Browse entries in the PDBbind-CN Database
HEADER 4URM_COMPLEX COMPND 4URM_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 87 LEU GLU ALA ALA ARG LYS ARG PRO GLY MET TYR ILE GLY SEQRES 2 A 87 SER THR SER GLU ARG GLY LEU HIS HIS LEU VAL TRP GLU SEQRES 3 A 87 ILE VAL ASP ASN SER ILE ASP GLU ALA LEU ALA GLY TYR SEQRES 4 A 87 ALA ASN GLN ILE GLU VAL VAL ILE GLU LYS ASP ASN TRP SEQRES 5 A 87 ILE LYS VAL THR ASP ASN GLY ARG GLY ILE PRO VAL ASP SEQRES 6 A 87 ILE GLN GLU LYS MET GLY ARG PRO ALA VAL GLU VAL ILE SEQRES 7 A 87 LEU THR VAL LEU HIS ALA GLY GLY LYS SEQRES 1 A 107 GLY VAL GLY SER SER VAL VAL ASN ALA LEU SER GLN ASP SEQRES 2 A 107 LEU GLU VAL TYR VAL HIS ARG ASN GLU THR ILE TYR HIS SEQRES 3 A 107 GLN ALA TYR LYS LYS GLY VAL PRO GLN PHE ASP LEU LYS SEQRES 4 A 107 GLU VAL GLY THR THR ASP LYS THR GLY THR VAL ILE ARG SEQRES 5 A 107 PHE LYS ALA ASP GLY GLU ILE PHE THR GLU THR THR VAL SEQRES 6 A 107 TYR ASN TYR GLU THR LEU GLN GLN ARG ILE ARG GLU LEU SEQRES 7 A 107 ALA PHE LEU ASN LYS GLY ILE GLN ILE THR LEU ARG ASP SEQRES 8 A 107 GLU ARG ASP GLU GLU ASN VAL ARG GLU ASP SER TYR HIS SEQRES 9 A 107 TYR GLU GLY HET XAM A 200 124 ATOM 1 N LEU A 25 27.947 1.519 19.781 1.00 78.95 N ATOM 2 CA LEU A 25 27.520 2.646 20.609 1.00 79.12 C ATOM 3 C LEU A 25 26.063 2.442 21.074 1.00 78.84 C ATOM 4 O LEU A 25 25.832 2.116 22.245 1.00 78.54 O ATOM 5 CB LEU A 25 27.689 3.980 19.827 1.00 79.58 C ATOM 6 HN3 LEU A 25 27.329 1.449 18.947 1.00 0.00 H ATOM 7 HN2 LEU A 25 27.885 0.641 20.334 1.00 0.00 H ATOM 8 HN1 LEU A 25 28.929 1.668 19.474 1.00 0.00 H ATOM 9 N GLU A 26 25.087 2.616 20.137 1.00 76.89 N ATOM 10 CA GLU A 26 23.641 2.443 20.348 1.00 76.41 C ATOM 11 C GLU A 26 23.276 0.949 20.163 1.00 76.03 C ATOM 12 O GLU A 26 22.125 0.555 20.379 1.00 76.03 O ATOM 13 CB GLU A 26 22.835 3.376 19.406 1.00 77.65 C ATOM 14 CG GLU A 26 21.308 3.376 19.572 1.00 77.97 C ATOM 15 CD GLU A 26 20.646 4.302 20.582 1.00 78.02 C ATOM 16 OE1 GLU A 26 21.341 5.175 21.148 1.00 77.87 O ATOM 17 OE2 GLU A 26 19.421 4.157 20.803 1.00 77.83 O ATOM 18 H GLU A 26 25.394 2.897 19.184 1.00 0.00 H ATOM 19 N ALA A 27 24.279 0.115 19.784 1.00 74.50 N ATOM 20 CA ALA A 27 24.144 -1.338 19.596 1.00 73.70 C ATOM 21 C ALA A 27 23.814 -1.991 20.939 1.00 73.03 C ATOM 22 O ALA A 27 22.990 -2.907 20.996 1.00 72.62 O ATOM 23 CB ALA A 27 25.436 -1.923 19.036 1.00 74.33 C ATOM 24 H ALA A 27 25.215 0.536 19.614 1.00 0.00 H ATOM 25 N ALA A 28 24.458 -1.495 22.019 1.00 70.11 N ATOM 26 CA ALA A 28 24.266 -1.960 23.387 1.00 69.49 C ATOM 27 C ALA A 28 22.873 -1.555 23.867 1.00 69.06 C ATOM 28 O ALA A 28 22.232 -2.308 24.594 1.00 68.99 O ATOM 29 CB ALA A 28 25.339 -1.372 24.289 1.00 70.11 C ATOM 30 H ALA A 28 25.140 -0.726 21.862 1.00 0.00 H ATOM 31 N ARG A 29 22.404 -0.384 23.425 1.00 65.14 N ATOM 32 CA ARG A 29 21.098 0.169 23.756 1.00 64.67 C ATOM 33 C ARG A 29 19.977 -0.559 23.027 1.00 64.44 C ATOM 34 O ARG A 29 18.906 -0.747 23.593 1.00 64.34 O ATOM 35 CB ARG A 29 21.066 1.669 23.426 1.00 65.70 C ATOM 36 CG ARG A 29 21.972 2.514 24.321 1.00 65.90 C ATOM 37 CD ARG A 29 21.568 3.973 24.375 1.00 66.17 C ATOM 38 NE ARG A 29 20.130 4.176 24.610 1.00 66.26 N ATOM 39 CZ ARG A 29 19.547 4.278 25.806 1.00 65.57 C ATOM 40 NH1 ARG A 29 20.266 4.171 26.917 1.00 65.13 N ATOM 41 NH2 ARG A 29 18.240 4.488 25.898 1.00 65.44 N ATOM 42 HE ARG A 29 19.516 4.246 23.773 1.00 0.00 H ATOM 43 HH12 ARG A 29 19.804 4.252 27.845 1.00 0.00 H ATOM 44 HH11 ARG A 29 21.291 4.006 26.859 1.00 0.00 H ATOM 45 HH22 ARG A 29 17.790 4.567 26.833 1.00 0.00 H ATOM 46 HH21 ARG A 29 17.665 4.574 25.036 1.00 0.00 H ATOM 47 H ARG A 29 23.018 0.174 22.798 1.00 0.00 H ATOM 48 N LYS A 30 20.217 -0.953 21.764 1.00 65.03 N ATOM 49 CA LYS A 30 19.247 -1.668 20.927 1.00 65.04 C ATOM 50 C LYS A 30 19.213 -3.178 21.239 1.00 65.09 C ATOM 51 O LYS A 30 18.137 -3.776 21.227 1.00 65.24 O ATOM 52 CB LYS A 30 19.512 -1.402 19.439 1.00 66.78 C ATOM 53 H LYS A 30 21.148 -0.737 21.355 1.00 0.00 H ATOM 54 N ARG A 31 20.380 -3.788 21.544 1.00 65.21 N ATOM 55 CA ARG A 31 20.498 -5.214 21.882 1.00 65.10 C ATOM 56 C ARG A 31 21.048 -5.427 23.346 1.00 64.95 C ATOM 57 O ARG A 31 22.070 -6.113 23.499 1.00 65.05 O ATOM 58 CB ARG A 31 21.356 -5.939 20.818 1.00 64.43 C ATOM 59 H ARG A 31 21.247 -3.214 21.539 1.00 0.00 H ATOM 60 N PRO A 32 20.388 -4.861 24.420 1.00 64.05 N ATOM 61 CA PRO A 32 20.903 -5.029 25.796 1.00 63.77 C ATOM 62 C PRO A 32 21.171 -6.461 26.262 1.00 63.53 C ATOM 63 O PRO A 32 22.197 -6.673 26.909 1.00 63.60 O ATOM 64 CB PRO A 32 19.838 -4.348 26.656 1.00 65.07 C ATOM 65 CG PRO A 32 19.233 -3.355 25.764 1.00 65.26 C ATOM 66 CD PRO A 32 19.172 -4.023 24.437 1.00 65.35 C ATOM 67 N GLY A 33 20.284 -7.409 25.929 1.00 63.54 N ATOM 68 CA GLY A 33 20.444 -8.819 26.280 1.00 63.09 C ATOM 69 C GLY A 33 21.734 -9.348 25.687 1.00 62.90 C ATOM 70 O GLY A 33 22.531 -9.988 26.378 1.00 62.68 O ATOM 71 H GLY A 33 19.438 -7.127 25.393 1.00 0.00 H ATOM 72 N MET A 34 21.989 -8.995 24.406 1.00 64.57 N ATOM 73 CA MET A 34 23.196 -9.370 23.656 1.00 64.30 C ATOM 74 C MET A 34 24.437 -8.659 24.184 1.00 64.02 C ATOM 75 O MET A 34 25.467 -8.671 23.510 1.00 64.12 O ATOM 76 CB MET A 34 23.006 -9.049 22.157 1.00 66.87 C ATOM 77 H MET A 34 21.278 -8.415 23.916 1.00 0.00 H ATOM 78 N TYR A 35 24.343 -8.038 25.380 1.00 62.89 N ATOM 79 CA TYR A 35 25.438 -7.284 25.992 1.00 62.54 C ATOM 80 C TYR A 35 25.554 -7.396 27.510 1.00 61.80 C ATOM 81 O TYR A 35 26.654 -7.213 28.043 1.00 61.74 O ATOM 82 CB TYR A 35 25.342 -5.807 25.591 1.00 64.24 C ATOM 83 CG TYR A 35 25.934 -5.533 24.229 1.00 66.28 C ATOM 84 CD1 TYR A 35 27.311 -5.425 24.055 1.00 67.84 C ATOM 85 CD2 TYR A 35 25.121 -5.404 23.104 1.00 67.33 C ATOM 86 CE1 TYR A 35 27.861 -5.180 22.802 1.00 68.83 C ATOM 87 CE2 TYR A 35 25.662 -5.156 21.845 1.00 68.09 C ATOM 88 CZ TYR A 35 27.035 -5.045 21.702 1.00 69.41 C ATOM 89 OH TYR A 35 27.595 -4.810 20.473 1.00 70.78 O ATOM 90 HH TYR A 35 28.580 -4.762 20.564 1.00 0.00 H ATOM 91 H TYR A 35 23.442 -8.099 25.895 1.00 0.00 H ATOM 92 N ILE A 36 24.433 -7.669 28.202 1.00 58.70 N ATOM 93 CA ILE A 36 24.395 -7.769 29.654 1.00 58.00 C ATOM 94 C ILE A 36 23.481 -8.944 30.124 1.00 57.31 C ATOM 95 O ILE A 36 23.247 -9.121 31.319 1.00 57.56 O ATOM 96 CB ILE A 36 24.036 -6.361 30.234 1.00 60.03 C ATOM 97 CG1 ILE A 36 24.725 -6.109 31.576 1.00 60.96 C ATOM 98 CG2 ILE A 36 22.547 -6.056 30.300 1.00 59.37 C ATOM 99 CD1 ILE A 36 26.105 -5.445 31.456 1.00 62.14 C ATOM 100 H ILE A 36 23.550 -7.816 27.673 1.00 0.00 H ATOM 101 N GLY A 37 23.011 -9.749 29.175 1.00 59.75 N ATOM 102 CA GLY A 37 22.157 -10.904 29.441 1.00 58.59 C ATOM 103 C GLY A 37 20.671 -10.621 29.613 1.00 57.80 C ATOM 104 O GLY A 37 19.844 -11.049 28.796 1.00 57.75 O ATOM 105 H GLY A 37 23.266 -9.545 28.188 1.00 0.00 H ATOM 106 N SER A 38 20.323 -9.913 30.691 1.00 58.44 N ATOM 107 CA SER A 38 18.943 -9.602 31.016 1.00 57.46 C ATOM 108 C SER A 38 18.712 -8.106 31.174 1.00 56.67 C ATOM 109 O SER A 38 19.650 -7.360 31.409 1.00 56.75 O ATOM 110 CB SER A 38 18.547 -10.337 32.291 1.00 61.06 C ATOM 111 OG SER A 38 17.257 -9.966 32.745 1.00 61.80 O ATOM 112 HG SER A 38 17.043 -10.466 33.572 1.00 0.00 H ATOM 113 H SER A 38 21.073 -9.570 31.325 1.00 0.00 H ATOM 114 N THR A 39 17.462 -7.674 31.038 1.00 55.87 N ATOM 115 CA THR A 39 17.067 -6.289 31.196 1.00 54.58 C ATOM 116 C THR A 39 16.208 -6.187 32.494 1.00 53.82 C ATOM 117 O THR A 39 15.613 -5.136 32.788 1.00 53.89 O ATOM 118 CB THR A 39 16.472 -5.760 29.876 1.00 58.87 C ATOM 119 OG1 THR A 39 16.686 -4.353 29.770 1.00 58.51 O ATOM 120 CG2 THR A 39 14.999 -6.136 29.658 1.00 58.97 C ATOM 121 HG1 THR A 39 16.248 -3.895 30.531 1.00 0.00 H ATOM 122 H THR A 39 16.725 -8.370 30.805 1.00 0.00 H ATOM 123 N SER A 40 16.171 -7.303 33.272 1.00 55.02 N ATOM 124 CA SER A 40 15.462 -7.421 34.549 1.00 54.15 C ATOM 125 C SER A 40 16.479 -7.180 35.686 1.00 53.20 C ATOM 126 O SER A 40 17.552 -6.621 35.414 1.00 53.05 O ATOM 127 CB SER A 40 14.844 -8.811 34.679 1.00 57.49 C ATOM 128 OG SER A 40 15.804 -9.791 35.050 1.00 57.41 O ATOM 129 HG SER A 40 16.515 -9.832 34.362 1.00 0.00 H ATOM 130 H SER A 40 16.688 -8.140 32.933 1.00 0.00 H ATOM 131 N GLU A 41 16.169 -7.630 36.941 1.00 51.78 N ATOM 132 CA GLU A 41 17.046 -7.519 38.117 1.00 50.48 C ATOM 133 C GLU A 41 18.471 -8.026 37.794 1.00 49.46 C ATOM 134 O GLU A 41 19.439 -7.353 38.128 1.00 49.64 O ATOM 135 CB GLU A 41 16.444 -8.267 39.324 1.00 51.57 C ATOM 136 H GLU A 41 15.243 -8.085 37.073 1.00 0.00 H ATOM 137 N ARG A 42 18.590 -9.172 37.100 1.00 47.99 N ATOM 138 CA ARG A 42 19.878 -9.742 36.703 1.00 46.71 C ATOM 139 C ARG A 42 20.757 -8.742 35.940 1.00 45.53 C ATOM 140 O ARG A 42 21.949 -8.628 36.242 1.00 45.77 O ATOM 141 CB ARG A 42 19.697 -11.035 35.883 1.00 46.44 C ATOM 142 H ARG A 42 17.722 -9.679 36.832 1.00 0.00 H ATOM 143 N GLY A 43 20.165 -8.029 34.979 1.00 42.74 N ATOM 144 CA GLY A 43 20.878 -7.042 34.178 1.00 40.78 C ATOM 145 C GLY A 43 21.272 -5.775 34.921 1.00 39.45 C ATOM 146 O GLY A 43 22.331 -5.196 34.630 1.00 39.26 O ATOM 147 H GLY A 43 19.153 -8.184 34.794 1.00 0.00 H ATOM 148 N LEU A 44 20.394 -5.326 35.872 1.00 32.80 N ATOM 149 CA LEU A 44 20.576 -4.141 36.711 1.00 31.34 C ATOM 150 C LEU A 44 21.772 -4.380 37.640 1.00 31.17 C ATOM 151 O LEU A 44 22.693 -3.566 37.674 1.00 31.29 O ATOM 152 CB LEU A 44 19.289 -3.827 37.523 1.00 28.98 C ATOM 153 CG LEU A 44 19.292 -2.549 38.369 1.00 27.43 C ATOM 154 CD1 LEU A 44 18.952 -1.369 37.556 1.00 27.41 C ATOM 155 CD2 LEU A 44 18.343 -2.635 39.535 1.00 26.08 C ATOM 156 H LEU A 44 19.522 -5.875 36.010 1.00 0.00 H ATOM 157 N HIS A 45 21.776 -5.501 38.359 1.00 32.77 N ATOM 158 CA HIS A 45 22.865 -5.828 39.254 1.00 32.23 C ATOM 159 C HIS A 45 24.150 -6.104 38.481 1.00 32.65 C ATOM 160 O HIS A 45 25.233 -5.987 39.063 1.00 32.88 O ATOM 161 CB HIS A 45 22.492 -7.002 40.149 1.00 32.04 C ATOM 162 CG HIS A 45 21.439 -6.652 41.138 1.00 29.78 C ATOM 163 ND1 HIS A 45 20.097 -6.706 40.813 1.00 27.61 N ATOM 164 CD2 HIS A 45 21.563 -6.223 42.412 1.00 28.84 C ATOM 165 CE1 HIS A 45 19.447 -6.336 41.901 1.00 28.27 C ATOM 166 NE2 HIS A 45 20.290 -6.042 42.892 1.00 27.15 N ATOM 167 H HIS A 45 20.975 -6.159 38.275 1.00 0.00 H ATOM 168 N HIS A 46 24.036 -6.451 37.173 1.00 37.34 N ATOM 169 CA HIS A 46 25.187 -6.733 36.324 1.00 37.46 C ATOM 170 C HIS A 46 25.944 -5.479 35.947 1.00 36.92 C ATOM 171 O HIS A 46 27.117 -5.570 35.561 1.00 37.33 O ATOM 172 CB HIS A 46 24.810 -7.535 35.074 1.00 39.79 C ATOM 173 CG HIS A 46 25.989 -8.264 34.508 1.00 43.18 C ATOM 174 ND1 HIS A 46 26.823 -7.671 33.572 1.00 44.75 N ATOM 175 CD2 HIS A 46 26.484 -9.485 34.821 1.00 45.27 C ATOM 176 CE1 HIS A 46 27.776 -8.555 33.323 1.00 45.09 C ATOM 177 NE2 HIS A 46 27.615 -9.662 34.051 1.00 44.98 N ATOM 178 H HIS A 46 23.085 -6.519 36.758 1.00 0.00 H ATOM 179 N LEU A 47 25.285 -4.301 36.054 1.00 36.67 N ATOM 180 CA LEU A 47 25.889 -2.994 35.756 1.00 35.75 C ATOM 181 C LEU A 47 26.920 -2.723 36.820 1.00 35.11 C ATOM 182 O LEU A 47 28.010 -2.246 36.519 1.00 35.04 O ATOM 183 CB LEU A 47 24.838 -1.896 35.778 1.00 35.30 C ATOM 184 CG LEU A 47 23.666 -2.063 34.831 1.00 35.04 C ATOM 185 CD1 LEU A 47 22.531 -1.164 35.241 1.00 34.90 C ATOM 186 CD2 LEU A 47 24.100 -1.818 33.388 1.00 35.47 C ATOM 187 H LEU A 47 24.293 -4.322 36.365 1.00 0.00 H ATOM 188 N VAL A 48 26.583 -3.085 38.070 1.00 36.61 N ATOM 189 CA VAL A 48 27.452 -2.954 39.238 1.00 35.82 C ATOM 190 C VAL A 48 28.633 -3.933 39.092 1.00 36.30 C ATOM 191 O VAL A 48 29.744 -3.592 39.501 1.00 36.19 O ATOM 192 CB VAL A 48 26.659 -3.149 40.549 1.00 37.25 C ATOM 193 CG1 VAL A 48 27.573 -3.146 41.764 1.00 36.94 C ATOM 194 CG2 VAL A 48 25.581 -2.083 40.686 1.00 36.44 C ATOM 195 H VAL A 48 25.635 -3.487 38.217 1.00 0.00 H ATOM 196 N TRP A 49 28.406 -5.113 38.471 1.00 38.20 N ATOM 197 CA TRP A 49 29.459 -6.094 38.263 1.00 38.04 C ATOM 198 C TRP A 49 30.540 -5.602 37.319 1.00 37.88 C ATOM 199 O TRP A 49 31.713 -5.717 37.670 1.00 38.29 O ATOM 200 CB TRP A 49 28.919 -7.455 37.777 1.00 39.07 C ATOM 201 CG TRP A 49 27.886 -8.107 38.641 1.00 41.29 C ATOM 202 CD1 TRP A 49 26.978 -9.041 38.241 1.00 42.92 C ATOM 203 CD2 TRP A 49 27.661 -7.907 40.055 1.00 42.50 C ATOM 204 NE1 TRP A 49 26.180 -9.416 39.304 1.00 42.85 N ATOM 205 CE2 TRP A 49 26.574 -8.731 40.425 1.00 41.69 C ATOM 206 CE3 TRP A 49 28.261 -7.099 41.040 1.00 44.69 C ATOM 207 CZ2 TRP A 49 26.067 -8.762 41.723 1.00 42.94 C ATOM 208 CZ3 TRP A 49 27.770 -7.142 42.331 1.00 46.21 C ATOM 209 CH2 TRP A 49 26.684 -7.964 42.662 1.00 45.74 C ATOM 210 HE1 TRP A 49 25.404 -10.107 39.261 1.00 0.00 H ATOM 211 H TRP A 49 27.446 -5.326 38.131 1.00 0.00 H ATOM 212 N GLU A 50 30.170 -5.065 36.135 1.00 33.02 N ATOM 213 CA GLU A 50 31.172 -4.630 35.167 1.00 32.56 C ATOM 214 C GLU A 50 32.040 -3.488 35.681 1.00 32.07 C ATOM 215 O GLU A 50 33.238 -3.494 35.387 1.00 32.32 O ATOM 216 CB GLU A 50 30.572 -4.320 33.789 1.00 33.61 C ATOM 217 CG GLU A 50 31.596 -4.166 32.667 1.00 34.09 C ATOM 218 CD GLU A 50 32.527 -5.327 32.354 1.00 36.05 C ATOM 219 OE1 GLU A 50 32.087 -6.495 32.467 1.00 35.87 O ATOM 220 OE2 GLU A 50 33.698 -5.070 31.982 1.00 38.65 O ATOM 221 H GLU A 50 29.160 -4.961 35.911 1.00 0.00 H ATOM 222 N ILE A 51 31.480 -2.544 36.469 1.00 27.89 N ATOM 223 CA ILE A 51 32.300 -1.459 37.005 1.00 27.27 C ATOM 224 C ILE A 51 33.259 -2.007 38.094 1.00 28.09 C ATOM 225 O ILE A 51 34.414 -1.567 38.159 1.00 28.68 O ATOM 226 CB ILE A 51 31.466 -0.237 37.477 1.00 27.21 C ATOM 227 CG1 ILE A 51 30.497 0.257 36.402 1.00 25.76 C ATOM 228 CG2 ILE A 51 32.346 0.892 38.002 1.00 26.34 C ATOM 229 CD1 ILE A 51 31.123 0.723 35.133 1.00 23.38 C ATOM 230 H ILE A 51 30.466 -2.589 36.694 1.00 0.00 H ATOM 231 N VAL A 52 32.798 -2.979 38.924 1.00 27.09 N ATOM 232 CA VAL A 52 33.624 -3.528 40.004 1.00 27.03 C ATOM 233 C VAL A 52 34.741 -4.373 39.431 1.00 27.27 C ATOM 234 O VAL A 52 35.840 -4.332 39.972 1.00 27.35 O ATOM 235 CB VAL A 52 32.796 -4.235 41.125 1.00 29.27 C ATOM 236 CG1 VAL A 52 33.673 -4.982 42.144 1.00 29.49 C ATOM 237 CG2 VAL A 52 31.910 -3.227 41.841 1.00 28.98 C ATOM 238 H VAL A 52 31.833 -3.343 38.790 1.00 0.00 H ATOM 239 N ASP A 53 34.495 -5.087 38.329 1.00 31.21 N ATOM 240 CA ASP A 53 35.515 -5.938 37.711 1.00 31.90 C ATOM 241 C ASP A 53 36.674 -5.132 37.171 1.00 31.77 C ATOM 242 