Browse entries in the PDBbind-CN Database
HEADER 5NHZ_COMPLEX COMPND 5NHZ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 230 GLU TYR PRO THR VAL SER GLU ILE PRO VAL GLY GLU VAL SEQRES 2 A 230 ARG LEU TYR GLN ILE ALA ASP GLY VAL TRP SER HIS ILE SEQRES 3 A 230 ALA THR GLN SER PHE ASP GLY ALA VAL TYR PRO SER ASN SEQRES 4 A 230 GLY LEU ILE VAL ARG ASP GLY ASP GLU LEU LEU LEU ILE SEQRES 5 A 230 ASP THR ALA TRP GLY ALA LYS ASN THR ALA ALA LEU LEU SEQRES 6 A 230 ALA GLU ILE GLU LYS GLN ILE GLY LEU PRO VAL THR ARG SEQRES 7 A 230 ALA VAL SER THR HIS PHE HIS ASP ASP ARG VAL GLY GLY SEQRES 8 A 230 VAL ASP VAL LEU ARG ALA ALA GLY VAL ALA THR TYR ALA SEQRES 9 A 230 SER PRO SER THR ARG ARG LEU ALA GLU VAL GLU GLY ASN SEQRES 10 A 230 GLU ILE PRO THR HIS SER LEU GLU GLY LEU SER SER SER SEQRES 11 A 230 GLY ASP ALA VAL ARG PHE GLY PRO VAL GLU LEU PHE TYR SEQRES 12 A 230 PRO GLY ALA ALA HIS SER THR ASP ASN LEU VAL VAL TYR SEQRES 13 A 230 VAL PRO SER ALA SER VAL LEU TYR GLY GLY CYS ALA ILE SEQRES 14 A 230 TYR GLU LEU SER ARG THR SER ALA GLY ASN VAL ALA ASP SEQRES 15 A 230 ALA ASP LEU ALA GLU TRP PRO THR SER ILE GLU ARG ILE SEQRES 16 A 230 GLN GLN HIS TYR PRO GLU ALA GLN PHE VAL ILE PRO GLY SEQRES 17 A 230 HIS GLY LEU PRO GLY GLY LEU ASP LEU LEU LYS HIS THR SEQRES 18 A 230 THR ASN VAL VAL LYS ALA HIS THR ASN HET ZN A 1 1 HET ZN A 2 1 HET UNN A 414 36 ATOM 1 N GLU A 30 6.120 -0.355 -7.458 1.00 51.04 N ATOM 2 CA GLU A 30 6.136 0.808 -6.576 1.00 46.92 C ATOM 3 C GLU A 30 5.163 1.918 -7.037 1.00 38.72 C ATOM 4 O GLU A 30 4.569 2.563 -6.191 1.00 38.21 O ATOM 5 CB GLU A 30 7.555 1.354 -6.444 1.00 53.38 C ATOM 6 CG GLU A 30 7.653 2.596 -5.584 1.00 56.46 C ATOM 7 CD GLU A 30 9.028 2.854 -5.008 1.00 64.39 C ATOM 8 OE1 GLU A 30 9.677 1.890 -4.544 1.00 70.11 O ATOM 9 OE2 GLU A 30 9.453 4.041 -5.016 1.00 65.57 O ATOM 10 HN3 GLU A 30 6.397 -0.065 -8.417 1.00 0.00 H ATOM 11 HN2 GLU A 30 5.162 -0.759 -7.480 1.00 0.00 H ATOM 12 HN1 GLU A 30 6.789 -1.067 -7.103 1.00 0.00 H ATOM 13 N TYR A 31 5.000 2.169 -8.340 1.00 34.04 N ATOM 14 CA TYR A 31 3.997 3.144 -8.777 1.00 29.62 C ATOM 15 C TYR A 31 2.639 2.493 -8.578 1.00 28.19 C ATOM 16 O TYR A 31 2.453 1.375 -8.995 1.00 28.46 O ATOM 17 CB TYR A 31 4.172 3.568 -10.241 1.00 29.84 C ATOM 18 CG TYR A 31 3.490 4.883 -10.544 1.00 25.75 C ATOM 19 CD1 TYR A 31 4.104 6.081 -10.206 1.00 25.31 C ATOM 20 CD2 TYR A 31 2.219 4.946 -11.122 1.00 23.48 C ATOM 21 CE1 TYR A 31 3.524 7.283 -10.446 1.00 24.18 C ATOM 22 CE2 TYR A 31 1.614 6.196 -11.373 1.00 21.76 C ATOM 23 CZ TYR A 31 2.277 7.358 -11.022 1.00 22.21 C ATOM 24 OH TYR A 31 1.726 8.610 -11.253 1.00 22.39 O ATOM 25 HH TYR A 31 2.351 9.308 -10.933 1.00 0.00 H ATOM 26 H TYR A 31 5.584 1.673 -9.043 1.00 0.00 H ATOM 27 N PRO A 32 1.697 3.186 -7.944 1.00 26.49 N ATOM 28 CA PRO A 32 0.437 2.511 -7.661 1.00 30.37 C ATOM 29 C PRO A 32 -0.431 2.341 -8.897 1.00 29.02 C ATOM 30 O PRO A 32 -0.404 3.204 -9.775 1.00 28.21 O ATOM 31 CB PRO A 32 -0.238 3.441 -6.655 1.00 30.24 C ATOM 32 CG PRO A 32 0.291 4.755 -6.961 1.00 28.43 C ATOM 33 CD PRO A 32 1.707 4.556 -7.417 1.00 25.94 C ATOM 34 N THR A 33 -1.149 1.218 -8.935 1.00 29.52 N ATOM 35 CA THR A 33 -1.947 0.821 -10.069 1.00 29.40 C ATOM 36 C THR A 33 -3.421 0.871 -9.709 1.00 27.88 C ATOM 37 O THR A 33 -3.800 1.065 -8.532 1.00 27.05 O ATOM 38 CB THR A 33 -1.540 -0.559 -10.570 1.00 33.89 C ATOM 39 OG1 THR A 33 -1.762 -1.552 -9.558 1.00 36.83 O ATOM 40 CG2 THR A 33 -0.087 -0.553 -10.943 1.00 38.17 C ATOM 41 HG1 THR A 33 -1.225 -1.331 -8.757 1.00 0.00 H ATOM 42 H THR A 33 -1.133 0.595 -8.102 1.00 0.00 H ATOM 43 N VAL A 34 -4.257 0.745 -10.732 1.00 25.68 N ATOM 44 CA VAL A 34 -5.674 1.017 -10.583 1.00 24.33 C ATOM 45 C VAL A 34 -6.344 0.097 -9.530 1.00 27.57 C ATOM 46 O VAL A 34 -7.142 0.585 -8.730 1.00 29.55 O ATOM 47 CB VAL A 34 -6.388 0.937 -11.984 1.00 25.33 C ATOM 48 CG1 VAL A 34 -6.257 -0.439 -12.628 1.00 29.48 C ATOM 49 CG2 VAL A 34 -7.831 1.363 -11.884 1.00 23.31 C ATOM 50 H VAL A 34 -3.889 0.446 -11.658 1.00 0.00 H ATOM 51 N SER A 35 -5.983 -1.189 -9.471 1.00 26.60 N ATOM 52 CA SER A 35 -6.636 -2.132 -8.553 1.00 28.48 C ATOM 53 C SER A 35 -6.269 -1.854 -7.095 1.00 30.63 C ATOM 54 O SER A 35 -6.888 -2.388 -6.196 1.00 34.06 O ATOM 55 CB SER A 35 -6.277 -3.592 -8.871 1.00 30.74 C ATOM 56 OG SER A 35 -4.911 -3.847 -8.637 1.00 32.40 O ATOM 57 HG SER A 35 -4.363 -3.255 -9.211 1.00 0.00 H ATOM 58 H SER A 35 -5.221 -1.530 -10.091 1.00 0.00 H ATOM 59 N GLU A 36 -5.251 -1.032 -6.886 1.00 28.96 N ATOM 60 CA GLU A 36 -4.727 -0.741 -5.563 1.00 29.24 C ATOM 61 C GLU A 36 -5.355 0.482 -4.935 1.00 28.89 C ATOM 62 O GLU A 36 -5.097 0.768 -3.771 1.00 32.56 O ATOM 63 CB GLU A 36 -3.220 -0.521 -5.646 1.00 31.57 C ATOM 64 CG GLU A 36 -2.476 -1.787 -5.947 1.00 36.32 C ATOM 65 CD GLU A 36 -0.983 -1.591 -6.121 1.00 39.32 C ATOM 66 OE1 GLU A 36 -0.281 -2.572 -5.895 1.00 43.97 O ATOM 67 OE2 GLU A 36 -0.518 -0.485 -6.482 1.00 38.68 O ATOM 68 H GLU A 36 -4.807 -0.574 -7.707 1.00 0.00 H ATOM 69 N ILE A 37 -6.133 1.227 -5.712 1.00 25.03 N ATOM 70 CA ILE A 37 -6.652 2.526 -5.248 1.00 25.30 C ATOM 71 C ILE A 37 -8.168 2.539 -5.332 1.00 23.70 C ATOM 72 O ILE A 37 -8.737 2.734 -6.399 1.00 22.41 O ATOM 73 CB ILE A 37 -6.096 3.722 -6.055 1.00 23.02 C ATOM 74 CG1 ILE A 37 -4.556 3.703 -6.115 1.00 22.19 C ATOM 75 CG2 ILE A 37 -6.579 5.037 -5.455 1.00 21.47 C ATOM 76 CD1 ILE A 37 -3.970 4.778 -7.079 1.00 27.27 C ATOM 77 H ILE A 37 -6.380 0.888 -6.664 1.00 0.00 H ATOM 78 N PRO A 38 -8.830 2.340 -4.202 1.00 26.64 N ATOM 79 CA PRO A 38 -10.290 2.423 -4.245 1.00 26.80 C ATOM 80 C PRO A 38 -10.724 3.815 -4.647 1.00 25.38 C ATOM 81 O PRO A 38 -10.016 4.794 -4.335 1.00 24.01 O ATOM 82 CB PRO A 38 -10.702 2.102 -2.824 1.00 28.27 C ATOM 83 CG PRO A 38 -9.577 1.320 -2.269 1.00 30.79 C ATOM 84 CD PRO A 38 -8.349 1.820 -2.911 1.00 27.63 C ATOM 85 N VAL A 39 -11.853 3.900 -5.350 1.00 23.58 N ATOM 86 CA VAL A 39 -12.417 5.187 -5.722 1.00 23.47 C ATOM 87 C VAL A 39 -12.705 5.992 -4.452 1.00 22.89 C ATOM 88 O VAL A 39 -13.360 5.513 -3.520 1.00 24.81 O ATOM 89 CB VAL A 39 -13.674 4.993 -6.587 1.00 23.90 C ATOM 90 CG1 VAL A 39 -14.353 6.351 -6.950 1.00 24.03 C ATOM 91 CG2 VAL A 39 -13.278 4.255 -7.860 1.00 23.38 C ATOM 92 H VAL A 39 -12.340 3.028 -5.638 1.00 0.00 H ATOM 93 N GLY A 40 -12.195 7.221 -4.441 1.00 24.50 N ATOM 94 CA GLY A 40 -12.310 8.105 -3.303 1.00 26.99 C ATOM 95 C GLY A 40 -11.007 8.226 -2.534 1.00 26.48 C ATOM 96 O GLY A 40 -10.914 9.064 -1.647 1.00 29.55 O ATOM 97 H GLY A 40 -11.693 7.560 -5.286 1.00 0.00 H ATOM 98 N GLU A 41 -10.024 7.383 -2.840 1.00 23.88 N ATOM 99 CA GLU A 41 -8.691 7.474 -2.187 1.00 23.39 C ATOM 100 C GLU A 41 -7.711 8.042 -3.171 1.00 22.46 C ATOM 101 O GLU A 41 -7.893 7.918 -4.375 1.00 21.04 O ATOM 102 CB GLU A 41 -8.196 6.110 -1.686 1.00 25.73 C ATOM 103 CG GLU A 41 -9.179 5.414 -0.803 1.00 30.14 C ATOM 104 CD GLU A 41 -8.563 4.329 0.072 1.00 35.60 C ATOM 105 OE1 GLU A 41 -7.347 4.064 -0.034 1.00 36.89 O ATOM 106 OE2 GLU A 41 -9.300 3.746 0.894 1.00 38.65 O ATOM 107 H GLU A 41 -10.192 6.644 -3.552 1.00 0.00 H ATOM 108 N VAL A 42 -6.671 8.703 -2.668 1.00 22.54 N ATOM 109 CA VAL A 42 -5.661 9.297 -3.534 1.00 21.44 C ATOM 110 C VAL A 42 -4.268 8.901 -3.026 1.00 22.56 C ATOM 111 O VAL A 42 -4.053 8.884 -1.837 1.00 24.83 O ATOM 112 CB VAL A 42 -5.795 10.837 -3.573 1.00 22.48 C ATOM 113 CG1 VAL A 42 -4.611 11.466 -4.292 1.00 24.08 C ATOM 114 CG2 VAL A 42 -7.120 11.260 -4.214 1.00 24.05 C ATOM 115 H VAL A 42 -6.577 8.797 -1.637 1.00 0.00 H ATOM 116 N ARG A 43 -3.344 8.592 -3.933 1.00 19.36 N ATOM 117 CA ARG A 43 -1.949 8.306 -3.575 1.00 20.53 C ATOM 118 C ARG A 43 -1.041 9.429 -4.043 1.00 21.54 C ATOM 119 O ARG A 43 -1.311 10.058 -5.080 1.00 20.71 O ATOM 120 CB ARG A 43 -1.460 6.998 -4.210 1.00 24.29 C ATOM 121 CG ARG A 43 -2.317 5.796 -3.973 1.00 28.11 C ATOM 122 CD ARG A 43 -2.033 5.136 -2.664 1.00 37.25 C ATOM 123 NE ARG A 43 -3.175 5.296 -1.783 1.00 42.93 N ATOM 124 CZ ARG A 43 -4.069 4.363 -1.456 1.00 42.95 C ATOM 125 NH1 ARG A 43 -3.995 3.108 -1.889 1.00 43.13 N ATOM 126 NH2 ARG A 43 -5.054 4.712 -0.651 1.00 44.38 N ATOM 127 HE ARG A 43 -3.310 6.238 -1.363 1.00 0.00 H ATOM 128 HH12 ARG A 43 -4.718 2.417 -1.605 1.00 0.00 H ATOM 129 HH11 ARG A 43 -3.214 2.818 -2.511 1.00 0.00 H ATOM 130 HH22 ARG A 43 -5.771 4.012 -0.373 1.00 0.00 H ATOM 131 HH21 ARG A 43 -5.113 5.687 -0.294 1.00 0.00 H ATOM 132 H ARG A 43 -3.621 8.552 -4.935 1.00 0.00 H ATOM 133 N LEU A 44 0.025 9.657 -3.292 1.00 20.40 N ATOM 134 CA LEU A 44 1.088 10.577 -3.717 1.00 22.75 C ATOM 135 C LEU A 44 2.316 9.727 -4.017 1.00 23.92 C ATOM 136 O LEU A 44 2.621 8.768 -3.304 1.00 25.30 O ATOM 137 CB LEU A 44 1.403 11.624 -2.637 1.00 24.16 C ATOM 138 CG LEU A 44 0.242 12.516 -2.194 1.00 24.50 C ATOM 139 CD1 LEU A 44 0.723 13.613 -1.193 1.00 27.96 C ATOM 140 CD2 LEU A 44 -0.514 13.093 -3.360 1.00 23.59 C ATOM 141 H LEU A 44 0.112 9.172 -2.376 1.00 0.00 H ATOM 142 N TYR A 45 3.041 10.104 -5.061 1.00 21.53 N ATOM 143 CA TYR A 45 4.231 9.383 -5.462 1.00 21.79 C ATOM 144 C TYR A 45 5.337 10.390 -5.733 1.00 24.38 C ATOM 145 O TYR A 45 5.177 11.306 -6.535 1.00 22.73 O ATOM 146 CB TYR A 45 3.939 8.537 -6.700 1.00 21.73 C ATOM 147 CG TYR A 45 5.130 7.755 -7.175 1.00 24.93 C ATOM 148 CD1 TYR A 45 5.327 6.465 -6.727 1.00 27.98 C ATOM 149 CD2 TYR A 45 6.029 8.281 -8.088 1.00 27.07 C ATOM 150 CE1 TYR A 45 6.392 5.735 -7.116 1.00 32.45 C ATOM 151 CE2 TYR A 45 7.140 7.542 -8.505 1.00 31.08 C ATOM 152 CZ TYR A 45 7.313 6.263 -8.007 1.00 34.02 C ATOM 153 OH TYR A 45 8.361 5.448 -8.372 1.00 40.00 O ATOM 154 HH TYR A 45 8.331 5.292 -9.349 1.00 0.00 H ATOM 155 H TYR A 45 2.747 10.939 -5.606 1.00 0.00 H ATOM 156 N GLN A 47 6.443 10.244 -5.030 1.00 26.66 N ATOM 157 CA GLN A 47 7.545 11.182 -5.155 1.00 30.06 C ATOM 158 C GLN A 47 8.372 10.898 -6.402 1.00 30.04 C ATOM 159 O GLN A 47 8.920 9.822 -6.544 1.00 31.11 O ATOM 160 CB GLN A 47 8.434 11.102 -3.920 1.00 34.89 C ATOM 161 CG GLN A 47 9.505 12.125 -3.922 1.00 43.95 C ATOM 162 CD GLN A 47 9.559 12.869 -2.614 1.00 51.74 C ATOM 163 OE1 GLN A 47 9.459 14.097 -2.590 1.00 54.42 O ATOM 164 NE2 GLN A 47 9.693 12.130 -1.510 1.00 54.89 N ATOM 165 HE22 GLN A 47 9.774 11.096 -1.583 1.00 0.00 H ATOM 166 HE21 GLN A 47 9.717 12.589 -0.577 1.00 0.00 H ATOM 167 H GLN A 47 6.528 9.442 -4.373 1.00 0.00 H ATOM 168 N ILE A 48 8.411 11.853 -7.314 1.00 29.67 N ATOM 169 CA ILE A 48 9.163 11.710 -8.557 1.00 32.23 C ATOM 170 C ILE A 48 10.571 12.260 -8.410 1.00 33.24 C ATOM 171 O ILE A 48 11.522 11.720 -8.974 1.00 35.30 O ATOM 172 CB ILE A 48 8.452 12.437 -9.708 1.00 32.87 C ATOM 173 CG1 ILE A 48 7.093 11.791 -9.976 1.00 33.48 C ATOM 174 CG2 ILE A 48 9.308 12.393 -10.997 1.00 35.72 C ATOM 175 CD1 ILE A 48 6.195 12.686 -10.719 1.00 33.69 C ATOM 176 H ILE A 48 7.889 12.736 -7.141 1.00 0.00 H ATOM 177 N ALA A 49 10.709 13.332 -7.638 1.00 31.42 N ATOM 178 CA ALA A 49 12.008 13.968 -7.403 1.00 35.30 C ATOM 179 C ALA A 49 11.844 14.942 -6.258 1.00 34.12 C ATOM 180 O ALA A 49 10.729 15.134 -5.798 1.00 33.82 O ATOM 181 CB ALA A 49 12.503 14.676 -8.639 1.00 37.00 C ATOM 182 H ALA A 49 9.864 13.735 -7.184 1.00 0.00 H ATOM 183 N ASP A 50 12.919 15.566 -5.787 1.00 35.14 N ATOM 184 CA ASP A 50 12.731 16.551 -4.726 1.00 36.13 C ATOM 185 C ASP A 50 11.752 17.630 -5.198 1.00 31.66 C ATOM 186 O ASP A 50 11.908 18.225 -6.248 1.00 32.92 O ATOM 187 CB ASP A 50 14.053 17.183 -4.281 1.00 40.15 C ATOM 188 CG ASP A 50 14.960 16.194 -3.559 1.00 45.78 C ATOM 189 OD1 ASP A 50 14.447 15.231 -2.940 1.00 47.67 O ATOM 190 OD2 ASP A 50 16.189 16.380 -3.622 1.00 49.12 O ATOM 191 H ASP A 50 13.866 15.359 -6.163 1.00 0.00 H ATOM 192 N GLY A 51 10.705 17.841 -4.432 1.00 30.72 N ATOM 193 CA GLY A 51 9.764 18.891 -4.735 1.00 28.41 C ATOM 194 C GLY A 51 8.809 18.610 -5.875 1.00 26.19 C ATOM 195 O GLY A 51 8.094 19.514 -6.318 1.00 24.71 O ATOM 196 H GLY A 51 10.553 17.242 -3.595 1.00 0.00 H ATOM 197 N VAL A 52 8.776 17.362 -6.339 1.00 24.13 N ATOM 198 CA VAL A 52 7.857 16.977 -7.395 1.00 21.12 C ATOM 199 C VAL A 52 7.207 15.646 -7.095 1.00 22.01 C ATOM 200 O VAL A 52 7.895 14.645 -6.899 1.00 25.21 O ATOM 201 CB VAL A 52 8.550 16.869 -8.751 1.00 24.31 C ATOM 202 CG1 VAL A 52 7.512 16.589 -9.825 1.00 25.01 C ATOM 203 CG2 VAL A 52 9.301 18.139 -9.046 1.00 26.24 C ATOM 204 H VAL A 52 9.420 16.651 -5.938 1.00 0.00 H ATOM 205 N TRP A 53 5.875 15.660 -7.059 1.00 20.28 N ATOM 206 CA TRP A 53 5.091 14.459 -6.864 1.00 22.96 C ATOM 207 C TRP A 53 4.062 14.302 -7.987 1.00 22.49 C ATOM 208 O TRP A 53 3.599 15.295 -8.543 1.00 23.34 O ATOM 209 CB TRP A 53 4.334 14.499 -5.545 1.00 21.32 C ATOM 210 CG TRP A 53 5.145 14.690 -4.293 1.00 23.25 C ATOM 211 CD1 TRP A 53 5.477 13.741 -3.384 1.00 26.95 C ATOM 212 CD2 TRP A 53 5.658 15.936 -3.781 1.00 24.88 C ATOM 213 NE1 TRP A 53 6.196 14.304 -2.350 1.00 26.75 N ATOM 214 CE2 TRP A 53 6.305 15.654 -2.563 1.00 26.80 C ATOM 215 CE3 TRP A 53 5.612 17.258 -4.231 1.00 24.95 C ATOM 216 CZ2 TRP A 53 6.933 16.642 -1.796 1.00 27.42 C ATOM 217 CZ3 TRP A 53 6.225 18.236 -3.480 1.00 26.06 C ATOM 218 CH2 TRP A 53 6.875 17.924 -2.264 1.00 25.62 C ATOM 219 HE1 TRP A 53 6.592 13.787 -1.539 1.00 0.00 H ATOM 220 H TRP A 53 5.380 16.567 -7.175 1.00 0.00 H ATOM 221 N SER A 54 3.670 13.062 -8.274 1.00 21.20 N ATOM 222 CA SER A 54 2.377 12.851 -8.930 1.00 20.26 C ATOM 223 C SER A 54 1.325 12.506 -7.887 1.00 20.61 C ATOM 224 O SER A 54 1.647 12.016 -6.766 1.00 20.62 O ATOM 225 CB SER A 54 2.453 11.754 -10.007 1.00 20.60 C ATOM 226 OG SER A 54 2.727 10.501 -9.424 1.00 23.93 O ATOM 227 HG SER A 54 2.772 9.811 -10.133 1.00 0.00 H ATOM 228 H SER A 54 4.276 12.251 -8.035 1.00 0.00 H ATOM 229 N HIS A 55 0.073 12.801 -8.231 1.00 18.06 N ATOM 230 CA HIS A 55 -1.061 12.280 -7.508 1.00 19.92 C ATOM 231 C HIS A 55 -1.812 11.323 -8.420 1.00 21.21 C ATOM 232 O HIS A 55 -1.935 11.555 -9.620 1.00 21.34 O ATOM 233 CB HIS A 55 -1.991 13.384 -6.932 1.00 18.81 C ATOM 234 CG HIS A 55 -2.595 14.333 -7.923 1.00 18.58 C ATOM 235 ND1 HIS A 55 -3.803 14.090 -8.549 1.00 20.28 N ATOM 236 CD2 HIS A 55 -2.233 15.585 -8.288 1.00 21.27 C ATOM 237 CE1 HIS A 55 -4.112 15.110 -9.324 1.00 19.97 C ATOM 238 NE2 HIS A 55 -3.183 16.045 -9.175 1.00 20.39 N ATOM 239 H HIS A 55 -0.092 13.426 -9.046 1.00 0.00 H ATOM 240 N ILE A 56 -2.260 10.228 -7.810 1.00 21.89 N ATOM 241 CA ILE A 56 -2.976 9.171 -8.498 1.00 20.26 C ATOM 242 C ILE A 56 -4.300 8.917 -7.804 1.00 18.21 C ATOM 243 O ILE A 56 -4.378 8.712 -6.564 1.00 19.51 O ATOM 244 CB ILE A 56 -2.136 7.868 -8.549 1.00 20.69 C ATOM 245 CG1 ILE A 56 -0.725 8.183 -9.046 1.00 22.19 C ATOM 246 CG2 ILE A 56 -2.785 6.833 -9.471 1.00 22.25 C ATOM 247 CD1 ILE A 56 0.307 8.423 -7.972 1.00 23.53 C ATOM 248 H ILE A 56 -2.088 10.125 -6.789 1.00 0.00 H ATOM 249 N ALA A 57 -5.357 8.955 -8.599 1.00 15.33 N ATOM 250 CA ALA A 57 -6.691 8.652 -8.123 1.00 19.12 C ATOM 251 C ALA A 57 -7.398 7.770 -9.135 1.00 21.02 C ATOM 252 O ALA A 57 -6.869 7.523 -10.228 1.00 22.34 O ATOM 253 CB ALA A 57 -7.455 9.927 -7.896 1.00 18.40 C ATOM 254 H ALA A 57 -5.226 9.211 -9.598 1.00 0.00 H ATOM 255 N THR A 58 -8.623 7.365 -8.806 1.00 20.53 N ATOM 256 CA THR A 58 -9.393 6.492 -9.678 1.00 20.45 C ATOM 257 C THR A 58 -10.838 6.931 -9.758 1.00 20.13 C ATOM 258 O THR A 58 -11.378 7.516 -8.813 1.00 20.04 O ATOM 259 CB THR A 58 -9.332 5.030 -9.178 1.00 20.89 C ATOM 260 OG1 THR A 58 -9.680 4.990 -7.797 1.00 23.59 O ATOM 261 CG2 THR A 58 -7.962 4.446 -9.358 1.00 22.02 C ATOM 262 HG1 THR A 58 -9.641 4.055 -7.475 1.00 0.00 H ATOM 263 H THR A 58 -9.038 7.680 -7.906 1.00 0.00 H ATOM 264 N GLN A 59 -11.485 6.666 -10.888 1.00 20.29 N ATOM 265 CA GLN A 59 -12.851 7.125 -11.099 1.00 20.05 C ATOM 266 C GLN A 59 -13.567 6.271 -12.117 1.00 19.74 C ATOM 267 O GLN A 59 -12.931 5.728 -12.996 1.00 22.63 O ATOM 268 CB GLN A 59 -12.834 8.590 -11.572 1.00 20.14 C ATOM 269 CG GLN A 59 -14.167 9.263 -11.601 1.00 22.99 C ATOM 270 CD GLN A 59 -14.881 9.137 -10.257 1.00 25.76 C ATOM 271 OE1 GLN A 59 -15.690 8.221 -10.054 1.00 26.18 O ATOM 272 NE2 GLN A 59 -14.572 10.044 -9.338 1.00 28.53 N ATOM 273 HE22 GLN A 59 -13.886 10.794 -9.558 1.00 0.00 H ATOM 274 HE21 GLN A 59 -15.016 10.004 -8.398 1.00 0.00 H ATOM 275 H GLN A 59 -11.008 6.121 -11.635 1.00 0.00 H ATOM 276 N SER A 60 -14.883 6.180 -12.037 1.00 22.38 N ATOM 277 CA SER A 60 -15.647 5.410 -13.009 1.00 25.99 C ATOM 278 C SER A 60 -15.962 6.271 -14.220 1.00 28.41 C ATOM 279 O SER A 60 -16.290 7.467 -14.091 1.00 24.76 O ATOM 280 CB SER A 60 -16.944 4.839 -12.421 1.00 31.84 C ATOM 281 OG SER A 60 -17.704 5.868 -11.835 1.00 37.52 O ATOM 282 HG SER A 60 -17.929 6.544 -12.523 1.00 0.00 H ATOM 283 H SER A 60 -15.382 6.667 -11.266 1.00 0.00 H ATOM 284 N PHE A 61 -15.844 5.630 -15.383 1.00 29.20 N ATOM 285 CA PHE A 61 -16.153 6.216 -16.680 1.00 31.56 C ATOM 286 C PHE A 61 -16.736 5.118 -17.559 1.00 34.02 C ATOM 287 O PHE A 61 -16.041 4.133 -17.866 1.00 34.38 O ATOM 288 CB PHE