C ATOM 521 O VAL A 66 4.630 20.915 -21.856 1.00 13.54 O ATOM 522 CB VAL A 66 6.099 22.997 -23.422 1.00 15.57 C ATOM 523 CG1 VAL A 66 7.507 22.499 -22.995 1.00 15.14 C ATOM 524 CG2 VAL A 66 6.191 24.142 -24.431 1.00 15.68 C ATOM 525 H VAL A 66 3.358 22.841 -23.558 1.00 0.00 H ATOM 526 N TYR A 67 5.697 19.529 -23.297 1.00 14.06 N ATOM 527 CA TYR A 67 5.729 18.385 -22.408 1.00 12.58 C ATOM 528 C TYR A 67 7.172 18.085 -21.972 1.00 15.27 C ATOM 529 O TYR A 67 8.046 17.901 -22.821 1.00 13.07 O ATOM 530 CB TYR A 67 5.163 17.143 -23.103 1.00 12.79 C ATOM 531 CG TYR A 67 3.671 17.190 -23.334 1.00 14.29 C ATOM 532 CD1 TYR A 67 3.142 17.732 -24.505 1.00 15.03 C ATOM 533 CD2 TYR A 67 2.786 16.631 -22.407 1.00 14.60 C ATOM 534 CE1 TYR A 67 1.761 17.759 -24.727 1.00 15.04 C ATOM 535 CE2 TYR A 67 1.409 16.643 -22.617 1.00 14.04 C ATOM 536 CZ TYR A 67 0.899 17.203 -23.779 1.00 13.69 C ATOM 537 OH TYR A 67 -0.470 17.171 -23.977 1.00 14.63 O ATOM 538 HH TYR A 67 -0.920 17.657 -23.241 1.00 0.00 H ATOM 539 H TYR A 67 6.117 19.434 -24.244 1.00 0.00 H ATOM 540 N SER A 68 7.400 18.049 -20.662 1.00 13.46 N ATOM 541 CA SER A 68 8.689 17.669 -20.041 1.00 13.73 C ATOM 542 C SER A 68 8.529 16.241 -19.479 1.00 18.00 C ATOM 543 O SER A 68 7.399 15.738 -19.387 1.00 15.85 O ATOM 544 CB SER A 68 9.029 18.641 -18.923 1.00 15.87 C ATOM 545 OG SER A 68 8.003 18.574 -17.951 1.00 20.70 O ATOM 546 HG SER A 68 8.207 19.202 -17.213 1.00 0.00 H ATOM 547 H SER A 68 6.616 18.306 -20.028 1.00 0.00 H ATOM 548 N GLY A 69 9.652 15.593 -19.152 1.00 16.20 N ATOM 549 CA GLY A 69 9.689 14.248 -18.576 1.00 16.07 C ATOM 550 C GLY A 69 9.177 13.132 -19.452 1.00 21.03 C ATOM 551 O GLY A 69 8.863 12.050 -18.952 1.00 22.69 O ATOM 552 H GLY A 69 10.558 16.076 -19.318 1.00 0.00 H ATOM 553 N ILE A 70 9.102 13.353 -20.763 1.00 15.83 N ATOM 554 CA ILE A 70 8.573 12.320 -21.650 1.00 15.25 C ATOM 555 C ILE A 70 9.629 11.331 -22.110 1.00 19.86 C ATOM 556 O ILE A 70 10.672 11.756 -22.589 1.00 19.14 O ATOM 557 CB ILE A 70 7.833 12.966 -22.874 1.00 17.28 C ATOM 558 CG1 ILE A 70 6.667 13.895 -22.424 1.00 16.93 C ATOM 559 CG2 ILE A 70 7.374 11.900 -23.909 1.00 18.06 C ATOM 560 CD1 ILE A 70 5.556 13.265 -21.491 1.00 17.72 C ATOM 561 H ILE A 70 9.420 14.262 -21.156 1.00 0.00 H ATOM 562 N LEU A 71 9.322 10.018 -22.058 1.00 16.71 N ATOM 563 CA LEU A 71 10.209 9.022 -22.674 1.00 16.14 C ATOM 564 C LEU A 71 9.523 8.616 -23.993 1.00 18.41 C ATOM 565 O LEU A 71 10.097 8.781 -25.070 1.00 16.14 O ATOM 566 CB LEU A 71 10.495 7.777 -21.777 1.00 16.36 C ATOM 567 CG LEU A 71 11.306 6.646 -22.474 1.00 20.81 C ATOM 568 CD1 LEU A 71 12.745 7.092 -22.764 1.00 20.77 C ATOM 569 CD2 LEU A 71 11.257 5.327 -21.687 1.00 23.71 C ATOM 570 H LEU A 71 8.452 9.709 -21.579 1.00 0.00 H ATOM 571 N ASN A 72 8.259 8.138 -23.902 1.00 15.59 N ATOM 572 CA ASN A 72 7.475 7.690 -25.052 1.00 15.55 C ATOM 573 C ASN A 72 6.415 8.716 -25.463 1.00 19.03 C ATOM 574 O ASN A 72 5.663 9.166 -24.604 1.00 18.21 O ATOM 575 CB ASN A 72 6.766 6.378 -24.681 1.00 20.55 C ATOM 576 CG ASN A 72 7.579 5.117 -24.918 1.00 39.41 C ATOM 577 OD1 ASN A 72 8.715 5.187 -25.401 1.00 24.96 O ATOM 578 ND2 ASN A 72 6.974 3.943 -24.615 1.00 38.51 N ATOM 579 HD22 ASN A 72 6.016 3.941 -24.210 1.00 0.00 H ATOM 580 HD21 ASN A 72 7.468 3.044 -24.787 1.00 0.00 H ATOM 581 H ASN A 72 7.821 8.087 -22.960 1.00 0.00 H ATOM 582 N GLN A 73 6.290 9.013 -26.781 1.00 15.21 N ATOM 583 CA GLN A 73 5.230 9.913 -27.280 1.00 14.81 C ATOM 584 C GLN A 73 3.847 9.331 -26.919 1.00 19.96 C ATOM 585 O GLN A 73 2.942 10.077 -26.546 1.00 17.39 O ATOM 586 CB GLN A 73 5.336 10.108 -28.799 1.00 16.10 C ATOM 587 CG GLN A 73 6.541 10.975 -29.218 1.00 16.56 C ATOM 588 CD GLN A 73 6.348 12.430 -28.894 1.00 19.97 C ATOM 589 OE1 GLN A 73 5.226 12.942 -28.820 1.00 18.68 O ATOM 590 NE2 GLN A 73 7.445 13.152 -28.747 1.00 13.91 N ATOM 591 HE22 GLN A 73 8.379 12.699 -28.813 1.00 0.00 H ATOM 592 HE21 GLN A 73 7.375 14.174 -28.565 1.00 0.00 H ATOM 593 H GLN A 73 6.959 8.595 -27.459 1.00 0.00 H ATOM 594 N SER A 74 3.720 7.981 -26.966 1.00 16.47 N ATOM 595 CA SER A 74 2.485 7.238 -26.651 1.00 15.93 C ATOM 596 C SER A 74 2.069 7.381 -25.188 1.00 21.03 C ATOM 597 O SER A 74 0.904 7.115 -24.883 1.00 22.05 O ATOM 598 CB SER A 74 2.638 5.749 -26.988 1.00 17.23 C ATOM 599 OG SER A 74 3.617 5.162 -26.147 1.00 20.32 O ATOM 600 HG SER A 74 3.338 5.256 -25.202 1.00 0.00 H ATOM 601 H SER A 74 4.556 7.429 -27.245 1.00 0.00 H ATOM 602 N GLU A 75 2.988 7.775 -24.277 1.00 16.96 N ATOM 603 CA GLU A 75 2.601 7.948 -22.867 1.00 17.22 C ATOM 604 C GLU A 75 1.824 9.264 -22.617 1.00 21.27 C ATOM 605 O GLU A 75 1.317 9.466 -21.517 1.00 21.14 O ATOM 606 CB GLU A 75 3.802 7.801 -21.907 1.00 18.35 C ATOM 607 CG GLU A 75 4.592 9.087 -21.688 1.00 24.71 C ATOM 608 CD GLU A 75 6.008 8.884 -21.180 1.00 33.91 C ATOM 609 OE1 GLU A 75 6.451 9.699 -20.345 1.00 30.56 O ATOM 610 OE2 GLU A 75 6.650 7.881 -21.560 1.00 28.94 O ATOM 611 H GLU A 75 3.969 7.956 -24.573 1.00 0.00 H ATOM 612 N ILE A 76 1.756 10.149 -23.622 1.00 17.58 N ATOM 613 CA ILE A 76 1.057 11.437 -23.509 1.00 16.89 C ATOM 614 C ILE A 76 -0.438 11.181 -23.635 1.00 20.84 C ATOM 615 O ILE A 76 -0.931 10.822 -24.707 1.00 19.65 O ATOM 616 CB ILE A 76 1.581 12.485 -24.539 1.00 19.04 C ATOM 617 CG1 ILE A 76 3.057 12.877 -24.224 1.00 18.73 C ATOM 618 CG2 ILE A 76 0.667 13.721 -24.577 1.00 18.00 C ATOM 619 CD1 ILE A 76 3.798 13.665 -25.359 1.00 15.40 C ATOM 620 H ILE A 76 2.219 9.913 -24.523 1.00 0.00 H ATOM 621 N LYS A 77 -1.150 11.386 -22.542 1.00 18.09 N ATOM 622 CA LYS A 77 -2.599 11.179 -22.518 1.00 19.10 C ATOM 623 C LYS A 77 -3.280 12.460 -22.062 1.00 22.18 C ATOM 624 O LYS A 77 -2.597 13.432 -21.737 1.00 19.54 O ATOM 625 CB LYS A 77 -2.928 9.984 -21.601 1.00 23.02 C ATOM 626 CG LYS A 77 -2.643 8.652 -22.287 1.00 36.63 C ATOM 627 CD LYS A 77 -1.937 7.678 -21.393 1.00 49.01 C ATOM 628 CE LYS A 77 -1.457 6.492 -22.205 1.00 60.53 C ATOM 629 NZ LYS A 77 -0.636 5.551 -21.393 1.00 68.05 N ATOM 630 HZ1 LYS A 77 0.198 6.050 -21.024 1.00 0.00 H ATOM 631 HZ2 LYS A 77 -1.205 5.192 -20.600 1.00 0.00 H ATOM 632 HZ3 LYS A 77 -0.330 4.756 -21.990 1.00 0.00 H ATOM 633 H LYS A 77 -0.669 11.703 -21.676 1.00 0.00 H ATOM 634 N GLU A 78 -4.630 12.464 -22.023 1.00 20.31 N ATOM 635 CA GLU A 78 -5.405 13.627 -21.587 1.00 19.49 C ATOM 636 C GLU A 78 -4.945 14.210 -20.245 1.00 20.44 C ATOM 637 O GLU A 78 -4.828 15.427 -20.131 1.00 19.12 O ATOM 638 CB GLU A 78 -6.891 13.291 -21.544 1.00 20.92 C ATOM 639 CG GLU A 78 -7.733 14.499 -21.166 1.00 27.43 C ATOM 640 CD GLU A 78 -9.210 14.179 -21.076 1.00 32.65 C ATOM 641 OE1 GLU A 78 -9.597 13.475 -20.120 1.00 24.55 O ATOM 642 OE2 GLU A 78 -9.976 14.638 -21.948 1.00 40.95 O ATOM 643 H GLU A 78 -5.140 11.606 -22.315 1.00 0.00 H ATOM 644 N ASP A 79 -4.664 13.355 -19.248 1.00 18.00 N ATOM 645 CA ASP A 79 -4.271 13.800 -17.920 1.00 18.91 C ATOM 646 C ASP A 79 -2.756 13.997 -17.720 1.00 20.20 C ATOM 647 O ASP A 79 -2.335 14.242 -16.587 1.00 19.31 O ATOM 648 CB ASP A 79 -4.846 12.869 -16.838 1.00 21.90 C ATOM 649 CG ASP A 79 -4.249 11.472 -16.831 1.00 32.87 C ATOM 650 OD1 ASP A 79 -3.756 11.030 -17.897 1.00 34.14 O ATOM 651 OD2 ASP A 79 -4.300 10.811 -15.765 1.00 36.02 O ATOM 652 H ASP A 79 -4.730 12.334 -19.433 1.00 0.00 H ATOM 653 N THR A 80 -1.940 13.885 -18.790 1.00 16.06 N ATOM 654 CA THR A 80 -0.492 14.131 -18.680 1.00 15.83 C ATOM 655 C THR A 80 -0.343 15.661 -18.538 1.00 18.70 C ATOM 656 O THR A 80 -0.955 16.422 -19.294 1.00 17.27 O ATOM 657 CB THR A 80 0.258 13.626 -19.929 1.00 20.75 C ATOM 658 OG1 THR A 80 0.009 12.222 -20.068 1.00 20.93 O ATOM 659 CG2 THR A 80 1.783 13.911 -19.868 1.00 15.67 C ATOM 660 HG1 THR A 80 0.484 11.881 -20.867 1.00 0.00 H ATOM 661 H THR A 80 -2.343 13.619 -19.711 1.00 0.00 H ATOM 662 N SER A 81 0.433 16.104 -17.558 1.00 14.67 N ATOM 663 CA SER A 81 0.576 17.558 -17.377 1.00 15.80 C ATOM 664 C SER A 81 1.494 18.165 -18.444 1.00 19.84 C ATOM 665 O SER A 81 2.353 17.472 -19.015 1.00 19.78 O ATOM 666 CB SER A 81 0.998 17.905 -15.947 1.00 21.62 C ATOM 667 OG SER A 81 2.343 17.508 -15.757 1.00 41.13 O ATOM 668 HG SER A 81 2.421 16.532 -15.902 1.00 0.00 H ATOM 669 H SER A 81 0.930 15.439 -16.931 1.00 0.00 H ATOM 670 N PHE A 82 1.276 19.464 -18.745 1.00 14.56 N ATOM 671 CA PHE A 82 2.056 20.122 -19.770 1.00 14.05 C ATOM 672 C PHE A 82 2.067 21.593 -19.438 1.00 18.43 C ATOM 673 O PHE A 82 1.361 22.025 -18.525 1.00 17.38 O ATOM 674 CB PHE A 82 1.443 19.862 -21.194 1.00 15.07 C ATOM 675 CG PHE A 82 0.009 20.323 -21.319 1.00 16.05 C ATOM 676 CD1 PHE A 82 -1.041 19.508 -20.899 1.00 19.14 C ATOM 677 CD2 PHE A 82 -0.289 21.606 -21.778 1.00 15.98 C ATOM 678 CE1 PHE A 82 -2.364 19.963 -20.945 1.00 19.90 C ATOM 679 CE2 PHE A 82 -1.613 22.025 -21.906 1.00 18.94 C ATOM 680 CZ PHE A 82 -2.640 21.227 -21.437 1.00 18.11 C ATOM 681 H PHE A 82 0.541 19.995 -18.235 1.00 0.00 H ATOM 682 N PHE A 83 2.842 22.357 -20.193 1.00 14.92 N ATOM 683 CA PHE A 83 2.923 23.811 -19.990 1.00 14.43 C ATOM 684 C PHE A 83 2.358 24.523 -21.210 1.00 17.36 C ATOM 685 O PHE A 83 2.584 24.102 -22.342 1.00 17.25 O ATOM 686 CB PHE A 83 4.395 24.247 -19.742 1.00 15.70 C ATOM 687 CG PHE A 83 5.033 23.640 -18.513 1.00 17.14 C ATOM 688 CD1 PHE A 83 4.879 24.236 -17.261 1.00 18.99 C ATOM 689 CD2 PHE A 83 5.804 22.483 -18.607 1.00 18.17 C ATOM 690 CE1 PHE A 83 5.463 23.668 -16.120 1.00 19.53 C ATOM 691 CE2 PHE A 83 6.368 21.900 -17.462 1.00 21.44 C ATOM 692 CZ PHE A 83 6.186 22.494 -16.223 1.00 19.62 C ATOM 693 H PHE A 83 3.407 21.918 -20.948 1.00 0.00 H ATOM 694 N GLY A 84 1.661 25.626 -20.965 1.00 16.17 N ATOM 695 CA GLY A 84 1.157 26.496 -22.016 1.00 16.08 C ATOM 696 C GLY A 84 2.258 27.470 -22.389 1.00 20.40 C ATOM 697 O GLY A 84 3.210 27.636 -21.622 1.00 20.53 O ATOM 698 H GLY A 84 1.466 25.880 -19.975 1.00 0.00 H ATOM 699 N VAL A 85 2.136 28.125 -23.557 1.00 16.42 N ATOM 700 CA VAL A 85 3.129 29.088 -24.037 1.00 16.24 C ATOM 701 C VAL A 85 2.444 30.453 -24.166 1.00 20.91 C ATOM 702 O VAL A 85 1.430 30.597 -24.875 1.00 19.11 O ATOM 703 CB VAL A 85 3.783 28.656 -25.375 1.00 20.12 C ATOM 704 CG1 VAL A 85 4.771 29.709 -25.870 1.00 19.69 C ATOM 705 CG2 VAL A 85 4.483 27.309 -25.230 1.00 20.31 C ATOM 706 H VAL A 85 1.299 27.939 -24.146 1.00 0.00 H ATOM 707 N GLN A 86 3.013 31.421 -23.465 1.00 19.44 N ATOM 708 CA GLN A 86 2.596 32.830 -23.378 1.00 21.56 C ATOM 709 C GLN A 86 3.091 33.625 -24.587 1.00 24.62 C ATOM 710 O GLN A 86 2.434 34.578 -25.044 1.00 22.09 O ATOM 711 CB GLN A 86 3.353 33.456 -22.189 1.00 23.97 C ATOM 712 CG GLN A 86 2.649 33.569 -20.907 1.00 37.39 C ATOM 713 CD GLN A 86 3.393 34.553 -20.050 1.00 32.61 C ATOM 714 OE1 GLN A 86 3.296 35.756 -20.243 1.00 25.01 O ATOM 715 NE2 GLN A 86 4.146 34.066 -19.090 1.00 23.38 N ATOM 716 HE22 GLN A 86 4.209 33.037 -18.950 1.00 0.00 H ATOM 717 HE21 GLN A 86 4.679 34.709 -18.470 1.00 0.00 H ATOM 718 H GLN A 86 3.852 31.155 -22.911 1.00 0.00 H ATOM 719 N GLU A 87 4.335 33.337 -25.001 1.00 20.94 N ATOM 720 CA GLU A 87 5.028 34.139 -25.996 1.00 20.28 C ATOM 721 C GLU A 87 6.073 33.351 -26.747 1.00 22.98 C ATOM 722 O GLU A 87 6.817 32.558 -26.150 1.00 20.86 O ATOM 723 CB GLU A 87 5.723 35.324 -25.264 1.00 21.31 C ATOM 724 CG GLU A 87 6.223 36.431 -26.186 1.00 33.70 C ATOM 725 CD GLU A 87 6.973 37.590 -25.546 1.00 46.27 C ATOM 726 OE1 GLU A 87 7.065 37.652 -24.296 1.00 30.89 O ATOM 727 OE2 GLU A 87 7.504 38.426 -26.311 1.00 31.10 O ATOM 728 H GLU A 87 4.820 32.511 -24.596 1.00 0.00 H ATOM 729 N ILE A 88 6.166 33.624 -28.052 1.00 19.91 N ATOM 730 CA ILE A 88 7.193 33.062 -28.944 1.00 19.78 C ATOM 731 C ILE A 88 8.125 34.237 -29.293 1.00 22.58 C ATOM 732 O ILE A 88 7.656 35.271 -29.780 1.00 22.01 O ATOM 733 CB ILE A 88 6.607 32.425 -30.238 1.00 23.27 C ATOM 734 CG1 ILE A 88 5.557 31.325 -29.940 1.00 22.77 C ATOM 735 CG2 ILE A 88 7.738 31.876 -31.160 1.00 24.62 C ATOM 736 CD1 ILE A 88 4.597 31.025 -31.174 1.00 24.33 C ATOM 737 H ILE A 88 5.468 34.276 -28.464 1.00 0.00 H ATOM 738 N ILE A 89 9.424 34.091 -29.015 1.00 18.31 N ATOM 739 CA ILE A 89 10.409 35.117 -29.338 1.00 17.82 C ATOM 740 C ILE A 89 11.363 34.569 -30.384 1.00 20.72 C ATOM 741 O ILE A 89 12.207 33.734 -30.067 1.00 19.12 O ATOM 742 CB ILE A 89 11.147 35.668 -28.085 1.00 20.95 C ATOM 743 CG1 ILE A 89 10.130 36.152 -26.994 1.00 22.24 C ATOM 744 CG2 ILE A 89 12.171 36.778 -28.483 1.00 20.09 C ATOM 745 CD1 ILE A 89 10.795 36.444 -25.585 1.00 25.49 C ATOM 746 H ILE A 89 9.743 33.216 -28.553 1.00 0.00 H ATOM 747 N ILE A 90 11.216 35.037 -31.624 1.00 18.19 N ATOM 748 CA ILE A 90 12.051 34.611 -32.752 1.00 18.66 C ATOM 749 C ILE A 90 13.149 35.657 -32.951 1.00 21.80 C ATOM 750 O ILE A 90 12.869 36.852 -32.859 1.00 21.60 O ATOM 751 CB ILE A 90 11.159 34.359 -34.020 1.00 21.79 C ATOM 752 CG1 ILE A 90 10.271 33.096 -33.808 1.00 23.16 C ATOM 753 CG2 ILE A 90 12.007 34.183 -35.296 1.00 21.34 C ATOM 754 CD1 ILE A 90 9.185 32.851 -34.835 1.00 34.16 C ATOM 755 H ILE A 90 10.471 35.741 -31.800 1.00 0.00 H ATOM 756 N HIS A 91 14.396 35.225 -33.195 1.00 17.77 N ATOM 757 CA HIS A 91 15.489 36.167 -33.442 1.00 17.49 C ATOM 758 C HIS A 91 15.082 37.099 -34.614 1.00 20.73 C ATOM 759 O HIS A 91 14.650 36.600 -35.647 1.00 20.55 O ATOM 760 CB HIS A 91 16.788 35.420 -33.775 1.00 17.39 C ATOM 761 CG HIS A 91 17.989 36.297 -33.626 1.00 19.69 C ATOM 762 ND1 HIS A 91 18.274 37.293 -34.548 1.00 20.49 N ATOM 763 CD2 HIS A 91 18.919 36.327 -32.640 1.00 19.98 C ATOM 764 CE1 HIS A 91 19.368 37.882 -34.099 1.00 19.56 C ATOM 765 NE2 HIS A 91 19.795 37.327 -32.958 1.00 19.52 N ATOM 766 H HIS A 91 14.589 34.203 -33.209 1.00 0.00 H ATOM 767 N ASP A 92 15.176 38.439 -34.445 1.00 20.33 N ATOM 768 CA ASP A 92 14.700 39.362 -35.496 1.00 21.92 C ATOM 769 C ASP A 92 15.487 39.281 -36.833 1.00 23.43 C ATOM 770 O ASP A 92 14.998 39.772 -37.846 1.00 23.01 O ATOM 771 CB ASP A 92 14.595 40.825 -34.988 1.00 25.58 C ATOM 772 CG ASP A 92 15.873 41.549 -34.587 1.00 40.28 C ATOM 773 OD1 ASP A 92 16.962 41.131 -35.029 1.00 38.03 O ATOM 774 OD2 ASP A 92 15.771 42.603 -33.914 1.00 53.21 O ATOM 775 H ASP A 92 15.586 38.821 -33.569 1.00 0.00 H ATOM 776 N GLN A 93 16.662 38.629 -36.853 1.00 19.85 N ATOM 777 CA GLN A 93 17.417 38.461 -38.111 1.00 19.25 C ATOM 778 C GLN A 93 17.080 37.126 -38.811 1.00 22.55 C ATOM 779 O GLN A 93 17.572 36.874 -39.909 1.00 20.68 O ATOM 780 CB GLN A 93 18.936 38.597 -37.882 1.00 20.22 C ATOM 781 CG GLN A 93 19.396 39.973 -37.368 1.00 29.24 C ATOM 782 CD GLN A 93 18.913 41.127 -38.200 1.00 49.22 C ATOM 783 OE1 GLN A 93 19.360 41.348 -39.330 1.00 50.70 O ATOM 784 NE2 GLN A 93 17.991 41.895 -37.648 1.00 34.22 N ATOM 785 HE22 GLN A 93 17.637 41.679 -36.694 1.00 0.00 H ATOM 786 HE21 GLN A 93 17.619 