O ASP A 53 37.808 -5.638 37.075 1.00 31.56 O ATOM 243 CB ASP A 53 34.916 -6.876 36.667 1.00 36.06 C ATOM 244 CG ASP A 53 34.540 -8.207 37.288 1.00 37.52 C ATOM 245 OD1 ASP A 53 33.445 -8.286 37.935 1.00 37.78 O ATOM 246 OD2 ASP A 53 35.340 -9.171 37.155 1.00 39.10 O ATOM 247 H ASP A 53 33.550 -5.037 37.897 1.00 0.00 H ATOM 248 N ASN A 54 36.384 -3.844 36.878 1.00 32.07 N ATOM 249 CA ASN A 54 37.345 -2.871 36.392 1.00 31.29 C ATOM 250 C ASN A 54 38.289 -2.495 37.498 1.00 30.91 C ATOM 251 O ASN A 54 39.489 -2.355 37.261 1.00 31.34 O ATOM 252 CB ASN A 54 36.623 -1.668 35.839 1.00 34.36 C ATOM 253 CG ASN A 54 36.333 -1.846 34.380 1.00 35.18 C ATOM 254 OD1 ASN A 54 37.240 -1.760 33.532 1.00 34.69 O ATOM 255 ND2 ASN A 54 35.083 -2.119 34.053 1.00 34.48 N ATOM 256 HD22 ASN A 54 34.354 -2.182 34.792 1.00 0.00 H ATOM 257 HD21 ASN A 54 34.828 -2.271 33.056 1.00 0.00 H ATOM 258 H ASN A 54 35.402 -3.528 37.010 1.00 0.00 H ATOM 259 N SER A 55 37.754 -2.364 38.714 1.00 30.03 N ATOM 260 CA SER A 55 38.523 -2.043 39.903 1.00 29.53 C ATOM 261 C SER A 55 39.302 -3.239 40.337 1.00 29.54 C ATOM 262 O SER A 55 40.422 -3.048 40.785 1.00 30.21 O ATOM 263 CB SER A 55 37.616 -1.583 41.028 1.00 33.96 C ATOM 264 OG SER A 55 37.085 -0.297 40.755 1.00 34.57 O ATOM 265 HG SER A 55 37.827 0.351 40.658 1.00 0.00 H ATOM 266 H SER A 55 36.728 -2.500 38.815 1.00 0.00 H ATOM 267 N ILE A 56 38.744 -4.477 40.202 1.00 29.58 N ATOM 268 CA ILE A 56 39.431 -5.728 40.566 1.00 29.57 C ATOM 269 C ILE A 56 40.640 -5.877 39.629 1.00 29.92 C ATOM 270 O ILE A 56 41.725 -6.275 40.086 1.00 29.45 O ATOM 271 CB ILE A 56 38.487 -6.975 40.533 1.00 31.13 C ATOM 272 CG1 ILE A 56 37.367 -6.918 41.640 1.00 30.29 C ATOM 273 CG2 ILE A 56 39.250 -8.314 40.557 1.00 31.21 C ATOM 274 CD1 ILE A 56 37.674 -7.360 43.120 1.00 32.68 C ATOM 275 H ILE A 56 37.779 -4.541 39.820 1.00 0.00 H ATOM 276 N ASP A 57 40.454 -5.523 38.321 1.00 33.52 N ATOM 277 CA ASP A 57 41.512 -5.581 37.302 1.00 34.01 C ATOM 278 C ASP A 57 42.721 -4.790 37.748 1.00 33.85 C ATOM 279 O ASP A 57 43.815 -5.351 37.788 1.00 34.49 O ATOM 280 CB ASP A 57 41.014 -5.101 35.927 1.00 37.46 C ATOM 281 CG ASP A 57 40.315 -6.175 35.114 1.00 38.49 C ATOM 282 OD1 ASP A 57 40.595 -7.389 35.350 1.00 39.32 O ATOM 283 OD2 ASP A 57 39.489 -5.812 34.238 1.00 39.71 O ATOM 284 H ASP A 57 39.511 -5.194 38.031 1.00 0.00 H ATOM 285 N GLU A 58 42.504 -3.512 38.128 1.00 31.74 N ATOM 286 CA GLU A 58 43.505 -2.563 38.621 1.00 31.72 C ATOM 287 C GLU A 58 44.173 -3.089 39.895 1.00 31.10 C ATOM 288 O GLU A 58 45.371 -2.886 40.092 1.00 31.28 O ATOM 289 CB GLU A 58 42.830 -1.201 38.909 1.00 33.20 C ATOM 290 CG GLU A 58 43.752 -0.093 39.413 1.00 34.33 C ATOM 291 CD GLU A 58 44.673 0.580 38.411 1.00 34.58 C ATOM 292 OE1 GLU A 58 45.411 -0.136 37.704 1.00 33.73 O ATOM 293 OE2 GLU A 58 44.672 1.828 38.344 1.00 35.51 O ATOM 294 H GLU A 58 41.525 -3.166 38.064 1.00 0.00 H ATOM 295 N ALA A 59 43.385 -3.748 40.753 1.00 31.55 N ATOM 296 CA ALA A 59 43.831 -4.312 42.006 1.00 31.02 C ATOM 297 C ALA A 59 44.729 -5.518 41.765 1.00 30.89 C ATOM 298 O ALA A 59 45.792 -5.623 42.402 1.00 31.00 O ATOM 299 CB ALA A 59 42.643 -4.669 42.860 1.00 31.23 C ATOM 300 H ALA A 59 42.383 -3.862 40.500 1.00 0.00 H ATOM 301 N LEU A 60 44.403 -6.356 40.818 1.00 30.58 N ATOM 302 CA LEU A 60 45.274 -7.467 40.528 1.00 30.04 C ATOM 303 C LEU A 60 46.543 -7.125 39.805 1.00 29.93 C ATOM 304 O LEU A 60 47.403 -7.952 39.673 1.00 30.49 O ATOM 305 CB LEU A 60 44.533 -8.536 39.759 1.00 30.17 C ATOM 306 CG LEU A 60 43.256 -9.076 40.354 1.00 30.08 C ATOM 307 CD1 LEU A 60 42.573 -9.877 39.292 1.00 30.60 C ATOM 308 CD2 LEU A 60 43.551 -9.935 41.542 1.00 28.42 C ATOM 309 H LEU A 60 43.524 -6.223 40.279 1.00 0.00 H ATOM 310 N ALA A 61 46.660 -5.904 39.338 1.00 28.51 N ATOM 311 CA ALA A 61 47.890 -5.402 38.725 1.00 27.92 C ATOM 312 C ALA A 61 48.832 -4.857 39.820 1.00 28.16 C ATOM 313 O ALA A 61 50.012 -4.596 39.555 1.00 28.49 O ATOM 314 CB ALA A 61 47.570 -4.347 37.686 1.00 28.17 C ATOM 315 H ALA A 61 45.842 -5.265 39.407 1.00 0.00 H ATOM 316 N GLY A 62 48.283 -4.722 41.038 1.00 28.15 N ATOM 317 CA GLY A 62 48.961 -4.285 42.254 1.00 28.65 C ATOM 318 C GLY A 62 48.904 -2.817 42.591 1.00 28.99 C ATOM 319 O GLY A 62 49.781 -2.337 43.302 1.00 28.51 O ATOM 320 H GLY A 62 47.272 -4.952 41.123 1.00 0.00 H ATOM 321 N TYR A 63 47.864 -2.101 42.127 1.00 29.82 N ATOM 322 CA TYR A 63 47.719 -0.657 42.306 1.00 30.74 C ATOM 323 C TYR A 63 46.590 -0.224 43.276 1.00 31.40 C ATOM 324 O TYR A 63 46.727 0.797 43.963 1.00 32.15 O ATOM 325 CB TYR A 63 47.584 -0.004 40.921 1.00 30.54 C ATOM 326 CG TYR A 63 48.866 -0.202 40.130 1.00 32.57 C ATOM 327 CD1 TYR A 63 49.974 0.623 40.337 1.00 32.87 C ATOM 328 CD2 TYR A 63 49.009 -1.272 39.245 1.00 32.63 C ATOM 329 CE1 TYR A 63 51.176 0.410 39.657 1.00 32.60 C ATOM 330 CE2 TYR A 63 50.208 -1.492 38.557 1.00 34.05 C ATOM 331 CZ TYR A 63 51.289 -0.651 38.771 1.00 33.25 C ATOM 332 OH TYR A 63 52.470 -0.859 38.101 1.00 31.36 O ATOM 333 HH TYR A 63 53.128 -0.171 38.373 1.00 0.00 H ATOM 334 H TYR A 63 47.117 -2.606 41.609 1.00 0.00 H ATOM 335 N ALA A 64 45.516 -0.994 43.356 1.00 30.92 N ATOM 336 CA ALA A 64 44.396 -0.709 44.243 1.00 31.10 C ATOM 337 C ALA A 64 44.215 -1.873 45.231 1.00 31.66 C ATOM 338 O ALA A 64 44.441 -3.045 44.894 1.00 31.69 O ATOM 339 CB ALA A 64 43.128 -0.517 43.424 1.00 31.88 C ATOM 340 H ALA A 64 45.470 -1.843 42.757 1.00 0.00 H ATOM 341 N ASN A 65 43.815 -1.567 46.452 1.00 30.42 N ATOM 342 CA ASN A 65 43.619 -2.623 47.440 1.00 30.96 C ATOM 343 C ASN A 65 42.311 -2.410 48.204 1.00 30.54 C ATOM 344 O ASN A 65 42.014 -3.130 49.158 1.00 30.76 O ATOM 345 CB ASN A 65 44.862 -2.715 48.360 1.00 30.70 C ATOM 346 CG ASN A 65 45.119 -1.536 49.267 1.00 33.46 C ATOM 347 OD1 ASN A 65 44.311 -0.601 49.398 1.00 35.18 O ATOM 348 ND2 ASN A 65 46.264 -1.572 49.938 1.00 36.25 N ATOM 349 HD22 ASN A 65 46.919 -2.369 49.806 1.00 0.00 H ATOM 350 HD21 ASN A 65 46.506 -0.803 50.596 1.00 0.00 H ATOM 351 H ASN A 65 43.640 -0.575 46.709 1.00 0.00 H ATOM 352 N GLN A 66 41.551 -1.388 47.763 1.00 30.14 N ATOM 353 CA GLN A 66 40.285 -0.930 48.308 1.00 29.69 C ATOM 354 C GLN A 66 39.290 -0.557 47.231 1.00 29.15 C ATOM 355 O GLN A 66 39.560 0.313 46.391 1.00 29.49 O ATOM 356 CB GLN A 66 40.513 0.308 49.170 1.00 31.71 C ATOM 357 CG GLN A 66 40.394 0.046 50.650 1.00 34.87 C ATOM 358 CD GLN A 66 41.111 1.107 51.430 1.00 39.10 C ATOM 359 OE1 GLN A 66 42.353 1.228 51.387 1.00 40.18 O ATOM 360 NE2 GLN A 66 40.349 1.894 52.162 1.00 39.14 N ATOM 361 HE22 GLN A 66 39.318 1.759 52.170 1.00 0.00 H ATOM 362 HE21 GLN A 66 40.779 2.650 52.732 1.00 0.00 H ATOM 363 H GLN A 66 41.912 -0.868 46.938 1.00 0.00 H ATOM 364 N ILE A 67 38.122 -1.196 47.277 1.00 27.44 N ATOM 365 CA ILE A 67 36.994 -0.926 46.399 1.00 26.12 C ATOM 366 C ILE A 67 35.818 -0.635 47.327 1.00 26.18 C ATOM 367 O ILE A 67 35.724 -1.216 48.417 1.00 25.74 O ATOM 368 CB ILE A 67 36.723 -2.071 45.404 1.00 28.75 C ATOM 369 CG1 ILE A 67 37.990 -2.341 44.522 1.00 27.80 C ATOM 370 CG2 ILE A 67 35.452 -1.799 44.553 1.00 27.28 C ATOM 371 CD1 ILE A 67 38.063 -3.722 43.814 1.00 26.28 C ATOM 372 H ILE A 67 38.008 -1.942 47.993 1.00 0.00 H ATOM 373 N GLU A 68 34.952 0.303 46.920 1.00 28.53 N ATOM 374 CA GLU A 68 33.766 0.705 47.679 1.00 29.00 C ATOM 375 C GLU A 68 32.629 0.824 46.694 1.00 28.62 C ATOM 376 O GLU A 68 32.786 1.460 45.649 1.00 29.35 O ATOM 377 CB GLU A 68 34.005 2.035 48.399 1.00 30.97 C ATOM 378 CG GLU A 68 32.884 2.482 49.313 1.00 33.76 C ATOM 379 CD GLU A 68 32.887 3.972 49.620 1.00 37.65 C ATOM 380 OE1 GLU A 68 32.817 4.789 48.667 1.00 40.78 O ATOM 381 OE2 GLU A 68 32.933 4.319 50.825 1.00 38.72 O ATOM 382 H GLU A 68 35.133 0.774 46.010 1.00 0.00 H ATOM 383 N VAL A 69 31.501 0.168 47.012 1.00 27.18 N ATOM 384 CA VAL A 69 30.271 0.126 46.226 1.00 26.52 C ATOM 385 C VAL A 69 29.175 0.695 47.143 1.00 26.02 C ATOM 386 O VAL A 69 28.828 0.080 48.151 1.00 25.80 O ATOM 387 CB VAL A 69 29.950 -1.332 45.769 1.00 30.56 C ATOM 388 CG1 VAL A 69 28.693 -1.394 44.884 1.00 30.95 C ATOM 389 CG2 VAL A 69 31.151 -2.005 45.102 1.00 30.17 C ATOM 390 H VAL A 69 31.504 -0.363 47.906 1.00 0.00 H ATOM 391 N VAL A 70 28.667 1.885 46.806 1.00 24.80 N ATOM 392 CA VAL A 70 27.615 2.605 47.544 1.00 24.52 C ATOM 393 C VAL A 70 26.294 2.658 46.724 1.00 24.53 C ATOM 394 O VAL A 70 26.325 2.968 45.518 1.00 24.61 O ATOM 395 CB VAL A 70 28.082 4.024 47.985 1.00 24.58 C ATOM 396 CG1 VAL A 70 27.008 4.732 48.809 1.00 24.55 C ATOM 397 CG2 VAL A 70 29.389 3.952 48.766 1.00 24.33 C ATOM 398 H VAL A 70 29.046 2.340 45.951 1.00 0.00 H ATOM 399 N ILE A 71 25.145 2.315 47.379 1.00 25.98 N ATOM 400 CA ILE A 71 23.805 2.379 46.760 1.00 26.37 C ATOM 401 C ILE A 71 23.289 3.721 47.298 1.00 26.95 C ATOM 402 O ILE A 71 22.936 3.797 48.476 1.00 26.59 O ATOM 403 CB ILE A 71 22.837 1.193 47.095 1.00 27.61 C ATOM 404 CG1 ILE A 71 23.557 -0.164 47.220 1.00 28.07 C ATOM 405 CG2 ILE A 71 21.683 1.124 46.078 1.00 26.73 C ATOM 406 CD1 ILE A 71 22.724 -1.270 47.972 1.00 29.37 C ATOM 407 H ILE A 71 25.217 1.992 48.365 1.00 0.00 H ATOM 408 N GLU A 72 23.307 4.786 46.481 1.00 25.88 N ATOM 409 CA GLU A 72 22.905 6.108 46.955 1.00 26.15 C ATOM 410 C GLU A 72 21.441 6.408 46.814 1.00 26.25 C ATOM 411 O GLU A 72 20.696 5.587 46.274 1.00 26.30 O ATOM 412 CB GLU A 72 23.726 7.182 46.259 1.00 27.48 C ATOM 413 CG GLU A 72 25.200 7.091 46.583 1.00 28.96 C ATOM 414 CD GLU A 72 26.064 8.030 45.774 1.00 32.15 C ATOM 415 OE1 GLU A 72 25.679 8.316 44.618 1.00 32.72 O ATOM 416 OE2 GLU A 72 27.116 8.481 46.288 1.00 33.44 O ATOM 417 H GLU A 72 23.612 4.668 45.494 1.00 0.00 H ATOM 418 N LYS A 73 21.021 7.612 47.274 1.00 26.92 N ATOM 419 CA LYS A 73 19.636 8.054 47.147 1.00 27.15 C ATOM 420 C LYS A 73 19.191 7.941 45.659 1.00 27.16 C ATOM 421 O LYS A 73 20.013 8.095 44.743 1.00 26.94 O ATOM 422 CB LYS A 73 19.434 9.464 47.728 1.00 28.17 C ATOM 423 H LYS A 73 21.709 8.242 47.733 1.00 0.00 H ATOM 424 N ASP A 74 17.897 7.595 45.447 1.00 28.63 N ATOM 425 CA ASP A 74 17.235 7.382 44.151 1.00 29.17 C ATOM 426 C ASP A 74 17.921 6.240 43.316 1.00 29.30 C ATOM 427 O ASP A 74 17.890 6.266 42.077 1.00 29.51 O ATOM 428 CB ASP A 74 17.051 8.694 43.355 1.00 29.38 C ATOM 429 H ASP A 74 17.308 7.466 46.294 1.00 0.00 H ATOM 430 N ASN A 75 18.495 5.221 44.015 1.00 27.01 N ATOM 431 CA ASN A 75 19.165 4.044 43.444 1.00 27.07 C ATOM 432 C ASN A 75 20.250 4.381 42.432 1.00 27.27 C ATOM 433 O ASN A 75 20.280 3.908 41.274 1.00 27.11 O ATOM 434 CB ASN A 75 18.165 3.068 42.875 1.00 24.05 C ATOM 435 CG ASN A 75 17.487 2.267 43.919 1.00 24.56 C ATOM 436 OD1 ASN A 75 17.881 1.132 44.185 1.00 26.21 O ATOM 437 ND2 ASN A 75 16.463 2.837 44.531 1.00 26.62 N ATOM 438 HD22 ASN A 75 16.170 3.800 44.268 1.00 0.00 H ATOM 439 HD21 ASN A 75 15.950 2.323 45.275 1.00 0.00 H ATOM 440 H ASN A 75 18.455 5.282 45.052 1.00 0.00 H ATOM 441 N TRP A 76 21.157 5.236 42.890 1.00 29.53 N ATOM 442 CA TRP A 76 22.323 5.616 42.102 1.00 29.19 C ATOM 443 C TRP A 76 23.400 4.681 42.628 1.00 28.89 C ATOM 444 O TRP A 76 23.260 4.152 43.748 1.00 28.58 O ATOM 445 CB TRP A 76 22.709 7.076 42.371 1.00 28.10 C ATOM 446 CG TRP A 76 22.195 8.049 41.356 1.00 28.46 C ATOM 447 CD1 TRP A 76 20.927 8.531 41.258 1.00 28.14 C ATOM 448 CD2 TRP A 76 22.959 8.707 40.324 1.00 28.36 C ATOM 449 NE1 TRP A 76 20.842 9.431 40.214 1.00 26.71 N ATOM 450 CE2 TRP A 76 22.079 9.577 39.642 1.00 27.29 C ATOM 451 CE3 TRP A 76 24.295 8.615 39.883 1.00 27.11 C ATOM 452 CZ2 TRP A 76 22.487 10.343 38.546 1.00 27.53 C ATOM 453 CZ3 TRP A 76 24.700 9.386 38.802 1.00 27.86 C ATOM 454 CH2 TRP A 76 23.811 10.250 38.161 1.00 28.49 C ATOM 455 HE1 TRP A 76 19.976 9.921 39.910 1.00 0.00 H ATOM 456 H TRP A 76 21.032 5.646 43.838 1.00 0.00 H ATOM 457 N ILE A 77 24.435 4.440 41.834 1.00 24.89 N ATOM 458 CA ILE A 77 25.515 3.574 42.282 1.00 24.41 C ATOM 459 C ILE A 77 26.791 4.358 42.274 1.00 24.48 C ATOM 460 O ILE A 77 27.074 5.049 41.299 1.00 24.14 O ATOM 461 CB ILE A 77 25.613 2.250 41.473 1.00 26.00 C ATOM 462 CG1 ILE A 77 24.447 1.301 41.809 1.00 25.00 C ATOM 463 CG2 ILE A 77 26.981 1.538 41.627 1.00 25.72 C ATOM 464 CD1 ILE A 77 24.444 0.603 43.145 1.00 22.48 C ATOM 465 H ILE A 77 24.475 4.871 40.888 1.00 0.00 H ATOM 466 N LYS A 78 27.575 4.250 43.350 1.00 23.74 N ATOM 467 CA LYS A 78 28.855 4.924 43.365 1.00 24.40 C ATOM 468 C LYS A 78 29.962 3.912 43.614 1.00 24.45 C ATOM 469 O LYS A 78 30.019 3.371 44.711 1.00 25.56 O ATOM 470 CB LYS A 78 28.881 6.103 44.349 1.00 25.89 C ATOM 471 CG LYS A 78 30.105 6.982 44.189 1.00 26.11 C ATOM 472 CD LYS A 78 30.253 7.911 45.346 1.00 28.20 C ATOM 473 CE LYS A 78 31.014 7.331 46.529 1.00 31.82 C ATOM 474 NZ LYS A 78 30.513 7.878 47.831 1.00 34.14 N ATOM 475 HZ1 LYS A 78 30.631 8.911 47.840 1.00 0.00 H ATOM 476 HZ2 LYS A 78 29.506 7.642 47.941 1.00 0.00 H ATOM 477 HZ3 LYS A 78 31.056 7.459 48.613 1.00 0.00 H ATOM 478 H LYS A 78 27.268 3.687 44.169 1.00 0.00 H ATOM 479 N VAL A 79 30.824 3.642 42.593 1.00 25.07 N ATOM 480 CA VAL A 79 31.980 2.715 42.714 1.00 24.64 C ATOM 481 C VAL A 79 33.291 3.527 42.792 1.00 24.66 C ATOM 482 O VAL A 79 33.550 4.363 41.930 1.00 24.69 O ATOM 483 CB VAL A 79 32.059 1.536 41.692 1.00 27.15 C ATOM 484 CG1 VAL A 79 33.232 0.606 42.010 1.00 27.07 C ATOM 485 CG2 VAL A 79 30.756 0.739 41.655 1.00 27.80 C ATOM 486 H VAL A 79 30.664 4.111 41.678 1.00 0.00 H ATOM 487 N THR A 80 34.089 3.280 43.852 1.00 26.24 N ATOM 488 CA THR A 80 35.359 3.954 44.155 1.00 25.92 C ATOM 489 C THR A 80 36.533 2.997 44.435 1.00 26.35 C ATOM 490 O THR A 80 36.480 2.165 45.351 1.00 27.07 O ATOM 491 CB THR A 80 35.179 4.807 45.419 1.00 29.89 C ATOM 492 OG1 THR A 80 34.003 5.610 45.329 1.00 30.87 O ATOM 493 CG2 THR A 80 36.380 5.632 45.736 1.00 28.25 C ATOM 494 HG1 THR A 80 33.909 6.149 46.154 1.00 0.00 H ATOM 495 H THR A 80 33.776 2.544 44.516 1.00 0.00 H ATOM 496 N ASP A 81 37.615 3.155 43.685 1.00 27.28 N ATOM 497 CA ASP A 81 38.826 2.383 43.962 1.00 26.37 C ATOM 498 C ASP A 81 39.945 3.379 44.240 1.00 26.22 C ATOM 499 O ASP A 81 39.805 4.564 43.897 1.00 25.51 O ATOM 500 CB ASP A 81 39.203 1.372 42.864 1.00 27.31 C ATOM 501 CG ASP A 81 39.594 1.965 41.531 1.00 27.49 C ATOM 502 OD1 ASP A 81 40.505 2.816 41.500 1.00 30.22 O ATOM 503 OD2 ASP A 81 38.993 1.579 40.524 1.00 