A 61 -14.901 6.803 -17.327 1.00 31.77 C ATOM 289 CG PHE A 61 -15.107 7.267 -18.769 1.00 39.47 C ATOM 290 CD1 PHE A 61 -15.853 8.394 -19.047 1.00 42.29 C ATOM 291 CD2 PHE A 61 -14.538 6.575 -19.834 1.00 43.81 C ATOM 292 CE1 PHE A 61 -16.043 8.828 -20.362 1.00 46.77 C ATOM 293 CE2 PHE A 61 -14.722 6.998 -21.150 1.00 47.42 C ATOM 294 CZ PHE A 61 -15.476 8.124 -21.410 1.00 48.81 C ATOM 295 H PHE A 61 -15.509 4.646 -15.363 1.00 0.00 H ATOM 296 N ASP A 62 -18.005 5.280 -17.935 1.00 35.41 N ATOM 297 CA ASP A 62 -18.715 4.356 -18.814 1.00 39.13 C ATOM 298 C ASP A 62 -18.620 2.907 -18.341 1.00 37.89 C ATOM 299 O ASP A 62 -18.417 2.004 -19.144 1.00 37.72 O ATOM 300 CB ASP A 62 -18.193 4.474 -20.265 1.00 42.69 C ATOM 301 CG ASP A 62 -19.137 3.810 -21.302 1.00 50.35 C ATOM 302 OD1 ASP A 62 -18.642 3.359 -22.360 1.00 49.93 O ATOM 303 OD2 ASP A 62 -20.369 3.736 -21.062 1.00 52.28 O ATOM 304 H ASP A 62 -18.518 6.113 -17.582 1.00 0.00 H ATOM 305 N GLY A 63 -18.778 2.676 -17.040 1.00 33.50 N ATOM 306 CA GLY A 63 -18.885 1.309 -16.560 1.00 32.03 C ATOM 307 C GLY A 63 -17.548 0.654 -16.229 1.00 27.92 C ATOM 308 O GLY A 63 -17.505 -0.549 -15.958 1.00 28.98 O ATOM 309 H GLY A 63 -18.825 3.470 -16.370 1.00 0.00 H ATOM 310 N ALA A 64 -16.467 1.419 -16.260 1.00 27.74 N ATOM 311 CA ALA A 64 -15.166 0.930 -15.786 1.00 28.34 C ATOM 312 C ALA A 64 -14.443 1.983 -14.946 1.00 25.25 C ATOM 313 O ALA A 64 -14.702 3.170 -15.057 1.00 27.38 O ATOM 314 CB ALA A 64 -14.306 0.529 -16.951 1.00 31.02 C ATOM 315 H ALA A 64 -16.541 2.389 -16.629 1.00 0.00 H ATOM 316 N VAL A 66 -13.517 1.535 -14.121 1.00 23.96 N ATOM 317 CA VAL A 66 -12.736 2.431 -13.295 1.00 22.67 C ATOM 318 C VAL A 66 -11.323 2.522 -13.829 1.00 21.80 C ATOM 319 O VAL A 66 -10.700 1.507 -14.135 1.00 23.17 O ATOM 320 CB VAL A 66 -12.754 1.962 -11.813 1.00 21.27 C ATOM 321 CG1 VAL A 66 -11.649 2.615 -11.001 1.00 23.11 C ATOM 322 CG2 VAL A 66 -14.078 2.274 -11.256 1.00 21.45 C ATOM 323 H VAL A 66 -13.343 0.511 -14.062 1.00 0.00 H ATOM 324 N TYR A 67 -10.845 3.761 -13.927 1.00 20.50 N ATOM 325 CA TYR A 67 -9.568 4.088 -14.512 1.00 22.24 C ATOM 326 C TYR A 67 -8.752 4.894 -13.540 1.00 21.84 C ATOM 327 O TYR A 67 -9.316 5.702 -12.802 1.00 22.04 O ATOM 328 CB TYR A 67 -9.734 4.924 -15.782 1.00 22.08 C ATOM 329 CG TYR A 67 -10.468 4.225 -16.896 1.00 24.89 C ATOM 330 CD1 TYR A 67 -11.824 4.341 -17.010 1.00 24.63 C ATOM 331 CD2 TYR A 67 -9.792 3.463 -17.836 1.00 27.87 C ATOM 332 CE1 TYR A 67 -12.513 3.686 -18.008 1.00 26.58 C ATOM 333 CE2 TYR A 67 -10.468 2.826 -18.846 1.00 31.29 C ATOM 334 CZ TYR A 67 -11.832 2.957 -18.926 1.00 29.89 C ATOM 335 OH TYR A 67 -12.537 2.325 -19.920 1.00 33.77 O ATOM 336 HH TYR A 67 -13.500 2.531 -19.822 1.00 0.00 H ATOM 337 H TYR A 67 -11.428 4.540 -13.559 1.00 0.00 H ATOM 338 N PRO A 68 -7.424 4.741 -13.599 1.00 22.13 N ATOM 339 CA PRO A 68 -6.532 5.584 -12.823 1.00 19.94 C ATOM 340 C PRO A 68 -6.285 6.884 -13.571 1.00 20.13 C ATOM 341 O PRO A 68 -6.553 6.997 -14.789 1.00 23.18 O ATOM 342 CB PRO A 68 -5.276 4.728 -12.704 1.00 22.15 C ATOM 343 CG PRO A 68 -5.219 4.002 -14.021 1.00 22.37 C ATOM 344 CD PRO A 68 -6.653 3.870 -14.514 1.00 22.94 C ATOM 345 N SER A 69 -5.805 7.886 -12.854 1.00 16.35 N ATOM 346 CA SER A 69 -5.555 9.187 -13.464 1.00 19.96 C ATOM 347 C SER A 69 -4.449 9.843 -12.647 1.00 19.06 C ATOM 348 O SER A 69 -4.446 9.735 -11.418 1.00 20.43 O ATOM 349 CB SER A 69 -6.828 10.037 -13.462 1.00 21.11 C ATOM 350 OG SER A 69 -6.583 11.264 -14.104 1.00 23.67 O ATOM 351 HG SER A 69 -5.865 11.748 -13.625 1.00 0.00 H ATOM 352 H SER A 69 -5.603 7.745 -11.844 1.00 0.00 H ATOM 353 N ASN A 70 -3.539 10.516 -13.352 1.00 17.89 N ATOM 354 CA ASN A 70 -2.399 11.217 -12.767 1.00 18.40 C ATOM 355 C ASN A 70 -2.589 12.751 -12.818 1.00 19.55 C ATOM 356 O ASN A 70 -3.054 13.283 -13.824 1.00 19.80 O ATOM 357 CB ASN A 70 -1.116 10.894 -13.548 1.00 19.72 C ATOM 358 CG ASN A 70 -0.696 9.436 -13.437 1.00 21.17 C ATOM 359 OD1 ASN A 70 -0.738 8.847 -12.366 1.00 23.23 O ATOM 360 ND2 ASN A 70 -0.290 8.857 -14.552 1.00 24.38 N ATOM 361 HD22 ASN A 70 -0.271 9.397 -15.441 1.00 0.00 H ATOM 362 HD21 ASN A 70 0.010 7.861 -14.541 1.00 0.00 H ATOM 363 H ASN A 70 -3.648 10.544 -14.386 1.00 0.00 H ATOM 364 N GLY A 71 -2.124 13.434 -11.781 1.00 19.76 N ATOM 365 CA GLY A 71 -1.834 14.850 -11.835 1.00 18.74 C ATOM 366 C GLY A 71 -0.417 15.056 -11.283 1.00 20.57 C ATOM 367 O GLY A 71 0.286 14.082 -10.942 1.00 20.60 O ATOM 368 H GLY A 71 -1.960 12.928 -10.887 1.00 0.00 H ATOM 369 N LEU A 72 -0.042 16.315 -11.128 1.00 18.48 N ATOM 370 CA LEU A 72 1.266 16.702 -10.619 1.00 19.47 C ATOM 371 C LEU A 72 1.150 17.673 -9.449 1.00 20.30 C ATOM 372 O LEU A 72 0.199 18.471 -9.369 1.00 19.80 O ATOM 373 CB LEU A 72 2.080 17.345 -11.736 1.00 23.02 C ATOM 374 CG LEU A 72 3.599 17.164 -11.697 1.00 24.84 C ATOM 375 CD1 LEU A 72 3.931 15.719 -11.895 1.00 24.50 C ATOM 376 CD2 LEU A 72 4.290 18.045 -12.748 1.00 26.67 C ATOM 377 H LEU A 72 -0.715 17.066 -11.382 1.00 0.00 H ATOM 378 N ILE A 73 2.135 17.614 -8.553 1.00 18.61 N ATOM 379 CA ILE A 73 2.306 18.586 -7.478 1.00 17.64 C ATOM 380 C ILE A 73 3.754 19.058 -7.506 1.00 18.83 C ATOM 381 O ILE A 73 4.678 18.231 -7.552 1.00 19.36 O ATOM 382 CB ILE A 73 2.005 17.991 -6.111 1.00 16.70 C ATOM 383 CG1 ILE A 73 0.609 17.321 -6.063 1.00 19.03 C ATOM 384 CG2 ILE A 73 2.115 19.074 -4.985 1.00 24.38 C ATOM 385 CD1 ILE A 73 0.491 16.404 -4.860 1.00 22.88 C ATOM 386 H ILE A 73 2.818 16.833 -8.624 1.00 0.00 H ATOM 387 N VAL A 74 3.965 20.376 -7.475 1.00 18.51 N ATOM 388 CA VAL A 74 5.322 20.933 -7.557 1.00 21.30 C ATOM 389 C VAL A 74 5.517 21.950 -6.448 1.00 20.69 C ATOM 390 O VAL A 74 4.699 22.868 -6.288 1.00 23.02 O ATOM 391 CB VAL A 74 5.609 21.640 -8.917 1.00 21.93 C ATOM 392 CG1 VAL A 74 7.046 22.042 -8.982 1.00 23.47 C ATOM 393 CG2 VAL A 74 5.228 20.739 -10.091 1.00 23.61 C ATOM 394 H VAL A 74 3.153 21.021 -7.391 1.00 0.00 H ATOM 395 N ARG A 75 6.570 21.771 -5.657 1.00 21.02 N ATOM 396 CA ARG A 75 6.922 22.767 -4.651 1.00 19.36 C ATOM 397 C ARG A 75 7.260 24.134 -5.293 1.00 22.00 C ATOM 398 O ARG A 75 8.060 24.223 -6.234 1.00 24.22 O ATOM 399 CB ARG A 75 8.094 22.313 -3.797 1.00 23.20 C ATOM 400 CG ARG A 75 8.293 23.272 -2.606 1.00 23.37 C ATOM 401 CD ARG A 75 9.399 22.863 -1.665 1.00 25.93 C ATOM 402 NE ARG A 75 10.758 22.964 -2.201 1.00 25.73 N ATOM 403 CZ ARG A 75 11.520 24.058 -2.159 1.00 26.67 C ATOM 404 NH1 ARG A 75 11.073 25.208 -1.645 1.00 26.31 N ATOM 405 NH2 ARG A 75 12.721 24.014 -2.650 1.00 28.44 N ATOM 406 HE ARG A 75 11.161 22.116 -2.650 1.00 0.00 H ATOM 407 HH12 ARG A 75 11.691 26.044 -1.626 1.00 0.00 H ATOM 408 HH11 ARG A 75 10.107 25.267 -1.264 1.00 0.00 H ATOM 409 HH22 ARG A 75 13.325 24.860 -2.623 1.00 0.00 H ATOM 410 HH21 ARG A 75 13.079 23.133 -3.070 1.00 0.00 H ATOM 411 H ARG A 75 7.149 20.913 -5.756 1.00 0.00 H ATOM 412 N ASP A 76 6.647 25.169 -4.735 1.00 21.68 N ATOM 413 CA ASP A 76 6.714 26.562 -5.208 1.00 25.54 C ATOM 414 C ASP A 76 7.130 27.433 -3.997 1.00 24.29 C ATOM 415 O ASP A 76 6.316 28.146 -3.441 1.00 26.15 O ATOM 416 CB ASP A 76 5.339 26.958 -5.763 1.00 25.95 C ATOM 417 CG ASP A 76 5.287 28.358 -6.352 1.00 31.84 C ATOM 418 OD1 ASP A 76 6.360 28.957 -6.638 1.00 30.18 O ATOM 419 OD2 ASP A 76 4.120 28.835 -6.557 1.00 34.55 O ATOM 420 H ASP A 76 6.069 24.981 -3.891 1.00 0.00 H ATOM 421 N GLY A 77 8.370 27.281 -3.558 1.00 25.22 N ATOM 422 CA GLY A 77 8.861 27.986 -2.374 1.00 27.54 C ATOM 423 C GLY A 77 8.212 27.358 -1.146 1.00 27.01 C ATOM 424 O GLY A 77 8.450 26.192 -0.832 1.00 23.73 O ATOM 425 H GLY A 77 9.013 26.643 -4.069 1.00 0.00 H ATOM 426 N ASP A 78 7.347 28.118 -0.488 1.00 26.97 N ATOM 427 CA ASP A 78 6.689 27.654 0.728 1.00 26.69 C ATOM 428 C ASP A 78 5.277 27.125 0.451 1.00 24.55 C ATOM 429 O ASP A 78 4.581 26.652 1.345 1.00 25.66 O ATOM 430 CB ASP A 78 6.676 28.788 1.758 1.00 30.69 C ATOM 431 CG ASP A 78 6.006 30.057 1.227 1.00 34.30 C ATOM 432 OD1 ASP A 78 6.141 30.358 0.018 1.00 33.39 O ATOM 433 OD2 ASP A 78 5.346 30.745 2.029 1.00 36.31 O ATOM 434 H ASP A 78 7.132 29.070 -0.849 1.00 0.00 H ATOM 435 N GLU A 79 4.890 27.131 -0.819 1.00 21.25 N ATOM 436 CA GLU A 79 3.549 26.767 -1.265 1.00 22.74 C ATOM 437 C GLU A 79 3.648 25.606 -2.253 1.00 22.82 C ATOM 438 O GLU A 79 4.746 25.239 -2.645 1.00 24.82 O ATOM 439 CB GLU A 79 2.892 27.964 -1.941 1.00 24.99 C ATOM 440 CG GLU A 79 2.941 29.241 -1.129 1.00 29.87 C ATOM 441 CD GLU A 79 2.380 30.480 -1.856 1.00 34.97 C ATOM 442 OE1 GLU A 79 2.042 30.417 -3.067 1.00 33.96 O ATOM 443 OE2 GLU A 79 2.273 31.531 -1.187 1.00 39.97 O ATOM 444 H GLU A 79 5.585 27.412 -1.540 1.00 0.00 H ATOM 445 N LEU A 80 2.510 25.031 -2.629 1.00 21.09 N ATOM 446 CA LEU A 80 2.471 24.021 -3.683 1.00 20.97 C ATOM 447 C LEU A 80 1.672 24.487 -4.876 1.00 19.82 C ATOM 448 O LEU A 80 0.643 25.135 -4.728 1.00 21.84 O ATOM 449 CB LEU A 80 1.864 22.729 -3.155 1.00 21.76 C ATOM 450 CG LEU A 80 2.561 22.187 -1.910 1.00 22.29 C ATOM 451 CD1 LEU A 80 1.805 20.995 -1.430 1.00 22.21 C ATOM 452 CD2 LEU A 80 4.015 21.858 -2.185 1.00 23.84 C ATOM 453 H LEU A 80 1.624 25.308 -2.160 1.00 0.00 H ATOM 454 N LEU A 81 2.142 24.108 -6.052 1.00 18.46 N ATOM 455 CA LEU A 81 1.430 24.272 -7.305 1.00 20.16 C ATOM 456 C LEU A 81 0.826 22.898 -7.674 1.00 19.36 C ATOM 457 O LEU A 81 1.521 21.910 -7.678 1.00 21.21 O ATOM 458 CB LEU A 81 2.364 24.756 -8.414 1.00 21.92 C ATOM 459 CG LEU A 81 1.753 24.793 -9.823 1.00 21.05 C ATOM 460 CD1 LEU A 81 0.605 25.763 -9.834 1.00 18.57 C ATOM 461 CD2 LEU A 81 2.783 25.170 -10.909 1.00 23.82 C ATOM 462 H LEU A 81 3.082 23.664 -6.081 1.00 0.00 H ATOM 463 N LEU A 82 -0.468 22.861 -7.940 1.00 17.69 N ATOM 464 CA LEU A 82 -1.156 21.629 -8.302 1.00 17.00 C ATOM 465 C LEU A 82 -1.420 21.711 -9.766 1.00 17.89 C ATOM 466 O LEU A 82 -1.895 22.735 -10.243 1.00 18.53 O ATOM 467 CB LEU A 82 -2.468 21.508 -7.518 1.00 20.39 C ATOM 468 CG LEU A 82 -3.372 20.347 -7.846 1.00 20.71 C ATOM 469 CD1 LEU A 82 -2.709 19.016 -7.429 1.00 20.19 C ATOM 470 CD2 LEU A 82 -4.697 20.576 -7.140 1.00 21.82 C ATOM 471 H LEU A 82 -1.015 23.744 -7.889 1.00 0.00 H ATOM 472 N ILE A 83 -1.161 20.617 -10.466 1.00 16.89 N ATOM 473 CA ILE A 83 -1.544 20.438 -11.867 1.00 17.35 C ATOM 474 C ILE A 83 -2.613 19.341 -11.910 1.00 16.97 C ATOM 475 O ILE A 83 -2.344 18.167 -11.611 1.00 17.92 O ATOM 476 CB ILE A 83 -0.372 19.992 -12.759 1.00 18.17 C ATOM 477 CG1 ILE A 83 0.878 20.876 -12.540 1.00 19.35 C ATOM 478 CG2 ILE A 83 -0.804 19.990 -14.197 1.00 20.59 C ATOM 479 CD1 ILE A 83 0.672 22.359 -12.837 1.00 22.20 C ATOM 480 H ILE A 83 -0.656 19.840 -9.993 1.00 0.00 H ATOM 481 N ASP A 84 -3.817 19.796 -12.228 1.00 18.68 N ATOM 482 CA ASP A 84 -5.016 19.039 -12.456 1.00 18.71 C ATOM 483 C ASP A 84 -5.661 18.537 -11.172 1.00 20.38 C ATOM 484 O ASP A 84 -4.993 18.247 -10.173 1.00 18.27 O ATOM 485 CB ASP A 84 -4.735 17.882 -13.433 1.00 22.08 C ATOM 486 CG ASP A 84 -4.554 18.379 -14.859 1.00 23.19 C ATOM 487 OD1 ASP A 84 -5.265 19.351 -15.244 1.00 24.28 O ATOM 488 OD2 ASP A 84 -3.747 17.790 -15.640 1.00 23.46 O ATOM 489 H ASP A 84 -3.904 20.828 -12.324 1.00 0.00 H ATOM 490 N THR A 85 -6.991 18.443 -11.218 1.00 20.34 N ATOM 491 CA THR A 85 -7.729 17.909 -10.089 1.00 21.13 C ATOM 492 C THR A 85 -7.510 16.392 -10.038 1.00 21.23 C ATOM 493 O THR A 85 -6.866 15.810 -10.923 1.00 21.84 O ATOM 494 CB THR A 85 -9.217 18.202 -10.200 1.00 22.26 C ATOM 495 OG1 THR A 85 -9.758 17.446 -11.284 1.00 23.51 O ATOM 496 CG2 THR A 85 -9.506 19.693 -10.421 1.00 22.10 C ATOM 497 HG1 THR A 85 -10.727 17.631 -11.363 1.00 0.00 H ATOM 498 H THR A 85 -7.502 18.755 -12.069 1.00 0.00 H ATOM 499 N ALA A 86 -8.089 15.742 -9.027 1.00 18.90 N ATOM 500 CA ALA A 86 -8.027 14.289 -8.931 1.00 18.87 C ATOM 501 C ALA A 86 -9.292 13.593 -9.482 1.00 20.75 C ATOM 502 O ALA A 86 -9.650 12.498 -9.052 1.00 20.93 O ATOM 503 CB ALA A 86 -7.776 13.894 -7.485 1.00 19.56 C ATOM 504 H ALA A 86 -8.593 16.281 -8.295 1.00 0.00 H ATOM 505 N TRP A 87 -9.946 14.227 -10.446 1.00 19.15 N ATOM 506 CA TRP A 87 -11.118 13.707 -11.128 1.00 20.23 C ATOM 507 C TRP A 87 -12.328 13.493 -10.225 1.00 21.58 C ATOM 508 O TRP A 87 -12.712 12.363 -9.937 1.00 23.77 O ATOM 509 CB TRP A 87 -10.772 12.398 -11.822 1.00 19.58 C ATOM 510 CG TRP A 87 -11.744 11.916 -12.843 1.00 21.38 C ATOM 511 CD1 TRP A 87 -12.957 12.438 -13.191 1.00 23.45 C ATOM 512 CD2 TRP A 87 -11.540 10.788 -13.671 1.00 22.19 C ATOM 513 NE1 TRP A 87 -13.516 11.687 -14.204 1.00 25.29 N ATOM 514 CE2 TRP A 87 -12.659 10.664 -14.503 1.00 24.15 C ATOM 515 CE3 TRP A 87 -10.511 9.851 -13.777 1.00 23.23 C ATOM 516 CZ2 TRP A 87 -12.775 9.627 -15.437 1.00 26.90 C ATOM 517 CZ3 TRP A 87 -10.634 8.834 -14.703 1.00 24.16 C ATOM 518 CH2 TRP A 87 -11.749 8.728 -15.509 1.00 24.29 C ATOM 519 HE1 TRP A 87 -14.432 11.868 -14.662 1.00 0.00 H ATOM 520 H TRP A 87 -9.595 15.163 -10.734 1.00 0.00 H ATOM 521 N GLY A 88 -12.883 14.599 -9.777 1.00 22.18 N ATOM 522 CA GLY A 88 -14.161 14.639 -9.093 1.00 25.33 C ATOM 523 C GLY A 88 -13.960 15.356 -7.769 1.00 23.93 C ATOM 524 O GLY A 88 -12.861 15.414 -7.246 1.00 20.54 O ATOM 525 H GLY A 88 -12.376 15.495 -9.922 1.00 0.00 H ATOM 526 N ALA A 89 -15.052 15.876 -7.228 1.00 24.02 N ATOM 527 CA ALA A 89 -15.012 16.582 -5.956 1.00 21.61 C ATOM 528 C ALA A 89 -14.496 15.677 -4.821 1.00 18.82 C ATOM 529 O ALA A 89 -13.653 16.090 -4.049 1.00 18.41 O ATOM 530 CB ALA A 89 -16.395 17.115 -5.628 1.00 21.33 C ATOM 531 H ALA A 89 -15.960 15.777 -7.725 1.00 0.00 H ATOM 532 N LYS A 90 -15.065 14.487 -4.686 1.00 21.59 N ATOM 533 CA LYS A 90 -14.689 13.610 -3.559 1.00 23.09 C ATOM 534 C LYS A 90 -13.189 13.287 -3.608 1.00 19.20 C ATOM 535 O LYS A 90 -12.471 13.436 -2.633 1.00 18.19 O ATOM 536 CB LYS A 90 -15.517 12.340 -3.575 1.00 25.66 C ATOM 537 CG LYS A 90 -15.255 11.464 -2.347 1.00 28.36 C ATOM 538 CD LYS A 90 -16.110 10.195 -2.324 1.00 35.43 C ATOM 539 CE LYS A 90 -15.808 9.354 -1.084 1.00 40.09 C ATOM 540 NZ LYS A 90 -16.717 8.177 -0.987 1.00 46.41 N ATOM 541 HZ1 LYS A 90 -17.702 8.505 -0.931 1.00 0.00 H ATOM 542 HZ2 LYS A 90 -16.597 7.578 -1.829 1.00 0.00 H ATOM 543 HZ3 LYS A 90 -16.483 7.629 -0.134 1.00 0.00 H ATOM 544 H LYS A 90 -15.777 14.171 -5.375 1.00 0.00 H ATOM 545 N ASN A 91 -12.696 12.885 -4.771 1.00 19.07 N ATOM 546 CA ASN A 91 -11.268 12.607 -4.928 1.00 19.49 C ATOM 547 C ASN A 91 -10.379 13.833 -4.657 1.00 19.24 C ATOM 548 O ASN A 91 -9.321 13.746 -4.059 1.00 16.97 O ATOM 549 CB ASN A 91 -10.996 12.102 -6.352 1.00 19.66 C ATOM 550 CG ASN A 91 -11.435 10.664 -6.589 1.00 21.03 C ATOM 551 OD1 ASN A 91 -11.929 9.984 -5.713 1.00 24.41 O ATOM 552 ND2 ASN A 91 -11.265 10.200 -7.828 1.00 19.29 N ATOM 553 HD22 ASN A 91 -10.839 10.807 -8.557 1.00 0.00 H ATOM 554 HD21 ASN A 91 -11.559 9.231 -8.065 1.00 0.00 H ATOM 555 H ASN A 91 -13.334 12.765 -5.584 1.00 0.00 H ATOM 556 N THR A 92 -10.804 15.008 -5.119 1.00 17.14 N ATOM 557 CA THR A 92 -9.991 16.200 -4.937 1.00 15.48 C ATOM 558 C THR A 92 -9.941 16.598 -3.468 1.00 16.47 C ATOM 559 O THR A 92 -8.932 17.069 -3.016 1.00 17.49 O ATOM 560 CB THR A 92 -10.505 17.333 -5.830 1.00 18.38 C ATOM 561 OG1 THR A 92 -10.377 16.895 -7.190 1.00 20.79 O ATOM 562 CG2 THR A 92 -9.716 18.588 -5.709 1.00 21.23 C ATOM 563 HG1 THR A 92 -10.915 16.075 -7.323 1.00 0.00 H ATOM 564 H THR A 92 -11.718 15.073 -5.610 1.00 0.00 H ATOM 565 N ALA A 93 -11.018 16.377 -2.721 1.00 19.17 N ATOM 566 CA ALA A 93 -10.947 16.593 -1.280 1.00 21.56 C ATOM 567 C ALA A 93 -9.960 15.607 -0.619 1.00 22.52 C ATOM 568 O ALA A 93 -9.242 15.978 0.295 1.00 19.08 O ATOM 569 CB ALA A 93 -12.319 16.472 -0.659 1.00 21.37 C ATOM 570 H ALA A 93 -11.903 16.053 -3.160 1.00 0.00 H ATOM 571 N ALA A 94 -9.933 14.355 -1.074 1.00 22.15 N ATOM 572 CA ALA A 94 -9.017 13.378 -0.502 1.00 19.67 C ATOM 573 C ALA A 94 -7.574 13.773 -0.848 1.00 19.51 C ATOM 574 O ALA A 94 -6.678 13.604 -0.043 1.00 21.22 O ATOM 575 CB ALA A 94 -9.356 11.959 -0.999 1.00 20.77 C ATOM 576 H ALA A 94 -10.572 14.073 -1.845 1.00 0.00 H ATOM 577 N LEU A 95 -7.366 14.318 -2.045 1.00 17.92 N ATOM 578 CA LEU A 95 -6.083 14.846 -2.461 1.00 18.34 C ATOM 579 C LEU A 95 -5.582 15.935 -1.531 1.00 19.76 C ATOM 580 O LEU A 95 -4.461 15.887 -1.106 1.00 19.10 O ATOM 581 CB LEU A 95 -6.173 15.379 -3.890 1.00 17.79 C ATOM 582 CG LEU A 95 -5.002 16.158 -4.444 1.00 20.92 C ATOM 583 CD1 LEU A 95 -3.743 15.308 -4.473 1.00 22.20 C ATOM 584 CD2 LEU A 95 -5.312 16.654 -5.823 1.00 22.21 C ATOM 585 H LEU A 95 -8.162 14.367 -2.712 1.00 0.00 H ATOM 586 N LEU A 96 -6.425 16.923 -1.226 1.00 18.66 N ATOM 587 CA LEU A 96 -6.019 17.976 -0.293 1.00 20.30 C ATOM 588 C LEU A 96 -5.681 17.434 1.078 1.00 18.68 C ATOM 589 O LEU A 96 -4.729 17.886 1.682 1.00 19.82 O ATOM 590 CB LEU A 96 -7.095 19.042 -0.179 1.00 20.75 C ATOM 591 CG LEU A 96 -7.306 19.866 -1.455 1.00 21.84 C ATOM 592 CD1 LEU A 96 -8.416 20.889 -1.252 1.00 24.80 C ATOM 593 CD2 LEU A 96 -6.028 20.539 -1.891 1.00 23.41 C ATOM 