Browse entries in the PDBbind-CN Database
HEADER 4OS2_COMPLEX COMPND 4OS2_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 245 ILE ILE GLY GLY GLU PHE THR THR ILE GLU ASN GLN PRO SEQRES 2 A 245 TRP PHE ALA ALA ILE TYR ARG ARG HIS ARG GLY GLY SER SEQRES 3 A 245 VAL THR TYR VAL CYS GLY GLY SER LEU ILE SER PRO CYS SEQRES 4 A 245 TRP VAL ILE SER ALA THR HIS CYS PHE ILE ASP TYR PRO SEQRES 5 A 245 LYS LYS GLU ASP TYR ILE VAL TYR LEU GLY ARG SER ARG SEQRES 6 A 245 LEU ASN SER ASN THR GLN GLY GLU MET LYS PHE GLU VAL SEQRES 7 A 245 GLU ASN LEU ILE LEU HIS LYS ASP TYR SER ALA ASP THR SEQRES 8 A 245 LEU ALA HIS HIS ASN ASP ILE ALA LEU LEU LYS ILE ARG SEQRES 9 A 245 SER LYS GLU GLY ARG CYS ALA GLN PRO SER ARG THR ILE SEQRES 10 A 245 GLN THR ILE ALA LEU PRO SER MET TYR ASN ASP PRO GLN SEQRES 11 A 245 PHE GLY THR SER CYS GLU ILE THR GLY PHE GLY LYS GLU SEQRES 12 A 245 GLN SER THR ASP TYR LEU TYR PRO GLU GLN LEU LYS MET SEQRES 13 A 245 THR VAL VAL LYS LEU ILE SER HIS ARG GLU CYS GLN GLN SEQRES 14 A 245 PRO HIS TYR TYR GLY SER GLU VAL THR THR LYS MET LEU SEQRES 15 A 245 CYS ALA ALA ASP PRO GLN TRP LYS THR ASP SER CYS GLN SEQRES 16 A 245 GLY ASP SER GLY GLY PRO LEU VAL CYS SER LEU GLN GLY SEQRES 17 A 245 ARG MET THR LEU THR GLY ILE VAL SER TRP GLY ARG GLY SEQRES 18 A 245 CYS ALA LEU LYS ASP LYS PRO GLY VAL TYR THR ARG VAL SEQRES 19 A 245 SER HIS PHE LEU PRO TRP ILE ARG SER HIS THR HET GLY A 371 194 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 50 CYS A 111 SSBOND 3 CYS A 168 CYS A 182 SSBOND 4 CYS A 136 CYS A 201 SSBOND 5 CYS A 191 CYS A 220 ATOM 1 CA ILE A 16 50.142 54.491 19.711 1.00 16.24 C ATOM 2 C ILE A 16 49.238 54.736 20.917 1.00 16.71 C ATOM 3 O ILE A 16 49.711 54.757 22.077 1.00 15.20 O ATOM 4 CB ILE A 16 50.758 53.079 19.857 1.00 16.31 C ATOM 5 CG1 ILE A 16 51.743 52.775 18.722 1.00 17.04 C ATOM 6 CG2 ILE A 16 49.652 52.023 19.905 1.00 16.60 C ATOM 7 CD1 ILE A 16 51.127 52.629 17.355 1.00 17.72 C ATOM 8 N ILE A 17 47.949 54.901 20.635 1.00 17.48 N ATOM 9 CA ILE A 17 46.907 55.002 21.653 1.00 19.28 C ATOM 10 C ILE A 17 46.484 53.588 21.993 1.00 18.73 C ATOM 11 O ILE A 17 46.207 52.794 21.104 1.00 18.68 O ATOM 12 CB ILE A 17 45.650 55.729 21.128 1.00 20.64 C ATOM 13 CG1 ILE A 17 46.019 57.063 20.472 1.00 21.65 C ATOM 14 CG2 ILE A 17 44.614 55.899 22.240 1.00 21.07 C ATOM 15 CD1 ILE A 17 46.739 58.029 21.374 1.00 22.32 C ATOM 16 H ILE A 17 47.668 54.961 19.636 1.00 0.00 H ATOM 17 N GLY A 18 46.428 53.280 23.285 1.00 18.82 N ATOM 18 CA GLY A 18 46.055 51.950 23.708 1.00 18.20 C ATOM 19 C GLY A 18 47.171 50.988 23.361 1.00 17.69 C ATOM 20 O GLY A 18 48.342 51.347 23.437 1.00 17.87 O ATOM 21 H GLY A 18 46.655 54.003 23.997 1.00 0.00 H ATOM 22 N GLY A 19 46.813 49.774 22.965 1.00 17.77 N ATOM 23 CA GLY A 19 47.814 48.763 22.625 1.00 17.57 C ATOM 24 C GLY A 19 48.681 48.317 23.793 1.00 18.08 C ATOM 25 O GLY A 19 48.246 48.350 24.961 1.00 17.34 O ATOM 26 H GLY A 19 45.803 49.537 22.895 1.00 0.00 H ATOM 27 N GLU A 20 49.913 47.924 23.467 1.00 18.10 N ATOM 28 CA GLU A 20 50.878 47.399 24.430 1.00 17.81 C ATOM 29 C GLU A 20 52.277 47.978 24.225 1.00 17.97 C ATOM 30 O GLU A 20 52.707 48.282 23.096 1.00 17.11 O ATOM 31 CB GLU A 20 50.967 45.880 24.301 1.00 17.58 C ATOM 32 CG GLU A 20 49.666 45.144 24.558 1.00 17.88 C ATOM 33 CD GLU A 20 49.736 43.663 24.237 1.00 17.78 C ATOM 34 OE1 GLU A 20 48.668 43.033 24.230 1.00 18.02 O ATOM 35 OE2 GLU A 20 50.835 43.122 23.996 1.00 17.64 O ATOM 36 H GLU A 20 50.203 47.995 22.471 1.00 0.00 H ATOM 37 N PHE A 21 53.013 48.092 25.319 1.00 17.37 N ATOM 38 CA PHE A 21 54.449 48.314 25.223 1.00 17.73 C ATOM 39 C PHE A 21 55.076 47.057 24.620 1.00 17.16 C ATOM 40 O PHE A 21 54.615 45.941 24.847 1.00 17.16 O ATOM 41 CB PHE A 21 55.040 48.666 26.587 1.00 18.93 C ATOM 42 CG PHE A 21 54.533 49.967 27.110 1.00 21.16 C ATOM 43 CD1 PHE A 21 54.975 51.156 26.564 1.00 22.17 C ATOM 44 CD2 PHE A 21 53.558 50.006 28.098 1.00 23.14 C ATOM 45 CE1 PHE A 21 54.479 52.378 27.022 1.00 23.61 C ATOM 46 CE2 PHE A 21 53.058 51.220 28.551 1.00 24.23 C ATOM 47 CZ PHE A 21 53.532 52.405 28.017 1.00 24.11 C ATOM 48 H PHE A 21 52.563 48.023 26.254 1.00 0.00 H ATOM 49 N THR A 22 56.100 47.248 23.807 1.00 17.30 N ATOM 50 CA THR A 22 56.735 46.146 23.132 1.00 17.34 C ATOM 51 C THR A 22 58.244 46.302 23.252 1.00 17.83 C ATOM 52 O THR A 22 58.731 47.208 23.944 1.00 19.24 O ATOM 53 CB THR A 22 56.222 46.066 21.660 1.00 17.64 C ATOM 54 OG1 THR A 22 56.646 44.843 21.042 1.00 16.87 O ATOM 55 CG2 THR A 22 56.668 47.243 20.845 1.00 16.95 C ATOM 56 HG1 THR A 22 56.283 44.075 21.550 1.00 0.00 H ATOM 57 H THR A 22 56.454 48.213 23.652 1.00 0.00 H ATOM 58 N THR A 23 58.978 45.404 22.605 1.00 18.24 N ATOM 59 CA THR A 23 60.417 45.491 22.520 1.00 18.93 C ATOM 60 C THR A 23 60.830 45.223 21.078 1.00 18.54 C ATOM 61 O THR A 23 60.070 44.623 20.334 1.00 18.48 O ATOM 62 CB THR A 23 61.099 44.517 23.490 1.00 20.47 C ATOM 63 OG1 THR A 23 62.493 44.839 23.587 1.00 23.00 O ATOM 64 CG2 THR A 23 60.912 43.084 23.056 1.00 21.08 C ATOM 65 HG1 THR A 23 62.911 44.763 22.693 1.00 0.00 H ATOM 66 H THR A 23 58.498 44.607 22.141 1.00 0.00 H ATOM 67 N ILE A 24 62.029 45.660 20.697 1.00 18.42 N ATOM 68 CA ILE A 24 62.429 45.617 19.280 1.00 18.28 C ATOM 69 C ILE A 24 62.555 44.186 18.720 1.00 18.59 C ATOM 70 O ILE A 24 62.384 43.960 17.510 1.00 18.59 O ATOM 71 CB ILE A 24 63.712 46.451 19.043 1.00 18.54 C ATOM 72 CG1 ILE A 24 63.881 46.767 17.553 1.00 18.55 C ATOM 73 CG2 ILE A 24 64.945 45.758 19.607 1.00 18.55 C ATOM 74 CD1 ILE A 24 62.816 47.689 17.002 1.00 17.92 C ATOM 75 H ILE A 24 62.690 46.035 21.407 1.00 0.00 H ATOM 76 N GLU A 25 62.848 43.216 19.581 1.00 19.11 N ATOM 77 CA GLU A 25 62.869 41.805 19.151 1.00 20.34 C ATOM 78 C GLU A 25 61.522 41.326 18.597 1.00 20.09 C ATOM 79 O GLU A 25 61.485 40.408 17.783 1.00 19.67 O ATOM 80 CB GLU A 25 63.316 40.878 20.306 1.00 21.62 C ATOM 81 CG GLU A 25 63.694 39.481 19.834 1.00 22.15 C ATOM 82 CD GLU A 25 64.151 38.559 20.949 1.00 22.79 C ATOM 83 OE1 GLU A 25 64.557 39.047 22.025 1.00 22.86 O ATOM 84 OE2 GLU A 25 64.116 37.332 20.731 1.00 23.29 O ATOM 85 H GLU A 25 63.065 43.455 20.570 1.00 0.00 H ATOM 86 N ASN A 26 60.421 41.951 19.019 1.00 19.36 N ATOM 87 CA ASN A 26 59.091 41.599 18.524 1.00 20.12 C ATOM 88 C ASN A 26 58.724 42.374 17.255 1.00 20.42 C ATOM 89 O ASN A 26 57.742 42.047 16.601 1.00 21.22 O ATOM 90 CB ASN A 26 58.030 41.854 19.598 1.00 20.57 C ATOM 91 CG ASN A 26 58.258 41.032 20.848 1.00 21.45 C ATOM 92 OD1 ASN A 26 59.214 40.262 20.931 1.00 20.75 O ATOM 93 ND2 ASN A 26 57.378 41.191 21.829 1.00 22.32 N ATOM 94 HD22 ASN A 26 56.585 41.854 21.714 1.00 0.00 H ATOM 95 HD21 ASN A 26 57.482 40.653 22.713 1.00 0.00 H ATOM 96 H ASN A 26 60.512 42.712 19.722 1.00 0.00 H ATOM 97 N GLN A 27 59.534 43.382 16.920 1.00 20.55 N ATOM 98 CA GLN A 27 59.308 44.264 15.770 1.00 20.25 C ATOM 99 C GLN A 27 60.635 44.587 15.057 1.00 18.63 C ATOM 100 O GLN A 27 60.947 45.762 14.852 1.00 18.39 O ATOM 101 CB GLN A 27 58.710 45.600 16.282 1.00 20.98 C ATOM 102 CG GLN A 27 57.672 45.519 17.400 1.00 22.21 C ATOM 103 CD GLN A 27 56.365 44.876 16.993 1.00 21.45 C ATOM 104 OE1 GLN A 27 55.576 44.488 17.855 1.00 21.26 O ATOM 105 NE2 GLN A 27 56.124 44.750 15.685 1.00 21.85 N ATOM 106 HE22 GLN A 27 56.820 45.093 14.993 1.00 0.00 H ATOM 107 HE21 GLN A 27 55.240 44.309 15.359 1.00 0.00 H ATOM 108 H GLN A 27 60.374 43.551 17.509 1.00 0.00 H ATOM 109 N PRO A 28 61.433 43.557 14.674 1.00 17.69 N ATOM 110 CA PRO A 28 62.854 43.798 14.370 1.00 17.58 C ATOM 111 C PRO A 28 63.169 44.570 13.070 1.00 17.04 C ATOM 112 O PRO A 28 64.329 44.929 12.831 1.00 17.72 O ATOM 113 CB PRO A 28 63.447 42.386 14.301 1.00 18.02 C ATOM 114 CG PRO A 28 62.291 41.508 13.956 1.00 17.64 C ATOM 115 CD PRO A 28 61.093 42.122 14.602 1.00 17.82 C ATOM 116 N TRP A 29 62.144 44.809 12.261 1.00 17.22 N ATOM 117 CA TRP A 29 62.251 45.630 11.049 1.00 16.96 C ATOM 118 C TRP A 29 62.021 47.105 11.362 1.00 16.21 C ATOM 119 O TRP A 29 62.110 47.930 10.469 1.00 15.70 O ATOM 120 CB TRP A 29 61.218 45.191 9.998 1.00 17.94 C ATOM 121 CG TRP A 29 59.865 45.028 10.595 1.00 19.14 C ATOM 122 CD1 TRP A 29 58.961 46.013 10.890 1.00 19.71 C ATOM 123 CD2 TRP A 29 59.302 43.807 11.073 1.00 20.49 C ATOM 124 NE1 TRP A 29 57.848 45.464 11.491 1.00 20.60 N ATOM 125 CE2 TRP A 29 58.042 44.114 11.627 1.00 21.51 C ATOM 126 CE3 TRP A 29 59.741 42.480 11.081 1.00 20.67 C ATOM 127 CZ2 TRP A 29 57.205 43.131 12.161 1.00 22.19 C ATOM 128 CZ3 TRP A 29 58.917 41.516 11.602 1.00 21.68 C ATOM 129 CH2 TRP A 29 57.666 41.843 12.142 1.00 21.66 C ATOM 130 HE1 TRP A 29 57.001 45.988 11.791 1.00 0.00 H ATOM 131 H TRP A 29 61.220 44.394 12.498 1.00 0.00 H ATOM 132 N PHE A 30 61.727 47.437 12.618 1.00 15.06 N ATOM 133 CA PHE A 30 61.317 48.800 12.934 1.00 15.49 C ATOM 134 C PHE A 30 62.522 49.744 12.991 1.00 15.25 C ATOM 135 O PHE A 30 63.494 49.466 13.694 1.00 16.08 O ATOM 136 CB PHE A 30 60.547 48.893 14.258 1.00 15.32 C ATOM 137 CG PHE A 30 60.126 50.298 14.582 1.00 15.26 C ATOM 138 CD1 PHE A 30 59.052 50.876 13.924 1.00 15.52 C ATOM 139 CD2 PHE A 30 60.858 51.077 15.471 1.00 15.69 C ATOM 140 CE1 PHE A 30 58.672 52.190 14.186 1.00 15.69 C ATOM 141 CE2 PHE A 30 60.492 52.399 15.725 1.00 15.86 C ATOM 142 CZ PHE A 30 59.403 52.953 15.083 1.00 15.48 C ATOM 143 H PHE A 30 61.790 46.724 13.373 1.00 0.00 H ATOM 144 N ALA A 31 62.422 50.853 12.256 1.00 15.14 N ATOM 145 CA ALA A 31 63.468 51.870 12.173 1.00 14.67 C ATOM 146 C ALA A 31 62.999 53.123 12.895 1.00 14.22 C ATOM 147 O ALA A 31 61.890 53.586 12.689 1.00 15.90 O ATOM 148 CB ALA A 31 63.769 52.199 10.705 1.00 14.88 C ATOM 149 H ALA A 31 61.549 51.002 11.711 1.00 0.00 H ATOM 150 N ALA A 32 63.846 53.664 13.753 1.00 14.23 N ATOM 151 CA ALA A 32 63.558 54.886 14.465 1.00 14.34 C ATOM 152 C ALA A 32 64.366 56.010 13.840 1.00 13.80 C ATOM 153 O ALA A 32 65.599 55.947 13.789 1.00 13.88 O ATOM 154 CB ALA A 32 63.920 54.727 15.939 1.00 14.28 C ATOM 155 H ALA A 32 64.756 53.190 13.922 1.00 0.00 H ATOM 156 N ILE A 33 63.669 57.045 13.379 1.00 14.17 N ATOM 157 CA ILE A 33 64.302 58.133 12.621 1.00 14.01 C ATOM 158 C ILE A 33 64.242 59.445 13.386 1.00 14.70 C ATOM 159 O ILE A 33 63.159 59.909 13.780 1.00 15.10 O ATOM 160 CB ILE A 33 63.656 58.329 11.240 1.00 14.23 C ATOM 161 CG1 ILE A 33 63.568 56.987 10.515 1.00 14.17 C ATOM 162 CG2 ILE A 33 64.469 59.340 10.430 1.00 14.23 C ATOM 163 CD1 ILE A 33 62.831 57.032 9.189 1.00 14.17 C ATOM 164 H ILE A 33 62.646 57.085 13.560 1.00 0.00 H ATOM 165 N TYR A 34 65.419 60.034 13.582 1.00 15.69 N ATOM 166 CA TYR A 34 65.573 61.267 14.336 1.00 16.74 C ATOM 167 C TYR A 34 66.186 62.357 13.457 1.00 17.71 C ATOM 168 O TYR A 34 66.740 62.067 12.403 1.00 17.30 O ATOM 169 CB TYR A 34 66.502 61.045 15.505 1.00 16.50 C ATOM 170 CG TYR A 34 66.126 59.986 16.525 1.00 16.31 C ATOM 171 CD1 TYR A 34 66.257 58.630 16.250 1.00 17.07 C ATOM 172 CD2 TYR A 34 65.731 60.352 17.805 1.00 16.92 C ATOM 173 CE1 TYR A 34 65.957 57.671 17.200 1.00 17.09 C ATOM 174 CE2 TYR A 34 65.444 59.402 18.768 1.00 17.08 C ATOM 175 CZ TYR A 34 65.562 58.069 18.466 1.00 18.02 C ATOM 176 OH TYR A 34 65.278 57.121 19.424 1.00 18.79 O ATOM 177 HH TYR A 34 65.880 57.247 20.200 1.00 0.00 H ATOM 178 H TYR A 34 66.268 59.591 13.177 1.00 0.00 H ATOM 179 N ARG A 35 66.084 63.608 13.889 1.00 18.69 N ATOM 180 CA ARG A 35 66.709 64.725 13.173 1.00 20.56 C ATOM 181 C ARG A 35 67.537 65.550 14.129 1.00 21.59 C ATOM 182 O ARG A 35 67.086 65.854 15.232 1.00 20.54 O ATOM 183 CB ARG A 35 65.666 65.629 12.529 1.00 22.38 C ATOM 184 CG ARG A 35 66.283 66.731 11.685 1.00 24.72 C ATOM 185 CD ARG A 35 65.299 67.348 10.714 1.00 25.95 C ATOM 186 NE ARG A 35 64.306 68.204 11.356 1.00 27.29 N ATOM 187 CZ ARG A 35 64.488 69.483 11.692 1.00 29.21 C ATOM 188 NH1 ARG A 35 65.652 70.090 11.490 1.00 29.24 N ATOM 189 NH2 ARG A 35 63.491 70.158 12.251 1.00 30.04 N ATOM 190 HE ARG A 35 63.380 67.782 11.569 1.00 0.00 H ATOM 191 HH12 ARG A 35 65.772 71.087 11.759 1.00 0.00 H ATOM 192 HH11 ARG A 35 66.443 69.568 11.062 1.00 0.00 H ATOM 193 HH22 ARG A 35 63.622 71.155 12.517 1.00 0.00 H ATOM 194 HH21 ARG A 35 62.578 69.690 12.423 1.00 0.00 H ATOM 195 H ARG A 35 65.547 63.801 14.758 1.00 0.00 H ATOM 196 N ARG A 36 68.744 65.898 13.695 1.00 23.40 N ATOM 197 CA ARG A 36 69.624 66.769 14.455 1.00 25.94 C ATOM 198 C ARG A 36 69.302 68.207 14.080 1.00 27.92 C ATOM 199 O ARG A 36 69.228 68.550 12.895 1.00 27.31 O ATOM 200 CB ARG A 36 71.078 66.443 14.137 1.00 26.96 C ATOM 201 CG ARG A 36 72.102 67.120 15.039 1.00 27.82 C ATOM 202 CD ARG A 36 73.531 66.777 14.629 1.00 28.79 C ATOM 203 NE ARG A 36 73.713 65.352 14.343 1.00 29.79 N ATOM 204 CZ ARG A 36 73.679 64.822 13.123 1.00 30.33 C ATOM 205 NH1 ARG A 36 73.474 65.595 12.067 1.00 31.59 N ATOM 206 NH2 ARG A 36 73.846 63.520 12.958 1.00 30.57 N ATOM 207 HE ARG A 36 73.880 64.713 15.146 1.00 0.00 H ATOM 208 HH12 ARG A 36 73.448 65.178 11.115 1.00 0.00 H ATOM 209 HH11 ARG A 36 73.339 66.619 12.190 1.00 0.00 H ATOM 210 HH22 ARG A 36 73.819 63.109 12.003 1.00 0.00 H ATOM 211 HH21 ARG A 36 74.004 62.907 13.783 1.00 0.00 H ATOM 212 H ARG A 36 69.071 65.533 12.777 1.00 0.00 H ATOM 213 N HIS A 37 69.120 69.041 15.094 1.00 31.42 N ATOM 214 CA HIS A 37 68.750 70.439 14.895 1.00 34.78 C ATOM 215 C HIS A 37 69.951 71.357 