27.34 O ATOM 504 H ASP A 81 37.602 3.832 42.895 1.00 0.00 H ATOM 505 N ASN A 82 41.038 2.895 44.874 1.00 25.99 N ATOM 506 CA ASN A 82 42.226 3.684 45.201 1.00 26.02 C ATOM 507 C ASN A 82 43.332 3.441 44.174 1.00 26.45 C ATOM 508 O ASN A 82 44.512 3.530 44.508 1.00 27.10 O ATOM 509 CB ASN A 82 42.696 3.475 46.644 1.00 24.18 C ATOM 510 CG ASN A 82 42.869 2.041 47.079 1.00 23.30 C ATOM 511 OD1 ASN A 82 42.524 1.085 46.359 1.00 22.20 O ATOM 512 ND2 ASN A 82 43.393 1.848 48.301 1.00 20.49 N ATOM 513 HD22 ASN A 82 43.673 2.664 48.882 1.00 0.00 H ATOM 514 HD21 ASN A 82 43.519 0.882 48.666 1.00 0.00 H ATOM 515 H ASN A 82 41.033 1.892 45.148 1.00 0.00 H ATOM 516 N GLY A 83 42.930 3.200 42.927 1.00 23.16 N ATOM 517 CA GLY A 83 43.823 2.947 41.814 1.00 24.56 C ATOM 518 C GLY A 83 44.589 4.166 41.349 1.00 25.55 C ATOM 519 O GLY A 83 44.595 5.215 41.991 1.00 25.40 O ATOM 520 H GLY A 83 41.907 3.193 42.740 1.00 0.00 H ATOM 521 N ARG A 84 45.266 4.025 40.230 1.00 27.73 N ATOM 522 CA ARG A 84 46.080 5.072 39.639 1.00 29.10 C ATOM 523 C ARG A 84 45.216 6.120 38.973 1.00 30.85 C ATOM 524 O ARG A 84 45.745 7.150 38.539 1.00 32.01 O ATOM 525 CB ARG A 84 46.953 4.458 38.523 1.00 28.25 C ATOM 526 CG ARG A 84 47.952 3.411 38.954 1.00 26.87 C ATOM 527 CD ARG A 84 48.555 2.810 37.719 1.00 26.44 C ATOM 528 NE ARG A 84 47.908 1.541 37.386 1.00 27.40 N ATOM 529 CZ ARG A 84 48.408 0.658 36.533 1.00 29.06 C ATOM 530 NH1 ARG A 84 49.563 0.895 35.922 1.00 29.30 N ATOM 531 NH2 ARG A 84 47.773 -0.477 36.302 1.00 27.78 N ATOM 532 HE ARG A 84 47.002 1.318 37.846 1.00 0.00 H ATOM 533 HH12 ARG A 84 49.950 0.199 35.254 1.00 0.00 H ATOM 534 HH11 ARG A 84 50.080 1.777 36.112 1.00 0.00 H ATOM 535 HH22 ARG A 84 48.169 -1.167 35.632 1.00 0.00 H ATOM 536 HH21 ARG A 84 46.877 -0.680 36.790 1.00 0.00 H ATOM 537 H ARG A 84 45.215 3.109 39.740 1.00 0.00 H ATOM 538 N GLY A 85 43.931 5.823 38.810 1.00 29.38 N ATOM 539 CA GLY A 85 43.006 6.688 38.101 1.00 30.51 C ATOM 540 C GLY A 85 43.100 6.377 36.620 1.00 31.57 C ATOM 541 O GLY A 85 44.210 6.248 36.101 1.00 31.83 O ATOM 542 H GLY A 85 43.572 4.932 39.208 1.00 0.00 H ATOM 543 N ILE A 86 41.947 6.220 35.924 1.00 33.84 N ATOM 544 CA ILE A 86 41.895 5.929 34.480 1.00 35.44 C ATOM 545 C ILE A 86 42.706 7.015 33.772 1.00 37.54 C ATOM 546 O ILE A 86 42.549 8.185 34.140 1.00 37.78 O ATOM 547 CB ILE A 86 40.451 5.898 33.941 1.00 36.78 C ATOM 548 CG1 ILE A 86 39.553 4.913 34.715 1.00 35.87 C ATOM 549 CG2 ILE A 86 40.466 5.614 32.435 1.00 36.26 C ATOM 550 CD1 ILE A 86 38.096 4.873 34.246 1.00 36.67 C ATOM 551 H ILE A 86 41.048 6.310 36.439 1.00 0.00 H ATOM 552 N PRO A 87 43.602 6.703 32.803 1.00 41.74 N ATOM 553 CA PRO A 87 44.375 7.780 32.170 1.00 43.70 C ATOM 554 C PRO A 87 43.467 8.871 31.619 1.00 45.70 C ATOM 555 O PRO A 87 42.444 8.628 30.979 1.00 45.94 O ATOM 556 CB PRO A 87 45.158 7.066 31.082 1.00 45.03 C ATOM 557 CG PRO A 87 45.198 5.670 31.495 1.00 44.29 C ATOM 558 CD PRO A 87 43.943 5.393 32.220 1.00 43.29 C ATOM 559 N VAL A 88 43.831 10.080 31.959 1.00 50.92 N ATOM 560 CA VAL A 88 43.152 11.317 31.614 1.00 53.24 C ATOM 561 C VAL A 88 43.780 11.944 30.345 1.00 55.07 C ATOM 562 O VAL A 88 43.111 12.675 29.622 1.00 55.43 O ATOM 563 CB VAL A 88 43.232 12.172 32.897 1.00 56.38 C ATOM 564 CG1 VAL A 88 43.676 13.601 32.650 1.00 56.79 C ATOM 565 CG2 VAL A 88 41.931 12.094 33.667 1.00 57.00 C ATOM 566 H VAL A 88 44.693 10.164 32.534 1.00 0.00 H ATOM 567 N ASP A 89 45.060 11.602 30.074 1.00 60.30 N ATOM 568 CA ASP A 89 45.873 12.046 28.941 1.00 62.34 C ATOM 569 C ASP A 89 45.290 11.579 27.607 1.00 62.90 C ATOM 570 O ASP A 89 44.948 10.406 27.444 1.00 62.82 O ATOM 571 CB ASP A 89 47.332 11.555 29.085 1.00 65.58 C ATOM 572 CG ASP A 89 47.976 11.768 30.454 1.00 68.06 C ATOM 573 OD1 ASP A 89 47.521 11.120 31.441 1.00 69.36 O ATOM 574 OD2 ASP A 89 48.944 12.560 30.538 1.00 70.67 O ATOM 575 H ASP A 89 45.517 10.952 30.745 1.00 0.00 H ATOM 576 N ILE A 90 45.194 12.524 26.665 1.00 63.90 N ATOM 577 CA ILE A 90 44.693 12.405 25.291 1.00 65.19 C ATOM 578 C ILE A 90 45.237 11.160 24.582 1.00 66.29 C ATOM 579 O ILE A 90 46.430 10.868 24.666 1.00 66.33 O ATOM 580 CB ILE A 90 45.105 13.701 24.514 1.00 67.35 C ATOM 581 CG1 ILE A 90 44.576 15.001 25.198 1.00 67.16 C ATOM 582 CG2 ILE A 90 44.750 13.651 23.028 1.00 66.97 C ATOM 583 CD1 ILE A 90 43.062 15.280 25.168 1.00 66.22 C ATOM 584 H ILE A 90 45.519 13.472 26.944 1.00 0.00 H ATOM 585 N GLN A 91 44.365 10.447 23.872 1.00 68.06 N ATOM 586 CA GLN A 91 44.739 9.273 23.088 1.00 69.27 C ATOM 587 C GLN A 91 45.310 9.868 21.790 1.00 69.66 C ATOM 588 O GLN A 91 44.553 10.443 21.009 1.00 69.72 O ATOM 589 CB GLN A 91 43.481 8.421 22.798 1.00 71.48 C ATOM 590 CG GLN A 91 43.750 7.057 22.172 1.00 71.48 C ATOM 591 CD GLN A 91 43.790 5.926 23.178 1.00 71.48 C ATOM 592 OE1 GLN A 91 43.491 6.105 24.366 1.00 71.48 O ATOM 593 NE2 GLN A 91 44.165 4.727 22.722 1.00 71.48 N ATOM 594 HE22 GLN A 91 44.411 4.606 21.719 1.00 0.00 H ATOM 595 HE21 GLN A 91 44.211 3.915 23.370 1.00 0.00 H ATOM 596 H GLN A 91 43.367 10.741 23.876 1.00 0.00 H ATOM 597 N GLU A 92 46.639 9.765 21.569 1.00 69.74 N ATOM 598 CA GLU A 92 47.287 10.323 20.370 1.00 70.08 C ATOM 599 C GLU A 92 46.679 9.818 19.040 1.00 69.78 C ATOM 600 O GLU A 92 46.986 10.388 17.986 1.00 69.66 O ATOM 601 CB GLU A 92 48.811 10.119 20.405 1.00 71.32 C ATOM 602 H GLU A 92 47.227 9.273 22.272 1.00 0.00 H ATOM 603 N LYS A 93 45.790 8.788 19.100 1.00 68.68 N ATOM 604 CA LYS A 93 45.116 8.191 17.939 1.00 68.27 C ATOM 605 C LYS A 93 43.631 8.605 17.768 1.00 68.38 C ATOM 606 O LYS A 93 43.107 8.556 16.645 1.00 68.40 O ATOM 607 CB LYS A 93 45.262 6.652 17.954 1.00 70.26 C ATOM 608 CG LYS A 93 44.296 5.886 18.870 1.00 70.26 C ATOM 609 CD LYS A 93 44.668 4.411 19.052 1.00 70.26 C ATOM 610 CE LYS A 93 44.162 3.519 17.943 1.00 70.26 C ATOM 611 NZ LYS A 93 43.482 2.321 18.479 1.00 70.26 N ATOM 612 HZ1 LYS A 93 44.150 1.776 19.062 1.00 0.00 H ATOM 613 HZ2 LYS A 93 42.672 2.615 19.061 1.00 0.00 H ATOM 614 HZ3 LYS A 93 43.148 1.732 17.690 1.00 0.00 H ATOM 615 H LYS A 93 45.572 8.395 20.038 1.00 0.00 H ATOM 616 N MET A 94 42.955 8.981 18.874 1.00 68.43 N ATOM 617 CA MET A 94 41.541 9.372 18.848 1.00 68.17 C ATOM 618 C MET A 94 41.323 10.852 19.203 1.00 67.54 C ATOM 619 O MET A 94 40.254 11.409 18.938 1.00 67.38 O ATOM 620 CB MET A 94 40.709 8.445 19.742 1.00 70.92 C ATOM 621 CG MET A 94 40.566 7.057 19.178 1.00 72.03 C ATOM 622 SD MET A 94 38.834 6.540 19.083 1.00 75.63 S ATOM 623 CE MET A 94 38.915 5.421 17.680 1.00 74.06 C ATOM 624 H MET A 94 43.458 8.994 19.784 1.00 0.00 H ATOM 625 N GLY A 95 42.344 11.465 19.797 1.00 64.88 N ATOM 626 CA GLY A 95 42.338 12.865 20.196 1.00 63.88 C ATOM 627 C GLY A 95 41.624 13.155 21.495 1.00 63.11 C ATOM 628 O GLY A 95 41.925 14.159 22.144 1.00 63.38 O ATOM 629 H GLY A 95 43.201 10.908 19.988 1.00 0.00 H ATOM 630 N ARG A 96 40.671 12.293 21.880 1.00 59.26 N ATOM 631 CA ARG A 96 39.886 12.456 23.105 1.00 58.28 C ATOM 632 C ARG A 96 40.660 11.916 24.319 1.00 56.90 C ATOM 633 O ARG A 96 41.501 11.039 24.115 1.00 56.79 O ATOM 634 CB ARG A 96 38.496 11.771 22.969 1.00 59.30 C ATOM 635 CG ARG A 96 37.700 12.083 21.677 1.00 60.96 C ATOM 636 CD ARG A 96 37.619 13.564 21.285 1.00 63.17 C ATOM 637 NE ARG A 96 36.690 14.332 22.120 1.00 63.89 N ATOM 638 CZ ARG A 96 37.025 15.365 22.892 1.00 64.28 C ATOM 639 NH1 ARG A 96 38.289 15.773 22.960 1.00 64.76 N ATOM 640 NH2 ARG A 96 36.102 15.994 23.606 1.00 64.45 N ATOM 641 HE ARG A 96 35.690 14.048 22.109 1.00 0.00 H ATOM 642 HH12 ARG A 96 38.543 16.580 23.565 1.00 0.00 H ATOM 643 HH11 ARG A 96 39.023 15.285 22.408 1.00 0.00 H ATOM 644 HH22 ARG A 96 36.369 16.800 24.207 1.00 0.00 H ATOM 645 HH21 ARG A 96 35.111 15.682 23.565 1.00 0.00 H ATOM 646 H ARG A 96 40.480 11.467 21.278 1.00 0.00 H ATOM 647 N PRO A 97 40.419 12.394 25.575 1.00 51.85 N ATOM 648 CA PRO A 97 41.149 11.837 26.728 1.00 50.64 C ATOM 649 C PRO A 97 40.845 10.344 26.900 1.00 49.52 C ATOM 650 O PRO A 97 39.737 9.899 26.600 1.00 49.70 O ATOM 651 CB PRO A 97 40.623 12.661 27.904 1.00 51.64 C ATOM 652 CG PRO A 97 40.089 13.895 27.303 1.00 52.13 C ATOM 653 CD PRO A 97 39.475 13.432 26.023 1.00 52.88 C ATOM 654 N ALA A 98 41.837 9.566 27.347 1.00 49.45 N ATOM 655 CA ALA A 98 41.697 8.120 27.514 1.00 47.84 C ATOM 656 C ALA A 98 40.469 7.703 28.315 1.00 46.72 C ATOM 657 O ALA A 98 39.816 6.752 27.895 1.00 46.67 O ATOM 658 CB ALA A 98 42.961 7.513 28.093 1.00 48.45 C ATOM 659 H ALA A 98 42.747 10.009 27.586 1.00 0.00 H ATOM 660 N VAL A 99 40.122 8.430 29.423 1.00 44.26 N ATOM 661 CA VAL A 99 38.938 8.151 30.265 1.00 42.98 C ATOM 662 C VAL A 99 37.632 8.320 29.463 1.00 42.31 C ATOM 663 O VAL A 99 36.682 7.571 29.663 1.00 41.79 O ATOM 664 CB VAL A 99 38.932 8.933 31.607 1.00 46.42 C ATOM 665 CG1 VAL A 99 38.763 10.435 31.399 1.00 45.91 C ATOM 666 CG2 VAL A 99 37.881 8.389 32.579 1.00 46.27 C ATOM 667 H VAL A 99 40.731 9.230 29.690 1.00 0.00 H ATOM 668 N GLU A 100 37.608 9.282 28.540 1.00 41.92 N ATOM 669 CA GLU A 100 36.452 9.514 27.698 1.00 41.54 C ATOM 670 C GLU A 100 36.313 8.308 26.775 1.00 41.24 C ATOM 671 O GLU A 100 35.209 7.800 26.632 1.00 40.53 O ATOM 672 CB GLU A 100 36.610 10.839 26.924 1.00 43.77 C ATOM 673 CG GLU A 100 35.309 11.435 26.403 1.00 43.74 C ATOM 674 CD GLU A 100 35.464 12.733 25.627 1.00 44.48 C ATOM 675 OE1 GLU A 100 35.903 13.748 26.226 1.00 45.26 O ATOM 676 OE2 GLU A 100 35.137 12.735 24.415 1.00 44.04 O ATOM 677 H GLU A 100 38.447 9.886 28.421 1.00 0.00 H ATOM 678 N VAL A 101 37.451 7.809 26.225 1.00 42.01 N ATOM 679 CA VAL A 101 37.540 6.653 25.300 1.00 42.18 C ATOM 680 C VAL A 101 36.922 5.352 25.875 1.00 41.87 C ATOM 681 O VAL A 101 35.937 4.883 25.294 1.00 41.48 O ATOM 682 CB VAL A 101 38.961 6.389 24.728 1.00 45.96 C ATOM 683 CG1 VAL A 101 38.934 5.255 23.707 1.00 46.57 C ATOM 684 CG2 VAL A 101 39.563 7.657 24.111 1.00 46.39 C ATOM 685 H VAL A 101 38.343 8.282 26.476 1.00 0.00 H ATOM 686 N ILE A 102 37.467 4.767 26.977 1.00 41.00 N ATOM 687 CA ILE A 102 36.879 3.525 27.540 1.00 41.43 C ATOM 688 C ILE A 102 35.375 3.620 27.827 1.00 41.46 C ATOM 689 O ILE A 102 34.646 2.639 27.605 1.00 41.46 O ATOM 690 CB ILE A 102 37.595 2.954 28.778 1.00 44.72 C ATOM 691 CG1 ILE A 102 38.232 4.044 29.645 1.00 44.72 C ATOM 692 CG2 ILE A 102 38.588 1.901 28.376 1.00 44.72 C ATOM 693 CD1 ILE A 102 37.329 4.637 30.681 1.00 44.72 C ATOM 694 H ILE A 102 38.302 5.193 27.428 1.00 0.00 H ATOM 695 N LEU A 103 34.933 4.794 28.336 1.00 38.74 N ATOM 696 CA LEU A 103 33.555 5.059 28.711 1.00 38.19 C ATOM 697 C LEU A 103 32.618 5.262 27.531 1.00 38.57 C ATOM 698 O LEU A 103 31.415 5.030 27.678 1.00 38.80 O ATOM 699 CB LEU A 103 33.483 6.248 29.675 1.00 36.92 C ATOM 700 CG LEU A 103 33.997 6.041 31.086 1.00 34.89 C ATOM 701 CD1 LEU A 103 34.096 7.327 31.789 1.00 32.65 C ATOM 702 CD2 LEU A 103 33.073 5.181 31.885 1.00 35.02 C ATOM 703 H LEU A 103 35.627 5.558 28.467 1.00 0.00 H ATOM 704 N THR A 104 33.158 5.696 26.361 1.00 40.96 N ATOM 705 CA THR A 104 32.367 5.974 25.137 1.00 41.48 C ATOM 706 C THR A 104 32.551 4.926 24.010 1.00 42.35 C ATOM 707 O THR A 104 31.547 4.450 23.489 1.00 42.67 O ATOM 708 CB THR A 104 32.613 7.398 24.632 1.00 34.24 C ATOM 709 OG1 THR A 104 33.977 7.526 24.248 1.00 33.13 O ATOM 710 CG2 THR A 104 32.253 8.463 25.684 1.00 34.65 C ATOM 711 HG1 THR A 104 34.557 7.344 25.029 1.00 0.00 H ATOM 712 H THR A 104 34.187 5.842 26.322 1.00 0.00 H ATOM 713 N VAL A 105 33.790 4.568 23.636 1.00 42.48 N ATOM 714 CA VAL A 105 34.010 3.570 22.588 1.00 43.49 C ATOM 715 C VAL A 105 33.606 2.204 23.136 1.00 44.41 C ATOM 716 O VAL A 105 34.073 1.812 24.199 1.00 44.18 O ATOM 717 CB VAL A 105 35.450 3.595 22.018 1.00 46.36 C ATOM 718 CG1 VAL A 105 35.753 2.340 21.197 1.00 46.02 C ATOM 719 CG2 VAL A 105 35.684 4.851 21.190 1.00 46.14 C ATOM 720 H VAL A 105 34.610 5.009 24.100 1.00 0.00 H ATOM 721 N LEU A 106 32.716 1.503 22.433 1.00 47.47 N ATOM 722 CA LEU A 106 32.242 0.192 22.857 1.00 48.86 C ATOM 723 C LEU A 106 33.370 -0.809 22.934 1.00 49.72 C ATOM 724 O LEU A 106 34.296 -0.768 22.108 1.00 49.91 O ATOM 725 CB LEU A 106 31.148 -0.326 21.920 1.00 48.93 C ATOM 726 CG LEU A 106 30.157 -1.293 22.551 1.00 48.96 C ATOM 727 CD1 LEU A 106 29.181 -0.552 23.501 1.00 50.90 C ATOM 728 CD2 LEU A 106 29.383 -2.041 21.484 1.00 48.25 C ATOM 729 H LEU A 106 32.346 1.907 21.549 1.00 0.00 H ATOM 730 N HIS A 107 33.295 -1.683 23.952 1.00 50.86 N ATOM 731 CA HIS A 107 34.228 -2.761 24.266 1.00 51.83 C ATOM 732 C HIS A 107 35.691 -2.359 24.496 1.00 52.25 C ATOM 733 O HIS A 107 36.518 -3.259 24.642 1.00 52.27 O ATOM 734 CB HIS A 107 34.186 -3.856 23.189 1.00 54.08 C ATOM 735 CG HIS A 107 32.840 -4.442 22.913 1.00 55.75 C ATOM 736 ND1 HIS A 107 32.019 -4.884 23.935 1.00 56.48 N ATOM 737 CD2 HIS A 107 32.239 -4.693 21.725 1.00 56.18 C ATOM 738 CE1 HIS A 107 30.939 -5.367 23.341 1.00 56.87 C ATOM 739 NE2 HIS A 107 31.021 -5.267 22.012 1.00 56.09 N ATOM 740 H HIS A 107 32.479 -1.580 24.589 1.00 0.00 H ATOM 741 N ALA A 108 36.023 -1.058 24.546 1.00 50.02 N ATOM 742 CA ALA A 108 37.404 -0.581 24.734 1.00 50.40 C ATOM 743 C ALA A 108 38.167 -1.201 25.951 1.00 50.81 C ATOM 744 O ALA A 108 37.704 -1.168 27.093 1.00 50.16 O ATOM 745 CB ALA A 108 37.445 0.944 24.792 1.00 50.91 C ATOM 746 H ALA A 108 35.266 -0.352 24.447 1.00 0.00 H ATOM 747 N GLY A 109 39.317 -1.794 25.647 1.00 50.10 N ATOM 748 CA GLY A 109 40.210 -2.416 26.613 1.00 51.54 C ATOM 749 C GLY A 109 39.953 -3.870 26.928 1.00 52.80 C ATOM 750 O GLY A 109 40.111 -4.267 28.083 1.00 52.73 O ATOM 751 H GLY A 109 39.599 -1.815 24.646 1.00 0.00 H ATOM 752 N GLY A 110 39.589 -4.667 25.927 1.00 52.24 N ATOM 753 CA GLY A 110 39.331 -6.085 26.153 1.00 53.57 C ATOM 754 C GLY A 110 38.920 -6.832 24.910 1.00 54.64 C ATOM 755 O GLY A 110 39.504 -6.604 23.842 1.00 54.78 O ATOM 756 H GLY A 110 39.487 -4.274 24.970 1.00 0.00 H ATOM 757 N LYS A 111 37.914 -7.751 25.050 1.00 53.33 N ATOM 758 CA LYS A 111 37.348 -8.568 23.956 1.00 53.87 C ATOM 759 C LYS A 111 35.918 -9.076 24.273 1.00 54.07 C ATOM 760 O LYS A 111 35.052 -9.147 23.394 1.00 54.49 O ATOM 761 CB LYS A 111 38.287 -9.728 23.579 1.00 56.26 C ATOM 762 H LYS A 111 37.517 -7.885 26.002 1.00 0.00 H TER 763 LYS A 111 ATOM 764 N GLY A 125 32.620 -10.421 30.974 1.00 69.42 N