594 H LEU A 96 -7.373 16.945 -1.652 1.00 0.00 H ATOM 595 N ALA A 97 -6.413 16.441 1.539 1.00 20.36 N ATOM 596 CA ALA A 97 -6.168 15.881 2.873 1.00 23.31 C ATOM 597 C ALA A 97 -4.866 15.096 2.895 1.00 21.97 C ATOM 598 O ALA A 97 -4.123 15.112 3.871 1.00 24.00 O ATOM 599 CB ALA A 97 -7.330 14.993 3.285 1.00 22.76 C ATOM 600 H ALA A 97 -7.175 16.049 0.950 1.00 0.00 H ATOM 601 N GLU A 98 -4.609 14.378 1.806 1.00 20.37 N ATOM 602 CA GLU A 98 -3.384 13.616 1.636 1.00 22.96 C ATOM 603 C GLU A 98 -2.171 14.557 1.592 1.00 22.38 C ATOM 604 O GLU A 98 -1.139 14.288 2.185 1.00 22.64 O ATOM 605 CB GLU A 98 -3.509 12.799 0.350 1.00 27.98 C ATOM 606 CG GLU A 98 -3.098 11.348 0.352 1.00 37.13 C ATOM 607 CD GLU A 98 -3.434 10.542 1.629 1.00 37.27 C ATOM 608 OE1 GLU A 98 -4.493 9.848 1.753 1.00 38.17 O ATOM 609 OE2 GLU A 98 -2.565 10.562 2.490 1.00 35.34 O ATOM 610 H GLU A 98 -5.315 14.361 1.043 1.00 0.00 H ATOM 611 N ILE A 99 -2.299 15.665 0.881 1.00 20.18 N ATOM 612 CA ILE A 99 -1.217 16.630 0.798 1.00 20.94 C ATOM 613 C ILE A 99 -0.939 17.191 2.184 1.00 22.52 C ATOM 614 O ILE A 99 0.200 17.372 2.566 1.00 22.54 O ATOM 615 CB ILE A 99 -1.576 17.749 -0.202 1.00 19.52 C ATOM 616 CG1 ILE A 99 -1.581 17.165 -1.628 1.00 18.40 C ATOM 617 CG2 ILE A 99 -0.647 18.978 -0.075 1.00 21.08 C ATOM 618 CD1 ILE A 99 -2.008 18.103 -2.691 1.00 20.78 C ATOM 619 H ILE A 99 -3.188 15.848 0.374 1.00 0.00 H ATOM 620 N GLU A 100 -1.991 17.458 2.938 1.00 23.10 N ATOM 621 CA GLU A 100 -1.816 18.113 4.237 1.00 25.35 C ATOM 622 C GLU A 100 -1.155 17.138 5.216 1.00 27.20 C ATOM 623 O GLU A 100 -0.259 17.507 5.973 1.00 27.51 O ATOM 624 CB GLU A 100 -3.158 18.620 4.758 1.00 29.03 C ATOM 625 CG GLU A 100 -3.098 19.127 6.218 1.00 36.57 C ATOM 626 CD GLU A 100 -2.124 20.287 6.420 1.00 44.04 C ATOM 627 OE1 GLU A 100 -1.703 20.933 5.420 1.00 44.62 O ATOM 628 OE2 GLU A 100 -1.766 20.556 7.596 1.00 47.70 O ATOM 629 H GLU A 100 -2.944 17.203 2.609 1.00 0.00 H ATOM 630 N LYS A 102 -1.560 15.878 5.138 1.00 26.93 N ATOM 631 CA LYS A 102 -1.002 14.814 5.944 1.00 29.08 C ATOM 632 C LYS A 102 0.453 14.536 5.585 1.00 30.05 C ATOM 633 O LYS A 102 1.290 14.410 6.465 1.00 30.84 O ATOM 634 CB LYS A 102 -1.834 13.548 5.777 1.00 32.16 C ATOM 635 CG LYS A 102 -1.245 12.305 6.449 1.00 38.17 C ATOM 636 CD LYS A 102 -2.128 11.056 6.243 1.00 40.44 C ATOM 637 CE LYS A 102 -1.627 9.870 7.063 1.00 43.95 C ATOM 638 NZ LYS A 102 -2.380 8.610 6.757 1.00 44.10 N ATOM 639 HZ1 LYS A 102 -3.388 8.749 6.972 1.00 0.00 H ATOM 640 HZ2 LYS A 102 -2.268 8.377 5.750 1.00 0.00 H ATOM 641 HZ3 LYS A 102 -2.004 7.833 7.338 1.00 0.00 H ATOM 642 H LYS A 102 -2.316 15.643 4.464 1.00 0.00 H ATOM 643 N GLN A 103 0.768 14.426 4.297 1.00 27.36 N ATOM 644 CA GLN A 103 2.094 13.948 3.884 1.00 28.80 C ATOM 645 C GLN A 103 3.143 15.031 3.592 1.00 28.08 C ATOM 646 O GLN A 103 4.338 14.771 3.725 1.00 29.07 O ATOM 647 CB GLN A 103 1.968 13.069 2.641 1.00 30.78 C ATOM 648 CG GLN A 103 1.198 11.799 2.925 1.00 33.86 C ATOM 649 CD GLN A 103 1.226 10.829 1.769 1.00 35.04 C ATOM 650 OE1 GLN A 103 0.185 10.395 1.296 1.00 37.50 O ATOM 651 NE2 GLN A 103 2.404 10.485 1.312 1.00 35.19 N ATOM 652 HE22 GLN A 103 3.264 10.878 1.744 1.00 0.00 H ATOM 653 HE21 GLN A 103 2.479 9.819 0.517 1.00 0.00 H ATOM 654 H GLN A 103 0.066 14.682 3.573 1.00 0.00 H ATOM 655 N ILE A 104 2.693 16.212 3.183 1.00 28.67 N ATOM 656 CA ILE A 104 3.596 17.295 2.795 1.00 27.95 C ATOM 657 C ILE A 104 3.444 18.509 3.726 1.00 27.58 C ATOM 658 O ILE A 104 4.453 19.052 4.228 1.00 30.37 O ATOM 659 CB ILE A 104 3.369 17.701 1.326 1.00 25.75 C ATOM 660 CG1 ILE A 104 3.530 16.465 0.424 1.00 25.41 C ATOM 661 CG2 ILE A 104 4.379 18.769 0.924 1.00 25.82 C ATOM 662 CD1 ILE A 104 3.167 16.688 -1.023 1.00 26.57 C ATOM 663 H ILE A 104 1.666 16.371 3.137 1.00 0.00 H ATOM 664 N GLY A 105 2.215 18.940 3.960 1.00 28.38 N ATOM 665 CA GLY A 105 1.952 19.942 4.983 1.00 32.36 C ATOM 666 C GLY A 105 2.256 21.358 4.519 1.00 34.81 C ATOM 667 O GLY A 105 2.418 22.244 5.342 1.00 39.58 O ATOM 668 H GLY A 105 1.424 18.557 3.404 1.00 0.00 H ATOM 669 N LEU A 106 2.360 21.569 3.209 1.00 29.48 N ATOM 670 CA LEU A 106 2.423 22.919 2.663 1.00 26.02 C ATOM 671 C LEU A 106 1.083 23.203 1.997 1.00 23.78 C ATOM 672 O LEU A 106 0.427 22.274 1.508 1.00 23.58 O ATOM 673 CB LEU A 106 3.560 23.059 1.677 1.00 25.37 C ATOM 674 CG LEU A 106 4.973 23.409 2.149 1.00 29.47 C ATOM 675 CD1 LEU A 106 5.377 22.837 3.462 1.00 31.45 C ATOM 676 CD2 LEU A 106 5.956 23.027 1.086 1.00 28.11 C ATOM 677 H LEU A 106 2.397 20.755 2.563 1.00 0.00 H ATOM 678 N PRO A 107 0.647 24.474 1.987 1.00 24.73 N ATOM 679 CA PRO A 107 -0.626 24.812 1.331 1.00 26.13 C ATOM 680 C PRO A 107 -0.556 24.738 -0.203 1.00 24.05 C ATOM 681 O PRO A 107 0.422 25.222 -0.757 1.00 24.52 O ATOM 682 CB PRO A 107 -0.863 26.260 1.762 1.00 27.68 C ATOM 683 CG PRO A 107 0.451 26.801 2.014 1.00 30.30 C ATOM 684 CD PRO A 107 1.323 25.669 2.521 1.00 29.12 C ATOM 685 N VAL A 109 -1.559 24.171 -0.846 1.00 22.70 N ATOM 686 CA VAL A 109 -1.756 24.373 -2.294 1.00 22.35 C ATOM 687 C VAL A 109 -2.344 25.763 -2.469 1.00 24.17 C ATOM 688 O VAL A 109 -3.434 26.028 -1.949 1.00 25.22 O ATOM 689 CB VAL A 109 -2.722 23.355 -2.887 1.00 23.38 C ATOM 690 CG1 VAL A 109 -2.892 23.559 -4.415 1.00 25.65 C ATOM 691 CG2 VAL A 109 -2.275 21.952 -2.556 1.00 25.71 C ATOM 692 H VAL A 109 -2.225 23.569 -0.321 1.00 0.00 H ATOM 693 N THR A 110 -1.665 26.642 -3.191 1.00 21.87 N ATOM 694 CA THR A 110 -2.160 28.000 -3.345 1.00 23.20 C ATOM 695 C THR A 110 -2.640 28.283 -4.771 1.00 22.91 C ATOM 696 O THR A 110 -3.482 29.162 -4.975 1.00 23.76 O ATOM 697 CB THR A 110 -1.116 29.011 -2.957 1.00 26.64 C ATOM 698 OG1 THR A 110 0.051 28.818 -3.748 1.00 29.02 O ATOM 699 CG2 THR A 110 -0.784 28.908 -1.451 1.00 26.84 C ATOM 700 HG1 THR A 110 0.736 29.484 -3.491 1.00 0.00 H ATOM 701 H THR A 110 -0.775 26.360 -3.649 1.00 0.00 H ATOM 702 N ARG A 111 -2.125 27.522 -5.746 1.00 22.34 N ATOM 703 CA ARG A 111 -2.561 27.660 -7.142 1.00 22.79 C ATOM 704 C ARG A 111 -2.709 26.314 -7.806 1.00 21.90 C ATOM 705 O ARG A 111 -1.993 25.365 -7.443 1.00 21.05 O ATOM 706 CB ARG A 111 -1.577 28.495 -7.925 1.00 24.35 C ATOM 707 CG ARG A 111 -1.374 29.878 -7.396 1.00 29.56 C ATOM 708 CD ARG A 111 -0.474 30.654 -8.303 1.00 32.21 C ATOM 709 NE ARG A 111 0.943 30.294 -8.183 1.00 33.68 N ATOM 710 CZ ARG A 111 1.928 30.903 -8.840 1.00 36.38 C ATOM 711 NH1 ARG A 111 1.669 31.904 -9.681 1.00 37.81 N ATOM 712 NH2 ARG A 111 3.191 30.522 -8.661 1.00 37.55 N ATOM 713 HE ARG A 111 1.194 29.513 -7.544 1.00 0.00 H ATOM 714 HH12 ARG A 111 2.447 32.372 -10.188 1.00 0.00 H ATOM 715 HH11 ARG A 111 0.689 32.218 -9.830 1.00 0.00 H ATOM 716 HH22 ARG A 111 3.957 31.001 -9.177 1.00 0.00 H ATOM 717 HH21 ARG A 111 3.412 29.745 -8.006 1.00 0.00 H ATOM 718 H ARG A 111 -1.399 26.816 -5.509 1.00 0.00 H ATOM 719 N ALA A 112 -3.669 26.210 -8.746 1.00 20.67 N ATOM 720 CA ALA A 112 -3.896 24.979 -9.494 1.00 17.98 C ATOM 721 C ALA A 112 -4.109 25.335 -10.985 1.00 21.77 C ATOM 722 O ALA A 112 -4.758 26.334 -11.293 1.00 23.48 O ATOM 723 CB ALA A 112 -5.095 24.216 -8.977 1.00 17.97 C ATOM 724 H ALA A 112 -4.269 27.036 -8.945 1.00 0.00 H ATOM 725 N VAL A 113 -3.558 24.515 -11.870 1.00 19.63 N ATOM 726 CA VAL A 113 -3.742 24.664 -13.329 1.00 19.79 C ATOM 727 C VAL A 113 -4.424 23.407 -13.842 1.00 20.86 C ATOM 728 O VAL A 113 -3.961 22.309 -13.541 1.00 20.13 O ATOM 729 CB VAL A 113 -2.406 24.854 -14.049 1.00 20.45 C ATOM 730 CG1 VAL A 113 -2.584 24.815 -15.577 1.00 22.81 C ATOM 731 CG2 VAL A 113 -1.727 26.144 -13.598 1.00 20.20 C ATOM 732 H VAL A 113 -2.970 23.731 -11.521 1.00 0.00 H ATOM 733 N SER A 114 -5.484 23.580 -14.642 1.00 21.37 N ATOM 734 CA SER A 114 -6.130 22.463 -15.301 1.00 22.00 C ATOM 735 C SER A 114 -5.634 22.413 -16.760 1.00 20.87 C ATOM 736 O SER A 114 -5.671 23.418 -17.456 1.00 21.55 O ATOM 737 CB SER A 114 -7.652 22.593 -15.235 1.00 24.05 C ATOM 738 OG SER A 114 -8.155 22.474 -13.889 1.00 23.07 O ATOM 739 HG SER A 114 -7.762 23.188 -13.327 1.00 0.00 H ATOM 740 H SER A 114 -5.853 24.540 -14.794 1.00 0.00 H ATOM 741 N THR A 115 -5.152 21.248 -17.191 1.00 20.55 N ATOM 742 CA THR A 115 -4.524 21.133 -18.508 1.00 20.63 C ATOM 743 C THR A 115 -5.493 20.838 -19.669 1.00 21.91 C ATOM 744 O THR A 115 -5.085 20.977 -20.842 1.00 23.05 O ATOM 745 CB THR A 115 -3.436 20.075 -18.502 1.00 21.59 C ATOM 746 OG1 THR A 115 -3.983 18.801 -18.138 1.00 24.27 O ATOM 747 CG2 THR A 115 -2.325 20.527 -17.536 1.00 22.03 C ATOM 748 HG1 THR A 115 -4.382 18.861 -17.234 1.00 0.00 H ATOM 749 H THR A 115 -5.223 20.408 -16.582 1.00 0.00 H ATOM 750 N HIS A 116 -6.721 20.414 -19.392 1.00 20.30 N ATOM 751 CA HIS A 116 -7.804 20.577 -20.384 1.00 20.63 C ATOM 752 C HIS A 116 -9.173 20.539 -19.708 1.00 22.71 C ATOM 753 O HIS A 116 -9.263 20.524 -18.467 1.00 20.07 O ATOM 754 CB HIS A 116 -7.685 19.558 -21.544 1.00 22.26 C ATOM 755 CG HIS A 116 -8.065 18.140 -21.236 1.00 21.26 C ATOM 756 ND1 HIS A 116 -7.188 17.245 -20.654 1.00 22.21 N ATOM 757 CD2 HIS A 116 -9.168 17.415 -21.565 1.00 22.83 C ATOM 758 CE1 HIS A 116 -7.760 16.057 -20.571 1.00 22.47 C ATOM 759 NE2 HIS A 116 -8.952 16.122 -21.144 1.00 24.09 N ATOM 760 H HIS A 116 -6.921 19.966 -18.475 1.00 0.00 H ATOM 761 N PHE A 117 -10.230 20.559 -20.510 1.00 22.12 N ATOM 762 CA PHE A 117 -11.519 20.940 -19.974 1.00 23.49 C ATOM 763 C PHE A 117 -12.364 19.780 -19.441 1.00 24.02 C ATOM 764 O PHE A 117 -13.407 20.027 -18.850 1.00 24.05 O ATOM 765 CB PHE A 117 -12.285 21.714 -21.025 1.00 24.86 C ATOM 766 CG PHE A 117 -12.861 20.874 -22.140 1.00 24.61 C ATOM 767 CD1 PHE A 117 -12.103 20.576 -23.284 1.00 24.79 C ATOM 768 CD2 PHE A 117 -14.182 20.466 -22.096 1.00 24.88 C ATOM 769 CE1 PHE A 117 -12.662 19.856 -24.332 1.00 25.77 C ATOM 770 CE2 PHE A 117 -14.747 19.726 -23.131 1.00 27.72 C ATOM 771 CZ PHE A 117 -13.992 19.428 -24.264 1.00 27.60 C ATOM 772 H PHE A 117 -10.133 20.303 -21.513 1.00 0.00 H ATOM 773 N HIS A 118 -11.913 18.538 -19.632 1.00 24.25 N ATOM 774 CA HIS A 118 -12.699 17.368 -19.221 1.00 26.00 C ATOM 775 C HIS A 118 -12.669 17.182 -17.699 1.00 24.05 C ATOM 776 O HIS A 118 -11.828 17.726 -16.996 1.00 22.54 O ATOM 777 CB HIS A 118 -12.188 16.091 -19.910 1.00 25.78 C ATOM 778 CG HIS A 118 -12.478 16.044 -21.383 1.00 27.60 C ATOM 779 ND1 HIS A 118 -11.615 15.465 -22.290 1.00 27.75 N ATOM 780 CD2 HIS A 118 -13.556 16.456 -22.100 1.00 30.35 C ATOM 781 CE1 HIS A 118 -12.128 15.551 -23.507 1.00 29.02 C ATOM 782 NE2 HIS A 118 -13.313 16.134 -23.422 1.00 31.37 N ATOM 783 H HIS A 118 -10.986 18.396 -20.081 1.00 0.00 H ATOM 784 N ASP A 119 -13.573 16.343 -17.214 1.00 29.05 N ATOM 785 CA ASP A 119 -13.788 16.213 -15.773 1.00 30.41 C ATOM 786 C ASP A 119 -12.654 15.604 -14.974 1.00 28.77 C ATOM 787 O ASP A 119 -12.576 15.829 -13.741 1.00 24.88 O ATOM 788 CB ASP A 119 -15.057 15.405 -15.537 1.00 37.93 C ATOM 789 CG ASP A 119 -16.246 16.290 -15.304 1.00 44.21 C ATOM 790 OD1 ASP A 119 -17.270 16.039 -15.954 1.00 48.56 O ATOM 791 OD2 ASP A 119 -16.144 17.245 -14.481 1.00 45.18 O ATOM 792 H ASP A 119 -14.139 15.767 -17.869 1.00 0.00 H ATOM 793 N ASP A 120 -11.751 14.868 -15.615 1.00 27.04 N ATOM 794 CA ASP A 120 -10.596 14.368 -14.863 1.00 29.06 C ATOM 795 C ASP A 120 -9.593 15.484 -14.603 1.00 28.27 C ATOM 796 O ASP A 120 -8.625 15.294 -13.840 1.00 26.95 O ATOM 797 CB ASP A 120 -9.918 13.151 -15.552 1.00 28.96 C ATOM 798 CG ASP A 120 -9.446 13.418 -16.972 1.00 29.35 C ATOM 799 OD1 ASP A 120 -9.917 14.360 -17.596 1.00 28.40 O ATOM 800 OD2 ASP A 120 -8.642 12.614 -17.492 1.00 30.62 O ATOM 801 H ASP A 120 -11.861 14.652 -16.626 1.00 0.00 H ATOM 802 N ARG A 121 -9.816 16.657 -15.214 1.00 23.46 N ATOM 803 CA ARG A 121 -8.871 17.755 -15.083 1.00 19.75 C ATOM 804 C ARG A 121 -9.448 18.973 -14.340 1.00 19.21 C ATOM 805 O ARG A 121 -8.701 19.672 -13.622 1.00 19.03 O ATOM 806 CB ARG A 121 -8.378 18.229 -16.482 1.00 22.83 C ATOM 807 CG ARG A 121 -7.755 17.122 -17.334 1.00 26.74 C ATOM 808 CD ARG A 121 -6.515 16.514 -16.664 1.00 28.33 C ATOM 809 NE ARG A 121 -6.504 15.064 -16.740 1.00 29.41 N ATOM 810 CZ ARG A 121 -5.646 14.280 -16.088 1.00 32.71 C ATOM 811 NH1 ARG A 121 -4.746 14.807 -15.288 1.00 34.09 N ATOM 812 NH2 ARG A 121 -5.689 12.969 -16.225 1.00 35.67 N ATOM 813 HE ARG A 121 -7.215 14.606 -17.345 1.00 0.00 H ATOM 814 HH12 ARG A 121 -4.078 14.193 -14.781 1.00 0.00 H ATOM 815 HH11 ARG A 121 -4.702 15.838 -15.162 1.00 0.00 H ATOM 816 HH22 ARG A 121 -5.013 12.370 -15.710 1.00 0.00 H ATOM 817 HH21 ARG A 121 -6.399 12.534 -16.848 1.00 0.00 H ATOM 818 H ARG A 121 -10.674 16.783 -15.788 1.00 0.00 H ATOM 819 N VAL A 122 -10.747 19.219 -14.499 1.00 21.24 N ATOM 820 CA VAL A 122 -11.396 20.347 -13.798 1.00 22.35 C ATOM 821 C VAL A 122 -12.447 19.881 -12.778 1.00 22.24 C ATOM 822 O VAL A 122 -12.959 20.681 -12.008 1.00 22.58 O ATOM 823 CB VAL A 122 -12.100 21.345 -14.785 1.00 22.75 C ATOM 824 CG1 VAL A 122 -11.096 22.006 -15.809 1.00 22.41 C ATOM 825 CG2 VAL A 122 -13.310 20.698 -15.505 1.00 24.01 C ATOM 826 H VAL A 122 -11.312 18.610 -15.124 1.00 0.00 H ATOM 827 N GLY A 123 -12.785 18.595 -12.759 1.00 22.34 N ATOM 828 CA GLY A 123 -13.787 18.113 -11.818 1.00 23.16 C ATOM 829 C GLY A 123 -13.169 18.196 -10.425 1.00 23.17 C ATOM 830 O GLY A 123 -12.197 17.500 -10.139 1.00 22.48 O ATOM 831 H GLY A 123 -12.332 17.931 -13.419 1.00 0.00 H ATOM 832 N GLY A 124 -13.736 19.011 -9.543 1.00 22.73 N ATOM 833 CA GLY A 124 -13.078 19.259 -8.257 1.00 20.08 C ATOM 834 C GLY A 124 -12.545 20.662 -8.073 1.00 21.23 C ATOM 835 O GLY A 124 -12.056 21.019 -7.019 1.00 19.69 O ATOM 836 H GLY A 124 -14.642 19.471 -9.764 1.00 0.00 H ATOM 837 N VAL A 125 -12.609 21.472 -9.115 1.00 20.84 N ATOM 838 CA VAL A 125 -12.202 22.865 -8.999 1.00 19.44 C ATOM 839 C VAL A 125 -12.993 23.646 -7.930 1.00 19.13 C ATOM 840 O VAL A 125 -12.444 24.520 -7.242 1.00 20.97 O ATOM 841 CB VAL A 125 -12.329 23.523 -10.397 1.00 22.90 C ATOM 842 CG1 VAL A 125 -12.661 24.973 -10.314 1.00 26.71 C ATOM 843 CG2 VAL A 125 -11.035 23.268 -11.159 1.00 20.24 C ATOM 844 H VAL A 125 -12.954 21.111 -10.027 1.00 0.00 H ATOM 845 N ASP A 126 -14.270 23.332 -7.775 1.00 20.92 N ATOM 846 CA ASP A 126 -15.068 24.019 -6.756 1.00 23.12 C ATOM 847 C ASP A 126 -14.536 23.682 -5.351 1.00 22.54 C ATOM 848 O ASP A 126 -14.496 24.540 -4.470 1.00 22.46 O ATOM 849 CB ASP A 126 -16.563 23.660 -6.887 1.00 27.94 C ATOM 850 CG ASP A 126 -17.248 24.360 -8.074 1.00 34.34 C ATOM 851 OD1 ASP A 126 -16.648 25.290 -8.658 1.00 37.24 O ATOM 852 OD2 ASP A 126 -18.383 23.979 -8.426 1.00 35.41 O ATOM 853 H ASP A 126 -14.705 22.601 -8.374 1.00 0.00 H ATOM 854 N VAL A 127 -14.114 22.431 -5.136 1.00 21.28 N ATOM 855 CA VAL A 127 -13.506 22.052 -3.876 1.00 21.38 C ATOM 856 C VAL A 127 -12.214 22.814 -3.650 1.00 20.97 C ATOM 857 O VAL A 127 -11.987 23.310 -2.559 1.00 20.19 O ATOM 858 CB VAL A 127 -13.263 20.513 -3.810 1.00 21.04 C ATOM 859 CG1 VAL A 127 -12.374 20.152 -2.629 1.00 22.00 C ATOM 860 CG2 VAL A 127 -14.586 19.814 -3.746 1.00 22.40 C ATOM 861 H VAL A 127 -14.224 21.718 -5.885 1.00 0.00 H ATOM 862 N LEU A 128 -11.373 22.931 -4.681 1.00 21.13 N ATOM 863 CA LEU A 128 -10.126 23.700 -4.578 1.00 18.92 C ATOM 864 C LEU A 128 -10.377 25.136 -4.164 1.00 19.02 C ATOM 865 O LEU A 128 -9.740 25.658 -3.242 1.00 20.55 O ATOM 866 CB LEU A 128 -9.370 23.668 -5.911 1.00 20.01 C ATOM 867 CG LEU A 128 -8.904 22.273 -6.362 1.00 20.83 C ATOM 868 CD1 LEU A 128 -8.198 22.398 -7.715 1.00 20.81 C ATOM 869 CD2 LEU A 128 -7.992 21.621 -5.330 1.00 19.87 C ATOM 870 H LEU A 128 -11.607 22.465 -5.581 1.00 0.00 H ATOM 871 N ARG A 129 -11.331 25.747 -4.827 1.00 19.32 N ATOM 872 CA ARG A 129 -11.668 27.133 -4.595 1.00 21.25 C ATOM 873 C ARG A 129 -12.219 27.300 -3.157 1.00 24.05 C ATOM 874 O ARG A 129 -11.822 28.210 -2.433 1.00 24.68 O ATOM 875 CB ARG A 129 -12.636 27.605 -5.644 1.00 24.60 C ATOM 876 CG ARG A 129 -13.050 29.044 -5.445 1.00 30.05 C ATOM 877 CD ARG A 129 -14.076 29.505 -6.461 1.00 34.34 C ATOM 878 NE ARG A 129 -13.724 29.181 -7.845 1.00 36.81 N ATOM 879 CZ ARG A 129 -14.388 28.330 -8.636 1.00 39.86 C ATOM 880 NH1 ARG A 129 -15.453 27.669 -8.197 1.00 45.27 N ATOM 881 NH2 ARG A 129 -13.992 28.147 -9.894 1.00 38.29 N ATOM 882 HE ARG A 129 -12.888 29.652 -8.247 1.00 0.00 H ATOM 883 HH12 ARG A 129 -15.954 27.012 -8.829 1.00 0.00 H ATOM 884 HH11 ARG A 129 -15.786 27.808 -7.222 1.00 0.00 H ATOM 885 HH22 ARG A 129 -14.507 27.486 -10.510 1.00 0.00 H ATOM 886 HH21 ARG A 129 -13.168 28.665 -10.260 1.00 0.00 H ATOM 887 H ARG A 129 -11.863 25.215 -5.545 1.00 0.00 H ATOM 888 N ALA A 130 -13.070 26.381 -2.726 1.00 24.73 N ATOM 889 CA ALA A 130 -13.586 26.392 -1.344 1.00 26.26 C ATOM 890 C ALA A 130 -12.486 26.275 -0.286 1.00 25.51 C ATOM 891 O ALA A 130 -12.641 26.714 0.862 1.00 27.00 O ATOM 892 CB ALA A 130 -14.596 25.265 -1.177 1.00 26.45 C ATOM 893 H ALA A 130 -13.382 25.633 -3.378 1.00 0.00 H ATOM 894 N ALA A 131 -11.384 