14.957 1.00 37.34 C ATOM 216 O HIS A 37 70.991 70.997 15.516 1.00 38.26 O ATOM 217 CB HIS A 37 67.743 70.865 15.957 1.00 35.02 C ATOM 218 CG HIS A 37 66.387 70.292 15.740 1.00 34.88 C ATOM 219 ND1 HIS A 37 66.106 68.961 15.952 1.00 34.77 N ATOM 220 CD2 HIS A 37 65.239 70.858 15.305 1.00 34.72 C ATOM 221 CE1 HIS A 37 64.840 68.735 15.663 1.00 34.01 C ATOM 222 NE2 HIS A 37 64.289 69.869 15.275 1.00 35.71 N ATOM 223 H HIS A 37 69.245 68.687 16.064 1.00 0.00 H ATOM 224 N ARG A 37A 69.791 72.553 14.393 1.00 39.99 N ATOM 225 CA ARG A 37A 70.796 73.597 14.552 1.00 41.50 C ATOM 226 C ARG A 37A 70.936 73.860 16.043 1.00 42.27 C ATOM 227 O ARG A 37A 69.945 74.105 16.737 1.00 43.54 O ATOM 228 CB ARG A 37A 70.417 74.864 13.776 1.00 40.70 C ATOM 229 CG ARG A 37A 70.411 74.691 12.260 1.00 40.53 C ATOM 230 CD ARG A 37A 71.780 74.311 11.702 1.00 40.89 C ATOM 231 NE ARG A 37A 72.171 72.943 12.043 1.00 41.30 N ATOM 232 CZ ARG A 37A 71.955 71.884 11.267 1.00 41.50 C ATOM 233 NH1 ARG A 37A 71.366 72.024 10.084 1.00 40.67 N ATOM 234 NH2 ARG A 37A 72.340 70.681 11.673 1.00 41.13 N ATOM 235 HE ARG A 37A 72.650 72.788 12.953 1.00 0.00 H ATOM 236 HH12 ARG A 37A 71.201 71.191 9.484 1.00 0.00 H ATOM 237 HH11 ARG A 37A 71.070 72.966 9.759 1.00 0.00 H ATOM 238 HH22 ARG A 37A 72.173 69.850 11.070 1.00 0.00 H ATOM 239 HH21 ARG A 37A 72.809 70.569 12.595 1.00 0.00 H ATOM 240 H ARG A 37A 68.937 72.745 13.831 1.00 0.00 H ATOM 241 N GLY A 37B 72.167 73.743 16.533 1.00 42.78 N ATOM 242 CA GLY A 37B 72.438 73.782 17.965 1.00 42.65 C ATOM 243 C GLY A 37B 72.837 72.421 18.494 1.00 42.72 C ATOM 244 O GLY A 37B 73.438 72.320 19.566 1.00 42.93 O ATOM 245 H GLY A 37B 72.962 73.620 15.874 1.00 0.00 H ATOM 246 N GLY A 37C 72.475 71.368 17.759 1.00 43.24 N ATOM 247 CA GLY A 37C 72.894 70.003 18.089 1.00 42.19 C ATOM 248 C GLY A 37C 71.905 69.159 18.886 1.00 40.77 C ATOM 249 O GLY A 37C 72.237 68.043 19.287 1.00 42.82 O ATOM 250 H GLY A 37C 71.875 71.521 16.923 1.00 0.00 H ATOM 251 N SER A 37D 70.701 69.670 19.135 1.00 38.43 N ATOM 252 CA SER A 37D 69.669 68.858 19.789 1.00 36.88 C ATOM 253 C SER A 37D 69.114 67.874 18.754 1.00 33.50 C ATOM 254 O SER A 37D 69.069 68.188 17.556 1.00 29.59 O ATOM 255 CB SER A 37D 68.552 69.724 20.390 1.00 37.99 C ATOM 256 OG SER A 37D 67.661 70.213 19.396 1.00 40.98 O ATOM 257 HG SER A 37D 66.960 70.764 19.826 1.00 0.00 H ATOM 258 H SER A 37D 70.491 70.652 18.864 1.00 0.00 H ATOM 259 N VAL A 38 68.724 66.689 19.218 1.00 31.10 N ATOM 260 CA VAL A 38 68.156 65.654 18.352 1.00 30.87 C ATOM 261 C VAL A 38 66.725 65.351 18.794 1.00 30.28 C ATOM 262 O VAL A 38 66.467 65.153 19.985 1.00 30.38 O ATOM 263 CB VAL A 38 68.993 64.358 18.381 1.00 31.16 C ATOM 264 CG1 VAL A 38 68.410 63.311 17.442 1.00 31.45 C ATOM 265 CG2 VAL A 38 70.440 64.634 17.993 1.00 31.39 C ATOM 266 H VAL A 38 68.827 66.491 20.234 1.00 0.00 H ATOM 267 N THR A 39 65.797 65.343 17.839 1.00 25.81 N ATOM 268 CA THR A 39 64.401 65.040 18.126 1.00 25.02 C ATOM 269 C THR A 39 63.923 63.883 17.254 1.00 22.01 C ATOM 270 O THR A 39 64.450 63.654 16.161 1.00 19.20 O ATOM 271 CB THR A 39 63.469 66.242 17.892 1.00 26.73 C ATOM 272 OG1 THR A 39 63.460 66.590 16.504 1.00 29.03 O ATOM 273 CG2 THR A 39 63.894 67.455 18.724 1.00 28.98 C ATOM 274 HG1 THR A 39 63.138 65.819 15.974 1.00 0.00 H ATOM 275 H THR A 39 66.077 65.559 16.861 1.00 0.00 H ATOM 276 N TYR A 40 62.926 63.164 17.755 1.00 19.46 N ATOM 277 CA TYR A 40 62.327 62.058 17.022 1.00 17.95 C ATOM 278 C TYR A 40 61.407 62.599 15.937 1.00 17.35 C ATOM 279 O TYR A 40 60.624 63.504 16.180 1.00 17.38 O ATOM 280 CB TYR A 40 61.540 61.162 17.972 1.00 17.55 C ATOM 281 CG TYR A 40 61.063 59.894 17.315 1.00 16.24 C ATOM 282 CD1 TYR A 40 61.964 58.901 16.969 1.00 16.97 C ATOM 283 CD2 TYR A 40 59.727 59.703 17.011 1.00 16.18 C ATOM 284 CE1 TYR A 40 61.543 57.742 16.349 1.00 16.18 C ATOM 285 CE2 TYR A 40 59.290 58.543 16.401 1.00 16.03 C ATOM 286 CZ TYR A 40 60.204 57.562 16.083 1.00 16.29 C ATOM 287 OH TYR A 40 59.800 56.391 15.480 1.00 17.10 O ATOM 288 HH TYR A 40 59.153 55.925 16.067 1.00 0.00 H ATOM 289 H TYR A 40 62.561 63.398 18.700 1.00 0.00 H ATOM 290 N VAL A 41 61.510 62.024 14.744 1.00 16.30 N ATOM 291 CA VAL A 41 60.726 62.442 13.594 1.00 15.72 C ATOM 292 C VAL A 41 59.598 61.461 13.275 1.00 15.11 C ATOM 293 O VAL A 41 58.429 61.805 13.379 1.00 15.05 O ATOM 294 CB VAL A 41 61.645 62.576 12.376 1.00 16.18 C ATOM 295 CG1 VAL A 41 60.846 62.844 11.112 1.00 16.87 C ATOM 296 CG2 VAL A 41 62.650 63.691 12.618 1.00 16.90 C ATOM 297 H VAL A 41 62.182 61.239 14.628 1.00 0.00 H ATOM 298 N CYS A 42 59.963 60.241 12.893 1.00 14.91 N ATOM 299 CA CYS A 42 59.028 59.255 12.382 1.00 14.93 C ATOM 300 C CYS A 42 59.617 57.861 12.484 1.00 13.92 C ATOM 301 O CYS A 42 60.813 57.691 12.737 1.00 13.45 O ATOM 302 CB CYS A 42 58.740 59.543 10.898 1.00 15.95 C ATOM 303 SG CYS A 42 57.507 60.814 10.598 1.00 18.53 S ATOM 304 H CYS A 42 60.967 59.980 12.964 1.00 0.00 H ATOM 305 N GLY A 43 58.760 56.870 12.250 1.00 13.39 N ATOM 306 CA GLY A 43 59.155 55.491 12.163 1.00 13.66 C ATOM 307 C GLY A 43 59.424 55.141 10.708 1.00 13.80 C ATOM 308 O GLY A 43 59.235 55.964 9.804 1.00 14.23 O ATOM 309 H GLY A 43 57.755 57.105 12.124 1.00 0.00 H ATOM 310 N GLY A 44 59.895 53.922 10.506 1.00 14.76 N ATOM 311 CA GLY A 44 60.187 53.387 9.174 1.00 14.77 C ATOM 312 C GLY A 44 60.336 51.881 9.290 1.00 15.14 C ATOM 313 O GLY A 44 60.287 51.324 10.387 1.00 14.18 O ATOM 314 H GLY A 44 60.066 53.314 11.332 1.00 0.00 H ATOM 315 N SER A 45 60.500 51.221 8.153 1.00 15.32 N ATOM 316 CA SER A 45 60.625 49.778 8.115 1.00 16.51 C ATOM 317 C SER A 45 61.812 49.368 7.270 1.00 17.18 C ATOM 318 O SER A 45 62.002 49.881 6.158 1.00 16.09 O ATOM 319 CB SER A 45 59.370 49.147 7.520 1.00 16.93 C ATOM 320 OG SER A 45 58.218 49.513 8.232 1.00 18.15 O ATOM 321 HG SER A 45 58.115 50.497 8.207 1.00 0.00 H ATOM 322 H SER A 45 60.540 51.755 7.261 1.00 0.00 H ATOM 323 N LEU A 46 62.581 48.409 7.772 1.00 17.93 N ATOM 324 CA LEU A 46 63.727 47.894 7.031 1.00 18.88 C ATOM 325 C LEU A 46 63.243 46.860 5.998 1.00 19.10 C ATOM 326 O LEU A 46 62.741 45.799 6.367 1.00 17.83 O ATOM 327 CB LEU A 46 64.734 47.273 7.999 1.00 19.26 C ATOM 328 CG LEU A 46 66.053 46.824 7.369 1.00 19.51 C ATOM 329 CD1 LEU A 46 66.934 48.006 6.984 1.00 20.26 C ATOM 330 CD2 LEU A 46 66.782 45.905 8.330 1.00 20.09 C ATOM 331 H LEU A 46 62.362 48.018 8.711 1.00 0.00 H ATOM 332 N ILE A 47 63.372 47.179 4.706 1.00 20.27 N ATOM 333 CA ILE A 47 62.905 46.263 3.650 1.00 21.50 C ATOM 334 C ILE A 47 64.052 45.505 2.951 1.00 23.89 C ATOM 335 O ILE A 47 63.837 44.478 2.309 1.00 23.91 O ATOM 336 CB ILE A 47 62.005 46.973 2.620 1.00 22.12 C ATOM 337 CG1 ILE A 47 62.687 48.217 2.048 1.00 21.71 C ATOM 338 CG2 ILE A 47 60.675 47.339 3.267 1.00 22.42 C ATOM 339 CD1 ILE A 47 62.113 48.685 0.730 1.00 22.59 C ATOM 340 H ILE A 47 63.808 48.086 4.443 1.00 0.00 H ATOM 341 N SER A 48 65.264 46.013 3.092 1.00 24.63 N ATOM 342 CA SER A 48 66.455 45.280 2.685 1.00 26.23 C ATOM 343 C SER A 48 67.582 45.830 3.541 1.00 26.04 C ATOM 344 O SER A 48 67.402 46.861 4.193 1.00 25.22 O ATOM 345 CB SER A 48 66.729 45.464 1.190 1.00 27.05 C ATOM 346 OG SER A 48 67.229 46.756 0.924 1.00 29.42 O ATOM 347 HG SER A 48 68.074 46.890 1.422 1.00 0.00 H ATOM 348 H SER A 48 65.370 46.962 3.505 1.00 0.00 H ATOM 349 N PRO A 49 68.738 45.151 3.572 1.00 25.14 N ATOM 350 CA PRO A 49 69.777 45.623 4.475 1.00 25.78 C ATOM 351 C PRO A 49 70.161 47.101 4.308 1.00 24.17 C ATOM 352 O PRO A 49 70.497 47.734 5.304 1.00 23.89 O ATOM 353 CB PRO A 49 70.957 44.703 4.162 1.00 26.61 C ATOM 354 CG PRO A 49 70.322 43.444 3.668 1.00 26.75 C ATOM 355 CD PRO A 49 69.107 43.885 2.911 1.00 27.16 C ATOM 356 N CYS A 50 70.085 47.639 3.085 1.00 24.23 N ATOM 357 CA CYS A 50 70.459 49.043 2.824 1.00 25.22 C ATOM 358 C CYS A 50 69.284 50.025 2.706 1.00 22.73 C ATOM 359 O CYS A 50 69.515 51.215 2.526 1.00 23.05 O ATOM 360 CB CYS A 50 71.310 49.160 1.548 1.00 28.11 C ATOM 361 SG CYS A 50 72.800 48.124 1.534 1.00 33.98 S ATOM 362 H CYS A 50 69.752 47.050 2.295 1.00 0.00 H ATOM 363 N TRP A 51 68.046 49.555 2.820 1.00 20.74 N ATOM 364 CA TRP A 51 66.901 50.404 2.524 1.00 20.51 C ATOM 365 C TRP A 51 65.838 50.408 3.606 1.00 19.16 C ATOM 366 O TRP A 51 65.337 49.357 4.004 1.00 19.26 O ATOM 367 CB TRP A 51 66.262 49.963 1.216 1.00 21.45 C ATOM 368 CG TRP A 51 67.086 50.271 0.018 1.00 23.29 C ATOM 369 CD1 TRP A 51 67.887 49.412 -0.671 1.00 24.98 C ATOM 370 CD2 TRP A 51 67.180 51.529 -0.651 1.00 24.09 C ATOM 371 NE1 TRP A 51 68.467 50.052 -1.736 1.00 24.41 N ATOM 372 CE2 TRP A 51 68.050 51.354 -1.749 1.00 25.29 C ATOM 373 CE3 TRP A 51 66.601 52.781 -0.442 1.00 24.55 C ATOM 374 CZ2 TRP A 51 68.368 52.392 -2.623 1.00 25.57 C ATOM 375 CZ3 TRP A 51 66.909 53.806 -1.308 1.00 25.37 C ATOM 376 CH2 TRP A 51 67.785 53.606 -2.391 1.00 25.84 C ATOM 377 HE1 TRP A 51 69.118 49.618 -2.422 1.00 0.00 H ATOM 378 H TRP A 51 67.894 48.572 3.123 1.00 0.00 H ATOM 379 N VAL A 52 65.493 51.609 4.062 1.00 18.44 N ATOM 380 CA VAL A 52 64.371 51.819 4.971 1.00 18.49 C ATOM 381 C VAL A 52 63.252 52.539 4.238 1.00 18.08 C ATOM 382 O VAL A 52 63.503 53.489 3.503 1.00 18.37 O ATOM 383 CB VAL A 52 64.805 52.646 6.193 1.00 18.46 C ATOM 384 CG1 VAL A 52 63.607 53.100 7.010 1.00 18.85 C ATOM 385 CG2 VAL A 52 65.761 51.835 7.036 1.00 18.64 C ATOM 386 H VAL A 52 66.047 52.435 3.757 1.00 0.00 H ATOM 387 N ILE A 53 62.023 52.087 4.435 1.00 17.03 N ATOM 388 CA ILE A 53 60.865 52.732 3.829 1.00 18.05 C ATOM 389 C ILE A 53 60.072 53.503 4.895 1.00 16.97 C ATOM 390 O ILE A 53 59.925 53.057 6.041 1.00 17.09 O ATOM 391 CB ILE A 53 59.979 51.721 3.059 1.00 19.10 C ATOM 392 CG1 ILE A 53 58.928 52.438 2.227 1.00 21.55 C ATOM 393 CG2 ILE A 53 59.321 50.724 3.992 1.00 18.78 C ATOM 394 CD1 ILE A 53 58.373 51.558 1.116 1.00 22.29 C ATOM 395 H ILE A 53 61.881 51.251 5.037 1.00 0.00 H ATOM 396 N SER A 54 59.588 54.672 4.515 1.00 16.83 N ATOM 397 CA SER A 54 58.889 55.571 5.440 1.00 16.53 C ATOM 398 C SER A 54 57.919 56.439 4.628 1.00 16.18 C ATOM 399 O SER A 54 57.532 56.058 3.506 1.00 15.31 O ATOM 400 CB SER A 54 59.912 56.410 6.213 1.00 16.89 C ATOM 401 OG SER A 54 59.312 57.104 7.304 1.00 17.86 O ATOM 402 HG SER A 54 58.910 56.450 7.929 1.00 0.00 H ATOM 403 H SER A 54 59.707 54.966 3.524 1.00 0.00 H ATOM 404 N ALA A 55 57.496 57.565 5.191 1.00 15.50 N ATOM 405 CA ALA A 55 56.540 58.461 4.541 1.00 16.13 C ATOM 406 C ALA A 55 57.229 59.764 4.106 1.00 15.68 C ATOM 407 O ALA A 55 58.041 60.320 4.829 1.00 15.56 O ATOM 408 CB ALA A 55 55.360 58.737 5.465 1.00 16.34 C ATOM 409 H ALA A 55 57.859 57.820 6.132 1.00 0.00 H ATOM 410 N THR A 56 56.951 60.228 2.890 1.00 15.65 N ATOM 411 CA THR A 56 57.504 61.498 2.445 1.00 15.19 C ATOM 412 C THR A 56 57.136 62.684 3.366 1.00 15.11 C ATOM 413 O THR A 56 57.965 63.560 3.598 1.00 14.74 O ATOM 414 CB THR A 56 57.093 61.806 0.987 1.00 15.89 C ATOM 415 OG1 THR A 56 57.955 61.061 0.126 1.00 16.04 O ATOM 416 CG2 THR A 56 57.232 63.291 0.685 1.00 16.08 C ATOM 417 HG1 THR A 56 57.854 60.095 0.316 1.00 0.00 H ATOM 418 H THR A 56 56.336 59.680 2.255 1.00 0.00 H ATOM 419 N HIS A 57 55.922 62.695 3.912 1.00 15.41 N ATOM 420 CA HIS A 57 55.508 63.830 4.755 1.00 15.77 C ATOM 421 C HIS A 57 56.444 64.053 5.938 1.00 15.48 C ATOM 422 O HIS A 57 56.544 65.172 6.434 1.00 16.77 O ATOM 423 CB HIS A 57 54.044 63.727 5.199 1.00 15.00 C ATOM 424 CG HIS A 57 53.823 62.909 6.434 1.00 15.06 C ATOM 425 ND1 HIS A 57 53.164 61.703 6.416 1.00 15.25 N ATOM 426 CD2 HIS A 57 54.157 63.139 7.727 1.00 15.66 C ATOM 427 CE1 HIS A 57 53.097 61.222 7.647 1.00 16.39 C ATOM 428 NE2 HIS A 57 53.688 62.077 8.460 1.00 16.49 N ATOM 429 H HIS A 57 55.268 61.904 3.744 1.00 0.00 H ATOM 430 N CYS A 58 57.162 63.014 6.362 1.00 15.44 N ATOM 431 CA CYS A 58 58.093 63.125 7.496 1.00 15.97 C ATOM 432 C CYS A 58 59.333 63.971 7.204 1.00 16.50 C ATOM 433 O CYS A 58 59.967 64.430 8.129 1.00 16.54 O ATOM 434 CB CYS A 58 58.559 61.749 7.968 1.00 16.73 C ATOM 435 SG CYS A 58 57.254 60.685 8.577 1.00 17.22 S ATOM 436 H CYS A 58 57.062 62.099 5.878 1.00 0.00 H ATOM 437 N PHE A 59 59.645 64.193 5.920 1.00 16.08 N ATOM 438 CA PHE A 59 60.896 64.831 5.485 1.00 17.11 C ATOM 439 C PHE A 59 60.724 66.062 4.603 1.00 16.97 C ATOM 440 O PHE A 59 61.673 66.844 4.452 1.00 16.90 O ATOM 441 CB PHE A 59 61.731 63.815 4.697 1.00 17.62 C ATOM 442 CG PHE A 59 61.886 62.515 5.409 1.00 19.03 C ATOM 443 CD1 PHE A 59 62.782 62.401 6.457 1.00 19.99 C ATOM 444 CD2 PHE A 59 61.101 61.418 5.072 1.00 19.27 C ATOM 445 CE1 PHE A 59 62.911 61.204 7.145 1.00 20.96 C ATOM 446 CE2 PHE A 59 61.238 60.216 5.745 1.00 19.36 C ATOM 447 CZ PHE A 59 62.132 60.115 6.796 1.00 20.55 C ATOM 448 H PHE A 59 58.965 63.898 5.191 1.00 0.00 H ATOM 449 N ILE A 60 59.522 66.244 4.061 1.00 16.65 N ATOM 450 CA ILE A 60 59.256 67.241 3.004 1.00 17.54 C ATOM 451 C ILE A 60 59.620 68.681 3.407 1.00 17.59 C ATOM 452 O ILE A 60 60.076 69.470 2.563 1.00 16.74 O ATOM 453 CB ILE A 60 57.789 67.125 2.506 1.00 17.57 C ATOM 454 CG1 ILE A 60 57.556 67.904 1.204 1.00 18.19 C ATOM 455 CG2 ILE A 60 56.798 67.598 3.561 1.00 17.92 C ATOM 456 CD1 ILE A 60 58.208 67.306 -0.013 1.00 18.68 C ATOM 457 H ILE A 60 58.733 65.656 4.398 1.00 0.00 H ATOM 458 N ASP A 60A 59.446 69.024 4.687 1.00 17.15 N ATOM 459 CA ASP A 60A 59.803 