42.716 -38.167 1.00 0.00 H ATOM 787 H GLN A 93 17.045 38.237 -35.969 1.00 0.00 H ATOM 788 N TYR A 94 16.241 36.271 -38.180 1.00 18.43 N ATOM 789 CA TYR A 94 15.893 34.980 -38.767 1.00 16.31 C ATOM 790 C TYR A 94 15.076 35.094 -40.063 1.00 23.23 C ATOM 791 O TYR A 94 14.067 35.804 -40.098 1.00 23.60 O ATOM 792 CB TYR A 94 15.137 34.080 -37.758 1.00 15.70 C ATOM 793 CG TYR A 94 14.700 32.777 -38.380 1.00 14.78 C ATOM 794 CD1 TYR A 94 15.629 31.786 -38.689 1.00 15.93 C ATOM 795 CD2 TYR A 94 13.376 32.578 -38.771 1.00 15.71 C ATOM 796 CE1 TYR A 94 15.245 30.606 -39.308 1.00 16.91 C ATOM 797 CE2 TYR A 94 12.987 31.418 -39.441 1.00 15.10 C ATOM 798 CZ TYR A 94 13.928 30.439 -39.712 1.00 17.89 C ATOM 799 OH TYR A 94 13.570 29.297 -40.375 1.00 16.37 O ATOM 800 HH TYR A 94 13.212 29.533 -41.267 1.00 0.00 H ATOM 801 H TYR A 94 15.837 36.539 -37.260 1.00 0.00 H ATOM 802 N LYS A 95 15.477 34.326 -41.093 1.00 20.13 N ATOM 803 CA LYS A 95 14.740 34.221 -42.365 1.00 20.44 C ATOM 804 C LYS A 95 14.480 32.760 -42.693 1.00 24.27 C ATOM 805 O LYS A 95 13.340 32.373 -42.969 1.00 24.29 O ATOM 806 CB LYS A 95 15.488 34.921 -43.503 1.00 22.81 C ATOM 807 CG LYS A 95 15.553 36.447 -43.324 1.00 32.00 C ATOM 808 H LYS A 95 16.354 33.777 -40.986 1.00 0.00 H ATOM 809 N MET A 96 15.554 31.928 -42.650 1.00 21.76 N ATOM 810 CA MET A 96 15.465 30.502 -42.969 1.00 20.61 C ATOM 811 C MET A 96 16.621 29.774 -42.291 1.00 22.78 C ATOM 812 O MET A 96 17.669 30.380 -42.069 1.00 20.76 O ATOM 813 CB MET A 96 15.475 30.314 -44.497 1.00 23.21 C ATOM 814 CG MET A 96 14.853 29.019 -44.967 1.00 27.01 C ATOM 815 SD MET A 96 16.144 27.835 -45.409 1.00 31.37 S ATOM 816 CE MET A 96 16.816 28.619 -46.833 1.00 28.84 C ATOM 817 H MET A 96 16.478 32.321 -42.379 1.00 0.00 H ATOM 818 N ALA A 97 16.414 28.505 -41.897 1.00 17.64 N ATOM 819 CA ALA A 97 17.461 27.730 -41.183 1.00 16.85 C ATOM 820 C ALA A 97 18.839 27.774 -41.865 1.00 19.08 C ATOM 821 O ALA A 97 19.830 28.033 -41.192 1.00 18.10 O ATOM 822 CB ALA A 97 17.004 26.287 -40.976 1.00 17.01 C ATOM 823 H ALA A 97 15.498 28.055 -42.097 1.00 0.00 H ATOM 824 N GLU A 98 18.890 27.572 -43.200 1.00 18.28 N ATOM 825 CA GLU A 98 20.144 27.568 -43.988 1.00 19.69 C ATOM 826 C GLU A 98 20.916 28.896 -43.943 1.00 22.07 C ATOM 827 O GLU A 98 22.069 28.907 -44.357 1.00 22.87 O ATOM 828 CB GLU A 98 19.891 27.189 -45.473 1.00 21.43 C ATOM 829 CG GLU A 98 19.478 25.743 -45.736 1.00 29.64 C ATOM 830 CD GLU A 98 18.854 25.566 -47.116 1.00 52.57 C ATOM 831 OE1 GLU A 98 19.596 25.570 -48.125 1.00 32.06 O ATOM 832 OE2 GLU A 98 17.611 25.460 -47.191 1.00 46.46 O ATOM 833 H GLU A 98 17.995 27.410 -43.704 1.00 0.00 H ATOM 834 N SER A 99 20.291 30.000 -43.469 1.00 17.35 N ATOM 835 CA SER A 99 20.959 31.294 -43.374 1.00 17.55 C ATOM 836 C SER A 99 21.264 31.698 -41.925 1.00 21.74 C ATOM 837 O SER A 99 21.675 32.827 -41.702 1.00 21.98 O ATOM 838 CB SER A 99 20.161 32.383 -44.088 1.00 20.25 C ATOM 839 OG SER A 99 19.900 32.053 -45.434 1.00 31.64 O ATOM 840 HG SER A 99 20.757 31.932 -45.915 1.00 0.00 H ATOM 841 H SER A 99 19.300 29.923 -43.162 1.00 0.00 H ATOM 842 N GLY A 100 21.040 30.792 -40.960 1.00 16.83 N ATOM 843 CA GLY A 100 21.353 31.066 -39.553 1.00 14.75 C ATOM 844 C GLY A 100 20.287 31.802 -38.778 1.00 17.94 C ATOM 845 O GLY A 100 19.140 31.936 -39.240 1.00 16.57 O ATOM 846 H GLY A 100 20.633 29.870 -41.217 1.00 0.00 H ATOM 847 N TYR A 101 20.657 32.249 -37.549 1.00 14.89 N ATOM 848 CA TYR A 101 19.744 32.926 -36.609 1.00 15.99 C ATOM 849 C TYR A 101 18.559 32.029 -36.276 1.00 15.67 C ATOM 850 O TYR A 101 17.476 32.514 -35.949 1.00 15.64 O ATOM 851 CB TYR A 101 19.298 34.308 -37.138 1.00 18.42 C ATOM 852 CG TYR A 101 20.464 35.240 -37.355 1.00 23.55 C ATOM 853 CD1 TYR A 101 21.073 35.886 -36.283 1.00 25.97 C ATOM 854 CD2 TYR A 101 20.999 35.434 -38.627 1.00 25.92 C ATOM 855 CE1 TYR A 101 22.159 36.737 -36.473 1.00 27.86 C ATOM 856 CE2 TYR A 101 22.096 36.272 -38.828 1.00 28.06 C ATOM 857 CZ TYR A 101 22.673 36.922 -37.747 1.00 38.81 C ATOM 858 OH TYR A 101 23.749 37.756 -37.938 1.00 44.29 O ATOM 859 HH TYR A 101 24.032 38.133 -37.067 1.00 0.00 H ATOM 860 H TYR A 101 21.644 32.105 -37.253 1.00 0.00 H ATOM 861 N ASP A 102 18.757 30.702 -36.430 1.00 11.48 N ATOM 862 CA ASP A 102 17.713 29.721 -36.179 1.00 13.34 C ATOM 863 C ASP A 102 17.604 29.458 -34.668 1.00 16.46 C ATOM 864 O ASP A 102 18.030 28.422 -34.161 1.00 16.19 O ATOM 865 CB ASP A 102 17.966 28.430 -36.961 1.00 14.59 C ATOM 866 CG ASP A 102 16.728 27.581 -37.109 1.00 14.96 C ATOM 867 OD1 ASP A 102 15.645 28.028 -36.678 1.00 15.61 O ATOM 868 OD2 ASP A 102 16.861 26.439 -37.545 1.00 14.37 O ATOM 869 H ASP A 102 19.692 30.369 -36.740 1.00 0.00 H ATOM 870 N ILE A 103 17.000 30.413 -33.970 1.00 13.23 N ATOM 871 CA ILE A 103 16.857 30.353 -32.518 1.00 14.29 C ATOM 872 C ILE A 103 15.584 31.065 -32.114 1.00 17.76 C ATOM 873 O ILE A 103 15.252 32.120 -32.684 1.00 16.94 O ATOM 874 CB ILE A 103 18.137 30.952 -31.849 1.00 17.18 C ATOM 875 CG1 ILE A 103 18.179 30.689 -30.340 1.00 16.36 C ATOM 876 CG2 ILE A 103 18.340 32.479 -32.168 1.00 18.39 C ATOM 877 CD1 ILE A 103 19.599 31.039 -29.659 1.00 17.23 C ATOM 878 H ILE A 103 16.614 31.235 -34.477 1.00 0.00 H ATOM 879 N ALA A 104 14.870 30.480 -31.135 1.00 14.24 N ATOM 880 CA ALA A 104 13.627 31.021 -30.596 1.00 14.27 C ATOM 881 C ALA A 104 13.500 30.682 -29.123 1.00 18.09 C ATOM 882 O ALA A 104 14.021 29.662 -28.666 1.00 17.19 O ATOM 883 CB ALA A 104 12.416 30.468 -31.363 1.00 13.79 C ATOM 884 H ALA A 104 15.226 29.587 -30.738 1.00 0.00 H ATOM 885 N LEU A 105 12.831 31.557 -28.382 1.00 14.42 N ATOM 886 CA LEU A 105 12.543 31.337 -26.971 1.00 13.93 C ATOM 887 C LEU A 105 11.046 31.179 -26.819 1.00 18.42 C ATOM 888 O LEU A 105 10.277 31.914 -27.467 1.00 17.38 O ATOM 889 CB LEU A 105 12.994 32.532 -26.122 1.00 13.58 C ATOM 890 CG LEU A 105 14.501 32.636 -25.861 1.00 16.74 C ATOM 891 CD1 LEU A 105 14.867 34.083 -25.499 1.00 15.60 C ATOM 892 CD2 LEU A 105 14.934 31.685 -24.721 1.00 17.56 C ATOM 893 H LEU A 105 12.499 32.436 -28.827 1.00 0.00 H ATOM 894 N LEU A 106 10.631 30.236 -25.966 1.00 14.54 N ATOM 895 CA LEU A 106 9.229 30.095 -25.611 1.00 14.91 C ATOM 896 C LEU A 106 9.123 30.496 -24.141 1.00 18.48 C ATOM 897 O LEU A 106 9.808 29.923 -23.292 1.00 16.89 O ATOM 898 CB LEU A 106 8.687 28.656 -25.806 1.00 14.77 C ATOM 899 CG LEU A 106 8.837 28.026 -27.197 1.00 18.17 C ATOM 900 CD1 LEU A 106 8.307 26.594 -27.204 1.00 16.69 C ATOM 901 CD2 LEU A 106 8.144 28.870 -28.282 1.00 20.29 C ATOM 902 H LEU A 106 11.328 29.588 -25.547 1.00 0.00 H ATOM 903 N LYS A 107 8.303 31.509 -23.848 1.00 16.24 N ATOM 904 CA LYS A 107 8.040 31.912 -22.475 1.00 14.82 C ATOM 905 C LYS A 107 6.800 31.119 -22.049 1.00 17.18 C ATOM 906 O LYS A 107 5.734 31.250 -22.649 1.00 16.67 O ATOM 907 CB LYS A 107 7.772 33.424 -22.364 1.00 17.05 C ATOM 908 CG LYS A 107 7.701 33.885 -20.911 1.00 22.02 C ATOM 909 CD LYS A 107 7.430 35.402 -20.808 1.00 25.96 C ATOM 910 CE LYS A 107 7.534 35.865 -19.371 1.00 28.62 C ATOM 911 NZ LYS A 107 7.104 37.275 -19.234 1.00 35.78 N ATOM 912 HZ1 LYS A 107 7.710 37.880 -19.824 1.00 0.00 H ATOM 913 HZ2 LYS A 107 6.115 37.366 -19.543 1.00 0.00 H ATOM 914 HZ3 LYS A 107 7.186 37.566 -18.239 1.00 0.00 H ATOM 915 H LYS A 107 7.839 32.024 -24.623 1.00 0.00 H ATOM 916 N LEU A 108 6.960 30.285 -21.036 1.00 15.54 N ATOM 917 CA LEU A 108 5.876 29.451 -20.539 1.00 16.10 C ATOM 918 C LEU A 108 4.836 30.277 -19.782 1.00 22.16 C ATOM 919 O LEU A 108 5.165 31.320 -19.196 1.00 21.04 O ATOM 920 CB LEU A 108 6.411 28.294 -19.668 1.00 16.03 C ATOM 921 CG LEU A 108 7.496 27.396 -20.312 1.00 19.08 C ATOM 922 CD1 LEU A 108 8.006 26.368 -19.336 1.00 18.73 C ATOM 923 CD2 LEU A 108 6.955 26.713 -21.573 1.00 17.68 C ATOM 924 H LEU A 108 7.892 30.223 -20.579 1.00 0.00 H ATOM 925 N GLU A 109 3.576 29.791 -19.806 1.00 20.41 N ATOM 926 CA GLU A 109 2.438 30.435 -19.119 1.00 20.49 C ATOM 927 C GLU A 109 2.604 30.344 -17.599 1.00 24.46 C ATOM 928 O GLU A 109 2.087 31.191 -16.878 1.00 25.43 O ATOM 929 CB GLU A 109 1.107 29.794 -19.545 1.00 21.08 C ATOM 930 CG GLU A 109 0.575 30.214 -20.919 1.00 27.69 C ATOM 931 CD GLU A 109 -0.752 29.550 -21.263 1.00 34.42 C ATOM 932 OE1 GLU A 109 -1.388 28.997 -20.341 1.00 23.53 O ATOM 933 OE2 GLU A 109 -1.136 29.529 -22.453 1.00 31.93 O ATOM 934 H GLU A 109 3.397 28.915 -20.337 1.00 0.00 H ATOM 935 N THR A 110 3.302 29.298 -17.107 1.00 19.03 N ATOM 936 CA THR A 110 3.606 29.102 -15.678 1.00 17.64 C ATOM 937 C THR A 110 5.076 28.657 -15.520 1.00 22.78 C ATOM 938 O THR A 110 5.703 28.248 -16.494 1.00 22.07 O ATOM 939 CB THR A 110 2.666 28.063 -15.014 1.00 22.92 C ATOM 940 OG1 THR A 110 2.807 26.803 -15.677 1.00 22.44 O ATOM 941 CG2 THR A 110 1.188 28.494 -15.008 1.00 18.16 C ATOM 942 HG1 THR A 110 2.207 26.139 -15.253 1.00 0.00 H ATOM 943 H THR A 110 3.648 28.584 -17.780 1.00 0.00 H ATOM 944 N THR A 111 5.599 28.674 -14.278 1.00 19.45 N ATOM 945 CA THR A 111 6.963 28.259 -14.003 1.00 19.90 C ATOM 946 C THR A 111 7.080 26.741 -13.775 1.00 23.79 C ATOM 947 O THR A 111 6.150 26.089 -13.304 1.00 22.42 O ATOM 948 CB THR A 111 7.571 29.090 -12.853 1.00 26.33 C ATOM 949 OG1 THR A 111 6.778 28.886 -11.685 1.00 24.98 O ATOM 950 CG2 THR A 111 7.629 30.577 -13.180 1.00 23.63 C ATOM 951 HG1 THR A 111 7.154 29.413 -10.936 1.00 0.00 H ATOM 952 H THR A 111 5.004 28.996 -13.488 1.00 0.00 H ATOM 953 N VAL A 112 8.226 26.189 -14.128 1.00 19.79 N ATOM 954 CA VAL A 112 8.569 24.776 -13.994 1.00 19.63 C ATOM 955 C VAL A 112 9.084 24.542 -12.564 1.00 24.27 C ATOM 956 O VAL A 112 9.893 25.318 -12.073 1.00 23.83 O ATOM 957 CB VAL A 112 9.689 24.394 -15.032 1.00 23.34 C ATOM 958 CG1 VAL A 112 10.145 22.942 -14.862 1.00 22.77 C ATOM 959 CG2 VAL A 112 9.238 24.655 -16.470 1.00 23.00 C ATOM 960 H VAL A 112 8.948 26.816 -14.538 1.00 0.00 H ATOM 961 N ASN A 113 8.677 23.435 -11.939 1.00 22.09 N ATOM 962 CA ASN A 113 9.182 23.016 -10.620 1.00 21.47 C ATOM 963 C ASN A 113 10.211 21.975 -10.951 1.00 23.52 C ATOM 964 O ASN A 113 9.875 20.941 -11.546 1.00 22.09 O ATOM 965 CB ASN A 113 8.066 22.401 -9.767 1.00 26.95 C ATOM 966 CG ASN A 113 6.929 23.343 -9.430 1.00 53.65 C ATOM 967 OD1 ASN A 113 7.120 24.471 -8.965 1.00 50.50 O ATOM 968 ND2 ASN A 113 5.712 22.858 -9.579 1.00 48.79 N ATOM 969 HD22 ASN A 113 5.577 21.905 -9.973 1.00 0.00 H ATOM 970 HD21 ASN A 113 4.887 23.428 -9.303 1.00 0.00 H ATOM 971 H ASN A 113 7.967 22.837 -12.408 1.00 0.00 H ATOM 972 N TYR A 114 11.480 22.273 -10.663 1.00 20.40 N ATOM 973 CA TYR A 114 12.548 21.354 -11.013 1.00 20.32 C ATOM 974 C TYR A 114 12.444 20.071 -10.209 1.00 26.04 C ATOM 975 O TYR A 114 12.227 20.109 -8.996 1.00 25.85 O ATOM 976 CB TYR A 114 13.938 21.985 -10.853 1.00 20.83 C ATOM 977 CG TYR A 114 14.218 23.233 -11.678 1.00 22.28 C ATOM 978 CD1 TYR A 114 13.411 23.577 -12.769 1.00 23.32 C ATOM 979 CD2 TYR A 114 15.304 24.053 -11.387 1.00 22.57 C ATOM 980 CE1 TYR A 114 13.653 24.736 -13.510 1.00 23.25 C ATOM 981 CE2 TYR A 114 15.558 25.210 -12.125 1.00 23.15 C ATOM 982 CZ TYR A 114 14.736 25.542 -13.189 1.00 28.85 C ATOM 983 OH TYR A 114 14.996 26.679 -13.910 1.00 32.04 O ATOM 984 HH TYR A 114 15.900 26.616 -14.308 1.00 0.00 H ATOM 985 H TYR A 114 11.705 23.169 -10.185 1.00 0.00 H ATOM 986 N THR A 115 12.576 18.943 -10.897 1.00 21.74 N ATOM 987 CA THR A 115 12.539 17.596 -10.308 1.00 22.05 C ATOM 988 C THR A 115 13.534 16.753 -11.069 1.00 26.94 C ATOM 989 O THR A 115 14.200 17.256 -11.988 1.00 23.28 O ATOM 990 CB THR A 115 11.139 16.938 -10.448 1.00 28.47 C ATOM 991 OG1 THR A 115 10.932 16.568 -11.808 1.00 27.85 O ATOM 992 CG2 THR A 115 9.995 17.803 -9.950 1.00 27.24 C ATOM 993 HG1 THR A 115 10.041 16.148 -11.902 1.00 0.00 H ATOM 994 H THR A 115 12.715 19.017 -11.925 1.00 0.00 H ATOM 995 N ASP A 116 13.551 15.438 -10.774 1.00 25.26 N ATOM 996 CA ASP A 116 14.385 14.501 -11.497 1.00 26.13 C ATOM 997 C ASP A 116 13.944 14.354 -12.944 1.00 29.45 C ATOM 998 O ASP A 116 14.761 13.973 -13.761 1.00 29.14 O ATOM 999 CB ASP A 116 14.372 13.113 -10.820 1.00 28.96 C ATOM 1000 CG ASP A 116 15.292 13.048 -9.628 1.00 48.19 C ATOM 1001 OD1 ASP A 116 16.301 13.804 -9.608 1.00 49.03 O ATOM 1002 OD2 ASP A 116 15.033 12.217 -8.726 1.00 56.53 O ATOM 1003 H ASP A 116 12.947 15.086 -10.004 1.00 0.00 H ATOM 1004 N SER A 117 12.689 14.642 -13.267 1.00 25.16 N ATOM 1005 CA SER A 117 12.178 14.489 -14.625 1.00 24.33 C ATOM 1006 C SER A 117 12.242 15.778 -15.480 1.00 24.75 C ATOM 1007 O SER A 117 12.119 15.695 -16.700 1.00 23.01 O ATOM 1008 CB SER A 117 10.754 13.941 -14.588 1.00 27.27 C ATOM 1009 OG SER A 117 9.818 14.931 -14.193 1.00 34.53 O ATOM 1010 HG SER A 117 10.049 15.259 -13.288 1.00 0.00 H ATOM 1011 H SER A 117 12.047 14.989 -12.526 1.00 0.00 H ATOM 1012 N GLN A 118 12.375 16.955 -14.852 1.00 19.39 N ATOM 1013 CA GLN A 118 12.380 18.232 -15.566 1.00 18.59 C ATOM 1014 C GLN A 118 13.358 19.211 -14.873 1.00 20.64 C ATOM 1015 O GLN A 118 13.133 19.636 -13.744 1.00 17.66 O ATOM 1016 CB GLN A 118 10.944 18.793 -15.695 1.00 19.57 C ATOM 1017 CG GLN A 118 10.164 18.803 -14.367 1.00 22.95 C ATOM 1018 CD GLN A 118 8.745 19.292 -14.484 1.00 31.30 C ATOM 1019 OE1 GLN A 118 8.065 19.046 -15.446 1.00 32.83 O ATOM 1020 NE2 GLN A 118 8.242 19.960 -13.482 1.00 24.74 N ATOM 1021 HE22 GLN A 118 8.830 20.172 -12.651 1.00 0.00 H ATOM 1022 HE21 GLN A 118 7.253 20.280 -13.515 1.00 0.00 H ATOM 1023 H GLN A 118 12.479 16.961 -13.817 1.00 0.00 H ATOM 1024 N ARG A 119 14.479 19.494 -15.522 1.00 17.93 N ATOM 1025 CA ARG A 119 15.555 20.317 -14.969 1.00 18.41 C ATOM 1026 C ARG A 119 16.130 21.137 -16.125 1.00 21.21 C ATOM 1027 O ARG A 119 16.127 20.651 -17.252 1.00 19.04 O ATOM 1028 CB ARG A 119 16.732 19.400 -14.476 1.00 20.55 C ATOM 1029 CG ARG A 119 16.421 18.356 -13.449 1.00 44.91 C ATOM 1030 CD ARG A 119 17.472 18.214 -12.353 1.00 56.07 C ATOM 1031 NE ARG A 119 18.807 17.885 -12.851 1.00 69.23 N ATOM 1032 HE ARG A 119 18.967 17.770 -13.872 1.00 0.00 H ATOM 1033 H ARG A 119 14.601 19.108 -16.480 1.00 0.00 H ATOM 1034 N PRO A 120 16.752 22.311 -15.864 1.00 19.49 N ATOM 1035 CA PRO A 120 17.362 23.058 -16.963 1.00 18.97 C ATOM 1036 C PRO A 120 18.770 22.581 -17.328 1.00 20.03 C ATOM 1037 O PRO A 120 19.468 21.940 -16.529 1.00 19.84 O ATOM 1038 CB PRO A 120 17.402 24.480 -16.409 1.00 21.07 C ATOM 1039 CG PRO A 120 17.649 24.280 -14.925 1.00 25.32 C ATOM 1040 CD PRO A 120 16.906 23.022 -14.572 1.00 20.33 C ATOM 1041 N ILE A 121 19.182 22.879 -18.547 1.00 12.79 N ATOM 1042 CA ILE A 121 20.556 22.627 -18.970 1.00 12.17 C ATOM 1043 C ILE A 121 21.244 24.009 -18.975 1.00 17.64 C ATOM 1044 O ILE A 121 20.664 24.984 -19.460 1.00 16.05 O ATOM 1045 CB ILE A 121 20.665 21.940 -20.363 