25.646 -0.667 1.00 24.17 N ATOM 895 CA ALA A 131 -10.228 25.425 0.185 1.00 25.01 C ATOM 896 C ALA A 131 -9.203 26.561 0.109 1.00 27.09 C ATOM 897 O ALA A 131 -8.214 26.559 0.819 1.00 30.17 O ATOM 898 CB ALA A 131 -9.572 24.099 -0.179 1.00 23.35 C ATOM 899 H ALA A 131 -11.344 25.286 -1.642 1.00 0.00 H ATOM 900 N GLY A 133 -9.460 27.551 -0.728 1.00 26.59 N ATOM 901 CA GLY A 133 -8.624 28.733 -0.786 1.00 26.68 C ATOM 902 C GLY A 133 -7.635 28.702 -1.923 1.00 25.38 C ATOM 903 O GLY A 133 -6.754 29.544 -1.997 1.00 27.39 O ATOM 904 H GLY A 133 -10.282 27.480 -1.361 1.00 0.00 H ATOM 905 N VAL A 134 -7.766 27.726 -2.814 1.00 22.23 N ATOM 906 CA VAL A 134 -6.842 27.614 -3.951 1.00 21.45 C ATOM 907 C VAL A 134 -7.282 28.487 -5.113 1.00 22.57 C ATOM 908 O VAL A 134 -8.459 28.458 -5.485 1.00 24.09 O ATOM 909 CB VAL A 134 -6.739 26.156 -4.462 1.00 22.24 C ATOM 910 CG1 VAL A 134 -5.684 26.055 -5.576 1.00 22.92 C ATOM 911 CG2 VAL A 134 -6.403 25.248 -3.354 1.00 21.56 C ATOM 912 H VAL A 134 -8.533 27.032 -2.706 1.00 0.00 H ATOM 913 N ALA A 135 -6.350 29.259 -5.679 1.00 21.92 N ATOM 914 CA ALA A 135 -6.622 30.040 -6.878 1.00 24.22 C ATOM 915 C ALA A 135 -6.497 29.085 -8.077 1.00 24.14 C ATOM 916 O ALA A 135 -5.470 28.437 -8.254 1.00 23.42 O ATOM 917 CB ALA A 135 -5.681 31.213 -7.005 1.00 24.22 C ATOM 918 H ALA A 135 -5.403 29.304 -5.251 1.00 0.00 H ATOM 919 N THR A 136 -7.561 28.989 -8.868 1.00 23.36 N ATOM 920 CA THR A 136 -7.612 28.036 -9.965 1.00 22.71 C ATOM 921 C THR A 136 -7.446 28.733 -11.311 1.00 21.86 C ATOM 922 O THR A 136 -7.985 29.825 -11.533 1.00 21.36 O ATOM 923 CB THR A 136 -8.918 27.232 -9.941 1.00 21.28 C ATOM 924 OG1 THR A 136 -10.045 28.105 -9.987 1.00 21.35 O ATOM 925 CG2 THR A 136 -8.979 26.389 -8.672 1.00 19.80 C ATOM 926 HG1 THR A 136 -10.025 28.709 -9.203 1.00 0.00 H ATOM 927 H THR A 136 -8.377 29.611 -8.698 1.00 0.00 H ATOM 928 N TYR A 137 -6.688 28.081 -12.195 1.00 19.95 N ATOM 929 CA TYR A 137 -6.258 28.649 -13.499 1.00 21.71 C ATOM 930 C TYR A 137 -6.458 27.678 -14.648 1.00 22.47 C ATOM 931 O TYR A 137 -6.285 26.475 -14.489 1.00 21.07 O ATOM 932 CB TYR A 137 -4.776 29.007 -13.515 1.00 20.83 C ATOM 933 CG TYR A 137 -4.368 30.116 -12.573 1.00 24.22 C ATOM 934 CD1 TYR A 137 -4.205 29.868 -11.221 1.00 24.77 C ATOM 935 CD2 TYR A 137 -4.143 31.386 -13.031 1.00 26.47 C ATOM 936 CE1 TYR A 137 -3.837 30.867 -10.358 1.00 26.80 C ATOM 937 CE2 TYR A 137 -3.767 32.399 -12.164 1.00 30.41 C ATOM 938 CZ TYR A 137 -3.619 32.108 -10.810 1.00 30.86 C ATOM 939 OH TYR A 137 -3.253 33.074 -9.901 1.00 33.34 O ATOM 940 HH TYR A 137 -2.368 33.442 -10.151 1.00 0.00 H ATOM 941 H TYR A 137 -6.380 27.117 -11.957 1.00 0.00 H ATOM 942 N ALA A 138 -6.748 28.228 -15.823 1.00 22.33 N ATOM 943 CA ALA A 138 -6.719 27.457 -17.069 1.00 21.56 C ATOM 944 C ALA A 138 -6.643 28.451 -18.212 1.00 22.66 C ATOM 945 O ALA A 138 -6.858 29.658 -18.019 1.00 26.07 O ATOM 946 CB ALA A 138 -7.934 26.586 -17.203 1.00 20.58 C ATOM 947 H ALA A 138 -7.003 29.236 -15.859 1.00 0.00 H ATOM 948 N SER A 139 -6.357 27.961 -19.410 1.00 23.53 N ATOM 949 CA SER A 139 -6.325 28.840 -20.574 1.00 27.15 C ATOM 950 C SER A 139 -7.723 29.350 -20.877 1.00 27.06 C ATOM 951 O SER A 139 -8.716 28.737 -20.467 1.00 25.55 O ATOM 952 CB SER A 139 -5.771 28.116 -21.789 1.00 27.96 C ATOM 953 OG SER A 139 -6.738 27.204 -22.245 1.00 28.22 O ATOM 954 HG SER A 139 -6.390 26.724 -23.038 1.00 0.00 H ATOM 955 H SER A 139 -6.155 26.947 -19.521 1.00 0.00 H ATOM 956 N PRO A 140 -7.810 30.464 -21.605 1.00 27.73 N ATOM 957 CA PRO A 140 -9.142 30.952 -21.966 1.00 30.42 C ATOM 958 C PRO A 140 -9.942 29.894 -22.726 1.00 31.49 C ATOM 959 O PRO A 140 -11.161 29.820 -22.570 1.00 30.98 O ATOM 960 CB PRO A 140 -8.832 32.186 -22.831 1.00 32.89 C ATOM 961 CG PRO A 140 -7.575 32.714 -22.241 1.00 32.52 C ATOM 962 CD PRO A 140 -6.772 31.475 -21.885 1.00 29.93 C ATOM 963 N SER A 141 -9.255 29.074 -23.517 1.00 32.14 N ATOM 964 CA SER A 141 -9.918 28.066 -24.326 1.00 33.07 C ATOM 965 C SER A 141 -10.520 26.967 -23.440 1.00 31.08 C ATOM 966 O SER A 141 -11.686 26.577 -23.635 1.00 30.99 O ATOM 967 CB SER A 141 -8.932 27.473 -25.321 1.00 38.64 C ATOM 968 OG SER A 141 -9.500 26.372 -25.992 1.00 43.19 O ATOM 969 HG SER A 141 -8.842 26.003 -26.633 1.00 0.00 H ATOM 970 H SER A 141 -8.219 29.157 -23.557 1.00 0.00 H ATOM 971 N THR A 142 -9.721 26.494 -22.482 1.00 25.20 N ATOM 972 CA THR A 142 -10.146 25.490 -21.535 1.00 24.70 C ATOM 973 C THR A 142 -11.371 25.983 -20.731 1.00 25.98 C ATOM 974 O THR A 142 -12.375 25.272 -20.592 1.00 24.73 O ATOM 975 CB THR A 142 -9.030 25.141 -20.600 1.00 22.25 C ATOM 976 OG1 THR A 142 -7.927 24.540 -21.322 1.00 22.62 O ATOM 977 CG2 THR A 142 -9.532 24.205 -19.505 1.00 21.94 C ATOM 978 HG1 THR A 142 -8.239 23.715 -21.771 1.00 0.00 H ATOM 979 H THR A 142 -8.751 26.864 -22.414 1.00 0.00 H ATOM 980 N ARG A 143 -11.307 27.216 -20.247 1.00 25.32 N ATOM 981 CA ARG A 143 -12.416 27.792 -19.504 1.00 27.26 C ATOM 982 C ARG A 143 -13.722 27.833 -20.332 1.00 29.99 C ATOM 983 O ARG A 143 -14.800 27.511 -19.829 1.00 29.39 O ATOM 984 CB ARG A 143 -12.039 29.209 -19.031 1.00 28.18 C ATOM 985 CG ARG A 143 -10.961 29.210 -17.948 1.00 27.92 C ATOM 986 CD ARG A 143 -10.639 30.610 -17.424 1.00 29.74 C ATOM 987 NE ARG A 143 -11.677 31.121 -16.516 1.00 29.96 N ATOM 988 CZ ARG A 143 -12.548 32.090 -16.788 1.00 33.36 C ATOM 989 NH1 ARG A 143 -12.536 32.735 -17.944 1.00 35.46 N ATOM 990 NH2 ARG A 143 -13.447 32.443 -15.878 1.00 35.40 N ATOM 991 HE ARG A 143 -11.736 30.685 -15.574 1.00 0.00 H ATOM 992 HH12 ARG A 143 -13.230 33.488 -18.127 1.00 0.00 H ATOM 993 HH11 ARG A 143 -11.833 32.489 -18.669 1.00 0.00 H ATOM 994 HH22 ARG A 143 -14.129 33.200 -16.087 1.00 0.00 H ATOM 995 HH21 ARG A 143 -13.469 31.963 -14.956 1.00 0.00 H ATOM 996 H ARG A 143 -10.448 27.781 -20.402 1.00 0.00 H ATOM 997 N ARG A 144 -13.631 28.253 -21.592 1.00 28.50 N ATOM 998 CA ARG A 144 -14.802 28.325 -22.444 1.00 30.64 C ATOM 999 C ARG A 144 -15.411 26.944 -22.717 1.00 30.53 C ATOM 1000 O ARG A 144 -16.641 26.794 -22.760 1.00 31.23 O ATOM 1001 CB ARG A 144 -14.449 28.995 -23.780 1.00 32.14 C ATOM 1002 CG ARG A 144 -14.353 30.500 -23.691 1.00 33.81 C ATOM 1003 CD ARG A 144 -14.089 31.114 -25.053 1.00 36.72 C ATOM 1004 NE ARG A 144 -12.863 30.624 -25.697 1.00 37.09 N ATOM 1005 CZ ARG A 144 -11.722 31.314 -25.771 1.00 39.47 C ATOM 1006 NH1 ARG A 144 -11.622 32.512 -25.215 1.00 41.59 N ATOM 1007 NH2 ARG A 144 -10.669 30.807 -26.403 1.00 40.56 N ATOM 1008 HE ARG A 144 -12.885 29.676 -26.124 1.00 0.00 H ATOM 1009 HH12 ARG A 144 -10.729 33.042 -25.278 1.00 0.00 H ATOM 1010 HH11 ARG A 144 -12.436 32.923 -24.715 1.00 0.00 H ATOM 1011 HH22 ARG A 144 -9.784 31.350 -26.457 1.00 0.00 H ATOM 1012 HH21 ARG A 144 -10.730 29.867 -26.844 1.00 0.00 H ATOM 1013 H ARG A 144 -12.704 28.534 -21.972 1.00 0.00 H ATOM 1014 N LEU A 145 -14.536 25.974 -22.974 1.00 28.72 N ATOM 1015 CA LEU A 145 -14.962 24.628 -23.284 1.00 29.25 C ATOM 1016 C LEU A 145 -15.568 23.957 -22.060 1.00 27.45 C ATOM 1017 O LEU A 145 -16.576 23.262 -22.178 1.00 29.45 O ATOM 1018 CB LEU A 145 -13.796 23.815 -23.812 1.00 28.31 C ATOM 1019 CG LEU A 145 -13.348 24.273 -25.215 1.00 32.52 C ATOM 1020 CD1 LEU A 145 -12.026 23.554 -25.593 1.00 34.26 C ATOM 1021 CD2 LEU A 145 -14.435 24.083 -26.296 1.00 35.06 C ATOM 1022 H LEU A 145 -13.519 26.190 -22.951 1.00 0.00 H ATOM 1023 N ALA A 146 -14.976 24.188 -20.896 1.00 26.33 N ATOM 1024 CA ALA A 146 -15.549 23.686 -19.644 1.00 25.14 C ATOM 1025 C ALA A 146 -16.963 24.241 -19.428 1.00 27.73 C ATOM 1026 O ALA A 146 -17.885 23.514 -19.048 1.00 29.24 O ATOM 1027 CB ALA A 146 -14.638 24.034 -18.469 1.00 23.55 C ATOM 1028 H ALA A 146 -14.091 24.734 -20.871 1.00 0.00 H ATOM 1029 N GLU A 147 -17.157 25.519 -19.709 1.00 29.10 N ATOM 1030 CA GLU A 147 -18.463 26.150 -19.557 1.00 35.31 C ATOM 1031 C GLU A 147 -19.514 25.483 -20.452 1.00 36.81 C ATOM 1032 O GLU A 147 -20.581 25.076 -19.984 1.00 39.07 O ATOM 1033 CB GLU A 147 -18.352 27.628 -19.899 1.00 39.73 C ATOM 1034 CG GLU A 147 -19.538 28.438 -19.505 1.00 45.39 C ATOM 1035 CD GLU A 147 -19.375 29.903 -19.845 1.00 52.18 C ATOM 1036 OE1 GLU A 147 -19.975 30.728 -19.123 1.00 56.19 O ATOM 1037 OE2 GLU A 147 -18.683 30.233 -20.850 1.00 52.60 O ATOM 1038 H GLU A 147 -16.356 26.090 -20.048 1.00 0.00 H ATOM 1039 N VAL A 148 -19.200 25.389 -21.742 1.00 32.53 N ATOM 1040 CA VAL A 148 -20.073 24.762 -22.730 1.00 34.65 C ATOM 1041 C VAL A 148 -20.417 23.319 -22.377 1.00 35.39 C ATOM 1042 O VAL A 148 -21.518 22.840 -22.667 1.00 35.22 O ATOM 1043 CB VAL A 148 -19.411 24.769 -24.132 1.00 42.85 C ATOM 1044 CG1 VAL A 148 -20.130 23.820 -25.065 1.00 46.38 C ATOM 1045 CG2 VAL A 148 -19.406 26.178 -24.691 1.00 44.14 C ATOM 1046 H VAL A 148 -18.291 25.780 -22.061 1.00 0.00 H ATOM 1047 N GLU A 149 -19.447 22.634 -21.790 1.00 35.39 N ATOM 1048 CA GLU A 149 -19.588 21.236 -21.417 1.00 39.85 C ATOM 1049 C GLU A 149 -20.426 21.065 -20.123 1.00 40.44 C ATOM 1050 O GLU A 149 -20.862 19.960 -19.811 1.00 40.42 O ATOM 1051 CB GLU A 149 -18.197 20.618 -21.251 1.00 41.85 C ATOM 1052 CG GLU A 149 -18.154 19.102 -21.143 1.00 46.88 C ATOM 1053 CD GLU A 149 -18.595 18.391 -22.419 1.00 53.02 C ATOM 1054 OE1 GLU A 149 -18.580 19.007 -23.510 1.00 54.93 O ATOM 1055 OE2 GLU A 149 -18.956 17.205 -22.317 1.00 55.06 O ATOM 1056 H GLU A 149 -18.548 23.116 -21.588 1.00 0.00 H ATOM 1057 N GLY A 150 -20.670 22.150 -19.390 1.00 39.30 N ATOM 1058 CA GLY A 150 -21.298 22.052 -18.081 1.00 39.22 C ATOM 1059 C GLY A 150 -20.366 21.582 -16.961 1.00 35.64 C ATOM 1060 O GLY A 150 -20.822 21.099 -15.920 1.00 35.66 O ATOM 1061 H GLY A 150 -20.407 23.085 -19.760 1.00 0.00 H ATOM 1062 N ASN A 165 -19.059 21.751 -17.143 1.00 29.91 N ATOM 1063 CA ASN A 165 -18.078 21.400 -16.124 1.00 27.76 C ATOM 1064 C ASN A 165 -17.713 22.592 -15.241 1.00 27.51 C ATOM 1065 O ASN A 165 -18.082 23.745 -15.514 1.00 26.03 O ATOM 1066 CB ASN A 165 -16.798 20.842 -16.772 1.00 26.37 C ATOM 1067 CG ASN A 165 -17.005 19.477 -17.390 1.00 30.28 C ATOM 1068 OD1 ASN A 165 -18.075 18.854 -17.220 1.00 30.27 O ATOM 1069 ND2 ASN A 165 -15.989 18.991 -18.110 1.00 29.97 N ATOM 1070 HD22 ASN A 165 -15.118 19.548 -18.222 1.00 0.00 H ATOM 1071 HD21 ASN A 165 -16.069 18.056 -18.558 1.00 0.00 H ATOM 1072 H ASN A 165 -18.725 22.148 -18.045 1.00 0.00 H ATOM 1073 N GLU A 166 -17.022 22.309 -14.157 1.00 27.44 N ATOM 1074 CA GLU A 166 -16.533 23.372 -13.301 1.00 28.60 C ATOM 1075 C GLU A 166 -15.505 24.224 -14.065 1.00 27.59 C ATOM 1076 O GLU A 166 -14.772 23.724 -14.907 1.00 25.40 O ATOM 1077 CB GLU A 166 -15.950 22.786 -12.026 1.00 26.96 C ATOM 1078 CG GLU A 166 -17.005 22.051 -11.220 1.00 29.31 C ATOM 1079 CD GLU A 166 -16.386 20.996 -10.335 1.00 32.90 C ATOM 1080 OE1 GLU A 166 -15.651 21.368 -9.403 1.00 30.83 O ATOM 1081 OE2 GLU A 166 -16.617 19.786 -10.592 1.00 37.76 O ATOM 1082 H GLU A 166 -16.826 21.317 -13.913 1.00 0.00 H ATOM 1083 N ILE A 167 -15.513 25.529 -13.792 1.00 28.73 N ATOM 1084 CA ILE A 167 -14.728 26.473 -14.558 1.00 27.60 C ATOM 1085 C ILE A 167 -13.635 27.077 -13.675 1.00 26.11 C ATOM 1086 O ILE A 167 -13.947 27.773 -12.695 1.00 26.22 O ATOM 1087 CB ILE A 167 -15.583 27.597 -15.102 1.00 28.14 C ATOM 1088 CG1 ILE A 167 -16.812 27.068 -15.882 1.00 29.21 C ATOM 1089 CG2 ILE A 167 -14.738 28.511 -15.989 1.00 27.47 C ATOM 1090 CD1 ILE A 167 -17.841 28.145 -16.167 1.00 31.76 C ATOM 1091 H ILE A 167 -16.099 25.878 -13.007 1.00 0.00 H ATOM 1092 N PRO A 168 -12.368 26.846 -14.025 1.00 23.06 N ATOM 1093 CA PRO A 168 -11.301 27.529 -13.289 1.00 23.27 C ATOM 1094 C PRO A 168 -11.464 29.033 -13.323 1.00 24.18 C ATOM 1095 O PRO A 168 -11.939 29.575 -14.305 1.00 28.04 O ATOM 1096 CB PRO A 168 -10.036 27.086 -14.025 1.00 23.15 C ATOM 1097 CG PRO A 168 -10.371 25.728 -14.494 1.00 24.91 C ATOM 1098 CD PRO A 168 -11.811 25.869 -14.974 1.00 25.11 C ATOM 1099 N THR A 169 -11.154 29.702 -12.218 1.00 26.36 N ATOM 1100 CA THR A 169 -11.430 31.143 -12.086 1.00 27.95 C ATOM 1101 C THR A 169 -10.629 32.073 -12.997 1.00 29.03 C ATOM 1102 O THR A 169 -11.186 33.034 -13.587 1.00 29.54 O ATOM 1103 CB THR A 169 -11.164 31.575 -10.623 1.00 29.94 C ATOM 1104 OG1 THR A 169 -12.103 30.913 -9.787 1.00 30.34 O ATOM 1105 CG2 THR A 169 -11.288 33.059 -10.426 1.00 32.61 C ATOM 1106 HG1 THR A 169 -11.949 31.177 -8.845 1.00 0.00 H ATOM 1107 H THR A 169 -10.706 29.196 -11.427 1.00 0.00 H ATOM 1108 N HIS A 170 -9.325 31.834 -13.061 1.00 27.44 N ATOM 1109 CA HIS A 170 -8.384 32.755 -13.703 1.00 29.42 C ATOM 1110 C HIS A 170 -7.901 32.252 -15.062 1.00 28.67 C ATOM 1111 O HIS A 170 -7.643 31.063 -15.217 1.00 28.20 O ATOM 1112 CB HIS A 170 -7.162 32.987 -12.790 1.00 29.44 C ATOM 1113 CG HIS A 170 -7.504 33.531 -11.440 1.00 30.53 C ATOM 1114 ND1 HIS A 170 -7.859 34.849 -11.237 1.00 34.95 N ATOM 1115 CD2 HIS A 170 -7.531 32.946 -10.220 1.00 32.96 C ATOM 1116 CE1 HIS A 170 -8.109 35.045 -9.954 1.00 35.99 C ATOM 1117 NE2 HIS A 170 -7.918 33.906 -9.315 1.00 34.06 N ATOM 1118 H HIS A 170 -8.957 30.958 -12.639 1.00 0.00 H ATOM 1119 N SER A 171 -7.778 33.161 -16.032 1.00 29.65 N ATOM 1120 CA SER A 171 -7.246 32.842 -17.353 1.00 32.75 C ATOM 1121 C SER A 171 -5.729 32.947 -17.403 1.00 35.47 C ATOM 1122 O SER A 171 -5.151 33.961 -16.982 1.00 38.58 O ATOM 1123 CB SER A 171 -7.814 33.779 -18.423 1.00 37.69 C ATOM 1124 OG SER A 171 -9.130 33.439 -18.769 1.00 38.96 O ATOM 1125 HG SER A 171 -9.460 34.065 -19.461 1.00 0.00 H ATOM 1126 H SER A 171 -8.074 34.139 -15.838 1.00 0.00 H ATOM 1127 N LEU A 172 -5.102 31.924 -17.977 1.00 34.00 N ATOM 1128 CA LEU A 172 -3.686 31.963 -18.312 1.00 34.71 C ATOM 1129 C LEU A 172 -3.449 32.701 -19.621 1.00 39.56 C ATOM 1130 O LEU A 172 -3.869 32.246 -20.665 1.00 38.51 O ATOM 1131 CB LEU A 172 -3.136 30.554 -18.437 1.00 33.35 C ATOM 1132 CG LEU A 172 -3.252 29.699 -17.179 1.00 32.34 C ATOM 1133 CD1 LEU A 172 -3.109 28.221 -17.496 1.00 33.07 C ATOM 1134 CD2 LEU A 172 -2.203 30.125 -16.195 1.00 32.26 C ATOM 1135 H LEU A 172 -5.644 31.064 -18.195 1.00 0.00 H ATOM 1136 N GLU A 173 -2.732 33.803 -19.585 1.00 44.63 N ATOM 1137 CA GLU A 173 -2.420 34.492 -20.828 1.00 49.57 C ATOM 1138 C GLU A 173 -1.206 33.855 -21.524 1.00 44.61 C ATOM 1139 O GLU A 173 -0.410 33.161 -20.898 1.00 42.71 O ATOM 1140 CB GLU A 173 -2.204 35.976 -20.546 1.00 56.68 C ATOM 1141 CG GLU A 173 -3.487 36.674 -20.047 1.00 60.76 C ATOM 1142 CD GLU A 173 -4.698 36.394 -20.940 1.00 63.34 C ATOM 1143 OE1 GLU A 173 -5.842 36.303 -20.427 1.00 62.69 O ATOM 1144 OE2 GLU A 173 -4.497 36.255 -22.165 1.00 66.68 O ATOM 1145 H GLU A 173 -2.391 34.178 -18.677 1.00 0.00 H ATOM 1146 N GLY A 174 -1.132 34.031 -22.836 1.00 41.24 N ATOM 1147 CA GLY A 174 0.049 33.672 -23.590 1.00 38.98 C ATOM 1148 C GLY A 174 0.101 32.263 -24.140 1.00 36.38 C ATOM 1149 O GLY A 174 1.170 31.831 -24.550 1.00 36.36 O ATOM 1150 H GLY A 174 -1.947 34.439 -23.338 1.00 0.00 H ATOM 1151 N LEU A 175 -1.019 31.544 -24.176 1.00 36.50 N ATOM 1152 CA LEU A 175 -1.007 30.138 -24.643 1.00 35.46 C ATOM 1153 C LEU A 175 -1.904 29.911 -25.868 1.00 39.28 C ATOM 1154 O LEU A 175 -2.285 28.770 -26.163 1.00 40.29 O ATOM 1155 CB LEU A 175 -1.419 29.206 -23.496 1.00 33.24 C ATOM 1156 CG LEU A 175 -0.356 29.136 -22.393 1.00 32.32 C ATOM 1157 CD1 LEU A 175 -0.888 28.482 -21.115 1.00 30.97 C ATOM 1158 CD2 LEU A 175 0.885 28.425 -22.896 1.00 32.30 C ATOM 1159 H LEU A 175 -1.915 31.975 -23.872 1.00 0.00 H ATOM 1160 N SER A 176 -2.189 30.985 -26.595 1.00 43.53 N ATOM 1161 CA SER A 176 -3.184 30.981 -27.670 1.00 48.23 C ATOM 1162 C SER A 176 -2.835 30.102 -28.866 1.00 46.31 C ATOM 1163 O SER A 176 -3.711 29.490 -29.474 1.00 49.73 O ATOM 1164 CB SER A 176 -3.397 32.412 -28.188 1.00 53.66 C ATOM 1165 OG SER A 176 -3.201 33.360 -27.151 1.00 57.86 O ATOM 1166 HG SER A 176 -2.277 33.281 -26.803 1.00 0.00 H ATOM 1167 H SER A 176 -1.682 31.870 -26.392 1.00 0.00 H ATOM 1168 N SER A 177 -1.562 30.065 -29.223 1.00 41.68 N ATOM 1169 CA SER A 177 -1.141 29.469 -30.486 1.00 39.96 C ATOM 1170 C SER A 177 -0.227 28.288 -30.254 1.00 37.72 C ATOM 1171 O SER A 177 0.587 28.303 -29.336 1.00 34.50 O ATOM 1172 CB SER A 177 -0.438 30.520 -31.346 1.00 44.14 C ATOM 1173 OG SER A 177 -1.320 31.598 -31.594 1.00 48.49 O ATOM 1174 HG SER A 177 -0.862 32.276 -32.151 1.00 0.00 H ATOM 1175 H SER A 177 -0.845 30.470 -28.588 1.00 0.00 H ATOM 1176 N SER A 178 -0.383 27.251 -31.067 1.00 39.57 N ATOM 1177 CA SER A 178 0.490 26.085 -30.998 1.00 42.53 C ATOM 1178 C SER A 178 1.952 26.509 -30.924 1.00 41.70 C ATOM 1179 O SER A 178 2.407 27.313 -31.740 1.00 44.64 O ATOM 1180 CB SER A 178 0.277 25.193 -32.222 1.00 49.84 C ATOM 1181 OG SER A 178 -1.073 24.800 -32.306 1.00 53.13 O ATOM 1182 HG SER A 178 -1.645 25.604 -32.386 1.00 0.00 H ATOM 1183 H SER A 178 -1.148 27.270 -31.772 1.00 0.00 H ATOM 1184 N GLY A 179 2.674 25.983 -29.940 1.00 39.31 N ATOM 1185 CA GLY A 179 4.072 26.333 -29.743 1.00 39.48 C ATOM 1186 