70.367 5.162 1.00 18.80 C ATOM 460 C ASP A 60A 61.297 70.534 5.485 1.00 17.80 C ATOM 461 O ASP A 60A 61.789 71.659 5.538 1.00 17.53 O ATOM 462 CB ASP A 60A 58.962 70.784 6.382 1.00 19.65 C ATOM 463 CG ASP A 60A 57.627 71.435 6.010 1.00 21.46 C ATOM 464 OD1 ASP A 60A 57.203 71.384 4.821 1.00 23.97 O ATOM 465 OD2 ASP A 60A 56.974 71.989 6.930 1.00 21.87 O ATOM 466 H ASP A 60A 59.053 68.331 5.355 1.00 0.00 H ATOM 467 N TYR A 60B 62.007 69.426 5.703 1.00 17.28 N ATOM 468 CA TYR A 60B 63.445 69.439 6.016 1.00 17.78 C ATOM 469 C TYR A 60B 64.144 68.351 5.227 1.00 17.62 C ATOM 470 O TYR A 60B 64.563 67.327 5.763 1.00 17.32 O ATOM 471 CB TYR A 60B 63.674 69.232 7.523 1.00 18.83 C ATOM 472 CG TYR A 60B 63.042 70.310 8.355 1.00 20.28 C ATOM 473 CD1 TYR A 60B 61.706 70.223 8.749 1.00 21.32 C ATOM 474 CD2 TYR A 60B 63.776 71.431 8.758 1.00 21.17 C ATOM 475 CE1 TYR A 60B 61.117 71.220 9.514 1.00 21.58 C ATOM 476 CE2 TYR A 60B 63.193 72.433 9.526 1.00 22.40 C ATOM 477 CZ TYR A 60B 61.866 72.324 9.896 1.00 22.68 C ATOM 478 OH TYR A 60B 61.272 73.311 10.650 1.00 25.12 O ATOM 479 HH TYR A 60B 60.327 73.070 10.821 1.00 0.00 H ATOM 480 H TYR A 60B 61.521 68.508 5.649 1.00 0.00 H ATOM 481 N PRO A 60C 64.259 68.547 3.913 1.00 17.54 N ATOM 482 CA PRO A 60C 64.709 67.464 3.067 1.00 18.48 C ATOM 483 C PRO A 60C 66.240 67.340 2.963 1.00 20.85 C ATOM 484 O PRO A 60C 66.740 66.806 1.981 1.00 23.73 O ATOM 485 CB PRO A 60C 64.086 67.819 1.715 1.00 18.22 C ATOM 486 CG PRO A 60C 64.028 69.303 1.726 1.00 17.69 C ATOM 487 CD PRO A 60C 63.820 69.720 3.145 1.00 17.97 C ATOM 488 N LYS A 61 66.974 67.840 3.951 1.00 21.84 N ATOM 489 CA LYS A 61 68.422 67.739 3.945 1.00 22.71 C ATOM 490 C LYS A 61 68.866 66.447 4.624 1.00 22.83 C ATOM 491 O LYS A 61 68.785 66.327 5.853 1.00 22.11 O ATOM 492 CB LYS A 61 69.040 68.944 4.629 1.00 25.04 C ATOM 493 CG LYS A 61 70.539 68.975 4.438 1.00 26.24 C ATOM 494 CD LYS A 61 71.293 69.345 5.688 1.00 28.61 C ATOM 495 CE LYS A 61 71.384 70.835 5.887 1.00 29.15 C ATOM 496 NZ LYS A 61 72.697 71.213 6.474 1.00 29.84 N ATOM 497 HZ1 LYS A 61 72.811 70.745 7.395 1.00 0.00 H ATOM 498 HZ2 LYS A 61 73.460 70.913 5.834 1.00 0.00 H ATOM 499 HZ3 LYS A 61 72.734 72.245 6.601 1.00 0.00 H ATOM 500 H LYS A 61 66.501 68.314 4.746 1.00 0.00 H ATOM 501 N LYS A 62 69.356 65.493 3.837 1.00 22.22 N ATOM 502 CA LYS A 62 69.578 64.149 4.366 1.00 23.66 C ATOM 503 C LYS A 62 70.618 64.075 5.475 1.00 23.11 C ATOM 504 O LYS A 62 70.518 63.206 6.339 1.00 22.65 O ATOM 505 CB LYS A 62 69.903 63.154 3.255 1.00 24.20 C ATOM 506 CG LYS A 62 71.332 63.173 2.781 1.00 25.83 C ATOM 507 CD LYS A 62 71.463 62.588 1.387 1.00 27.42 C ATOM 508 CE LYS A 62 72.900 62.181 1.104 1.00 28.54 C ATOM 509 NZ LYS A 62 73.909 63.205 1.475 1.00 28.68 N ATOM 510 HZ1 LYS A 62 73.728 64.078 0.940 1.00 0.00 H ATOM 511 HZ2 LYS A 62 73.843 63.402 2.494 1.00 0.00 H ATOM 512 HZ3 LYS A 62 74.860 62.850 1.250 1.00 0.00 H ATOM 513 H LYS A 62 69.581 65.704 2.844 1.00 0.00 H ATOM 514 N GLU A 62A 71.588 64.992 5.477 1.00 23.10 N ATOM 515 CA GLU A 62A 72.660 65.007 6.497 1.00 24.29 C ATOM 516 C GLU A 62A 72.137 65.120 7.924 1.00 24.21 C ATOM 517 O GLU A 62A 72.809 64.696 8.869 1.00 25.22 O ATOM 518 CB GLU A 62A 73.642 66.168 6.243 1.00 26.55 C ATOM 519 CG GLU A 62A 74.985 66.063 6.960 1.00 28.23 C ATOM 520 CD GLU A 62A 75.640 67.419 7.219 1.00 30.73 C ATOM 521 OE1 GLU A 62A 74.931 68.373 7.613 1.00 32.86 O ATOM 522 OE2 GLU A 62A 76.876 67.531 7.054 1.00 32.99 O ATOM 523 H GLU A 62A 71.590 65.721 4.736 1.00 0.00 H ATOM 524 N ASP A 63 70.953 65.694 8.092 1.00 23.83 N ATOM 525 CA ASP A 63 70.419 65.951 9.435 1.00 23.58 C ATOM 526 C ASP A 63 69.790 64.731 10.098 1.00 22.58 C ATOM 527 O ASP A 63 69.526 64.767 11.291 1.00 21.09 O ATOM 528 CB ASP A 63 69.392 67.076 9.395 1.00 26.43 C ATOM 529 CG ASP A 63 70.017 68.428 9.072 1.00 29.28 C ATOM 530 OD1 ASP A 63 71.228 68.621 9.336 1.00 32.95 O ATOM 531 OD2 ASP A 63 69.283 69.299 8.569 1.00 32.62 O ATOM 532 H ASP A 63 70.394 65.966 7.259 1.00 0.00 H ATOM 533 N TYR A 64 69.583 63.651 9.348 1.00 19.77 N ATOM 534 CA TYR A 64 68.838 62.511 9.877 1.00 19.17 C ATOM 535 C TYR A 64 69.716 61.387 10.412 1.00 19.89 C ATOM 536 O TYR A 64 70.816 61.108 9.901 1.00 19.62 O ATOM 537 CB TYR A 64 67.850 61.986 8.835 1.00 18.78 C ATOM 538 CG TYR A 64 66.754 62.984 8.539 1.00 17.94 C ATOM 539 CD1 TYR A 64 65.620 63.070 9.348 1.00 17.16 C ATOM 540 CD2 TYR A 64 66.876 63.886 7.479 1.00 17.80 C ATOM 541 CE1 TYR A 64 64.636 64.015 9.105 1.00 17.24 C ATOM 542 CE2 TYR A 64 65.892 64.827 7.222 1.00 17.36 C ATOM 543 CZ TYR A 64 64.773 64.890 8.030 1.00 17.36 C ATOM 544 OH TYR A 64 63.794 65.808 7.761 1.00 16.51 O ATOM 545 HH TYR A 64 64.177 66.720 7.805 1.00 0.00 H ATOM 546 H TYR A 64 69.955 63.618 8.377 1.00 0.00 H ATOM 547 N ILE A 65 69.211 60.767 11.473 1.00 19.74 N ATOM 548 CA ILE A 65 69.837 59.619 12.088 1.00 20.32 C ATOM 549 C ILE A 65 68.805 58.504 12.112 1.00 18.95 C ATOM 550 O ILE A 65 67.658 58.718 12.529 1.00 18.59 O ATOM 551 CB ILE A 65 70.282 59.931 13.526 1.00 22.30 C ATOM 552 CG1 ILE A 65 71.185 61.172 13.551 1.00 23.99 C ATOM 553 CG2 ILE A 65 71.032 58.750 14.110 1.00 23.50 C ATOM 554 CD1 ILE A 65 71.466 61.682 14.949 1.00 25.09 C ATOM 555 H ILE A 65 68.323 61.125 11.880 1.00 0.00 H ATOM 556 N VAL A 66 69.207 57.321 11.664 1.00 17.65 N ATOM 557 CA VAL A 66 68.328 56.154 11.664 1.00 18.05 C ATOM 558 C VAL A 66 68.890 55.089 12.598 1.00 18.39 C ATOM 559 O VAL A 66 70.061 54.703 12.484 1.00 18.30 O ATOM 560 CB VAL A 66 68.193 55.565 10.247 1.00 18.37 C ATOM 561 CG1 VAL A 66 67.318 54.314 10.275 1.00 19.06 C ATOM 562 CG2 VAL A 66 67.607 56.598 9.300 1.00 18.11 C ATOM 563 H VAL A 66 70.177 57.222 11.302 1.00 0.00 H ATOM 564 N TYR A 67 68.069 54.635 13.544 1.00 19.55 N ATOM 565 CA TYR A 67 68.436 53.509 14.386 1.00 19.77 C ATOM 566 C TYR A 67 67.634 52.263 14.027 1.00 19.34 C ATOM 567 O TYR A 67 66.425 52.327 13.763 1.00 18.77 O ATOM 568 CB TYR A 67 68.209 53.800 15.870 1.00 21.49 C ATOM 569 CG TYR A 67 69.181 54.744 16.502 1.00 23.26 C ATOM 570 CD1 TYR A 67 68.960 56.118 16.463 1.00 25.26 C ATOM 571 CD2 TYR A 67 70.305 54.272 17.177 1.00 25.50 C ATOM 572 CE1 TYR A 67 69.833 56.999 17.066 1.00 26.93 C ATOM 573 CE2 TYR A 67 71.191 55.148 17.784 1.00 26.59 C ATOM 574 CZ TYR A 67 70.949 56.507 17.720 1.00 27.65 C ATOM 575 OH TYR A 67 71.818 57.383 18.309 1.00 32.23 O ATOM 576 HH TYR A 67 71.497 58.309 18.169 1.00 0.00 H ATOM 577 H TYR A 67 67.147 55.096 13.683 1.00 0.00 H ATOM 578 N LEU A 68 68.334 51.135 14.040 1.00 18.71 N ATOM 579 CA LEU A 68 67.737 49.812 14.038 1.00 19.18 C ATOM 580 C LEU A 68 68.087 49.123 15.343 1.00 18.74 C ATOM 581 O LEU A 68 69.092 49.453 15.989 1.00 19.18 O ATOM 582 CB LEU A 68 68.290 48.985 12.891 1.00 18.87 C ATOM 583 CG LEU A 68 68.149 49.619 11.512 1.00 19.78 C ATOM 584 CD1 LEU A 68 68.778 48.697 10.488 1.00 20.13 C ATOM 585 CD2 LEU A 68 66.701 49.903 11.169 1.00 20.38 C ATOM 586 H LEU A 68 69.372 51.203 14.052 1.00 0.00 H ATOM 587 N GLY A 69 67.271 48.153 15.729 1.00 18.46 N ATOM 588 CA GLY A 69 67.508 47.415 16.963 1.00 18.82 C ATOM 589 C GLY A 69 67.292 48.226 18.226 1.00 19.70 C ATOM 590 O GLY A 69 67.831 47.900 19.276 1.00 19.72 O ATOM 591 H GLY A 69 66.447 47.914 15.141 1.00 0.00 H ATOM 592 N ARG A 70 66.481 49.274 18.137 1.00 21.29 N ATOM 593 CA ARG A 70 66.272 50.192 19.254 1.00 23.51 C ATOM 594 C ARG A 70 64.849 50.101 19.815 1.00 22.57 C ATOM 595 O ARG A 70 63.884 50.290 19.070 1.00 22.09 O ATOM 596 CB ARG A 70 66.561 51.602 18.752 1.00 26.69 C ATOM 597 CG ARG A 70 66.342 52.724 19.740 1.00 29.77 C ATOM 598 CD ARG A 70 67.509 53.690 19.629 1.00 32.92 C ATOM 599 NE ARG A 70 67.352 54.873 20.462 1.00 35.92 N ATOM 600 CZ ARG A 70 68.354 55.600 20.946 1.00 36.74 C ATOM 601 NH1 ARG A 70 69.619 55.257 20.725 1.00 37.68 N ATOM 602 NH2 ARG A 70 68.084 56.668 21.686 1.00 38.99 N ATOM 603 HE ARG A 70 66.384 55.172 20.696 1.00 0.00 H ATOM 604 HH12 ARG A 70 70.390 55.838 21.111 1.00 0.00 H ATOM 605 HH11 ARG A 70 69.837 54.408 20.166 1.00 0.00 H ATOM 606 HH22 ARG A 70 68.860 57.244 22.070 1.00 0.00 H ATOM 607 HH21 ARG A 70 67.096 56.929 21.882 1.00 0.00 H ATOM 608 H ARG A 70 65.978 49.447 17.243 1.00 0.00 H ATOM 609 N SER A 71 64.738 49.851 21.128 1.00 21.75 N ATOM 610 CA SER A 71 63.446 49.686 21.827 1.00 21.95 C ATOM 611 C SER A 71 63.009 50.909 22.626 1.00 20.46 C ATOM 612 O SER A 71 61.847 51.001 23.004 1.00 20.45 O ATOM 613 CB SER A 71 63.512 48.533 22.840 1.00 21.83 C ATOM 614 OG SER A 71 63.836 47.312 22.247 1.00 22.46 O ATOM 615 HG SER A 71 63.865 46.607 22.941 1.00 0.00 H ATOM 616 H SER A 71 65.611 49.768 21.687 1.00 0.00 H ATOM 617 N ARG A 72 63.944 51.810 22.918 1.00 20.57 N ATOM 618 CA ARG A 72 63.656 52.983 23.719 1.00 21.69 C ATOM 619 C ARG A 72 64.078 54.250 23.016 1.00 21.22 C ATOM 620 O ARG A 72 65.055 54.277 22.275 1.00 22.49 O ATOM 621 CB ARG A 72 64.329 52.882 25.087 1.00 22.93 C ATOM 622 CG ARG A 72 63.743 51.766 25.935 1.00 25.00 C ATOM 623 CD ARG A 72 64.307 51.763 27.349 1.00 25.75 C ATOM 624 NE ARG A 72 65.691 51.292 27.399 1.00 25.92 N ATOM 625 CZ ARG A 72 66.472 51.348 28.479 1.00 26.93 C ATOM 626 NH1 ARG A 72 67.718 50.895 28.418 1.00 27.59 N ATOM 627 NH2 ARG A 72 66.028 51.867 29.617 1.00 26.94 N ATOM 628 HE ARG A 72 66.095 50.885 26.531 1.00 0.00 H ATOM 629 HH12 ARG A 72 68.329 50.938 29.259 1.00 0.00 H ATOM 630 HH11 ARG A 72 68.084 50.497 27.529 1.00 0.00 H ATOM 631 HH22 ARG A 72 66.650 51.903 30.450 1.00 0.00 H ATOM 632 HH21 ARG A 72 65.058 52.238 29.676 1.00 0.00 H ATOM 633 H ARG A 72 64.910 51.668 22.561 1.00 0.00 H ATOM 634 N LEU A 73 63.330 55.307 23.271 1.00 21.70 N ATOM 635 CA LEU A 73 63.463 56.526 22.496 1.00 22.54 C ATOM 636 C LEU A 73 64.766 57.255 22.793 1.00 23.73 C ATOM 637 O LEU A 73 65.464 57.682 21.867 1.00 22.41 O ATOM 638 CB LEU A 73 62.280 57.444 22.785 1.00 22.69 C ATOM 639 CG LEU A 73 62.089 58.581 21.796 1.00 23.10 C ATOM 640 CD1 LEU A 73 61.787 58.032 20.409 1.00 23.53 C ATOM 641 CD2 LEU A 73 60.973 59.465 22.304 1.00 23.50 C ATOM 642 H LEU A 73 62.633 55.265 24.041 1.00 0.00 H ATOM 643 N ASN A 74 65.106 57.340 24.080 1.00 25.29 N ATOM 644 CA ASN A 74 66.218 58.167 24.553 1.00 30.29 C ATOM 645 C ASN A 74 67.249 57.434 25.407 1.00 32.41 C ATOM 646 O ASN A 74 68.061 58.080 26.075 1.00 35.00 O ATOM 647 CB ASN A 74 65.676 59.346 25.364 1.00 31.26 C ATOM 648 CG ASN A 74 65.037 60.409 24.500 1.00 33.58 C ATOM 649 OD1 ASN A 74 65.676 60.961 23.605 1.00 36.17 O ATOM 650 ND2 ASN A 74 63.780 60.730 24.781 1.00 35.63 N ATOM 651 HD22 ASN A 74 63.276 60.238 25.546 1.00 0.00 H ATOM 652 HD21 ASN A 74 63.299 61.474 24.236 1.00 0.00 H ATOM 653 H ASN A 74 64.558 56.796 24.777 1.00 0.00 H ATOM 654 N SER A 75 67.211 56.105 25.409 1.00 33.00 N ATOM 655 CA SER A 75 68.285 55.318 26.004 1.00 35.52 C ATOM 656 C SER A 75 68.735 54.267 25.013 1.00 36.44 C ATOM 657 O SER A 75 68.087 54.053 23.989 1.00 36.12 O ATOM 658 CB SER A 75 67.846 54.684 27.325 1.00 36.55 C ATOM 659 OG SER A 75 66.630 53.982 27.168 1.00 40.20 O ATOM 660 HG SER A 75 66.367 53.582 28.034 1.00 0.00 H ATOM 661 H SER A 75 66.400 55.617 24.978 1.00 0.00 H ATOM 662 N ASN A 76 69.864 53.627 25.305 1.00 37.02 N ATOM 663 CA ASN A 76 70.446 52.656 24.390 1.00 38.69 C ATOM 664 C ASN A 76 69.869 51.266 24.612 1.00 37.34 C ATOM 665 O ASN A 76 69.490 50.917 25.729 1.00 37.78 O ATOM 666 CB ASN A 76 71.965 52.625 24.541 1.00 41.53 C ATOM 667 CG ASN A 76 72.590 53.987 24.327 1.00 43.35 C ATOM 668 OD1 ASN A 76 72.722 54.773 25.266 1.00 48.71 O ATOM 669 ND2 ASN A 76 72.968 54.280 23.087 1.00 42.80 N ATOM 670 HD22 ASN A 76 72.837 53.584 22.325 1.00 0.00 H ATOM 671 HD21 ASN A 76 73.395 55.205 22.878 1.00 0.00 H ATOM 672 H ASN A 76 70.342 53.825 26.207 1.00 0.00 H ATOM 673 N THR A 77 69.771 50.504 23.525 1.00 35.35 N ATOM 674 CA THR A 77 69.373 49.099 23.558 1.00 34.73 C ATOM 675 C THR A 77 70.567 48.293 23.070 1.00 34.17 C ATOM 676 O THR A 77 71.164 48.623 22.044 1.00 33.47 O ATOM 677 CB THR A 77 68.166 48.827 22.626 1.00 33.99 C ATOM 678 OG1 THR A 77 67.011 49.527 23.108 1.00 32.80 O ATOM 679 CG2 THR A 77 67.844 47.338 22.532 1.00 33.52 C ATOM 680 HG1 THR A 77 67.199 50.499 23.125 1.00 0.00 H ATOM 681 H THR A 77 69.990 50.932 22.603 1.00 0.00 H ATOM 682 N GLN A 78 70.914 47.234 23.793 1.00 32.78 N ATOM 683 CA GLN A 78 72.041 46.398 23.394 1.00 32.08 C ATOM 684 C GLN A 78 71.754 45.774 22.037 1.00 30.38 C ATOM 685 O GLN A 78 70.668 45.250 21.814 1.00 30.21 O ATOM 686 CB GLN A 78 72.317 45.324 24.447 1.00 33.49 C ATOM 687 CG GLN A 78 72.690 45.912 25.802 1.00 33.93 C ATOM 688 CD GLN A 78 73.784 45.140 26.515 1.00 34.83 C ATOM 689 OE1 GLN A 78 74.786 45.720 26.941 1.00 35.47 O ATOM 690 NE2 GLN A 78 73.602 43.828 26.648 1.00 34.16 N ATOM 691 HE22 GLN A 78 72.741 43.382 26.273 1.00 0.00 H ATOM 692 HE21 GLN A 78 74.321 43.249 27.127 1.00 0.00 H ATOM 693 H GLN A 78 70.377 46.999 24.652 1.00 0.00 H ATOM 694 N GLY A 79 72.720 45.863 21.127 1.00 29.60 N ATOM 695 CA GLY A 79 72.548 45.384 19.757 1.00 28.99 C ATOM 696 C GLY A 79 72.059 46.442 18.771 1.00 28.85 C ATOM 697 O GLY A 79 71.941 46.165 17.578 1.00 28.56 O ATOM 698 H GLY A 79 73.629 46.288 21.400 1.00 0.00 H ATOM 699 N GLU A 80 71.755 47.645 19.254 1.00 28.58 N ATOM 700 CA GLU A 80 71.275 48.705 18.366 1.00 28.58 C ATOM 701 C GLU A 80 72.386 49.128 17.408 1.00 27.27 