ATOM 765 CA GLY A 125 33.398 -9.190 30.849 1.00 69.83 C ATOM 766 C GLY A 125 33.178 -8.487 29.523 1.00 69.88 C ATOM 767 O GLY A 125 33.736 -8.914 28.508 1.00 70.00 O ATOM 768 HN3 GLY A 125 32.891 -11.079 30.216 1.00 0.00 H ATOM 769 HN2 GLY A 125 31.607 -10.199 30.896 1.00 0.00 H ATOM 770 HN1 GLY A 125 32.810 -10.857 31.899 1.00 0.00 H ATOM 771 N VAL A 126 32.368 -7.395 29.517 1.00 64.40 N ATOM 772 CA VAL A 126 32.001 -6.654 28.300 1.00 63.75 C ATOM 773 C VAL A 126 32.562 -5.193 28.224 1.00 63.12 C ATOM 774 O VAL A 126 32.951 -4.773 27.135 1.00 63.10 O ATOM 775 CB VAL A 126 30.458 -6.719 28.099 1.00 67.49 C ATOM 776 CG1 VAL A 126 29.689 -6.021 29.220 1.00 67.09 C ATOM 777 CG2 VAL A 126 30.026 -6.241 26.715 1.00 67.48 C ATOM 778 H VAL A 126 31.985 -7.064 30.426 1.00 0.00 H ATOM 779 N GLY A 127 32.596 -4.452 29.336 1.00 56.28 N ATOM 780 CA GLY A 127 33.123 -3.087 29.356 1.00 54.88 C ATOM 781 C GLY A 127 32.298 -2.044 30.089 1.00 54.15 C ATOM 782 O GLY A 127 31.067 -2.106 30.084 1.00 54.27 O ATOM 783 H GLY A 127 32.234 -4.861 30.221 1.00 0.00 H ATOM 784 N SER A 128 32.979 -1.056 30.710 1.00 46.70 N ATOM 785 CA SER A 128 32.362 0.053 31.442 1.00 45.54 C ATOM 786 C SER A 128 31.509 0.952 30.525 1.00 45.52 C ATOM 787 O SER A 128 30.643 1.682 31.008 1.00 45.71 O ATOM 788 CB SER A 128 33.432 0.884 32.138 1.00 45.09 C ATOM 789 OG SER A 128 34.231 1.552 31.183 1.00 45.09 O ATOM 790 HG SER A 128 34.921 2.088 31.649 1.00 0.00 H ATOM 791 H SER A 128 34.018 -1.085 30.665 1.00 0.00 H ATOM 792 N SER A 129 31.768 0.893 29.207 1.00 43.20 N ATOM 793 CA SER A 129 31.075 1.636 28.154 1.00 42.53 C ATOM 794 C SER A 129 29.639 1.160 27.993 1.00 42.46 C ATOM 795 O SER A 129 28.771 1.967 27.665 1.00 42.80 O ATOM 796 CB SER A 129 31.804 1.468 26.830 1.00 44.41 C ATOM 797 OG SER A 129 31.975 0.100 26.501 1.00 45.43 O ATOM 798 HG SER A 129 32.451 0.027 25.636 1.00 0.00 H ATOM 799 H SER A 129 32.535 0.258 28.907 1.00 0.00 H ATOM 800 N VAL A 130 29.388 -0.152 28.196 1.00 40.35 N ATOM 801 CA VAL A 130 28.048 -0.724 28.076 1.00 39.77 C ATOM 802 C VAL A 130 27.240 -0.250 29.264 1.00 38.89 C ATOM 803 O VAL A 130 26.077 0.114 29.088 1.00 39.12 O ATOM 804 CB VAL A 130 27.960 -2.268 27.788 1.00 43.72 C ATOM 805 CG1 VAL A 130 29.264 -2.832 27.215 1.00 44.06 C ATOM 806 CG2 VAL A 130 27.462 -3.084 28.984 1.00 43.20 C ATOM 807 H VAL A 130 30.179 -0.779 28.447 1.00 0.00 H ATOM 808 N VAL A 131 27.880 -0.189 30.462 1.00 37.39 N ATOM 809 CA VAL A 131 27.268 0.313 31.705 1.00 36.41 C ATOM 810 C VAL A 131 26.945 1.777 31.464 1.00 35.60 C ATOM 811 O VAL A 131 25.971 2.268 32.018 1.00 35.33 O ATOM 812 CB VAL A 131 28.140 0.119 32.982 1.00 39.04 C ATOM 813 CG1 VAL A 131 27.390 0.559 34.234 1.00 39.21 C ATOM 814 CG2 VAL A 131 28.608 -1.330 33.131 1.00 39.13 C ATOM 815 H VAL A 131 28.866 -0.518 30.504 1.00 0.00 H ATOM 816 N ASN A 132 27.732 2.462 30.608 1.00 36.61 N ATOM 817 CA ASN A 132 27.478 3.848 30.263 1.00 36.02 C ATOM 818 C ASN A 132 26.234 3.926 29.402 1.00 36.36 C ATOM 819 O ASN A 132 25.232 4.470 29.869 1.00 36.58 O ATOM 820 CB ASN A 132 28.657 4.510 29.557 1.00 31.53 C ATOM 821 CG ASN A 132 28.563 6.016 29.525 1.00 30.12 C ATOM 822 OD1 ASN A 132 27.560 6.626 29.931 1.00 30.09 O ATOM 823 ND2 ASN A 132 29.612 6.664 29.052 1.00 28.25 N ATOM 824 HD22 ASN A 132 30.442 6.135 28.717 1.00 0.00 H ATOM 825 HD21 ASN A 132 29.608 7.703 29.015 1.00 0.00 H ATOM 826 H ASN A 132 28.549 1.980 30.181 1.00 0.00 H ATOM 827 N ALA A 133 26.270 3.371 28.168 1.00 38.44 N ATOM 828 CA ALA A 133 25.147 3.397 27.236 1.00 38.43 C ATOM 829 C ALA A 133 23.857 2.913 27.864 1.00 38.68 C ATOM 830 O ALA A 133 22.798 3.433 27.536 1.00 39.28 O ATOM 831 CB ALA A 133 25.474 2.598 25.997 1.00 39.33 C ATOM 832 H ALA A 133 27.147 2.900 27.867 1.00 0.00 H ATOM 833 N LEU A 134 23.937 1.968 28.805 1.00 39.32 N ATOM 834 CA LEU A 134 22.767 1.448 29.512 1.00 38.95 C ATOM 835 C LEU A 134 22.314 2.282 30.741 1.00 38.73 C ATOM 836 O LEU A 134 21.448 1.811 31.481 1.00 38.81 O ATOM 837 CB LEU A 134 23.040 -0.003 29.922 1.00 39.81 C ATOM 838 CG LEU A 134 22.352 -1.119 29.140 1.00 40.63 C ATOM 839 CD1 LEU A 134 22.161 -0.773 27.644 1.00 41.04 C ATOM 840 CD2 LEU A 134 23.103 -2.430 29.339 1.00 39.87 C ATOM 841 H LEU A 134 24.873 1.585 29.046 1.00 0.00 H ATOM 842 N SER A 135 22.878 3.497 30.957 1.00 37.82 N ATOM 843 CA SER A 135 22.531 4.390 32.079 1.00 37.90 C ATOM 844 C SER A 135 21.973 5.726 31.604 1.00 38.49 C ATOM 845 O SER A 135 22.565 6.348 30.715 1.00 38.84 O ATOM 846 CB SER A 135 23.752 4.673 32.947 1.00 38.64 C ATOM 847 OG SER A 135 24.188 3.516 33.633 1.00 38.95 O ATOM 848 HG SER A 135 24.428 2.815 32.976 1.00 0.00 H ATOM 849 H SER A 135 23.604 3.821 30.286 1.00 0.00 H ATOM 850 N GLN A 136 20.874 6.206 32.209 1.00 38.44 N ATOM 851 CA GLN A 136 20.305 7.527 31.846 1.00 38.27 C ATOM 852 C GLN A 136 21.284 8.672 32.234 1.00 38.04 C ATOM 853 O GLN A 136 21.326 9.700 31.569 1.00 38.13 O ATOM 854 CB GLN A 136 18.885 7.762 32.429 1.00 38.96 C ATOM 855 CG GLN A 136 18.804 7.462 33.906 1.00 39.22 C ATOM 856 CD GLN A 136 17.572 7.969 34.567 1.00 39.88 C ATOM 857 OE1 GLN A 136 16.477 7.451 34.347 1.00 38.94 O ATOM 858 NE2 GLN A 136 17.738 8.972 35.421 1.00 40.96 N ATOM 859 HE22 GLN A 136 18.685 9.375 35.572 1.00 0.00 H ATOM 860 HE21 GLN A 136 16.921 9.354 35.939 1.00 0.00 H ATOM 861 H GLN A 136 20.412 5.639 32.948 1.00 0.00 H ATOM 862 N ASP A 137 22.074 8.463 33.288 1.00 35.46 N ATOM 863 CA ASP A 137 23.079 9.402 33.772 1.00 35.43 C ATOM 864 C ASP A 137 24.336 8.700 34.285 1.00 34.93 C ATOM 865 O ASP A 137 24.248 7.651 34.934 1.00 35.30 O ATOM 866 CB ASP A 137 22.492 10.335 34.822 1.00 37.28 C ATOM 867 CG ASP A 137 21.781 11.506 34.200 1.00 38.93 C ATOM 868 OD1 ASP A 137 22.469 12.377 33.626 1.00 42.19 O ATOM 869 OD2 ASP A 137 20.535 11.556 34.287 1.00 41.27 O ATOM 870 H ASP A 137 21.965 7.565 33.802 1.00 0.00 H ATOM 871 N LEU A 138 25.507 9.267 33.965 1.00 32.99 N ATOM 872 CA LEU A 138 26.783 8.705 34.417 1.00 31.74 C ATOM 873 C LEU A 138 27.850 9.787 34.663 1.00 31.25 C ATOM 874 O LEU A 138 28.045 10.674 33.852 1.00 30.28 O ATOM 875 CB LEU A 138 27.301 7.581 33.491 1.00 32.01 C ATOM 876 CG LEU A 138 28.402 6.675 34.055 1.00 29.98 C ATOM 877 CD1 LEU A 138 28.230 5.261 33.579 1.00 26.03 C ATOM 878 CD2 LEU A 138 29.793 7.186 33.679 1.00 27.25 C ATOM 879 H LEU A 138 25.511 10.128 33.381 1.00 0.00 H ATOM 880 N GLU A 139 28.527 9.686 35.791 1.00 28.21 N ATOM 881 CA GLU A 139 29.570 10.603 36.161 1.00 28.78 C ATOM 882 C GLU A 139 30.876 9.863 36.356 1.00 28.47 C ATOM 883 O GLU A 139 30.873 8.694 36.729 1.00 28.65 O ATOM 884 CB GLU A 139 29.193 11.282 37.461 1.00 31.41 C ATOM 885 CG GLU A 139 28.290 12.484 37.311 1.00 34.26 C ATOM 886 CD GLU A 139 27.599 12.791 38.621 1.00 38.34 C ATOM 887 OE1 GLU A 139 28.275 12.731 39.681 1.00 37.49 O ATOM 888 OE2 GLU A 139 26.375 13.077 38.588 1.00 40.55 O ATOM 889 H GLU A 139 28.296 8.908 36.441 1.00 0.00 H ATOM 890 N VAL A 140 31.999 10.555 36.115 1.00 26.76 N ATOM 891 CA VAL A 140 33.350 10.012 36.291 1.00 26.71 C ATOM 892 C VAL A 140 34.237 11.061 37.003 1.00 26.99 C ATOM 893 O VAL A 140 34.234 12.240 36.643 1.00 27.00 O ATOM 894 CB VAL A 140 33.980 9.390 35.001 1.00 29.20 C ATOM 895 CG1 VAL A 140 34.236 10.419 33.900 1.00 29.85 C ATOM 896 CG2 VAL A 140 35.236 8.575 35.320 1.00 29.26 C ATOM 897 H VAL A 140 31.906 11.536 35.783 1.00 0.00 H ATOM 898 N TYR A 141 34.929 10.616 38.063 1.00 28.37 N ATOM 899 CA TYR A 141 35.825 11.449 38.847 1.00 29.04 C ATOM 900 C TYR A 141 37.142 10.689 39.030 1.00 29.59 C ATOM 901 O TYR A 141 37.256 9.827 39.909 1.00 29.11 O ATOM 902 CB TYR A 141 35.227 11.860 40.214 1.00 28.93 C ATOM 903 CG TYR A 141 33.922 12.619 40.154 1.00 29.50 C ATOM 904 CD1 TYR A 141 32.706 11.948 40.056 1.00 30.35 C ATOM 905 CD2 TYR A 141 33.894 14.008 40.262 1.00 29.15 C ATOM 906 CE1 TYR A 141 31.502 12.640 39.986 1.00 29.86 C ATOM 907 CE2 TYR A 141 32.693 14.714 40.217 1.00 29.31 C ATOM 908 CZ TYR A 141 31.497 14.023 40.075 1.00 29.62 C ATOM 909 OH TYR A 141 30.302 14.708 40.034 1.00 28.84 O ATOM 910 HH TYR A 141 29.557 14.064 39.930 1.00 0.00 H ATOM 911 H TYR A 141 34.818 9.619 38.339 1.00 0.00 H ATOM 912 N VAL A 142 38.126 11.008 38.174 1.00 32.21 N ATOM 913 CA VAL A 142 39.474 10.442 38.232 1.00 33.80 C ATOM 914 C VAL A 142 40.339 11.332 39.153 1.00 34.96 C ATOM 915 O VAL A 142 40.382 12.551 38.987 1.00 35.14 O ATOM 916 CB VAL A 142 40.102 10.300 36.813 1.00 36.71 C ATOM 917 CG1 VAL A 142 41.572 9.936 36.887 1.00 37.25 C ATOM 918 CG2 VAL A 142 39.350 9.274 35.971 1.00 37.40 C ATOM 919 H VAL A 142 37.918 11.699 37.425 1.00 0.00 H ATOM 920 N HIS A 143 41.016 10.716 40.119 1.00 38.73 N ATOM 921 CA HIS A 143 41.958 11.379 41.024 1.00 40.46 C ATOM 922 C HIS A 143 43.367 10.974 40.534 1.00 41.78 C ATOM 923 O HIS A 143 43.778 9.798 40.602 1.00 42.03 O ATOM 924 CB HIS A 143 41.713 10.994 42.487 1.00 39.92 C ATOM 925 CG HIS A 143 40.471 11.596 43.056 1.00 39.54 C ATOM 926 ND1 HIS A 143 39.297 11.654 42.330 1.00 39.29 N ATOM 927 CD2 HIS A 143 40.255 12.125 44.279 1.00 39.26 C ATOM 928 CE1 HIS A 143 38.415 12.233 43.126 1.00 39.82 C ATOM 929 NE2 HIS A 143 38.953 12.547 44.302 1.00 38.85 N ATOM 930 H HIS A 143 40.866 9.694 40.240 1.00 0.00 H ATOM 931 N ARG A 144 44.056 11.958 39.957 1.00 44.97 N ATOM 932 CA ARG A 144 45.380 11.848 39.361 1.00 46.23 C ATOM 933 C ARG A 144 45.972 13.261 39.322 1.00 46.08 C ATOM 934 O ARG A 144 45.227 14.233 39.125 1.00 47.05 O ATOM 935 CB ARG A 144 45.214 11.331 37.921 1.00 49.35 C ATOM 936 CG ARG A 144 46.143 10.206 37.514 1.00 52.79 C ATOM 937 CD ARG A 144 45.897 9.840 36.063 1.00 59.22 C ATOM 938 NE ARG A 144 46.275 8.463 35.745 1.00 63.63 N ATOM 939 CZ ARG A 144 47.284 8.123 34.950 1.00 67.05 C ATOM 940 NH1 ARG A 144 48.047 9.059 34.393 1.00 68.53 N ATOM 941 NH2 ARG A 144 47.538 6.844 34.701 1.00 67.66 N ATOM 942 HE ARG A 144 45.715 7.697 36.171 1.00 0.00 H ATOM 943 HH12 ARG A 144 48.835 8.786 33.772 1.00 0.00 H ATOM 944 HH11 ARG A 144 47.856 10.064 34.579 1.00 0.00 H ATOM 945 HH22 ARG A 144 48.329 6.583 34.078 1.00 0.00 H ATOM 946 HH21 ARG A 144 46.946 6.103 35.129 1.00 0.00 H ATOM 947 H ARG A 144 43.605 12.895 39.930 1.00 0.00 H ATOM 948 N ASN A 145 47.302 13.377 39.495 1.00 45.52 N ATOM 949 CA ASN A 145 48.082 14.635 39.454 1.00 44.71 C ATOM 950 C ASN A 145 47.577 15.648 40.459 1.00 44.09 C ATOM 951 O ASN A 145 47.407 16.821 40.135 1.00 44.43 O ATOM 952 CB ASN A 145 48.154 15.226 38.021 1.00 44.52 C ATOM 953 CG ASN A 145 48.339 14.198 36.919 1.00 45.39 C ATOM 954 OD1 ASN A 145 47.625 14.233 35.904 1.00 46.16 O ATOM 955 ND2 ASN A 145 49.284 13.246 37.083 1.00 45.62 N ATOM 956 HD22 ASN A 145 49.870 13.237 37.942 1.00 0.00 H ATOM 957 HD21 ASN A 145 49.425 12.522 36.350 1.00 0.00 H ATOM 958 H ASN A 145 47.832 12.500 39.674 1.00 0.00 H ATOM 959 N GLU A 146 47.307 15.165 41.688 1.00 44.28 N ATOM 960 CA GLU A 146 46.775 15.914 42.834 1.00 43.84 C ATOM 961 C GLU A 146 45.520 16.754 42.469 1.00 43.13 C ATOM 962 O GLU A 146 45.224 17.704 43.178 1.00 43.05 O ATOM 963 CB GLU A 146 47.876 16.753 43.519 1.00 44.82 C ATOM 964 H GLU A 146 47.496 14.154 41.841 1.00 0.00 H ATOM 965 N THR A 147 44.795 16.395 41.362 1.00 41.24 N ATOM 966 CA THR A 147 43.595 17.075 40.830 1.00 40.51 C ATOM 967 C THR A 147 42.432 16.091 40.519 1.00 39.65 C ATOM 968 O THR A 147 42.686 14.901 40.377 1.00 39.74 O ATOM 969 CB THR A 147 43.956 17.904 39.569 1.00 50.79 C ATOM 970 OG1 THR A 147 44.501 17.055 38.569 1.00 50.37 O ATOM 971 CG2 THR A 147 44.935 19.051 39.854 1.00 51.70 C ATOM 972 HG1 THR A 147 45.318 16.619 38.918 1.00 0.00 H ATOM 973 H THR A 147 45.124 15.556 40.842 1.00 0.00 H ATOM 974 N ILE A 148 41.169 16.581 40.396 1.00 34.60 N ATOM 975 CA ILE A 148 40.000 15.738 40.094 1.00 33.69 C ATOM 976 C ILE A 148 39.474 15.977 38.684 1.00 34.01 C ATOM 977 O ILE A 148 38.905 17.036 38.428 1.00 33.87 O ATOM 978 CB ILE A 148 38.860 15.934 41.134 1.00 34.83 C ATOM 979 CG1 ILE A 148 39.343 15.553 42.555 1.00 33.49 C ATOM 980 CG2 ILE A 148 37.603 15.128 40.705 1.00 34.49 C ATOM 981 CD1 ILE A 148 38.502 15.873 43.651 1.00 31.25 C ATOM 982 H ILE A 148 41.022 17.603 40.522 1.00 0.00 H ATOM 983 N TYR A 149 39.622 15.026 37.773 1.00 32.71 N ATOM 984 CA TYR A 149 39.084 15.240 36.421 1.00 33.45 C ATOM 985 C TYR A 149 37.678 14.659 36.397 1.00 32.87 C ATOM 986 O TYR A 149 37.454 13.542 36.853 1.00 32.96 O ATOM 987 CB TYR A 149 39.978 14.644 35.310 1.00 35.09 C ATOM 988 CG TYR A 149 41.413 15.130 35.373 1.00 37.83 C ATOM 989 CD1 TYR A 149 42.309 14.615 36.317 1.00 40.01 C ATOM 990 CD2 TYR A 149 41.881 16.100 34.490 1.00 39.84 C ATOM 991 CE1 TYR A 149 43.624 15.068 36.388 1.00 41.69 C ATOM 992 CE2 TYR A 149 43.193 16.570 34.563 1.00 41.76 C ATOM 993 CZ TYR A 149 44.058 16.059 35.519 1.00 42.94 C ATOM 994 OH TYR A 149 45.349 16.525 35.594 1.00 44.17 O ATOM 995 HH TYR A 149 45.825 16.058 36.325 1.00 0.00 H ATOM 996 H TYR A 149 40.112 14.140 38.011 1.00 0.00 H ATOM 997 N HIS A 150 36.728 15.427 35.899 1.00 32.36 N ATOM 998 CA HIS A 150 35.343 15.011 35.836 1.00 31.98 C ATOM 999 C HIS A 150 34.747 15.126 34.430 1.00 31.38 C ATOM 1000 O HIS A 150 35.169 15.951 33.616 1.00 31.04 O ATOM 1001 CB HIS A 150 34.521 15.786 36.886 1.00 32.38 C ATOM 1002 CG HIS A 150 33.030 15.606 36.813 1.00 33.68 C ATOM 1003 ND1 HIS A 150 32.443 14.342 36.765 1.00 35.30 N ATOM 1004 CD2 HIS A 150 32.050 16.540 36.796 1.00 34.70 C ATOM 1005 CE1 HIS A 150 31.138 14.554 36.724 1.00 35.33 C ATOM 1006 NE2 HIS A 150 30.854 15.861 36.735 1.00 35.88 N ATOM 1007 H HIS A 150 36.984 16.368 35.538 1.00 0.00 H ATOM 1008 N GLN A 151 33.764 14.275 34.158 1.00 31.24 N ATOM 1009 CA GLN A 151 32.995 14.255 32.931 1.00 31.49 C ATOM 1010 C GLN A 151 31.704 13.541 33.207 1.00 31.65 C ATOM 1011 O GLN A 151 31.681 12.641 34.043 1.00 32.10 O ATOM 1012 CB GLN A 151 33.735 13.589 31.791 1.00 33.68 C ATOM 1013 CG GLN A 151 32.976 13.776 30.497 1.00 32.32 C ATOM 1014 CD GLN A 151 33.738 13.332 29.297 1.00 30.93 C ATOM 1015 OE1 GLN A 151 34.817 12.738 29.404 1.00 31.55 O ATOM 1016 NE2 GLN A 151 33.176 13.611 28.127 1.00 30.79 N ATOM 1017 HE22 GLN A 151 32.266 14.113 28.094 1.00 0.00 H ATOM 1018 HE21 GLN A 151 33.646 13.327 27.244 1.00 0.00 H ATOM 1019 H GLN A 151 33.528 13.568 34.883 1.00 0.00 H ATOM 1020 N ALA A 152 30.632 13.931 32.523 1.00 