1.00 14.80 C ATOM 1046 CG1 ILE A 121 22.177 21.697 -20.768 1.00 13.73 C ATOM 1047 CG2 ILE A 121 19.884 22.740 -21.477 1.00 12.06 C ATOM 1048 CD1 ILE A 121 22.355 20.624 -21.930 1.00 15.32 C ATOM 1049 H ILE A 121 18.512 23.303 -19.221 1.00 0.00 H ATOM 1050 N SER A 122 22.496 24.062 -18.477 1.00 15.70 N ATOM 1051 CA SER A 122 23.281 25.296 -18.473 1.00 16.34 C ATOM 1052 C SER A 122 23.636 25.731 -19.892 1.00 18.77 C ATOM 1053 O SER A 122 23.901 24.903 -20.776 1.00 18.98 O ATOM 1054 CB SER A 122 24.598 25.092 -17.710 1.00 18.94 C ATOM 1055 OG SER A 122 24.344 24.829 -16.344 1.00 28.86 O ATOM 1056 HG SER A 122 23.795 24.009 -16.264 1.00 0.00 H ATOM 1057 H SER A 122 22.917 23.197 -18.083 1.00 0.00 H ATOM 1058 N LEU A 123 23.647 27.038 -20.104 1.00 16.40 N ATOM 1059 CA LEU A 123 24.080 27.601 -21.374 1.00 15.49 C ATOM 1060 C LEU A 123 25.613 27.454 -21.402 1.00 20.33 C ATOM 1061 O LEU A 123 26.236 27.340 -20.335 1.00 19.43 O ATOM 1062 CB LEU A 123 23.696 29.086 -21.425 1.00 14.83 C ATOM 1063 CG LEU A 123 22.180 29.400 -21.498 1.00 18.65 C ATOM 1064 CD1 LEU A 123 21.946 30.893 -21.522 1.00 18.21 C ATOM 1065 CD2 LEU A 123 21.539 28.732 -22.731 1.00 19.09 C ATOM 1066 H LEU A 123 23.339 27.678 -19.344 1.00 0.00 H ATOM 1067 N PRO A 124 26.271 27.428 -22.573 1.00 17.75 N ATOM 1068 CA PRO A 124 27.739 27.394 -22.548 1.00 17.61 C ATOM 1069 C PRO A 124 28.255 28.715 -21.963 1.00 22.35 C ATOM 1070 O PRO A 124 27.574 29.749 -22.041 1.00 20.27 O ATOM 1071 CB PRO A 124 28.137 27.289 -24.040 1.00 19.78 C ATOM 1072 CG PRO A 124 26.909 27.183 -24.798 1.00 23.05 C ATOM 1073 CD PRO A 124 25.753 27.586 -23.945 1.00 19.00 C ATOM 1074 N SER A 125 29.425 28.666 -21.328 1.00 21.57 N ATOM 1075 CA SER A 125 30.077 29.854 -20.803 1.00 22.43 C ATOM 1076 C SER A 125 30.694 30.603 -21.975 1.00 24.70 C ATOM 1077 O SER A 125 31.313 29.983 -22.860 1.00 20.67 O ATOM 1078 CB SER A 125 31.186 29.470 -19.820 1.00 29.02 C ATOM 1079 OG SER A 125 30.673 28.659 -18.775 1.00 45.58 O ATOM 1080 HG SER A 125 31.405 28.423 -18.152 1.00 0.00 H ATOM 1081 H SER A 125 29.889 27.744 -21.203 1.00 0.00 H ATOM 1082 N LYS A 126 30.537 31.945 -21.979 1.00 24.53 N ATOM 1083 CA LYS A 126 31.119 32.816 -23.003 1.00 24.69 C ATOM 1084 C LYS A 126 32.645 32.636 -23.101 1.00 30.43 C ATOM 1085 O LYS A 126 33.195 32.739 -24.195 1.00 30.34 O ATOM 1086 CB LYS A 126 30.742 34.280 -22.763 1.00 26.40 C ATOM 1087 CG LYS A 126 29.273 34.576 -23.040 1.00 35.91 C ATOM 1088 CD LYS A 126 29.023 36.073 -23.258 1.00 43.87 C ATOM 1089 CE LYS A 126 28.840 36.851 -21.974 1.00 52.27 C ATOM 1090 NZ LYS A 126 28.644 38.300 -22.240 1.00 60.24 N ATOM 1091 HZ1 LYS A 126 29.476 38.675 -22.738 1.00 0.00 H ATOM 1092 HZ2 LYS A 126 27.797 38.432 -22.829 1.00 0.00 H ATOM 1093 HZ3 LYS A 126 28.522 38.803 -21.338 1.00 0.00 H ATOM 1094 H LYS A 126 29.976 32.380 -21.219 1.00 0.00 H ATOM 1095 N GLY A 127 33.282 32.284 -21.982 1.00 28.78 N ATOM 1096 CA GLY A 127 34.715 32.005 -21.903 1.00 29.05 C ATOM 1097 C GLY A 127 35.117 30.722 -22.606 1.00 33.79 C ATOM 1098 O GLY A 127 36.286 30.542 -22.944 1.00 34.26 O ATOM 1099 H GLY A 127 32.722 32.203 -21.109 1.00 0.00 H ATOM 1100 N ASP A 128 34.143 29.819 -22.846 1.00 30.50 N ATOM 1101 CA ASP A 128 34.343 28.528 -23.516 1.00 28.78 C ATOM 1102 C ASP A 128 33.986 28.587 -25.006 1.00 28.53 C ATOM 1103 O ASP A 128 33.846 27.540 -25.646 1.00 24.69 O ATOM 1104 CB ASP A 128 33.487 27.445 -22.827 1.00 30.20 C ATOM 1105 CG ASP A 128 33.979 26.946 -21.475 1.00 35.32 C ATOM 1106 OD1 ASP A 128 35.163 27.207 -21.130 1.00 33.94 O ATOM 1107 OD2 ASP A 128 33.196 26.256 -20.778 1.00 38.35 O ATOM 1108 H ASP A 128 33.180 30.055 -22.533 1.00 0.00 H ATOM 1109 N ARG A 129 33.882 29.815 -25.558 1.00 26.46 N ATOM 1110 CA ARG A 129 33.529 30.120 -26.954 1.00 26.73 C ATOM 1111 C ARG A 129 34.316 29.295 -27.992 1.00 31.00 C ATOM 1112 O ARG A 129 33.753 28.916 -29.017 1.00 30.27 O ATOM 1113 CB ARG A 129 33.702 31.636 -27.201 1.00 27.31 C ATOM 1114 CG ARG A 129 33.385 32.130 -28.602 1.00 40.92 C ATOM 1115 CD ARG A 129 33.479 33.645 -28.706 1.00 44.91 C ATOM 1116 H ARG A 129 34.070 30.626 -24.935 1.00 0.00 H ATOM 1117 N ASN A 130 35.605 29.010 -27.717 1.00 26.93 N ATOM 1118 CA ASN A 130 36.471 28.299 -28.653 1.00 26.97 C ATOM 1119 C ASN A 130 36.744 26.841 -28.290 1.00 29.13 C ATOM 1120 O ASN A 130 37.477 26.160 -29.015 1.00 28.40 O ATOM 1121 CB ASN A 130 37.777 29.083 -28.853 1.00 32.77 C ATOM 1122 CG ASN A 130 37.533 30.462 -29.401 1.00 50.58 C ATOM 1123 OD1 ASN A 130 36.773 30.654 -30.356 1.00 48.33 O ATOM 1124 ND2 ASN A 130 38.124 31.454 -28.770 1.00 36.99 N ATOM 1125 HD22 ASN A 130 38.758 31.257 -27.970 1.00 0.00 H ATOM 1126 HD21 ASN A 130 37.957 32.435 -29.072 1.00 0.00 H ATOM 1127 H ASN A 130 35.998 29.309 -26.802 1.00 0.00 H ATOM 1128 N VAL A 131 36.095 26.327 -27.218 1.00 25.83 N ATOM 1129 CA VAL A 131 36.252 24.929 -26.801 1.00 23.82 C ATOM 1130 C VAL A 131 35.705 23.996 -27.897 1.00 27.23 C ATOM 1131 O VAL A 131 34.596 24.216 -28.403 1.00 26.38 O ATOM 1132 CB VAL A 131 35.581 24.628 -25.417 1.00 26.40 C ATOM 1133 CG1 VAL A 131 35.566 23.131 -25.113 1.00 25.53 C ATOM 1134 CG2 VAL A 131 36.265 25.393 -24.275 1.00 25.58 C ATOM 1135 H VAL A 131 35.463 26.945 -26.671 1.00 0.00 H ATOM 1136 N ILE A 132 36.475 22.961 -28.251 1.00 21.71 N ATOM 1137 CA ILE A 132 35.975 21.947 -29.175 1.00 21.92 C ATOM 1138 C ILE A 132 35.603 20.759 -28.252 1.00 25.37 C ATOM 1139 O ILE A 132 36.464 19.980 -27.831 1.00 24.45 O ATOM 1140 CB ILE A 132 36.939 21.562 -30.340 1.00 25.61 C ATOM 1141 CG1 ILE A 132 37.332 22.806 -31.193 1.00 25.85 C ATOM 1142 CG2 ILE A 132 36.286 20.448 -31.225 1.00 26.97 C ATOM 1143 CD1 ILE A 132 38.636 22.613 -32.069 1.00 28.82 C ATOM 1144 H ILE A 132 37.437 22.878 -27.865 1.00 0.00 H ATOM 1145 N TYR A 133 34.316 20.689 -27.883 1.00 20.68 N ATOM 1146 CA TYR A 133 33.764 19.672 -26.994 1.00 19.89 C ATOM 1147 C TYR A 133 33.923 18.291 -27.613 1.00 23.38 C ATOM 1148 O TYR A 133 33.710 18.153 -28.820 1.00 23.06 O ATOM 1149 CB TYR A 133 32.279 19.971 -26.760 1.00 19.70 C ATOM 1150 CG TYR A 133 32.011 21.332 -26.158 1.00 19.99 C ATOM 1151 CD1 TYR A 133 31.834 22.451 -26.966 1.00 21.55 C ATOM 1152 CD2 TYR A 133 31.865 21.489 -24.783 1.00 20.55 C ATOM 1153 CE1 TYR A 133 31.583 23.707 -26.420 1.00 22.69 C ATOM 1154 CE2 TYR A 133 31.571 22.731 -24.226 1.00 21.89 C ATOM 1155 CZ TYR A 133 31.446 23.842 -25.047 1.00 28.21 C ATOM 1156 OH TYR A 133 31.153 25.068 -24.500 1.00 25.83 O ATOM 1157 HH TYR A 133 31.100 25.745 -25.220 1.00 0.00 H ATOM 1158 H TYR A 133 33.666 21.410 -28.256 1.00 0.00 H ATOM 1159 N THR A 134 34.271 17.274 -26.805 1.00 20.05 N ATOM 1160 CA THR A 134 34.477 15.895 -27.297 1.00 19.81 C ATOM 1161 C THR A 134 33.431 14.898 -26.782 1.00 25.08 C ATOM 1162 O THR A 134 33.499 13.715 -27.134 1.00 25.29 O ATOM 1163 CB THR A 134 35.885 15.388 -26.928 1.00 27.28 C ATOM 1164 OG1 THR A 134 36.008 15.464 -25.512 1.00 26.79 O ATOM 1165 CG2 THR A 134 36.992 16.173 -27.611 1.00 26.39 C ATOM 1166 HG1 THR A 134 36.905 15.144 -25.242 1.00 0.00 H ATOM 1167 H THR A 134 34.401 17.466 -25.791 1.00 0.00 H ATOM 1168 N ASP A 135 32.463 15.348 -25.958 1.00 21.46 N ATOM 1169 CA ASP A 135 31.447 14.409 -25.472 1.00 20.22 C ATOM 1170 C ASP A 135 30.058 15.016 -25.731 1.00 21.54 C ATOM 1171 O ASP A 135 29.430 15.515 -24.814 1.00 20.53 O ATOM 1172 CB ASP A 135 31.670 14.098 -23.973 1.00 21.28 C ATOM 1173 CG ASP A 135 30.766 13.009 -23.402 1.00 27.34 C ATOM 1174 OD1 ASP A 135 30.163 12.236 -24.207 1.00 26.08 O ATOM 1175 OD2 ASP A 135 30.641 12.939 -22.151 1.00 30.84 O ATOM 1176 H ASP A 135 32.437 16.347 -25.671 1.00 0.00 H ATOM 1177 N CYS A 136 29.622 14.993 -27.006 1.00 18.88 N ATOM 1178 CA CYS A 136 28.379 15.625 -27.475 1.00 17.66 C ATOM 1179 C CYS A 136 27.373 14.619 -27.950 1.00 19.16 C ATOM 1180 O CYS A 136 27.700 13.675 -28.669 1.00 18.39 O ATOM 1181 CB CYS A 136 28.671 16.663 -28.553 1.00 17.97 C ATOM 1182 SG CYS A 136 29.799 17.973 -28.018 1.00 21.31 S ATOM 1183 H CYS A 136 30.205 14.493 -27.708 1.00 0.00 H ATOM 1184 N TRP A 137 26.122 14.869 -27.584 1.00 16.07 N ATOM 1185 CA TRP A 137 24.997 13.997 -27.860 1.00 16.43 C ATOM 1186 C TRP A 137 23.815 14.780 -28.450 1.00 16.66 C ATOM 1187 O TRP A 137 23.476 15.876 -27.968 1.00 14.01 O ATOM 1188 CB TRP A 137 24.557 13.331 -26.538 1.00 16.34 C ATOM 1189 CG TRP A 137 25.582 12.398 -25.930 1.00 18.03 C ATOM 1190 CD1 TRP A 137 26.695 12.739 -25.214 1.00 20.77 C ATOM 1191 CD2 TRP A 137 25.573 10.961 -25.999 1.00 18.73 C ATOM 1192 NE1 TRP A 137 27.389 11.601 -24.846 1.00 21.09 N ATOM 1193 CE2 TRP A 137 26.738 10.501 -25.341 1.00 22.95 C ATOM 1194 CE3 TRP A 137 24.716 10.021 -26.595 1.00 20.20 C ATOM 1195 CZ2 TRP A 137 27.036 9.138 -25.216 1.00 22.75 C ATOM 1196 CZ3 TRP A 137 25.025 8.677 -26.497 1.00 21.83 C ATOM 1197 CH2 TRP A 137 26.187 8.245 -25.835 1.00 22.79 C ATOM 1198 HE1 TRP A 137 28.264 11.583 -24.284 1.00 0.00 H ATOM 1199 H TRP A 137 25.936 15.750 -27.064 1.00 0.00 H ATOM 1200 N VAL A 138 23.193 14.203 -29.487 1.00 13.22 N ATOM 1201 CA VAL A 138 21.983 14.767 -30.098 1.00 13.71 C ATOM 1202 C VAL A 138 20.815 13.861 -29.717 1.00 16.98 C ATOM 1203 O VAL A 138 20.959 12.643 -29.765 1.00 16.23 O ATOM 1204 CB VAL A 138 22.110 15.036 -31.625 1.00 16.58 C ATOM 1205 CG1 VAL A 138 22.325 13.750 -32.410 1.00 16.15 C ATOM 1206 CG2 VAL A 138 20.893 15.801 -32.148 1.00 15.63 C ATOM 1207 H VAL A 138 23.583 13.320 -29.875 1.00 0.00 H ATOM 1208 N THR A 139 19.678 14.453 -29.303 1.00 14.36 N ATOM 1209 CA THR A 139 18.519 13.689 -28.831 1.00 14.45 C ATOM 1210 C THR A 139 17.229 14.142 -29.492 1.00 15.34 C ATOM 1211 O THR A 139 17.099 15.302 -29.889 1.00 14.33 O ATOM 1212 CB THR A 139 18.397 13.800 -27.288 1.00 16.90 C ATOM 1213 OG1 THR A 139 18.495 15.179 -26.918 1.00 15.66 O ATOM 1214 CG2 THR A 139 19.445 12.988 -26.547 1.00 18.37 C ATOM 1215 HG1 THR A 139 17.765 15.688 -27.351 1.00 0.00 H ATOM 1216 H THR A 139 19.620 15.491 -29.319 1.00 0.00 H ATOM 1217 N GLY A 140 16.284 13.224 -29.592 1.00 11.98 N ATOM 1218 CA GLY A 140 14.972 13.530 -30.144 1.00 11.89 C ATOM 1219 C GLY A 140 14.150 12.339 -30.573 1.00 16.28 C ATOM 1220 O GLY A 140 14.614 11.193 -30.545 1.00 15.47 O ATOM 1221 H GLY A 140 16.483 12.256 -29.267 1.00 0.00 H ATOM 1222 N TRP A 141 12.904 12.629 -30.982 1.00 13.41 N ATOM 1223 CA TRP A 141 11.932 11.644 -31.438 1.00 12.87 C ATOM 1224 C TRP A 141 11.837 11.654 -32.960 1.00 17.45 C ATOM 1225 O TRP A 141 10.855 11.166 -33.531 1.00 17.56 O ATOM 1226 CB TRP A 141 10.552 11.954 -30.796 1.00 11.98 C ATOM 1227 CG TRP A 141 10.478 11.739 -29.303 1.00 12.79 C ATOM 1228 CD1 TRP A 141 10.104 10.588 -28.659 1.00 15.63 C ATOM 1229 CD2 TRP A 141 10.702 12.716 -28.277 1.00 12.13 C ATOM 1230 NE1 TRP A 141 10.131 10.775 -27.295 1.00 13.52 N ATOM 1231 CE2 TRP A 141 10.459 12.081 -27.033 1.00 15.33 C ATOM 1232 CE3 TRP A 141 11.079 14.074 -28.282 1.00 13.56 C ATOM 1233 CZ2 TRP A 141 10.598 12.752 -25.808 1.00 15.16 C ATOM 1234 CZ3 TRP A 141 11.203 14.736 -27.068 1.00 15.27 C ATOM 1235 CH2 TRP A 141 10.958 14.078 -25.852 1.00 15.54 C ATOM 1236 HE1 TRP A 141 9.935 10.045 -26.580 1.00 0.00 H ATOM 1237 H TRP A 141 12.612 13.627 -30.973 1.00 0.00 H ATOM 1238 N GLY A 142 12.855 12.190 -33.627 1.00 14.14 N ATOM 1239 CA GLY A 142 12.853 12.304 -35.090 1.00 13.32 C ATOM 1240 C GLY A 142 13.005 10.999 -35.839 1.00 17.17 C ATOM 1241 O GLY A 142 13.214 9.946 -35.234 1.00 15.83 O ATOM 1242 H GLY A 142 13.678 12.539 -33.095 1.00 0.00 H ATOM 1243 N TYR A 143 12.876 11.060 -37.178 1.00 16.12 N ATOM 1244 CA TYR A 143 12.983 9.896 -38.090 1.00 17.23 C ATOM 1245 C TYR A 143 14.327 9.175 -37.910 1.00 21.40 C ATOM 1246 O TYR A 143 15.330 9.824 -37.594 1.00 21.88 O ATOM 1247 CB TYR A 143 12.875 10.377 -39.569 1.00 18.23 C ATOM 1248 CG TYR A 143 11.521 10.910 -40.031 1.00 20.35 C ATOM 1249 CD1 TYR A 143 10.522 11.247 -39.113 1.00 21.17 C ATOM 1250 CD2 TYR A 143 11.255 11.110 -41.385 1.00 21.72 C ATOM 1251 CE1 TYR A 143 9.290 11.751 -39.535 1.00 21.73 C ATOM 1252 CE2 TYR A 143 10.032 11.624 -41.815 1.00 22.77 C ATOM 1253 CZ TYR A 143 9.047 11.921 -40.888 1.00 31.03 C ATOM 1254 OH TYR A 143 7.836 12.402 -41.318 1.00 33.92 O ATOM 1255 HH TYR A 143 7.249 12.562 -40.537 1.00 0.00 H ATOM 1256 H TYR A 143 12.688 11.990 -37.603 1.00 0.00 H ATOM 1257 N ARG A 145 14.357 7.862 -38.142 1.00 17.48 N ATOM 1258 CA ARG A 145 15.593 7.058 -38.100 1.00 19.19 C ATOM 1259 C ARG A 145 16.220 6.949 -39.501 1.00 27.81 C ATOM 1260 O ARG A 145 17.328 6.434 -39.636 1.00 28.32 O ATOM 1261 CB ARG A 145 15.314 5.654 -37.566 1.00 20.47 C ATOM 1262 CG ARG A 145 14.986 5.584 -36.104 1.00 32.26 C ATOM 1263 CD ARG A 145 14.645 4.155 -35.714 1.00 54.14 C ATOM 1264 NE ARG A 145 13.361 3.732 -36.276 1.00 74.20 N ATOM 1265 CZ ARG A 145 13.201 2.702 -37.096 1.00 90.14 C ATOM 1266 NH1 ARG A 145 11.998 2.398 -37.561 1.00 69.57 N ATOM 1267 NH2 ARG A 145 14.244 1.958 -37.451 1.00 84.97 N ATOM 1268 HE ARG A 145 12.515 4.277 -36.014 1.00 0.00 H ATOM 1269 HH12 ARG A 145 11.878 1.589 -38.204 1.00 0.00 H ATOM 1270 HH11 ARG A 145 11.174 2.968 -37.283 1.00 0.00 H ATOM 1271 HH22 ARG A 145 14.113 1.151 -38.094 1.00 0.00 H ATOM 1272 HH21 ARG A 145 15.191 2.182 -37.085 1.00 0.00 H ATOM 1273 H ARG A 145 13.463 7.380 -38.364 1.00 0.00 H ATOM 1274 N LYS A 146 15.496 7.414 -40.523 1.00 27.70 N ATOM 1275 CA LYS A 146 15.876 7.440 -41.952 1.00 29.57 C ATOM 1276 C LYS A 146 14.985 8.483 -42.632 1.00 36.17 C ATOM 1277 O LYS A 146 13.967 8.850 -42.043 1.00 33.37 O ATOM 1278 CB LYS A 146 15.760 6.044 -42.605 1.00 32.13 C ATOM 1279 CG LYS A 146 14.368 5.422 -42.534 1.00 39.38 C ATOM 1280 CD LYS A 146 14.378 3.944 -42.877 1.00 47.70 C ATOM 1281 CE LYS A 146 12.983 3.369 -42.842 1.00 59.70 C ATOM 1282 NZ LYS A 146 12.965 1.937 -43.243 1.00 74.21 N ATOM 1283 HZ1 LYS A 146 13.332 1.845 -44.212 1.00 0.00 H ATOM 1284 HZ2 LYS A 146 13.561 1.388 -42.591 1.00 0.00 H ATOM 1285 HZ3 LYS A 146 11.989 1.580 -43.206 1.00 0.00 H ATOM 1286 H LYS A 146 14.560 7.801 -40.287 1.00 0.00 H ATOM 1287 N LEU A 147 15.358 8.989 -43.833 1.00 36.67 N ATOM 1288 CA LEU A 147 14.611 10.082 -44.490 1.00 37.82 C ATOM 1289 C LEU A 147 13.113 9.835 -44.693 1.00 41.57 C ATOM 1290 O LEU A 147 12.325 10.757 -44.480 1.00 42.78 O ATOM 1291 CB LEU A 147 15.232 10.557 -45.801 1.00 38.60 C ATOM 1292 CG LEU A 147 16.110 11.834 -45.667 1.00 44.55 C ATOM 1293 CD1 LEU A 147 16.962 12.026 -46.870 1.00 44.94 C ATOM 1294 CD2 LEU A 147 15.276 13.074 -45.354 1.00 46.28 C ATOM 1295 H LEU A 147 16.196 8.596 -44.307 1.00 0.00 H ATOM 1296 N ARG A 148 12.712 8.637 -45.085 1.00 36.04 N ATOM 1297 CA ARG A 148 11.279 8.356 -45.262 1.00 36.28 C ATOM 1298 C ARG A 148 10.887 7.438 -44.106 1.00 40.91 C ATOM 1299 O ARG A 