C GLY A 179 4.289 27.406 -28.691 1.00 38.51 C ATOM 1187 O GLY A 179 5.421 27.685 -28.335 1.00 39.80 O ATOM 1188 H GLY A 179 2.227 25.302 -29.293 1.00 0.00 H ATOM 1189 N ASP A 180 3.212 27.993 -28.174 1.00 37.75 N ATOM 1190 CA ASP A 180 3.324 29.016 -27.128 1.00 37.41 C ATOM 1191 C ASP A 180 3.750 28.407 -25.788 1.00 36.22 C ATOM 1192 O ASP A 180 3.247 27.355 -25.393 1.00 31.90 O ATOM 1193 CB ASP A 180 1.997 29.745 -26.922 1.00 37.13 C ATOM 1194 CG ASP A 180 1.694 30.763 -28.012 1.00 42.64 C ATOM 1195 OD1 ASP A 180 2.611 31.239 -28.724 1.00 41.67 O ATOM 1196 OD2 ASP A 180 0.503 31.121 -28.125 1.00 46.61 O ATOM 1197 H ASP A 180 2.270 27.720 -28.519 1.00 0.00 H ATOM 1198 N ALA A 181 4.647 29.078 -25.071 1.00 38.31 N ATOM 1199 CA ALA A 181 5.030 28.618 -23.725 1.00 37.72 C ATOM 1200 C ALA A 181 5.065 29.808 -22.780 1.00 38.68 C ATOM 1201 O ALA A 181 5.306 30.923 -23.212 1.00 39.36 O ATOM 1202 CB ALA A 181 6.386 27.906 -23.752 1.00 37.47 C ATOM 1203 H ALA A 181 5.083 29.936 -25.465 1.00 0.00 H ATOM 1204 N VAL A 182 4.800 29.571 -21.500 1.00 37.72 N ATOM 1205 CA VAL A 182 4.836 30.648 -20.503 1.00 39.87 C ATOM 1206 C VAL A 182 5.340 30.068 -19.204 1.00 37.17 C ATOM 1207 O VAL A 182 5.122 28.894 -18.923 1.00 34.80 O ATOM 1208 CB VAL A 182 3.428 31.330 -20.237 1.00 39.21 C ATOM 1209 CG1 VAL A 182 2.850 31.933 -21.526 1.00 40.61 C ATOM 1210 CG2 VAL A 182 2.443 30.371 -19.596 1.00 38.67 C ATOM 1211 H VAL A 182 4.563 28.604 -21.199 1.00 0.00 H ATOM 1212 N ARG A 183 6.005 30.889 -18.405 1.00 38.49 N ATOM 1213 CA ARG A 183 6.433 30.428 -17.098 1.00 38.01 C ATOM 1214 C ARG A 183 5.289 30.572 -16.111 1.00 35.43 C ATOM 1215 O ARG A 183 4.534 31.522 -16.169 1.00 38.06 O ATOM 1216 CB ARG A 183 7.643 31.211 -16.618 1.00 43.07 C ATOM 1217 CG ARG A 183 8.293 30.587 -15.405 1.00 46.54 C ATOM 1218 CD ARG A 183 8.291 31.502 -14.197 1.00 50.74 C ATOM 1219 NE ARG A 183 9.654 31.826 -13.795 1.00 55.73 N ATOM 1220 CZ ARG A 183 10.109 31.804 -12.544 1.00 59.19 C ATOM 1221 NH1 ARG A 183 9.324 31.468 -11.529 1.00 59.47 N ATOM 1222 NH2 ARG A 183 11.369 32.118 -12.307 1.00 62.80 N ATOM 1223 HE ARG A 183 10.323 32.095 -14.544 1.00 0.00 H ATOM 1224 HH12 ARG A 183 9.702 31.458 -10.560 1.00 0.00 H ATOM 1225 HH11 ARG A 183 8.330 31.214 -11.702 1.00 0.00 H ATOM 1226 HH22 ARG A 183 11.734 32.104 -11.333 1.00 0.00 H ATOM 1227 HH21 ARG A 183 11.997 32.380 -13.094 1.00 0.00 H ATOM 1228 H ARG A 183 6.219 31.859 -18.713 1.00 0.00 H ATOM 1229 N PHE A 184 5.168 29.628 -15.190 1.00 30.24 N ATOM 1230 CA PHE A 184 4.159 29.714 -14.147 1.00 28.83 C ATOM 1231 C PHE A 184 4.787 29.169 -12.875 1.00 29.27 C ATOM 1232 O PHE A 184 4.769 27.977 -12.629 1.00 29.14 O ATOM 1233 CB PHE A 184 2.896 28.947 -14.560 1.00 27.30 C ATOM 1234 CG PHE A 184 1.660 29.317 -13.787 1.00 28.16 C ATOM 1235 CD1 PHE A 184 0.946 30.468 -14.096 1.00 31.23 C ATOM 1236 CD2 PHE A 184 1.224 28.546 -12.743 1.00 26.66 C ATOM 1237 CE1 PHE A 184 -0.193 30.804 -13.379 1.00 29.98 C ATOM 1238 CE2 PHE A 184 0.081 28.887 -12.032 1.00 26.34 C ATOM 1239 CZ PHE A 184 -0.622 30.013 -12.356 1.00 27.69 C ATOM 1240 H PHE A 184 5.808 28.808 -15.213 1.00 0.00 H ATOM 1241 N GLY A 185 5.369 30.058 -12.080 1.00 32.54 N ATOM 1242 CA GLY A 185 6.061 29.654 -10.876 1.00 32.56 C ATOM 1243 C GLY A 185 7.193 28.708 -11.231 1.00 32.75 C ATOM 1244 O GLY A 185 8.014 29.032 -12.056 1.00 34.51 O ATOM 1245 H GLY A 185 5.327 31.067 -12.328 1.00 0.00 H ATOM 1246 N PRO A 186 7.218 27.508 -10.631 1.00 32.09 N ATOM 1247 CA PRO A 186 8.336 26.592 -10.872 1.00 33.02 C ATOM 1248 C PRO A 186 8.160 25.707 -12.129 1.00 31.25 C ATOM 1249 O PRO A 186 8.987 24.820 -12.351 1.00 31.07 O ATOM 1250 CB PRO A 186 8.348 25.741 -9.604 1.00 32.54 C ATOM 1251 CG PRO A 186 6.960 25.624 -9.268 1.00 31.12 C ATOM 1252 CD PRO A 186 6.327 26.979 -9.595 1.00 31.33 C ATOM 1253 N VAL A 187 7.135 25.955 -12.937 1.00 27.85 N ATOM 1254 CA VAL A 187 6.956 25.179 -14.167 1.00 27.42 C ATOM 1255 C VAL A 187 6.892 26.067 -15.417 1.00 29.55 C ATOM 1256 O VAL A 187 6.778 27.303 -15.336 1.00 29.64 O ATOM 1257 CB VAL A 187 5.687 24.289 -14.125 1.00 24.99 C ATOM 1258 CG1 VAL A 187 5.632 23.423 -12.847 1.00 26.03 C ATOM 1259 CG2 VAL A 187 4.385 25.106 -14.224 1.00 23.42 C ATOM 1260 H VAL A 187 6.456 26.704 -12.695 1.00 0.00 H ATOM 1261 N GLU A 188 6.998 25.396 -16.564 1.00 28.10 N ATOM 1262 CA GLU A 188 6.668 25.976 -17.864 1.00 27.83 C ATOM 1263 C GLU A 188 5.402 25.310 -18.377 1.00 27.48 C ATOM 1264 O GLU A 188 5.273 24.082 -18.324 1.00 27.63 O ATOM 1265 CB GLU A 188 7.796 25.778 -18.861 1.00 31.58 C ATOM 1266 CG GLU A 188 7.512 26.441 -20.198 1.00 35.92 C ATOM 1267 CD GLU A 188 8.737 26.516 -21.074 1.00 40.30 C ATOM 1268 OE1 GLU A 188 9.084 25.481 -21.669 1.00 40.98 O ATOM 1269 OE2 GLU A 188 9.346 27.599 -21.160 1.00 42.86 O ATOM 1270 H GLU A 188 7.332 24.412 -16.532 1.00 0.00 H ATOM 1271 N LEU A 189 4.462 26.110 -18.860 1.00 26.10 N ATOM 1272 CA LEU A 189 3.257 25.595 -19.495 1.00 24.23 C ATOM 1273 C LEU A 189 3.446 25.740 -21.004 1.00 25.58 C ATOM 1274 O LEU A 189 3.925 26.763 -21.467 1.00 26.74 O ATOM 1275 CB LEU A 189 1.999 26.354 -19.034 1.00 24.14 C ATOM 1276 CG LEU A 189 1.800 26.490 -17.524 1.00 25.22 C ATOM 1277 CD1 LEU A 189 0.637 27.379 -17.229 1.00 26.81 C ATOM 1278 CD2 LEU A 189 1.593 25.114 -16.870 1.00 22.76 C ATOM 1279 H LEU A 189 4.589 27.139 -18.783 1.00 0.00 H ATOM 1280 N PHE A 190 3.068 24.708 -21.746 1.00 25.36 N ATOM 1281 CA PHE A 190 3.283 24.624 -23.185 1.00 26.51 C ATOM 1282 C PHE A 190 1.997 24.183 -23.870 1.00 25.91 C ATOM 1283 O PHE A 190 1.389 23.204 -23.456 1.00 24.47 O ATOM 1284 CB PHE A 190 4.414 23.635 -23.474 1.00 27.43 C ATOM 1285 CG PHE A 190 4.796 23.504 -24.939 1.00 30.29 C ATOM 1286 CD1 PHE A 190 5.360 24.564 -25.638 1.00 32.95 C ATOM 1287 CD2 PHE A 190 4.638 22.291 -25.596 1.00 29.95 C ATOM 1288 CE1 PHE A 190 5.753 24.416 -26.978 1.00 35.55 C ATOM 1289 CE2 PHE A 190 5.017 22.138 -26.932 1.00 32.91 C ATOM 1290 CZ PHE A 190 5.573 23.203 -27.623 1.00 35.14 C ATOM 1291 H PHE A 190 2.591 23.913 -21.274 1.00 0.00 H ATOM 1292 N TYR A 191 1.578 24.904 -24.904 1.00 27.48 N ATOM 1293 CA TYR A 191 0.445 24.471 -25.706 1.00 26.66 C ATOM 1294 C TYR A 191 0.975 23.873 -26.999 1.00 27.92 C ATOM 1295 O TYR A 191 1.434 24.604 -27.820 1.00 30.55 O ATOM 1296 CB TYR A 191 -0.493 25.622 -26.028 1.00 28.13 C ATOM 1297 CG TYR A 191 -1.579 25.226 -27.021 1.00 28.09 C ATOM 1298 CD1 TYR A 191 -2.325 24.065 -26.828 1.00 28.16 C ATOM 1299 CD2 TYR A 191 -1.873 26.020 -28.132 1.00 29.74 C ATOM 1300 CE1 TYR A 191 -3.314 23.693 -27.717 1.00 28.79 C ATOM 1301 CE2 TYR A 191 -2.859 25.649 -29.037 1.00 31.44 C ATOM 1302 CZ TYR A 191 -3.578 24.490 -28.814 1.00 30.39 C ATOM 1303 OH TYR A 191 -4.560 24.100 -29.688 1.00 30.23 O ATOM 1304 HH TYR A 191 -4.965 23.254 -29.371 1.00 0.00 H ATOM 1305 H TYR A 191 2.067 25.790 -25.143 1.00 0.00 H ATOM 1306 N PRO A 192 0.926 22.538 -27.149 1.00 28.11 N ATOM 1307 CA PRO A 192 1.584 21.910 -28.297 1.00 29.47 C ATOM 1308 C PRO A 192 0.742 21.907 -29.558 1.00 30.56 C ATOM 1309 O PRO A 192 1.231 21.473 -30.594 1.00 31.31 O ATOM 1310 CB PRO A 192 1.829 20.475 -27.823 1.00 28.94 C ATOM 1311 CG PRO A 192 0.688 20.206 -26.836 1.00 26.28 C ATOM 1312 CD PRO A 192 0.376 21.550 -26.196 1.00 25.75 C ATOM 1313 N GLY A 193 -0.503 22.366 -29.463 1.00 30.79 N ATOM 1314 CA GLY A 193 -1.465 22.182 -30.538 1.00 31.90 C ATOM 1315 C GLY A 193 -2.478 21.109 -30.168 1.00 30.87 C ATOM 1316 O GLY A 193 -2.379 20.447 -29.122 1.00 28.85 O ATOM 1317 H GLY A 193 -0.795 22.868 -28.600 1.00 0.00 H ATOM 1318 N ALA A 194 -3.471 20.955 -31.027 1.00 30.67 N ATOM 1319 CA ALA A 194 -4.567 20.043 -30.758 1.00 30.45 C ATOM 1320 C ALA A 194 -4.084 18.590 -30.744 1.00 29.95 C ATOM 1321 O ALA A 194 -3.257 18.171 -31.565 1.00 31.08 O ATOM 1322 CB ALA A 194 -5.675 20.238 -31.810 1.00 31.83 C ATOM 1323 H ALA A 194 -3.467 21.499 -31.914 1.00 0.00 H ATOM 1324 N ALA A 195 -4.634 17.819 -29.830 1.00 28.77 N ATOM 1325 CA ALA A 195 -4.286 16.411 -29.719 1.00 28.78 C ATOM 1326 C ALA A 195 -5.439 15.636 -29.085 1.00 28.28 C ATOM 1327 O ALA A 195 -6.447 15.389 -29.721 1.00 29.40 O ATOM 1328 CB ALA A 195 -3.004 16.262 -28.910 1.00 28.45 C ATOM 1329 H ALA A 195 -5.332 18.225 -29.174 1.00 0.00 H ATOM 1330 N HIS A 196 -5.293 15.256 -27.824 1.00 26.80 N ATOM 1331 CA HIS A 196 -6.383 14.602 -27.116 1.00 26.40 C ATOM 1332 C HIS A 196 -7.596 15.530 -27.141 1.00 26.46 C ATOM 1333 O HIS A 196 -8.730 15.091 -27.289 1.00 27.23 O ATOM 1334 CB HIS A 196 -5.982 14.270 -25.673 1.00 24.83 C ATOM 1335 CG HIS A 196 -7.142 13.929 -24.793 1.00 24.33 C ATOM 1336 ND1 HIS A 196 -7.761 12.694 -24.817 1.00 27.04 N ATOM 1337 CD2 HIS A 196 -7.820 14.671 -23.886 1.00 23.75 C ATOM 1338 CE1 HIS A 196 -8.756 12.686 -23.949 1.00 26.68 C ATOM 1339 NE2 HIS A 196 -8.815 13.874 -23.376 1.00 26.74 N ATOM 1340 H HIS A 196 -4.391 15.427 -27.336 1.00 0.00 H ATOM 1341 N SER A 197 -7.337 16.812 -26.939 1.00 25.83 N ATOM 1342 CA SER A 197 -8.359 17.839 -27.127 1.00 26.31 C ATOM 1343 C SER A 197 -7.732 19.069 -27.755 1.00 26.82 C ATOM 1344 O SER A 197 -6.511 19.158 -27.899 1.00 26.64 O ATOM 1345 CB SER A 197 -9.027 18.213 -25.800 1.00 25.04 C ATOM 1346 OG SER A 197 -8.072 18.761 -24.914 1.00 23.69 O ATOM 1347 HG SER A 197 -7.675 19.573 -25.319 1.00 0.00 H ATOM 1348 H SER A 197 -6.382 17.095 -26.639 1.00 0.00 H ATOM 1349 N THR A 198 -8.565 20.017 -28.152 1.00 27.75 N ATOM 1350 CA THR A 198 -8.035 21.172 -28.868 1.00 28.70 C ATOM 1351 C THR A 198 -7.268 22.104 -27.921 1.00 28.18 C ATOM 1352 O THR A 198 -6.484 22.958 -28.369 1.00 29.26 O ATOM 1353 CB THR A 198 -9.146 21.979 -29.545 1.00 32.48 C ATOM 1354 OG1 THR A 198 -10.107 22.357 -28.552 1.00 32.51 O ATOM 1355 CG2 THR A 198 -9.826 21.159 -30.620 1.00 33.93 C ATOM 1356 HG1 THR A 198 -10.487 21.543 -28.135 1.00 0.00 H ATOM 1357 H THR A 198 -9.584 19.940 -27.956 1.00 0.00 H ATOM 1358 N ASP A 199 -7.543 21.978 -26.624 1.00 26.02 N ATOM 1359 CA ASP A 199 -7.034 22.926 -25.645 1.00 25.53 C ATOM 1360 C ASP A 199 -5.912 22.347 -24.783 1.00 25.05 C ATOM 1361 O ASP A 199 -5.414 23.041 -23.893 1.00 25.76 O ATOM 1362 CB ASP A 199 -8.186 23.413 -24.725 1.00 24.76 C ATOM 1363 CG ASP A 199 -8.834 22.281 -23.940 1.00 24.95 C ATOM 1364 OD1 ASP A 199 -9.003 21.174 -24.511 1.00 24.00 O ATOM 1365 OD2 ASP A 199 -9.179 22.481 -22.741 1.00 25.43 O ATOM 1366 H ASP A 199 -8.134 21.185 -26.304 1.00 0.00 H ATOM 1367 N ASN A 200 -5.503 21.103 -25.027 1.00 23.82 N ATOM 1368 CA ASN A 200 -4.659 20.431 -24.031 1.00 22.31 C ATOM 1369 C ASN A 200 -3.280 21.072 -23.888 1.00 25.00 C ATOM 1370 O ASN A 200 -2.618 21.408 -24.854 1.00 23.48 O ATOM 1371 CB ASN A 200 -4.492 18.926 -24.296 1.00 22.37 C ATOM 1372 CG ASN A 200 -4.193 18.542 -25.749 1.00 24.48 C ATOM 1373 OD1 ASN A 200 -4.556 17.430 -26.141 1.00 25.01 O ATOM 1374 ND2 ASN A 200 -3.493 19.379 -26.503 1.00 24.73 N ATOM 1375 HD22 ASN A 200 -3.211 20.306 -26.126 1.00 0.00 H ATOM 1376 HD21 ASN A 200 -3.226 19.108 -27.471 1.00 0.00 H ATOM 1377 H ASN A 200 -5.776 20.617 -25.905 1.00 0.00 H ATOM 1378 N LEU A 201 -2.879 21.231 -22.633 1.00 24.50 N ATOM 1379 CA LEU A 201 -1.592 21.784 -22.262 1.00 23.73 C ATOM 1380 C LEU A 201 -0.706 20.696 -21.720 1.00 24.87 C ATOM 1381 O LEU A 201 -1.217 19.706 -21.182 1.00 25.34 O ATOM 1382 CB LEU A 201 -1.731 22.869 -21.176 1.00 23.96 C ATOM 1383 CG LEU A 201 -2.603 24.107 -21.390 1.00 25.61 C ATOM 1384 CD1 LEU A 201 -2.488 25.042 -20.169 1.00 23.86 C ATOM 1385 CD2 LEU A 201 -2.193 24.789 -22.660 1.00 26.47 C ATOM 1386 H LEU A 201 -3.526 20.942 -21.872 1.00 0.00 H ATOM 1387 N VAL A 202 0.610 20.884 -21.833 1.00 24.64 N ATOM 1388 CA VAL A 202 1.560 20.053 -21.106 1.00 23.34 C ATOM 1389 C VAL A 202 2.405 20.956 -20.214 1.00 23.64 C ATOM 1390 O VAL A 202 2.421 22.176 -20.365 1.00 24.12 O ATOM 1391 CB VAL A 202 2.447 19.182 -22.029 1.00 25.97 C ATOM 1392 CG1 VAL A 202 1.569 18.301 -22.932 1.00 30.14 C ATOM 1393 CG2 VAL A 202 3.391 19.987 -22.849 1.00 26.50 C ATOM 1394 H VAL A 202 0.965 21.640 -22.453 1.00 0.00 H ATOM 1395 N VAL A 203 3.107 20.335 -19.283 1.00 22.10 N ATOM 1396 CA VAL A 203 3.758 21.057 -18.200 1.00 21.82 C ATOM 1397 C VAL A 203 5.151 20.491 -18.037 1.00 23.36 C ATOM 1398 O VAL A 203 5.310 19.278 -17.978 1.00 24.88 O ATOM 1399 CB VAL A 203 2.955 20.889 -16.876 1.00 24.42 C ATOM 1400 CG1 VAL A 203 3.673 21.573 -15.713 1.00 24.36 C ATOM 1401 CG2 VAL A 203 1.494 21.404 -17.051 1.00 23.68 C ATOM 1402 H VAL A 203 3.197 19.300 -19.325 1.00 0.00 H ATOM 1403 N TYR A 204 6.149 21.354 -17.953 1.00 23.96 N ATOM 1404 CA TYR A 204 7.521 20.924 -17.771 1.00 25.53 C ATOM 1405 C TYR A 204 8.055 21.523 -16.487 1.00 27.59 C ATOM 1406 O TYR A 204 7.799 22.700 -16.205 1.00 27.52 O ATOM 1407 CB TYR A 204 8.393 21.352 -18.957 1.00 27.63 C ATOM 1408 CG TYR A 204 9.792 20.791 -18.942 1.00 29.69 C ATOM 1409 CD1 TYR A 204 10.003 19.420 -19.047 1.00 30.58 C ATOM 1410 CD2 TYR A 204 10.897 21.615 -18.846 1.00 32.34 C ATOM 1411 CE1 TYR A 204 11.271 18.894 -19.053 1.00 33.29 C ATOM 1412 CE2 TYR A 204 12.186 21.091 -18.852 1.00 33.49 C ATOM 1413 CZ TYR A 204 12.352 19.725 -18.954 1.00 33.82 C ATOM 1414 OH TYR A 204 13.592 19.165 -18.976 1.00 37.90 O ATOM 1415 HH TYR A 204 14.097 19.516 -19.752 1.00 0.00 H ATOM 1416 H TYR A 204 5.944 22.371 -18.019 1.00 0.00 H ATOM 1417 N VAL A 205 8.812 20.724 -15.738 1.00 28.32 N ATOM 1418 CA VAL A 205 9.434 21.157 -14.488 1.00 29.16 C ATOM 1419 C VAL A 205 10.936 21.174 -14.706 1.00 31.00 C ATOM 1420 O VAL A 205 11.591 20.132 -14.577 1.00 31.78 O ATOM 1421 CB VAL A 205 9.131 20.219 -13.299 1.00 29.98 C ATOM 1422 CG1 VAL A 205 9.760 20.811 -12.026 1.00 31.67 C ATOM 1423 CG2 VAL A 205 7.632 19.938 -13.154 1.00 27.60 C ATOM 1424 H VAL A 205 8.968 19.747 -16.057 1.00 0.00 H ATOM 1425 N PRO A 209 11.499 22.340 -15.063 1.00 31.73 N ATOM 1426 CA PRO A 209 12.874 22.338 -15.552 1.00 36.60 C ATOM 1427 C PRO A 209 13.898 21.933 -14.502 1.00 37.21 C ATOM 1428 O PRO A 209 14.888 21.352 -14.858 1.00 35.61 O ATOM 1429 CB PRO A 209 13.096 23.790 -16.012 1.00 38.91 C ATOM 1430 CG PRO A 209 11.995 24.577 -15.454 1.00 37.19 C ATOM 1431 CD PRO A 209 10.867 23.667 -15.159 1.00 33.74 C ATOM 1432 N SER A 210 13.639 22.191 -13.229 1.00 39.78 N ATOM 1433 CA SER A 210 14.615 21.866 -12.198 1.00 44.70 C ATOM 1434 C SER A 210 14.764 20.343 -12.004 1.00 43.25 C ATOM 1435 O SER A 210 15.773 19.879 -11.488 1.00 44.71 O ATOM 1436 CB SER A 210 14.206 22.532 -10.881 1.00 46.11 C ATOM 1437 OG SER A 210 12.980 21.998 -10.454 1.00 46.35 O ATOM 1438 HG SER A 210 12.289 22.170 -11.142 1.00 0.00 H ATOM 1439 H SER A 210 12.733 22.628 -12.964 1.00 0.00 H ATOM 1440 N ALA A 211 13.764 19.579 -12.448 1.00 39.95 N ATOM 1441 CA ALA A 211 13.740 18.126 -12.277 1.00 38.11 C ATOM 1442 C ALA A 211 13.672 17.344 -13.597 1.00 38.37 C ATOM 1443 O ALA A 211 13.654 16.113 -13.594 1.00 39.61 O ATOM 1444 CB ALA A 211 12.573 17.759 -11.429 1.00 36.57 C ATOM 1445 H ALA A 211 12.968 20.036 -12.936 1.00 0.00 H ATOM 1446 N SER A 215 13.604 18.055 -14.716 1.00 37.94 N ATOM 1447 CA SER A 215 13.460 17.423 -16.032 1.00 38.73 C ATOM 1448 C SER A 215 12.253 16.478 -16.087 1.00 33.94 C ATOM 1449 O SER A 215 12.356 15.343 -16.567 1.00 34.70 O ATOM 1450 CB SER A 215 14.721 16.651 -16.404 1.00 41.65 C ATOM 1451 OG SER A 215 15.825 17.521 -16.496 1.00 45.28 O ATOM 1452 HG SER A 215 16.633 17.003 -16.738 1.00 0.00 H ATOM 1453 H SER A 215 13.654 19.092 -14.658 1.00 0.00 H ATOM 1454 N VAL A 216 11.134 16.948 -15.571 1.00 29.98 N ATOM 1455 CA VAL A 216 9.898 16.189 -15.556 1.00 26.83 C ATOM 1456 C VAL A 216 8.917 16.801 -16.522 1.00 27.96 C ATOM 1457 O VAL A 216 8.540 17.971 -16.396 1.00 28.05 O ATOM 1458 CB VAL A 216 9.249 16.146 -14.134 1.00 27.14 C ATOM 1459 CG1 VAL A 216 7.856 15.543 -14.184 1.00 26.85 C ATOM 1460 CG2 VAL A 216 10.155 15.385 -13.139 1.00 29.53 C ATOM 1461 H VAL A 216 11.138 17.902 -15.158 1.00 0.00 H ATOM 1462 N LEU A 217 8.461 15.977 -17.460 1.00 27.62 N ATOM 1463 CA LEU A 217 7.440 16.366 -18.412 1.00 26.17 C ATOM 1464 C LEU A 217 6.110 15.711 -18.115 1.00 27.07 C ATOM 1465 O LEU A 217 5.979 14.493 -18.170 1.00 28.71 O ATOM 1466 CB LEU A 217 7.904 15.992 -19.813 1.00 28.15 C ATOM 1467 CG LEU A 217 6.960 16.285 -20.974 1.00 29.94 C ATOM 1468 CD1 LEU A 217 6.639 17.767 -21.041 1.00 29.96 C ATOM 1469 CD2 LEU A 217 7.607 15.818 -22.246 1.00 31.19 C ATOM 1470 H LEU A 217 8.852 15.015 -17.513 1.00 0.00 H ATOM 1471 N TYR A 218 5.102 16.525 -17.830 1.00 25.82 N ATOM 1472 CA TYR A 218 3.759 16.023 -17.589 1.00 25.01 C ATOM 1473 C TYR A 218 2.924 16.235 -18.853 1.00 25.67 C ATOM 1474 O TYR A 218 2.675 17.372 -19.246 1.00 25.53 O ATOM 1475 CB TYR A 218 3.141 16.743 -16.387 1.00 24.22 C ATOM 1476 CG TYR A 218 1.697 16.402 -16.143 1.00 24.41 C ATOM 1477 CD1 TYR A 218 1.334 15.184 -15.617 1.00 25.56 C ATOM 1478 CD2 TYR A 218 0.693 17.303 -16.459 1.00 24.17 C ATOM 1479 CE1 TYR A 218 0.024 14.880 -15.388 1.00 27.01 C ATOM 