28.67 N ATOM 1021 CA ALA A 152 29.329 13.304 32.683 1.00 29.16 C ATOM 1022 C ALA A 152 28.710 12.929 31.330 1.00 29.68 C ATOM 1023 O ALA A 152 28.959 13.561 30.314 1.00 30.45 O ATOM 1024 CB ALA A 152 28.407 14.173 33.507 1.00 29.34 C ATOM 1025 H ALA A 152 30.729 14.715 31.847 1.00 0.00 H ATOM 1026 N TYR A 153 27.942 11.856 31.335 1.00 31.14 N ATOM 1027 CA TYR A 153 27.303 11.229 30.198 1.00 31.63 C ATOM 1028 C TYR A 153 25.809 11.070 30.465 1.00 32.02 C ATOM 1029 O TYR A 153 25.370 11.143 31.618 1.00 32.21 O ATOM 1030 CB TYR A 153 27.987 9.855 29.960 1.00 32.48 C ATOM 1031 CG TYR A 153 29.502 9.945 29.989 1.00 32.48 C ATOM 1032 CD1 TYR A 153 30.200 9.901 31.193 1.00 33.01 C ATOM 1033 CD2 TYR A 153 30.230 10.142 28.821 1.00 31.88 C ATOM 1034 CE1 TYR A 153 31.581 10.066 31.236 1.00 32.06 C ATOM 1035 CE2 TYR A 153 31.616 10.293 28.849 1.00 31.13 C ATOM 1036 CZ TYR A 153 32.287 10.250 30.059 1.00 31.29 C ATOM 1037 OH TYR A 153 33.650 10.392 30.103 1.00 30.03 O ATOM 1038 HH TYR A 153 33.901 11.272 29.725 1.00 0.00 H ATOM 1039 H TYR A 153 27.777 11.411 32.260 1.00 0.00 H ATOM 1040 N LYS A 154 25.032 10.898 29.387 1.00 33.82 N ATOM 1041 CA LYS A 154 23.583 10.700 29.377 1.00 34.18 C ATOM 1042 C LYS A 154 23.376 9.735 28.229 1.00 34.72 C ATOM 1043 O LYS A 154 23.664 10.100 27.078 1.00 34.79 O ATOM 1044 CB LYS A 154 22.846 12.021 29.123 1.00 34.51 C ATOM 1045 CG LYS A 154 22.607 12.861 30.355 1.00 34.51 C ATOM 1046 CD LYS A 154 21.739 14.090 30.050 1.00 35.16 C ATOM 1047 CE LYS A 154 21.446 14.966 31.250 1.00 37.05 C ATOM 1048 NZ LYS A 154 20.416 14.362 32.140 1.00 37.72 N ATOM 1049 HZ1 LYS A 154 19.532 14.232 31.607 1.00 0.00 H ATOM 1050 HZ2 LYS A 154 20.754 13.440 32.483 1.00 0.00 H ATOM 1051 HZ3 LYS A 154 20.245 14.993 32.949 1.00 0.00 H ATOM 1052 H LYS A 154 25.508 10.906 28.462 1.00 0.00 H ATOM 1053 N LYS A 155 22.950 8.479 28.527 1.00 39.51 N ATOM 1054 CA LYS A 155 22.781 7.422 27.505 1.00 40.45 C ATOM 1055 C LYS A 155 24.121 7.268 26.695 1.00 40.64 C ATOM 1056 O LYS A 155 24.113 7.169 25.468 1.00 41.00 O ATOM 1057 CB LYS A 155 21.559 7.704 26.578 1.00 44.92 C ATOM 1058 CG LYS A 155 20.180 7.524 27.232 1.00 46.05 C ATOM 1059 CD LYS A 155 19.167 8.558 26.716 1.00 49.62 C ATOM 1060 CE LYS A 155 17.734 8.055 26.684 1.00 52.30 C ATOM 1061 NZ LYS A 155 17.091 7.988 28.040 1.00 52.54 N ATOM 1062 HZ1 LYS A 155 17.634 7.343 28.648 1.00 0.00 H ATOM 1063 HZ2 LYS A 155 17.079 8.938 28.464 1.00 0.00 H ATOM 1064 HZ3 LYS A 155 16.117 7.637 27.943 1.00 0.00 H ATOM 1065 H LYS A 155 22.733 8.250 29.518 1.00 0.00 H ATOM 1066 N GLY A 156 25.252 7.307 27.406 1.00 41.02 N ATOM 1067 CA GLY A 156 26.587 7.199 26.824 1.00 41.24 C ATOM 1068 C GLY A 156 27.174 8.507 26.319 1.00 41.61 C ATOM 1069 O GLY A 156 28.393 8.725 26.394 1.00 42.08 O ATOM 1070 H GLY A 156 25.177 7.421 28.437 1.00 0.00 H ATOM 1071 N VAL A 157 26.299 9.391 25.799 1.00 42.04 N ATOM 1072 CA VAL A 157 26.656 10.687 25.216 1.00 41.50 C ATOM 1073 C VAL A 157 27.286 11.648 26.225 1.00 41.26 C ATOM 1074 O VAL A 157 26.580 12.061 27.150 1.00 41.07 O ATOM 1075 CB VAL A 157 25.461 11.353 24.479 1.00 43.85 C ATOM 1076 CG1 VAL A 157 25.944 12.424 23.514 1.00 44.54 C ATOM 1077 CG2 VAL A 157 24.607 10.328 23.750 1.00 43.69 C ATOM 1078 H VAL A 157 25.292 9.133 25.813 1.00 0.00 H ATOM 1079 N PRO A 158 28.570 12.063 26.031 1.00 41.75 N ATOM 1080 CA PRO A 158 29.179 13.042 26.952 1.00 42.02 C ATOM 1081 C PRO A 158 28.417 14.378 26.955 1.00 42.13 C ATOM 1082 O PRO A 158 28.128 14.911 25.888 1.00 42.30 O ATOM 1083 CB PRO A 158 30.604 13.212 26.400 1.00 42.74 C ATOM 1084 CG PRO A 158 30.850 12.006 25.581 1.00 42.64 C ATOM 1085 CD PRO A 158 29.520 11.681 24.970 1.00 42.35 C ATOM 1086 N GLN A 159 28.064 14.901 28.136 1.00 45.27 N ATOM 1087 CA GLN A 159 27.335 16.161 28.270 1.00 45.24 C ATOM 1088 C GLN A 159 28.219 17.370 28.054 1.00 45.19 C ATOM 1089 O GLN A 159 27.712 18.454 27.736 1.00 45.37 O ATOM 1090 CB GLN A 159 26.649 16.256 29.639 1.00 47.46 C ATOM 1091 CG GLN A 159 25.363 15.438 29.746 1.00 47.80 C ATOM 1092 CD GLN A 159 24.378 15.777 28.654 1.00 47.79 C ATOM 1093 OE1 GLN A 159 24.348 15.124 27.595 1.00 46.47 O ATOM 1094 NE2 GLN A 159 23.551 16.806 28.892 1.00 48.51 N ATOM 1095 HE22 GLN A 159 23.611 17.324 29.792 1.00 0.00 H ATOM 1096 HE21 GLN A 159 22.850 17.086 28.177 1.00 0.00 H ATOM 1097 H GLN A 159 28.321 14.385 29.001 1.00 0.00 H ATOM 1098 N PHE A 160 29.538 17.176 28.229 1.00 44.32 N ATOM 1099 CA PHE A 160 30.599 18.179 28.122 1.00 43.56 C ATOM 1100 C PHE A 160 31.974 17.487 28.113 1.00 43.31 C ATOM 1101 O PHE A 160 32.062 16.295 28.432 1.00 43.67 O ATOM 1102 CB PHE A 160 30.534 19.153 29.316 1.00 43.61 C ATOM 1103 CG PHE A 160 30.537 18.502 30.681 1.00 42.35 C ATOM 1104 CD1 PHE A 160 31.731 18.198 31.322 1.00 41.12 C ATOM 1105 CD2 PHE A 160 29.345 18.199 31.329 1.00 41.24 C ATOM 1106 CE1 PHE A 160 31.735 17.611 32.588 1.00 40.72 C ATOM 1107 CE2 PHE A 160 29.348 17.610 32.597 1.00 41.82 C ATOM 1108 CZ PHE A 160 30.546 17.318 33.218 1.00 41.42 C ATOM 1109 H PHE A 160 29.837 16.208 28.466 1.00 0.00 H ATOM 1110 N ASP A 161 33.041 18.243 27.774 1.00 44.12 N ATOM 1111 CA ASP A 161 34.420 17.762 27.727 1.00 43.51 C ATOM 1112 C ASP A 161 35.037 17.718 29.109 1.00 43.00 C ATOM 1113 O ASP A 161 34.732 18.579 29.935 1.00 43.09 O ATOM 1114 CB ASP A 161 35.270 18.652 26.805 1.00 46.93 C ATOM 1115 CG ASP A 161 35.073 18.388 25.325 1.00 46.64 C ATOM 1116 OD1 ASP A 161 34.037 17.768 24.959 1.00 44.37 O ATOM 1117 OD2 ASP A 161 35.956 18.795 24.526 1.00 46.24 O ATOM 1118 H ASP A 161 32.869 19.239 27.529 1.00 0.00 H ATOM 1119 N LEU A 162 35.926 16.729 29.341 1.00 39.60 N ATOM 1120 CA LEU A 162 36.620 16.527 30.612 1.00 39.15 C ATOM 1121 C LEU A 162 37.140 17.852 31.156 1.00 38.79 C ATOM 1122 O LEU A 162 37.853 18.549 30.452 1.00 38.76 O ATOM 1123 CB LEU A 162 37.740 15.462 30.482 1.00 38.18 C ATOM 1124 CG LEU A 162 38.313 14.878 31.787 1.00 37.63 C ATOM 1125 CD1 LEU A 162 37.378 13.845 32.404 1.00 35.91 C ATOM 1126 CD2 LEU A 162 39.661 14.263 31.543 1.00 36.29 C ATOM 1127 H LEU A 162 36.131 16.068 28.565 1.00 0.00 H ATOM 1128 N LYS A 163 36.706 18.223 32.374 1.00 38.94 N ATOM 1129 CA LYS A 163 37.035 19.462 33.091 1.00 39.17 C ATOM 1130 C LYS A 163 37.731 19.127 34.417 1.00 39.49 C ATOM 1131 O LYS A 163 37.486 18.061 34.970 1.00 39.74 O ATOM 1132 CB LYS A 163 35.733 20.239 33.384 1.00 39.55 C ATOM 1133 H LYS A 163 36.069 17.561 32.861 1.00 0.00 H ATOM 1134 N GLU A 164 38.594 20.014 34.930 1.00 37.63 N ATOM 1135 CA GLU A 164 39.257 19.795 36.233 1.00 37.84 C ATOM 1136 C GLU A 164 38.318 20.473 37.225 1.00 37.96 C ATOM 1137 O GLU A 164 37.865 21.585 36.956 1.00 38.46 O ATOM 1138 CB GLU A 164 40.656 20.407 36.259 1.00 39.83 C ATOM 1139 CG GLU A 164 41.590 19.780 35.241 1.00 41.08 C ATOM 1140 CD GLU A 164 42.971 20.404 35.168 1.00 42.13 C ATOM 1141 OE1 GLU A 164 43.447 20.931 36.207 1.00 40.61 O ATOM 1142 OE2 GLU A 164 43.583 20.351 34.069 1.00 40.58 O ATOM 1143 H GLU A 164 38.804 20.882 34.396 1.00 0.00 H ATOM 1144 N VAL A 165 37.950 19.801 38.319 1.00 32.87 N ATOM 1145 CA VAL A 165 36.930 20.352 39.235 1.00 32.72 C ATOM 1146 C VAL A 165 37.329 20.421 40.749 1.00 33.28 C ATOM 1147 O VAL A 165 36.471 20.672 41.604 1.00 33.40 O ATOM 1148 CB VAL A 165 35.588 19.579 39.036 1.00 32.92 C ATOM 1149 CG1 VAL A 165 35.088 19.705 37.601 1.00 32.06 C ATOM 1150 CG2 VAL A 165 35.724 18.109 39.413 1.00 31.75 C ATOM 1151 H VAL A 165 38.386 18.880 38.528 1.00 0.00 H ATOM 1152 N GLY A 166 38.608 20.229 41.048 1.00 36.25 N ATOM 1153 CA GLY A 166 39.099 20.288 42.416 1.00 37.11 C ATOM 1154 C GLY A 166 40.486 19.707 42.525 1.00 37.76 C ATOM 1155 O GLY A 166 41.029 19.194 41.539 1.00 37.81 O ATOM 1156 H GLY A 166 39.280 20.030 40.280 1.00 0.00 H ATOM 1157 N THR A 167 41.076 19.803 43.712 1.00 40.89 N ATOM 1158 CA THR A 167 42.402 19.241 43.943 1.00 41.54 C ATOM 1159 C THR A 167 42.249 18.114 44.972 1.00 41.89 C ATOM 1160 O THR A 167 41.289 18.111 45.745 1.00 41.88 O ATOM 1161 CB THR A 167 43.487 20.308 44.220 1.00 48.95 C ATOM 1162 OG1 THR A 167 43.064 21.228 45.231 1.00 48.25 O ATOM 1163 CG2 THR A 167 43.911 21.049 42.947 1.00 48.60 C ATOM 1164 HG1 THR A 167 43.777 21.897 45.386 1.00 0.00 H ATOM 1165 H THR A 167 40.584 20.287 44.490 1.00 0.00 H ATOM 1166 N THR A 168 43.159 17.133 44.955 1.00 43.23 N ATOM 1167 CA THR A 168 43.067 15.960 45.823 1.00 42.73 C ATOM 1168 C THR A 168 44.417 15.386 46.318 1.00 42.52 C ATOM 1169 O THR A 168 45.421 15.439 45.590 1.00 42.68 O ATOM 1170 CB THR A 168 42.276 14.895 45.057 1.00 41.22 C ATOM 1171 OG1 THR A 168 42.251 13.703 45.832 1.00 41.57 O ATOM 1172 CG2 THR A 168 42.847 14.610 43.668 1.00 39.87 C ATOM 1173 HG1 THR A 168 41.742 13.006 45.347 1.00 0.00 H ATOM 1174 H THR A 168 43.963 17.208 44.299 1.00 0.00 H ATOM 1175 N ASP A 169 44.422 14.816 47.544 1.00 40.77 N ATOM 1176 CA ASP A 169 45.612 14.191 48.123 1.00 40.12 C ATOM 1177 C ASP A 169 45.747 12.764 47.524 1.00 39.92 C ATOM 1178 O ASP A 169 46.844 12.343 47.129 1.00 40.33 O ATOM 1179 CB ASP A 169 45.494 14.127 49.664 1.00 40.86 C ATOM 1180 H ASP A 169 43.543 14.822 48.099 1.00 0.00 H ATOM 1181 N LYS A 170 44.598 12.043 47.454 1.00 37.93 N ATOM 1182 CA LYS A 170 44.382 10.679 46.993 1.00 36.46 C ATOM 1183 C LYS A 170 44.421 10.470 45.474 1.00 35.47 C ATOM 1184 O LYS A 170 44.333 11.428 44.705 1.00 35.01 O ATOM 1185 CB LYS A 170 43.016 10.222 47.530 1.00 37.86 C ATOM 1186 H LYS A 170 43.744 12.540 47.779 1.00 0.00 H ATOM 1187 N THR A 171 44.532 9.180 45.052 1.00 34.72 N ATOM 1188 CA THR A 171 44.514 8.692 43.651 1.00 33.61 C ATOM 1189 C THR A 171 43.408 7.632 43.543 1.00 32.69 C ATOM 1190 O THR A 171 43.128 6.925 44.530 1.00 31.62 O ATOM 1191 CB THR A 171 45.811 7.987 43.252 1.00 37.84 C ATOM 1192 OG1 THR A 171 46.014 6.846 44.106 1.00 38.82 O ATOM 1193 CG2 THR A 171 47.004 8.911 43.210 1.00 37.32 C ATOM 1194 HG1 THR A 171 45.252 6.221 44.007 1.00 0.00 H ATOM 1195 H THR A 171 44.641 8.458 45.793 1.00 0.00 H ATOM 1196 N GLY A 172 42.824 7.524 42.351 1.00 30.76 N ATOM 1197 CA GLY A 172 41.782 6.546 42.073 1.00 30.63 C ATOM 1198 C GLY A 172 40.737 6.961 41.064 1.00 30.16 C ATOM 1199 O GLY A 172 40.847 8.013 40.422 1.00 30.38 O ATOM 1200 H GLY A 172 43.124 8.164 41.588 1.00 0.00 H ATOM 1201 N THR A 173 39.726 6.105 40.910 1.00 28.95 N ATOM 1202 CA THR A 173 38.601 6.363 40.020 1.00 28.42 C ATOM 1203 C THR A 173 37.305 6.302 40.839 1.00 28.21 C ATOM 1204 O THR A 173 37.270 5.672 41.901 1.00 28.57 O ATOM 1205 CB THR A 173 38.619 5.445 38.787 1.00 25.44 C ATOM 1206 OG1 THR A 173 39.882 5.548 38.133 1.00 25.10 O ATOM 1207 CG2 THR A 173 37.509 5.778 37.802 1.00 25.01 C ATOM 1208 HG1 THR A 173 40.599 5.275 38.758 1.00 0.00 H ATOM 1209 H THR A 173 39.741 5.215 41.448 1.00 0.00 H ATOM 1210 N VAL A 174 36.268 6.999 40.358 1.00 28.65 N ATOM 1211 CA VAL A 174 34.937 7.095 40.961 1.00 27.85 C ATOM 1212 C VAL A 174 33.933 7.109 39.817 1.00 27.48 C ATOM 1213 O VAL A 174 34.088 7.896 38.874 1.00 27.01 O ATOM 1214 CB VAL A 174 34.785 8.348 41.865 1.00 30.33 C ATOM 1215 CG1 VAL A 174 33.336 8.584 42.248 1.00 30.39 C ATOM 1216 CG2 VAL A 174 35.653 8.255 43.114 1.00 30.66 C ATOM 1217 H VAL A 174 36.422 7.522 39.472 1.00 0.00 H ATOM 1218 N ILE A 175 32.921 6.237 39.889 1.00 27.23 N ATOM 1219 CA ILE A 175 31.869 6.148 38.879 1.00 27.02 C ATOM 1220 C ILE A 175 30.512 6.147 39.560 1.00 27.54 C ATOM 1221 O ILE A 175 30.286 5.356 40.492 1.00 27.89 O ATOM 1222 CB ILE A 175 32.086 4.946 37.893 1.00 29.76 C ATOM 1223 CG1 ILE A 175 32.917 5.380 36.722 1.00 29.26 C ATOM 1224 CG2 ILE A 175 30.795 4.328 37.349 1.00 27.81 C ATOM 1225 CD1 ILE A 175 34.212 5.065 36.877 1.00 31.02 C ATOM 1226 H ILE A 175 32.881 5.591 40.703 1.00 0.00 H ATOM 1227 N ARG A 176 29.618 7.028 39.095 1.00 24.49 N ATOM 1228 CA ARG A 176 28.251 7.116 39.588 1.00 24.93 C ATOM 1229 C ARG A 176 27.349 6.949 38.394 1.00 25.22 C ATOM 1230 O ARG A 176 27.581 7.552 37.336 1.00 24.64 O ATOM 1231 CB ARG A 176 27.912 8.447 40.240 1.00 26.13 C ATOM 1232 CG ARG A 176 28.856 8.952 41.277 1.00 28.17 C ATOM 1233 CD ARG A 176 28.378 10.304 41.747 1.00 31.11 C ATOM 1234 NE ARG A 176 27.188 10.168 42.592 1.00 35.35 N ATOM 1235 CZ ARG A 176 25.980 10.628 42.289 1.00 36.83 C ATOM 1236 NH1 ARG A 176 25.781 11.299 41.164 1.00 37.45 N ATOM 1237 NH2 ARG A 176 24.969 10.449 43.122 1.00 37.68 N ATOM 1238 HE ARG A 176 27.299 9.673 43.500 1.00 0.00 H ATOM 1239 HH12 ARG A 176 24.832 11.657 40.933 1.00 0.00 H ATOM 1240 HH11 ARG A 176 26.574 11.468 40.512 1.00 0.00 H ATOM 1241 HH22 ARG A 176 24.025 10.812 42.879 1.00 0.00 H ATOM 1242 HH21 ARG A 176 25.118 9.946 44.020 1.00 0.00 H ATOM 1243 H ARG A 176 29.915 7.683 38.344 1.00 0.00 H ATOM 1244 N PHE A 177 26.308 6.128 38.560 1.00 27.73 N ATOM 1245 CA PHE A 177 25.354 5.904 37.494 1.00 28.75 C ATOM 1246 C PHE A 177 23.999 5.656 37.991 1.00 29.23 C ATOM 1247 O PHE A 177 23.832 5.096 39.067 1.00 29.38 O ATOM 1248 CB PHE A 177 25.793 4.787 36.518 1.00 30.07 C ATOM 1249 CG PHE A 177 25.903 3.388 37.061 1.00 30.38 C ATOM 1250 CD1 PHE A 177 24.793 2.553 37.109 1.00 29.97 C ATOM 1251 CD2 PHE A 177 27.128 2.886 37.486 1.00 29.97 C ATOM 1252 CE1 PHE A 177 24.900 1.253 37.609 1.00 30.11 C ATOM 1253 CE2 PHE A 177 27.236 1.581 37.978 1.00 30.87 C ATOM 1254 CZ PHE A 177 26.122 0.775 38.031 1.00 30.44 C ATOM 1255 H PHE A 177 26.181 5.642 39.470 1.00 0.00 H ATOM 1256 N LYS A 178 23.016 6.101 37.219 1.00 30.88 N ATOM 1257 CA LYS A 178 21.605 5.866 37.476 1.00 32.39 C ATOM 1258 C LYS A 178 21.253 5.103 36.229 1.00 33.99 C ATOM 1259 O LYS A 178 21.353 5.664 35.123 1.00 34.83 O ATOM 1260 CB LYS A 178 20.767 7.155 37.578 1.00 32.11 C ATOM 1261 CG LYS A 178 19.237 6.897 37.540 1.00 32.11 C ATOM 1262 CD LYS A 178 18.567 6.743 38.903 1.00 32.99 C ATOM 1263 CE LYS A 178 17.430 5.753 38.887 1.00 32.10 C ATOM 1264 NZ LYS A 178 17.875 4.323 38.750 1.00 31.35 N ATOM 1265 HZ1 LYS A 178 18.399 4.208 37.859 1.00 0.00 H ATOM 1266 HZ2 LYS A 178 18.491 4.075 39.550 1.00 0.00 H ATOM 1267 HZ3 LYS A 178 17.042 3.701 38.746 1.00 0.00 H ATOM 1268 H LYS A 178 23.272 6.653 36.376 1.00 0.00 H ATOM 1269 N ALA A 179 20.910 3.808 36.387 1.00 35.01 N ATOM 1270 CA ALA A 179 20.539 2.966 35.264 1.00 36.41 C ATOM 1271 C ALA A 179 19.331 3.591 34.574 1.00 37.77 C ATOM 1272 O ALA A 179 18.444 4.100 35.264 1.00 