148 11.157 6.233 -44.134 1.00 43.06 O ATOM 1300 CB ARG A 148 10.972 7.706 -46.637 1.00 35.50 C ATOM 1301 CG ARG A 148 11.345 8.574 -47.842 1.00 46.30 C ATOM 1302 H ARG A 148 13.413 7.891 -45.269 1.00 0.00 H ATOM 1303 N ASP A 149 10.352 8.041 -43.044 1.00 33.41 N ATOM 1304 CA ASP A 149 9.999 7.329 -41.837 1.00 31.34 C ATOM 1305 C ASP A 149 8.853 8.057 -41.170 1.00 31.23 C ATOM 1306 O ASP A 149 8.042 8.727 -41.822 1.00 29.41 O ATOM 1307 CB ASP A 149 11.254 7.256 -40.912 1.00 32.92 C ATOM 1308 CG ASP A 149 11.302 6.147 -39.865 1.00 41.89 C ATOM 1309 OD1 ASP A 149 10.460 5.229 -39.932 1.00 42.38 O ATOM 1310 OD2 ASP A 149 12.168 6.220 -38.955 1.00 41.35 O ATOM 1311 H ASP A 149 10.182 9.066 -43.086 1.00 0.00 H ATOM 1312 N LYS A 150 8.776 7.904 -39.857 1.00 26.29 N ATOM 1313 CA LYS A 150 7.793 8.544 -39.009 1.00 24.62 C ATOM 1314 C LYS A 150 8.481 8.865 -37.684 1.00 25.26 C ATOM 1315 O LYS A 150 9.584 8.364 -37.405 1.00 24.87 O ATOM 1316 CB LYS A 150 6.560 7.634 -38.804 1.00 27.27 C ATOM 1317 CG LYS A 150 6.845 6.254 -38.240 1.00 39.04 C ATOM 1318 CD LYS A 150 5.558 5.454 -38.109 1.00 55.96 C ATOM 1319 CE LYS A 150 5.781 4.118 -37.441 1.00 74.20 C ATOM 1320 NZ LYS A 150 4.512 3.353 -37.295 1.00 85.70 N ATOM 1321 HZ1 LYS A 150 3.843 3.900 -36.716 1.00 0.00 H ATOM 1322 HZ2 LYS A 150 4.101 3.184 -38.235 1.00 0.00 H ATOM 1323 HZ3 LYS A 150 4.709 2.443 -36.832 1.00 0.00 H ATOM 1324 H LYS A 150 9.472 7.279 -39.402 1.00 0.00 H ATOM 1325 N ILE A 151 7.845 9.714 -36.891 1.00 20.18 N ATOM 1326 CA ILE A 151 8.309 10.086 -35.554 1.00 18.92 C ATOM 1327 C ILE A 151 8.469 8.826 -34.708 1.00 23.97 C ATOM 1328 O ILE A 151 7.603 7.948 -34.716 1.00 23.16 O ATOM 1329 CB ILE A 151 7.296 11.105 -34.943 1.00 22.09 C ATOM 1330 CG1 ILE A 151 7.338 12.441 -35.720 1.00 21.28 C ATOM 1331 CG2 ILE A 151 7.458 11.323 -33.407 1.00 23.08 C ATOM 1332 CD1 ILE A 151 8.716 13.183 -35.809 1.00 15.11 C ATOM 1333 H ILE A 151 6.963 10.142 -37.239 1.00 0.00 H ATOM 1334 N GLN A 152 9.586 8.743 -33.987 1.00 21.61 N ATOM 1335 CA GLN A 152 9.865 7.613 -33.113 1.00 20.18 C ATOM 1336 C GLN A 152 9.082 7.737 -31.819 1.00 22.16 C ATOM 1337 O GLN A 152 8.903 8.845 -31.306 1.00 21.77 O ATOM 1338 CB GLN A 152 11.376 7.483 -32.860 1.00 20.05 C ATOM 1339 CG GLN A 152 12.137 7.093 -34.133 1.00 27.87 C ATOM 1340 CD GLN A 152 11.522 5.893 -34.819 1.00 38.24 C ATOM 1341 OE1 GLN A 152 11.646 4.772 -34.357 1.00 31.99 O ATOM 1342 NE2 GLN A 152 10.775 6.105 -35.887 1.00 32.32 N ATOM 1343 HE22 GLN A 152 10.678 7.067 -36.271 1.00 0.00 H ATOM 1344 HE21 GLN A 152 10.284 5.310 -36.344 1.00 0.00 H ATOM 1345 H GLN A 152 10.283 9.512 -34.051 1.00 0.00 H ATOM 1346 N ASN A 153 8.564 6.614 -31.321 1.00 16.53 N ATOM 1347 CA ASN A 153 7.835 6.647 -30.057 1.00 15.87 C ATOM 1348 C ASN A 153 8.778 6.965 -28.895 1.00 19.31 C ATOM 1349 O ASN A 153 8.491 7.864 -28.103 1.00 17.05 O ATOM 1350 CB ASN A 153 7.099 5.321 -29.788 1.00 17.30 C ATOM 1351 CG ASN A 153 6.118 5.453 -28.661 1.00 26.42 C ATOM 1352 OD1 ASN A 153 5.445 6.474 -28.520 1.00 21.54 O ATOM 1353 ND2 ASN A 153 5.956 4.411 -27.877 1.00 19.23 N ATOM 1354 HD22 ASN A 153 6.537 3.560 -28.017 1.00 0.00 H ATOM 1355 HD21 ASN A 153 5.247 4.437 -27.117 1.00 0.00 H ATOM 1356 H ASN A 153 8.679 5.716 -31.832 1.00 0.00 H ATOM 1357 N THR A 154 9.940 6.296 -28.852 1.00 16.13 N ATOM 1358 CA THR A 154 10.897 6.444 -27.754 1.00 15.41 C ATOM 1359 C THR A 154 12.000 7.436 -28.077 1.00 18.04 C ATOM 1360 O THR A 154 12.611 7.355 -29.140 1.00 17.90 O ATOM 1361 CB THR A 154 11.518 5.078 -27.410 1.00 18.11 C ATOM 1362 OG1 THR A 154 10.476 4.130 -27.301 1.00 16.73 O ATOM 1363 CG2 THR A 154 12.313 5.115 -26.127 1.00 16.50 C ATOM 1364 HG1 THR A 154 9.851 4.409 -26.585 1.00 0.00 H ATOM 1365 H THR A 154 10.170 5.646 -29.630 1.00 0.00 H ATOM 1366 N LEU A 155 12.292 8.320 -27.121 1.00 16.08 N ATOM 1367 CA LEU A 155 13.366 9.324 -27.255 1.00 14.90 C ATOM 1368 C LEU A 155 14.682 8.620 -27.597 1.00 19.86 C ATOM 1369 O LEU A 155 15.078 7.700 -26.888 1.00 19.26 O ATOM 1370 CB LEU A 155 13.541 10.117 -25.940 1.00 13.65 C ATOM 1371 CG LEU A 155 14.617 11.212 -25.947 1.00 16.61 C ATOM 1372 CD1 LEU A 155 14.252 12.313 -26.932 1.00 15.50 C ATOM 1373 CD2 LEU A 155 14.784 11.820 -24.563 1.00 15.72 C ATOM 1374 H LEU A 155 11.738 8.301 -26.241 1.00 0.00 H ATOM 1375 N GLN A 156 15.337 9.050 -28.692 1.00 17.05 N ATOM 1376 CA GLN A 156 16.610 8.464 -29.138 1.00 16.04 C ATOM 1377 C GLN A 156 17.764 9.373 -28.830 1.00 18.25 C ATOM 1378 O GLN A 156 17.575 10.577 -28.677 1.00 15.97 O ATOM 1379 CB GLN A 156 16.595 8.165 -30.649 1.00 16.34 C ATOM 1380 CG GLN A 156 15.444 7.236 -31.084 1.00 19.21 C ATOM 1381 CD GLN A 156 15.663 5.814 -30.672 1.00 29.79 C ATOM 1382 OE1 GLN A 156 16.674 5.192 -31.026 1.00 20.72 O ATOM 1383 NE2 GLN A 156 14.728 5.281 -29.903 1.00 22.64 N ATOM 1384 HE22 GLN A 156 13.896 5.842 -29.631 1.00 0.00 H ATOM 1385 HE21 GLN A 156 14.825 4.301 -29.570 1.00 0.00 H ATOM 1386 H GLN A 156 14.926 9.829 -29.245 1.00 0.00 H ATOM 1387 N LYS A 157 18.973 8.793 -28.742 1.00 14.38 N ATOM 1388 CA LYS A 157 20.197 9.549 -28.476 1.00 13.51 C ATOM 1389 C LYS A 157 21.310 9.004 -29.373 1.00 18.29 C ATOM 1390 O LYS A 157 21.316 7.814 -29.715 1.00 16.53 O ATOM 1391 CB LYS A 157 20.598 9.458 -26.982 1.00 15.70 C ATOM 1392 CG LYS A 157 20.999 8.043 -26.537 1.00 18.84 C ATOM 1393 CD LYS A 157 21.461 7.982 -25.111 1.00 24.03 C ATOM 1394 CE LYS A 157 21.940 6.566 -24.814 1.00 35.11 C ATOM 1395 NZ LYS A 157 22.662 6.467 -23.518 1.00 45.00 N ATOM 1396 HZ1 LYS A 157 23.495 7.089 -23.538 1.00 0.00 H ATOM 1397 HZ2 LYS A 157 22.029 6.759 -22.747 1.00 0.00 H ATOM 1398 HZ3 LYS A 157 22.965 5.484 -23.366 1.00 0.00 H ATOM 1399 H LYS A 157 19.041 7.763 -28.868 1.00 0.00 H ATOM 1400 N ALA A 158 22.228 9.880 -29.781 1.00 15.60 N ATOM 1401 CA ALA A 158 23.412 9.468 -30.565 1.00 15.69 C ATOM 1402 C ALA A 158 24.563 10.356 -30.173 1.00 20.55 C ATOM 1403 O ALA A 158 24.382 11.570 -30.033 1.00 19.80 O ATOM 1404 CB ALA A 158 23.157 9.567 -32.072 1.00 15.85 C ATOM 1405 H ALA A 158 22.108 10.885 -29.540 1.00 0.00 H ATOM 1406 N LYS A 159 25.735 9.751 -29.935 1.00 17.02 N ATOM 1407 CA LYS A 159 26.945 10.522 -29.620 1.00 16.11 C ATOM 1408 C LYS A 159 27.545 10.892 -30.969 1.00 20.86 C ATOM 1409 O LYS A 159 27.748 10.010 -31.827 1.00 22.31 O ATOM 1410 CB LYS A 159 27.946 9.699 -28.793 1.00 16.73 C ATOM 1411 CG LYS A 159 29.156 10.528 -28.363 1.00 19.66 C ATOM 1412 CD LYS A 159 30.094 9.733 -27.466 1.00 28.48 C ATOM 1413 CE LYS A 159 31.247 10.583 -27.001 1.00 34.96 C ATOM 1414 NZ LYS A 159 31.993 9.920 -25.905 1.00 45.58 N ATOM 1415 HZ1 LYS A 159 31.354 9.758 -25.101 1.00 0.00 H ATOM 1416 HZ2 LYS A 159 32.366 9.010 -26.242 1.00 0.00 H ATOM 1417 HZ3 LYS A 159 32.781 10.529 -25.606 1.00 0.00 H ATOM 1418 H LYS A 159 25.789 8.713 -29.974 1.00 0.00 H ATOM 1419 N ILE A 160 27.795 12.199 -31.192 1.00 16.48 N ATOM 1420 CA ILE A 160 28.291 12.660 -32.487 1.00 16.41 C ATOM 1421 C ILE A 160 29.510 13.617 -32.328 1.00 20.28 C ATOM 1422 O ILE A 160 29.485 14.470 -31.437 1.00 19.25 O ATOM 1423 CB ILE A 160 27.090 13.276 -33.286 1.00 19.62 C ATOM 1424 CG1 ILE A 160 25.867 12.301 -33.326 1.00 19.82 C ATOM 1425 CG2 ILE A 160 27.499 13.691 -34.688 1.00 20.08 C ATOM 1426 CD1 ILE A 160 24.801 12.572 -34.317 1.00 26.21 C ATOM 1427 H ILE A 160 27.632 12.889 -30.431 1.00 0.00 H ATOM 1428 N PRO A 161 30.606 13.494 -33.149 1.00 17.45 N ATOM 1429 CA PRO A 161 31.733 14.428 -32.969 1.00 17.05 C ATOM 1430 C PRO A 161 31.482 15.777 -33.639 1.00 20.23 C ATOM 1431 O PRO A 161 30.847 15.839 -34.703 1.00 19.91 O ATOM 1432 CB PRO A 161 32.912 13.707 -33.648 1.00 19.08 C ATOM 1433 CG PRO A 161 32.280 12.866 -34.709 1.00 24.77 C ATOM 1434 CD PRO A 161 30.863 12.554 -34.274 1.00 20.39 C ATOM 1435 N LEU A 162 32.029 16.840 -33.063 1.00 15.65 N ATOM 1436 CA LEU A 162 31.945 18.175 -33.640 1.00 16.37 C ATOM 1437 C LEU A 162 32.921 18.235 -34.813 1.00 22.67 C ATOM 1438 O LEU A 162 33.963 17.570 -34.806 1.00 20.46 O ATOM 1439 CB LEU A 162 32.324 19.261 -32.608 1.00 16.50 C ATOM 1440 CG LEU A 162 31.451 19.393 -31.353 1.00 20.33 C ATOM 1441 CD1 LEU A 162 31.865 20.626 -30.556 1.00 21.50 C ATOM 1442 CD2 LEU A 162 29.953 19.536 -31.718 1.00 20.07 C ATOM 1443 H LEU A 162 32.538 16.715 -32.164 1.00 0.00 H ATOM 1444 N VAL A 163 32.555 19.003 -35.826 1.00 19.75 N ATOM 1445 CA VAL A 163 33.354 19.219 -37.033 1.00 19.34 C ATOM 1446 C VAL A 163 33.697 20.718 -37.012 1.00 22.80 C ATOM 1447 O VAL A 163 32.790 21.531 -36.802 1.00 23.32 O ATOM 1448 CB VAL A 163 32.500 18.811 -38.279 1.00 22.44 C ATOM 1449 CG1 VAL A 163 33.136 19.273 -39.590 1.00 21.68 C ATOM 1450 CG2 VAL A 163 32.233 17.292 -38.304 1.00 21.64 C ATOM 1451 H VAL A 163 31.637 19.486 -35.760 1.00 0.00 H ATOM 1452 N THR A 164 34.976 21.095 -37.261 1.00 16.83 N ATOM 1453 CA THR A 164 35.381 22.505 -37.297 1.00 15.85 C ATOM 1454 C THR A 164 34.617 23.277 -38.384 1.00 18.56 C ATOM 1455 O THR A 164 34.190 22.683 -39.384 1.00 18.03 O ATOM 1456 CB THR A 164 36.921 22.654 -37.555 1.00 23.45 C ATOM 1457 OG1 THR A 164 37.238 22.153 -38.868 1.00 22.25 O ATOM 1458 CG2 THR A 164 37.772 21.973 -36.469 1.00 22.53 C ATOM 1459 HG1 THR A 164 36.984 21.198 -38.926 1.00 0.00 H ATOM 1460 H THR A 164 35.693 20.361 -37.432 1.00 0.00 H ATOM 1461 N ASN A 165 34.488 24.588 -38.197 1.00 15.31 N ATOM 1462 CA ASN A 165 33.828 25.497 -39.119 1.00 16.46 C ATOM 1463 C ASN A 165 34.480 25.404 -40.507 1.00 20.58 C ATOM 1464 O ASN A 165 33.777 25.354 -41.502 1.00 19.99 O ATOM 1465 CB ASN A 165 33.917 26.929 -38.575 1.00 18.78 C ATOM 1466 CG ASN A 165 33.396 27.982 -39.515 1.00 46.78 C ATOM 1467 OD1 ASN A 165 34.155 28.541 -40.302 1.00 38.87 O ATOM 1468 ND2 ASN A 165 32.125 28.345 -39.422 1.00 40.34 N ATOM 1469 HD22 ASN A 165 31.494 27.862 -38.751 1.00 0.00 H ATOM 1470 HD21 ASN A 165 31.758 29.113 -40.020 1.00 0.00 H ATOM 1471 H ASN A 165 34.889 24.992 -37.327 1.00 0.00 H ATOM 1472 N GLU A 166 35.823 25.354 -40.562 1.00 19.48 N ATOM 1473 CA GLU A 166 36.545 25.261 -41.827 1.00 20.03 C ATOM 1474 C GLU A 166 36.150 24.025 -42.613 1.00 20.85 C ATOM 1475 O GLU A 166 35.835 24.160 -43.797 1.00 17.02 O ATOM 1476 CB GLU A 166 38.062 25.308 -41.613 1.00 22.39 C ATOM 1477 CG GLU A 166 38.800 25.720 -42.877 1.00 38.68 C ATOM 1478 CD GLU A 166 40.309 25.854 -42.774 1.00 61.43 C ATOM 1479 OE1 GLU A 166 40.821 26.094 -41.655 1.00 44.54 O ATOM 1480 OE2 GLU A 166 40.978 25.765 -43.831 1.00 52.58 O ATOM 1481 H GLU A 166 36.364 25.383 -39.674 1.00 0.00 H ATOM 1482 N GLU A 167 36.137 22.838 -41.971 1.00 16.35 N ATOM 1483 CA GLU A 167 35.745 21.592 -42.632 1.00 16.33 C ATOM 1484 C GLU A 167 34.251 21.638 -43.010 1.00 19.67 C ATOM 1485 O GLU A 167 33.885 21.230 -44.110 1.00 16.60 O ATOM 1486 CB GLU A 167 36.015 20.384 -41.738 1.00 17.25 C ATOM 1487 CG GLU A 167 35.672 19.051 -42.402 1.00 23.80 C ATOM 1488 CD GLU A 167 36.036 17.796 -41.630 1.00 29.19 C ATOM 1489 OE1 GLU A 167 36.822 17.892 -40.662 1.00 32.96 O ATOM 1490 OE2 GLU A 167 35.521 16.713 -41.983 1.00 29.85 O ATOM 1491 H GLU A 167 36.416 22.807 -40.970 1.00 0.00 H ATOM 1492 N CYS A 168 33.389 22.099 -42.080 1.00 15.75 N ATOM 1493 CA CYS A 168 31.969 22.182 -42.379 1.00 15.70 C ATOM 1494 C CYS A 168 31.699 23.077 -43.598 1.00 17.52 C ATOM 1495 O CYS A 168 30.896 22.698 -44.434 1.00 17.00 O ATOM 1496 CB CYS A 168 31.170 22.649 -41.175 1.00 16.54 C ATOM 1497 SG CYS A 168 29.392 22.450 -41.402 1.00 20.65 S ATOM 1498 H CYS A 168 33.741 22.396 -41.147 1.00 0.00 H ATOM 1499 N GLN A 168A 32.371 24.261 -43.688 1.00 15.72 N ATOM 1500 CA GLN A 168A 32.239 25.152 -44.847 1.00 16.62 C ATOM 1501 C GLN A 168A 32.625 24.425 -46.165 1.00 20.74 C ATOM 1502 O GLN A 168A 31.944 24.595 -47.172 1.00 20.99 O ATOM 1503 CB GLN A 168A 33.042 26.460 -44.672 1.00 17.25 C ATOM 1504 CG GLN A 168A 32.886 27.444 -45.856 1.00 24.91 C ATOM 1505 CD GLN A 168A 31.461 27.903 -46.057 1.00 21.51 C ATOM 1506 OE1 GLN A 168A 31.019 28.883 -45.450 1.00 19.31 O ATOM 1507 NE2 GLN A 168A 30.696 27.213 -46.906 1.00 14.31 N ATOM 1508 HE22 GLN A 168A 31.087 26.390 -47.408 1.00 0.00 H ATOM 1509 HE21 GLN A 168A 29.709 27.498 -47.066 1.00 0.00 H ATOM 1510 H GLN A 168A 32.999 24.542 -42.908 1.00 0.00 H ATOM 1511 N LYS A 169 33.652 23.567 -46.121 1.00 17.46 N ATOM 1512 CA LYS A 169 34.052 22.803 -47.292 1.00 19.54 C ATOM 1513 C LYS A 169 32.943 21.818 -47.746 1.00 23.19 C ATOM 1514 O LYS A 169 32.763 21.635 -48.946 1.00 23.77 O ATOM 1515 CB LYS A 169 35.404 22.081 -47.051 1.00 22.95 C ATOM 1516 CG LYS A 169 35.782 21.141 -48.204 1.00 26.63 C ATOM 1517 CD LYS A 169 37.121 20.455 -48.044 1.00 24.62 C ATOM 1518 CE LYS A 169 37.298 19.522 -49.221 1.00 31.63 C ATOM 1519 NZ LYS A 169 38.709 19.058 -49.361 1.00 26.66 N ATOM 1520 HZ1 LYS A 169 39.331 19.880 -49.502 1.00 0.00 H ATOM 1521 HZ2 LYS A 169 38.993 18.551 -48.499 1.00 0.00 H ATOM 1522 HZ3 LYS A 169 38.784 18.421 -50.180 1.00 0.00 H ATOM 1523 H LYS A 169 34.175 23.444 -45.230 1.00 0.00 H ATOM 1524 N ARG A 170 32.180 21.231 -46.798 1.00 18.49 N ATOM 1525 CA ARG A 170 31.083 20.290 -47.119 1.00 16.38 C ATOM 1526 C ARG A 170 29.840 21.038 -47.616 1.00 20.46 C ATOM 1527 O ARG A 170 29.009 20.452 -48.314 1.00 20.37 O ATOM 1528 CB ARG A 170 30.683 19.469 -45.869 1.00 13.27 C ATOM 1529 CG ARG A 170 31.848 18.766 -45.141 1.00 20.78 C ATOM 1530 CD ARG A 170 32.741 17.982 -46.090 1.00 23.19 C ATOM 1531 NE ARG A 170 33.788 17.301 -45.351 1.00 25.71 N ATOM 1532 CZ ARG A 170 34.845 16.731 -45.906 1.00 37.33 C ATOM 1533 NH1 ARG A 170 35.008 16.759 -47.219 1.00 22.68 N ATOM 1534 NH2 ARG A 170 35.754 16.136 -45.152 1.00 34.84 N ATOM 1535 HE ARG A 170 33.702 17.258 -44.315 1.00 0.00 H ATOM 1536 HH12 ARG A 170 35.841 16.309 -47.649 1.00 0.00 H ATOM 1537 HH11 ARG A 170 34.303 17.231 -47.821 1.00 0.00 H ATOM 1538 HH22 ARG A 170 36.583 15.689 -45.592 1.00 0.00 H ATOM 1539 HH21 ARG A 170 35.639 16.115 -44.119 1.00 0.00 H ATOM 1540 H ARG A 170 32.372 21.450 -45.799 1.00 0.00 H ATOM 1541 N TYR A 171 29.683 22.296 -47.196 1.00 16.32 N ATOM 1542 CA TYR A 171 28.533 23.108 -47.574 1.00 16.15 C ATOM 1543 C TYR A 171 28.942 24.326 -48.403 1.00 19.08 C ATOM 1544 O TYR A 171 28.626 25.463 -48.056 1.00 16.69 O ATOM 1545 CB TYR A 171 27.720 23.485 -46.316 1.00 16.48 C ATOM 1546 CG TYR A 171 26.993 22.295 -45.719 1.00 17.06 C ATOM 1547 CD1 TYR A 171 25.848 21.771 -46.326 1.00 18.55 C ATOM 1548 CD2 TYR A 171 27.445 21.691 -44.544 1.00 15.91 C ATOM 1549 CE1 TYR A 171 25.172 20.671 -45.784 1.00 18.17 C ATOM 1550 CE2 TYR A 171 26.771 20.594 -43.990 1.00 16.36 C ATOM 1551 CZ TYR A 171 25.629 20.094 -44.608 1.00 20.53 C ATOM 1552 OH TYR A 171 24.957 18.998 -44.100 1.00 18.58 O ATOM 1553 HH TYR A 171 24.649 19.198 -43.181 1.00 0.00 H ATOM 1554 