1480 CE2 TYR A 218 -0.614 17.014 -16.242 1.00 24.62 C ATOM 1481 CZ TYR A 218 -0.953 15.813 -15.692 1.00 26.94 C ATOM 1482 OH TYR A 218 -2.267 15.519 -15.471 1.00 30.73 O ATOM 1483 HH TYR A 218 -2.339 14.617 -15.071 1.00 0.00 H ATOM 1484 H TYR A 218 5.277 17.549 -17.778 1.00 0.00 H ATOM 1485 N GLY A 219 2.484 15.141 -19.476 1.00 27.41 N ATOM 1486 CA GLY A 219 1.817 15.215 -20.757 1.00 27.95 C ATOM 1487 C GLY A 219 0.305 15.281 -20.687 1.00 27.70 C ATOM 1488 O GLY A 219 -0.353 15.569 -21.699 1.00 26.52 O ATOM 1489 H GLY A 219 2.624 14.212 -19.030 1.00 0.00 H ATOM 1490 N GLY A 220 -0.258 15.020 -19.510 1.00 28.19 N ATOM 1491 CA GLY A 220 -1.687 14.893 -19.369 1.00 25.42 C ATOM 1492 C GLY A 220 -2.189 13.882 -20.387 1.00 24.98 C ATOM 1493 O GLY A 220 -1.452 12.980 -20.811 1.00 23.52 O ATOM 1494 H GLY A 220 0.347 14.905 -18.672 1.00 0.00 H ATOM 1495 N CYS A 221 -3.421 14.064 -20.854 1.00 24.60 N ATOM 1496 CA CYS A 221 -4.071 13.034 -21.647 1.00 25.30 C ATOM 1497 C CYS A 221 -3.605 13.055 -23.107 1.00 26.55 C ATOM 1498 O CYS A 221 -4.014 12.209 -23.895 1.00 28.76 O ATOM 1499 CB CYS A 221 -5.579 13.179 -21.512 1.00 26.27 C ATOM 1500 SG CYS A 221 -6.003 13.160 -19.699 1.00 29.92 S ATOM 1501 H CYS A 221 -3.924 14.951 -20.650 1.00 0.00 H ATOM 1502 N ALA A 222 -2.708 13.977 -23.455 1.00 22.68 N ATOM 1503 CA ALA A 222 -2.114 13.936 -24.799 1.00 24.77 C ATOM 1504 C ALA A 222 -1.053 12.836 -24.946 1.00 25.02 C ATOM 1505 O ALA A 222 -0.658 12.506 -26.061 1.00 26.57 O ATOM 1506 CB ALA A 222 -1.491 15.278 -25.144 1.00 26.39 C ATOM 1507 H ALA A 222 -2.431 14.719 -22.781 1.00 0.00 H ATOM 1508 N ILE A 223 -0.564 12.331 -23.817 1.00 24.39 N ATOM 1509 CA ILE A 223 0.471 11.296 -23.799 1.00 27.33 C ATOM 1510 C ILE A 223 -0.097 10.031 -23.160 1.00 25.92 C ATOM 1511 O ILE A 223 -0.670 10.083 -22.077 1.00 24.94 O ATOM 1512 CB ILE A 223 1.729 11.753 -23.012 1.00 26.60 C ATOM 1513 CG1 ILE A 223 2.312 13.055 -23.584 1.00 27.21 C ATOM 1514 CG2 ILE A 223 2.779 10.678 -23.031 1.00 28.56 C ATOM 1515 CD1 ILE A 223 2.558 13.001 -25.031 1.00 31.07 C ATOM 1516 H ILE A 223 -0.932 12.685 -22.911 1.00 0.00 H ATOM 1517 N TYR A 224 0.059 8.912 -23.858 1.00 27.37 N ATOM 1518 CA TYR A 224 -0.355 7.595 -23.375 1.00 28.66 C ATOM 1519 C TYR A 224 0.789 6.870 -22.654 1.00 29.68 C ATOM 1520 O TYR A 224 1.966 7.048 -23.018 1.00 29.85 O ATOM 1521 CB TYR A 224 -0.826 6.715 -24.552 1.00 31.58 C ATOM 1522 CG TYR A 224 -2.165 7.068 -25.161 1.00 35.18 C ATOM 1523 CD1 TYR A 224 -2.914 8.148 -24.716 1.00 35.13 C ATOM 1524 CD2 TYR A 224 -2.695 6.298 -26.176 1.00 40.51 C ATOM 1525 CE1 TYR A 224 -4.155 8.449 -25.282 1.00 36.34 C ATOM 1526 CE2 TYR A 224 -3.934 6.598 -26.752 1.00 42.38 C ATOM 1527 CZ TYR A 224 -4.661 7.665 -26.290 1.00 39.79 C ATOM 1528 OH TYR A 224 -5.896 7.965 -26.843 1.00 41.06 O ATOM 1529 HH TYR A 224 -6.274 8.760 -26.391 1.00 0.00 H ATOM 1530 H TYR A 224 0.499 8.976 -24.798 1.00 0.00 H ATOM 1531 N GLU A 225 0.444 6.032 -21.666 1.00 28.90 N ATOM 1532 CA GLU A 225 1.421 5.114 -21.087 1.00 30.14 C ATOM 1533 C GLU A 225 1.833 4.010 -22.067 1.00 33.00 C ATOM 1534 O GLU A 225 1.122 3.660 -23.030 1.00 33.59 O ATOM 1535 CB GLU A 225 0.892 4.478 -19.780 1.00 29.87 C ATOM 1536 CG GLU A 225 -0.179 3.404 -19.963 1.00 31.11 C ATOM 1537 CD GLU A 225 -0.480 2.601 -18.689 1.00 35.01 C ATOM 1538 OE1 GLU A 225 0.442 2.368 -17.862 1.00 33.14 O ATOM 1539 OE2 GLU A 225 -1.654 2.168 -18.547 1.00 37.15 O ATOM 1540 H GLU A 225 -0.532 6.036 -21.307 1.00 0.00 H ATOM 1541 N LEU A 226 3.006 3.451 -21.800 1.00 35.30 N ATOM 1542 CA LEU A 226 3.638 2.549 -22.735 1.00 38.96 C ATOM 1543 C LEU A 226 2.788 1.297 -23.015 1.00 40.71 C ATOM 1544 O LEU A 226 2.751 0.810 -24.151 1.00 43.38 O ATOM 1545 CB LEU A 226 5.010 2.133 -22.202 1.00 41.95 C ATOM 1546 CG LEU A 226 6.228 2.237 -23.131 1.00 44.58 C ATOM 1547 CD1 LEU A 226 7.337 1.390 -22.562 1.00 44.66 C ATOM 1548 CD2 LEU A 226 5.960 1.858 -24.577 1.00 45.58 C ATOM 1549 H LEU A 226 3.480 3.666 -20.900 1.00 0.00 H ATOM 1550 N SER A 227 2.105 0.772 -22.002 1.00 40.15 N ATOM 1551 CA SER A 227 1.340 -0.462 -22.193 1.00 42.73 C ATOM 1552 C SER A 227 0.001 -0.251 -22.912 1.00 42.68 C ATOM 1553 O SER A 227 -0.608 -1.207 -23.353 1.00 45.41 O ATOM 1554 CB SER A 227 1.084 -1.139 -20.849 1.00 42.40 C ATOM 1555 OG SER A 227 0.339 -0.283 -19.993 1.00 41.34 O ATOM 1556 HG SER A 227 -0.530 -0.070 -20.417 1.00 0.00 H ATOM 1557 H SER A 227 2.114 1.239 -21.073 1.00 0.00 H ATOM 1558 N ARG A 228 -0.449 0.995 -23.023 1.00 40.70 N ATOM 1559 CA ARG A 228 -1.768 1.300 -23.571 1.00 43.22 C ATOM 1560 C ARG A 228 -1.737 1.293 -25.094 1.00 46.47 C ATOM 1561 O ARG A 228 -1.095 2.135 -25.709 1.00 44.68 O ATOM 1562 CB ARG A 228 -2.246 2.658 -23.056 1.00 42.56 C ATOM 1563 CG ARG A 228 -3.555 3.169 -23.634 1.00 44.76 C ATOM 1564 CD ARG A 228 -3.984 4.424 -22.851 1.00 43.61 C ATOM 1565 NE ARG A 228 -5.159 5.074 -23.418 1.00 44.82 N ATOM 1566 CZ ARG A 228 -5.673 6.226 -22.985 1.00 44.05 C ATOM 1567 NH1 ARG A 228 -5.113 6.894 -21.983 1.00 42.37 N ATOM 1568 NH2 ARG A 228 -6.737 6.742 -23.588 1.00 45.46 N ATOM 1569 HE ARG A 228 -5.631 4.606 -24.218 1.00 0.00 H ATOM 1570 HH12 ARG A 228 -5.529 7.791 -21.659 1.00 0.00 H ATOM 1571 HH11 ARG A 228 -4.259 6.520 -21.522 1.00 0.00 H ATOM 1572 HH22 ARG A 228 -7.140 7.640 -23.253 1.00 0.00 H ATOM 1573 HH21 ARG A 228 -7.167 6.248 -24.396 1.00 0.00 H ATOM 1574 H ARG A 228 0.158 1.779 -22.709 1.00 0.00 H ATOM 1575 N THR A 229 -2.435 0.330 -25.685 1.00 51.66 N ATOM 1576 CA THR A 229 -2.415 0.117 -27.129 1.00 58.79 C ATOM 1577 C THR A 229 -3.677 0.649 -27.784 1.00 68.65 C ATOM 1578 O THR A 229 -3.762 0.710 -29.007 1.00 68.30 O ATOM 1579 CB THR A 229 -2.282 -1.368 -27.474 1.00 58.81 C ATOM 1580 OG1 THR A 229 -2.293 -1.537 -28.897 1.00 59.70 O ATOM 1581 CG2 THR A 229 -3.439 -2.160 -26.858 1.00 59.22 C ATOM 1582 HG1 THR A 229 -3.145 -1.190 -29.263 1.00 0.00 H ATOM 1583 H THR A 229 -3.019 -0.297 -25.096 1.00 0.00 H ATOM 1584 N SER A 230 -4.651 1.032 -26.965 1.00 78.99 N ATOM 1585 CA SER A 230 -5.944 1.478 -27.464 1.00 86.23 C ATOM 1586 C SER A 230 -6.190 2.921 -27.089 1.00 81.20 C ATOM 1587 O SER A 230 -6.172 3.274 -25.906 1.00 85.62 O ATOM 1588 CB SER A 230 -7.071 0.610 -26.902 1.00 91.92 C ATOM 1589 OG SER A 230 -7.526 1.123 -25.659 1.00 91.02 O ATOM 1590 HG SER A 230 -7.864 2.044 -25.788 1.00 0.00 H ATOM 1591 H SER A 230 -4.485 1.013 -25.939 1.00 0.00 H ATOM 1592 N ALA A 231 -6.426 3.755 -28.094 1.00 70.08 N ATOM 1593 CA ALA A 231 -6.853 5.119 -27.840 1.00 60.63 C ATOM 1594 C ALA A 231 -8.194 5.075 -27.123 1.00 64.12 C ATOM 1595 O ALA A 231 -9.093 4.336 -27.503 1.00 62.28 O ATOM 1596 CB ALA A 231 -6.936 5.921 -29.135 1.00 55.17 C ATOM 1597 H ALA A 231 -6.304 3.428 -29.074 1.00 0.00 H ATOM 1598 N GLY A 232 -8.311 5.859 -26.066 1.00 71.50 N ATOM 1599 CA GLY A 232 -9.431 5.725 -25.158 1.00 76.09 C ATOM 1600 C GLY A 232 -10.549 6.634 -25.590 1.00 74.41 C ATOM 1601 O GLY A 232 -11.120 6.463 -26.671 1.00 82.10 O ATOM 1602 H GLY A 232 -7.588 6.583 -25.883 1.00 0.00 H ATOM 1603 N ASN A 233 -10.863 7.601 -24.739 1.00 61.59 N ATOM 1604 CA ASN A 233 -11.817 8.632 -25.089 1.00 53.38 C ATOM 1605 C ASN A 233 -11.183 9.591 -26.096 1.00 50.81 C ATOM 1606 O ASN A 233 -10.239 10.301 -25.761 1.00 47.37 O ATOM 1607 CB ASN A 233 -12.257 9.386 -23.839 1.00 47.59 C ATOM 1608 CG ASN A 233 -13.261 10.475 -24.128 1.00 48.20 C ATOM 1609 OD1 ASN A 233 -13.921 10.483 -25.170 1.00 50.68 O ATOM 1610 ND2 ASN A 233 -13.368 11.423 -23.206 1.00 47.52 N ATOM 1611 HD22 ASN A 233 -12.791 11.376 -22.342 1.00 0.00 H ATOM 1612 HD21 ASN A 233 -14.029 12.214 -23.347 1.00 0.00 H ATOM 1613 H ASN A 233 -10.415 7.619 -23.801 1.00 0.00 H ATOM 1614 N VAL A 234 -11.705 9.626 -27.318 1.00 53.93 N ATOM 1615 CA VAL A 234 -11.159 10.489 -28.371 1.00 54.38 C ATOM 1616 C VAL A 234 -12.243 11.395 -28.963 1.00 52.26 C ATOM 1617 O VAL A 234 -12.114 11.892 -30.086 1.00 51.57 O ATOM 1618 CB VAL A 234 -10.505 9.658 -29.494 1.00 58.75 C ATOM 1619 CG1 VAL A 234 -9.171 9.089 -29.029 1.00 58.18 C ATOM 1620 CG2 VAL A 234 -11.444 8.546 -29.955 1.00 62.55 C ATOM 1621 H VAL A 234 -12.525 9.024 -27.534 1.00 0.00 H ATOM 1622 N ALA A 235 -13.285 11.642 -28.178 1.00 51.64 N ATOM 1623 CA ALA A 235 -14.474 12.346 -28.655 1.00 53.65 C ATOM 1624 C ALA A 235 -14.157 13.747 -29.165 1.00 49.91 C ATOM 1625 O ALA A 235 -14.712 14.198 -30.154 1.00 51.00 O ATOM 1626 CB ALA A 235 -15.511 12.423 -27.542 1.00 55.38 C ATOM 1627 H ALA A 235 -13.254 11.323 -27.189 1.00 0.00 H ATOM 1628 N ASP A 236 -13.253 14.423 -28.471 1.00 44.63 N ATOM 1629 CA ASP A 236 -12.939 15.811 -28.751 1.00 41.63 C ATOM 1630 C ASP A 236 -11.506 15.941 -29.296 1.00 38.20 C ATOM 1631 O ASP A 236 -10.932 17.033 -29.333 1.00 38.19 O ATOM 1632 CB ASP A 236 -13.141 16.633 -27.470 1.00 41.00 C ATOM 1633 CG ASP A 236 -14.600 16.596 -26.979 1.00 43.49 C ATOM 1634 OD1 ASP A 236 -15.513 16.888 -27.795 1.00 47.70 O ATOM 1635 OD2 ASP A 236 -14.846 16.263 -25.796 1.00 41.61 O ATOM 1636 H ASP A 236 -12.751 13.941 -27.698 1.00 0.00 H ATOM 1637 N ALA A 237 -10.950 14.812 -29.723 1.00 35.89 N ATOM 1638 CA ALA A 237 -9.566 14.743 -30.187 1.00 34.32 C ATOM 1639 C ALA A 237 -9.454 15.195 -31.627 1.00 33.94 C ATOM 1640 O ALA A 237 -10.438 15.195 -32.367 1.00 35.15 O ATOM 1641 CB ALA A 237 -9.020 13.325 -30.060 1.00 35.22 C ATOM 1642 H ALA A 237 -11.522 13.944 -29.727 1.00 0.00 H ATOM 1643 N ASP A 238 -8.239 15.553 -32.013 1.00 33.21 N ATOM 1644 CA ASP A 238 -7.932 15.869 -33.409 1.00 35.54 C ATOM 1645 C ASP A 238 -6.834 14.899 -33.842 1.00 36.65 C ATOM 1646 O ASP A 238 -5.648 15.142 -33.604 1.00 35.10 O ATOM 1647 CB ASP A 238 -7.494 17.323 -33.542 1.00 34.88 C ATOM 1648 CG ASP A 238 -7.339 17.762 -34.983 1.00 37.58 C ATOM 1649 OD1 ASP A 238 -6.996 16.922 -35.830 1.00 38.49 O ATOM 1650 OD2 ASP A 238 -7.542 18.960 -35.261 1.00 38.89 O ATOM 1651 H ASP A 238 -7.481 15.611 -31.304 1.00 0.00 H ATOM 1652 N LEU A 239 -7.236 13.787 -34.437 1.00 38.27 N ATOM 1653 CA LEU A 239 -6.305 12.699 -34.729 1.00 40.74 C ATOM 1654 C LEU A 239 -5.252 13.052 -35.771 1.00 42.67 C ATOM 1655 O LEU A 239 -4.126 12.565 -35.696 1.00 43.57 O ATOM 1656 CB LEU A 239 -7.077 11.458 -35.191 1.00 44.46 C ATOM 1657 CG LEU A 239 -7.909 10.750 -34.122 1.00 46.43 C ATOM 1658 CD1 LEU A 239 -8.535 9.485 -34.671 1.00 48.38 C ATOM 1659 CD2 LEU A 239 -7.076 10.428 -32.912 1.00 46.80 C ATOM 1660 H LEU A 239 -8.236 13.685 -34.703 1.00 0.00 H ATOM 1661 N ALA A 240 -5.609 13.889 -36.741 1.00 43.26 N ATOM 1662 CA ALA A 240 -4.658 14.323 -37.768 1.00 42.90 C ATOM 1663 C ALA A 240 -3.568 15.231 -37.197 1.00 41.51 C ATOM 1664 O ALA A 240 -2.426 15.210 -37.659 1.00 41.30 O ATOM 1665 CB ALA A 240 -5.381 15.044 -38.894 1.00 44.10 C ATOM 1666 H ALA A 240 -6.586 14.244 -36.771 1.00 0.00 H ATOM 1667 N GLU A 241 -3.930 16.047 -36.210 1.00 38.60 N ATOM 1668 CA GLU A 241 -2.996 17.017 -35.644 1.00 37.43 C ATOM 1669 C GLU A 241 -2.161 16.421 -34.493 1.00 36.56 C ATOM 1670 O GLU A 241 -1.073 16.901 -34.219 1.00 35.35 O ATOM 1671 CB GLU A 241 -3.749 18.254 -35.126 1.00 36.51 C ATOM 1672 CG GLU A 241 -4.396 19.102 -36.206 1.00 39.31 C ATOM 1673 CD GLU A 241 -3.371 19.748 -37.133 1.00 42.11 C ATOM 1674 OE1 GLU A 241 -2.187 19.833 -36.717 1.00 42.23 O ATOM 1675 OE2 GLU A 241 -3.750 20.161 -38.265 1.00 43.22 O ATOM 1676 H GLU A 241 -4.898 15.993 -35.834 1.00 0.00 H ATOM 1677 N TRP A 242 -2.682 15.380 -33.848 1.00 34.92 N ATOM 1678 CA TRP A 242 -2.063 14.836 -32.639 1.00 33.33 C ATOM 1679 C TRP A 242 -0.579 14.480 -32.855 1.00 34.04 C ATOM 1680 O TRP A 242 0.252 14.855 -32.050 1.00 32.99 O ATOM 1681 CB TRP A 242 -2.875 13.626 -32.162 1.00 33.08 C ATOM 1682 CG TRP A 242 -2.688 13.197 -30.738 1.00 31.32 C ATOM 1683 CD1 TRP A 242 -1.576 13.317 -29.961 1.00 30.36 C ATOM 1684 CD2 TRP A 242 -3.671 12.541 -29.943 1.00 30.60 C ATOM 1685 NE1 TRP A 242 -1.811 12.773 -28.715 1.00 29.05 N ATOM 1686 CE2 TRP A 242 -3.092 12.286 -28.684 1.00 29.16 C ATOM 1687 CE3 TRP A 242 -4.996 12.144 -30.176 1.00 31.26 C ATOM 1688 CZ2 TRP A 242 -3.792 11.666 -27.664 1.00 28.33 C ATOM 1689 CZ3 TRP A 242 -5.687 11.519 -29.162 1.00 30.89 C ATOM 1690 CH2 TRP A 242 -5.076 11.282 -27.914 1.00 28.98 C ATOM 1691 HE1 TRP A 242 -1.130 12.738 -27.930 1.00 0.00 H ATOM 1692 H TRP A 242 -3.552 14.942 -34.213 1.00 0.00 H ATOM 1693 N PRO A 243 -0.231 13.808 -33.967 1.00 36.08 N ATOM 1694 CA PRO A 243 1.200 13.480 -34.072 1.00 36.87 C ATOM 1695 C PRO A 243 2.089 14.720 -34.252 1.00 37.32 C ATOM 1696 O PRO A 243 3.218 14.732 -33.771 1.00 36.88 O ATOM 1697 CB PRO A 243 1.263 12.569 -35.314 1.00 39.31 C ATOM 1698 CG PRO A 243 -0.122 12.070 -35.499 1.00 39.46 C ATOM 1699 CD PRO A 243 -1.018 13.173 -35.037 1.00 37.88 C ATOM 1700 N THR A 244 1.581 15.741 -34.942 1.00 37.53 N ATOM 1701 CA THR A 244 2.290 17.015 -35.070 1.00 37.81 C ATOM 1702 C THR A 244 2.469 17.706 -33.709 1.00 35.76 C ATOM 1703 O THR A 244 3.518 18.266 -33.417 1.00 35.92 O ATOM 1704 CB THR A 244 1.541 17.955 -36.026 1.00 38.94 C ATOM 1705 OG1 THR A 244 1.420 17.309 -37.297 1.00 41.06 O ATOM 1706 CG2 THR A 244 2.291 19.275 -36.203 1.00 39.70 C ATOM 1707 HG1 THR A 244 0.938 17.905 -37.924 1.00 0.00 H ATOM 1708 H THR A 244 0.655 15.629 -35.402 1.00 0.00 H ATOM 1709 N SER A 245 1.431 17.665 -32.889 1.00 34.06 N ATOM 1710 CA SER A 245 1.501 18.261 -31.563 1.00 32.20 C ATOM 1711 C SER A 245 2.544 17.511 -30.698 1.00 31.71 C ATOM 1712 O SER A 245 3.274 18.126 -29.923 1.00 31.02 O ATOM 1713 CB SER A 245 0.103 18.254 -30.930 1.00 32.70 C ATOM 1714 OG SER A 245 -0.805 18.994 -31.761 1.00 31.70 O ATOM 1715 HG SER A 245 -1.706 18.988 -31.350 1.00 0.00 H ATOM 1716 H SER A 245 0.553 17.200 -33.196 1.00 0.00 H ATOM 1717 N ILE A 246 2.624 16.193 -30.849 1.00 32.04 N ATOM 1718 CA ILE A 246 3.629 15.421 -30.129 1.00 31.92 C ATOM 1719 C ILE A 246 5.013 15.828 -30.596 1.00 33.45 C ATOM 1720 O ILE A 246 5.921 15.951 -29.780 1.00 33.12 O ATOM 1721 CB ILE A 246 3.473 13.901 -30.329 1.00 35.37 C ATOM 1722 CG1 ILE A 246 2.162 13.385 -29.734 1.00 34.66 C ATOM 1723 CG2 ILE A 246 4.680 13.126 -29.740 1.00 35.48 C ATOM 1724 CD1 ILE A 246 2.132 13.306 -28.266 1.00 36.26 C ATOM 1725 H ILE A 246 1.962 15.707 -31.488 1.00 0.00 H ATOM 1726 N GLU A 247 5.178 16.007 -31.916 1.00 35.23 N ATOM 1727 CA GLU A 247 6.458 16.413 -32.461 1.00 37.82 C ATOM 1728 C GLU A 247 6.906 17.757 -31.868 1.00 36.68 C ATOM 1729 O GLU A 247 8.079 17.939 -31.579 1.00 37.23 O ATOM 1730 CB GLU A 247 6.385 16.493 -33.981 1.00 44.92 C ATOM 1731 CG GLU A 247 7.750 16.602 -34.661 1.00 53.45 C ATOM 1732 CD GLU A 247 8.674 15.424 -34.346 1.00 59.80 C ATOM 1733 OE1 GLU A 247 9.653 15.616 -33.589 1.00 61.29 O ATOM 1734 OE2 GLU A 247 8.428 14.310 -34.867 1.00 64.03 O ATOM 1735 H GLU A 247 4.375 15.852 -32.558 1.00 0.00 H ATOM 1736 N ARG A 248 5.977 18.692 -31.671 1.00 35.33 N ATOM 1737 CA ARG A 248 6.312 19.950 -31.008 1.00 35.08 C ATOM 1738 C ARG A 248 6.830 19.729 -29.579 1.00 33.82 C ATOM 1739 O ARG A 248 7.758 20.408 -29.152 1.00 34.14 O ATOM 1740 CB ARG A 248 5.107 20.885 -30.942 1.00 34.00 C ATOM 1741 CG ARG A 248 4.675 21.404 -32.285 1.00 35.63 C ATOM 1742 CD ARG A 248 3.836 22.671 -32.183 1.00 35.38 C ATOM 1743 NE ARG A 248 3.344 23.022 -33.508 1.00 37.13 N ATOM 1744 CZ ARG A 248 2.234 22.548 -34.070 1.00 37.12 C ATOM 1745 NH1 ARG A 248 1.433 21.719 -33.403 1.00 35.85 N ATOM 1746 NH2 ARG A 248 1.921 22.918 -35.322 1.00 39.18 N ATOM 1747 HE ARG A 248 3.907 23.699 -34.061 1.00 0.00 H ATOM 1748 HH12 ARG A 248 0.569 21.356 -33.854 1.00 0.00 H ATOM 1749 HH11 ARG A 248 1.672 21.435 -32.431 1.00 0.00 H ATOM 1750 HH22 ARG A 248 1.056 22.554 -35.771 1.00 0.00 H ATOM 1751 HH21 ARG A 248 2.543 23.569 -35.843 1.00 0.00 H ATOM 1752 H ARG A 248 5.002 18.524 -31.993 1.00 0.00 H ATOM 1753 N ILE A 249 6.193 18.822 -28.843 1.00 32.01 N ATOM 1754 CA ILE A 249 6.604 18.541 -27.464 1.00 30.84 C ATOM 1755 C ILE A 249 8.040 18.022 -27.485 1.00 34.11 C ATOM 1756 O ILE A 249 8.897 18.500 -26.764 1.00 35.59 O ATOM 1757 CB ILE A 249 5.699 17.519 -26.783 1.00 30.73 C ATOM 1758 CG1 ILE A 249 4.261 18.058 -26.689 1.00 28.00 C ATOM 1759 CG2 ILE A 249 6.223 17.188 -25.380 1.00 28.42 C ATOM 1760 CD1 ILE A 249 3.251 17.051 -26.174 1.00 27.64 C ATOM 1761 H ILE A 249 5.390 18.304 -29.253 1.00 0.00 H ATOM 1762 N GLN A 250 8.273 17.055 -28.360 1.00 35.23 N ATOM 1763 CA GLN A 250 9.562 16.442 -28.553 1.00 40.90 C ATOM 1764 C GLN A 250 10.664 17.476 -28.842 1.00 42.23 C ATOM 1765 O GLN A 250 11.766 17.384 -28.315 1.00 40.88 O ATOM 1766 CB GLN A 250 9.443 15.434 -29.690 1.00 46.20 C ATOM 1767 CG GLN A 250 10.705 14.656 -29.988 1.00 54.76 C ATOM 1768 CD GLN A 250 11.006 13.638 -28.906 1.00 60.05 C ATOM 1769 OE1 GLN A 250 10.346 12.593 -28.813 1.00 61.88 O ATOM 1770 NE2 GLN A 250 12.001 13.938 -28.072 1.00 61.83 N ATOM 1771 HE22 GLN A 250 12.527 14.827 -28.189 1.00 0.00 H ATOM 1772 HE21 GLN A 250 12.251 13.283 -27.304 1.00 0.00 H ATOM 1773 H GLN A 250 7.479 16.719 -28.941 