38.00 O ATOM 1273 CB ALA A 179 20.190 1.579 35.761 1.00 37.28 C ATOM 1274 H ALA A 179 20.911 3.400 37.344 1.00 0.00 H ATOM 1275 N ASP A 180 19.318 3.584 33.225 1.00 40.05 N ATOM 1276 CA ASP A 180 18.255 4.126 32.387 1.00 41.02 C ATOM 1277 C ASP A 180 16.911 3.443 32.656 1.00 41.76 C ATOM 1278 O ASP A 180 16.803 2.223 32.552 1.00 41.41 O ATOM 1279 CB ASP A 180 18.648 3.982 30.911 1.00 43.11 C ATOM 1280 CG ASP A 180 17.798 4.736 29.907 1.00 43.23 C ATOM 1281 OD1 ASP A 180 16.712 5.217 30.286 1.00 43.87 O ATOM 1282 OD2 ASP A 180 18.227 4.853 28.733 1.00 42.58 O ATOM 1283 H ASP A 180 20.134 3.156 32.743 1.00 0.00 H ATOM 1284 N GLY A 181 15.909 4.249 33.008 1.00 46.31 N ATOM 1285 CA GLY A 181 14.542 3.805 33.281 1.00 47.47 C ATOM 1286 C GLY A 181 13.901 3.143 32.074 1.00 48.52 C ATOM 1287 O GLY A 181 13.104 2.210 32.225 1.00 48.62 O ATOM 1288 H GLY A 181 16.114 5.265 33.095 1.00 0.00 H ATOM 1289 N GLU A 182 14.287 3.609 30.865 1.00 49.12 N ATOM 1290 CA GLU A 182 13.838 3.091 29.578 1.00 50.03 C ATOM 1291 C GLU A 182 14.246 1.638 29.321 1.00 49.86 C ATOM 1292 O GLU A 182 13.424 0.877 28.826 1.00 49.86 O ATOM 1293 CB GLU A 182 14.365 3.954 28.427 1.00 52.85 C ATOM 1294 CG GLU A 182 13.648 5.286 28.291 1.00 55.84 C ATOM 1295 CD GLU A 182 13.925 6.059 27.016 1.00 59.70 C ATOM 1296 OE1 GLU A 182 14.974 5.809 26.371 1.00 60.69 O ATOM 1297 OE2 GLU A 182 13.085 6.923 26.664 1.00 60.46 O ATOM 1298 H GLU A 182 14.960 4.402 30.852 1.00 0.00 H ATOM 1299 N ILE A 183 15.496 1.254 29.613 1.00 45.43 N ATOM 1300 CA ILE A 183 15.983 -0.101 29.368 1.00 45.28 C ATOM 1301 C ILE A 183 15.585 -1.060 30.464 1.00 45.43 C ATOM 1302 O ILE A 183 15.139 -2.173 30.169 1.00 45.49 O ATOM 1303 CB ILE A 183 17.518 -0.099 29.102 1.00 47.96 C ATOM 1304 CG1 ILE A 183 17.827 0.437 27.718 1.00 47.84 C ATOM 1305 CG2 ILE A 183 18.167 -1.476 29.275 1.00 48.36 C ATOM 1306 CD1 ILE A 183 18.459 1.630 27.791 1.00 49.05 C ATOM 1307 H ILE A 183 16.146 1.949 30.031 1.00 0.00 H ATOM 1308 N PHE A 184 15.756 -0.651 31.727 1.00 44.87 N ATOM 1309 CA PHE A 184 15.445 -1.538 32.842 1.00 45.56 C ATOM 1310 C PHE A 184 13.985 -1.427 33.241 1.00 46.04 C ATOM 1311 O PHE A 184 13.633 -0.829 34.261 1.00 46.77 O ATOM 1312 CB PHE A 184 16.439 -1.378 34.019 1.00 44.96 C ATOM 1313 CG PHE A 184 17.828 -1.729 33.550 1.00 45.15 C ATOM 1314 CD1 PHE A 184 18.229 -3.055 33.448 1.00 45.71 C ATOM 1315 CD2 PHE A 184 18.704 -0.739 33.124 1.00 46.06 C ATOM 1316 CE1 PHE A 184 19.492 -3.384 32.958 1.00 46.51 C ATOM 1317 CE2 PHE A 184 19.963 -1.066 32.629 1.00 46.07 C ATOM 1318 CZ PHE A 184 20.351 -2.387 32.553 1.00 46.50 C ATOM 1319 H PHE A 184 16.114 0.307 31.915 1.00 0.00 H ATOM 1320 N THR A 185 13.129 -2.026 32.403 1.00 48.28 N ATOM 1321 CA THR A 185 11.682 -2.088 32.623 1.00 48.13 C ATOM 1322 C THR A 185 11.446 -3.319 33.490 1.00 47.76 C ATOM 1323 O THR A 185 11.976 -4.399 33.180 1.00 48.07 O ATOM 1324 CB THR A 185 10.894 -2.035 31.298 1.00 52.62 C ATOM 1325 OG1 THR A 185 11.652 -2.635 30.231 1.00 52.72 O ATOM 1326 CG2 THR A 185 10.518 -0.607 30.925 1.00 53.39 C ATOM 1327 HG1 THR A 185 11.130 -2.591 29.391 1.00 0.00 H ATOM 1328 H THR A 185 13.514 -2.473 31.546 1.00 0.00 H ATOM 1329 N GLU A 186 10.709 -3.123 34.603 1.00 46.55 N ATOM 1330 CA GLU A 186 10.345 -4.083 35.661 1.00 46.12 C ATOM 1331 C GLU A 186 10.981 -3.680 36.977 1.00 45.65 C ATOM 1332 O GLU A 186 10.263 -3.624 37.975 1.00 45.66 O ATOM 1333 CB GLU A 186 10.652 -5.571 35.345 1.00 47.53 C ATOM 1334 H GLU A 186 10.346 -2.157 34.733 1.00 0.00 H ATOM 1335 N THR A 187 12.321 -3.412 36.993 1.00 44.98 N ATOM 1336 CA THR A 187 13.022 -3.005 38.218 1.00 43.84 C ATOM 1337 C THR A 187 14.307 -2.157 37.982 1.00 42.88 C ATOM 1338 O THR A 187 15.133 -2.461 37.113 1.00 42.85 O ATOM 1339 CB THR A 187 13.301 -4.197 39.150 1.00 52.41 C ATOM 1340 OG1 THR A 187 13.787 -3.712 40.401 1.00 52.92 O ATOM 1341 CG2 THR A 187 14.250 -5.231 38.551 1.00 52.64 C ATOM 1342 HG1 THR A 187 13.967 -4.477 41.003 1.00 0.00 H ATOM 1343 H THR A 187 12.862 -3.499 36.109 1.00 0.00 H ATOM 1344 N THR A 188 14.424 -1.080 38.810 1.00 40.76 N ATOM 1345 CA THR A 188 15.499 -0.105 38.923 1.00 38.82 C ATOM 1346 C THR A 188 15.988 0.003 40.397 1.00 37.50 C ATOM 1347 O THR A 188 16.945 0.737 40.679 1.00 37.69 O ATOM 1348 CB THR A 188 15.125 1.232 38.290 1.00 52.77 C ATOM 1349 OG1 THR A 188 16.334 1.986 38.119 1.00 53.57 O ATOM 1350 CG2 THR A 188 14.144 2.036 39.137 1.00 53.01 C ATOM 1351 HG1 THR A 188 16.760 2.129 39.001 1.00 0.00 H ATOM 1352 H THR A 188 13.625 -0.933 39.459 1.00 0.00 H ATOM 1353 N VAL A 189 15.333 -0.731 41.325 1.00 32.11 N ATOM 1354 CA VAL A 189 15.690 -0.767 42.748 1.00 30.50 C ATOM 1355 C VAL A 189 16.599 -1.961 42.974 1.00 29.45 C ATOM 1356 O VAL A 189 16.202 -3.084 42.654 1.00 29.55 O ATOM 1357 CB VAL A 189 14.474 -0.741 43.723 1.00 32.23 C ATOM 1358 CG1 VAL A 189 14.892 -1.111 45.137 1.00 31.94 C ATOM 1359 CG2 VAL A 189 13.800 0.622 43.732 1.00 32.66 C ATOM 1360 H VAL A 189 14.526 -1.306 41.010 1.00 0.00 H ATOM 1361 N TYR A 190 17.819 -1.717 43.526 1.00 28.93 N ATOM 1362 CA TYR A 190 18.820 -2.755 43.799 1.00 26.68 C ATOM 1363 C TYR A 190 18.554 -3.571 45.072 1.00 25.98 C ATOM 1364 O TYR A 190 18.122 -3.033 46.101 1.00 25.18 O ATOM 1365 CB TYR A 190 20.239 -2.166 43.900 1.00 25.91 C ATOM 1366 CG TYR A 190 20.728 -1.472 42.657 1.00 25.13 C ATOM 1367 CD1 TYR A 190 21.408 -2.173 41.663 1.00 24.30 C ATOM 1368 CD2 TYR A 190 20.566 -0.103 42.495 1.00 24.42 C ATOM 1369 CE1 TYR A 190 21.881 -1.531 40.516 1.00 24.20 C ATOM 1370 CE2 TYR A 190 21.029 0.548 41.353 1.00 23.77 C ATOM 1371 CZ TYR A 190 21.675 -0.171 40.360 1.00 24.68 C ATOM 1372 OH TYR A 190 22.115 0.491 39.242 1.00 25.75 O ATOM 1373 HH TYR A 190 22.552 -0.152 38.630 1.00 0.00 H ATOM 1374 H TYR A 190 18.057 -0.734 43.769 1.00 0.00 H ATOM 1375 N ASN A 191 18.860 -4.872 45.002 1.00 27.58 N ATOM 1376 CA ASN A 191 18.731 -5.757 46.132 1.00 26.93 C ATOM 1377 C ASN A 191 20.074 -5.783 46.797 1.00 26.04 C ATOM 1378 O ASN A 191 21.043 -6.239 46.171 1.00 26.08 O ATOM 1379 CB ASN A 191 18.312 -7.163 45.721 1.00 30.00 C ATOM 1380 CG ASN A 191 17.816 -7.911 46.930 1.00 30.42 C ATOM 1381 OD1 ASN A 191 18.572 -8.557 47.654 1.00 32.23 O ATOM 1382 ND2 ASN A 191 16.530 -7.781 47.218 1.00 32.00 N ATOM 1383 HD22 ASN A 191 15.910 -7.230 46.591 1.00 0.00 H ATOM 1384 HD21 ASN A 191 16.140 -8.230 48.071 1.00 0.00 H ATOM 1385 H ASN A 191 19.203 -5.258 44.099 1.00 0.00 H ATOM 1386 N TYR A 192 20.144 -5.271 48.056 1.00 27.21 N ATOM 1387 CA TYR A 192 21.362 -5.208 48.865 1.00 26.34 C ATOM 1388 C TYR A 192 21.951 -6.592 49.040 1.00 26.34 C ATOM 1389 O TYR A 192 23.157 -6.762 48.815 1.00 27.02 O ATOM 1390 CB TYR A 192 21.088 -4.598 50.231 1.00 27.83 C ATOM 1391 CG TYR A 192 22.324 -4.396 51.086 1.00 28.34 C ATOM 1392 CD1 TYR A 192 22.861 -5.444 51.839 1.00 30.41 C ATOM 1393 CD2 TYR A 192 22.934 -3.146 51.181 1.00 26.96 C ATOM 1394 CE1 TYR A 192 23.983 -5.252 52.649 1.00 30.45 C ATOM 1395 CE2 TYR A 192 24.047 -2.940 51.998 1.00 27.85 C ATOM 1396 CZ TYR A 192 24.571 -3.995 52.726 1.00 30.75 C ATOM 1397 OH TYR A 192 25.672 -3.787 53.526 1.00 34.22 O ATOM 1398 HH TYR A 192 25.918 -4.635 53.974 1.00 0.00 H ATOM 1399 H TYR A 192 19.268 -4.897 48.474 1.00 0.00 H ATOM 1400 N GLU A 193 21.110 -7.590 49.433 1.00 27.31 N ATOM 1401 CA GLU A 193 21.587 -8.961 49.654 1.00 27.11 C ATOM 1402 C GLU A 193 22.210 -9.540 48.398 1.00 27.03 C ATOM 1403 O GLU A 193 23.229 -10.212 48.504 1.00 27.10 O ATOM 1404 CB GLU A 193 20.512 -9.860 50.254 1.00 28.52 C ATOM 1405 H GLU A 193 20.103 -7.375 49.580 1.00 0.00 H ATOM 1406 N THR A 194 21.647 -9.205 47.206 1.00 29.37 N ATOM 1407 CA THR A 194 22.179 -9.614 45.901 1.00 29.50 C ATOM 1408 C THR A 194 23.606 -9.065 45.760 1.00 29.70 C ATOM 1409 O THR A 194 24.503 -9.855 45.477 1.00 29.45 O ATOM 1410 CB THR A 194 21.247 -9.190 44.749 1.00 35.15 C ATOM 1411 OG1 THR A 194 19.998 -9.866 44.893 1.00 35.63 O ATOM 1412 CG2 THR A 194 21.815 -9.502 43.377 1.00 34.25 C ATOM 1413 HG1 THR A 194 19.590 -9.622 45.762 1.00 0.00 H ATOM 1414 H THR A 194 20.786 -8.623 47.220 1.00 0.00 H ATOM 1415 N LEU A 195 23.819 -7.736 45.990 1.00 28.09 N ATOM 1416 CA LEU A 195 25.148 -7.107 45.899 1.00 28.34 C ATOM 1417 C LEU A 195 26.151 -7.674 46.939 1.00 28.65 C ATOM 1418 O LEU A 195 27.305 -7.932 46.609 1.00 28.26 O ATOM 1419 CB LEU A 195 25.064 -5.567 45.989 1.00 27.21 C ATOM 1420 CG LEU A 195 24.253 -4.794 44.925 1.00 26.75 C ATOM 1421 CD1 LEU A 195 24.368 -3.299 45.148 1.00 27.21 C ATOM 1422 CD2 LEU A 195 24.748 -5.049 43.509 1.00 23.87 C ATOM 1423 H LEU A 195 23.005 -7.140 46.241 1.00 0.00 H ATOM 1424 N GLN A 196 25.677 -7.889 48.180 1.00 31.81 N ATOM 1425 CA GLN A 196 26.427 -8.412 49.331 1.00 33.58 C ATOM 1426 C GLN A 196 27.078 -9.748 49.020 1.00 34.20 C ATOM 1427 O GLN A 196 28.258 -9.931 49.297 1.00 35.04 O ATOM 1428 CB GLN A 196 25.494 -8.521 50.545 1.00 35.94 C ATOM 1429 CG GLN A 196 25.995 -9.403 51.665 1.00 37.59 C ATOM 1430 CD GLN A 196 25.341 -9.082 52.992 1.00 41.50 C ATOM 1431 OE1 GLN A 196 24.093 -9.040 53.132 1.00 43.54 O ATOM 1432 NE2 GLN A 196 26.179 -8.862 54.014 1.00 42.89 N ATOM 1433 HE22 GLN A 196 27.207 -8.905 53.862 1.00 0.00 H ATOM 1434 HE21 GLN A 196 25.802 -8.648 54.959 1.00 0.00 H ATOM 1435 H GLN A 196 24.675 -7.661 48.342 1.00 0.00 H ATOM 1436 N GLN A 197 26.310 -10.660 48.439 1.00 31.84 N ATOM 1437 CA GLN A 197 26.714 -11.992 48.049 1.00 32.51 C ATOM 1438 C GLN A 197 27.847 -11.977 47.018 1.00 33.20 C ATOM 1439 O GLN A 197 28.869 -12.647 47.240 1.00 33.94 O ATOM 1440 CB GLN A 197 25.493 -12.768 47.560 1.00 33.97 C ATOM 1441 CG GLN A 197 24.598 -13.193 48.731 1.00 33.41 C ATOM 1442 CD GLN A 197 23.166 -13.589 48.392 1.00 32.96 C ATOM 1443 OE1 GLN A 197 22.781 -13.833 47.227 1.00 32.67 O ATOM 1444 NE2 GLN A 197 22.351 -13.667 49.443 1.00 31.72 N ATOM 1445 HE22 GLN A 197 22.710 -13.456 50.396 1.00 0.00 H ATOM 1446 HE21 GLN A 197 21.356 -13.939 49.310 1.00 0.00 H ATOM 1447 H GLN A 197 25.324 -10.391 48.246 1.00 0.00 H ATOM 1448 N ARG A 198 27.708 -11.190 45.917 1.00 33.63 N ATOM 1449 CA ARG A 198 28.760 -11.121 44.900 1.00 34.67 C ATOM 1450 C ARG A 198 30.018 -10.426 45.429 1.00 34.35 C ATOM 1451 O ARG A 198 31.117 -10.879 45.124 1.00 34.53 O ATOM 1452 CB ARG A 198 28.248 -10.526 43.592 1.00 42.53 C ATOM 1453 CG ARG A 198 29.243 -10.475 42.412 1.00 46.32 C ATOM 1454 CD ARG A 198 29.488 -11.748 41.576 1.00 52.61 C ATOM 1455 NE ARG A 198 30.672 -11.540 40.716 1.00 57.89 N ATOM 1456 CZ ARG A 198 30.655 -11.087 39.454 1.00 60.93 C ATOM 1457 NH1 ARG A 198 29.499 -10.844 38.841 1.00 62.42 N ATOM 1458 NH2 ARG A 198 31.794 -10.900 38.791 1.00 60.67 N ATOM 1459 HE ARG A 198 31.601 -11.765 41.126 1.00 0.00 H ATOM 1460 HH12 ARG A 198 29.493 -10.493 37.862 1.00 0.00 H ATOM 1461 HH11 ARG A 198 28.601 -11.005 39.341 1.00 0.00 H ATOM 1462 HH22 ARG A 198 31.774 -10.548 37.812 1.00 0.00 H ATOM 1463 HH21 ARG A 198 32.704 -11.105 39.252 1.00 0.00 H ATOM 1464 H ARG A 198 26.841 -10.628 45.795 1.00 0.00 H ATOM 1465 N ILE A 199 29.863 -9.379 46.255 1.00 30.19 N ATOM 1466 CA ILE A 199 30.991 -8.667 46.860 1.00 29.75 C ATOM 1467 C ILE A 199 31.765 -9.608 47.801 1.00 29.97 C ATOM 1468 O ILE A 199 32.988 -9.659 47.713 1.00 29.39 O ATOM 1469 CB ILE A 199 30.540 -7.333 47.502 1.00 31.04 C ATOM 1470 CG1 ILE A 199 30.622 -6.214 46.461 1.00 30.22 C ATOM 1471 CG2 ILE A 199 31.357 -6.968 48.722 1.00 31.02 C ATOM 1472 CD1 ILE A 199 29.470 -5.282 46.419 1.00 27.65 C ATOM 1473 H ILE A 199 28.898 -9.059 46.475 1.00 0.00 H ATOM 1474 N ARG A 200 31.048 -10.390 48.639 1.00 31.36 N ATOM 1475 CA ARG A 200 31.638 -11.343 49.590 1.00 32.04 C ATOM 1476 C ARG A 200 32.481 -12.459 48.873 1.00 32.11 C ATOM 1477 O ARG A 200 33.509 -12.921 49.390 1.00 31.99 O ATOM 1478 CB ARG A 200 30.525 -11.947 50.481 1.00 35.20 C ATOM 1479 CG ARG A 200 31.012 -12.994 51.491 1.00 36.09 C ATOM 1480 CD ARG A 200 29.920 -13.436 52.442 1.00 38.15 C ATOM 1481 NE ARG A 200 28.956 -14.339 51.809 1.00 39.42 N ATOM 1482 CZ ARG A 200 27.635 -14.250 51.948 1.00 39.47 C ATOM 1483 NH1 ARG A 200 27.099 -13.291 52.700 1.00 40.05 N ATOM 1484 NH2 ARG A 200 26.839 -15.120 51.340 1.00 39.76 N ATOM 1485 HE ARG A 200 29.329 -15.102 51.210 1.00 0.00 H ATOM 1486 HH12 ARG A 200 26.066 -13.228 52.804 1.00 0.00 H ATOM 1487 HH11 ARG A 200 27.713 -12.605 53.184 1.00 0.00 H ATOM 1488 HH22 ARG A 200 25.808 -15.047 51.451 1.00 0.00 H ATOM 1489 HH21 ARG A 200 27.246 -15.875 50.752 1.00 0.00 H ATOM 1490 H ARG A 200 30.011 -10.312 48.609 1.00 0.00 H ATOM 1491 N GLU A 201 31.995 -12.881 47.690 1.00 31.48 N ATOM 1492 CA GLU A 201 32.584 -13.887 46.848 1.00 31.06 C ATOM 1493 C GLU A 201 33.857 -13.281 46.256 1.00 30.64 C ATOM 1494 O GLU A 201 34.927 -13.842 46.442 1.00 30.58 O ATOM 1495 CB GLU A 201 31.566 -14.262 45.766 1.00 32.73 C ATOM 1496 CG GLU A 201 31.813 -15.600 45.093 1.00 34.88 C ATOM 1497 CD GLU A 201 30.706 -16.068 44.161 1.00 39.19 C ATOM 1498 OE1 GLU A 201 30.727 -15.683 42.967 1.00 41.09 O ATOM 1499 OE2 GLU A 201 29.824 -16.830 44.628 1.00 39.13 O ATOM 1500 H GLU A 201 31.115 -12.440 47.355 1.00 0.00 H ATOM 1501 N LEU A 202 33.762 -12.142 45.616 1.00 29.93 N ATOM 1502 CA LEU A 202 34.906 -11.487 45.028 1.00 29.54 C ATOM 1503 C LEU A 202 36.037 -11.180 45.964 1.00 29.34 C ATOM 1504 O LEU A 202 37.157 -11.214 45.578 1.00 28.99 O ATOM 1505 CB LEU A 202 34.470 -10.211 44.362 1.00 28.71 C ATOM 1506 CG LEU A 202 33.698 -10.401 43.084 1.00 28.39 C ATOM 1507 CD1 LEU A 202 32.858 -9.192 42.827 1.00 29.47 C ATOM 1508 CD2 LEU A 202 34.639 -10.596 41.943 1.00 28.89 C ATOM 1509 H LEU A 202 32.828 -11.693 45.528 1.00 0.00 H ATOM 1510 N ALA A 203 35.728 -10.807 47.179 1.00 29.49 N ATOM 1511 CA ALA A 203 36.710 -10.520 48.190 1.00 29.41 C ATOM 1512 C ALA A 203 37.496 -11.708 48.576 1.00 29.74 C ATOM 1513 O ALA A 203 38.650 -11.604 48.850 1.00 30.68 O ATOM 1514 CB ALA A 203 36.028 -9.974 49.407 1.00 29.65 C ATOM 1515 H ALA A 203 34.722 -10.713 47.426 1.00 0.00 H ATOM 1516 N PHE A 204 36.810 -12.822 48.699 1.00 28.86 N ATOM 1517 CA PHE A 204 37.362 -14.139 48.925 1.00 28.35 C ATOM 1518 C PHE A 204 38.167 -14.686 47.760 1.00 28.46 C ATOM 1519 O PHE A 204 39.181 -15.279 47.981 1.00 28.69 O ATOM 1520 CB PHE A 204 36.201 -15.074 49.323 1.00 28.50 C ATOM 1521 CG PHE A 204 36.609 -16.422 49.827 1.00 27.83 C ATOM 1522 