C ATOM 702 O GLU A 80 73.569 49.067 17.754 1.00 25.46 O ATOM 703 CB GLU A 80 70.750 49.913 19.158 1.00 30.87 C ATOM 704 CG GLU A 80 71.817 50.808 19.783 1.00 33.69 C ATOM 705 CD GLU A 80 71.230 52.004 20.519 1.00 36.58 C ATOM 706 OE1 GLU A 80 70.042 51.958 20.892 1.00 37.20 O ATOM 707 OE2 GLU A 80 71.959 52.998 20.734 1.00 39.65 O ATOM 708 H GLU A 80 71.860 47.833 20.271 1.00 0.00 H ATOM 709 N MET A 81 71.991 49.493 16.184 1.00 26.28 N ATOM 710 CA MET A 81 72.893 49.979 15.133 1.00 25.52 C ATOM 711 C MET A 81 72.454 51.397 14.735 1.00 24.40 C ATOM 712 O MET A 81 71.261 51.657 14.597 1.00 23.08 O ATOM 713 CB MET A 81 72.838 49.070 13.887 1.00 26.62 C ATOM 714 CG MET A 81 73.563 47.721 13.971 1.00 27.64 C ATOM 715 SD MET A 81 73.607 46.782 12.408 1.00 29.28 S ATOM 716 CE MET A 81 75.040 47.471 11.583 1.00 29.27 C ATOM 717 H MET A 81 70.977 49.428 15.962 1.00 0.00 H ATOM 718 N LYS A 82 73.415 52.300 14.541 1.00 23.87 N ATOM 719 CA LYS A 82 73.143 53.687 14.156 1.00 23.70 C ATOM 720 C LYS A 82 73.558 53.920 12.703 1.00 22.25 C ATOM 721 O LYS A 82 74.628 53.475 12.287 1.00 21.44 O ATOM 722 CB LYS A 82 73.941 54.598 15.083 1.00 24.87 C ATOM 723 CG LYS A 82 73.683 56.090 14.923 1.00 27.13 C ATOM 724 CD LYS A 82 74.349 56.851 16.067 1.00 28.35 C ATOM 725 CE LYS A 82 74.434 58.342 15.801 1.00 30.32 C ATOM 726 NZ LYS A 82 74.848 59.102 17.016 1.00 30.57 N ATOM 727 HZ1 LYS A 82 74.154 58.945 17.775 1.00 0.00 H ATOM 728 HZ2 LYS A 82 75.784 58.773 17.327 1.00 0.00 H ATOM 729 HZ3 LYS A 82 74.894 60.116 16.790 1.00 0.00 H ATOM 730 H LYS A 82 74.404 52.006 14.669 1.00 0.00 H ATOM 731 N PHE A 83 72.719 54.616 11.938 1.00 21.65 N ATOM 732 CA PHE A 83 72.978 54.842 10.516 1.00 21.73 C ATOM 733 C PHE A 83 72.799 56.292 10.124 1.00 22.39 C ATOM 734 O PHE A 83 72.054 57.038 10.759 1.00 21.19 O ATOM 735 CB PHE A 83 72.065 53.966 9.647 1.00 22.17 C ATOM 736 CG PHE A 83 72.242 52.498 9.885 1.00 22.74 C ATOM 737 CD1 PHE A 83 71.512 51.856 10.874 1.00 23.19 C ATOM 738 CD2 PHE A 83 73.162 51.757 9.144 1.00 23.46 C ATOM 739 CE1 PHE A 83 71.686 50.502 11.117 1.00 23.63 C ATOM 740 CE2 PHE A 83 73.346 50.401 9.389 1.00 24.04 C ATOM 741 CZ PHE A 83 72.604 49.774 10.377 1.00 24.30 C ATOM 742 H PHE A 83 71.856 55.010 12.363 1.00 0.00 H ATOM 743 N GLU A 84 73.514 56.669 9.069 1.00 23.31 N ATOM 744 CA GLU A 84 73.324 57.937 8.377 1.00 24.47 C ATOM 745 C GLU A 84 72.517 57.630 7.127 1.00 22.91 C ATOM 746 O GLU A 84 72.416 56.477 6.710 1.00 21.85 O ATOM 747 CB GLU A 84 74.677 58.533 7.957 1.00 26.81 C ATOM 748 CG GLU A 84 74.878 59.982 8.353 1.00 29.50 C ATOM 749 CD GLU A 84 75.547 60.125 9.700 1.00 31.62 C ATOM 750 OE1 GLU A 84 74.889 60.611 10.646 1.00 33.83 O ATOM 751 OE2 GLU A 84 76.735 59.748 9.812 1.00 35.28 O ATOM 752 H GLU A 84 74.250 56.023 8.718 1.00 0.00 H ATOM 753 N VAL A 85 71.971 58.670 6.511 1.00 22.05 N ATOM 754 CA VAL A 85 71.188 58.516 5.295 1.00 21.51 C ATOM 755 C VAL A 85 72.042 58.864 4.073 1.00 22.20 C ATOM 756 O VAL A 85 72.453 60.016 3.893 1.00 21.28 O ATOM 757 CB VAL A 85 69.927 59.401 5.346 1.00 21.19 C ATOM 758 CG1 VAL A 85 69.093 59.238 4.087 1.00 20.98 C ATOM 759 CG2 VAL A 85 69.087 59.065 6.570 1.00 21.58 C ATOM 760 H VAL A 85 72.106 59.622 6.908 1.00 0.00 H ATOM 761 N GLU A 86 72.273 57.870 3.222 1.00 22.84 N ATOM 762 CA GLU A 86 73.113 58.027 2.030 1.00 25.01 C ATOM 763 C GLU A 86 72.327 58.646 0.889 1.00 24.68 C ATOM 764 O GLU A 86 72.868 59.423 0.095 1.00 23.79 O ATOM 765 CB GLU A 86 73.676 56.667 1.593 1.00 26.90 C ATOM 766 CG GLU A 86 74.461 56.690 0.281 1.00 29.04 C ATOM 767 CD GLU A 86 75.059 55.344 -0.096 1.00 30.97 C ATOM 768 OE1 GLU A 86 75.167 54.455 0.780 1.00 31.09 O ATOM 769 OE2 GLU A 86 75.420 55.175 -1.285 1.00 32.12 O ATOM 770 H GLU A 86 71.841 56.943 3.409 1.00 0.00 H ATOM 771 N ASN A 87 71.056 58.268 0.798 1.00 23.19 N ATOM 772 CA ASN A 87 70.156 58.781 -0.207 1.00 24.36 C ATOM 773 C ASN A 87 68.761 58.869 0.391 1.00 23.98 C ATOM 774 O ASN A 87 68.264 57.903 0.977 1.00 23.85 O ATOM 775 CB ASN A 87 70.160 57.853 -1.411 1.00 25.71 C ATOM 776 CG ASN A 87 69.555 58.480 -2.650 1.00 29.63 C ATOM 777 OD1 ASN A 87 68.950 59.550 -2.608 1.00 32.98 O ATOM 778 ND2 ASN A 87 69.703 57.797 -3.771 1.00 31.93 N ATOM 779 HD22 ASN A 87 70.222 56.895 -3.766 1.00 0.00 H ATOM 780 HD21 ASN A 87 69.301 58.161 -4.659 1.00 0.00 H ATOM 781 H ASN A 87 70.694 57.572 1.481 1.00 0.00 H ATOM 782 N LEU A 88 68.152 60.041 0.256 1.00 23.04 N ATOM 783 CA LEU A 88 66.792 60.282 0.708 1.00 22.62 C ATOM 784 C LEU A 88 65.906 60.492 -0.514 1.00 21.74 C ATOM 785 O LEU A 88 66.028 61.505 -1.193 1.00 22.08 O ATOM 786 CB LEU A 88 66.765 61.511 1.609 1.00 22.67 C ATOM 787 CG LEU A 88 65.404 61.944 2.143 1.00 23.46 C ATOM 788 CD1 LEU A 88 64.710 60.803 2.879 1.00 23.38 C ATOM 789 CD2 LEU A 88 65.578 63.132 3.071 1.00 23.31 C ATOM 790 H LEU A 88 68.672 60.822 -0.193 1.00 0.00 H ATOM 791 N ILE A 89 65.034 59.531 -0.796 1.00 20.78 N ATOM 792 CA ILE A 89 64.177 59.572 -1.981 1.00 21.28 C ATOM 793 C ILE A 89 62.732 59.812 -1.570 1.00 20.89 C ATOM 794 O ILE A 89 62.091 58.955 -0.966 1.00 21.26 O ATOM 795 CB ILE A 89 64.263 58.274 -2.804 1.00 22.24 C ATOM 796 CG1 ILE A 89 65.726 57.974 -3.163 1.00 23.07 C ATOM 797 CG2 ILE A 89 63.394 58.379 -4.056 1.00 23.05 C ATOM 798 CD1 ILE A 89 65.938 56.603 -3.757 1.00 23.53 C ATOM 799 H ILE A 89 64.957 58.719 -0.151 1.00 0.00 H ATOM 800 N LEU A 90 62.237 60.998 -1.893 1.00 20.32 N ATOM 801 CA LEU A 90 60.853 61.364 -1.654 1.00 19.55 C ATOM 802 C LEU A 90 60.094 61.196 -2.954 1.00 20.59 C ATOM 803 O LEU A 90 60.686 61.321 -4.027 1.00 21.20 O ATOM 804 CB LEU A 90 60.770 62.811 -1.174 1.00 20.10 C ATOM 805 CG LEU A 90 61.670 63.178 -0.003 1.00 19.47 C ATOM 806 CD1 LEU A 90 61.430 64.625 0.408 1.00 19.60 C ATOM 807 CD2 LEU A 90 61.474 62.231 1.174 1.00 19.78 C ATOM 808 H LEU A 90 62.867 61.696 -2.337 1.00 0.00 H ATOM 809 N HIS A 91 58.790 60.944 -2.859 1.00 21.44 N ATOM 810 CA HIS A 91 57.954 60.730 -4.041 1.00 21.74 C ATOM 811 C HIS A 91 57.654 62.071 -4.687 1.00 21.93 C ATOM 812 O HIS A 91 57.170 62.984 -4.027 1.00 20.60 O ATOM 813 CB HIS A 91 56.646 60.026 -3.669 1.00 22.97 C ATOM 814 CG HIS A 91 56.007 59.311 -4.816 1.00 23.95 C ATOM 815 ND1 HIS A 91 55.446 59.975 -5.881 1.00 25.33 N ATOM 816 CD2 HIS A 91 55.836 57.993 -5.062 1.00 24.99 C ATOM 817 CE1 HIS A 91 54.955 59.098 -6.738 1.00 25.63 C ATOM 818 NE2 HIS A 91 55.182 57.886 -6.266 1.00 25.22 N ATOM 819 H HIS A 91 58.352 60.898 -1.917 1.00 0.00 H ATOM 820 N LYS A 92 57.931 62.187 -5.983 1.00 22.17 N ATOM 821 CA LYS A 92 57.833 63.485 -6.671 1.00 23.16 C ATOM 822 C LYS A 92 56.405 64.014 -6.793 1.00 23.30 C ATOM 823 O LYS A 92 56.193 65.211 -6.977 1.00 24.05 O ATOM 824 CB LYS A 92 58.482 63.409 -8.068 1.00 24.70 C ATOM 825 CG LYS A 92 57.735 62.546 -9.075 1.00 25.06 C ATOM 826 CD LYS A 92 58.100 62.939 -10.500 1.00 25.98 C ATOM 827 CE LYS A 92 57.675 61.878 -11.491 1.00 26.78 C ATOM 828 NZ LYS A 92 58.498 60.650 -11.331 1.00 28.13 N ATOM 829 HZ1 LYS A 92 59.499 60.881 -11.494 1.00 0.00 H ATOM 830 HZ2 LYS A 92 58.379 60.278 -10.367 1.00 0.00 H ATOM 831 HZ3 LYS A 92 58.190 59.935 -12.021 1.00 0.00 H ATOM 832 H LYS A 92 58.222 61.345 -6.520 1.00 0.00 H ATOM 833 N ASP A 93 55.428 63.119 -6.709 1.00 22.73 N ATOM 834 CA ASP A 93 54.019 63.468 -6.789 1.00 23.60 C ATOM 835 C ASP A 93 53.369 63.513 -5.406 1.00 21.93 C ATOM 836 O ASP A 93 52.149 63.448 -5.298 1.00 20.47 O ATOM 837 CB ASP A 93 53.266 62.453 -7.657 1.00 26.33 C ATOM 838 CG ASP A 93 53.821 62.369 -9.071 1.00 30.14 C ATOM 839 OD1 ASP A 93 53.939 63.436 -9.703 1.00 33.44 O ATOM 840 OD2 ASP A 93 54.141 61.248 -9.533 1.00 32.70 O ATOM 841 H ASP A 93 55.683 62.119 -6.580 1.00 0.00 H ATOM 842 N TYR A 94 54.180 63.626 -4.363 1.00 20.32 N ATOM 843 CA TYR A 94 53.643 63.856 -3.022 1.00 19.83 C ATOM 844 C TYR A 94 52.852 65.164 -2.960 1.00 20.33 C ATOM 845 O TYR A 94 53.293 66.189 -3.457 1.00 20.26 O ATOM 846 CB TYR A 94 54.752 63.922 -1.979 1.00 19.02 C ATOM 847 CG TYR A 94 54.240 64.389 -0.632 1.00 18.35 C ATOM 848 CD1 TYR A 94 53.577 63.513 0.220 1.00 18.03 C ATOM 849 CD2 TYR A 94 54.381 65.716 -0.231 1.00 18.31 C ATOM 850 CE1 TYR A 94 53.081 63.947 1.450 1.00 17.83 C ATOM 851 CE2 TYR A 94 53.898 66.152 0.996 1.00 17.88 C ATOM 852 CZ TYR A 94 53.248 65.263 1.827 1.00 17.98 C ATOM 853 OH TYR A 94 52.772 65.705 3.046 1.00 17.19 O ATOM 854 HH TYR A 94 52.335 64.954 3.520 1.00 0.00 H ATOM 855 H TYR A 94 55.208 63.550 -4.500 1.00 0.00 H ATOM 856 N SER A 95 51.687 65.126 -2.335 1.00 21.14 N ATOM 857 CA SER A 95 50.957 66.350 -2.018 1.00 21.51 C ATOM 858 C SER A 95 50.124 66.147 -0.764 1.00 22.04 C ATOM 859 O SER A 95 49.826 65.003 -0.365 1.00 21.54 O ATOM 860 CB SER A 95 50.046 66.798 -3.166 1.00 22.27 C ATOM 861 OG SER A 95 48.912 65.957 -3.303 1.00 23.05 O ATOM 862 HG SER A 95 49.210 65.031 -3.487 1.00 0.00 H ATOM 863 H SER A 95 51.283 64.207 -2.064 1.00 0.00 H ATOM 864 N ALA A 96 49.741 67.265 -0.164 1.00 21.90 N ATOM 865 CA ALA A 96 48.949 67.248 1.055 1.00 21.82 C ATOM 866 C ALA A 96 47.725 68.164 0.941 1.00 23.05 C ATOM 867 O ALA A 96 47.818 69.305 0.497 1.00 23.66 O ATOM 868 CB ALA A 96 49.810 67.658 2.234 1.00 21.39 C ATOM 869 H ALA A 96 50.015 68.180 -0.577 1.00 0.00 H ATOM 870 N ASP A 97 46.587 67.624 1.351 1.00 23.26 N ATOM 871 CA ASP A 97 45.347 68.359 1.497 1.00 24.64 C ATOM 872 C ASP A 97 45.114 68.603 2.992 1.00 25.62 C ATOM 873 O ASP A 97 45.993 68.298 3.806 1.00 25.49 O ATOM 874 CB ASP A 97 44.213 67.557 0.872 1.00 25.37 C ATOM 875 CG ASP A 97 44.182 67.701 -0.635 1.00 27.65 C ATOM 876 OD1 ASP A 97 43.668 68.731 -1.127 1.00 27.35 O ATOM 877 OD2 ASP A 97 44.682 66.795 -1.322 1.00 28.82 O ATOM 878 H ASP A 97 46.583 66.610 1.582 1.00 0.00 H ATOM 879 N THR A 97A 43.953 69.152 3.346 1.00 25.03 N ATOM 880 CA THR A 97A 43.629 69.458 4.740 1.00 26.32 C ATOM 881 C THR A 97A 43.842 68.264 5.668 1.00 25.38 C ATOM 882 O THR A 97A 44.356 68.425 6.775 1.00 26.01 O ATOM 883 CB THR A 97A 42.175 69.962 4.870 1.00 28.36 C ATOM 884 OG1 THR A 97A 41.944 70.984 3.892 1.00 31.63 O ATOM 885 CG2 THR A 97A 41.901 70.530 6.269 1.00 28.86 C ATOM 886 HG1 THR A 97A 41.013 71.311 3.971 1.00 0.00 H ATOM 887 H THR A 97A 43.254 69.370 2.608 1.00 0.00 H ATOM 888 N LEU A 97B 43.423 67.078 5.230 1.00 23.97 N ATOM 889 CA LEU A 97B 43.647 65.848 6.001 1.00 23.55 C ATOM 890 C LEU A 97B 44.513 64.851 5.264 1.00 22.03 C ATOM 891 O LEU A 97B 45.406 64.256 5.863 1.00 20.93 O ATOM 892 CB LEU A 97B 42.329 65.164 6.355 1.00 24.84 C ATOM 893 CG LEU A 97B 41.415 65.810 7.397 1.00 26.30 C ATOM 894 CD1 LEU A 97B 40.194 64.913 7.601 1.00 26.52 C ATOM 895 CD2 LEU A 97B 42.137 66.072 8.714 1.00 26.55 C ATOM 896 H LEU A 97B 42.925 67.021 4.319 1.00 0.00 H ATOM 897 N ALA A 98 44.233 64.653 3.974 1.00 20.81 N ATOM 898 CA ALA A 98 44.828 63.562 3.222 1.00 20.44 C ATOM 899 C ALA A 98 46.213 63.897 2.700 1.00 20.34 C ATOM 900 O ALA A 98 46.520 65.050 2.361 1.00 22.56 O ATOM 901 CB ALA A 98 43.926 63.138 2.066 1.00 20.65 C ATOM 902 H ALA A 98 43.572 65.297 3.495 1.00 0.00 H ATOM 903 N HIS A 99 47.052 62.870 2.656 1.00 19.55 N ATOM 904 CA HIS A 99 48.369 62.959 2.077 1.00 19.11 C ATOM 905 C HIS A 99 48.437 61.927 0.977 1.00 19.91 C ATOM 906 O HIS A 99 48.004 60.788 1.157 1.00 21.07 O ATOM 907 CB HIS A 99 49.416 62.725 3.156 1.00 19.19 C ATOM 908 CG HIS A 99 49.435 63.812 4.177 1.00 18.82 C ATOM 909 ND1 HIS A 99 50.447 64.738 4.253 1.00 18.81 N ATOM 910 CD2 HIS A 99 48.531 64.161 5.121 1.00 19.12 C ATOM 911 CE1 HIS A 99 50.184 65.595 5.224 1.00 19.68 C ATOM 912 NE2 HIS A 99 49.025 65.270 5.765 1.00 19.30 N ATOM 913 H HIS A 99 46.746 61.961 3.057 1.00 0.00 H ATOM 914 N HIS A 100 48.936 62.351 -0.182 1.00 19.17 N ATOM 915 CA HIS A 100 48.958 61.521 -1.382 1.00 19.05 C ATOM 916 C HIS A 100 50.376 61.135 -1.741 1.00 17.22 C ATOM 917 O HIS A 100 51.301 61.921 -1.568 1.00 16.69 O ATOM 918 CB HIS A 100 48.293 62.280 -2.540 1.00 20.10 C ATOM 919 CG HIS A 100 46.894 62.698 -2.230 1.00 20.78 C ATOM 920 ND1 HIS A 100 46.580 63.957 -1.767 1.00 22.13 N ATOM 921 CD2 HIS A 100 45.734 62.002 -2.244 1.00 21.62 C ATOM 922 CE1 HIS A 100 45.285 64.021 -1.528 1.00 21.81 C ATOM 923 NE2 HIS A 100 44.748 62.850 -1.814 1.00 22.72 N ATOM 924 H HIS A 100 49.326 63.314 -0.234 1.00 0.00 H ATOM 925 N ASN A 101 50.532 59.923 -2.270 1.00 17.72 N ATOM 926 CA ASN A 101 51.845 59.373 -2.637 1.00 17.47 C ATOM 927 C ASN A 101 52.821 59.542 -1.484 1.00 16.81 C ATOM 928 O ASN A 101 53.954 59.971 -1.654 1.00 16.53 O ATOM 929 CB ASN A 101 52.359 60.015 -3.935 1.00 18.95 C ATOM 930 CG ASN A 101 51.412 59.766 -5.096 1.00 20.52 C ATOM 931 OD1 ASN A 101 51.082 58.611 -5.389 1.00 21.94 O ATOM 932 ND2 ASN A 101 50.912 60.837 -5.716 1.00 21.50 N ATOM 933 HD22 ASN A 101 51.219 61.790 -5.436 1.00 0.00 H ATOM 934 HD21 ASN A 101 50.216 60.718 -6.479 1.00 0.00 H ATOM 935 H ASN A 101 49.687 59.339 -2.431 1.00 0.00 H ATOM 936 N ASP A 102 52.346 59.202 -0.289 1.00 16.22 N ATOM 937 CA ASP A 102 53.094 59.444 0.924 1.00 16.09 C ATOM 938 C ASP A 102 54.007 58.254 1.245 1.00 17.13 C ATOM 939 O ASP A 102 53.699 57.386 2.090 1.00 17.70 O ATOM 940 CB ASP A 102 52.126 59.727 2.066 1.00 15.82 C ATOM 941 CG ASP A 102 52.799 60.377 3.253 1.00 16.28 C ATOM 942 OD1 ASP A 102 53.963 60.812 3.141 1.00 15.49 O ATOM 943 OD2 ASP A 102 52.134 60.465 4.303 1.00 16.19 O ATOM 944 H ASP A 