1.00 0.00 H ATOM 1774 N GLN A 251 10.368 18.458 -29.691 1.00 44.27 N ATOM 1775 CA GLN A 251 11.379 19.436 -30.070 1.00 48.50 C ATOM 1776 C GLN A 251 11.642 20.433 -28.951 1.00 45.53 C ATOM 1777 O GLN A 251 12.750 20.947 -28.815 1.00 47.04 O ATOM 1778 CB GLN A 251 10.961 20.191 -31.342 1.00 51.93 C ATOM 1779 CG GLN A 251 10.994 19.348 -32.592 1.00 54.79 C ATOM 1780 CD GLN A 251 12.406 19.100 -33.105 1.00 58.94 C ATOM 1781 OE1 GLN A 251 13.304 19.928 -32.924 1.00 60.66 O ATOM 1782 NE2 GLN A 251 12.607 17.957 -33.760 1.00 61.20 N ATOM 1783 HE22 GLN A 251 11.822 17.287 -33.890 1.00 0.00 H ATOM 1784 HE21 GLN A 251 13.549 17.735 -34.141 1.00 0.00 H ATOM 1785 H GLN A 251 9.409 18.527 -30.086 1.00 0.00 H ATOM 1786 N HIS A 252 10.620 20.713 -28.156 1.00 39.07 N ATOM 1787 CA HIS A 252 10.738 21.729 -27.131 1.00 39.77 C ATOM 1788 C HIS A 252 11.389 21.153 -25.858 1.00 40.97 C ATOM 1789 O HIS A 252 12.118 21.858 -25.161 1.00 42.32 O ATOM 1790 CB HIS A 252 9.353 22.312 -26.823 1.00 39.27 C ATOM 1791 CG HIS A 252 9.364 23.764 -26.466 1.00 42.68 C ATOM 1792 ND1 HIS A 252 9.157 24.219 -25.180 1.00 44.03 N ATOM 1793 CD2 HIS A 252 9.518 24.869 -27.234 1.00 45.54 C ATOM 1794 CE1 HIS A 252 9.209 25.541 -25.165 1.00 44.67 C ATOM 1795 NE2 HIS A 252 9.422 25.959 -26.400 1.00 46.83 N ATOM 1796 H HIS A 252 9.724 20.198 -28.269 1.00 0.00 H ATOM 1797 N TYR A 253 11.151 19.871 -25.575 1.00 40.11 N ATOM 1798 CA TYR A 253 11.640 19.260 -24.326 1.00 39.09 C ATOM 1799 C TYR A 253 12.489 18.002 -24.605 1.00 39.48 C ATOM 1800 O TYR A 253 12.175 16.909 -24.135 1.00 39.90 O ATOM 1801 CB TYR A 253 10.456 18.949 -23.406 1.00 37.84 C ATOM 1802 CG TYR A 253 9.653 20.191 -23.055 1.00 37.60 C ATOM 1803 CD1 TYR A 253 10.220 21.220 -22.313 1.00 37.56 C ATOM 1804 CD2 TYR A 253 8.337 20.343 -23.490 1.00 36.62 C ATOM 1805 CE1 TYR A 253 9.507 22.360 -22.019 1.00 38.92 C ATOM 1806 CE2 TYR A 253 7.609 21.467 -23.193 1.00 37.20 C ATOM 1807 CZ TYR A 253 8.191 22.473 -22.455 1.00 38.95 C ATOM 1808 OH TYR A 253 7.484 23.603 -22.171 1.00 38.23 O ATOM 1809 HH TYR A 253 8.047 24.218 -21.637 1.00 0.00 H ATOM 1810 H TYR A 253 10.610 19.292 -26.249 1.00 0.00 H ATOM 1811 N PRO A 254 13.594 18.170 -25.342 1.00 39.17 N ATOM 1812 CA PRO A 254 14.389 17.015 -25.785 1.00 41.69 C ATOM 1813 C PRO A 254 15.218 16.375 -24.674 1.00 45.07 C ATOM 1814 O PRO A 254 15.747 15.289 -24.856 1.00 48.24 O ATOM 1815 CB PRO A 254 15.305 17.613 -26.845 1.00 43.14 C ATOM 1816 CG PRO A 254 15.434 19.046 -26.465 1.00 42.94 C ATOM 1817 CD PRO A 254 14.074 19.422 -25.954 1.00 39.31 C ATOM 1818 N GLU A 255 15.301 17.053 -23.535 1.00 45.26 N ATOM 1819 CA GLU A 255 16.131 16.626 -22.416 1.00 46.56 C ATOM 1820 C GLU A 255 15.300 16.080 -21.260 1.00 43.36 C ATOM 1821 O GLU A 255 15.836 15.792 -20.193 1.00 43.76 O ATOM 1822 CB GLU A 255 16.993 17.799 -21.927 1.00 48.95 C ATOM 1823 CG GLU A 255 16.198 18.966 -21.331 1.00 47.61 C ATOM 1824 CD GLU A 255 15.191 19.565 -22.305 1.00 46.47 C ATOM 1825 OE1 GLU A 255 15.605 20.082 -23.366 1.00 50.88 O ATOM 1826 OE2 GLU A 255 13.992 19.496 -22.017 1.00 42.30 O ATOM 1827 H GLU A 255 14.748 17.929 -23.437 1.00 0.00 H ATOM 1828 N ALA A 256 13.991 15.945 -21.462 1.00 39.83 N ATOM 1829 CA ALA A 256 13.116 15.462 -20.391 1.00 36.60 C ATOM 1830 C ALA A 256 13.540 14.056 -19.972 1.00 37.52 C ATOM 1831 O ALA A 256 13.823 13.222 -20.811 1.00 37.62 O ATOM 1832 CB ALA A 256 11.660 15.472 -20.819 1.00 35.98 C ATOM 1833 H ALA A 256 13.586 16.185 -22.389 1.00 0.00 H ATOM 1834 N GLN A 257 13.578 13.807 -18.669 1.00 39.19 N ATOM 1835 CA GLN A 257 14.018 12.518 -18.139 1.00 43.84 C ATOM 1836 C GLN A 257 12.833 11.650 -17.701 1.00 42.73 C ATOM 1837 O GLN A 257 12.868 10.429 -17.850 1.00 43.37 O ATOM 1838 CB GLN A 257 14.965 12.742 -16.961 1.00 46.86 C ATOM 1839 CG GLN A 257 16.173 13.609 -17.293 1.00 50.69 C ATOM 1840 CD GLN A 257 17.323 12.817 -17.843 1.00 55.68 C ATOM 1841 OE1 GLN A 257 18.272 12.503 -17.125 1.00 57.48 O ATOM 1842 NE2 GLN A 257 17.264 12.501 -19.134 1.00 57.94 N ATOM 1843 HE22 GLN A 257 16.442 12.788 -19.702 1.00 0.00 H ATOM 1844 HE21 GLN A 257 18.040 11.967 -19.575 1.00 0.00 H ATOM 1845 H GLN A 257 13.286 14.552 -18.005 1.00 0.00 H ATOM 1846 N PHE A 258 11.798 12.285 -17.157 1.00 38.08 N ATOM 1847 CA PHE A 258 10.605 11.576 -16.660 1.00 37.64 C ATOM 1848 C PHE A 258 9.383 12.134 -17.373 1.00 36.09 C ATOM 1849 O PHE A 258 9.205 13.354 -17.403 1.00 36.01 O ATOM 1850 CB PHE A 258 10.405 11.742 -15.160 1.00 38.49 C ATOM 1851 CG PHE A 258 11.631 11.529 -14.340 1.00 44.39 C ATOM 1852 CD1 PHE A 258 12.528 12.572 -14.118 1.00 47.29 C ATOM 1853 CD2 PHE A 258 11.874 10.308 -13.745 1.00 47.14 C ATOM 1854 CE1 PHE A 258 13.660 12.387 -13.332 1.00 50.68 C ATOM 1855 CE2 PHE A 258 13.008 10.117 -12.968 1.00 51.23 C ATOM 1856 CZ PHE A 258 13.903 11.158 -12.767 1.00 52.51 C ATOM 1857 H PHE A 258 11.832 13.322 -17.079 1.00 0.00 H ATOM 1858 N VAL A 259 8.585 11.256 -17.983 1.00 32.43 N ATOM 1859 CA VAL A 259 7.391 11.681 -18.686 1.00 30.67 C ATOM 1860 C VAL A 259 6.196 11.019 -18.032 1.00 28.01 C ATOM 1861 O VAL A 259 6.123 9.788 -17.965 1.00 28.17 O ATOM 1862 CB VAL A 259 7.429 11.329 -20.201 1.00 28.60 C ATOM 1863 CG1 VAL A 259 6.178 11.797 -20.891 1.00 28.61 C ATOM 1864 CG2 VAL A 259 8.671 11.908 -20.877 1.00 30.38 C ATOM 1865 H VAL A 259 8.825 10.244 -17.953 1.00 0.00 H ATOM 1866 N ILE A 260 5.258 11.848 -17.593 1.00 25.33 N ATOM 1867 CA ILE A 260 4.053 11.398 -16.914 1.00 25.53 C ATOM 1868 C ILE A 260 2.872 11.475 -17.877 1.00 24.45 C ATOM 1869 O ILE A 260 2.550 12.558 -18.351 1.00 24.16 O ATOM 1870 CB ILE A 260 3.739 12.267 -15.677 1.00 26.76 C ATOM 1871 CG1 ILE A 260 4.990 12.510 -14.807 1.00 32.80 C ATOM 1872 CG2 ILE A 260 2.567 11.695 -14.870 1.00 22.52 C ATOM 1873 CD1 ILE A 260 5.758 11.309 -14.445 1.00 39.66 C ATOM 1874 H ILE A 260 5.391 12.869 -17.741 1.00 0.00 H ATOM 1875 N PRO A 261 2.238 10.331 -18.185 1.00 25.41 N ATOM 1876 CA PRO A 261 1.007 10.358 -18.976 1.00 25.32 C ATOM 1877 C PRO A 261 -0.158 10.692 -18.076 1.00 25.02 C ATOM 1878 O PRO A 261 -0.015 10.668 -16.839 1.00 24.26 O ATOM 1879 CB PRO A 261 0.908 8.946 -19.524 1.00 27.36 C ATOM 1880 CG PRO A 261 1.468 8.122 -18.365 1.00 28.63 C ATOM 1881 CD PRO A 261 2.583 8.961 -17.779 1.00 27.01 C ATOM 1882 N GLY A 262 -1.289 11.033 -18.684 1.00 25.95 N ATOM 1883 CA GLY A 262 -2.487 11.377 -17.943 1.00 24.89 C ATOM 1884 C GLY A 262 -3.040 10.213 -17.150 1.00 22.93 C ATOM 1885 O GLY A 262 -3.704 10.427 -16.146 1.00 21.31 O ATOM 1886 H GLY A 262 -1.316 11.054 -19.723 1.00 0.00 H ATOM 1887 N HIS A 263 -2.806 9.002 -17.632 1.00 22.52 N ATOM 1888 CA HIS A 263 -3.264 7.774 -16.966 1.00 24.75 C ATOM 1889 C HIS A 263 -2.169 6.725 -17.065 1.00 26.96 C ATOM 1890 O HIS A 263 -1.605 6.510 -18.120 1.00 28.40 O ATOM 1891 CB HIS A 263 -4.555 7.246 -17.589 1.00 27.61 C ATOM 1892 CG HIS A 263 -5.587 8.308 -17.762 1.00 29.06 C ATOM 1893 ND1 HIS A 263 -6.562 8.562 -16.821 1.00 27.45 N ATOM 1894 CD2 HIS A 263 -5.737 9.253 -18.727 1.00 31.67 C ATOM 1895 CE1 HIS A 263 -7.296 9.587 -17.218 1.00 30.76 C ATOM 1896 NE2 HIS A 263 -6.814 10.029 -18.368 1.00 32.51 N ATOM 1897 H HIS A 263 -2.274 8.916 -18.522 1.00 0.00 H ATOM 1898 N GLY A 264 -1.862 6.093 -15.947 1.00 26.04 N ATOM 1899 CA GLY A 264 -0.922 4.987 -15.937 1.00 26.84 C ATOM 1900 C GLY A 264 0.517 5.349 -15.624 1.00 27.92 C ATOM 1901 O GLY A 264 0.814 6.428 -15.124 1.00 27.34 O ATOM 1902 H GLY A 264 -2.303 6.394 -15.055 1.00 0.00 H ATOM 1903 N LEU A 265 1.408 4.414 -15.932 1.00 31.55 N ATOM 1904 CA LEU A 265 2.798 4.459 -15.491 1.00 32.88 C ATOM 1905 C LEU A 265 3.650 5.522 -16.161 1.00 33.41 C ATOM 1906 O LEU A 265 3.671 5.618 -17.372 1.00 32.95 O ATOM 1907 CB LEU A 265 3.470 3.124 -15.753 1.00 33.60 C ATOM 1908 CG LEU A 265 3.463 1.990 -14.729 1.00 37.31 C ATOM 1909 CD1 LEU A 265 2.253 1.969 -13.902 1.00 37.50 C ATOM 1910 CD2 LEU A 265 3.581 0.691 -15.516 1.00 41.02 C ATOM 1911 H LEU A 265 1.100 3.610 -16.516 1.00 0.00 H ATOM 1912 N PRO A 277 4.417 6.267 -15.370 1.00 35.67 N ATOM 1913 CA PRO A 277 5.406 7.142 -15.993 1.00 35.64 C ATOM 1914 C PRO A 277 6.473 6.363 -16.725 1.00 34.96 C ATOM 1915 O PRO A 277 6.679 5.168 -16.473 1.00 33.20 O ATOM 1916 CB PRO A 277 5.997 7.916 -14.813 1.00 39.19 C ATOM 1917 CG PRO A 277 5.570 7.207 -13.576 1.00 40.22 C ATOM 1918 CD PRO A 277 4.328 6.454 -13.904 1.00 38.35 C ATOM 1919 N GLY A 278 7.124 7.031 -17.664 1.00 33.30 N ATOM 1920 CA GLY A 278 8.219 6.430 -18.392 1.00 34.23 C ATOM 1921 C GLY A 278 9.150 7.512 -18.885 1.00 33.49 C ATOM 1922 O GLY A 278 9.333 8.514 -18.195 1.00 31.61 O ATOM 1923 H GLY A 278 6.842 8.008 -17.883 1.00 0.00 H ATOM 1924 N GLY A 279 9.715 7.304 -20.074 1.00 36.25 N ATOM 1925 CA GLY A 279 10.624 8.257 -20.699 1.00 38.71 C ATOM 1926 C GLY A 279 10.072 8.878 -21.982 1.00 37.24 C ATOM 1927 O GLY A 279 8.873 8.838 -22.252 1.00 33.12 O ATOM 1928 H GLY A 279 9.497 6.421 -20.579 1.00 0.00 H ATOM 1929 N LEU A 280 10.953 9.445 -22.790 1.00 40.51 N ATOM 1930 CA LEU A 280 10.523 10.114 -24.006 1.00 42.52 C ATOM 1931 C LEU A 280 9.937 9.133 -25.016 1.00 42.45 C ATOM 1932 O LEU A 280 9.227 9.547 -25.952 1.00 40.36 O ATOM 1933 CB LEU A 280 11.682 10.887 -24.626 1.00 47.69 C ATOM 1934 CG LEU A 280 11.829 12.315 -24.091 1.00 48.12 C ATOM 1935 CD1 LEU A 280 13.126 12.933 -24.598 1.00 50.92 C ATOM 1936 CD2 LEU A 280 10.626 13.176 -24.466 1.00 46.54 C ATOM 1937 H LEU A 280 11.965 9.411 -22.552 1.00 0.00 H ATOM 1938 N ASP A 281 10.216 7.842 -24.809 1.00 41.76 N ATOM 1939 CA ASP A 281 9.619 6.769 -25.607 1.00 43.26 C ATOM 1940 C ASP A 281 8.071 6.774 -25.586 1.00 40.42 C ATOM 1941 O ASP A 281 7.433 6.218 -26.490 1.00 39.81 O ATOM 1942 CB ASP A 281 10.136 5.422 -25.109 1.00 50.64 C ATOM 1943 CG ASP A 281 10.113 5.321 -23.585 1.00 54.72 C ATOM 1944 OD1 ASP A 281 9.171 4.708 -23.040 1.00 55.37 O ATOM 1945 OD2 ASP A 281 11.031 5.878 -22.932 1.00 56.73 O ATOM 1946 H ASP A 281 10.883 7.590 -24.052 1.00 0.00 H ATOM 1947 N LEU A 282 7.470 7.396 -24.561 1.00 36.25 N ATOM 1948 CA LEU A 282 6.010 7.535 -24.511 1.00 34.85 C ATOM 1949 C LEU A 282 5.450 8.383 -25.669 1.00 34.30 C ATOM 1950 O LEU A 282 4.324 8.148 -26.111 1.00 34.18 O ATOM 1951 CB LEU A 282 5.556 8.168 -23.191 1.00 33.46 C ATOM 1952 CG LEU A 282 5.813 7.372 -21.894 1.00 33.53 C ATOM 1953 CD1 LEU A 282 4.859 7.788 -20.770 1.00 32.28 C ATOM 1954 CD2 LEU A 282 5.749 5.887 -22.106 1.00 36.67 C ATOM 1955 H LEU A 282 8.048 7.786 -23.789 1.00 0.00 H ATOM 1956 N LEU A 283 6.210 9.384 -26.102 1.00 34.19 N ATOM 1957 CA LEU A 283 5.801 10.275 -27.196 1.00 34.52 C ATOM 1958 C LEU A 283 5.667 9.518 -28.532 1.00 36.44 C ATOM 1959 O LEU A 283 4.647 9.589 -29.215 1.00 36.24 O ATOM 1960 CB LEU A 283 6.803 11.430 -27.377 1.00 37.47 C ATOM 1961 CG LEU A 283 7.107 12.373 -26.197 1.00 40.31 C ATOM 1962 CD1 LEU A 283 7.662 13.728 -26.683 1.00 40.98 C ATOM 1963 CD2 LEU A 283 5.908 12.569 -25.318 1.00 40.89 C ATOM 1964 H LEU A 283 7.132 9.543 -25.648 1.00 0.00 H ATOM 1965 N LYS A 284 6.723 8.814 -28.908 1.00 38.59 N ATOM 1966 CA LYS A 284 6.694 7.978 -30.108 1.00 41.17 C ATOM 1967 C LYS A 284 5.596 6.923 -29.995 1.00 40.96 C ATOM 1968 O LYS A 284 4.841 6.694 -30.940 1.00 41.69 O ATOM 1969 CB LYS A 284 8.061 7.316 -30.317 1.00 44.11 C ATOM 1970 CG LYS A 284 8.126 6.272 -31.419 1.00 47.60 C ATOM 1971 CD LYS A 284 8.226 6.877 -32.798 1.00 49.49 C ATOM 1972 CE LYS A 284 8.806 5.857 -33.772 1.00 53.67 C ATOM 1973 NZ LYS A 284 8.912 6.366 -35.164 1.00 56.30 N ATOM 1974 HZ1 LYS A 284 7.966 6.627 -35.509 1.00 0.00 H ATOM 1975 HZ2 LYS A 284 9.531 7.202 -35.180 1.00 0.00 H ATOM 1976 HZ3 LYS A 284 9.313 5.625 -35.773 1.00 0.00 H ATOM 1977 H LYS A 284 7.592 8.856 -28.338 1.00 0.00 H ATOM 1978 N HIS A 285 5.511 6.277 -28.836 1.00 40.26 N ATOM 1979 CA HIS A 285 4.485 5.271 -28.624 1.00 41.21 C ATOM 1980 C HIS A 285 3.086 5.856 -28.827 1.00 38.60 C ATOM 1981 O HIS A 285 2.227 5.240 -29.437 1.00 39.38 O ATOM 1982 CB HIS A 285 4.582 4.679 -27.221 1.00 40.20 C ATOM 1983 CG HIS A 285 3.348 3.945 -26.805 1.00 40.17 C ATOM 1984 ND1 HIS A 285 2.997 2.720 -27.335 1.00 42.55 N ATOM 1985 CD2 HIS A 285 2.369 4.272 -25.927 1.00 38.48 C ATOM 1986 CE1 HIS A 285 1.858 2.322 -26.796 1.00 42.24 C ATOM 1987 NE2 HIS A 285 1.453 3.248 -25.941 1.00 39.86 N ATOM 1988 H HIS A 285 6.185 6.494 -28.074 1.00 0.00 H ATOM 1989 N THR A 286 2.861 7.049 -28.289 1.00 36.39 N ATOM 1990 CA THR A 286 1.551 7.680 -28.398 1.00 35.00 C ATOM 1991 C THR A 286 1.226 7.947 -29.886 1.00 35.94 C ATOM 1992 O THR A 286 0.151 7.586 -30.364 1.00 36.16 O ATOM 1993 CB THR A 286 1.492 8.991 -27.569 1.00 33.07 C ATOM 1994 OG1 THR A 286 1.702 8.689 -26.175 1.00 32.45 O ATOM 1995 CG2 THR A 286 0.132 9.669 -27.725 1.00 32.27 C ATOM 1996 HG1 THR A 286 2.589 8.265 -26.060 1.00 0.00 H ATOM 1997 H THR A 286 3.627 7.539 -27.784 1.00 0.00 H ATOM 1998 N THR A 287 2.166 8.539 -30.615 1.00 36.84 N ATOM 1999 CA THR A 287 1.987 8.733 -32.056 1.00 38.40 C ATOM 2000 C THR A 287 1.647 7.413 -32.781 1.00 40.29 C ATOM 2001 O THR A 287 0.765 7.386 -33.655 1.00 40.70 O ATOM 2002 CB THR A 287 3.237 9.366 -32.685 1.00 40.06 C ATOM 2003 OG1 THR A 287 3.313 10.729 -32.274 1.00 39.57 O ATOM 2004 CG2 THR A 287 3.167 9.351 -34.225 1.00 42.52 C ATOM 2005 HG1 THR A 287 4.116 11.149 -32.673 1.00 0.00 H ATOM 2006 H THR A 287 3.040 8.869 -30.157 1.00 0.00 H ATOM 2007 N ASN A 288 2.334 6.330 -32.425 1.00 41.51 N ATOM 2008 CA ASN A 288 2.061 5.042 -33.056 1.00 43.89 C ATOM 2009 C ASN A 288 0.616 4.615 -32.814 1.00 42.68 C ATOM 2010 O ASN A 288 -0.060 4.180 -33.734 1.00 43.71 O ATOM 2011 CB ASN A 288 3.008 3.942 -32.541 1.00 45.66 C ATOM 2012 CG ASN A 288 4.449 4.123 -33.010 1.00 48.46 C ATOM 2013 OD1 ASN A 288 4.730 4.877 -33.938 1.00 48.63 O ATOM 2014 ND2 ASN A 288 5.373 3.425 -32.347 1.00 49.33 N ATOM 2015 HD22 ASN A 288 5.090 2.798 -31.567 1.00 0.00 H ATOM 2016 HD21 ASN A 288 6.376 3.508 -32.610 1.00 0.00 H ATOM 2017 H ASN A 288 3.069 6.402 -31.693 1.00 0.00 H ATOM 2018 N VAL A 289 0.144 4.731 -31.570 1.00 40.64 N ATOM 2019 CA VAL A 289 -1.216 4.311 -31.249 1.00 40.06 C ATOM 2020 C VAL A 289 -2.235 5.172 -32.001 1.00 39.22 C ATOM 2021 O VAL A 289 -3.201 4.662 -32.563 1.00 39.76 O ATOM 2022 CB VAL A 289 -1.486 4.378 -29.721 1.00 38.68 C ATOM 2023 CG1 VAL A 289 -2.920 3.996 -29.409 1.00 38.62 C ATOM 2024 CG2 VAL A 289 -0.524 3.458 -28.984 1.00 40.06 C ATOM 2025 H VAL A 289 0.751 5.124 -30.823 1.00 0.00 H ATOM 2026 N VAL A 290 -2.003 6.479 -32.013 1.00 37.77 N ATOM 2027 CA VAL A 290 -2.867 7.414 -32.719 1.00 37.30 C ATOM 2028 C VAL A 290 -2.913 7.147 -34.239 1.00 40.09 C ATOM 2029 O VAL A 290 -3.996 6.993 -34.824 1.00 40.08 O ATOM 2030 CB VAL A 290 -2.394 8.846 -32.419 1.00 36.72 C ATOM 2031 CG1 VAL A 290 -3.103 9.867 -33.281 1.00 38.07 C ATOM 2032 CG2 VAL A 290 -2.609 9.119 -30.924 1.00 35.09 C ATOM 2033 H VAL A 290 -1.176 6.847 -31.501 1.00 0.00 H ATOM 2034 N LYS A 291 -1.749 7.065 -34.870 1.00 41.67 N ATOM 2035 CA LYS A 291 -1.680 6.726 -36.290 1.00 45.22 C ATOM 2036 C LYS A 291 -2.370 5.389 -36.603 1.00 49.82 C ATOM 2037 O LYS A 291 -2.983 5.241 -37.659 1.00 50.88 O ATOM 2038 CB LYS A 291 -0.219 6.686 -36.750 1.00 46.52 C ATOM 2039 CG LYS A 291 0.533 8.019 -36.582 1.00 46.19 C ATOM 2040 CD LYS A 291 0.633 8.814 -37.868 1.00 48.96 C ATOM 2041 CE LYS A 291 1.972 8.612 -38.566 1.00 53.97 C ATOM 2042 NZ LYS A 291 3.052 9.441 -37.963 1.00 55.72 N ATOM 2043 HZ1 LYS A 291 2.797 10.447 -38.037 1.00 0.00 H ATOM 2044 HZ2 LYS A 291 3.167 9.184 -36.962 1.00 0.00 H ATOM 2045 HZ3 LYS A 291 3.943 9.270 -38.471 1.00 0.00 H ATOM 2046 H LYS A 291 -0.870 7.245 -34.345 1.00 0.00 H ATOM 2047 N ALA A 292 -2.269 4.415 -35.703 1.00 52.82 N ATOM 2048 CA ALA A 292 -2.924 3.120 -35.908 1.00 57.53 C ATOM 2049 C ALA A 292 -4.446 3.246 -35.847 1.00 60.21 C ATOM 2050 O ALA A 292 -5.159 2.532 -36.551 1.00 58.84 O ATOM 2051 CB ALA A 292 -2.437 2.101 -34.884 1.00 57.95 C ATOM 2052 H ALA A 292 -1.715 4.575 -34.838 1.00 0.00 H ATOM 2053 N HIS A 293 -4.934 4.165 -35.018 1.00 65.22 N ATOM 2054 CA HIS A 293 -6.370 4.393 -34.862 1.00 71.63 C ATOM 2055 C HIS A 293 -6.909 5.430 -35.854 1.00 73.92 C ATOM 2056 O HIS A 293 -8.003 5.974 -35.670 1.00 74.31 O ATOM 2057 CB HIS A 293 -6.680 4.836 -33.430 1.00 73.14 C ATOM 2058 CG HIS A 293 -6.517 3.746 -32.416 1.00 77.24 C ATOM 2059 ND1 HIS A 293 -5.465 2.853 -32.444 1.00 79.52 N ATOM 2060 CD2 HIS A 293 -7.277 3.396 -31.352 1.00 78.48 C ATOM 2061 CE1 HIS A 293 -5.583 2.005 -31.439 1.00 80.73 C ATOM 2062 NE2 HIS A 293 -6.674 2.311 -30.761 1.00 80.00 N ATOM 2063 H HIS A 293 -4.271 4.741 -34.461 1.00 0.00 H ATOM 2064 N THR A 294 -6.131 5.711 -36.892 1.00 74.70 N ATOM 2065 CA THR A 294 -6.592 6.558 -37.980 1.00 75.40 C ATOM 2066 C THR A 294 -6.632 5.735 -39.264 1.00 79.43 C ATOM 2067 O THR A 294 -7.318 6.100 -40.214 1.00 79.61 O ATOM 2068 CB THR A 294 -5.690 7.798 -38.155 1.00 74.12 C ATOM 2069 OG1 THR A 294 -5.631 8.523 -36.923 1.00 71.06 O ATOM 2070 CG2 THR A 