CD1 PHE A 204 37.001 -16.600 51.098 1.00 27.09 C ATOM 1523 CD2 PHE A 204 36.543 -17.508 49.019 1.00 26.59 C ATOM 1524 CE1 PHE A 204 37.378 -17.826 51.545 1.00 24.14 C ATOM 1525 CE2 PHE A 204 36.909 -18.737 49.459 1.00 23.45 C ATOM 1526 CZ PHE A 204 37.326 -18.895 50.726 1.00 23.18 C ATOM 1527 H PHE A 204 35.775 -12.750 48.627 1.00 0.00 H ATOM 1528 N LEU A 205 37.708 -14.536 46.527 1.00 27.80 N ATOM 1529 CA LEU A 205 38.500 -14.967 45.388 1.00 28.55 C ATOM 1530 C LEU A 205 39.731 -14.163 45.207 1.00 28.78 C ATOM 1531 O LEU A 205 40.785 -14.691 44.986 1.00 29.30 O ATOM 1532 CB LEU A 205 37.720 -14.944 44.095 1.00 29.00 C ATOM 1533 CG LEU A 205 36.391 -15.655 44.081 1.00 31.73 C ATOM 1534 CD1 LEU A 205 35.576 -15.162 42.915 1.00 34.99 C ATOM 1535 CD2 LEU A 205 36.589 -17.139 43.971 1.00 33.07 C ATOM 1536 H LEU A 205 36.773 -14.106 46.373 1.00 0.00 H ATOM 1537 N ASN A 206 39.594 -12.862 45.311 1.00 29.87 N ATOM 1538 CA ASN A 206 40.727 -11.996 45.211 1.00 29.85 C ATOM 1539 C ASN A 206 41.059 -11.506 46.553 1.00 29.63 C ATOM 1540 O ASN A 206 40.497 -10.581 47.023 1.00 29.66 O ATOM 1541 CB ASN A 206 40.390 -10.832 44.335 1.00 20.00 C ATOM 1542 CG ASN A 206 39.701 -11.248 43.093 1.00 20.00 C ATOM 1543 OD1 ASN A 206 40.329 -11.619 42.134 1.00 20.00 O ATOM 1544 ND2 ASN A 206 38.405 -11.213 43.113 1.00 20.00 N ATOM 1545 HD22 ASN A 206 37.907 -10.885 43.965 1.00 0.00 H ATOM 1546 HD21 ASN A 206 37.864 -11.513 42.277 1.00 0.00 H ATOM 1547 H ASN A 206 38.650 -12.456 45.468 1.00 0.00 H ATOM 1548 N LYS A 207 42.041 -12.128 47.144 1.00 30.18 N ATOM 1549 CA LYS A 207 42.378 -11.912 48.507 1.00 29.62 C ATOM 1550 C LYS A 207 43.277 -10.739 48.572 1.00 29.01 C ATOM 1551 O LYS A 207 43.998 -10.455 47.662 1.00 29.14 O ATOM 1552 CB LYS A 207 43.098 -13.117 49.048 1.00 32.61 C ATOM 1553 CG LYS A 207 42.347 -14.405 48.895 1.00 33.01 C ATOM 1554 CD LYS A 207 41.751 -14.858 50.199 1.00 31.93 C ATOM 1555 CE LYS A 207 40.953 -16.111 50.007 1.00 29.36 C ATOM 1556 NZ LYS A 207 40.777 -16.769 51.307 1.00 27.05 N ATOM 1557 HZ1 LYS A 207 41.709 -17.003 51.705 1.00 0.00 H ATOM 1558 HZ2 LYS A 207 40.274 -16.128 51.953 1.00 0.00 H ATOM 1559 HZ3 LYS A 207 40.223 -17.640 51.181 1.00 0.00 H ATOM 1560 H LYS A 207 42.601 -12.811 46.594 1.00 0.00 H ATOM 1561 N GLY A 208 43.217 -10.054 49.678 1.00 29.77 N ATOM 1562 CA GLY A 208 43.941 -8.801 49.836 1.00 29.45 C ATOM 1563 C GLY A 208 43.086 -7.578 49.517 1.00 29.77 C ATOM 1564 O GLY A 208 43.298 -6.503 50.086 1.00 30.43 O ATOM 1565 H GLY A 208 42.639 -10.410 50.466 1.00 0.00 H ATOM 1566 N ILE A 209 42.110 -7.734 48.660 1.00 29.15 N ATOM 1567 CA ILE A 209 41.273 -6.637 48.284 1.00 28.43 C ATOM 1568 C ILE A 209 40.211 -6.436 49.294 1.00 28.56 C ATOM 1569 O ILE A 209 39.622 -7.370 49.708 1.00 28.75 O ATOM 1570 CB ILE A 209 40.600 -6.905 46.958 1.00 31.07 C ATOM 1571 CG1 ILE A 209 41.635 -7.078 45.875 1.00 31.24 C ATOM 1572 CG2 ILE A 209 39.771 -5.725 46.564 1.00 30.54 C ATOM 1573 CD1 ILE A 209 41.047 -7.234 44.502 1.00 32.40 C ATOM 1574 H ILE A 209 41.940 -8.672 48.245 1.00 0.00 H ATOM 1575 N GLN A 210 39.970 -5.191 49.665 1.00 30.79 N ATOM 1576 CA GLN A 210 38.948 -4.842 50.635 1.00 31.43 C ATOM 1577 C GLN A 210 37.809 -4.193 49.878 1.00 31.60 C ATOM 1578 O GLN A 210 37.985 -3.117 49.339 1.00 32.19 O ATOM 1579 CB GLN A 210 39.479 -3.902 51.711 1.00 34.31 C ATOM 1580 CG GLN A 210 38.353 -3.454 52.638 1.00 37.02 C ATOM 1581 CD GLN A 210 38.831 -2.523 53.706 1.00 41.44 C ATOM 1582 OE1 GLN A 210 39.559 -1.544 53.441 1.00 42.93 O ATOM 1583 NE2 GLN A 210 38.425 -2.814 54.945 1.00 43.80 N ATOM 1584 HE22 GLN A 210 37.818 -3.642 55.112 1.00 0.00 H ATOM 1585 HE21 GLN A 210 38.715 -2.212 55.742 1.00 0.00 H ATOM 1586 H GLN A 210 40.537 -4.428 49.244 1.00 0.00 H ATOM 1587 N ILE A 211 36.661 -4.844 49.798 1.00 30.83 N ATOM 1588 CA ILE A 211 35.507 -4.318 49.071 1.00 30.51 C ATOM 1589 C ILE A 211 34.472 -3.995 50.127 1.00 30.69 C ATOM 1590 O ILE A 211 34.263 -4.810 51.027 1.00 31.00 O ATOM 1591 CB ILE A 211 34.977 -5.305 47.984 1.00 32.95 C ATOM 1592 CG1 ILE A 211 36.113 -5.873 47.116 1.00 31.61 C ATOM 1593 CG2 ILE A 211 33.953 -4.625 47.093 1.00 34.23 C ATOM 1594 CD1 ILE A 211 35.814 -7.182 46.456 1.00 30.01 C ATOM 1595 H ILE A 211 36.576 -5.766 50.271 1.00 0.00 H ATOM 1596 N THR A 212 33.854 -2.798 50.050 1.00 28.81 N ATOM 1597 CA THR A 212 32.855 -2.355 51.019 1.00 28.89 C ATOM 1598 C THR A 212 31.546 -2.058 50.325 1.00 28.74 C ATOM 1599 O THR A 212 31.529 -1.554 49.206 1.00 28.61 O ATOM 1600 CB THR A 212 33.347 -1.111 51.772 1.00 33.79 C ATOM 1601 OG1 THR A 212 34.698 -1.297 52.163 1.00 34.45 O ATOM 1602 CG2 THR A 212 32.505 -0.786 52.996 1.00 34.90 C ATOM 1603 HG1 THR A 212 34.763 -2.088 52.754 1.00 0.00 H ATOM 1604 H THR A 212 34.100 -2.162 49.265 1.00 0.00 H ATOM 1605 N LEU A 213 30.444 -2.361 51.007 1.00 30.76 N ATOM 1606 CA LEU A 213 29.113 -2.093 50.509 1.00 31.28 C ATOM 1607 C LEU A 213 28.404 -1.210 51.497 1.00 31.48 C ATOM 1608 O LEU A 213 28.318 -1.564 52.672 1.00 31.45 O ATOM 1609 CB LEU A 213 28.310 -3.379 50.260 1.00 30.79 C ATOM 1610 CG LEU A 213 26.992 -3.170 49.498 1.00 30.28 C ATOM 1611 CD1 LEU A 213 27.232 -2.788 48.046 1.00 29.39 C ATOM 1612 CD2 LEU A 213 26.151 -4.399 49.561 1.00 32.04 C ATOM 1613 H LEU A 213 30.545 -2.810 51.939 1.00 0.00 H ATOM 1614 N ARG A 214 27.904 -0.056 51.018 1.00 34.36 N ATOM 1615 CA ARG A 214 27.149 0.912 51.815 1.00 35.17 C ATOM 1616 C ARG A 214 25.811 1.176 51.156 1.00 34.85 C ATOM 1617 O ARG A 214 25.752 1.446 49.948 1.00 34.81 O ATOM 1618 CB ARG A 214 27.872 2.258 51.929 1.00 41.09 C ATOM 1619 CG ARG A 214 29.128 2.276 52.770 1.00 44.76 C ATOM 1620 CD ARG A 214 29.697 3.676 52.859 1.00 51.15 C ATOM 1621 NE ARG A 214 28.655 4.656 53.167 1.00 57.62 N ATOM 1622 CZ ARG A 214 28.191 4.903 54.392 1.00 61.85 C ATOM 1623 NH1 ARG A 214 28.674 4.241 55.442 1.00 63.44 N ATOM 1624 NH2 ARG A 214 27.246 5.818 54.578 1.00 62.87 N ATOM 1625 HE ARG A 214 28.249 5.196 52.377 1.00 0.00 H ATOM 1626 HH12 ARG A 214 28.307 4.439 56.395 1.00 0.00 H ATOM 1627 HH11 ARG A 214 29.418 3.526 55.309 1.00 0.00 H ATOM 1628 HH22 ARG A 214 26.887 6.007 55.535 1.00 0.00 H ATOM 1629 HH21 ARG A 214 26.865 6.345 53.766 1.00 0.00 H ATOM 1630 H ARG A 214 28.065 0.163 50.014 1.00 0.00 H ATOM 1631 N ASP A 215 24.742 1.103 51.943 1.00 33.52 N ATOM 1632 CA ASP A 215 23.403 1.394 51.467 1.00 33.07 C ATOM 1633 C ASP A 215 23.104 2.733 52.111 1.00 33.08 C ATOM 1634 O ASP A 215 23.070 2.821 53.330 1.00 33.53 O ATOM 1635 CB ASP A 215 22.413 0.302 51.909 1.00 33.82 C ATOM 1636 CG ASP A 215 21.037 0.343 51.256 1.00 34.51 C ATOM 1637 OD1 ASP A 215 20.797 1.257 50.420 1.00 35.99 O ATOM 1638 OD2 ASP A 215 20.189 -0.534 51.592 1.00 34.02 O ATOM 1639 H ASP A 215 24.871 0.827 52.937 1.00 0.00 H ATOM 1640 N GLU A 216 22.947 3.780 51.315 1.00 35.39 N ATOM 1641 CA GLU A 216 22.697 5.127 51.815 1.00 35.82 C ATOM 1642 C GLU A 216 21.343 5.669 51.430 1.00 36.22 C ATOM 1643 O GLU A 216 20.973 6.760 51.877 1.00 36.42 O ATOM 1644 CB GLU A 216 23.746 6.052 51.263 1.00 38.29 C ATOM 1645 CG GLU A 216 24.900 6.230 52.202 1.00 39.85 C ATOM 1646 CD GLU A 216 26.029 6.939 51.495 1.00 40.29 C ATOM 1647 OE1 GLU A 216 25.744 7.711 50.546 1.00 37.89 O ATOM 1648 OE2 GLU A 216 27.199 6.716 51.888 1.00 41.88 O ATOM 1649 H GLU A 216 23.005 3.635 50.287 1.00 0.00 H ATOM 1650 N ARG A 217 20.615 4.916 50.590 1.00 36.21 N ATOM 1651 CA ARG A 217 19.276 5.208 50.074 1.00 35.91 C ATOM 1652 C ARG A 217 18.376 5.821 51.137 1.00 36.98 C ATOM 1653 O ARG A 217 17.552 6.679 50.810 1.00 37.37 O ATOM 1654 CB ARG A 217 18.631 3.932 49.512 1.00 31.04 C ATOM 1655 CG ARG A 217 19.330 3.380 48.307 1.00 27.76 C ATOM 1656 CD ARG A 217 18.531 2.228 47.799 1.00 21.98 C ATOM 1657 NE ARG A 217 18.850 0.984 48.498 1.00 17.39 N ATOM 1658 CZ ARG A 217 18.665 -0.230 47.986 1.00 14.32 C ATOM 1659 NH1 ARG A 217 18.123 -0.378 46.775 1.00 13.59 N ATOM 1660 NH2 ARG A 217 19.012 -1.307 48.681 1.00 13.59 N ATOM 1661 HE ARG A 217 19.247 1.053 49.457 1.00 0.00 H ATOM 1662 HH12 ARG A 217 17.982 -1.330 46.381 1.00 0.00 H ATOM 1663 HH11 ARG A 217 17.842 0.459 46.225 1.00 0.00 H ATOM 1664 HH22 ARG A 217 18.866 -2.255 48.278 1.00 0.00 H ATOM 1665 HH21 ARG A 217 19.429 -1.203 49.628 1.00 0.00 H ATOM 1666 H ARG A 217 21.050 4.027 50.270 1.00 0.00 H ATOM 1667 N ASP A 218 18.540 5.383 52.397 1.00 35.97 N ATOM 1668 CA ASP A 218 17.807 5.903 53.533 1.00 37.40 C ATOM 1669 C ASP A 218 18.816 6.429 54.542 1.00 38.51 C ATOM 1670 O ASP A 218 19.600 5.650 55.086 1.00 38.41 O ATOM 1671 CB ASP A 218 16.902 4.832 54.137 1.00 38.16 C ATOM 1672 CG ASP A 218 16.070 5.268 55.323 1.00 37.94 C ATOM 1673 OD1 ASP A 218 16.107 6.467 55.678 1.00 36.16 O ATOM 1674 OD2 ASP A 218 15.381 4.417 55.896 1.00 38.89 O ATOM 1675 H ASP A 218 19.234 4.627 52.566 1.00 0.00 H ATOM 1676 N GLU A 219 18.806 7.754 54.775 1.00 39.69 N ATOM 1677 CA GLU A 219 19.678 8.471 55.710 1.00 41.04 C ATOM 1678 C GLU A 219 19.454 8.001 57.164 1.00 41.44 C ATOM 1679 O GLU A 219 20.375 8.051 57.989 1.00 42.27 O ATOM 1680 CB GLU A 219 19.321 9.972 55.696 1.00 43.51 C ATOM 1681 CG GLU A 219 19.679 10.802 54.469 1.00 46.18 C ATOM 1682 CD GLU A 219 19.012 12.174 54.456 1.00 49.50 C ATOM 1683 OE1 GLU A 219 17.827 12.258 54.860 1.00 51.01 O ATOM 1684 OE2 GLU A 219 19.666 13.160 54.034 1.00 51.27 O ATOM 1685 H GLU A 219 18.116 8.322 54.243 1.00 0.00 H ATOM 1686 N GLU A 220 18.222 7.595 57.484 1.00 39.15 N ATOM 1687 CA GLU A 220 17.869 7.204 58.839 1.00 39.13 C ATOM 1688 C GLU A 220 18.364 5.829 59.258 1.00 38.87 C ATOM 1689 O GLU A 220 18.510 5.623 60.455 1.00 38.66 O ATOM 1690 CB GLU A 220 16.375 7.365 59.078 1.00 40.35 C ATOM 1691 CG GLU A 220 15.998 8.835 59.065 1.00 41.12 C ATOM 1692 CD GLU A 220 14.551 9.146 59.349 1.00 42.36 C ATOM 1693 OE1 GLU A 220 13.669 8.439 58.812 1.00 42.03 O ATOM 1694 OE2 GLU A 220 14.299 10.104 60.114 1.00 44.36 O ATOM 1695 H GLU A 220 17.494 7.558 56.742 1.00 0.00 H ATOM 1696 N ASN A 221 18.631 4.913 58.318 1.00 38.19 N ATOM 1697 CA ASN A 221 19.165 3.573 58.587 1.00 38.60 C ATOM 1698 C ASN A 221 20.225 3.327 57.539 1.00 38.36 C ATOM 1699 O ASN A 221 19.894 2.980 56.406 1.00 38.43 O ATOM 1700 CB ASN A 221 18.111 2.470 58.455 1.00 47.73 C ATOM 1701 CG ASN A 221 16.933 2.482 59.398 1.00 49.48 C ATOM 1702 OD1 ASN A 221 16.791 3.359 60.248 1.00 49.41 O ATOM 1703 ND2 ASN A 221 16.049 1.469 59.264 1.00 52.23 N ATOM 1704 HD22 ASN A 221 16.197 0.742 58.535 1.00 0.00 H ATOM 1705 HD21 ASN A 221 15.220 1.416 59.890 1.00 0.00 H ATOM 1706 H ASN A 221 18.447 5.170 57.327 1.00 0.00 H ATOM 1707 N VAL A 222 21.490 3.527 57.876 1.00 37.54 N ATOM 1708 CA VAL A 222 22.543 3.299 56.895 1.00 37.18 C ATOM 1709 C VAL A 222 23.164 1.932 57.118 1.00 37.32 C ATOM 1710 O VAL A 222 23.563 1.622 58.239 1.00 37.62 O ATOM 1711 CB VAL A 222 23.564 4.451 56.814 1.00 39.18 C ATOM 1712 CG1 VAL A 222 24.714 4.105 55.873 1.00 38.48 C ATOM 1713 CG2 VAL A 222 22.877 5.730 56.360 1.00 38.57 C ATOM 1714 H VAL A 222 21.731 3.845 58.836 1.00 0.00 H ATOM 1715 N ARG A 223 23.213 1.110 56.053 1.00 39.12 N ATOM 1716 CA ARG A 223 23.764 -0.246 56.086 1.00 39.19 C ATOM 1717 C ARG A 223 25.208 -0.300 55.546 1.00 38.87 C ATOM 1718 O ARG A 223 25.520 0.396 54.577 1.00 38.61 O ATOM 1719 CB ARG A 223 22.856 -1.164 55.282 1.00 40.51 C ATOM 1720 CG ARG A 223 22.722 -2.539 55.849 1.00 41.06 C ATOM 1721 CD ARG A 223 21.504 -3.221 55.246 1.00 42.64 C ATOM 1722 NE ARG A 223 21.585 -4.677 55.404 1.00 42.80 N ATOM 1723 CZ ARG A 223 20.928 -5.564 54.665 1.00 41.39 C ATOM 1724 NH1 ARG A 223 20.117 -5.161 53.691 1.00 42.05 N ATOM 1725 NH2 ARG A 223 21.086 -6.861 54.883 1.00 40.95 N ATOM 1726 HE ARG A 223 22.206 -5.044 56.154 1.00 0.00 H ATOM 1727 HH12 ARG A 223 19.606 -5.861 53.117 1.00 0.00 H ATOM 1728 HH11 ARG A 223 19.994 -4.145 53.504 1.00 0.00 H ATOM 1729 HH22 ARG A 223 20.570 -7.553 54.302 1.00 0.00 H ATOM 1730 HH21 ARG A 223 21.726 -7.188 55.635 1.00 0.00 H ATOM 1731 H ARG A 223 22.836 1.460 55.150 1.00 0.00 H ATOM 1732 N GLU A 224 26.092 -1.107 56.180 1.00 38.86 N ATOM 1733 CA GLU A 224 27.494 -1.264 55.764 1.00 39.05 C ATOM 1734 C GLU A 224 28.069 -2.630 56.071 1.00 38.60 C ATOM 1735 O GLU A 224 27.913 -3.107 57.184 1.00 38.67 O ATOM 1736 CB GLU A 224 28.396 -0.168 56.336 1.00 41.00 C ATOM 1737 CG GLU A 224 29.670 -0.054 55.526 1.00 44.02 C ATOM 1738 CD GLU A 224 30.718 0.923 56.008 1.00 46.94 C ATOM 1739 OE1 GLU A 224 30.562 2.138 55.740 1.00 47.32 O ATOM 1740 OE2 GLU A 224 31.706 0.469 56.635 1.00 49.06 O ATOM 1741 H GLU A 224 25.761 -1.645 57.006 1.00 0.00 H ATOM 1742 N ASP A 225 28.742 -3.251 55.095 1.00 36.41 N ATOM 1743 CA ASP A 225 29.409 -4.557 55.224 1.00 36.44 C ATOM 1744 C ASP A 225 30.743 -4.470 54.507 1.00 36.59 C ATOM 1745 O ASP A 225 30.754 -4.347 53.279 1.00 36.41 O ATOM 1746 CB ASP A 225 28.583 -5.672 54.591 1.00 38.51 C ATOM 1747 CG ASP A 225 27.495 -6.169 55.475 1.00 38.40 C ATOM 1748 OD1 ASP A 225 27.777 -7.055 56.313 1.00 37.31 O ATOM 1749 OD2 ASP A 225 26.349 -5.678 55.337 1.00 38.79 O ATOM 1750 H ASP A 225 28.798 -2.773 54.173 1.00 0.00 H ATOM 1751 N SER A 226 31.864 -4.514 55.258 1.00 35.19 N ATOM 1752 CA SER A 226 33.214 -4.420 54.693 1.00 35.80 C ATOM 1753 C SER A 226 33.806 -5.801 54.605 1.00 35.77 C ATOM 1754 O SER A 226 33.825 -6.484 55.617 1.00 35.55 O ATOM 1755 CB SER A 226 34.082 -3.522 55.563 1.00 39.47 C ATOM 1756 OG SER A 226 35.045 -2.867 54.760 1.00 40.79 O ATOM 1757 HG SER A 226 34.585 -2.318 54.077 1.00 0.00 H ATOM 1758 H SER A 226 31.765 -4.620 56.288 1.00 0.00 H ATOM 1759 N TYR A 227 34.261 -6.229 53.416 1.00 34.43 N ATOM 1760 CA TYR A 227 34.824 -7.566 53.191 1.00 36.14 C ATOM 1761 C TYR A 227 36.311 -7.575 52.858 1.00 36.82 C ATOM 1762 O TYR A 227 36.702 -7.098 51.792 1.00 36.90 O ATOM 1763 CB TYR A 227 34.033 -8.290 52.100 1.00 37.46 C ATOM 1764 CG TYR A 227 32.659 -8.700 52.553 1.00 39.44 C ATOM 1765 CD1 TYR A 227 32.474 -9.830 53.341 1.00 41.59 C ATOM 1766 CD2 TYR A 227 31.535 -7.957 52.201 1.00 40.25 C ATOM 1767 CE1 TYR A 227 31.207 -10.216 53.761 1.00 41.74 C ATOM 1768 CE2 TYR A 227 30.259 -8.338 52.613 1.00 40.76 C ATOM 1769 CZ TYR A 227 30.103 -9.462 53.406 1.00 41.44 C ATOM 1770 OH TYR A 227 28.866 -9.857 53.855 1.00 44.00 O ATOM 1771 HH TYR A 227 28.961 -10.676 54.403 1.00 0.00 H ATOM 1772 H TYR A 227 34.212 -5.576 