H TYR A 171 30.408 22.711 -46.577 1.00 0.00 H ATOM 1555 N ARG A 172 29.639 24.085 -49.521 1.00 16.03 N ATOM 1556 CA ARG A 172 30.153 25.153 -50.384 1.00 17.05 C ATOM 1557 C ARG A 172 29.084 26.114 -50.944 1.00 20.09 C ATOM 1558 O ARG A 172 29.395 27.278 -51.161 1.00 21.45 O ATOM 1559 CB ARG A 172 31.010 24.571 -51.531 1.00 17.59 C ATOM 1560 CG ARG A 172 32.357 24.107 -51.041 1.00 25.83 C ATOM 1561 H ARG A 172 29.824 23.097 -49.789 1.00 0.00 H ATOM 1562 N GLY A 173 27.859 25.641 -51.139 1.00 16.97 N ATOM 1563 CA GLY A 173 26.744 26.470 -51.614 1.00 16.74 C ATOM 1564 C GLY A 173 26.067 27.261 -50.503 1.00 20.75 C ATOM 1565 O GLY A 173 25.028 27.876 -50.728 1.00 18.45 O ATOM 1566 H GLY A 173 27.680 24.635 -50.946 1.00 0.00 H ATOM 1567 N HIS A 174 26.638 27.223 -49.269 1.00 17.82 N ATOM 1568 CA HIS A 174 26.096 27.951 -48.114 1.00 17.07 C ATOM 1569 C HIS A 174 27.165 28.814 -47.461 1.00 21.25 C ATOM 1570 O HIS A 174 28.345 28.697 -47.789 1.00 21.59 O ATOM 1571 CB HIS A 174 25.558 26.956 -47.073 1.00 16.83 C ATOM 1572 CG HIS A 174 24.335 26.232 -47.537 1.00 18.44 C ATOM 1573 ND1 HIS A 174 24.424 25.061 -48.258 1.00 19.70 N ATOM 1574 CD2 HIS A 174 23.035 26.555 -47.390 1.00 18.96 C ATOM 1575 CE1 HIS A 174 23.177 24.696 -48.512 1.00 18.03 C ATOM 1576 NE2 HIS A 174 22.309 25.564 -48.015 1.00 18.36 N ATOM 1577 H HIS A 174 27.498 26.652 -49.137 1.00 0.00 H ATOM 1578 N LYS A 175 26.750 29.695 -46.556 1.00 16.81 N ATOM 1579 CA LYS A 175 27.704 30.443 -45.760 1.00 16.97 C ATOM 1580 C LYS A 175 27.645 29.858 -44.317 1.00 21.02 C ATOM 1581 O LYS A 175 26.661 30.066 -43.607 1.00 20.11 O ATOM 1582 CB LYS A 175 27.460 31.970 -45.828 1.00 17.81 C ATOM 1583 CG LYS A 175 28.425 32.809 -44.975 1.00 36.25 C ATOM 1584 CD LYS A 175 29.903 32.624 -45.359 1.00 52.54 C ATOM 1585 CE LYS A 175 30.822 33.451 -44.500 1.00 65.90 C ATOM 1586 NZ LYS A 175 32.243 33.207 -44.841 1.00 76.11 N ATOM 1587 HZ1 LYS A 175 32.466 32.202 -44.693 1.00 0.00 H ATOM 1588 HZ2 LYS A 175 32.407 33.457 -45.837 1.00 0.00 H ATOM 1589 HZ3 LYS A 175 32.850 33.792 -44.231 1.00 0.00 H ATOM 1590 H LYS A 175 25.731 29.849 -46.417 1.00 0.00 H ATOM 1591 N ILE A 176 28.647 29.057 -43.935 1.00 16.85 N ATOM 1592 CA ILE A 176 28.697 28.472 -42.589 1.00 17.06 C ATOM 1593 C ILE A 176 29.441 29.457 -41.704 1.00 22.16 C ATOM 1594 O ILE A 176 30.660 29.566 -41.800 1.00 21.42 O ATOM 1595 CB ILE A 176 29.320 27.041 -42.571 1.00 19.31 C ATOM 1596 CG1 ILE A 176 28.612 26.087 -43.574 1.00 18.23 C ATOM 1597 CG2 ILE A 176 29.336 26.451 -41.138 1.00 17.84 C ATOM 1598 CD1 ILE A 176 27.041 25.780 -43.328 1.00 15.87 C ATOM 1599 H ILE A 176 29.410 28.843 -44.609 1.00 0.00 H ATOM 1600 N THR A 177 28.712 30.209 -40.879 1.00 20.40 N ATOM 1601 CA THR A 177 29.320 31.258 -40.049 1.00 20.41 C ATOM 1602 C THR A 177 29.739 30.686 -38.696 1.00 21.43 C ATOM 1603 O THR A 177 29.384 29.555 -38.381 1.00 16.33 O ATOM 1604 CB THR A 177 28.313 32.416 -39.843 1.00 29.32 C ATOM 1605 OG1 THR A 177 27.225 31.939 -39.051 1.00 26.32 O ATOM 1606 CG2 THR A 177 27.781 32.998 -41.162 1.00 30.55 C ATOM 1607 HG1 THR A 177 26.573 32.671 -38.912 1.00 0.00 H ATOM 1608 H THR A 177 27.686 30.049 -40.821 1.00 0.00 H ATOM 1609 N HIS A 178 30.429 31.484 -37.870 1.00 20.94 N ATOM 1610 CA HIS A 178 30.780 31.047 -36.514 1.00 23.01 C ATOM 1611 C HIS A 178 29.528 31.011 -35.623 1.00 22.52 C ATOM 1612 O HIS A 178 29.612 30.512 -34.507 1.00 21.66 O ATOM 1613 CB HIS A 178 31.893 31.906 -35.884 1.00 26.88 C ATOM 1614 CG HIS A 178 33.225 31.719 -36.552 1.00 33.56 C ATOM 1615 ND1 HIS A 178 33.865 30.481 -36.569 1.00 36.97 N ATOM 1616 CD2 HIS A 178 33.996 32.618 -37.213 1.00 37.74 C ATOM 1617 CE1 HIS A 178 34.985 30.663 -37.254 1.00 37.14 C ATOM 1618 NE2 HIS A 178 35.116 31.938 -37.650 1.00 37.83 N ATOM 1619 H HIS A 178 30.720 32.428 -38.195 1.00 0.00 H ATOM 1620 N LYS A 179 28.355 31.458 -36.127 1.00 17.00 N ATOM 1621 CA LYS A 179 27.074 31.358 -35.389 1.00 16.75 C ATOM 1622 C LYS A 179 26.414 29.978 -35.599 1.00 18.33 C ATOM 1623 O LYS A 179 25.312 29.713 -35.087 1.00 16.02 O ATOM 1624 CB LYS A 179 26.124 32.502 -35.764 1.00 21.14 C ATOM 1625 CG LYS A 179 26.605 33.841 -35.204 1.00 27.96 C ATOM 1626 CD LYS A 179 25.498 34.904 -35.287 1.00 36.39 C ATOM 1627 CE LYS A 179 26.058 36.310 -35.302 1.00 48.50 C ATOM 1628 NZ LYS A 179 26.820 36.620 -34.061 1.00 46.51 N ATOM 1629 HZ1 LYS A 179 26.191 36.529 -33.238 1.00 0.00 H ATOM 1630 HZ2 LYS A 179 27.614 35.955 -33.968 1.00 0.00 H ATOM 1631 HZ3 LYS A 179 27.185 37.592 -34.114 1.00 0.00 H ATOM 1632 H LYS A 179 28.352 31.890 -37.073 1.00 0.00 H ATOM 1633 N MET A 180 27.087 29.109 -36.373 1.00 13.88 N ATOM 1634 CA MET A 180 26.662 27.730 -36.608 1.00 13.82 C ATOM 1635 C MET A 180 27.771 26.808 -36.114 1.00 20.21 C ATOM 1636 O MET A 180 28.956 27.189 -36.083 1.00 19.71 O ATOM 1637 CB MET A 180 26.414 27.460 -38.111 1.00 16.41 C ATOM 1638 CG MET A 180 25.283 28.263 -38.712 1.00 21.14 C ATOM 1639 SD MET A 180 25.386 28.164 -40.521 1.00 25.25 S ATOM 1640 CE MET A 180 24.166 29.281 -40.965 1.00 22.52 C ATOM 1641 H MET A 180 27.961 29.437 -36.831 1.00 0.00 H ATOM 1642 N ILE A 181 27.395 25.586 -35.761 1.00 17.49 N ATOM 1643 CA ILE A 181 28.322 24.554 -35.327 1.00 18.08 C ATOM 1644 C ILE A 181 27.867 23.272 -35.986 1.00 21.13 C ATOM 1645 O ILE A 181 26.657 23.008 -36.063 1.00 20.35 O ATOM 1646 CB ILE A 181 28.466 24.468 -33.768 1.00 22.55 C ATOM 1647 CG1 ILE A 181 29.627 23.525 -33.344 1.00 24.32 C ATOM 1648 CG2 ILE A 181 27.154 24.110 -33.070 1.00 23.53 C ATOM 1649 CD1 ILE A 181 30.247 23.899 -31.958 1.00 32.42 C ATOM 1650 H ILE A 181 26.382 25.354 -35.797 1.00 0.00 H ATOM 1651 N CYS A 182 28.819 22.511 -36.529 1.00 16.00 N ATOM 1652 CA CYS A 182 28.494 21.271 -37.225 1.00 16.35 C ATOM 1653 C CYS A 182 28.937 20.050 -36.462 1.00 18.03 C ATOM 1654 O CYS A 182 29.917 20.116 -35.709 1.00 16.61 O ATOM 1655 CB CYS A 182 29.077 21.309 -38.635 1.00 17.16 C ATOM 1656 SG CYS A 182 28.669 22.840 -39.534 1.00 20.79 S ATOM 1657 H CYS A 182 29.813 22.808 -36.454 1.00 0.00 H ATOM 1658 N ALA A 183 28.218 18.934 -36.654 1.00 15.33 N ATOM 1659 CA ALA A 183 28.541 17.682 -36.008 1.00 15.31 C ATOM 1660 C ALA A 183 28.152 16.497 -36.886 1.00 19.46 C ATOM 1661 O ALA A 183 27.079 16.481 -37.503 1.00 18.19 O ATOM 1662 CB ALA A 183 27.866 17.607 -34.634 1.00 15.45 C ATOM 1663 H ALA A 183 27.397 18.971 -37.292 1.00 0.00 H ATOM 1664 N GLY A 184 29.031 15.512 -36.948 1.00 17.57 N ATOM 1665 CA GLY A 184 28.804 14.324 -37.762 1.00 17.36 C ATOM 1666 C GLY A 184 30.075 13.546 -38.005 1.00 21.83 C ATOM 1667 O GLY A 184 31.158 14.100 -37.889 1.00 20.44 O ATOM 1668 H GLY A 184 29.911 15.587 -36.399 1.00 0.00 H ATOM 1669 N TYR A 184A 29.950 12.255 -38.289 1.00 20.72 N ATOM 1670 CA TYR A 184A 31.074 11.389 -38.639 1.00 20.80 C ATOM 1671 C TYR A 184A 31.337 11.607 -40.126 1.00 25.04 C ATOM 1672 O TYR A 184A 30.377 11.768 -40.881 1.00 24.65 O ATOM 1673 CB TYR A 184A 30.704 9.915 -38.405 1.00 21.99 C ATOM 1674 CG TYR A 184A 30.548 9.585 -36.937 1.00 24.74 C ATOM 1675 CD1 TYR A 184A 31.649 9.239 -36.158 1.00 27.27 C ATOM 1676 CD2 TYR A 184A 29.308 9.665 -36.316 1.00 25.41 C ATOM 1677 CE1 TYR A 184A 31.511 8.953 -34.798 1.00 30.02 C ATOM 1678 CE2 TYR A 184A 29.161 9.402 -34.958 1.00 26.38 C ATOM 1679 CZ TYR A 184A 30.260 9.031 -34.206 1.00 33.94 C ATOM 1680 OH TYR A 184A 30.089 8.790 -32.869 1.00 35.47 O ATOM 1681 HH TYR A 184A 29.746 9.608 -32.429 1.00 0.00 H ATOM 1682 H TYR A 184A 28.998 11.836 -38.261 1.00 0.00 H ATOM 1683 N ARG A 184B 32.607 11.549 -40.564 1.00 21.49 N ATOM 1684 CA ARG A 184B 32.943 11.724 -42.000 1.00 21.94 C ATOM 1685 C ARG A 184B 32.282 10.674 -42.874 1.00 25.08 C ATOM 1686 O ARG A 184B 31.861 10.981 -43.979 1.00 24.99 O ATOM 1687 CB ARG A 184B 34.474 11.708 -42.216 1.00 24.33 C ATOM 1688 CG ARG A 184B 35.109 13.051 -41.921 1.00 30.58 C ATOM 1689 CD ARG A 184B 36.548 13.111 -42.373 1.00 33.15 C ATOM 1690 NE ARG A 184B 37.231 14.285 -41.824 1.00 35.21 N ATOM 1691 CZ ARG A 184B 37.894 14.290 -40.673 1.00 47.18 C ATOM 1692 NH1 ARG A 184B 37.960 13.191 -39.932 1.00 37.63 N ATOM 1693 NH2 ARG A 184B 38.492 15.394 -40.251 1.00 31.94 N ATOM 1694 HE ARG A 184B 37.194 15.170 -42.369 1.00 0.00 H ATOM 1695 HH12 ARG A 184B 38.481 13.201 -39.032 1.00 0.00 H ATOM 1696 HH11 ARG A 184B 37.491 12.319 -40.252 1.00 0.00 H ATOM 1697 HH22 ARG A 184B 39.010 15.393 -39.349 1.00 0.00 H ATOM 1698 HH21 ARG A 184B 38.444 16.262 -40.822 1.00 0.00 H ATOM 1699 H ARG A 184B 33.372 11.378 -39.881 1.00 0.00 H ATOM 1700 N GLU A 185 32.174 9.438 -42.363 1.00 22.83 N ATOM 1701 CA GLU A 185 31.552 8.315 -43.043 1.00 24.14 C ATOM 1702 C GLU A 185 29.995 8.317 -42.977 1.00 29.14 C ATOM 1703 O GLU A 185 29.359 7.470 -43.610 1.00 30.48 O ATOM 1704 CB GLU A 185 32.143 6.988 -42.515 1.00 25.89 C ATOM 1705 CG GLU A 185 31.849 6.682 -41.040 1.00 39.36 C ATOM 1706 CD GLU A 185 32.829 7.179 -39.985 1.00 59.83 C ATOM 1707 OE1 GLU A 185 33.493 8.219 -40.212 1.00 38.99 O ATOM 1708 OE2 GLU A 185 32.896 6.547 -38.903 1.00 52.05 O ATOM 1709 H GLU A 185 32.563 9.272 -41.413 1.00 0.00 H ATOM 1710 N GLY A 186 29.411 9.262 -42.236 1.00 25.30 N ATOM 1711 CA GLY A 186 27.961 9.345 -42.029 1.00 24.44 C ATOM 1712 C GLY A 186 27.486 8.301 -41.034 1.00 27.94 C ATOM 1713 O GLY A 186 28.296 7.777 -40.271 1.00 28.15 O ATOM 1714 H GLY A 186 30.015 9.976 -41.782 1.00 0.00 H ATOM 1715 N GLY A 187 26.180 8.004 -41.021 1.00 24.77 N ATOM 1716 CA GLY A 187 25.616 6.977 -40.138 1.00 23.64 C ATOM 1717 C GLY A 187 24.920 7.412 -38.856 1.00 25.82 C ATOM 1718 O GLY A 187 24.054 6.697 -38.365 1.00 24.91 O ATOM 1719 H GLY A 187 25.542 8.520 -41.660 1.00 0.00 H ATOM 1720 N LYS A 188 25.318 8.546 -38.267 1.00 22.70 N ATOM 1721 CA LYS A 188 24.675 9.052 -37.039 1.00 21.75 C ATOM 1722 C LYS A 188 24.400 10.525 -37.238 1.00 25.32 C ATOM 1723 O LYS A 188 25.298 11.262 -37.657 1.00 24.80 O ATOM 1724 CB LYS A 188 25.521 8.817 -35.774 1.00 22.88 C ATOM 1725 CG LYS A 188 25.611 7.361 -35.368 1.00 29.70 C ATOM 1726 CD LYS A 188 26.350 7.175 -34.057 1.00 36.20 C ATOM 1727 CE LYS A 188 26.598 5.707 -33.806 1.00 49.20 C ATOM 1728 NZ LYS A 188 27.445 5.500 -32.605 1.00 59.94 N ATOM 1729 HZ1 LYS A 188 28.361 5.972 -32.743 1.00 0.00 H ATOM 1730 HZ2 LYS A 188 26.969 5.902 -31.773 1.00 0.00 H ATOM 1731 HZ3 LYS A 188 27.596 4.481 -32.460 1.00 0.00 H ATOM 1732 H LYS A 188 26.102 9.085 -38.686 1.00 0.00 H ATOM 1733 N ASP A 189 23.148 10.951 -37.020 1.00 20.41 N ATOM 1734 CA ASP A 189 22.756 12.350 -37.250 1.00 18.98 C ATOM 1735 C ASP A 189 21.346 12.560 -36.711 1.00 20.74 C ATOM 1736 O ASP A 189 20.614 11.595 -36.446 1.00 18.68 O ATOM 1737 CB ASP A 189 22.735 12.637 -38.787 1.00 21.35 C ATOM 1738 CG ASP A 189 22.715 14.091 -39.281 1.00 34.29 C ATOM 1739 OD1 ASP A 189 22.757 15.002 -38.445 1.00 36.89 O ATOM 1740 OD2 ASP A 189 22.589 14.305 -40.511 1.00 37.05 O ATOM 1741 H ASP A 189 22.435 10.275 -36.679 1.00 0.00 H ATOM 1742 N ALA A 190 20.962 13.831 -36.587 1.00 15.45 N ATOM 1743 CA ALA A 190 19.591 14.206 -36.307 1.00 14.84 C ATOM 1744 C ALA A 190 18.858 14.015 -37.670 1.00 18.11 C ATOM 1745 O ALA A 190 19.495 13.947 -38.739 1.00 15.80 O ATOM 1746 CB ALA A 190 19.548 15.688 -35.920 1.00 15.51 C ATOM 1747 H ALA A 190 21.674 14.582 -36.695 1.00 0.00 H ATOM 1748 N CYS A 191 17.535 13.908 -37.636 1.00 16.02 N ATOM 1749 CA CYS A 191 16.751 13.837 -38.874 1.00 16.21 C ATOM 1750 C CYS A 191 15.387 14.490 -38.609 1.00 19.42 C ATOM 1751 O CYS A 191 15.215 15.100 -37.556 1.00 17.82 O ATOM 1752 CB CYS A 191 16.637 12.415 -39.435 1.00 16.40 C ATOM 1753 SG CYS A 191 16.246 12.348 -41.214 1.00 20.16 S ATOM 1754 H CYS A 191 17.047 13.874 -36.718 1.00 0.00 H ATOM 1755 N LYS A 192 14.462 14.458 -39.582 1.00 14.94 N ATOM 1756 CA LYS A 192 13.136 15.102 -39.504 1.00 15.15 C ATOM 1757 C LYS A 192 12.429 14.834 -38.162 1.00 17.32 C ATOM 1758 O LYS A 192 12.272 13.691 -37.798 1.00 17.59 O ATOM 1759 CB LYS A 192 12.269 14.632 -40.690 1.00 17.37 C ATOM 1760 CG LYS A 192 12.852 15.095 -42.050 1.00 15.49 C ATOM 1761 CD LYS A 192 11.804 14.922 -43.140 1.00 24.11 C ATOM 1762 CE LYS A 192 12.333 15.358 -44.488 1.00 32.25 C ATOM 1763 NZ LYS A 192 11.350 15.033 -45.556 1.00 45.96 N ATOM 1764 HZ1 LYS A 192 11.183 14.007 -45.571 1.00 0.00 H ATOM 1765 HZ2 LYS A 192 10.456 15.528 -45.365 1.00 0.00 H ATOM 1766 HZ3 LYS A 192 11.726 15.338 -46.476 1.00 0.00 H ATOM 1767 H LYS A 192 14.697 13.942 -40.454 1.00 0.00 H ATOM 1768 N GLY A 193 12.023 15.881 -37.450 1.00 14.34 N ATOM 1769 CA GLY A 193 11.370 15.750 -36.137 1.00 12.96 C ATOM 1770 C GLY A 193 12.283 16.013 -34.952 1.00 14.99 C ATOM 1771 O GLY A 193 11.812 16.141 -33.822 1.00 13.83 O ATOM 1772 H GLY A 193 12.173 16.834 -37.838 1.00 0.00 H ATOM 1773 N ASP A 194 13.606 16.080 -35.188 1.00 12.41 N ATOM 1774 CA ASP A 194 14.586 16.352 -34.122 1.00 11.38 C ATOM 1775 C ASP A 194 14.859 17.832 -33.943 1.00 14.81 C ATOM 1776 O ASP A 194 15.381 18.227 -32.891 1.00 12.36 O ATOM 1777 CB ASP A 194 15.919 15.647 -34.419 1.00 12.52 C ATOM 1778 CG ASP A 194 15.801 14.161 -34.277 1.00 15.50 C ATOM 1779 OD1 ASP A 194 15.162 13.713 -33.311 1.00 15.02 O ATOM 1780 OD2 ASP A 194 16.383 13.441 -35.108 1.00 19.27 O ATOM 1781 H ASP A 194 13.950 15.934 -36.159 1.00 0.00 H ATOM 1782 N SER A 195 14.570 18.652 -34.974 1.00 11.69 N ATOM 1783 CA SER A 195 14.902 20.082 -34.905 1.00 10.13 C ATOM 1784 C SER A 195 14.358 20.797 -33.668 1.00 13.99 C ATOM 1785 O SER A 195 13.327 20.398 -33.121 1.00 14.15 O ATOM 1786 CB SER A 195 14.507 20.814 -36.174 1.00 11.61 C ATOM 1787 OG SER A 195 13.105 20.964 -36.281 1.00 14.80 O ATOM 1788 HG SER A 195 12.679 20.071 -36.292 1.00 0.00 H ATOM 1789 H SER A 195 14.109 18.270 -35.824 1.00 0.00 H ATOM 1790 N GLY A 196 15.101 21.811 -33.222 1.00 11.71 N ATOM 1791 CA GLY A 196 14.778 22.594 -32.028 1.00 12.03 C ATOM 1792 C GLY A 196 15.347 21.977 -30.766 1.00 14.46 C ATOM 1793 O GLY A 196 15.491 22.650 -29.741 1.00 13.09 O ATOM 1794 H GLY A 196 15.960 22.060 -33.753 1.00 0.00 H ATOM 1795 N GLY A 197 15.644 20.682 -30.834 1.00 13.19 N ATOM 1796 CA GLY A 197 16.190 19.943 -29.699 1.00 12.76 C ATOM 1797 C GLY A 197 17.644 20.284 -29.413 1.00 16.46 C ATOM 1798 O GLY A 197 18.310 20.963 -30.199 1.00 15.46 O ATOM 1799 H GLY A 197 15.481 20.177 -31.729 1.00 0.00 H ATOM 1800 N PRO A 198 18.181 19.762 -28.296 1.00 15.14 N ATOM 1801 CA PRO A 198 19.563 20.082 -27.928 1.00 14.45 C ATOM 1802 C PRO A 198 20.656 19.244 -28.580 1.00 16.96 C ATOM 1803 O PRO A 198 20.467 18.064 -28.890 1.00 15.64 O ATOM 1804 CB PRO A 198 19.582 19.766 -26.414 1.00 15.53 C ATOM 1805 CG PRO A 198 18.626 18.629 -26.260 1.00 19.05 C ATOM 1806 CD PRO A 198 17.516 18.946 -27.253 1.00 16.11 C ATOM 1807 N LEU A 199 21.838 19.867 -28.700 1.00 12.79 N ATOM 1808 CA LEU A 199 23.103 19.194 -28.938 1.00 12.69 C ATOM 1809 C LEU A 199 23.782 19.449 -27.556 1.00 16.16 C ATOM 1810 O LEU A 199 24.144 20.594 -27.245 1.00 15.64 O ATOM 1811 CB LEU A 199 23.913 19.784 -30.095 1.00 12.50 C ATOM 1812 CG LEU A 199 25.325 19.189 -30.282 1.00 15.94 C ATOM 1813 CD1 LEU A 199 25.274 17.683 -30.638 1.00 17.28 C ATOM 1814 CD2 LEU A 199 26.083 19.953 -31.324 1.00 18.95 C ATOM 1815 H LEU A 199 21.849 20.904 -28.617 1.00 0.00 H ATOM 1816 N SER A 200 23.766 18.433 -26.681 1.00 12.70 N ATOM 1817 CA SER A 200 24.231 18.557 -25.295 1.00 12.96 C ATOM 1818 C SER A 200 25.644 18.025 -25.162 1.00 17.81 C ATOM 1819 O SER A 200 25.898 16.901 -25.580 1.00 16.39 O ATOM 1820 CB SER A 200 23.306 17.790 -24.349 1.00 15.46 C ATOM 1821 OG SER A 200 21.935 18.072 -24.572 1.00 18.68 O ATOM 1822 HG SER A 200 21.694 17.822 -25.499 1.00 0.00 H ATOM 1823 H SER A 200 23.406 17.511 -27.001 1.00 0.00 H ATOM 1824 N CYS A 201 26.566 18.839 -24.616 1.00 16.91 N ATOM 1825 CA CYS A 201 27.961 18.419 -24.444 1.00 17.59 C ATOM 1826 C CYS A 201 28.350 18.439 -22.957 1.00 20.22 C ATOM 1827 O CYS A 201 28.088 19.409 -22.255 1.00 18.53 O ATOM 1828 CB CYS A 201 28.922 19.266 -25.287 1.00 17.48 C ATOM 1829 SG CYS A 201 28.550 19.295 -27.068 1.00 20.86 S ATOM 1830 H CYS A 201 26.282 19.791 -24.308 1.00 0.00 H ATOM 1831 N LYS A 202 28.994 17.358 -22.491 1.00 18.69 N ATOM 1832 CA LYS A 202 29.447 17.266 -21.112 1.00 19.24 C ATOM 1833 C LYS A 202 30.914 17.748 -21.046 1.00 23.34 C ATOM 1834 O LYS A 202 31.793 17.162 -21.693 1.00 22.72 O ATOM 1835 CB LYS A 202 29.296 15.833 -20.581 1.00 21.16 C ATOM 1836 CG LYS A 202 29.445 15.754 -19.052 1.00 40.60 C ATOM 1837 CD LYS A 202 29.392 14.323 -18.527 1.00 53.88 C ATOM 1838 CE LYS A 202 30.684 13.574 -18.731 1.00 71.08 C ATOM 1839 NZ LYS A 202 30.596 12.193 -18.191 1.00 85.25 N ATOM 1840 HZ1 LYS A 202 30.393 12.233 -17.172 1.00 0.00 H ATOM 1841 HZ2 LYS A 202 29.834 11.680 -18.678 1.00 0.00 H ATOM 1842 HZ3 LYS A 202 31.500 11.703 -18.346 1.00 0.00 H ATOM 1843 H LYS A 202 29.175 16.562 -23.135 1.00 0.00 H ATOM 1844 N HIS A 203 31.143 18.845 -20.321 1.00 21.01 N ATOM 1845 CA HIS A 203 32.447 19.514 -20.208 1.00 22.47 C ATOM 1846 C HIS A 203 32.741 19.726 -18.724 1.00 26.95 C ATOM 1847 O HIS A 203 31.960 20.376 -18.037 1.00 26.92 O ATOM 1848 CB HIS A 203 32.391 20.851 -20.987 1.00 23.97 C ATOM 1849 CG HIS A 203 33.630 21.687 -20.918 1.00 27.34 C ATOM 1850 ND1 HIS A 203 34.821 21.252 -21.459 1.00 28.86 N ATOM 1851 CD2 HIS A 203 33.813 22.920 -20.395 1.00 28.81 C ATOM 1852 CE1 HIS A 203 35.698 22.210 -21.229 1.00 27.84 C ATOM 1853 NE2 HIS A 203 35.142 23.232 -20.587 1.00 28.57 N ATOM 1854 H HIS A 203 30.342 19.255 -19.799 1.00 0.00 H ATOM 1855 N ASN A 204 33.831 19.121 -18.217 1.00 25.35 N ATOM 1856 CA ASN A 204 34.208 19.156 -16.790 1.00 25.36 C ATOM 1857 C ASN A 204 33.032 18.705 -15.892 1.00 29.84 C ATOM 1858 O ASN A 204 32.674 19.390 -14.938 1.00 29.78 O ATOM 1859 CB ASN A 204 34.799 20.522 -16.396 1.00 24.68 C ATOM 1860 CG ASN A 204 36.063 20.885 -17.156 1.00 39.77 C ATOM 1861 OD1 ASN A 204 36.873 20.029 -17.525 1.00 33.37 O ATOM 1862 ND2 ASN A 204 36.244 22.164 -17.432 1.00 30.29 N ATOM 1863 HD22 ASN A 204 35.549 22.868 -17.112 1.00 0.00 H ATOM 1864 HD21 ASN A 204 37.081 22.467 -17.970 1.00 0.00 H ATOM 1865 H ASN A 204 34.446 18.596 -18.871 1.00 0.00 H ATOM 1866 N GLU A 205 32.386 17.582 -16.286 1.00 28.46 N ATOM 1867 CA GLU A 205 31.233 16.922 -15.641 1.00 29.22 C ATOM 1868 C GLU A 205 29.949 17.780 -15.605 1.00 30.83 C ATOM 1869 O GLU A 205 29.030 17.464 -14.846 1.00 30.21 O ATOM 1870 CB GLU A 205 31.600 16.409 -14.219 1.00 30.88 C ATOM 1871 CG GLU A 205 32.624 15.283 -14.200 1.00 38.60 C ATOM 1872 CD GLU A 205 32.284 14.054 -15.029 1.00 66.16 C ATOM 1873 OE1 GLU A 205 31.130 13.572 -14.949 1.00 60.69 O ATOM 1874 OE2 GLU A 205 33.176 13.574 -15.764 1.00 65.80 O ATOM 1875 H GLU A 205 32.746 17.128 -17.150 1.00 0.00 H ATOM 1876 N VAL A 206 29.897 18.874 -16.388 1.00 25.36 N ATOM 1877 CA VAL A 206 28.714 19.745 -16.448 1.00 23.94 C ATOM 1878 C VAL A 206 28.144 19.660 -17.884 1.00 24.31 C ATOM 1879 O VAL A 206 28.902 19.792 -18.844 1.00 21.33 O ATOM 1880 CB VAL A 206 29.048 21.211 -16.028 1.00 28.28 C ATOM 1881 CG1 VAL A 206 27.820 22.119 -16.130 1.00 27.59 C ATOM 1882 CG2 VAL A 206 29.639 21.276 -14.611 1.00 28.85 C ATOM 1883 H VAL A 206 30.724 19.112 -16.972 1.00 0.00 H ATOM 1884 N TRP A 207 26.828 19.452 -18.027 1.00 20.85 N ATOM 1885 CA TRP A 207 26.206 19.436 -19.355 1.00 19.71 C ATOM 1886 C TRP A 207 25.941 20.877 -19.784 1.00 19.63 C ATOM 1887 O TRP A 207 25.451 21.673 -18.979 1.00 18.21 O ATOM 1888 CB TRP A 207 24.905 18.620 -19.355 1.00 18.22 C ATOM 1889 CG TRP A 207 25.145 17.141 -19.253 1.00 18.67 C ATOM 1890 CD1 TRP A 207 25.186 16.402 -18.110 1.00 21.86 C ATOM 1891 CD2 TRP A 207 25.472 16.240 -20.329 1.00 18.00 C ATOM 1892 NE1 TRP A 207 25.452 15.085 -18.407 1.00 21.75 N ATOM 1893 CE2 TRP A 207 25.651 14.959 -19.760 1.00 22.79 C ATOM 1894 CE3 TRP A 207 25.613 16.389 -21.725 1.00 18.22 C ATOM 1895 CZ2 TRP A 207 25.981 13.828 -20.536 1.00 21.93 C ATOM 1896 CZ3 TRP A 207 25.944 15.280 -22.501 1.00 19.48 C ATOM 1897 CH2 TRP A 207 26.121 14.014 -21.916 1.00 20.65 C ATOM 1898 HE1 TRP A 207 25.495 14.308 -17.717 1.00 0.00 H ATOM 1899 H TRP A 207 26.239 19.300 -17.184 1.00 0.00 H ATOM 1900 N HIS A 208 26.293 21.213 -21.039 1.00 16.73 N ATOM 1901 CA HIS A 208 26.043 22.546 -21.613 1.00 16.57 C ATOM 1902 C HIS A 208 25.279 22.397 -22.915 1.00 17.87 C ATOM 1903 O HIS A 208 25.484 21.425 -23.661 1.00 18.50 O ATOM 1904 CB HIS A 208 27.339 23.343 -21.859 1.00 17.70 C ATOM 1905 CG HIS A 208 28.094 23.667 -20.606 1.00 22.44 C ATOM 1906 ND1 HIS A 208 27.822 24.803 -19.871 1.00 25.12 N ATOM 1907 CD2 HIS A 208 29.080 22.978 -19.991 1.00 24.83 C ATOM 1908 CE1 HIS A 208 28.658 24.776 -18.837 1.00 24.12 C ATOM 1909 NE2 HIS A 208 29.434 23.704 -18.875 1.00 24.27 N ATOM 1910 H HIS A 208 26.763 20.498 -21.631 1.00 0.00 H ATOM 1911 N LEU A 209 24.390 23.362 -23.176 1.00 14.51 N ATOM 1912 CA LEU A 209 23.573 23.372 -24.383 1.00 12.94 C ATOM 1913 C LEU A 209 24.418 24.029 -25.491 1.00 17.16 C ATOM 1914 O LEU A 209 24.373 25.241 -25.688 1.00 16.57 O ATOM 1915 CB LEU A 209 22.260 24.142 -24.124 1.00 12.09 C ATOM 1916 CG LEU A 209 21.277 24.157 -25.312 1.00 14.52 C ATOM 1917 CD1 LEU A 209 20.967 22.754 -25.768 1.00 12.88 C ATOM 1918 CD2 LEU A 209 20.022 24.877 -24.954 1.00 16.58 C ATOM 1919 H LEU A 209 24.277 24.136 -22.490 1.00 0.00 H ATOM 1920 N VAL A 210 25.228 23.228 -26.157 1.00 14.47 N ATOM 1921 CA VAL A 210 26.159 23.743 -27.174 1.00 15.03 C ATOM 1922 C VAL A 210 25.455 24.083 -28.508 1.00 17.54 C ATOM 1923 O VAL A 210 25.757 25.105 -29.108 1.00 15.40 O ATOM 1924 CB VAL A 210 27.347 22.759 -27.331 1.00 17.86 C ATOM 1925 CG1 VAL A 210 28.212 23.073 -28.567 1.00 17.87 C ATOM 1926 CG2 VAL A 210 28.189 22.763 -26.057 1.00 17.33 C ATOM 1927 H VAL A 210 25.208 22.207 -25.958 1.00 0.00 H ATOM 1928 N GLY A 211 24.511 23.255 -28.928 1.00 12.14 N ATOM 1929 CA GLY A 211 23.792 23.500 -30.165 1.00 11.69 C ATOM 1930 C GLY A 211 22.299 23.286 -30.099 1.00 15.61 C ATOM 1931 O GLY A 211 21.784 22.668 -29.165 1.00 16.06 O ATOM 1932 H GLY A 211 24.280 22.414 -28.361 1.00 0.00 H ATOM 1933 N ILE A 212 21.600 23.821 -31.112 1.00 11.52 N ATOM 1934 CA ILE A 212 20.162 23.613 -31.330 1.00 9.97 C ATOM 1935 C ILE A 212 20.107 22.943 -32.726 1.00 12.34 C ATOM 1936 O ILE A 212 20.558 23.535 -33.705 1.00 12.87 O ATOM 1937 CB ILE A 212 19.321 24.918 -31.319 1.00 13.44 C ATOM 1938 CG1 ILE A 212 19.488 25.720 -30.017 1.00 14.47 C ATOM 1939 CG2 ILE A 212 17.803 24.609 -31.634 1.00 12.27 C ATOM 1940 CD1 ILE A 212 19.051 27.183 -30.152 1.00 14.68 C ATOM 1941 H ILE A 212 22.111 24.424 -31.788 1.00 0.00 H ATOM 1942 N THR A 213 19.517 21.749 -32.817 1.00 9.92 N ATOM 1943 CA THR A 213 19.321 20.994 -34.062 1.00 10.67 C ATOM 1944 C THR A 213 18.632 21.873 -35.084 1.00 13.56 C ATOM 1945 O THR A 213 17.521 22.347 -34.838 1.00 12.29 O ATOM 1946 CB THR A 213 18.570 19.702 -33.767 1.00 11.76 C ATOM 1947 OG1 THR A 213 19.310 19.022 -32.749 1.00 13.67 O ATOM 1948 CG2 THR A 213 18.421 18.825 -35.012 1.00 12.04 C ATOM 1949 HG1 THR A 213 18.856 18.172 -32.525 1.00 0.00 H ATOM 1950 H THR A 213 19.168 21.319 -31.937 1.00 0.00 H ATOM 1951 N SER A 214 19.292 22.102 -36.229 1.00 12.29 N ATOM 1952 CA SER A 214 18.751 23.066 -37.170 1.00 12.69 C ATOM 1953 C SER A 214 18.475 22.508 -38.589 1.00 17.12 C ATOM 1954 O SER A 214 17.295 22.406 -38.983 1.00 15.04 O ATOM 1955 CB SER A 214 19.650 24.303 -37.196 1.00 13.63 C ATOM 1956 OG SER A 214 19.212 25.290 -38.114 1.00 17.53 O ATOM 1957 HG SER A 214 18.300 25.587 -37.868 1.00 0.00 H ATOM 1958 H SER A 214 20.177 21.597 -36.439 1.00 0.00 H ATOM 1959 N TRP A 215 19.529 22.110 -39.334 1.00 14.86 N ATOM 1960 CA TRP A 215 19.339 21.597 -40.710 1.00 15.18 C ATOM 1961 C TRP A 215 20.522 20.760 -41.181 1.00 15.04 C ATOM 1962 O TRP A 215 21.578 20.761 -40.551 1.00 14.19 O ATOM 1963 CB TRP A 215 19.118 22.794 -41.684 1.00 13.94 C ATOM 1964 CG TRP A 215 20.313 23.718 -41.794 1.00 15.32 C ATOM 1965 CD1 TRP A 215 20.660 24.724 -40.935 1.00 17.98 C ATOM 1966 CD2 TRP A 215 21.302 23.723 -42.841 1.00 15.68 C ATOM 1967 NE1 TRP A 215 21.812 25.350 -41.373 1.00 17.67 N ATOM 1968 CE2 TRP A 215 22.200 24.783 -42.567 1.00 19.49 C ATOM 1969 CE3 TRP A 215 21.485 22.965 -44.018 1.00 16.80 C ATOM 1970 CZ2 TRP A 215 23.300 25.065 -43.391 1.00 18.89 C ATOM 1971 CZ3 TRP A 215 22.587 23.239 -44.824 1.00 18.17 C ATOM 1972 CH2 TRP A 215 23.474 24.279 -44.513 1.00 18.47 C ATOM 1973 HE1 TRP A 215 22.305 26.123 -40.882 1.00 0.00 H ATOM 1974 H TRP A 215 20.488 22.165 -38.935 1.00 0.00 H ATOM 1975 N GLY A 216 20.354 20.100 -42.320 1.00 14.12 N ATOM 1976 CA GLY A 216 21.419 19.310 -42.947 1.00 15.55 C ATOM 1977 C GLY A 216 21.055 18.932 -44.368 1.00 20.16 C ATOM 1978 O GLY A 216 19.891 19.069 -44.758 1.00 17.99 O ATOM 1979 H GLY A 216 19.427 20.145 -42.789 1.00 0.00 H ATOM 1980 N GLU A 217 22.035 18.465 -45.155 1.00 18.45 N ATOM 1981 CA GLU A 217 21.777 18.005 -46.515 1.00 18.51 C ATOM 1982 C GLU A 217 21.508 16.526 -46.390 1.00 23.81 C ATOM 1983 O GLU A 217 22.448 15.757 -46.180 1.00 25.12 O ATOM 1984 CB GLU A 217 22.978 18.281 -47.421 1.00 19.27 C ATOM 1985 CG GLU A 217 22.686 17.992 -48.894 1.00 27.01 C ATOM 1986 CD GLU A 217 23.864 18.351 -49.772 1.00 36.10 C ATOM 1987 OE1 GLU A 217 24.162 19.560 -49.908 1.00 34.95 O ATOM 1988 OE2 GLU A 217 24.565 17.418 -50.218 1.00 39.83 O ATOM 1989 H GLU A 217 23.006 18.430 -44.785 1.00 0.00 H ATOM 1990 N GLY A 218 20.230 16.146 -46.431 1.00 21.97 N ATOM 1991 CA GLY A 218 19.803 14.773 -46.156 1.00 22.60 C ATOM 1992 C GLY A 218 20.080 14.448 -44.691 1.00 26.60 C ATOM 1993 O GLY A 218 20.345 15.369 -43.903 1.00 26.21 O ATOM 1994 H GLY A 218 19.507 16.855 -46.668 1.00 0.00 H ATOM 1995 N CYS A 219 20.040 13.163 -44.300 1.00 22.08 N ATOM 1996 CA CYS A 219 20.342 12.763 -42.915 1.00 22.15 C ATOM 1997 C CYS A 219 21.447 11.750 -42.881 1.00 26.09 C ATOM 1998 O CYS A 219 21.371 10.770 -43.616 1.00 27.21 O ATOM 1999 CB CYS A 219 19.107 12.216 -42.207 1.00 22.39 C ATOM 2000 SG CYS A 219 17.709 13.347 -42.206 1.00 26.17 S ATOM 2001 H CYS A 219 19.789 12.431 -44.994 1.00 0.00 H ATOM 2002 N ALA A 220 22.433 11.953 -42.009 1.00 21.86 N ATOM 2003 CA ALA A 220 23.582 11.068 -41.764 1.00 23.03 C ATOM 2004 C ALA A 220 24.341 10.650 -43.037 1.00 25.94 C ATOM 2005 O ALA A 220 24.856 9.532 -43.093 1.00 26.97 O ATOM 2006 CB ALA A 220 23.138 9.831 -40.951 1.00 23.36 C ATOM 2007 H ALA A 220 22.386 12.825 -41.444 1.00 0.00 H ATOM 2008 N GLN A 221 24.403 11.523 -44.047 1.00 21.16 N ATOM 2009 CA GLN A 221 25.104 11.165 -45.290 1.00 20.93 C ATOM 2010 C GLN A 221 26.593 11.376 -45.080 1.00 22.95 C ATOM 2011 O GLN A 221 26.990 12.210 -44.252 1.00 19.79 O ATOM 2012 CB GLN A 221 24.661 12.030 -46.465 1.00 21.98 C ATOM 2013 CG GLN A 221 23.221 11.874 -46.934 1.00 30.33 C ATOM 2014 CD GLN A 221 23.174 12.484 -48.325 1.00 51.19 C ATOM 2015 OE1 GLN A 221 22.885 11.804 -49.313 1.00 45.11 O ATOM 2016 NE2 GLN A 221 23.472 13.789 -48.453 1.00 39.93 N ATOM 2017 HE22 GLN A 221 23.714 14.352 -47.613 1.00 0.00 H ATOM 2018 HE21 GLN A 221 23.460 14.235 -49.392 1.00 0.00 H ATOM 2019 H GLN A 221 23.955 12.457 -43.954 1.00 0.00 H ATOM 2020 N ARG A 222 27.424 10.629 -45.817 1.00 20.58 N ATOM 2021 CA ARG A 222 28.872 10.800 -45.704 1.00 20.89 C ATOM 2022 C ARG A 222 29.279 12.230 -46.078 1.00 20.59 C ATOM 2023 O ARG A 222 28.740 12.789 -47.029 1.00 19.13 O ATOM 2024 CB ARG A 222 29.659 9.739 -46.509 1.00 24.99 C ATOM 2025 CG ARG A 222 29.383 9.685 -47.996 1.00 42.48 C ATOM 2026 CD ARG A 222 30.312 8.706 -48.696 1.00 58.43 C ATOM 2027 NE ARG A 222 31.621 9.297 -48.987 1.00 64.83 N ATOM 2028 CZ ARG A 222 32.728 9.056 -48.292 1.00 80.16 C ATOM 2029 NH1 ARG A 222 32.705 8.222 -47.256 1.00 65.57 N ATOM 2030 NH2 ARG A 222 33.871 9.638 -48.632 1.00 68.71 N ATOM 2031 HE ARG A 222 31.688 9.950 -49.793 1.00 0.00 H ATOM 2032 HH12 ARG A 222 33.575 8.038 -46.717 1.00 0.00 H ATOM 2033 HH11 ARG A 222 31.817 7.754 -46.985 1.00 0.00 H ATOM 2034 HH22 ARG A 222 34.735 9.447 -48.085 1.00 0.00 H ATOM 2035 HH21 ARG A 222 33.903 10.286 -49.445 1.00 0.00 H ATOM 2036 H ARG A 222 27.037 9.922 -46.475 1.00 0.00 H ATOM 2037 N GLU A 223 30.149 12.839 -45.261 1.00 17.23 N ATOM 2038 CA GLU A 223 30.700 14.194 -45.464 1.00 17.66 C ATOM 2039 C GLU A 223 29.634 15.292 -45.524 1.00 20.81 C ATOM 2040 O GLU A 223 29.838 16.328 -46.150 1.00 19.17 O ATOM 2041 CB GLU A 223 31.620 14.222 -46.707 1.00 19.43 C ATOM 2042 CG GLU A 223 32.839 13.327 -46.499 1.00 24.39 C ATOM 2043 CD GLU A 223 33.841 13.210 -47.628 1.00 32.62 C ATOM 2044 OE1 GLU A 223 33.517 13.589 -48.776 1.00 23.46 O ATOM 2045 OE2 GLU A 223 34.957 12.715 -47.358 1.00 21.84 O ATOM 2046 H GLU A 223 30.461 12.316 -44.418 1.00 0.00 H ATOM 2047 N ARG A 224 28.494 15.063 -44.868 1.00 17.87 N ATOM 2048 CA ARG A 224 27.421 16.054 -44.796 1.00 17.31 C ATOM 2049 C ARG A 224 26.989 16.154 -43.314 1.00 20.14 C ATOM 2050 O ARG A 224 25.992 15.559 -42.903 1.00 19.21 O ATOM 2051 CB ARG A 224 26.252 15.701 -45.748 1.00 17.22 C ATOM 2052 CG ARG A 224 26.579 15.829 -47.262 1.00 17.09 C ATOM 2053 CD ARG A 224 26.950 17.261 -47.696 1.00 25.81 C ATOM 2054 NE ARG A 224 27.253 17.354 -49.132 1.00 24.24 N ATOM 2055 CZ ARG A 224 28.445 17.110 -49.671 1.00 38.08 C ATOM 2056 NH1 ARG A 224 29.474 16.767 -48.901 1.00 24.62 N ATOM 2057 NH2 ARG A 224 28.613 17.186 -50.982 1.00 27.01 N ATOM 2058 HE ARG A 224 26.481 17.630 -49.772 1.00 0.00 H ATOM 2059 HH12 ARG A 224 30.403 16.578 -49.328 1.00 0.00 H ATOM 2060 HH11 ARG A 224 29.350 