102 51.412 58.750 -0.226 1.00 0.00 H ATOM 945 N ILE A 103 55.141 58.229 0.564 1.00 16.65 N ATOM 946 CA ILE A 103 56.056 57.110 0.630 1.00 16.68 C ATOM 947 C ILE A 103 57.453 57.668 0.363 1.00 16.63 C ATOM 948 O ILE A 103 57.617 58.545 -0.489 1.00 16.64 O ATOM 949 CB ILE A 103 55.660 56.004 -0.375 1.00 16.75 C ATOM 950 CG1 ILE A 103 56.510 54.755 -0.180 1.00 17.39 C ATOM 951 CG2 ILE A 103 55.752 56.505 -1.807 1.00 17.46 C ATOM 952 CD1 ILE A 103 55.970 53.549 -0.907 1.00 18.22 C ATOM 953 H ILE A 103 55.383 59.041 -0.039 1.00 0.00 H ATOM 954 N ALA A 104 58.432 57.185 1.119 1.00 16.31 N ATOM 955 CA ALA A 104 59.820 57.632 1.009 1.00 16.95 C ATOM 956 C ALA A 104 60.770 56.468 1.234 1.00 17.65 C ATOM 957 O ALA A 104 60.432 55.491 1.914 1.00 17.81 O ATOM 958 CB ALA A 104 60.109 58.717 2.027 1.00 17.12 C ATOM 959 H ALA A 104 58.201 56.455 1.822 1.00 0.00 H ATOM 960 N LEU A 105 61.955 56.583 0.654 1.00 17.51 N ATOM 961 CA LEU A 105 62.987 55.572 0.780 1.00 18.09 C ATOM 962 C LEU A 105 64.233 56.223 1.317 1.00 18.52 C ATOM 963 O LEU A 105 64.612 57.304 0.867 1.00 18.87 O ATOM 964 CB LEU A 105 63.276 54.929 -0.583 1.00 18.11 C ATOM 965 CG LEU A 105 62.286 53.872 -1.048 1.00 18.20 C ATOM 966 CD1 LEU A 105 62.494 53.605 -2.539 1.00 18.64 C ATOM 967 CD2 LEU A 105 62.440 52.590 -0.260 1.00 18.52 C ATOM 968 H LEU A 105 62.153 57.431 0.086 1.00 0.00 H ATOM 969 N LEU A 106 64.839 55.578 2.319 1.00 18.33 N ATOM 970 CA LEU A 106 66.089 56.018 2.889 1.00 18.46 C ATOM 971 C LEU A 106 67.111 54.913 2.682 1.00 19.27 C ATOM 972 O LEU A 106 66.964 53.808 3.223 1.00 18.51 O ATOM 973 CB LEU A 106 65.942 56.295 4.391 1.00 18.66 C ATOM 974 CG LEU A 106 65.109 57.510 4.782 1.00 19.02 C ATOM 975 CD1 LEU A 106 63.620 57.264 4.572 1.00 19.65 C ATOM 976 CD2 LEU A 106 65.358 57.879 6.247 1.00 19.98 C ATOM 977 H LEU A 106 64.390 54.723 2.704 1.00 0.00 H ATOM 978 N LYS A 107 68.132 55.200 1.888 1.00 18.79 N ATOM 979 CA LYS A 107 69.289 54.317 1.814 1.00 19.93 C ATOM 980 C LYS A 107 70.178 54.637 2.999 1.00 19.71 C ATOM 981 O LYS A 107 70.615 55.773 3.166 1.00 20.35 O ATOM 982 CB LYS A 107 70.050 54.482 0.499 1.00 21.04 C ATOM 983 CG LYS A 107 71.192 53.497 0.304 1.00 22.12 C ATOM 984 CD LYS A 107 71.690 53.477 -1.139 1.00 23.65 C ATOM 985 CE LYS A 107 72.641 52.309 -1.370 1.00 25.14 C ATOM 986 NZ LYS A 107 73.264 52.372 -2.719 1.00 24.52 N ATOM 987 HZ1 LYS A 107 72.520 52.340 -3.445 1.00 0.00 H ATOM 988 HZ2 LYS A 107 73.801 53.258 -2.810 1.00 0.00 H ATOM 989 HZ3 LYS A 107 73.905 51.562 -2.842 1.00 0.00 H ATOM 990 H LYS A 107 68.108 56.065 1.311 1.00 0.00 H ATOM 991 N ILE A 108 70.416 53.633 3.836 1.00 19.28 N ATOM 992 CA ILE A 108 71.161 53.805 5.060 1.00 19.32 C ATOM 993 C ILE A 108 72.576 53.252 4.953 1.00 21.13 C ATOM 994 O ILE A 108 72.832 52.301 4.211 1.00 20.27 O ATOM 995 CB ILE A 108 70.442 53.160 6.262 1.00 19.47 C ATOM 996 CG1 ILE A 108 70.182 51.666 6.016 1.00 19.46 C ATOM 997 CG2 ILE A 108 69.133 53.893 6.507 1.00 19.38 C ATOM 998 CD1 ILE A 108 69.753 50.892 7.251 1.00 19.55 C ATOM 999 H ILE A 108 70.052 52.688 3.600 1.00 0.00 H ATOM 1000 N ARG A 109 73.464 53.855 5.737 1.00 22.41 N ATOM 1001 CA ARG A 109 74.874 53.500 5.781 1.00 24.97 C ATOM 1002 C ARG A 109 75.446 53.841 7.154 1.00 24.62 C ATOM 1003 O ARG A 109 75.223 54.941 7.666 1.00 24.76 O ATOM 1004 CB ARG A 109 75.584 54.326 4.721 1.00 27.65 C ATOM 1005 CG ARG A 109 77.002 53.933 4.434 1.00 30.78 C ATOM 1006 CD ARG A 109 77.512 54.659 3.197 1.00 32.97 C ATOM 1007 NE ARG A 109 77.334 56.115 3.277 1.00 35.22 N ATOM 1008 CZ ARG A 109 77.760 56.976 2.354 1.00 37.33 C ATOM 1009 NH1 ARG A 109 78.414 56.544 1.278 1.00 37.19 N ATOM 1010 NH2 ARG A 109 77.544 58.279 2.516 1.00 37.66 N ATOM 1011 HE ARG A 109 76.843 56.499 4.109 1.00 0.00 H ATOM 1012 HH12 ARG A 109 78.743 57.223 0.562 1.00 0.00 H ATOM 1013 HH11 ARG A 109 78.596 55.528 1.153 1.00 0.00 H ATOM 1014 HH22 ARG A 109 77.875 58.954 1.798 1.00 0.00 H ATOM 1015 HH21 ARG A 109 77.044 58.622 3.361 1.00 0.00 H ATOM 1016 H ARG A 109 73.132 54.624 6.354 1.00 0.00 H ATOM 1017 N SER A 110 76.179 52.910 7.756 1.00 25.00 N ATOM 1018 CA SER A 110 76.885 53.199 8.997 1.00 25.43 C ATOM 1019 C SER A 110 78.062 54.123 8.655 1.00 26.27 C ATOM 1020 O SER A 110 78.356 54.359 7.478 1.00 25.06 O ATOM 1021 CB SER A 110 77.403 51.912 9.645 1.00 26.12 C ATOM 1022 OG SER A 110 78.446 51.327 8.874 1.00 26.21 O ATOM 1023 HG SER A 110 78.105 51.110 7.970 1.00 0.00 H ATOM 1024 H SER A 110 76.250 51.962 7.335 1.00 0.00 H ATOM 1025 N LYS A 110A 78.746 54.629 9.666 1.00 28.06 N ATOM 1026 CA LYS A 110A 79.941 55.451 9.416 1.00 30.77 C ATOM 1027 C LYS A 110A 81.071 54.659 8.729 1.00 30.63 C ATOM 1028 O LYS A 110A 81.926 55.259 8.071 1.00 29.35 O ATOM 1029 CB LYS A 110A 80.406 56.136 10.705 1.00 33.26 C ATOM 1030 CG LYS A 110A 79.326 57.063 11.256 1.00 35.34 C ATOM 1031 CD LYS A 110A 79.841 58.381 11.814 1.00 38.10 C ATOM 1032 CE LYS A 110A 79.511 58.520 13.289 1.00 38.69 C ATOM 1033 NZ LYS A 110A 79.688 59.918 13.753 1.00 40.82 N ATOM 1034 HZ1 LYS A 110A 80.676 60.208 13.606 1.00 0.00 H ATOM 1035 HZ2 LYS A 110A 79.057 60.544 13.212 1.00 0.00 H ATOM 1036 HZ3 LYS A 110A 79.454 59.978 14.765 1.00 0.00 H ATOM 1037 H LYS A 110A 78.439 54.446 10.642 1.00 0.00 H ATOM 1038 N GLU A 110B 81.039 53.325 8.842 1.00 30.30 N ATOM 1039 CA GLU A 110B 81.968 52.433 8.130 1.00 30.41 C ATOM 1040 C GLU A 110B 81.527 52.106 6.715 1.00 30.33 C ATOM 1041 O GLU A 110B 82.235 51.396 5.996 1.00 30.35 O ATOM 1042 CB GLU A 110B 82.136 51.103 8.864 1.00 31.80 C ATOM 1043 CG GLU A 110B 82.911 51.203 10.155 1.00 32.30 C ATOM 1044 CD GLU A 110B 82.220 52.075 11.167 1.00 32.87 C ATOM 1045 OE1 GLU A 110B 81.039 51.805 11.458 1.00 34.32 O ATOM 1046 OE2 GLU A 110B 82.845 53.037 11.654 1.00 31.81 O ATOM 1047 H GLU A 110B 80.322 52.898 9.463 1.00 0.00 H ATOM 1048 N GLY A 110C 80.368 52.603 6.302 1.00 28.98 N ATOM 1049 CA GLY A 110C 79.872 52.306 4.967 1.00 30.00 C ATOM 1050 C GLY A 110C 79.097 51.003 4.886 1.00 30.37 C ATOM 1051 O GLY A 110C 78.811 50.519 3.787 1.00 31.26 O ATOM 1052 H GLY A 110C 79.810 53.209 6.937 1.00 0.00 H ATOM 1053 N ARG A 110D 78.743 50.438 6.038 1.00 30.49 N ATOM 1054 CA ARG A 110D 78.047 49.154 6.068 1.00 32.35 C ATOM 1055 C ARG A 110D 76.537 49.351 6.134 1.00 30.35 C ATOM 1056 O ARG A 110D 76.058 50.360 6.625 1.00 29.69 O ATOM 1057 CB ARG A 110D 78.514 48.296 7.251 1.00 34.25 C ATOM 1058 CG ARG A 110D 79.922 47.746 7.098 1.00 36.17 C ATOM 1059 CD ARG A 110D 80.242 46.740 8.191 1.00 37.34 C ATOM 1060 NE ARG A 110D 81.685 46.524 8.344 1.00 37.40 N ATOM 1061 CZ ARG A 110D 82.445 47.022 9.320 1.00 36.72 C ATOM 1062 NH1 ARG A 110D 81.939 47.787 10.282 1.00 37.36 N ATOM 1063 NH2 ARG A 110D 83.738 46.744 9.338 1.00 37.04 N ATOM 1064 HE ARG A 110D 82.155 45.932 7.630 1.00 0.00 H ATOM 1065 HH12 ARG A 110D 82.558 48.160 11.029 1.00 0.00 H ATOM 1066 HH11 ARG A 110D 80.924 48.012 10.287 1.00 0.00 H ATOM 1067 HH22 ARG A 110D 84.342 47.126 10.094 1.00 0.00 H ATOM 1068 HH21 ARG A 110D 84.151 46.143 8.596 1.00 0.00 H ATOM 1069 H ARG A 110D 78.966 50.919 6.933 1.00 0.00 H ATOM 1070 N CYS A 111 75.811 48.370 5.620 1.00 30.07 N ATOM 1071 CA CYS A 111 74.357 48.340 5.699 1.00 29.57 C ATOM 1072 C CYS A 111 73.982 47.570 6.971 1.00 27.94 C ATOM 1073 O CYS A 111 74.863 47.264 7.795 1.00 26.17 O ATOM 1074 CB CYS A 111 73.793 47.725 4.414 1.00 31.19 C ATOM 1075 SG CYS A 111 73.956 48.884 3.020 1.00 35.34 S ATOM 1076 H CYS A 111 76.300 47.588 5.140 1.00 0.00 H ATOM 1077 N ALA A 112 72.693 47.288 7.161 1.00 26.73 N ATOM 1078 CA ALA A 112 72.246 46.553 8.355 1.00 27.04 C ATOM 1079 C ALA A 112 72.801 45.129 8.353 1.00 27.75 C ATOM 1080 O ALA A 112 72.866 44.492 7.304 1.00 27.32 O ATOM 1081 CB ALA A 112 70.725 46.514 8.422 1.00 27.32 C ATOM 1082 H ALA A 112 71.993 47.592 6.455 1.00 0.00 H ATOM 1083 N GLN A 113 73.193 44.640 9.528 1.00 29.21 N ATOM 1084 CA GLN A 113 73.576 43.230 9.697 1.00 30.85 C ATOM 1085 C GLN A 113 72.455 42.509 10.465 1.00 30.46 C ATOM 1086 O GLN A 113 72.170 42.868 11.609 1.00 29.10 O ATOM 1087 CB GLN A 113 74.901 43.129 10.454 1.00 31.97 C ATOM 1088 CG GLN A 113 76.087 43.732 9.703 1.00 33.00 C ATOM 1089 CD GLN A 113 77.223 44.163 10.618 1.00 34.17 C ATOM 1090 OE1 GLN A 113 77.386 43.642 11.724 1.00 36.23 O ATOM 1091 NE2 GLN A 113 78.017 45.120 10.156 1.00 34.22 N ATOM 1092 HE22 GLN A 113 77.843 45.532 9.217 1.00 0.00 H ATOM 1093 HE21 GLN A 113 78.813 45.458 10.733 1.00 0.00 H ATOM 1094 H GLN A 113 73.229 45.274 10.351 1.00 0.00 H ATOM 1095 N PRO A 114 71.787 41.526 9.827 1.00 29.80 N ATOM 1096 CA PRO A 114 70.664 40.855 10.487 1.00 29.67 C ATOM 1097 C PRO A 114 71.034 40.259 11.839 1.00 28.43 C ATOM 1098 O PRO A 114 72.142 39.761 12.013 1.00 28.54 O ATOM 1099 CB PRO A 114 70.292 39.740 9.511 1.00 30.42 C ATOM 1100 CG PRO A 114 70.709 40.254 8.184 1.00 30.94 C ATOM 1101 CD PRO A 114 71.930 41.095 8.426 1.00 30.52 C ATOM 1102 N SER A 115 70.107 40.328 12.784 1.00 26.13 N ATOM 1103 CA SER A 115 70.333 39.848 14.132 1.00 25.46 C ATOM 1104 C SER A 115 69.001 39.517 14.779 1.00 26.22 C ATOM 1105 O SER A 115 67.962 39.591 14.138 1.00 25.03 O ATOM 1106 CB SER A 115 71.053 40.910 14.959 1.00 25.86 C ATOM 1107 OG SER A 115 70.153 41.918 15.386 1.00 24.33 O ATOM 1108 HG SER A 115 70.644 42.593 15.919 1.00 0.00 H ATOM 1109 H SER A 115 69.183 40.742 12.549 1.00 0.00 H ATOM 1110 N ARG A 116 69.033 39.178 16.065 1.00 26.82 N ATOM 1111 CA ARG A 116 67.816 38.925 16.825 1.00 28.57 C ATOM 1112 C ARG A 116 66.904 40.156 16.842 1.00 27.08 C ATOM 1113 O ARG A 116 65.676 40.035 16.890 1.00 25.92 O ATOM 1114 CB ARG A 116 68.181 38.546 18.265 1.00 32.11 C ATOM 1115 CG ARG A 116 67.159 37.674 18.970 1.00 35.90 C ATOM 1116 CD ARG A 116 67.709 37.111 20.280 1.00 37.83 C ATOM 1117 NE ARG A 116 67.660 38.081 21.374 1.00 40.19 N ATOM 1118 CZ ARG A 116 68.303 37.965 22.535 1.00 41.98 C ATOM 1119 NH1 ARG A 116 69.087 36.919 22.790 1.00 43.55 N ATOM 1120 NH2 ARG A 116 68.170 38.912 23.456 1.00 42.58 N ATOM 1121 HE ARG A 116 67.076 38.930 21.234 1.00 0.00 H ATOM 1122 HH12 ARG A 116 69.580 36.849 23.703 1.00 0.00 H ATOM 1123 HH11 ARG A 116 69.207 36.172 22.076 1.00 0.00 H ATOM 1124 HH22 ARG A 116 68.669 38.828 24.364 1.00 0.00 H ATOM 1125 HH21 ARG A 116 67.567 39.738 23.269 1.00 0.00 H ATOM 1126 H ARG A 116 69.953 39.091 16.542 1.00 0.00 H ATOM 1127 N THR A 117 67.512 41.339 16.803 1.00 24.83 N ATOM 1128 CA THR A 117 66.780 42.588 16.946 1.00 23.20 C ATOM 1129 C THR A 117 66.717 43.425 15.678 1.00 22.49 C ATOM 1130 O THR A 117 66.091 44.498 15.687 1.00 22.20 O ATOM 1131 CB THR A 117 67.380 43.430 18.085 1.00 22.77 C ATOM 1132 OG1 THR A 117 68.794 43.582 17.894 1.00 23.04 O ATOM 1133 CG2 THR A 117 67.110 42.771 19.415 1.00 23.30 C ATOM 1134 HG1 THR A 117 69.169 44.125 18.632 1.00 0.00 H ATOM 1135 H THR A 117 68.542 41.372 16.666 1.00 0.00 H ATOM 1136 N ILE A 118 67.334 42.932 14.596 1.00 21.55 N ATOM 1137 CA ILE A 118 67.357 43.609 13.292 1.00 20.66 C ATOM 1138 C ILE A 118 67.078 42.590 12.179 1.00 21.52 C ATOM 1139 O ILE A 118 67.874 41.669 11.954 1.00 21.35 O ATOM 1140 CB ILE A 118 68.709 44.315 13.048 1.00 20.37 C ATOM 1141 CG1 ILE A 118 68.963 45.372 14.126 1.00 20.75 C ATOM 1142 CG2 ILE A 118 68.744 44.988 11.685 1.00 20.41 C ATOM 1143 CD1 ILE A 118 70.371 45.921 14.159 1.00 20.82 C ATOM 1144 H ILE A 118 67.824 42.019 14.684 1.00 0.00 H ATOM 1145 N GLN A 119 65.939 42.754 11.508 1.00 21.33 N ATOM 1146 CA GLN A 119 65.511 41.873 10.409 1.00 23.10 C ATOM 1147 C GLN A 119 64.759 42.699 9.386 1.00 22.99 C ATOM 1148 O GLN A 119 64.178 43.731 9.724 1.00 23.68 O ATOM 1149 CB GLN A 119 64.575 40.769 10.925 1.00 23.78 C ATOM 1150 CG GLN A 119 65.199 39.760 11.866 1.00 25.53 C ATOM 1151 CD GLN A 119 66.098 38.769 11.145 1.00 27.85 C ATOM 1152 OE1 GLN A 119 65.743 38.250 10.077 1.00 31.06 O ATOM 1153 NE2 GLN A 119 67.264 38.497 11.718 1.00 29.89 N ATOM 1154 HE22 GLN A 119 67.522 38.956 12.615 1.00 0.00 H ATOM 1155 HE21 GLN A 119 67.919 37.825 11.270 1.00 0.00 H ATOM 1156 H GLN A 119 65.320 43.546 11.774 1.00 0.00 H ATOM 1157 N THR A 120 64.753 42.258 8.134 1.00 22.20 N ATOM 1158 CA THR A 120 63.938 42.884 7.121 1.00 21.49 C ATOM 1159 C THR A 120 62.494 42.385 7.182 1.00 20.99 C ATOM 1160 O THR A 120 62.208 41.298 7.715 1.00 20.80 O ATOM 1161 CB THR A 120 64.502 42.617 5.708 1.00 22.05 C ATOM 1162 OG1 THR A 120 64.556 41.206 5.479 1.00 22.99 O ATOM 1163 CG2 THR A 120 65.901 43.178 5.585 1.00 22.54 C ATOM 1164 HG1 THR A 120 64.917 41.033 4.574 1.00 0.00 H ATOM 1165 H THR A 120 65.348 41.444 7.878 1.00 0.00 H ATOM 1166 N ILE A 121 61.586 43.185 6.625 1.00 21.28 N ATOM 1167 CA ILE A 121 60.181 42.810 6.466 1.00 20.75 C ATOM 1168 C ILE A 121 59.902 42.639 4.978 1.00 21.34 C ATOM 1169 O ILE A 121 60.354 43.444 4.159 1.00 20.98 O ATOM 1170 CB ILE A 121 59.210 43.854 7.094 1.00 21.26 C ATOM 1171 CG1 ILE A 121 57.746 43.396 7.001 1.00 21.94 C ATOM 1172 CG2 ILE A 121 59.330 45.225 6.440 1.00 20.46 C ATOM 1173 CD1 ILE A 121 57.374 42.225 7.876 1.00 23.17 C ATOM 1174 H ILE A 121 61.890 44.120 6.287 1.00 0.00 H ATOM 1175 N ALA A 122 59.145 41.604 4.638 1.00 21.95 N ATOM 1176 CA ALA A 122 58.806 41.328 3.238 1.00 22.70 C ATOM 1177 C ALA A 122 57.847 42.372 2.669 1.00 23.14 C ATOM 1178 O ALA A 122 56.974 42.883 3.373 1.00 22.60 O ATOM 1179 CB ALA A 122 58.196 39.947 3.121 1.00 23.17 C ATOM 