294 -6.229 8.722 -39.243 1.00 75.43 C ATOM 2071 HG1 THR A 294 -5.257 7.940 -36.216 1.00 0.00 H ATOM 2072 H THR A 294 -5.170 5.316 -36.928 1.00 0.00 H ATOM 2073 N ASN A 295 -5.916 4.610 -39.268 1.00 83.99 N ATOM 2074 CA ASN A 295 -5.870 3.709 -40.418 1.00 89.08 C ATOM 2075 C ASN A 295 -7.039 2.731 -40.443 1.00 90.23 C ATOM 2076 O ASN A 295 -7.544 2.380 -41.513 1.00 91.74 O ATOM 2077 CB ASN A 295 -4.556 2.924 -40.422 1.00 91.71 C ATOM 2078 CG ASN A 295 -3.352 3.806 -40.673 1.00 92.51 C ATOM 2079 OD1 ASN A 295 -3.428 4.784 -41.417 1.00 92.64 O ATOM 2080 ND2 ASN A 295 -2.228 3.464 -40.051 1.00 93.24 N ATOM 2081 HD22 ASN A 295 -2.210 2.629 -39.431 1.00 0.00 H ATOM 2082 HD21 ASN A 295 -1.367 4.031 -40.184 1.00 0.00 H ATOM 2083 H ASN A 295 -5.368 4.364 -38.419 1.00 0.00 H TER 2084 ASN A 295 HETATM 2085 ZN ZN A 1 -9.962 14.527 -21.831 1.00 30.28 ZN HETATM 2086 ZN ZN A 2 -7.646 11.889 -19.002 1.00 25.13 ZN HETATM 2087 O HOH 3 7.244 -2.045 -7.528 1.00 66.70 O HETATM 2088 O HOH 4 -19.057 17.083 -16.248 1.00 46.32 O HETATM 2089 O HOH 5 9.151 4.195 -20.972 1.00 43.00 O HETATM 2090 O HOH 6 -15.119 12.962 -23.219 1.00 53.36 O HETATM 2091 O HOH 7 -11.501 12.249 -25.434 1.00 71.08 O HETATM 2092 O HOH 8 7.139 32.063 -1.388 1.00 43.64 O HETATM 2093 O HOH 9 0.802 0.212 -4.498 1.00 93.89 O HETATM 2094 O HOH 10 -15.665 20.483 -7.067 1.00 25.91 O HETATM 2095 O HOH 11 8.813 28.843 -7.110 1.00 63.05 O HETATM 2096 O HOH 12 -19.678 22.071 -7.446 1.00 42.65 O HETATM 2097 O HOH 13 -3.297 10.607 -37.036 1.00 44.06 O HETATM 2098 O HOH 14 -12.367 29.000 1.912 1.00 36.75 O HETATM 2099 O HOH 15 -1.654 21.121 2.894 1.00 28.67 O HETATM 2100 O HOH 16 11.396 5.407 -4.133 1.00 74.62 O HETATM 2101 O HOH 17 -15.076 2.304 -19.864 1.00 45.42 O HETATM 2102 O HOH 18 -4.633 7.769 3.207 1.00 62.21 O HETATM 2103 O HOH 19 6.211 31.354 -7.474 1.00 43.29 O HETATM 2104 O HOH 20 -1.056 23.408 5.384 1.00 63.94 O HETATM 2105 O HOH 21 -8.461 21.041 -34.082 1.00 59.59 O HETATM 2106 O HOH 22 7.146 12.207 -35.589 1.00 67.43 O HETATM 2107 O HOH 23 -0.660 33.768 -27.160 1.00 59.74 O HETATM 2108 O HOH 24 6.980 18.531 4.407 1.00 28.04 O HETATM 2109 O HOH 25 -5.519 25.769 -24.042 1.00 27.84 O HETATM 2110 O HOH 26 9.745 9.542 -28.503 1.00 40.95 O HETATM 2111 O HOH 27 -3.891 2.892 -19.673 1.00 35.20 O HETATM 2112 O HOH 28 -9.732 7.467 -6.182 1.00 20.04 O HETATM 2113 O HOH 29 -7.672 9.791 -25.632 1.00 25.07 O HETATM 2114 O HOH 30 -12.850 10.018 -0.157 1.00 37.37 O HETATM 2115 O HOH 31 -5.042 15.430 6.310 1.00 40.44 O HETATM 2116 O HOH 32 4.909 32.635 -0.482 1.00 56.02 O HETATM 2117 O HOH 33 -2.200 8.246 3.698 1.00 92.61 O HETATM 2118 O HOH 34 3.568 -0.271 -10.730 1.00 37.11 O HETATM 2119 O HOH 35 -6.807 13.148 -12.264 1.00 28.35 O HETATM 2120 O HOH 36 -16.912 19.506 -13.347 1.00 33.39 O HETATM 2121 O HOH 37 -2.867 9.165 -20.899 1.00 28.82 O HETATM 2122 O HOH 38 -19.602 0.890 -22.758 1.00 44.20 O HETATM 2123 O HOH 39 -2.372 6.526 -20.692 1.00 30.85 O HETATM 2124 O HOH 40 -0.860 20.038 -34.392 1.00 40.16 O HETATM 2125 O HOH 41 -5.876 25.079 -19.668 1.00 21.84 O HETATM 2126 O HOH 42 4.397 3.890 -19.304 1.00 27.65 O HETATM 2127 O HOH 43 2.507 6.079 -3.462 1.00 45.29 O HETATM 2128 O HOH 44 -3.920 20.463 1.563 1.00 25.73 O HETATM 2129 O HOH 45 -20.270 25.115 -16.353 1.00 42.10 O HETATM 2130 O HOH 46 -4.512 30.763 -2.945 1.00 35.41 O HETATM 2131 O HOH 47 -8.028 31.167 -26.958 1.00 69.53 O HETATM 2132 O HOH 48 -19.983 0.159 -20.418 1.00 47.40 O HETATM 2133 O HOH 49 -4.383 16.974 -20.141 1.00 24.48 O HETATM 2134 O HOH 50 -10.091 17.980 1.970 1.00 24.27 O HETATM 2135 O HOH 51 -2.964 7.426 0.220 1.00 40.67 O HETATM 2136 O HOH 52 -16.981 15.352 -21.857 1.00 51.66 O HETATM 2137 O HOH 53 4.884 12.450 -33.754 1.00 42.35 O HETATM 2138 O HOH 54 3.515 33.252 -24.881 1.00 53.42 O HETATM 2139 O HOH 55 9.374 7.548 -5.019 1.00 44.74 O HETATM 2140 O HOH 56 2.107 -1.131 -7.112 1.00 80.52 O HETATM 2141 O HOH 57 -11.346 14.073 -26.484 1.00 36.67 O HETATM 2142 O HOH 58 3.948 27.128 4.009 1.00 35.40 O HETATM 2143 O HOH 59 -18.794 16.392 -18.314 1.00 47.53 O HETATM 2144 O HOH 60 -3.709 31.894 -23.526 1.00 41.48 O HETATM 2145 O HOH 61 11.627 24.074 -11.841 1.00 33.93 O HETATM 2146 O HOH 62 -2.595 -0.830 -20.213 1.00 56.83 O HETATM 2147 O HOH 63 -1.455 4.030 -12.229 1.00 27.42 O HETATM 2148 O HOH 64 -2.459 17.366 -22.135 1.00 28.22 O HETATM 2149 O HOH 65 -8.701 33.248 -6.702 1.00 40.48 O HETATM 2150 O HOH 66 4.903 25.196 -34.356 1.00 44.52 O HETATM 2151 O HOH 67 -13.087 12.778 0.035 1.00 26.87 O HETATM 2152 O HOH 68 -2.268 6.495 -13.182 1.00 23.24 O HETATM 2153 O HOH 69 -14.694 9.720 -6.282 1.00 28.29 O HETATM 2154 O HOH 70 -2.401 0.925 -38.798 1.00 76.32 O HETATM 2155 O HOH 71 -7.667 24.780 -12.307 1.00 23.98 O HETATM 2156 O HOH 72 -6.794 8.958 0.159 1.00 26.02 O HETATM 2157 O HOH 73 -4.767 34.620 -24.478 1.00 43.64 O HETATM 2158 O HOH 74 -8.536 35.866 -15.575 1.00 49.48 O HETATM 2159 O HOH 75 -0.455 22.080 -36.948 1.00 33.51 O HETATM 2160 O HOH 76 1.395 28.021 -6.302 1.00 28.06 O HETATM 2161 O HOH 77 -17.132 9.879 -15.390 1.00 65.88 O HETATM 2162 O HOH 78 13.744 22.424 -31.571 1.00 62.52 O HETATM 2163 O HOH 79 -17.761 7.495 -8.196 1.00 41.45 O HETATM 2164 O HOH 80 13.853 18.758 -8.305 1.00 44.08 O HETATM 2165 O HOH 81 -10.072 29.672 -7.541 1.00 29.08 O HETATM 2166 O HOH 82 -5.323 12.152 -10.053 1.00 22.49 O HETATM 2167 O HOH 83 -8.086 24.980 3.233 1.00 45.00 O HETATM 2168 O HOH 84 5.911 31.003 -3.333 1.00 36.30 O HETATM 2169 O HOH 85 -7.290 11.584 1.928 1.00 68.56 O HETATM 2170 O HOH 86 -17.470 15.612 -8.790 1.00 33.23 O HETATM 2171 O HOH 87 3.791 29.768 -31.073 1.00 51.14 O HETATM 2172 O HOH 88 1.005 21.136 8.214 1.00 60.14 O HETATM 2173 O HOH 89 2.836 1.471 -19.286 1.00 34.50 O HETATM 2174 O HOH 90 0.660 2.960 -36.266 1.00 62.34 O HETATM 2175 O HOH 91 -3.351 22.123 -33.681 1.00 55.91 O HETATM 2176 O HOH 92 -3.884 23.026 0.462 1.00 28.40 O HETATM 2177 O HOH 93 6.628 33.530 -19.447 1.00 37.06 O HETATM 2178 O HOH 94 -9.945 0.413 -7.939 1.00 39.05 O HETATM 2179 O HOH 95 13.532 7.204 -22.223 1.00 74.34 O HETATM 2180 O HOH 96 -17.277 26.134 -11.541 1.00 40.49 O HETATM 2181 O HOH 97 -16.754 6.784 -3.569 1.00 54.59 O HETATM 2182 O HOH 98 -11.469 19.574 -27.955 1.00 28.42 O HETATM 2183 O HOH 99 -14.430 12.223 -7.058 1.00 24.20 O HETATM 2184 O HOH 100 -0.422 33.735 -10.659 1.00 40.69 O HETATM 2185 O HOH 101 10.418 25.819 -5.105 1.00 35.70 O HETATM 2186 O HOH 102 6.858 7.914 -3.258 1.00 33.18 O HETATM 2187 O HOH 103 -19.469 4.745 -15.011 1.00 48.22 O HETATM 2188 O HOH 104 -20.972 17.727 -17.821 1.00 49.88 O HETATM 2189 O HOH 105 -16.388 12.139 -14.930 1.00 36.32 O HETATM 2190 O HOH 106 -13.415 1.340 -5.594 1.00 34.73 O HETATM 2191 O HOH 107 0.472 15.180 9.258 1.00 57.95 O HETATM 2192 O HOH 108 4.545 1.742 -29.728 1.00 53.78 O HETATM 2193 O HOH 109 9.106 3.523 -10.591 1.00 54.43 O HETATM 2194 O HOH 110 3.860 31.618 -5.372 1.00 55.02 O HETATM 2195 O HOH 111 15.669 15.021 -6.958 1.00 51.53 O HETATM 2196 O HOH 112 -20.223 24.461 -10.804 1.00 61.77 O HETATM 2197 O HOH 113 -12.663 28.025 -27.275 1.00 49.86 O HETATM 2198 O HOH 114 -17.310 13.449 -6.474 1.00 27.44 O HETATM 2199 O HOH 115 -2.476 27.554 -33.296 1.00 43.69 O HETATM 2200 O HOH 116 -5.443 9.943 -22.270 1.00 37.96 O HETATM 2201 O HOH 117 -3.875 -3.070 -11.444 1.00 26.91 O HETATM 2202 O HOH 118 -0.080 1.798 -38.572 1.00 64.31 O HETATM 2203 O HOH 119 -2.976 33.533 -6.834 1.00 50.81 O HETATM 2204 O HOH 120 13.784 9.836 -21.544 1.00 61.85 O HETATM 2205 O HOH 121 12.525 21.187 -4.063 1.00 23.99 O HETATM 2206 O HOH 122 0.142 7.913 -0.600 1.00 23.47 O HETATM 2207 O HOH 123 5.848 33.107 -12.605 1.00 44.72 O HETATM 2208 O HOH 124 -9.581 9.099 1.199 1.00 55.14 O HETATM 2209 O HOH 125 5.995 12.667 0.328 1.00 52.71 O HETATM 2210 O HOH 126 4.891 32.915 -9.807 1.00 47.24 O HETATM 2211 O HOH 127 -7.146 26.163 -28.084 1.00 47.29 O HETATM 2212 O HOH 128 -7.452 37.383 -17.911 1.00 75.97 O HETATM 2213 O HOH 129 -5.327 -4.903 -5.022 1.00 77.07 O HETATM 2214 O HOH 130 -11.491 26.717 -28.459 1.00 53.19 O HETATM 2215 O HOH 131 -19.110 -2.823 -17.528 1.00 44.08 O HETATM 2216 O HOH 132 -14.998 31.124 -13.383 1.00 43.93 O HETATM 2217 O HOH 133 6.874 3.250 -19.057 1.00 42.41 O HETATM 2218 O HOH 134 -5.204 27.325 -26.000 1.00 42.95 O HETATM 2219 O HOH 135 7.148 0.258 -3.275 1.00 58.37 O HETATM 2220 O HOH 136 0.238 33.227 -17.690 1.00 59.20 O HETATM 2221 O HOH 137 -17.363 21.654 -25.004 1.00 49.85 O HETATM 2222 O HOH 138 -1.969 0.276 -31.716 1.00 61.83 O HETATM 2223 O HOH 139 -2.716 1.440 -13.546 1.00 22.28 O HETATM 2224 O HOH 140 14.806 26.339 -3.715 1.00 36.05 O HETATM 2225 O HOH 141 7.705 12.744 -32.036 1.00 50.07 O HETATM 2226 O HOH 142 7.353 15.724 2.716 1.00 59.11 O HETATM 2227 O HOH 143 -10.332 13.724 -35.690 1.00 42.34 O HETATM 2228 O HOH 144 4.970 11.754 -36.487 1.00 56.45 O HETATM 2229 O HOH 145 -19.894 7.803 -16.790 1.00 57.09 O HETATM 2230 O HOH 146 -13.252 6.116 -0.183 1.00 69.42 O HETATM 2231 O HOH 147 -6.298 29.780 -25.027 1.00 31.41 O HETATM 2232 O HOH 148 -1.301 34.442 -16.570 1.00 53.35 O HETATM 2233 O HOH 149 -4.670 24.820 1.031 1.00 48.21 O HETATM 2234 O HOH 150 -16.635 15.485 -11.535 1.00 48.11 O HETATM 2235 O HOH 151 10.272 28.175 -14.562 1.00 61.03 O HETATM 2236 O HOH 152 -4.235 36.377 -9.249 1.00 86.42 O HETATM 2237 O HOH 153 5.037 10.755 -1.007 1.00 52.72 O HETATM 2238 O HOH 154 -10.675 31.998 -6.740 1.00 43.13 O HETATM 2239 O HOH 155 10.403 28.993 -9.246 1.00 62.53 O HETATM 2240 O HOH 156 3.267 33.403 -12.471 1.00 81.88 O HETATM 2241 O HOH 157 -11.444 13.819 2.233 1.00 35.77 O HETATM 2242 O HOH 158 11.014 21.875 -7.348 1.00 40.52 O HETATM 2243 O HOH 159 7.660 4.531 -11.888 1.00 47.38 O HETATM 2244 O HOH 160 0.031 24.773 6.677 1.00 77.75 O HETATM 2245 O HOH 161 -20.161 20.739 -9.921 1.00 56.16 O HETATM 2246 O HOH 162 4.585 -2.024 -21.630 1.00 55.10 O HETATM 2247 O HOH 163 8.044 14.229 1.145 1.00 59.21 O HETATM 2248 O HOH 164 5.973 32.476 -5.014 1.00 69.78 O HETATM 2249 O HOH 165 -0.591 17.279 9.862 1.00 67.62 O HETATM 2250 O HOH 166 10.868 2.468 -8.741 1.00 59.95 O HETATM 2251 O HOH 167 16.590 24.266 -3.264 1.00 45.43 O HETATM 2252 O HOH 168 11.154 26.085 -7.846 1.00 89.29 O HETATM 2253 O HOH 169 4.443 -0.728 -19.156 1.00 42.47 O HETATM 2254 O HOH 170 -16.375 12.899 -11.664 1.00 53.47 O HETATM 2255 O HOH 171 -11.180 15.608 3.800 1.00 46.46 O HETATM 2256 O HOH 172 3.340 -2.777 -9.116 1.00 64.31 O HETATM 2257 O HOH 173 4.515 25.620 6.232 1.00 36.54 O HETATM 2258 O HOH 174 5.926 33.441 -2.731 1.00 50.14 O HETATM 2259 O HOH 175 15.804 16.439 -9.081 1.00 56.09 O HETATM 2260 O HOH 176 10.422 0.081 -8.275 1.00 72.26 O HETATM 2261 O HOH 177 -4.986 35.390 -6.613 1.00 59.05 O HETATM 2262 O HOH 178 -1.566 33.035 -4.823 1.00 61.33 O HETATM 2263 O HOH 179 0.925 19.081 10.664 1.00 65.05 O HETATM 2264 O HOH 180 -9.606 11.727 2.836 1.00 59.93 O HETATM 2265 O HOH 181 -17.083 8.588 -5.539 1.00 41.85 O HETATM 2266 O HOH 182 12.951 6.365 -2.973 1.00 77.67 O HETATM 2267 O HOH 183 15.492 9.819 -24.053 1.00 72.85 O HETATM 2268 CAA UNN A 184 -8.370 9.487 -22.138 1.00 0.02 C HETATM 2269 CAB UNN A 184 -8.611 10.627 -21.156 1.00 0.16 C HETATM 2270 OAC UNN A 184 -7.706 11.009 -20.448 1.00 -0.38 O HETATM 2271 SAD UNN A 184 -10.197 11.433 -21.175 1.00 -0.05 S HETATM 2272 CAE UNN A 184 -10.917 12.076 -19.724 1.00 0.03 C HETATM 2273 CAF UNN A 184 -12.005 11.063 -19.510 1.00 0.04 C HETATM 2274 PAP UNN A 184 -13.364 11.900 -18.641 1.00 0.06 P HETATM 2275 OAQ UNN A 184 -12.991 13.080 -17.860 1.00 -0.56 O HETATM 2276 OAR UNN A 184 -14.036 11.078 -17.638 1.00 -0.56 O HETATM 2277 OAS UNN A 184 -14.455 12.354 -19.555 1.00 -0.56 O HETATM 2278 CAG UNN A 184 -11.388 9.880 -18.780 1.00 -0.03 C HETATM 2279 CAH UNN A 184 -11.052 8.717 -19.705 1.00 -0.04 C HETATM 2280 CAI UNN A 184 -10.073 7.802 -19.010 1.00 -0.02 C HETATM 2281 CAJ UNN A 184 -9.725 6.608 -19.880 1.00 -0.04 C HETATM 2282 CAK UNN A 184 -8.413 6.160 -19.903 1.00 -0.06 C HETATM 2283 CAL UNN A 184 -8.053 5.078 -20.687 1.00 -0.07 C HETATM 2284 CAM UNN A 184 -9.008 4.444 -21.456 1.00 -0.07 C HETATM 2285 CAN UNN A 184 -10.316 4.888 -21.433 1.00 -0.07 C HETATM 2286 CAO UNN A 184 -10.680 5.972 -20.650 1.00 -0.06 C HETATM 2287 H17 UNN A 184 -11.707 6.319 -20.642 1.00 0.06 H HETATM 2288 H16 UNN A 184 -11.065 4.384 -22.033 1.00 0.06 H HETATM 2289 H15 UNN A 184 -8.732 3.599 -22.077 1.00 0.06 H HETATM 2290 H14 UNN A 184 -7.026 4.730 -20.697 1.00 0.06 H HETATM 2291 H13 UNN A 184 -7.663 6.662 -19.302 1.00 0.06 H HETATM 2292 H11 UNN A 184 -10.521 7.444 -18.072 1.00 0.04 H HETATM 2293 H12 UNN A 184 -9.154 8.363 -18.787 1.00 0.04 H HETATM 2294 H9 UNN A 184 -10.602 9.102 -20.632 1.00 0.03 H HETATM 2295 H10 UNN A 184 -11.970 8.160 -19.946 1.00 0.03 H HETATM 2296 H7 UNN A 184 -12.100 9.528 -18.019 1.00 0.03 H HETATM 2297 H8 UNN A 184 -10.463 10.215 -18.289 1.00 0.03 H HETATM 2298 H6 UNN A 184 -12.383 10.709 -20.480 1.00 0.05 H HETATM 2299 H4 UNN A 184 -11.323 13.086 -19.881 1.00 0.04 H HETATM 2300 H5 UNN A 184 -10.204 12.094 -18.887 1.00 0.04 H HETATM 2301 H1 UNN A 184 -7.351 9.096 -22.003 1.00 0.05 H HETATM 2302 H2 UNN A 184 -8.487 9.858 -23.167 1.00 0.05 H HETATM 2303 H3 UNN A 184 -9.098 8.684 -21.953 1.00 0.05 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 759 757 758 2085 CONECT 779 778 781 2085 CONECT 800 798 2086 CONECT 1339 1337 1338 2085 CONECT 1500 1499 2086 CONECT 1896 1894 1895 2086 CONECT 2085 759 779 1339 CONECT 2086 800 1500 1896 CONECT 2268 2269 2301 2302 2303 CONECT 2269 2268 2270 2271 CONECT 2270 2269 CONECT 2271 2269 2272 CONECT 2272 2271 2273 2299 2300 CONECT 2273 2272 2274 2278 2298 CONECT 2274 2273 2275 2276 2277 CONECT 2275 2274 CONECT 2276 2274 CONECT 2277 2274 CONECT 2278 2273 2279 2296 2297 CONECT 2279 2278 2280 2294 2295 CONECT 2280 2279 2281 2292 2293 CONECT 2281 2280 2282 2286 CONECT 2282 2281 2283 2291 CONECT 2283 2282 2284 2290 CONECT 2284 2283 2285 2289 CONECT 2285 2284 2286 2288 CONECT 2286 2281 2285 2287 CONECT 2287 2286 CONECT 2288 2285 CONECT 2289 2284 CONECT 2290 2283 CONECT 2291 2282 CONECT 2292 2280 CONECT 2293 2280 CONECT 2294 2279 CONECT 2295 2279 CONECT 2296 2278 CONECT 2297 2278 CONECT 2298 2273 CONECT 2299 2272 CONECT 2300 2272 CONECT 2301 2268 CONECT 2302 2268 CONECT 2303 2268 MASTER 0 0 0 0 0 0 0 0 2302 1 48 18 END
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Structure:
Ligand 2D
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Related entries of code: 5nhz
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Protein Sequence Similarity
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266aa, >5LCF_1|Chain... at 100%
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5le1
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PDBbind
266aa, >5LE1_1|Chain... at 100%
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RCSB PDB
PDBbind
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5lsc
RCSB PDB
PDBbind
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PDBbind
241aa, >5MM9_1|Chains... at 99%
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PDBbind
231aa, >5MXQ_1|Chain... at 100%
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PDBbind
232aa, >5MXR_1|Chain... at 100%
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RCSB PDB
PDBbind
232aa, >5N4S_1|Chains... at 99%
5n4t
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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5y6d
RCSB PDB
PDBbind
231aa, >5Y6D_1|Chains... at 100%
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
231aa, >6HF5_1|Chain... at 100%
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RCSB PDB
PDBbind
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6jn6
RCSB PDB
PDBbind
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6j8r
RCSB PDB
PDBbind
231aa, >6J8R_1|Chain... at 100%
6dd1
RCSB PDB
PDBbind
242aa, >6DD1_1|Chains... at 99%
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RCSB PDB
PDBbind
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5nhz
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Beta-lactamase class B VIM-2
Ligand Name
8XZ
EC.Number
E.C.-.-.-.-
Resolution
1.85(Å)
Affinity (Kd/Ki/IC50)
IC50=4.7uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Eur J Med Chem Vol. 135: pp. 159-173
Ligand Properties
Formula
C
1
3
H
2
0
O
4
PS
Molecular Weight
303.334
Exact Mass
303.082
No. of atoms
39
No. of bonds
39
Polar Surface Area
116.65
LOGP Value
1.40 (
Computed with XLOGP3
)
2.40 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 1
Canonical SMILES
CC(=O)SC[C@H](P(O)(O)O)CCCc1ccccc1
InChI String
InChI=1S/C13H21O4PS/c1-11(14)19-10-13(18(15,16)17)9-5-8-12-6-3-2-4-7-12/h2-4,6-7,13,15-18H,5,8-10H2,1H3/t13-/m1/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):
Q9K2N0
Entrez Gene ID
NCBI Entrez Gene ID:
61723701
ASD
Information of known allosteric effects of PDB entries
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