16.688 -47.871 1.00 0.00 H ATOM 2061 HH22 ARG A 224 29.546 16.994 -51.399 1.00 0.00 H ATOM 2062 HH21 ARG A 224 27.812 17.437 -51.595 1.00 0.00 H ATOM 2063 H ARG A 224 28.364 14.148 -44.391 1.00 0.00 H ATOM 2064 N PRO A 225 27.793 16.823 -42.465 1.00 17.15 N ATOM 2065 CA PRO A 225 27.429 16.889 -41.036 1.00 16.30 C ATOM 2066 C PRO A 225 26.156 17.700 -40.784 1.00 18.58 C ATOM 2067 O PRO A 225 25.805 18.564 -41.579 1.00 16.47 O ATOM 2068 CB PRO A 225 28.659 17.560 -40.400 1.00 17.69 C ATOM 2069 CG PRO A 225 29.274 18.362 -41.484 1.00 21.55 C ATOM 2070 CD PRO A 225 29.032 17.591 -42.744 1.00 17.99 C ATOM 2071 N GLY A 226 25.494 17.421 -39.669 1.00 14.95 N ATOM 2072 CA GLY A 226 24.332 18.185 -39.240 1.00 14.45 C ATOM 2073 C GLY A 226 24.771 19.578 -38.843 1.00 17.06 C ATOM 2074 O GLY A 226 25.916 19.766 -38.421 1.00 16.64 O ATOM 2075 H GLY A 226 25.817 16.627 -39.080 1.00 0.00 H ATOM 2076 N VAL A 227 23.907 20.577 -39.082 1.00 13.02 N ATOM 2077 CA VAL A 227 24.200 21.979 -38.791 1.00 12.64 C ATOM 2078 C VAL A 227 23.316 22.426 -37.637 1.00 16.30 C ATOM 2079 O VAL A 227 22.112 22.187 -37.640 1.00 14.84 O ATOM 2080 CB VAL A 227 24.098 22.911 -40.024 1.00 16.13 C ATOM 2081 CG1 VAL A 227 24.576 24.324 -39.669 1.00 17.18 C ATOM 2082 CG2 VAL A 227 24.906 22.349 -41.208 1.00 15.95 C ATOM 2083 H VAL A 227 22.982 20.341 -39.495 1.00 0.00 H ATOM 2084 N TYR A 228 23.942 23.027 -36.619 1.00 14.08 N ATOM 2085 CA TYR A 228 23.281 23.415 -35.381 1.00 12.93 C ATOM 2086 C TYR A 228 23.529 24.887 -35.122 1.00 15.28 C ATOM 2087 O TYR A 228 24.592 25.405 -35.485 1.00 13.70 O ATOM 2088 CB TYR A 228 23.873 22.588 -34.208 1.00 12.95 C ATOM 2089 CG TYR A 228 23.684 21.086 -34.345 1.00 12.75 C ATOM 2090 CD1 TYR A 228 24.450 20.337 -35.247 1.00 13.93 C ATOM 2091 CD2 TYR A 228 22.741 20.416 -33.580 1.00 11.81 C ATOM 2092 CE1 TYR A 228 24.249 18.961 -35.395 1.00 13.54 C ATOM 2093 CE2 TYR A 228 22.531 19.051 -33.721 1.00 12.20 C ATOM 2094 CZ TYR A 228 23.287 18.326 -34.619 1.00 17.63 C ATOM 2095 OH TYR A 228 23.030 16.988 -34.712 1.00 17.00 O ATOM 2096 HH TYR A 228 23.633 16.583 -35.385 1.00 0.00 H ATOM 2097 H TYR A 228 24.958 23.228 -36.717 1.00 0.00 H ATOM 2098 N THR A 229 22.587 25.548 -34.441 1.00 12.43 N ATOM 2099 CA THR A 229 22.770 26.957 -34.038 1.00 12.51 C ATOM 2100 C THR A 229 23.820 26.903 -32.903 1.00 16.26 C ATOM 2101 O THR A 229 23.681 26.084 -31.975 1.00 13.62 O ATOM 2102 CB THR A 229 21.441 27.514 -33.517 1.00 13.44 C ATOM 2103 OG1 THR A 229 20.515 27.476 -34.592 1.00 14.47 O ATOM 2104 CG2 THR A 229 21.544 28.953 -32.981 1.00 13.33 C ATOM 2105 HG1 THR A 229 19.642 27.831 -34.287 1.00 0.00 H ATOM 2106 H THR A 229 21.705 25.058 -34.189 1.00 0.00 H ATOM 2107 N ASN A 230 24.872 27.720 -33.007 1.00 13.08 N ATOM 2108 CA ASN A 230 25.976 27.738 -32.037 1.00 13.23 C ATOM 2109 C ASN A 230 25.555 28.624 -30.876 1.00 17.15 C ATOM 2110 O ASN A 230 25.703 29.851 -30.929 1.00 15.00 O ATOM 2111 CB ASN A 230 27.256 28.279 -32.720 1.00 13.06 C ATOM 2112 CG ASN A 230 28.502 28.135 -31.892 1.00 26.38 C ATOM 2113 OD1 ASN A 230 28.497 27.470 -30.864 1.00 21.30 O ATOM 2114 ND2 ASN A 230 29.601 28.748 -32.324 1.00 22.49 N ATOM 2115 HD22 ASN A 230 29.574 29.306 -33.201 1.00 0.00 H ATOM 2116 HD21 ASN A 230 30.487 28.669 -31.785 1.00 0.00 H ATOM 2117 H ASN A 230 24.912 28.375 -33.814 1.00 0.00 H ATOM 2118 N VAL A 231 24.963 27.999 -29.845 1.00 14.29 N ATOM 2119 CA VAL A 231 24.321 28.679 -28.711 1.00 13.12 C ATOM 2120 C VAL A 231 25.222 29.707 -28.028 1.00 16.98 C ATOM 2121 O VAL A 231 24.723 30.775 -27.671 1.00 15.57 O ATOM 2122 CB VAL A 231 23.719 27.676 -27.705 1.00 15.17 C ATOM 2123 CG1 VAL A 231 23.134 28.380 -26.480 1.00 13.81 C ATOM 2124 CG2 VAL A 231 22.649 26.805 -28.391 1.00 15.11 C ATOM 2125 H VAL A 231 24.959 26.959 -29.849 1.00 0.00 H ATOM 2126 N VAL A 232 26.523 29.400 -27.833 1.00 15.42 N ATOM 2127 CA VAL A 232 27.441 30.347 -27.164 1.00 16.05 C ATOM 2128 C VAL A 232 27.428 31.752 -27.816 1.00 20.60 C ATOM 2129 O VAL A 232 27.547 32.750 -27.109 1.00 20.12 O ATOM 2130 CB VAL A 232 28.875 29.782 -27.001 1.00 19.47 C ATOM 2131 CG1 VAL A 232 29.650 29.789 -28.324 1.00 19.07 C ATOM 2132 CG2 VAL A 232 29.633 30.540 -25.909 1.00 19.03 C ATOM 2133 H VAL A 232 26.885 28.481 -28.159 1.00 0.00 H ATOM 2134 N GLU A 233 27.210 31.822 -29.149 1.00 17.60 N ATOM 2135 CA GLU A 233 27.183 33.076 -29.898 1.00 16.66 C ATOM 2136 C GLU A 233 25.904 33.870 -29.650 1.00 19.19 C ATOM 2137 O GLU A 233 25.789 35.009 -30.090 1.00 18.73 O ATOM 2138 CB GLU A 233 27.397 32.798 -31.404 1.00 17.81 C ATOM 2139 CG GLU A 233 28.764 32.192 -31.722 1.00 18.84 C ATOM 2140 CD GLU A 233 29.977 33.024 -31.335 1.00 34.87 C ATOM 2141 OE1 GLU A 233 29.914 34.266 -31.470 1.00 25.54 O ATOM 2142 OE2 GLU A 233 30.996 32.434 -30.906 1.00 33.73 O ATOM 2143 H GLU A 233 27.053 30.935 -29.669 1.00 0.00 H ATOM 2144 N TYR A 234 24.944 33.275 -28.933 1.00 15.55 N ATOM 2145 CA TYR A 234 23.650 33.892 -28.647 1.00 15.93 C ATOM 2146 C TYR A 234 23.387 34.098 -27.141 1.00 18.93 C ATOM 2147 O TYR A 234 22.273 34.476 -26.775 1.00 18.17 O ATOM 2148 CB TYR A 234 22.538 33.024 -29.243 1.00 16.95 C ATOM 2149 CG TYR A 234 22.549 33.015 -30.752 1.00 16.94 C ATOM 2150 CD1 TYR A 234 21.917 34.020 -31.481 1.00 16.71 C ATOM 2151 CD2 TYR A 234 23.238 32.032 -31.456 1.00 17.42 C ATOM 2152 CE1 TYR A 234 21.933 34.024 -32.875 1.00 16.53 C ATOM 2153 CE2 TYR A 234 23.258 32.025 -32.856 1.00 18.28 C ATOM 2154 CZ TYR A 234 22.600 33.023 -33.560 1.00 20.96 C ATOM 2155 OH TYR A 234 22.616 33.039 -34.941 1.00 19.85 O ATOM 2156 HH TYR A 234 22.210 32.204 -35.284 1.00 0.00 H ATOM 2157 H TYR A 234 25.128 32.322 -28.559 1.00 0.00 H ATOM 2158 N VAL A 235 24.394 33.860 -26.277 1.00 15.97 N ATOM 2159 CA VAL A 235 24.231 34.041 -24.813 1.00 17.58 C ATOM 2160 C VAL A 235 23.706 35.456 -24.457 1.00 21.93 C ATOM 2161 O VAL A 235 22.720 35.562 -23.725 1.00 20.89 O ATOM 2162 CB VAL A 235 25.504 33.657 -24.004 1.00 21.59 C ATOM 2163 CG1 VAL A 235 25.385 34.068 -22.536 1.00 21.24 C ATOM 2164 CG2 VAL A 235 25.773 32.153 -24.108 1.00 21.83 C ATOM 2165 H VAL A 235 25.312 33.540 -26.647 1.00 0.00 H ATOM 2166 N ASP A 236 24.300 36.523 -25.036 1.00 19.55 N ATOM 2167 CA ASP A 236 23.820 37.887 -24.771 1.00 19.02 C ATOM 2168 C ASP A 236 22.377 38.085 -25.227 1.00 21.88 C ATOM 2169 O ASP A 236 21.591 38.679 -24.483 1.00 21.47 O ATOM 2170 CB ASP A 236 24.750 38.940 -25.392 1.00 20.33 C ATOM 2171 CG ASP A 236 26.085 39.044 -24.672 1.00 30.05 C ATOM 2172 OD1 ASP A 236 26.151 38.667 -23.479 1.00 29.54 O ATOM 2173 OD2 ASP A 236 27.063 39.476 -25.302 1.00 40.86 O ATOM 2174 H ASP A 236 25.106 36.377 -25.677 1.00 0.00 H ATOM 2175 N TRP A 237 22.019 37.555 -26.427 1.00 16.63 N ATOM 2176 CA TRP A 237 20.644 37.625 -26.945 1.00 16.75 C ATOM 2177 C TRP A 237 19.673 36.919 -25.975 1.00 18.93 C ATOM 2178 O TRP A 237 18.646 37.486 -25.627 1.00 18.86 O ATOM 2179 CB TRP A 237 20.563 37.041 -28.373 1.00 16.10 C ATOM 2180 CG TRP A 237 19.189 37.118 -28.989 1.00 17.08 C ATOM 2181 CD1 TRP A 237 18.636 38.176 -29.651 1.00 20.37 C ATOM 2182 CD2 TRP A 237 18.182 36.092 -28.950 1.00 16.51 C ATOM 2183 NE1 TRP A 237 17.347 37.869 -30.043 1.00 20.09 N ATOM 2184 CE2 TRP A 237 17.051 36.586 -29.640 1.00 20.71 C ATOM 2185 CE3 TRP A 237 18.135 34.793 -28.406 1.00 17.20 C ATOM 2186 CZ2 TRP A 237 15.879 35.833 -29.789 1.00 19.59 C ATOM 2187 CZ3 TRP A 237 16.987 34.033 -28.579 1.00 18.11 C ATOM 2188 CH2 TRP A 237 15.865 34.561 -29.243 1.00 19.03 C ATOM 2189 HE1 TRP A 237 16.705 38.504 -30.559 1.00 0.00 H ATOM 2190 H TRP A 237 22.746 37.082 -27.001 1.00 0.00 H ATOM 2191 N ILE A 238 20.017 35.710 -25.509 1.00 16.12 N ATOM 2192 CA ILE A 238 19.174 34.954 -24.565 1.00 15.38 C ATOM 2193 C ILE A 238 18.979 35.700 -23.220 1.00 22.47 C ATOM 2194 O ILE A 238 17.838 35.844 -22.750 1.00 21.13 O ATOM 2195 CB ILE A 238 19.736 33.514 -24.351 1.00 17.75 C ATOM 2196 CG1 ILE A 238 19.670 32.698 -25.674 1.00 17.36 C ATOM 2197 CG2 ILE A 238 18.978 32.805 -23.192 1.00 17.49 C ATOM 2198 CD1 ILE A 238 20.643 31.463 -25.714 1.00 20.61 C ATOM 2199 H ILE A 238 20.914 35.289 -25.826 1.00 0.00 H ATOM 2200 N LEU A 239 20.086 36.176 -22.615 1.00 21.69 N ATOM 2201 CA LEU A 239 20.021 36.922 -21.356 1.00 23.00 C ATOM 2202 C LEU A 239 19.192 38.214 -21.491 1.00 28.60 C ATOM 2203 O LEU A 239 18.387 38.500 -20.612 1.00 28.76 O ATOM 2204 CB LEU A 239 21.423 37.192 -20.767 1.00 23.71 C ATOM 2205 CG LEU A 239 22.292 35.954 -20.442 1.00 28.73 C ATOM 2206 CD1 LEU A 239 23.676 36.356 -19.948 1.00 29.89 C ATOM 2207 CD2 LEU A 239 21.612 35.013 -19.427 1.00 28.83 C ATOM 2208 H LEU A 239 21.013 36.009 -23.055 1.00 0.00 H ATOM 2209 N GLU A 240 19.319 38.940 -22.615 1.00 26.73 N ATOM 2210 CA GLU A 240 18.543 40.164 -22.873 1.00 27.03 C ATOM 2211 C GLU A 240 17.035 39.844 -22.990 1.00 32.12 C ATOM 2212 O GLU A 240 16.216 40.534 -22.386 1.00 31.76 O ATOM 2213 CB GLU A 240 19.033 40.865 -24.158 1.00 29.06 C ATOM 2214 CG GLU A 240 18.335 42.189 -24.464 1.00 42.60 C ATOM 2215 CD GLU A 240 18.236 42.578 -25.928 1.00 72.73 C ATOM 2216 OE1 GLU A 240 19.293 42.710 -26.588 1.00 74.73 O ATOM 2217 OE2 GLU A 240 17.099 42.798 -26.405 1.00 67.76 O ATOM 2218 H GLU A 240 19.997 38.622 -23.336 1.00 0.00 H ATOM 2219 N LYS A 241 16.676 38.803 -23.774 1.00 27.61 N ATOM 2220 CA LYS A 241 15.270 38.442 -23.981 1.00 27.19 C ATOM 2221 C LYS A 241 14.596 37.834 -22.751 1.00 31.52 C ATOM 2222 O LYS A 241 13.396 38.008 -22.596 1.00 31.67 O ATOM 2223 CB LYS A 241 15.095 37.527 -25.212 1.00 26.95 C ATOM 2224 CG LYS A 241 15.453 38.173 -26.551 1.00 25.32 C ATOM 2225 CD LYS A 241 14.609 39.420 -26.841 1.00 29.14 C ATOM 2226 CE LYS A 241 14.998 40.053 -28.149 1.00 36.97 C ATOM 2227 NZ LYS A 241 14.042 41.123 -28.536 1.00 47.34 N ATOM 2228 HZ1 LYS A 241 13.090 40.716 -28.635 1.00 0.00 H ATOM 2229 HZ2 LYS A 241 14.032 41.859 -27.801 1.00 0.00 H ATOM 2230 HZ3 LYS A 241 14.338 41.540 -29.442 1.00 0.00 H ATOM 2231 H LYS A 241 17.417 38.243 -24.243 1.00 0.00 H ATOM 2232 N THR A 242 15.357 37.133 -21.890 1.00 29.77 N ATOM 2233 CA THR A 242 14.809 36.478 -20.687 1.00 30.29 C ATOM 2234 C THR A 242 14.921 37.355 -19.411 1.00 38.41 C ATOM 2235 O THR A 242 14.469 36.928 -18.340 1.00 36.99 O ATOM 2236 CB THR A 242 15.413 35.074 -20.483 1.00 28.55 C ATOM 2237 OG1 THR A 242 16.796 35.205 -20.153 1.00 27.34 O ATOM 2238 CG2 THR A 242 15.235 34.170 -21.720 1.00 24.25 C ATOM 2239 HG1 THR A 242 17.268 35.668 -20.890 1.00 0.00 H ATOM 2240 H THR A 242 16.376 37.049 -22.081 1.00 0.00 H ATOM 2241 N GLN A 243 15.524 38.568 -19.540 1.00 36.44 N ATOM 2242 CA GLN A 243 15.742 39.570 -18.483 1.00 61.33 C ATOM 2243 C GLN A 243 16.593 39.036 -17.333 1.00 98.16 C ATOM 2244 O GLN A 243 17.676 38.498 -17.567 1.00 66.82 O ATOM 2245 CB GLN A 243 14.413 40.166 -17.973 1.00 62.64 C ATOM 2246 CG GLN A 243 13.585 40.875 -19.047 1.00 73.85 C ATOM 2247 H GLN A 243 15.869 38.815 -20.490 1.00 0.00 H TER 2248 GLN A 243 HETATM 2249 O HOH 1 43.464 26.025 -41.846 1.00 36.94 O HETATM 2250 O HOH 2 11.953 19.030 -43.327 1.00 31.46 O HETATM 2251 O HOH 3 23.184 4.434 -39.468 1.00 38.09 O HETATM 2252 O HOH 4 36.939 19.261 -38.378 1.00 28.02 O HETATM 2253 O HOH 5 36.477 25.878 -45.747 1.00 28.05 O HETATM 2254 O HOH 6 -1.272 30.949 -24.723 1.00 37.41 O HETATM 2255 O HOH 7 40.197 26.123 -39.046 1.00 20.91 O HETATM 2256 O HOH 8 9.895 27.431 -10.412 1.00 27.90 O HETATM 2257 O HOH 9 14.587 3.095 -22.250 1.00 26.79 O HETATM 2258 O HOH 10 -6.092 23.946 -30.916 1.00 33.27 O HETATM 2259 O HOH 11 17.309 27.933 -13.274 1.00 40.02 O HETATM 2260 O HOH 12 20.028 5.166 -22.756 1.00 39.36 O HETATM 2261 O HOH 13 5.366 24.951 -37.921 1.00 28.11 O HETATM 2262 O HOH 14 36.586 25.400 -19.694 1.00 31.24 O HETATM 2263 O HOH 15 -9.582 20.095 -33.298 1.00 43.73 O HETATM 2264 O HOH 16 2.521 24.412 -14.382 1.00 27.22 O HETATM 2265 O HOH 17 29.350 10.684 -21.293 1.00 39.96 O HETATM 2266 O HOH 18 10.408 -0.797 -26.848 1.00 29.56 O HETATM 2267 O HOH 19 0.096 24.015 -17.131 1.00 20.21 O HETATM 2268 O HOH 20 -3.345 17.446 -18.428 1.00 19.97 O HETATM 2269 O HOH 21 37.077 29.834 -25.483 1.00 34.10 O HETATM 2270 O HOH 22 38.992 22.617 -27.082 1.00 32.26 O HETATM 2271 O HOH 23 -1.611 25.071 -24.391 1.00 19.86 O HETATM 2272 O HOH 24 9.278 4.070 -17.042 1.00 40.73 O HETATM 2273 O HOH 25 35.425 17.561 -20.000 1.00 37.26 O HETATM 2274 O HOH 26 1.192 26.347 -17.998 1.00 17.46 O HETATM 2275 O HOH 27 -5.662 15.334 -30.872 1.00 32.95 O HETATM 2276 O HOH 28 34.727 11.265 -38.617 1.00 30.66 O HETATM 2277 O HOH 29 -6.174 10.470 -19.384 1.00 32.38 O HETATM 2278 O HOH 30 1.971 22.069 -15.669 1.00 30.56 O HETATM 2279 O HOH 31 18.956 4.381 -37.911 1.00 34.87 O HETATM 2280 O HOH 32 2.651 12.430 -35.556 1.00 34.22 O HETATM 2281 O HOH 33 10.656 21.326 -6.826 1.00 37.46 O HETATM 2282 O HOH 34 3.774 18.096 -36.832 1.00 36.66 O HETATM 2283 O HOH 35 14.334 2.380 -29.523 1.00 43.44 O HETATM 2284 O HOH 36 -3.764 23.536 -25.147 1.00 26.41 O HETATM 2285 O HOH 37 5.244 10.687 -38.025 1.00 28.22 O HETATM 2286 O HOH 38 -1.318 20.391 -17.559 1.00 24.86 O HETATM 2287 O HOH 39 15.410 30.221 -14.037 1.00 27.42 O HETATM 2288 O HOH 40 -6.135 10.156 -23.265 1.00 34.04 O HETATM 2289 O HOH 41 42.344 22.755 -25.664 1.00 50.36 O HETATM 2290 O HOH 42 10.756 26.264 -41.476 1.00 50.21 O HETATM 2291 O HOH 43 2.537 20.834 -36.827 1.00 40.18 O HETATM 2292 O HOH 44 31.765 27.418 -34.920 1.00 44.13 O HETATM 2293 O HOH 45 3.732 20.140 -15.007 1.00 53.93 O HETATM 2294 O HOH 46 18.140 7.817 -15.512 1.00 50.43 O HETATM 2295 O HOH 47 -2.989 17.204 -15.726 1.00 29.83 O HETATM 2296 O HOH 48 -4.893 11.500 -12.701 1.00 39.06 O HETATM 2297 O HOH 49 43.637 25.793 -45.637 1.00 56.51 O HETATM 2298 O HOH 50 -6.368 23.194 -24.420 1.00 35.71 O HETATM 2299 O HOH 51 24.710 8.975 -22.340 1.00 40.88 O HETATM 2300 O HOH 52 40.266 24.997 -27.332 1.00 41.64 O HETATM 2301 O HOH 53 8.179 22.264 -6.130 1.00 58.78 O HETATM 2302 O HOH 54 35.510 25.938 -48.455 1.00 43.68 O HETATM 2303 O HOH 55 -6.362 16.255 -24.316 1.00 31.44 O HETATM 2304 O HOH 56 3.070 23.473 -37.568 1.00 33.67 O HETATM 2305 O HOH 57 26.676 10.252 -21.043 1.00 49.92 O HETATM 2306 O HOH 58 10.934 19.067 -36.104 1.00 14.42 O HETATM 2307 O HOH 59 15.571 21.812 -41.051 1.00 18.84 O HETATM 2308 O HOH 60 2.999 13.200 -32.857 1.00 25.51 O HETATM 2309 O HOH 61 3.019 12.465 -30.330 1.00 42.18 O HETATM 2310 O HOH 62 14.887 16.950 -30.549 1.00 14.50 O HETATM 2311 O HOH 63 21.006 27.197 -38.895 1.00 14.35 O HETATM 2312 O HOH 64 18.295 17.574 -30.677 1.00 15.74 O HETATM 2313 O HOH 65 17.210 23.354 -27.694 1.00 12.85 O HETATM 2314 O HOH 66 -1.970 16.067 -21.917 1.00 20.84 O HETATM 2315 O HOH 67 18.047 33.209 -41.415 1.00 16.12 O HETATM 2316 O HOH 68 21.327 