1180 H ALA A 122 58.783 40.973 5.382 1.00 0.00 H ATOM 1181 N LEU A 123 58.012 42.685 1.387 1.00 23.69 N ATOM 1182 CA LEU A 123 57.044 43.497 0.674 1.00 25.01 C ATOM 1183 C LEU A 123 55.950 42.595 0.140 1.00 26.11 C ATOM 1184 O LEU A 123 56.168 41.396 -0.027 1.00 26.65 O ATOM 1185 CB LEU A 123 57.708 44.232 -0.483 1.00 26.13 C ATOM 1186 CG LEU A 123 58.684 45.345 -0.108 1.00 27.05 C ATOM 1187 CD1 LEU A 123 59.488 45.754 -1.329 1.00 27.38 C ATOM 1188 CD2 LEU A 123 57.926 46.536 0.456 1.00 27.16 C ATOM 1189 H LEU A 123 58.854 42.340 0.884 1.00 0.00 H ATOM 1190 N PRO A 124 54.767 43.163 -0.121 1.00 26.66 N ATOM 1191 CA PRO A 124 53.666 42.394 -0.683 1.00 27.62 C ATOM 1192 C PRO A 124 53.844 42.213 -2.176 1.00 29.11 C ATOM 1193 O PRO A 124 54.719 42.838 -2.761 1.00 27.53 O ATOM 1194 CB PRO A 124 52.446 43.273 -0.405 1.00 27.72 C ATOM 1195 CG PRO A 124 52.969 44.660 -0.310 1.00 27.82 C ATOM 1196 CD PRO A 124 54.417 44.585 0.067 1.00 26.88 C ATOM 1197 N SER A 125 53.018 41.368 -2.783 1.00 31.95 N ATOM 1198 CA SER A 125 53.030 41.215 -4.238 1.00 35.18 C ATOM 1199 C SER A 125 52.057 42.205 -4.881 1.00 37.16 C ATOM 1200 O SER A 125 51.208 42.791 -4.206 1.00 34.79 O ATOM 1201 CB SER A 125 52.692 39.776 -4.635 1.00 35.87 C ATOM 1202 OG SER A 125 51.456 39.375 -4.087 1.00 37.39 O ATOM 1203 HG SER A 125 51.263 38.443 -4.359 1.00 0.00 H ATOM 1204 H SER A 125 52.352 40.806 -2.215 1.00 0.00 H ATOM 1205 N MET A 126 52.185 42.379 -6.191 1.00 42.78 N ATOM 1206 CA MET A 126 51.415 43.390 -6.914 1.00 48.56 C ATOM 1207 C MET A 126 49.920 43.217 -6.685 1.00 51.94 C ATOM 1208 O MET A 126 49.367 42.137 -6.910 1.00 50.20 O ATOM 1209 CB MET A 126 51.710 43.334 -8.417 1.00 51.13 C ATOM 1210 CG MET A 126 51.410 44.635 -9.149 1.00 55.15 C ATOM 1211 SD MET A 126 52.842 45.732 -9.234 1.00 60.29 S ATOM 1212 CE MET A 126 53.794 44.930 -10.524 1.00 57.49 C ATOM 1213 H MET A 126 52.852 41.779 -6.718 1.00 0.00 H ATOM 1214 N TYR A 127 49.281 44.286 -6.214 1.00 56.93 N ATOM 1215 CA TYR A 127 47.829 44.318 -6.032 1.00 60.71 C ATOM 1216 C TYR A 127 47.334 43.094 -5.254 1.00 58.24 C ATOM 1217 O TYR A 127 46.330 42.471 -5.606 1.00 59.55 O ATOM 1218 CB TYR A 127 47.125 44.474 -7.396 1.00 65.12 C ATOM 1219 CG TYR A 127 46.937 45.925 -7.817 1.00 70.41 C ATOM 1220 CD1 TYR A 127 47.959 46.868 -7.648 1.00 71.86 C ATOM 1221 CD2 TYR A 127 45.738 46.356 -8.384 1.00 74.29 C ATOM 1222 CE1 TYR A 127 47.786 48.190 -8.026 1.00 72.86 C ATOM 1223 CE2 TYR A 127 45.559 47.678 -8.766 1.00 75.66 C ATOM 1224 CZ TYR A 127 46.587 48.589 -8.585 1.00 75.51 C ATOM 1225 OH TYR A 127 46.417 49.902 -8.961 1.00 78.30 O ATOM 1226 HH TYR A 127 47.243 50.410 -8.763 1.00 0.00 H ATOM 1227 H TYR A 127 49.835 45.131 -5.966 1.00 0.00 H ATOM 1228 N ASN A 128 48.072 42.761 -4.196 1.00 54.90 N ATOM 1229 CA ASN A 128 47.695 41.707 -3.270 1.00 51.04 C ATOM 1230 C ASN A 128 47.714 42.257 -1.846 1.00 48.73 C ATOM 1231 O ASN A 128 48.780 42.548 -1.286 1.00 49.24 O ATOM 1232 CB ASN A 128 48.644 40.519 -3.388 1.00 51.69 C ATOM 1233 CG ASN A 128 48.206 39.334 -2.546 1.00 52.59 C ATOM 1234 OD1 ASN A 128 47.021 39.159 -2.262 1.00 51.20 O ATOM 1235 ND2 ASN A 128 49.164 38.505 -2.148 1.00 54.53 N ATOM 1236 HD22 ASN A 128 50.153 38.690 -2.410 1.00 0.00 H ATOM 1237 HD21 ASN A 128 48.925 37.671 -1.574 1.00 0.00 H ATOM 1238 H ASN A 128 48.958 43.279 -4.025 1.00 0.00 H ATOM 1239 N ASP A 129 46.521 42.405 -1.282 1.00 43.98 N ATOM 1240 CA ASP A 129 46.333 42.921 0.062 1.00 41.58 C ATOM 1241 C ASP A 129 45.481 41.928 0.838 1.00 37.58 C ATOM 1242 O ASP A 129 44.759 41.134 0.235 1.00 35.23 O ATOM 1243 CB ASP A 129 45.627 44.279 0.009 1.00 44.88 C ATOM 1244 CG ASP A 129 46.385 45.302 -0.826 1.00 48.52 C ATOM 1245 OD1 ASP A 129 47.601 45.484 -0.586 1.00 50.43 O ATOM 1246 OD2 ASP A 129 45.768 45.919 -1.724 1.00 52.16 O ATOM 1247 H ASP A 129 45.679 42.138 -1.831 1.00 0.00 H ATOM 1248 N PRO A 130 45.548 41.969 2.178 1.00 34.55 N ATOM 1249 CA PRO A 130 44.635 41.147 2.958 1.00 32.54 C ATOM 1250 C PRO A 130 43.190 41.589 2.775 1.00 33.07 C ATOM 1251 O PRO A 130 42.942 42.740 2.420 1.00 31.36 O ATOM 1252 CB PRO A 130 45.066 41.401 4.409 1.00 33.17 C ATOM 1253 CG PRO A 130 46.391 42.062 4.336 1.00 32.80 C ATOM 1254 CD PRO A 130 46.426 42.786 3.034 1.00 33.52 C ATOM 1255 N GLN A 131 42.249 40.678 3.017 1.00 34.37 N ATOM 1256 CA GLN A 131 40.828 41.018 2.983 1.00 35.77 C ATOM 1257 C GLN A 131 40.498 42.002 4.101 1.00 32.89 C ATOM 1258 O GLN A 131 41.114 41.998 5.177 1.00 29.95 O ATOM 1259 CB GLN A 131 39.941 39.764 3.125 1.00 40.54 C ATOM 1260 CG GLN A 131 39.203 39.326 1.852 1.00 45.07 C ATOM 1261 CD GLN A 131 40.081 38.727 0.754 1.00 47.74 C ATOM 1262 OE1 GLN A 131 39.751 38.834 -0.428 1.00 51.67 O ATOM 1263 NE2 GLN A 131 41.181 38.074 1.132 1.00 51.12 N ATOM 1264 HE22 GLN A 131 41.425 38.006 2.141 1.00 0.00 H ATOM 1265 HE21 GLN A 131 41.795 37.633 0.418 1.00 0.00 H ATOM 1266 H GLN A 131 42.532 39.701 3.235 1.00 0.00 H ATOM 1267 N PHE A 132 39.503 42.839 3.867 1.00 30.62 N ATOM 1268 CA PHE A 132 39.084 43.751 4.905 1.00 29.44 C ATOM 1269 C PHE A 132 38.511 42.955 6.078 1.00 29.11 C ATOM 1270 O PHE A 132 37.982 41.860 5.893 1.00 28.64 O ATOM 1271 CB PHE A 132 38.178 44.826 4.317 1.00 30.42 C ATOM 1272 CG PHE A 132 38.887 45.660 3.275 1.00 29.58 C ATOM 1273 CD1 PHE A 132 39.984 46.434 3.633 1.00 28.92 C ATOM 1274 CD2 PHE A 132 38.516 45.617 1.939 1.00 29.52 C ATOM 1275 CE1 PHE A 132 40.672 47.179 2.693 1.00 29.45 C ATOM 1276 CE2 PHE A 132 39.199 46.367 0.995 1.00 29.28 C ATOM 1277 CZ PHE A 132 40.275 47.147 1.371 1.00 29.34 C ATOM 1278 H PHE A 132 39.026 42.841 2.943 1.00 0.00 H ATOM 1279 N GLY A 133 38.726 43.463 7.286 1.00 28.64 N ATOM 1280 CA GLY A 133 38.487 42.698 8.518 1.00 28.48 C ATOM 1281 C GLY A 133 39.725 41.987 9.068 1.00 27.80 C ATOM 1282 O GLY A 133 39.732 41.582 10.228 1.00 28.34 O ATOM 1283 H GLY A 133 39.077 44.439 7.363 1.00 0.00 H ATOM 1284 N THR A 134 40.771 41.834 8.255 1.00 26.50 N ATOM 1285 CA THR A 134 42.039 41.246 8.720 1.00 26.62 C ATOM 1286 C THR A 134 42.668 42.084 9.846 1.00 26.24 C ATOM 1287 O THR A 134 42.695 43.313 9.784 1.00 24.05 O ATOM 1288 CB THR A 134 43.054 41.130 7.564 1.00 27.08 C ATOM 1289 OG1 THR A 134 42.525 40.267 6.556 1.00 28.30 O ATOM 1290 CG2 THR A 134 44.389 40.559 8.032 1.00 27.35 C ATOM 1291 HG1 THR A 134 41.675 40.642 6.215 1.00 0.00 H ATOM 1292 H THR A 134 40.689 42.139 7.264 1.00 0.00 H ATOM 1293 N SER A 135 43.173 41.405 10.869 1.00 24.94 N ATOM 1294 CA SER A 135 43.881 42.066 11.950 1.00 24.16 C ATOM 1295 C SER A 135 45.332 42.283 11.550 1.00 23.66 C ATOM 1296 O SER A 135 45.992 41.360 11.069 1.00 24.34 O ATOM 1297 CB SER A 135 43.809 41.232 13.228 1.00 24.01 C ATOM 1298 OG SER A 135 42.493 41.233 13.731 1.00 25.06 O ATOM 1299 HG SER A 135 41.882 40.847 13.055 1.00 0.00 H ATOM 1300 H SER A 135 43.058 40.372 10.897 1.00 0.00 H ATOM 1301 N CYS A 136 45.815 43.509 11.739 1.00 22.06 N ATOM 1302 CA CYS A 136 47.174 43.883 11.402 1.00 21.02 C ATOM 1303 C CYS A 136 47.791 44.661 12.541 1.00 20.26 C ATOM 1304 O CYS A 136 47.079 45.211 13.372 1.00 18.91 O ATOM 1305 CB CYS A 136 47.180 44.736 10.141 1.00 24.17 C ATOM 1306 SG CYS A 136 46.479 43.847 8.729 1.00 26.99 S ATOM 1307 H CYS A 136 45.188 44.232 12.147 1.00 0.00 H ATOM 1308 N GLU A 137 49.117 44.698 12.559 1.00 18.92 N ATOM 1309 CA GLU A 137 49.882 45.313 13.643 1.00 20.05 C ATOM 1310 C GLU A 137 50.484 46.639 13.200 1.00 19.27 C ATOM 1311 O GLU A 137 50.960 46.772 12.069 1.00 18.00 O ATOM 1312 CB GLU A 137 51.031 44.400 14.047 1.00 21.35 C ATOM 1313 CG GLU A 137 51.879 44.928 15.186 1.00 23.09 C ATOM 1314 CD GLU A 137 52.969 43.961 15.572 1.00 24.71 C ATOM 1315 OE1 GLU A 137 53.567 43.360 14.656 1.00 25.93 O ATOM 1316 OE2 GLU A 137 53.232 43.823 16.785 1.00 27.34 O ATOM 1317 H GLU A 137 49.636 44.270 11.766 1.00 0.00 H ATOM 1318 N ILE A 138 50.494 47.595 14.118 1.00 18.70 N ATOM 1319 CA ILE A 138 51.219 48.847 13.926 1.00 19.00 C ATOM 1320 C ILE A 138 52.152 49.051 15.120 1.00 19.07 C ATOM 1321 O ILE A 138 51.866 48.576 16.226 1.00 18.70 O ATOM 1322 CB ILE A 138 50.246 50.030 13.722 1.00 20.25 C ATOM 1323 CG1 ILE A 138 49.252 50.131 14.879 1.00 22.78 C ATOM 1324 CG2 ILE A 138 49.488 49.868 12.416 1.00 19.93 C ATOM 1325 CD1 ILE A 138 48.503 51.452 14.949 1.00 24.05 C ATOM 1326 H ILE A 138 49.968 47.448 15.003 1.00 0.00 H ATOM 1327 N THR A 139 53.285 49.710 14.885 1.00 18.62 N ATOM 1328 CA THR A 139 54.324 49.878 15.893 1.00 18.99 C ATOM 1329 C THR A 139 54.859 51.302 15.809 1.00 17.50 C ATOM 1330 O THR A 139 54.997 51.848 14.712 1.00 15.25 O ATOM 1331 CB THR A 139 55.502 48.901 15.667 1.00 21.50 C ATOM 1332 OG1 THR A 139 55.012 47.554 15.578 1.00 25.32 O ATOM 1333 CG2 THR A 139 56.498 48.975 16.824 1.00 22.03 C ATOM 1334 HG1 THR A 139 54.379 47.484 14.820 1.00 0.00 H ATOM 1335 H THR A 139 53.435 50.122 13.942 1.00 0.00 H ATOM 1336 N GLY A 140 55.139 51.918 16.953 1.00 15.53 N ATOM 1337 CA GLY A 140 55.816 53.199 16.928 1.00 14.78 C ATOM 1338 C GLY A 140 56.032 53.836 18.281 1.00 14.62 C ATOM 1339 O GLY A 140 55.615 53.295 19.318 1.00 14.18 O ATOM 1340 H GLY A 140 54.874 51.484 17.860 1.00 0.00 H ATOM 1341 N PHE A 141 56.698 54.986 18.242 1.00 14.85 N ATOM 1342 CA PHE A 141 56.981 55.805 19.423 1.00 15.20 C ATOM 1343 C PHE A 141 56.052 57.024 19.499 1.00 15.95 C ATOM 1344 O PHE A 141 56.377 58.021 20.167 1.00 18.84 O ATOM 1345 CB PHE A 141 58.427 56.313 19.392 1.00 15.21 C ATOM 1346 CG PHE A 141 59.471 55.294 19.745 1.00 15.25 C ATOM 1347 CD1 PHE A 141 59.648 54.852 21.070 1.00 15.60 C ATOM 1348 CD2 PHE A 141 60.342 54.837 18.784 1.00 15.56 C ATOM 1349 CE1 PHE A 141 60.646 53.932 21.375 1.00 15.90 C ATOM 1350 CE2 PHE A 141 61.337 53.920 19.085 1.00 16.21 C ATOM 1351 CZ PHE A 141 61.489 53.465 20.386 1.00 16.10 C ATOM 1352 H PHE A 141 57.038 55.324 17.319 1.00 0.00 H ATOM 1353 N GLY A 142 54.896 56.967 18.853 1.00 15.06 N ATOM 1354 CA GLY A 142 53.991 58.130 18.804 1.00 15.17 C ATOM 1355 C GLY A 142 53.255 58.414 20.097 1.00 16.09 C ATOM 1356 O GLY A 142 53.397 57.681 21.074 1.00 16.84 O ATOM 1357 H GLY A 142 54.622 56.086 18.372 1.00 0.00 H ATOM 1358 N LYS A 143 52.448 59.469 20.095 1.00 17.41 N ATOM 1359 CA LYS A 143 51.701 59.867 21.304 1.00 18.57 C ATOM 1360 C LYS A 143 50.783 58.738 21.790 1.00 18.55 C ATOM 1361 O LYS A 143 50.230 57.984 20.981 1.00 17.62 O ATOM 1362 CB LYS A 143 50.866 61.112 21.029 1.00 19.62 C ATOM 1363 CG LYS A 143 51.658 62.376 20.738 1.00 20.69 C ATOM 1364 CD LYS A 143 50.734 63.492 20.273 1.00 21.68 C ATOM 1365 CE LYS A 143 49.834 63.986 21.392 1.00 23.24 C ATOM 1366 NZ LYS A 143 49.055 65.194 21.005 1.00 23.91 N ATOM 1367 HZ1 LYS A 143 49.710 65.963 20.757 1.00 0.00 H ATOM 1368 HZ2 LYS A 143 48.455 64.970 20.186 1.00 0.00 H ATOM 1369 HZ3 LYS A 143 48.458 65.490 21.803 1.00 0.00 H ATOM 1370 H LYS A 143 52.340 60.026 19.223 1.00 0.00 H ATOM 1371 N GLU A 144 50.650 58.630 23.116 1.00 19.07 N ATOM 1372 CA GLU A 144 49.754 57.681 23.772 1.00 19.59 C ATOM 1373 C GLU A 144 48.408 58.285 24.161 1.00 20.66 C ATOM 1374 O GLU A 144 47.421 57.560 24.385 1.00 19.78 O ATOM 1375 CB GLU A 144 50.379 57.182 25.067 1.00 19.45 C ATOM 1376 CG GLU A 144 51.654 56.401 24.913 1.00 19.42 C ATOM 1377 CD GLU A 144 52.004 55.703 26.214 1.00 18.31 C ATOM 1378 OE1 GLU A 144 51.338 54.699 26.537 1.00 17.08 O ATOM 1379 OE2 GLU A 144 52.923 56.174 26.907 1.00 18.28 O ATOM 1380 H GLU A 144 51.219 59.260 23.717 1.00 0.00 H ATOM 1381 N GLN A 145 48.367 59.607 24.259 1.00 20.68 N ATOM 1382 CA GLN A 145 47.128 60.318 24.524 1.00 21.91 C ATOM 1383 C GLN A 145 47.258 61.739 24.000 1.00 20.68 C ATOM 1384 O GLN A 145 48.372 62.222 23.779 1.00 19.24 O ATOM 1385 CB GLN A 145 46.834 60.332 26.026 1.00 24.43 C ATOM 1386 CG GLN A 145 47.972 60.894 26.847 1.00 27.76 C ATOM 1387 CD GLN A 145 47.814 60.697 28.349 1.00 30.72 C ATOM 1388 OE1 GLN A 145 46.994 59.899 28.815 1.00 33.34 O ATOM 1389 NE2 GLN A 145 48.615 61.427 29.114 1.00 32.88 N ATOM 1390 HE22 GLN A 145 49.291 62.087 28.679 1.00 0.00 H ATOM 1391 HE21 GLN A 145 48.567 61.340 30.149 1.00 0.00 H ATOM 1392 H GLN A 145 49.246 60.150 24.143 1.00 0.00 H ATOM 1393 N SER A 146 46.112 62.398 23.844 1.00 21.24 N ATOM 1394 CA SER A 146 46.030 63.742 23.263 1.00 22.86 C ATOM 1395 C SER A 146 46.914 64.735 23.992 1.00 21.17 C ATOM 1396 O SER A 146 47.526 65.611 23.382 1.00 21.29 O ATOM 1397 CB SER A 146 44.586 64.253 23.317 1.00 24.02 C ATOM 1398 OG SER A 146 43.742 63.488 22.486 1.00 27.08 O ATOM 1399 HG SER A 146 42.819 63.841 22.541 1.00 0.00 H ATOM 1400 H SER A 146 45.231 61.937 24.149 1.00 0.00 H ATOM 1401 N THR A 147 46.960 64.598 25.310 1.00 21.68 N ATOM 1402 CA THR A 147 47.641 65.548 26.171 1.00 21.95 C ATOM 1403 C THR A 147 49.148 65.310 26.290 1.00 22.15 C ATOM 1404 O THR A 147 49.843 66.083 26.956 1.00 22.85 O ATOM 1405 CB THR A 147 47.027 65.512 27.578 1.00 21.60 C ATOM 1406 OG1 THR A 147 46.972 64.157 28.024 1.00 23.64 O ATOM 1407 CG2 THR A 147 45.628 66.058 27.564 1.00 22.15 C ATOM 1408 HG1 THR A 147 46.577 64.125 28.931 1.00 0.00 H ATOM 1409 H THR A 147 46.490 63.778 25.744 1.00 0.00 H ATOM 1410 N ASP A 148 49.672 64.256 25.655 1.00 22.17 N ATOM 1411 CA ASP A 148 51.108 64.019 25.684 1.00 22.32 C ATOM 1412 C ASP A 148 51.829 65.189 25.047 1.00 22.28 C ATOM 1413 O ASP A 148 51.459 65.631 23.955 1.00 23.10 O ATOM 1414 CB ASP A 148 51.506 