52.608 1.00 0.00 H ATOM 1773 N HIS A 228 37.146 -8.133 53.749 1.00 38.43 N ATOM 1774 CA HIS A 228 38.595 -8.179 53.516 1.00 39.98 C ATOM 1775 C HIS A 228 39.255 -9.456 54.033 1.00 41.09 C ATOM 1776 O HIS A 228 39.560 -9.554 55.226 1.00 40.92 O ATOM 1777 CB HIS A 228 39.291 -6.913 54.070 1.00 40.42 C ATOM 1778 CG HIS A 228 40.770 -6.884 53.839 1.00 39.32 C ATOM 1779 ND1 HIS A 228 41.648 -6.579 54.860 1.00 39.28 N ATOM 1780 CD2 HIS A 228 41.480 -7.133 52.714 1.00 39.45 C ATOM 1781 CE1 HIS A 228 42.860 -6.647 54.329 1.00 40.62 C ATOM 1782 NE2 HIS A 228 42.809 -6.981 53.042 1.00 41.04 N ATOM 1783 H HIS A 228 36.758 -8.542 54.623 1.00 0.00 H ATOM 1784 N TYR A 229 39.484 -10.431 53.117 1.00 45.18 N ATOM 1785 CA TYR A 229 40.111 -11.708 53.473 1.00 47.58 C ATOM 1786 C TYR A 229 41.575 -11.705 53.120 1.00 49.13 C ATOM 1787 O TYR A 229 41.918 -11.441 51.962 1.00 49.65 O ATOM 1788 CB TYR A 229 39.469 -12.919 52.747 1.00 48.20 C ATOM 1789 CG TYR A 229 37.974 -13.090 52.907 1.00 49.34 C ATOM 1790 CD1 TYR A 229 37.084 -12.375 52.113 1.00 49.50 C ATOM 1791 CD2 TYR A 229 37.450 -14.025 53.791 1.00 49.57 C ATOM 1792 CE1 TYR A 229 35.707 -12.549 52.227 1.00 50.03 C ATOM 1793 CE2 TYR A 229 36.074 -14.206 53.918 1.00 49.83 C ATOM 1794 CZ TYR A 229 35.203 -13.467 53.130 1.00 49.85 C ATOM 1795 OH TYR A 229 33.837 -13.616 53.224 1.00 49.36 O ATOM 1796 HH TYR A 229 33.395 -13.004 52.583 1.00 0.00 H ATOM 1797 H TYR A 229 39.205 -10.267 52.129 1.00 0.00 H ATOM 1798 N GLU A 230 42.439 -12.023 54.099 1.00 52.36 N ATOM 1799 CA GLU A 230 43.871 -12.164 53.857 1.00 54.19 C ATOM 1800 C GLU A 230 44.141 -13.665 53.666 1.00 54.80 C ATOM 1801 O GLU A 230 45.128 -14.040 53.035 1.00 55.40 O ATOM 1802 CB GLU A 230 44.717 -11.563 54.984 1.00 56.49 C ATOM 1803 CG GLU A 230 45.017 -10.076 54.807 1.00 58.97 C ATOM 1804 CD GLU A 230 45.813 -9.575 53.600 1.00 61.66 C ATOM 1805 OE1 GLU A 230 46.384 -10.399 52.839 1.00 63.29 O ATOM 1806 OE2 GLU A 230 45.855 -8.333 53.423 1.00 60.76 O ATOM 1807 H GLU A 230 42.075 -12.174 55.061 1.00 0.00 H ATOM 1808 N GLY A 231 43.211 -14.484 54.179 1.00 54.51 N ATOM 1809 CA GLY A 231 43.190 -15.946 54.118 1.00 55.08 C ATOM 1810 C GLY A 231 42.204 -16.581 55.099 1.00 55.57 C ATOM 1811 O GLY A 231 41.009 -16.754 54.817 1.00 55.76 O ATOM 1812 H GLY A 231 42.417 -14.030 54.675 1.00 0.00 H TER 1813 GLY A 231 HETATM 1814 O HOH 1 28.296 3.760 23.805 1.00 19.46 O HETATM 1815 O HOH 2 37.197 -11.789 39.705 1.00 14.12 O HETATM 1816 O HOH 3 41.488 3.745 39.176 1.00 29.58 O HETATM 1817 O HOH 4 46.275 4.221 34.784 1.00 35.37 O HETATM 1818 O HOH 5 49.550 11.659 45.122 1.00 26.94 O HETATM 1819 C4 XAM A 6 38.037 -3.151 21.403 1.00 0.15 C HETATM 1820 C5 XAM A 6 37.637 -1.696 21.158 1.00 0.09 C HETATM 1821 C6 XAM A 6 37.157 -1.410 19.751 1.00 -0.04 C HETATM 1822 H XAM A 6 36.892 -0.346 19.663 1.00 0.03 H HETATM 1823 H XAM A 6 36.273 -2.028 19.532 1.00 0.03 H HETATM 1824 H XAM A 6 37.957 -1.648 19.035 1.00 0.03 H HETATM 1825 O5 XAM A 6 38.723 -0.791 21.459 1.00 -0.35 O HETATM 1826 C1 XAM A 6 40.069 -1.075 21.098 1.00 0.18 C HETATM 1827 NBE XAM A 6 40.892 0.057 21.639 1.00 -0.23 N HETATM 1828 CBD XAM A 6 41.411 0.044 22.945 1.00 0.18 C HETATM 1829 CBA XAM A 6 42.436 1.058 23.036 1.00 0.11 C HETATM 1830 CAZ XAM A 6 43.160 1.300 24.179 1.00 0.13 C HETATM 1831 CAJ XAM A 6 42.886 0.539 25.524 1.00 0.07 C HETATM 1832 CAE XAM A 6 42.946 1.463 26.774 1.00 0.03 C HETATM 1833 CAF XAM A 6 42.143 2.753 26.827 1.00 -0.06 C HETATM 1834 CAA XAM A 6 42.630 3.658 27.926 1.00 -0.01 C HETATM 1835 CAB XAM A 6 42.421 2.987 29.290 1.00 -0.01 C HETATM 1836 CAC XAM A 6 42.937 1.552 29.304 1.00 0.08 C HETATM 1837 OAL XAM A 6 42.476 0.939 30.539 1.00 -0.35 O HETATM 1838 CCG XAM A 6 43.144 1.375 31.720 1.00 0.16 C HETATM 1839 CCF XAM A 6 42.358 0.941 32.941 1.00 0.03 C HETATM 1840 CCE XAM A 6 43.057 1.103 34.325 1.00 0.12 C HETATM 1841 CAM XAM A 6 42.254 0.362 35.499 1.00 0.07 C HETATM 1842 NAO XAM A 6 40.893 0.998 35.659 1.00 -0.28 N HETATM 1843 CAP XAM A 6 40.325 1.348 36.821 1.00 0.21 C HETATM 1844 CAR XAM A 6 38.866 1.572 36.810 1.00 0.13 C HETATM 1845 CAS XAM A 6 37.904 1.572 35.815 1.00 0.04 C HETATM 1846 CLW XAM A 6 38.094 1.228 34.138 1.00 -0.10 CL HETATM 1847 CAT XAM A 6 36.650 1.884 36.401 1.00 0.04 C HETATM 1848 CLX XAM A 6 35.207 2.029 35.474 1.00 -0.11 CL HETATM 1849 CAU XAM A 6 36.898 2.043 37.773 1.00 0.05 C HETATM 1850 CAY XAM A 6 35.967 2.279 38.918 1.00 -0.01 C HETATM 1851 H XAM A 6 36.544 2.350 39.852 1.00 0.04 H HETATM 1852 H XAM A 6 35.255 1.444 38.990 1.00 0.04 H HETATM 1853 H XAM A 6 35.416 3.217 38.755 1.00 0.04 H HETATM 1854 NAV XAM A 6 38.232 1.873 37.986 1.00 -0.27 N HETATM 1855 H XAM A 6 38.698 1.958 38.901 1.00 0.23 H HETATM 1856 OAQ XAM A 6 40.961 1.522 37.855 1.00 -0.40 O HETATM 1857 H XAM A 6 40.370 1.173 34.825 1.00 0.18 H HETATM 1858 CAN XAM A 6 42.070 -1.157 35.314 1.00 -0.04 C HETATM 1859 H XAM A 6 43.054 -1.634 35.196 1.00 0.03 H HETATM 1860 H XAM A 6 41.461 -1.346 34.418 1.00 0.03 H HETATM 1861 H XAM A 6 41.563 -1.575 36.196 1.00 0.03 H HETATM 1862 H XAM A 6 42.822 0.513 36.428 1.00 0.06 H HETATM 1863 OCK XAM A 6 43.016 2.491 34.697 1.00 -0.38 O HETATM 1864 H XAM A 6 43.439 2.604 35.540 1.00 0.21 H HETATM 1865 CCD XAM A 6 44.587 0.650 34.177 1.00 0.11 C HETATM 1866 OCJ XAM A 6 45.207 1.130 35.358 1.00 -0.39 O HETATM 1867 H XAM A 6 44.790 0.737 36.115 1.00 0.21 H HETATM 1868 CCC XAM A 6 45.220 1.318 32.962 1.00 0.09 C HETATM 1869 CCI XAM A 6 46.663 0.919 32.758 1.00 -0.04 C HETATM 1870 H XAM A 6 47.063 1.431 31.870 1.00 0.03 H HETATM 1871 H XAM A 6 46.725 -0.170 32.613 1.00 0.03 H HETATM 1872 H XAM A 6 47.251 1.205 33.642 1.00 0.03 H HETATM 1873 OCH XAM A 6 44.502 0.946 31.767 1.00 -0.35 O HETATM 1874 H XAM A 6 45.167 2.408 33.098 1.00 0.06 H HETATM 1875 H XAM A 6 44.672 -0.444 34.096 1.00 0.06 H HETATM 1876 H XAM A 6 41.431 1.532 32.966 1.00 0.03 H HETATM 1877 H XAM A 6 42.111 -0.124 32.816 1.00 0.03 H HETATM 1878 H XAM A 6 43.155 2.475 31.707 1.00 0.09 H HETATM 1879 CAD XAM A 6 42.565 0.646 28.044 1.00 0.02 C HETATM 1880 CAG XAM A 6 43.339 -0.643 28.056 1.00 -0.09 C HETATM 1881 CAH XAM A 6 43.830 -1.256 26.981 1.00 -0.09 C HETATM 1882 CAI XAM A 6 43.716 -0.764 25.563 1.00 -0.00 C HETATM 1883 CBC XAM A 6 45.089 -0.686 24.893 1.00 -0.05 C HETATM 1884 H XAM A 6 45.594 -1.660 24.977 1.00 0.03 H HETATM 1885 H XAM A 6 45.696 0.085 25.390 1.00 0.03 H HETATM 1886 H XAM A 6 44.965 -0.427 23.831 1.00 0.03 H HETATM 1887 H XAM A 6 43.142 -1.516 25.001 1.00 0.05 H HETATM 1888 H XAM A 6 44.360 -2.194 27.141 1.00 0.05 H HETATM 1889 H XAM A 6 43.512 -1.113 29.023 1.00 0.05 H HETATM 1890 H XAM A 6 41.487 0.425 28.046 1.00 0.05 H HETATM 1891 H XAM A 6 44.035 1.604 29.335 1.00 0.06 H HETATM 1892 H XAM A 6 42.958 3.565 30.056 1.00 0.03 H HETATM 1893 H XAM A 6 41.346 2.980 29.522 1.00 0.03 H HETATM 1894 H XAM A 6 43.701 3.863 27.781 1.00 0.05 H HETATM 1895 H XAM A 6 42.068 4.603 27.895 1.00 0.05 H HETATM 1896 CAK XAM A 6 41.092 3.040 26.079 1.00 -0.13 C HETATM 1897 H XAM A 6 40.778 2.353 25.295 1.00 0.01 H HETATM 1898 H XAM A 6 40.540 3.964 26.247 1.00 0.01 H HETATM 1899 H XAM A 6 44.001 1.762 26.863 1.00 0.06 H HETATM 1900 H XAM A 6 41.837 0.210 25.477 1.00 0.07 H HETATM 1901 OBB XAM A 6 44.153 2.222 24.092 1.00 -0.30 O HETATM 1902 H XAM A 6 44.175 2.579 23.212 1.00 0.27 H HETATM 1903 CBG XAM A 6 42.539 1.706 21.729 1.00 0.13 C HETATM 1904 OBI XAM A 6 43.413 2.448 21.310 1.00 -0.41 O HETATM 1905 CBF XAM A 6 41.370 1.181 20.830 1.00 0.11 C HETATM 1906 CBJ XAM A 6 40.230 2.225 20.673 1.00 -0.01 C HETATM 1907 CBL XAM A 6 40.753 3.649 20.496 1.00 -0.06 C HETATM 1908 H XAM A 6 39.904 4.341 20.390 1.00 0.02 H HETATM 1909 H XAM A 6 41.382 3.699 19.595 1.00 0.02 H HETATM 1910 H XAM A 6 41.350 3.933 21.375 1.00 0.02 H HETATM 1911 CBK XAM A 6 39.264 1.862 19.539 1.00 -0.06 C HETATM 1912 H XAM A 6 38.898 0.835 19.683 1.00 0.02 H HETATM 1913 H XAM A 6 39.788 1.933 18.574 1.00 0.02 H HETATM 1914 H XAM A 6 38.413 2.558 19.546 1.00 0.02 H HETATM 1915 H XAM A 6 39.653 2.207 21.609 1.00 0.03 H HETATM 1916 H XAM A 6 41.728 0.862 19.840 1.00 0.08 H HETATM 1917 OBH XAM A 6 41.004 -0.732 23.800 1.00 -0.41 O HETATM 1918 C2 XAM A 6 40.435 -2.485 21.546 1.00 0.14 C HETATM 1919 C3 XAM A 6 39.447 -3.441 20.899 1.00 0.15 C HETATM 1920 O3 XAM A 6 39.502 -3.256 19.465 1.00 -0.27 O HETATM 1921 CBW XAM A 6 39.830 -4.314 18.689 1.00 0.23 C HETATM 1922 OBY XAM A 6 39.793 -5.456 19.067 1.00 -0.37 O HETATM 1923 CBX XAM A 6 40.240 -3.861 17.330 1.00 0.04 C HETATM 1924 H XAM A 6 40.502 -4.735 16.716 1.00 0.05 H HETATM 1925 H XAM A 6 41.112 -3.196 17.413 1.00 0.05 H HETATM 1926 H XAM A 6 39.408 -3.318 16.858 1.00 0.05 H HETATM 1927 H XAM A 6 39.718 -4.477 21.149 1.00 0.07 H HETATM 1928 O2 XAM A 6 41.796 -2.901 21.369 1.00 -0.37 O HETATM 1929 CCL XAM A 6 42.526 -2.326 20.277 1.00 0.04 C HETATM 1930 H XAM A 6 43.547 -2.734 20.264 1.00 0.05 H HETATM 1931 H XAM A 6 42.569 -1.234 20.399 1.00 0.05 H HETATM 1932 H XAM A 6 42.022 -2.569 19.330 1.00 0.05 H HETATM 1933 H XAM A 6 40.259 -2.519 22.631 1.00 0.07 H HETATM 1934 H XAM A 6 40.159 -1.056 20.002 1.00 0.09 H HETATM 1935 H XAM A 6 36.806 -1.473 21.843 1.00 0.06 H HETATM 1936 O4 XAM A 6 37.099 -4.031 20.748 1.00 -0.26 O HETATM 1937 CBZ XAM A 6 36.747 -5.298 21.262 1.00 0.32 C HETATM 1938 OCB XAM A 6 35.631 -5.735 21.091 1.00 -0.38 O HETATM 1939 NCA XAM A 6 37.732 -5.933 21.892 1.00 -0.28 N HETATM 1940 H XAM A 6 37.571 -6.837 22.288 1.00 0.18 H HETATM 1941 H XAM A 6 38.633 -5.506 21.970 1.00 0.18 H HETATM 1942 H XAM A 6 38.008 -3.342 22.486 1.00 0.07 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 764 765 768 769 770 CONECT 768 764 CONECT 769 764 CONECT 770 764 CONECT 1819 1820 1919 1936 1942 CONECT 1820 1819 1821 1825 1935 CONECT 1821 1820 1822 1823 1824 CONECT 1822 1821 CONECT 1823 1821 CONECT 1824 1821 CONECT 1825 1820 1826 CONECT 1826 1825 1827 1918 1934 CONECT 1827 1826 1828 1905 CONECT 1828 1827 1829 1917 CONECT 1829 1828 1830 1903 CONECT 1830 1829 1831 1901 CONECT 1831 1830 1832 1882 1900 CONECT 1832 1831 1833 1879 1899 CONECT 1833 1832 1834 1896 CONECT 1834 1833 1835 1894 1895 CONECT 1835 1834 1836 1892 1893 CONECT 1836 1835 1837 1879 1891 CONECT 1837 1836 1838 CONECT 1838 1837 1839 1873 1878 CONECT 1839 1838 1840 1876 1877 CONECT 1840 1839 1841 1863 1865 CONECT 1841 1840 1842 1858 1862 CONECT 1842 1841 1843 1857 CONECT 1843 1842 1844 1856 CONECT 1844 1843 1845 1854 CONECT 1845 1844 1846 1847 CONECT 1846 1845 CONECT 1847 1845 1848 1849 CONECT 1848 1847 CONECT 1849 1847 1850 1854 CONECT 1850 1849 1851 1852 1853 CONECT 1851 1850 CONECT 1852 1850 CONECT 1853 1850 CONECT 1854 1844 1849 1855 CONECT 1855 1854 CONECT 1856 1843 CONECT 1857 1842 CONECT 1858 1841 1859 1860 1861 CONECT 1859 1858 CONECT 1860 1858 CONECT 1861 1858 CONECT 1862 1841 CONECT 1863 1840 1864 CONECT 1864 1863 CONECT 1865 1840 1866 1868 1875 CONECT 1866 1865 1867 CONECT 1867 1866 CONECT 1868 1865 1869 1873 1874 CONECT 1869 1868 1870 1871 1872 CONECT 1870 1869 CONECT 1871 1869 CONECT 1872 1869 CONECT 1873 1838 1868 CONECT 1874 1868 CONECT 1875 1865 CONECT 1876 1839 CONECT 1877 1839 CONECT 1878 1838 CONECT 1879 1832 1836 1880 1890 CONECT 1880 1879 1881 1889 CONECT 1881 1880 1882 1888 CONECT 1882 1831 1881 1883 1887 CONECT 1883 1882 1884 1885 1886 CONECT 1884 1883 CONECT 1885 1883 CONECT 1886 1883 CONECT 1887 1882 CONECT 1888 1881 CONECT 1889 1880 CONECT 1890 1879 CONECT 1891 1836 CONECT 1892 1835 CONECT 1893 1835 CONECT 1894 1834 CONECT 1895 1834 CONECT 1896 1833 1897 1898 CONECT 1897 1896 CONECT 1898 1896 CONECT 1899 1832 CONECT 1900 1831 CONECT 1901 1830 1902 CONECT 1902 1901 CONECT 1903 1829 1904 1905 CONECT 1904 1903 CONECT 1905 1827 1903 1906 1916 CONECT 1906 1905 1907 1911 1915 CONECT 1907 1906 1908 1909 1910 CONECT 1908 1907 CONECT 1909 1907 CONECT 1910 1907 CONECT 1911 1906 1912 1913 1914 CONECT 1912 1911 CONECT 1913 1911 CONECT 1914 1911 CONECT 1915 1906 CONECT 1916 1905 CONECT 1917 1828 CONECT 1918 1826 1919 1928 1933 CONECT 1919 1819 1918 1920 1927 CONECT 1920 1919 1921 CONECT 1921 1920 1922 1923 CONECT 1922 1921 CONECT 1923 1921 1924 1925 1926 CONECT 1924 1923 CONECT 1925 1923 CONECT 1926 1923 CONECT 1927 1919 CONECT 1928 1918 1929 CONECT 1929 1928 1930 1931 1932 CONECT 1930 1929 CONECT 1931 1929 CONECT 1932 1929 CONECT 1933 1918 CONECT 1934 1826 CONECT 1935 1820 CONECT 1936 1819 1937 CONECT 1937 1936 1938 1939 CONECT 1938 1937 CONECT 1939 1937 1940 1941 CONECT 1940 1939 CONECT 1941 1939 CONECT 1942 1819 MASTER 0 0 0 0 0 0 0 0 1940 2 132 16 END
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Structure:
Ligand 2D
Ligand 3D
Protein
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Related entries of code: 4urm
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4uro
RCSB PDB
PDBbind
231aa, >4URO_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
4url
RCSB PDB
PDBbind
XAM
Entry Information
PDB ID
4urm
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
DNA GYRASE SUBUNIT B GyrB24
Ligand Name
XAM
EC.Number
E.C.5.99.1.3
Resolution
2.94(Å)
Affinity (Kd/Ki/IC50)
IC50=9nM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Acs Chem.Biol. Vol. 9: pp. 2023-2031
Ligand Properties
Formula
C
4
4
H
6
0
Cl
2
N
4
O
1
4
Molecular Weight
939.872
Exact Mass
938.348
No. of atoms
124
No. of bonds
129
Polar Surface Area
258.5
LOGP Value
4.86 (
Computed with XLOGP3
)
5.20 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 17
No. of Nitrogen and Oxygen Atoms: 18
No. of Rings: 6
Canonical SMILES
CO[C@@H]1[C@H](OC(=O)C)[C@H](OC(=O)N)[C@@H](O[C@H]1N1C(=O)/C(=C(\[C@H]2[C@@H](C)C=C[C@@H]3[C@@H]2C(=C)CC[C@H]3O[C@@H]2O[C@H](C)[C@H]([C@](C2)(O)[C@@H](NC(=O)c2[nH]c(c(c2Cl)Cl)C)C)O)/O)/C(=O)[C@@H]1C(C)C)C
InChI String
InChI=1S/C44H60Cl2N4O14/c1-16(2)33-35(53)29(41(56)50(33)42-38(59-10)37(62-23(9)51)36(20(6)61-42)64-43(47)57)34(52)28-18(4)11-13-24-25(14-12-17(3)27(24)28)63-26-15-44(58,39(54)21(7)60-26)22(8)49-40(55)32-31(46)30(45)19(5)48-32/h11,13,16,18,20-22,24-28,33,36-39,42,48,52,54,58H,3,12,14-15H2,1-2,4-10H3,(H2,47,57)(H,49,55)/b34-29+/t18-,20-,21+,22-,24-,25+,26-,27-,28-,33-,36+,37+,38+,39+,42+,44+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P0A0K8
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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