28.956 -36.736 1.00 14.73 O HETATM 2317 O HOH 69 23.156 30.785 -36.255 1.00 16.50 O HETATM 2318 O HOH 70 17.303 20.215 -42.955 1.00 17.37 O HETATM 2319 O HOH 71 14.669 9.669 -32.989 1.00 17.14 O HETATM 2320 O HOH 72 12.476 15.594 -31.148 1.00 12.00 O HETATM 2321 O HOH 73 27.608 26.819 -28.157 1.00 19.64 O HETATM 2322 O HOH 74 12.060 16.916 -19.661 1.00 16.09 O HETATM 2323 O HOH 75 21.115 16.143 -26.289 1.00 13.81 O HETATM 2324 O HOH 76 26.128 23.560 -49.841 1.00 19.22 O HETATM 2325 O HOH 77 28.921 13.747 -41.695 1.00 24.04 O HETATM 2326 O HOH 78 9.983 15.507 -22.501 1.00 17.57 O HETATM 2327 O HOH 79 0.073 27.561 -25.376 1.00 23.51 O HETATM 2328 O HOH 80 32.599 17.932 -24.184 1.00 24.96 O HETATM 2329 O HOH 81 23.828 30.007 -46.247 1.00 18.70 O HETATM 2330 O HOH 82 5.111 18.459 -18.993 1.00 20.61 O HETATM 2331 O HOH 83 23.489 14.284 -44.085 1.00 21.55 O HETATM 2332 O HOH 84 30.922 26.961 -26.323 1.00 25.27 O HETATM 2333 O HOH 85 17.980 6.133 -33.654 1.00 27.66 O HETATM 2334 O HOH 86 31.452 23.773 -36.714 1.00 25.69 O HETATM 2335 O HOH 87 20.315 27.459 -18.401 1.00 24.68 O HETATM 2336 O HOH 88 23.046 16.390 -42.133 1.00 20.00 O HETATM 2337 O HOH 89 27.208 11.480 -39.498 1.00 23.42 O HETATM 2338 O HOH 90 15.966 39.461 -31.841 1.00 23.95 O HETATM 2339 O HOH 91 24.207 37.241 -28.406 1.00 25.74 O HETATM 2340 O HOH 92 33.448 16.302 -30.699 1.00 40.35 O HETATM 2341 O HOH 93 31.073 13.997 -29.257 1.00 24.34 O HETATM 2342 O HOH 94 23.546 21.610 -17.055 1.00 22.19 O HETATM 2343 O HOH 95 10.883 29.203 -41.214 1.00 32.13 O HETATM 2344 O HOH 96 25.935 6.814 -29.834 1.00 22.91 O HETATM 2345 O HOH 97 26.588 20.881 -49.784 1.00 25.69 O HETATM 2346 O HOH 98 19.081 35.732 -42.266 1.00 33.02 O HETATM 2347 O HOH 99 22.724 28.715 -18.053 1.00 29.87 O HETATM 2348 O HOH 100 22.245 32.379 -46.707 1.00 34.28 O HETATM 2349 O HOH 101 17.774 17.527 -47.003 1.00 34.98 O HETATM 2350 O HOH 102 24.941 19.464 -15.701 1.00 27.74 O HETATM 2351 O HOH 103 12.997 13.236 -17.829 1.00 23.49 O HETATM 2352 O HOH 104 -1.116 19.744 -35.069 1.00 34.23 O HETATM 2353 O HOH 105 4.121 35.283 -29.321 1.00 28.85 O HETATM 2354 O HOH 106 26.647 36.238 -27.089 1.00 38.32 O HETATM 2355 O HOH 107 31.780 23.448 -17.445 1.00 31.07 O HETATM 2356 O HOH 108 22.134 38.170 -31.694 1.00 32.48 O HETATM 2357 O HOH 109 10.763 4.284 -30.607 1.00 28.47 O HETATM 2358 O HOH 110 30.736 25.832 -21.749 1.00 24.05 O HETATM 2359 O HOH 111 12.038 33.256 -45.445 1.00 32.08 O HETATM 2360 O HOH 112 26.357 12.975 -41.690 1.00 33.54 O HETATM 2361 O HOH 113 25.856 34.599 -38.803 1.00 49.04 O HETATM 2362 O HOH 114 32.444 25.893 -29.607 1.00 51.02 O HETATM 2363 O HOH 115 31.296 14.979 -41.270 1.00 29.50 O HETATM 2364 O HOH 116 17.669 20.824 -45.861 1.00 52.63 O HETATM 2365 O HOH 117 24.328 23.884 -51.884 1.00 25.97 O HETATM 2366 O HOH 118 12.692 36.922 -37.790 1.00 31.42 O HETATM 2367 O HOH 119 9.349 30.393 -38.190 1.00 33.53 O HETATM 2368 O HOH 120 15.691 15.813 -46.902 1.00 37.42 O HETATM 2369 O HOH 121 0.237 10.089 -27.031 1.00 30.28 O HETATM 2370 O HOH 122 5.967 21.988 -12.778 1.00 38.04 O HETATM 2371 O HOH 123 24.057 5.195 -30.987 1.00 46.97 O HETATM 2372 O HOH 124 9.250 37.304 -32.141 1.00 29.84 O HETATM 2373 O HOH 125 32.834 16.258 -42.934 1.00 30.50 O HETATM 2374 O HOH 126 1.974 14.003 -15.878 1.00 30.24 O HETATM 2375 O HOH 127 24.765 31.989 -43.223 1.00 32.08 O HETATM 2376 O HOH 128 -3.496 15.109 -25.036 1.00 31.00 O HETATM 2377 O HOH 129 -4.975 18.650 -27.747 1.00 30.40 O HETATM 2378 O HOH 130 22.604 21.529 -48.826 1.00 43.50 O HETATM 2379 O HOH 131 -6.213 18.830 -30.243 1.00 31.63 O HETATM 2380 O HOH 132 5.491 18.393 -16.101 1.00 31.78 O HETATM 2381 O HOH 133 30.258 30.527 -48.458 1.00 39.68 O HETATM 2382 O HOH 134 13.998 26.742 -42.710 1.00 35.35 O HETATM 2383 O HOH 135 33.281 15.612 -18.032 1.00 41.16 O HETATM 2384 O HOH 136 31.920 29.875 -30.987 1.00 33.24 O HETATM 2385 O HOH 137 24.006 14.956 -51.084 1.00 42.18 O HETATM 2386 O HOH 138 9.237 10.905 -16.573 1.00 51.96 O HETATM 2387 O HOH 139 22.703 40.568 -22.521 1.00 36.81 O HETATM 2388 O HOH 140 5.159 11.157 -18.491 1.00 43.14 O HETATM 2389 O HOH 141 24.388 36.758 -32.266 1.00 58.85 O HETATM 2390 O HOH 142 3.731 4.462 -23.349 1.00 50.12 O HETATM 2391 O HOH 143 18.707 24.267 -50.330 1.00 29.33 O HETATM 2392 O HOH 144 8.246 4.090 -33.096 1.00 31.23 O HETATM 2393 O HOH 145 18.180 14.542 -13.151 1.00 41.71 O HETATM 2394 O HOH 146 4.618 15.774 -18.926 1.00 41.96 O HETATM 2395 O HOH 147 8.228 15.856 -12.170 1.00 41.27 O HETATM 2396 O HOH 148 28.517 5.671 -38.143 1.00 42.28 O HETATM 2397 O HOH 149 32.418 30.556 -43.841 1.00 46.18 O HETATM 2398 O HOH 150 28.806 33.302 -19.785 1.00 45.35 O HETATM 2399 O HOH 151 26.686 31.568 -19.945 1.00 43.12 O HETATM 2400 O HOH 152 24.398 15.669 -36.592 1.00 27.43 O HETATM 2401 O HOH 153 19.709 21.266 -47.593 1.00 48.83 O HETATM 2402 O HOH 154 14.595 19.291 -43.390 1.00 57.46 O HETATM 2403 O HOH 155 22.593 12.923 -19.652 1.00 42.92 O HETATM 2404 O HOH 156 11.864 11.312 -16.229 1.00 37.02 O HETATM 2405 O HOH 157 13.270 24.294 -42.054 1.00 49.75 O HETATM 2406 O HOH 158 16.890 12.468 -14.137 1.00 31.89 O HETATM 2407 O HOH 159 31.168 26.674 -37.477 1.00 36.72 O HETATM 2408 O HOH 160 13.224 3.914 -32.429 1.00 46.33 O HETATM 2409 O HOH 161 13.520 19.720 -45.842 1.00 54.67 O HETATM 2410 O HOH 162 18.909 41.384 -33.145 1.00 48.71 O HETATM 2411 O HOH 163 9.185 38.823 -22.348 1.00 48.13 O HETATM 2412 O HOH 164 1.245 12.235 -28.335 1.00 55.05 O HETATM 2413 O HOH 165 -1.329 12.727 -29.115 1.00 49.50 O HETATM 2414 O HOH 166 32.241 16.339 -49.946 1.00 46.09 O HETATM 2415 O HOH 167 21.683 8.831 -46.461 1.00 56.54 O HETATM 2416 O HOH 168 13.232 39.130 -31.350 1.00 51.70 O HETATM 2417 N14 UNN A 169 10.464 18.392 -38.812 1.00 -0.33 N HETATM 2418 C13 UNN A 169 9.658 17.495 -39.492 1.00 0.01 C HETATM 2419 C15 UNN A 169 8.623 16.733 -38.768 1.00 -0.04 C HETATM 2420 C16 UNN A 169 8.067 15.587 -39.337 1.00 -0.04 C HETATM 2421 C17 UNN A 169 6.977 14.982 -38.717 1.00 0.08 C HETATM 2422 C18 UNN A 169 6.405 15.514 -37.545 1.00 0.03 C HETATM 2423 C19 UNN A 169 6.997 16.638 -36.970 1.00 -0.07 C HETATM 2424 C20 UNN A 169 8.089 17.233 -37.575 1.00 -0.07 C HETATM 2425 H3 UNN A 169 8.541 18.105 -37.116 1.00 0.05 H HETATM 2426 H2 UNN A 169 6.601 17.046 -36.047 1.00 0.06 H HETATM 2427 C39 UNN A 169 5.259 14.641 -37.241 1.00 0.11 C HETATM 2428 N38 UNN A 169 5.225 13.676 -38.161 1.00 -0.22 N HETATM 2429 N37 UNN A 169 6.256 13.879 -39.036 1.00 -0.24 N HETATM 2430 H21 UNN A 169 6.460 13.268 -39.840 1.00 0.23 H HETATM 2431 N40 UNN A 169 4.345 14.723 -36.255 1.00 -0.33 N HETATM 2432 H22 UNN A 169 3.597 14.018 -36.186 1.00 0.17 H HETATM 2433 H23 UNN A 169 4.394 15.491 -35.570 1.00 0.17 H HETATM 2434 H1 UNN A 169 8.478 15.173 -40.250 1.00 0.05 H HETATM 2435 C12 UNN A 169 10.051 17.442 -40.795 1.00 0.04 C HETATM 2436 N11 UNN A 169 11.085 18.328 -40.918 1.00 -0.26 N HETATM 2437 C3 UNN A 169 11.314 18.876 -39.703 1.00 0.14 C HETATM 2438 C2 UNN A 169 12.348 19.915 -39.376 1.00 0.13 C HETATM 2439 N1 UNN A 169 13.724 19.449 -39.549 1.00 -0.27 N HETATM 2440 C31 UNN A 169 14.251 18.612 -38.631 1.00 0.19 C HETATM 2441 C30 UNN A 169 15.665 18.219 -38.835 1.00 0.01 C HETATM 2442 C29 UNN A 169 16.473 18.475 -39.862 1.00 -0.04 C HETATM 2443 C25 UNN A 169 17.877 18.038 -39.934 1.00 0.03 C HETATM 2444 C24 UNN A 169 18.734 18.505 -38.930 1.00 -0.04 C HETATM 2445 C23 UNN A 169 20.063 18.134 -38.933 1.00 0.04 C HETATM 2446 C22 UNN A 169 20.577 17.309 -39.913 1.00 -0.05 C HETATM 2447 C21 UNN A 169 19.743 16.860 -40.928 1.00 -0.02 C HETATM 2448 C26 UNN A 169 18.390 17.194 -40.940 1.00 0.14 C HETATM 2449 N27 UNN A 169 17.599 16.856 -42.078 1.00 -0.09 N HETATM 2450 C33 UNN A 169 17.847 16.860 -43.398 1.00 0.17 C HETATM 2451 N34 UNN A 169 16.829 16.369 -44.048 1.00 -0.21 N HETATM 2452 N35 UNN A 169 15.928 16.019 -43.095 1.00 -0.14 N HETATM 2453 N36 UNN A 169 16.377 16.291 -41.908 1.00 -0.05 N HETATM 2454 H8 UNN A 169 18.765 17.221 -43.859 1.00 0.14 H HETATM 2455 H4 UNN A 169 20.149 16.242 -41.721 1.00 0.06 H HETATM 2456 H5 UNN A 169 21.620 17.015 -39.890 1.00 0.06 H HETATM 2457 CL1 UNN A 169 21.117 18.752 -37.690 1.00 -0.08 CL HETATM 2458 H6 UNN A 169 18.354 19.157 -38.152 1.00 0.06 H HETATM 2459 H19 UNN A 169 16.071 19.042 -40.700 1.00 0.07 H HETATM 2460 H20 UNN A 169 16.108 17.637 -38.028 1.00 0.06 H HETATM 2461 O32 UNN A 169 13.570 18.155 -37.711 1.00 -0.39 O HETATM 2462 H9 UNN A 169 14.266 19.746 -40.335 1.00 0.19 H HETATM 2463 C4 UNN A 169 12.095 21.227 -40.144 1.00 0.02 C HETATM 2464 C5 UNN A 169 10.759 21.864 -39.835 1.00 -0.04 C HETATM 2465 C6 UNN A 169 10.038 22.501 -40.837 1.00 -0.06 C HETATM 2466 C7 UNN A 169 8.817 23.092 -40.559 1.00 -0.07 C HETATM 2467 C8 UNN A 169 8.302 23.067 -39.277 1.00 -0.07 C HETATM 2468 C9 UNN A 169 9.004 22.440 -38.272 1.00 -0.07 C HETATM 2469 C10 UNN A 169 10.224 21.843 -38.547 1.00 -0.06 C HETATM 2470 H17 UNN A 169 10.771 21.353 -37.750 1.00 0.06 H HETATM 2471 H16 UNN A 169 8.602 22.413 -37.266 1.00 0.06 H HETATM 2472 H15 UNN A 169 7.350 23.539 -39.063 1.00 0.06 H HETATM 2473 H14 UNN A 169 8.261 23.578 -41.353 1.00 0.06 H HETATM 2474 H13 UNN A 169 10.435 22.536 -41.845 1.00 0.06 H HETATM 2475 H11 UNN A 169 12.136 21.012 -41.222 1.00 0.05 H HETATM 2476 H12 UNN A 169 12.889 21.942 -39.882 1.00 0.05 H HETATM 2477 H10 UNN A 169 12.230 20.145 -38.307 1.00 0.08 H HETATM 2478 H18 UNN A 169 11.600 18.541 -41.785 1.00 0.24 H HETATM 2479 H7 UNN A 169 9.627 16.819 -41.581 1.00 0.09 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 1182 1181 1829 CONECT 1497 1496 1656 CONECT 1656 1497 1655 CONECT 1753 1752 2000 CONECT 1829 1182 1828 CONECT 2000 1753 1999 CONECT 2417 2418 2437 CONECT 2418 2417 2419 2435 CONECT 2419 2418 2420 2424 CONECT 2420 2419 2421 2434 CONECT 2421 2420 2422 2429 CONECT 2422 2421 2423 2427 CONECT 2423 2422 2424 2426 CONECT 2424 2419 2423 2425 CONECT 2425 2424 CONECT 2426 2423 CONECT 2427 2422 2428 2431 CONECT 2428 2427 2429 CONECT 2429 2421 2428 2430 CONECT 2430 2429 CONECT 2431 2427 2432 2433 CONECT 2432 2431 CONECT 2433 2431 CONECT 2434 2420 CONECT 2435 2418 2436 2479 CONECT 2436 2435 2437 2478 CONECT 2437 2417 2436 2438 CONECT 2438 2437 2439 2463 2477 CONECT 2439 2438 2440 2462 CONECT 2440 2439 2441 2461 CONECT 2441 2440 2442 2460 CONECT 2442 2441 2443 2459 CONECT 2443 2442 2444 2448 CONECT 2444 2443 2445 2458 CONECT 2445 2444 2446 2457 CONECT 2446 2445 2447 2456 CONECT 2447 2446 2448 2455 CONECT 2448 2443 2447 2449 CONECT 2449 2448 2450 2453 CONECT 2450 2449 2451 2454 CONECT 2451 2450 2452 CONECT 2452 2451 2453 CONECT 2453 2449 2452 CONECT 2454 2450 CONECT 2455 2447 CONECT 2456 2446 CONECT 2457 2445 CONECT 2458 2444 CONECT 2459 2442 CONECT 2460 2441 CONECT 2461 2440 CONECT 2462 2439 CONECT 2463 2438 2464 2475 2476 CONECT 2464 2463 2465 2469 CONECT 2465 2464 2466 2474 CONECT 2466 2465 2467 2473 CONECT 2467 2466 2468 2472 CONECT 2468 2467 2469 2471 CONECT 2469 2464 2468 2470 CONECT 2470 2469 CONECT 2471 2468 CONECT 2472 2467 CONECT 2473 2466 CONECT 2474 2465 CONECT 2475 2463 CONECT 2476 2463 CONECT 2477 2438 CONECT 2478 2436 CONECT 2479 2435 MASTER 0 0 0 0 0 0 0 0 2478 1 75 19 END
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Structure:
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Related entries of code: 4x6p
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
1zom
RCSB PDB
PDBbind
238aa, >1ZOM_1|Chain... at 98%
1zpb
RCSB PDB
PDBbind
238aa, >1ZPB_1|Chain... at 98%
1zpc
RCSB PDB
PDBbind
238aa, >1ZPC_1|Chain... at 98%
2fda
RCSB PDB
PDBbind
238aa, >2FDA_1|Chain... at 98%
3bg8
RCSB PDB
PDBbind
238aa, >3BG8_1|Chain... at 99%
4cr5
RCSB PDB
PDBbind
238aa, >4CR5_1|Chain... at 98%
4cr9
RCSB PDB
PDBbind
238aa, >4CR9_1|Chain... at 98%
4cra
RCSB PDB
PDBbind
238aa, >4CRA_1|Chain... at 98%
4crb
RCSB PDB
PDBbind
238aa, >4CRB_1|Chain... at 98%
4crc
RCSB PDB
PDBbind
238aa, >4CRC_1|Chain... at 97%
4crd
RCSB PDB
PDBbind
238aa, >4CRD_1|Chain... at 98%
4crf
RCSB PDB
PDBbind
238aa, >4CRF_1|Chain... at 98%
4na7
RCSB PDB
PDBbind
244aa, >4NA7_1|Chain... at 97%
4na8
RCSB PDB
PDBbind
244aa, >4NA8_1|Chain... at 97%
4ty7
RCSB PDB
PDBbind
244aa, >4TY7_1|Chain... at 96%
4wxi
RCSB PDB
PDBbind
244aa, >4WXI_1|Chain... at 96%
4x6m
RCSB PDB
PDBbind
244aa, >4X6M_1|Chain... at 96%
4x6o
RCSB PDB
PDBbind
244aa, >4X6O_1|Chain... at 96%
4y8x
RCSB PDB
PDBbind
244aa, >4Y8X_1|Chain... at 96%
4y8y
RCSB PDB
PDBbind
244aa, >4Y8Y_1|Chain... at 96%
4y8z
RCSB PDB
PDBbind
244aa, >4Y8Z_1|Chain... at 96%
5e2o
RCSB PDB
PDBbind
244aa, >5E2O_1|Chain... at 96%
5e2p
RCSB PDB
PDBbind
244aa, >5E2P_1|Chain... at 96%
5eok
RCSB PDB
PDBbind
606aa, >5EOK_1|Chain... at 100%
5exl
RCSB PDB
PDBbind
244aa, >5EXL_1|Chain... at 96%
5exm
RCSB PDB
PDBbind
244aa, >5EXM_1|Chain... at 96%
5exn
RCSB PDB
PDBbind
238aa, >5EXN_1|Chain... at 99%
5i25
RCSB PDB
PDBbind
607aa, >5I25_1|Chain... *
5q0d
RCSB PDB
PDBbind
244aa, >5Q0D_1|Chain... at 96%
5q0e
RCSB PDB
PDBbind
244aa, >5Q0E_1|Chain... at 96%
5q0g
RCSB PDB
PDBbind
244aa, >5Q0G_1|Chain... at 96%
5q0h
RCSB PDB
PDBbind
244aa, >5Q0H_1|Chain... at 96%
5qck
RCSB PDB
PDBbind
244aa, >5QCK_1|Chain... at 96%
5qcl
RCSB PDB
PDBbind
244aa, >5QCL_1|Chain... at 96%
5qcm
RCSB PDB
PDBbind
244aa, >5QCM_1|Chain... at 96%
5qcn
RCSB PDB
PDBbind
244aa, >5QCN_1|Chain... at 96%
5tks
RCSB PDB
PDBbind
244aa, >5TKS_1|Chain... at 96%
5tkt
RCSB PDB
PDBbind
244aa, >5TKT_1|Chain... at 96%
5tku
RCSB PDB
PDBbind
244aa, >5TKU_1|Chain... at 96%
5wb6
RCSB PDB
PDBbind
244aa, >5WB6_1|Chain... at 96%
6c0s
RCSB PDB
PDBbind
244aa, >6C0S_1|Chain... at 96%
5qtt
RCSB PDB
PDBbind
244aa, >5QTT_1|Chain... at 96%
5qqp
RCSB PDB
PDBbind
244aa, >5QQP_1|Chain... at 96%
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
4x6p
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Coagulation factor XI, light chain
Ligand Name
3YU
EC.Number
E.C.3.4.21.27
Resolution
1.93(Å)
Affinity (Kd/Ki/IC50)
Ki=5nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Bioorg.Med.Chem.Lett. Vol. 25: pp. 1635-1642
Ligand Properties
Formula
C
2
8
H
2
3
ClN
1
0
O
Molecular Weight
551.002
Exact Mass
550.174
No. of atoms
63
No. of bonds
68
Polar Surface Area
156.08
LOGP Value
4.16 (
Computed with XLOGP3
)
5.25 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 6
Canonical SMILES
O=C(N[C@H](c1[nH]cc(n1)c1ccc2c(c1)[nH]nc2N)Cc1ccccc1)/C=C/c1cc(Cl)ccc1n1cnnn1
InChI String
InChI=1S/C28H23ClN10O/c29-20-8-10-25(39-16-32-37-38-39)19(13-20)7-11-26(40)33-23(12-17-4-2-1-3-5-17)28-31-15-24(34-28)18-6-9-21-22(14-18)35-36-27(21)30/h1-11,13-16,23H,12H2,(H,31,34)(H,33,40)(H3,30,35,36)/b11-7+/t23-/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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