62.760 24.910 1.00 23.60 C ATOM 1415 CG ASP A 148 51.215 61.488 25.652 1.00 24.50 C ATOM 1416 OD1 ASP A 148 50.922 61.537 26.864 1.00 25.85 O ATOM 1417 OD2 ASP A 148 51.310 60.421 25.008 1.00 25.15 O ATOM 1418 H ASP A 148 49.050 63.602 25.138 1.00 0.00 H ATOM 1419 N TYR A 149 52.861 65.681 25.722 1.00 21.28 N ATOM 1420 CA TYR A 149 53.747 66.681 25.137 1.00 22.39 C ATOM 1421 C TYR A 149 55.135 66.110 24.841 1.00 22.52 C ATOM 1422 O TYR A 149 55.945 66.768 24.188 1.00 23.53 O ATOM 1423 CB TYR A 149 53.822 67.935 26.015 1.00 22.95 C ATOM 1424 CG TYR A 149 54.339 67.720 27.417 1.00 23.06 C ATOM 1425 CD1 TYR A 149 55.700 67.761 27.685 1.00 23.67 C ATOM 1426 CD2 TYR A 149 53.467 67.524 28.479 1.00 24.59 C ATOM 1427 CE1 TYR A 149 56.186 67.571 28.966 1.00 24.88 C ATOM 1428 CE2 TYR A 149 53.947 67.341 29.774 1.00 24.59 C ATOM 1429 CZ TYR A 149 55.309 67.364 30.003 1.00 25.66 C ATOM 1430 OH TYR A 149 55.815 67.189 31.281 1.00 30.10 O ATOM 1431 HH TYR A 149 56.803 67.236 31.253 1.00 0.00 H ATOM 1432 H TYR A 149 53.042 65.346 26.690 1.00 0.00 H ATOM 1433 N LEU A 150 55.397 64.895 25.327 1.00 22.70 N ATOM 1434 CA LEU A 150 56.599 64.136 24.999 1.00 23.18 C ATOM 1435 C LEU A 150 56.165 62.787 24.440 1.00 21.66 C ATOM 1436 O LEU A 150 55.154 62.248 24.853 1.00 20.18 O ATOM 1437 CB LEU A 150 57.432 63.880 26.252 1.00 24.92 C ATOM 1438 CG LEU A 150 57.892 65.085 27.068 1.00 25.90 C ATOM 1439 CD1 LEU A 150 58.373 64.656 28.450 1.00 26.67 C ATOM 1440 CD2 LEU A 150 58.968 65.839 26.316 1.00 26.63 C ATOM 1441 H LEU A 150 54.706 64.466 25.975 1.00 0.00 H ATOM 1442 N TYR A 151 56.927 62.237 23.501 1.00 22.57 N ATOM 1443 CA TYR A 151 56.664 60.870 23.051 1.00 21.77 C ATOM 1444 C TYR A 151 57.056 59.859 24.144 1.00 22.09 C ATOM 1445 O TYR A 151 57.953 60.126 24.943 1.00 21.21 O ATOM 1446 CB TYR A 151 57.428 60.572 21.767 1.00 21.82 C ATOM 1447 CG TYR A 151 56.979 61.356 20.545 1.00 21.75 C ATOM 1448 CD1 TYR A 151 55.637 61.566 20.274 1.00 22.30 C ATOM 1449 CD2 TYR A 151 57.906 61.859 19.648 1.00 22.33 C ATOM 1450 CE1 TYR A 151 55.233 62.276 19.156 1.00 22.81 C ATOM 1451 CE2 TYR A 151 57.508 62.559 18.510 1.00 22.33 C ATOM 1452 CZ TYR A 151 56.169 62.767 18.278 1.00 21.94 C ATOM 1453 OH TYR A 151 55.756 63.461 17.163 1.00 20.90 O ATOM 1454 HH TYR A 151 56.067 62.991 16.349 1.00 0.00 H ATOM 1455 H TYR A 151 57.711 62.779 23.085 1.00 0.00 H ATOM 1456 N PRO A 152 56.378 58.695 24.190 1.00 21.70 N ATOM 1457 CA PRO A 152 56.745 57.678 25.173 1.00 21.51 C ATOM 1458 C PRO A 152 58.176 57.185 25.021 1.00 21.15 C ATOM 1459 O PRO A 152 58.710 57.083 23.906 1.00 19.86 O ATOM 1460 CB PRO A 152 55.765 56.536 24.881 1.00 21.42 C ATOM 1461 CG PRO A 152 55.473 56.687 23.417 1.00 21.65 C ATOM 1462 CD PRO A 152 55.365 58.182 23.251 1.00 21.71 C ATOM 1463 N GLU A 153 58.786 56.841 26.145 1.00 20.86 N ATOM 1464 CA GLU A 153 60.129 56.278 26.126 1.00 22.54 C ATOM 1465 C GLU A 153 60.174 54.861 25.564 1.00 21.30 C ATOM 1466 O GLU A 153 61.177 54.482 24.985 1.00 22.67 O ATOM 1467 CB GLU A 153 60.770 56.302 27.528 1.00 24.62 C ATOM 1468 CG GLU A 153 61.469 57.616 27.861 1.00 27.51 C ATOM 1469 CD GLU A 153 62.616 57.943 26.910 1.00 28.98 C ATOM 1470 OE1 GLU A 153 63.455 57.046 26.619 1.00 30.43 O ATOM 1471 OE2 GLU A 153 62.666 59.106 26.441 1.00 30.99 O ATOM 1472 H GLU A 153 58.299 56.975 27.054 1.00 0.00 H ATOM 1473 N GLN A 154 59.118 54.073 25.754 1.00 19.90 N ATOM 1474 CA GLN A 154 59.129 52.674 25.329 1.00 19.17 C ATOM 1475 C GLN A 154 58.323 52.502 24.044 1.00 17.48 C ATOM 1476 O GLN A 154 57.213 53.018 23.912 1.00 17.71 O ATOM 1477 CB GLN A 154 58.562 51.766 26.423 1.00 20.54 C ATOM 1478 CG GLN A 154 58.725 50.272 26.147 1.00 21.90 C ATOM 1479 CD GLN A 154 60.159 49.772 26.294 1.00 23.54 C ATOM 1480 OE1 GLN A 154 60.901 50.230 27.164 1.00 24.86 O ATOM 1481 NE2 GLN A 154 60.551 48.819 25.456 1.00 24.34 N ATOM 1482 HE22 GLN A 154 59.894 48.458 24.735 1.00 0.00 H ATOM 1483 HE21 GLN A 154 61.515 48.433 25.521 1.00 0.00 H ATOM 1484 H GLN A 154 58.269 54.460 26.213 1.00 0.00 H ATOM 1485 N LEU A 155 58.892 51.756 23.111 1.00 16.04 N ATOM 1486 CA LEU A 155 58.209 51.385 21.871 1.00 15.78 C ATOM 1487 C LEU A 155 56.853 50.729 22.174 1.00 15.34 C ATOM 1488 O LEU A 155 56.716 49.969 23.136 1.00 14.81 O ATOM 1489 CB LEU A 155 59.082 50.421 21.067 1.00 15.16 C ATOM 1490 CG LEU A 155 58.659 50.082 19.624 1.00 15.43 C ATOM 1491 CD1 LEU A 155 58.641 51.334 18.769 1.00 15.51 C ATOM 1492 CD2 LEU A 155 59.623 49.063 19.052 1.00 15.88 C ATOM 1493 H LEU A 155 59.864 51.420 23.265 1.00 0.00 H ATOM 1494 N LYS A 156 55.867 50.997 21.332 1.00 14.61 N ATOM 1495 CA LYS A 156 54.530 50.417 21.498 1.00 14.78 C ATOM 1496 C LYS A 156 54.063 49.722 20.239 1.00 15.62 C ATOM 1497 O LYS A 156 54.558 50.011 19.148 1.00 14.72 O ATOM 1498 CB LYS A 156 53.535 51.503 21.877 1.00 14.79 C ATOM 1499 CG LYS A 156 53.720 52.009 23.315 1.00 14.27 C ATOM 1500 CD LYS A 156 52.602 52.964 23.736 1.00 14.46 C ATOM 1501 CE LYS A 156 51.332 52.248 24.173 1.00 14.47 C ATOM 1502 NZ LYS A 156 50.173 53.168 24.392 1.00 13.53 N ATOM 1503 HZ1 LYS A 156 50.414 53.856 25.133 1.00 0.00 H ATOM 1504 HZ2 LYS A 156 49.959 53.671 23.507 1.00 0.00 H ATOM 1505 HZ3 LYS A 156 49.344 52.614 24.687 1.00 0.00 H ATOM 1506 H LYS A 156 56.045 51.636 20.531 1.00 0.00 H ATOM 1507 N MET A 157 53.093 48.825 20.399 1.00 17.09 N ATOM 1508 CA MET A 157 52.412 48.228 19.264 1.00 18.37 C ATOM 1509 C MET A 157 50.914 48.123 19.551 1.00 18.18 C ATOM 1510 O MET A 157 50.469 48.187 20.696 1.00 16.26 O ATOM 1511 CB MET A 157 52.991 46.845 18.943 1.00 20.93 C ATOM 1512 CG MET A 157 52.760 45.785 20.003 1.00 23.76 C ATOM 1513 SD MET A 157 51.091 45.086 20.100 1.00 30.62 S ATOM 1514 CE MET A 157 51.150 43.779 18.886 1.00 29.83 C ATOM 1515 H MET A 157 52.816 48.545 21.361 1.00 0.00 H ATOM 1516 N THR A 158 50.124 48.001 18.498 1.00 16.65 N ATOM 1517 CA THR A 158 48.748 47.625 18.681 1.00 17.52 C ATOM 1518 C THR A 158 48.254 46.868 17.471 1.00 17.00 C ATOM 1519 O THR A 158 48.971 46.738 16.478 1.00 17.28 O ATOM 1520 CB THR A 158 47.837 48.825 19.048 1.00 17.95 C ATOM 1521 OG1 THR A 158 46.595 48.337 19.581 1.00 18.51 O ATOM 1522 CG2 THR A 158 47.579 49.714 17.865 1.00 18.21 C ATOM 1523 HG1 THR A 158 46.014 49.104 19.815 1.00 0.00 H ATOM 1524 H THR A 158 50.496 48.176 17.543 1.00 0.00 H ATOM 1525 N VAL A 159 47.053 46.321 17.602 1.00 17.08 N ATOM 1526 CA VAL A 159 46.407 45.580 16.533 1.00 17.47 C ATOM 1527 C VAL A 159 45.123 46.294 16.154 1.00 17.78 C ATOM 1528 O VAL A 159 44.317 46.656 17.015 1.00 17.68 O ATOM 1529 CB VAL A 159 46.138 44.122 16.962 1.00 17.84 C ATOM 1530 CG1 VAL A 159 45.355 43.358 15.912 1.00 18.29 C ATOM 1531 CG2 VAL A 159 47.464 43.432 17.221 1.00 18.63 C ATOM 1532 H VAL A 159 46.553 46.427 18.508 1.00 0.00 H ATOM 1533 N VAL A 160 44.952 46.495 14.847 1.00 17.58 N ATOM 1534 CA VAL A 160 43.792 47.175 14.284 1.00 18.31 C ATOM 1535 C VAL A 160 43.274 46.281 13.156 1.00 18.50 C ATOM 1536 O VAL A 160 43.995 45.385 12.701 1.00 18.41 O ATOM 1537 CB VAL A 160 44.149 48.589 13.739 1.00 18.68 C ATOM 1538 CG1 VAL A 160 44.442 49.555 14.882 1.00 19.02 C ATOM 1539 CG2 VAL A 160 45.332 48.537 12.780 1.00 18.54 C ATOM 1540 H VAL A 160 45.685 46.149 14.195 1.00 0.00 H ATOM 1541 N LYS A 161 42.038 46.517 12.725 1.00 19.06 N ATOM 1542 CA LYS A 161 41.458 45.777 11.606 1.00 19.58 C ATOM 1543 C LYS A 161 41.354 46.640 10.352 1.00 20.08 C ATOM 1544 O LYS A 161 40.970 47.807 10.424 1.00 19.50 O ATOM 1545 CB LYS A 161 40.079 45.246 11.987 1.00 21.18 C ATOM 1546 CG LYS A 161 40.111 44.171 13.058 1.00 23.00 C ATOM 1547 CD LYS A 161 38.708 43.763 13.469 1.00 23.59 C ATOM 1548 CE LYS A 161 38.737 42.789 14.633 1.00 24.55 C ATOM 1549 NZ LYS A 161 37.401 42.171 14.850 1.00 25.16 N ATOM 1550 HZ1 LYS A 161 36.705 42.916 15.057 1.00 0.00 H ATOM 1551 HZ2 LYS A 161 37.115 41.656 13.993 1.00 0.00 H ATOM 1552 HZ3 LYS A 161 37.452 41.510 15.652 1.00 0.00 H ATOM 1553 H LYS A 161 41.469 47.248 13.197 1.00 0.00 H ATOM 1554 N LEU A 162 41.646 46.033 9.203 1.00 20.13 N ATOM 1555 CA LEU A 162 41.512 46.705 7.927 1.00 21.44 C ATOM 1556 C LEU A 162 40.049 47.004 7.611 1.00 22.76 C ATOM 1557 O LEU A 162 39.165 46.168 7.839 1.00 22.19 O ATOM 1558 CB LEU A 162 42.117 45.866 6.813 1.00 22.35 C ATOM 1559 CG LEU A 162 43.607 45.573 6.916 1.00 23.52 C ATOM 1560 CD1 LEU A 162 44.044 44.684 5.766 1.00 24.24 C ATOM 1561 CD2 LEU A 162 44.412 46.859 6.909 1.00 25.15 C ATOM 1562 H LEU A 162 41.980 45.048 9.223 1.00 0.00 H ATOM 1563 N ILE A 163 39.817 48.200 7.081 1.00 22.43 N ATOM 1564 CA ILE A 163 38.478 48.696 6.782 1.00 23.20 C ATOM 1565 C ILE A 163 38.370 48.857 5.273 1.00 22.70 C ATOM 1566 O ILE A 163 39.302 49.335 4.638 1.00 22.27 O ATOM 1567 CB ILE A 163 38.241 50.017 7.535 1.00 23.81 C ATOM 1568 CG1 ILE A 163 38.015 49.689 9.016 1.00 25.03 C ATOM 1569 CG2 ILE A 163 37.059 50.795 6.970 1.00 25.17 C ATOM 1570 CD1 ILE A 163 37.928 50.887 9.929 1.00 25.82 C ATOM 1571 H ILE A 163 40.630 48.813 6.869 1.00 0.00 H ATOM 1572 N SER A 164 37.242 48.457 4.699 1.00 23.05 N ATOM 1573 CA SER A 164 37.063 48.546 3.240 1.00 22.80 C ATOM 1574 C SER A 164 37.070 49.986 2.740 1.00 23.21 C ATOM 1575 O SER A 164 36.700 50.911 3.469 1.00 21.92 O ATOM 1576 CB SER A 164 35.750 47.883 2.810 1.00 22.96 C ATOM 1577 OG SER A 164 34.647 48.685 3.189 1.00 22.83 O ATOM 1578 HG SER A 164 34.720 49.571 2.754 1.00 0.00 H ATOM 1579 H SER A 164 36.474 48.076 5.288 1.00 0.00 H ATOM 1580 N HIS A 165 37.463 50.164 1.477 1.00 24.47 N ATOM 1581 CA HIS A 165 37.421 51.484 0.856 1.00 26.83 C ATOM 1582 C HIS A 165 35.991 52.035 0.902 1.00 27.00 C ATOM 1583 O HIS A 165 35.782 53.204 1.225 1.00 25.95 O ATOM 1584 CB HIS A 165 37.945 51.442 -0.586 1.00 29.06 C ATOM 1585 CG HIS A 165 37.909 52.772 -1.267 1.00 31.92 C ATOM 1586 ND1 HIS A 165 38.709 53.824 -0.876 1.00 34.07 N ATOM 1587 CD2 HIS A 165 37.141 53.238 -2.281 1.00 33.54 C ATOM 1588 CE1 HIS A 165 38.449 54.876 -1.632 1.00 34.90 C ATOM 1589 NE2 HIS A 165 37.501 54.548 -2.492 1.00 34.16 N ATOM 1590 H HIS A 165 37.804 49.350 0.927 1.00 0.00 H ATOM 1591 N ARG A 166 35.010 51.176 0.614 1.00 27.09 N ATOM 1592 CA ARG A 166 33.597 51.572 0.668 1.00 26.66 C ATOM 1593 C ARG A 166 33.203 52.146 2.025 1.00 24.48 C ATOM 1594 O ARG A 166 32.493 53.148 2.095 1.00 23.82 O ATOM 1595 CB ARG A 166 32.678 50.391 0.314 1.00 28.56 C ATOM 1596 CG ARG A 166 31.215 50.793 0.186 1.00 29.94 C ATOM 1597 CD ARG A 166 30.359 49.726 -0.473 1.00 31.80 C ATOM 1598 NE ARG A 166 28.969 50.167 -0.556 1.00 33.56 N ATOM 1599 CZ ARG A 166 27.993 49.486 -1.150 1.00 35.38 C ATOM 1600 NH1 ARG A 166 28.243 48.317 -1.725 1.00 36.15 N ATOM 1601 NH2 ARG A 166 26.763 49.980 -1.168 1.00 36.34 N ATOM 1602 HE ARG A 166 28.725 51.079 -0.119 1.00 0.00 H ATOM 1603 HH12 ARG A 166 27.475 47.790 -2.188 1.00 0.00 H ATOM 1604 HH11 ARG A 166 29.207 47.927 -1.713 1.00 0.00 H ATOM 1605 HH22 ARG A 166 25.997 49.451 -1.631 1.00 0.00 H ATOM 1606 HH21 ARG A 166 26.564 50.897 -0.719 1.00 0.00 H ATOM 1607 H ARG A 166 35.253 50.201 0.344 1.00 0.00 H ATOM 1608 N GLU A 167 33.660 51.515 3.105 1.00 23.36 N ATOM 1609 CA GLU A 167 33.379 52.018 4.445 1.00 23.13 C ATOM 1610 C GLU A 167 34.108 53.334 4.710 1.00 22.99 C ATOM 1611 O GLU A 167 33.536 54.287 5.255 1.00 21.62 O ATOM 1612 CB GLU A 167 33.756 50.978 5.516 1.00 23.93 C ATOM 1613 CG GLU A 167 33.574 51.471 6.954 1.00 24.59 C ATOM 1614 CD GLU A 167 33.570 50.343 7.987 1.00 26.39 C ATOM 1615 OE1 GLU A 167 33.299 49.186 7.612 1.00 29.00 O ATOM 1616 OE2 GLU A 167 33.820 50.614 9.177 1.00 27.35 O ATOM 1617 H GLU A 167 34.226 50.650 2.991 1.00 0.00 H ATOM 1618 N CYS A 168 35.385 53.376 4.341 1.00 23.24 N ATOM 1619 CA CYS A 168 36.207 54.538 4.654 1.00 23.56 C ATOM 1620 C CYS A 168 35.781 55.815 3.923 1.00 22.48 C ATOM 1621 O CYS A 168 36.060 56.915 4.390 1.00 21.15 O ATOM 1622 CB CYS A 168 37.686 54.254 4.390 1.00 24.80 C ATOM 1623 SG CYS A 168 38.712 55.148 5.575 1.00 27.75 S ATOM 1624 H CYS A 168 35.800 52.574 3.825 1.00 0.00 H ATOM 1625 N GLN A 169 35.120 55.655 2.776 1.00 23.63 N ATOM 1626 CA GLN A 169 34.647 56.788 1.976 1.00 23.63 C ATOM 1627 C GLN A 169 33.197 57.179 2.290 1.00 23.52 C ATOM 1628 O GLN A 169 32.598 57.989 1.590 1.00 22.07 O ATOM 1629 CB GLN A 169 34.839 56.517 0.475 1.00 24.57 C ATOM 1630 CG GLN A 169 34.053 55.346 -0.087 1.00 26.22 C ATOM 1631 CD GLN A 169 32.631 55.685 -0.489 1.00 26.50 C ATOM 1632 OE1 GLN A 169 31.675 55.092 0.025 1.00 26.67 O ATOM 1633 NE2 GLN A 169 32.479 56.631 -1.418 1.00 26.31 N ATOM 1634 HE22 GLN A 169 33.314 57.102 -1.822 1.00 0.00 H ATOM 1635 HE21 GLN A 169 31.526 56.897 -1.738 1.00 0.00 H ATOM 1636 H GLN A 169 34.933 54.690 2.436 1.00 0.00 H ATOM 1637 N GLN A 170 32.639 56.632 3.366 1.00 23.93 N ATOM 1638 CA GLN A 170 31.334 57.084 3.823 1.00 25.36 C ATOM 1639 C GLN A 170 31.465 58.527 4.258 1.00 25.44 C ATOM 1640 O GLN A 170 32.540 58.949 4.714 1.00 25.71 O ATOM 1641 CB GLN A 170 30.813 56.204 4.967 1.00 25.67 C ATOM 1642 CG GLN A 170 30.488 54.781 4.535 1.00 25.92 C ATOM 1643 CD GLN A 170 29.460 54.699 3.419 1.00 26.74 C ATOM 1644 OE1 GLN A 170 29.656 53.983 2.434 1.00 28.29 O ATOM 1645 NE2 GLN A 170 28.364 55.440 3.558 1.00 26.47 N ATOM 1646 HE22 GLN A 170 28.239 56.030 4.405 1.00 0.00 H ATOM 1647 HE21 GLN A 170 27.632 55.430 2.819 1.00 0.00 H ATOM 1648 H GLN A 170 33.137 55.879 3.882 1.00 0.00 H ATOM 1649 N PRO A 170A 30.381 59.307 4.110 1.00 26.67 N ATOM 1650 CA PRO A 170A 30.459 60.744 4.403 1.00 27.61 C ATOM 1651 C PRO A 170A 30.877 61.096 5.837 1.00 27.50 C ATOM 1652 O PRO A 170A 31.545 62.097 6.035 1.00 28.16 O ATOM 1653 CB PRO A 170A 29.038 61.264 4.085 1.00 27.39 C ATOM 1654 CG PRO A 170A 28.173 60.061 3.938 1.00 27.72 C ATOM 1655 CD PRO A 170A 29.056 58.899 3.606 1.00 27.02 C ATOM 1656 N HIS A 170B 30.502 60.287 6.823 1.00 28.42 N ATOM 1657 CA HIS A 170B 30.928 60.519 8.206 1.00 29.55 C ATOM 1658 C HIS A 170B 32.308 59.930 8.522 1.00 26.90 C ATOM 1659 O HIS A 170B 32.836 60.137 9.615 1.00 25.40 O ATOM 1660 CB HIS A 170B 29.906 59.949 9.193 1.00 34.43 C ATOM 1661 CG HIS A 170B 28.586 60.651 9.155 1.00 38.73 C ATOM 1662 ND1 HIS A 170B 28.321 61.771 9.912 1.00 41.84 N ATOM 1663 CD2 HIS A 170B 27.460 60.400 8.446 1.00 41.64 C ATOM 1664 CE1 HIS A 170B 27.086 62.176 9.677 1.00 43.03 C ATOM 1665 NE2 HIS A 170B 26.542 61.361 8.791 1.00 43.44 N ATOM 1666 H HIS A 170B 29.893 59.472 6.608 1.00 0.00 H ATOM 1667 N TYR A 171 32.873 59.173 7.585 1.00 24.95 N ATOM 1668 CA TYR A 171 34.271 58.769 7.694 1.00 23.18 C ATOM 1669 C TYR A 171 35.134 59.842 7.023 1.00 21.26 C ATOM 1670 O TYR A 171 35.313 60.912 7.598 1.00 21.58 O ATOM 1671 CB TYR A 171 34.483 57.366 7.137 1.00 23.13 C ATOM 1672 CG TYR A 171 34.100 56.274 8.125 1.00 23.78 C ATOM 1673 CD1 TYR A 171 32.819 56.214 8.667 1.00 24.80 C ATOM 1674 CD2 TYR A 171 35.018 55.296 8.508 1.00 24.27 C ATOM 1675 CE1 TYR A 171 32.462 55.225 9.577 1.00 24.77 C ATOM 1676 CE2 TYR A 171 34.671 54.302 9.421 1.00 25.06 C ATOM 1677 CZ TYR A 171 33.394 54.268 9.943 1.00 25.58 C ATOM 1678 OH TYR A 171 33.047 53.282 10.841 1.00 27.02 O ATOM 1679 HH TYR A 171 33.157 52.395 10.415 1.00 0.00 H ATOM 1680 H TYR A 171 32.312 58.866 6.765 1.00 0.00 H ATOM 1681 N TYR A 172 35.632 59.597 5.811 1.00 19.95 N ATOM 1682 CA TYR A 172 36.495 60.571 5.136 1.00 19.42 C ATOM 1683 C TYR A 172 35.970 61.019 3.765 1.00 19.92 C ATOM 1684 O TYR A 172 36.632 61.810 3.083 1.00 19.62 O ATOM 1685 CB TYR A 172 37.922 60.019 4.994 1.00 19.10 C ATOM 1686 CG TYR A 172 38.670 59.893 6.317 1.00 17.74 C ATOM 1687 CD1 TYR A 172 38.794 60.974 7.159 1.00 17.68 C ATOM 1688 CD2 TYR A 172 39.278 58.693 6.691 1.00 18.02 C ATOM 1689 CE1 TYR A 172 39.477 60.870 8.366 1.00 17.81 C ATOM 1690 CE2 TYR A 172 39.970 58.583 7.888 1.00 17.00 C ATOM 1691 CZ TYR A 172 40.075 59.672 8.713 1.00 17.29 C ATOM 1692 OH TYR A 172 40.746 59.567 9.921 1.00 17.52 O ATOM 1693 HH TYR A 172 41.685 59.303 9.754 1.00 0.00 H ATOM 1694 H TYR A 172 35.405 58.700 5.336 1.00 0.00 H ATOM 1695 N GLY A 173 34.783 60.548 3.387 1.00 19.25 N ATOM 1696 CA GLY A 173 34.226 60.864 2.073 1.00 19.22 C ATOM 1697 C GLY A 173 35.202 60.502 0.980 1.00 18.79 C ATOM 1698 O GLY A 173 35.951 59.514 1.067 1.00 18.06 O ATOM 1699 H GLY A 173 34.242 59.944 4.039 1.00 0.00 H ATOM 1700 N SER A 174 35.231 61.316 -0.072 1.00 18.61 N ATOM 1701 CA SER A 174 36.145 61.053 -1.168 1.00 18.69 C ATOM 1702 C SER A 174 37.593 61.497 -0.905 1.00 19.52 C ATOM 1703 O SER A 174 38.396 61.474 -1.821 1.00 19.27 O ATOM 1704 CB SER A 174 35.610 61.706 -2.451 1.00 18.20 C ATOM 1705 OG SER A 174 34.386 61.101 -2.796 1.00 18.61 O ATOM 1706 HG SER A 174 34.035 61.517 -3.623 1.00 0.00 H ATOM 1707 H SER A 174 34.599 62.141 -0.109 1.00 0.00 H ATOM 1708 N GLU A 175 37.928 61.904 0.324 1.00 20.31 N ATOM 1709 CA GLU A 175 39.301 62.304 0.663 1.00 22.63 C ATOM 1710 C GLU A 175 40.247 61.097 0.720 1.00 22.45 C ATOM 1711 O GLU A 175 41.452 61.236 0.541 1.00 22.06 O ATOM 1712 CB GLU A 175 39.350 63.081 1.984 1.00 24.27 C ATOM 1713 CG GLU A 175 38.619 64.415 1.923 1.00 26.72 C ATOM 1714 CD GLU A 175 38.461 65.086 3.278 1.00 31.33 C ATOM 1715 OE1 GLU A 175 37.309 65.450 3.624 1.00 34.93 O ATOM 1716 OE2 GLU A 175 39.473 65.265 3.993 1.00 32.74 O ATOM 1717 H GLU A 175 37.196 61.938 1.061 1.00 0.00 H ATOM 1718 N VAL A 176 39.688 59.919 0.969 1.00 22.56 N ATOM 1719 CA VAL A 176 40.443 58.666 0.943 1.00 22.95 C ATOM 1720 C VAL A 176 40.352 58.072 -0.453 1.00 23.34 C ATOM 1721 O VAL A 176 39.285 58.097 -1.060 1.00 25.22 O ATOM 1722 CB VAL A 176 39.896 57.653 1.968 1.00 23.09 C ATOM 1723 CG1 VAL A 176 40.393 56.244 1.666 1.00 23.62 C ATOM 1724 CG2 VAL A 176 40.308 58.064 3.370 1.00 22.69 C ATOM 1725 H VAL A 176 38.673 59.885 1.191 1.00 0.00 H ATOM 1726 N THR A 177 41.463 57.540 -0.957 1.00 23.68 N ATOM 1727 CA THR A 177 41.523 56.987 -2.324 1.00 24.26 C ATOM 1728 C THR A 177 41.912 55.521 -2.298 1.00 25.10 C ATOM 1729 O THR A 177 42.269 54.980 -1.248 1.00 25.12 O ATOM 1730 CB THR A 177 42.555 57.737 -3.208 1.00 23.90 C ATOM 1731 OG1 THR A 177 43.883 57.299 -2.896 1.00 23.76 O ATOM 1732 CG2 THR A 177 42.474 59.233 -3.017 1.00 24.68 C ATOM 1733 HG1 THR A 177 44.532 57.784 -3.466 1.00 0.00 H ATOM 1734 H THR A 177 42.319 57.513 -0.367 1.00 0.00 H ATOM 1735 N THR A 178 41.873 54.873 -3.457 1.00 24.86 N ATOM 1736 CA THR A 178 42.205 53.450 -3.526 1.00 25.95 C ATOM 1737 C THR A 178 43.705 53.166 -3.444 1.00 24.10 C ATOM 1738 O THR A 178 44.088 52.013 -3.408 1.00 25.49 O ATOM 1739 CB THR A 178 41.638 52.782 -4.794 1.00 27.40 C ATOM 1740 OG1 THR A 178 42.171 53.430 -5.948 1.00 29.06 O ATOM 1741 CG2 THR A 178 40.101 52.863 -4.802 1.00 28.78 C ATOM 1742 HG1 THR A 178 41.807 53.002 -6.763 1.00 0.00 H ATOM 1743 H THR A 178 41.604 55.382 -4.323 1.00 0.00 H ATOM 1744 N LYS A 179 44.554 54.197 -3.395 1.00 23.22 N ATOM 1745 CA LYS A 179 45.981 54.002 -3.089 1.00 22.14 C ATOM 1746 C LYS A 179 46.262 54.098 -1.572 1.00 20.81 C ATOM 1747 O LYS A 179 47.413 54.169 -1.147 1.00 20.26 O ATOM 1748 CB LYS A 179 46.847 54.994 -3.861 1.00 23.58 C ATOM 1749 CG LYS A 179 46.925 54.682 -5.357 1.00 24.79 C ATOM 1750 CD LYS A 179 47.288 55.899 -6.200 1.00 26.19 C ATOM 1751 CE LYS A 179 48.552 56.602 -5.730 1.00 26.28 C ATOM 1752 NZ LYS A 179 48.818 57.822 -6.547 1.00 27.88 N ATOM 1753 HZ1 LYS A 179 48.937 57.551 -7.544 1.00 0.00 H ATOM 1754 HZ2 LYS A 179 48.017 58.479 -6.458 1.00 0.00 H ATOM 1755 HZ3 LYS A 179 49.686 58.283 -6.206 1.00 0.00 H ATOM 1756 H LYS A 179 44.199 55.158 -3.577 1.00 0.00 H ATOM 1757 N MET A 180 45.196 54.106 -0.788 1.00 20.33 N ATOM 1758 CA MET A 180 45.272 54.171 0.663 1.00 20.76 C ATOM 1759 C MET A 180 44.506 53.004 1.256 1.00 21.01 C ATOM 1760 O MET A 180 43.600 52.459 0.623 1.00 20.84 O ATOM 1761 CB MET A 180 44.665 55.482 1.147 1.00 20.46 C ATOM 1762 CG MET A 180 45.349 56.740 0.609 1.00 20.50 C ATOM 1763 SD MET A 180 44.377 58.225 0.944 1.00 21.01 S ATOM 1764 CE MET A 180 45.152 59.426 -0.138 1.00 21.21 C ATOM 1765 H MET A 180 44.256 54.064 -1.232 1.00 0.00 H ATOM 1766 N LEU A 181 44.861 52.649 2.488 1.00 19.93 N ATOM 1767 CA LEU A 181 44.215 51.592 3.235 1.00 20.75 C ATOM 1768 C LEU A 181 43.811 52.210 4.567 1.00 20.15 C ATOM 1769 O LEU A 181 44.596 52.937 5.158 1.00 19.20 O ATOM 1770 CB LEU A 181 45.218 50.466 3.490 1.00 22.53 C ATOM 1771 CG LEU A 181 45.155 49.118 2.788 1.00 24.82 C ATOM 1772 CD1 LEU A 181 44.726 49.208 1.335 1.00 26.18 C ATOM 1773 CD2 LEU A 181 46.519 48.458 2.912 1.00 24.25 C ATOM 1774 H LEU A 181 45.647 53.160 2.939 1.00 0.00 H ATOM 1775 N CYS A 182 42.598 51.928 5.025 1.00 19.99 N ATOM 1776 CA CYS A 182 42.126 52.412 6.322 1.00 20.12 C ATOM 1777 C CYS A 182 42.157 51.259 7.296 1.00 18.41 C ATOM 1778 O CYS A 182 41.964 50.113 6.919 1.00 18.89 O ATOM 1779 CB CYS A 182 40.699 52.946 6.216 1.00 22.07 C ATOM 1780 SG CYS A 182 40.594 54.447 5.228 1.00 24.98 S ATOM 1781 H CYS A 182 41.963 51.345 4.444 1.00 0.00 H ATOM 1782 N ALA A 183 42.402 51.561 8.559 1.00 18.19 N ATOM 1783 CA ALA A 183 42.376 50.533 9.564 1.00 17.61 C ATOM 1784 C ALA A 183 42.046 51.185 10.887 1.00 17.77 C ATOM 1785 O ALA A 183 42.461 52.312 11.152 1.00 16.91 O ATOM 1786 CB ALA A 183 43.718 49.810 9.630 1.00 17.74 C ATOM 1787 H ALA A 183 42.614 52.543 8.826 1.00 0.00 H ATOM 1788 N ALA A 184 41.281 50.475 11.708 1.00 18.11 N ATOM 1789 CA ALA A 184 40.909 50.982 13.014 1.00 19.24 C ATOM 1790 C ALA A 184 40.463 49.870 13.951 1.00 20.29 C ATOM 1791 O ALA A 184 40.259 48.733 13.534 1.00 19.73 O ATOM 1792 CB ALA A 184 39.795 52.004 12.871 1.00 19.88 C ATOM 1793 H ALA A 184 40.943 49.538 11.409 1.00 0.00 H ATOM 1794 N ASP A 185 40.324 50.230 15.216 1.00 22.21 N ATOM 1795 CA ASP A 185 39.706 49.362 16.212 1.00 24.27 C ATOM 1796 C ASP A 185 38.182 49.468 16.089 1.00 24.97 C ATOM 1797 O ASP A 185 37.648 50.578 16.051 1.00 24.43 O ATOM 1798 CB ASP A 185 40.118 49.799 17.610 1.00 25.11 C ATOM 1799 CG ASP A 185 39.561 48.880 18.701 1.00 27.62 C ATOM 1800 OD1 ASP A 185 39.939 47.691 18.728 1.00 29.74 O ATOM 1801 OD2 ASP A 185 38.752 49.347 19.523 1.00 29.47 O ATOM 1802 H ASP A 185 40.668 51.166 15.511 1.00 0.00 H ATOM 1803 N PRO A 185A 37.472 48.323 16.061 1.00 27.46 N ATOM 1804 CA PRO A 185A 35.995 48.359 16.017 1.00 28.91 C ATOM 1805 C PRO A 185A 35.331 49.178 17.139 1.00 29.41 C ATOM 1806 O PRO A 185A 34.209 49.644 16.963 1.00 32.18 O ATOM 1807 CB PRO A 185A 35.609 46.881 16.129 1.00 29.09 C ATOM 1808 CG PRO A 185A 36.771 46.147 15.567 1.00 29.53 C ATOM 1809 CD PRO A 185A 37.984 46.941 15.967 1.00 28.63 C ATOM 1810 N GLN A 185B 36.012 49.348 18.269 1.00 29.07 N ATOM 1811 CA GLN A 185B 35.504 50.140 19.401 1.00 31.04 C ATOM 1812 C GLN A 185B 36.212 51.494 19.544 1.00 28.14 C ATOM 1813 O GLN A 185B 36.008 52.199 20.530 1.00 27.68 O ATOM 1814 CB GLN A 185B 35.693 49.356 20.707 1.00 35.13 C ATOM 1815 CG GLN A 185B 34.417 49.076 21.489 1.00 39.84 C ATOM 1816 CD GLN A 185B 33.781 47.758 21.098 1.00 42.28 C ATOM 1817 OE1 GLN A 185B 32.604 47.709 20.742 1.00 47.68 O ATOM 1818 NE2 GLN A 185B 34.560 46.677 21.156 1.00 43.75 N ATOM 1819 HE22 GLN A 185B 35.550 46.765 21.463 1.00 0.00 H ATOM 1820 HE21 GLN A 185B 34.178 45.746 20.894 1.00 0.00 H ATOM 1821 H GLN A 185B 36.947 48.901 18.357 1.00 0.00 H ATOM 1822 N TRP A 186 37.057 51.845 18.575 1.00 27.60 N ATOM 1823 CA TRP A 186 37.778 53.131 18.574 1.00 26.19 C ATOM 1824 C TRP A 186 38.584 53.370 19.854 1.00 25.62 C ATOM 1825 O TRP A 186 38.665 54.496 20.349 1.00 25.42 O ATOM 1826 CB TRP A 186 36.792 54.280 18.320 1.00 27.15 C ATOM 1827 CG TRP A 186 35.865 53.969 17.192 1.00 27.00 C ATOM 1828 CD1 TRP A 186 34.579 53.525 17.287 1.00 27.48 C ATOM 1829 CD2 TRP A 186 36.164 54.042 15.794 1.00 26.85 C ATOM 1830 NE1 TRP A 186 34.058 53.323 16.034 1.00 27.89 N ATOM 1831 CE2 TRP A 186 35.010 53.631 15.100 1.00 27.12 C ATOM 1832 CE3 TRP A 186 37.295 54.416 15.064 1.00 26.61 C ATOM 1833 CZ2 TRP A 186 34.948 53.594 13.706 1.00 26.44 C ATOM 1834 CZ3 TRP A 186 37.238 54.377 13.679 1.00 26.68 C ATOM 1835 CH2 TRP A 186 36.077 53.963 13.015 1.00 26.44 C ATOM 1836 HE1 TRP A 186 33.095 52.990 15.827 1.00 0.00 H ATOM 1837 H TRP A 186 37.214 51.185 17.787 1.00 0.00 H ATOM 1838 N LYS A 187 39.189 52.303 20.378 1.00 25.01 N ATOM 1839 CA LYS A 187 39.960 52.372 21.625 1.00 24.98 C ATOM 1840 C LYS A 187 41.480 52.388 21.393 1.00 23.44 C ATOM 1841 O LYS A 187 42.256 52.715 22.305 1.00 23.10 O ATOM 1842 CB LYS A 187 39.622 51.176 22.532 1.00 26.13 C ATOM 1843 CG LYS A 187 38.200 51.127 23.074 1.00 26.47 C ATOM 1844 CD LYS A 187 38.000 49.903 23.970 1.00 27.06 C ATOM 1845 CE LYS A 187 37.968 48.591 23.186 1.00 27.81 C ATOM 1846 NZ LYS A 187 38.511 47.422 23.939 1.00 28.41 N ATOM 1847 HZ1 LYS A 187 39.503 47.605 24.193 1.00 0.00 H ATOM 1848 HZ2 LYS A 187 37.951 47.278 24.804 1.00 0.00 H ATOM 1849 HZ3 LYS A 187 38.456 46.571 23.343 1.00 0.00 H ATOM 1850 H LYS A 187 39.112 51.390 19.886 1.00 0.00 H ATOM 1851 N THR A 188 41.920 52.023 20.193 1.00 21.42 N ATOM 1852 CA THR A 188 43.354 51.979 19.907 1.00 20.40 C ATOM 1853 C THR A 188 43.614 52.419 18.467 1.00 19.13 C ATOM 1854 O THR A 188 42.765 52.235 17.609 1.00 20.05 O ATOM 1855 CB THR A 188 43.954 50.574 20.174 1.00 21.38 C ATOM 1856 OG1 THR A 188 45.373 50.614 20.025 1.00 22.16 O ATOM 1857 CG2 THR A 188 43.387 49.507 19.240 1.00 21.61 C ATOM 1858 HG1 THR A 188 45.747 49.714 20.197 1.00 0.00 H ATOM 1859 H THR A 188 41.238 51.766 19.451 1.00 0.00 H ATOM 1860 N ASP A 189 44.774 53.023 18.232 1.00 18.69 N ATOM 1861 CA ASP A 189 45.093 53.619 16.922 1.00 18.83 C ATOM 1862 C ASP A 189 46.547 54.077 16.907 1.00 17.70 C ATOM 1863 O ASP A 189 47.177 54.195 17.956 1.00 17.47 O ATOM 1864 CB ASP A 189 44.200 54.847 16.696 1.00 19.70 C ATOM 1865 CG ASP A 189 44.086 55.249 15.229 1.00 20.69 C ATOM 1866 OD1 ASP A 189 44.709 54.595 14.366 1.00 20.24 O ATOM 1867 OD2 ASP A 189 43.373 56.248 14.959 1.00 22.13 O ATOM 1868 H ASP A 189 45.478 53.077 18.995 1.00 0.00 H ATOM 1869 N SER A 190 47.077 54.353 15.721 1.00 16.34 N ATOM 1870 CA SER A 190 48.316 55.095 15.622 1.00 16.91 C ATOM 1871 C SER A 190 48.003 56.563 15.907 1.00 17.57 C ATOM 1872 O SER A 190 46.844 56.997 15.882 1.00 18.12 O ATOM 1873 CB SER A 190 48.949 54.928 14.240 1.00 17.10 C ATOM 1874 OG SER A 190 47.963 55.085 13.248 1.00 17.24 O ATOM 1875 HG SER A 190 47.259 54.401 13.373 1.00 0.00 H ATOM 1876 H SER A 190 46.597 54.033 14.855 1.00 0.00 H ATOM 1877 N CYS A 191 49.043 57.324 16.193 1.00 18.05 N ATOM 1878 CA CYS A 191 48.890 58.730 16.498 1.00 19.53 C ATOM 1879 C CYS A 191 50.105 59.512 16.012 1.00 18.33 C ATOM 1880 O CYS A 191 51.004 58.942 15.397 1.00 16.54 O ATOM 1881 CB CYS A 191 48.680 58.924 18.007 1.00 22.28 C ATOM 1882 SG CYS A 191 47.875 60.507 18.373 1.00 26.98 S ATOM 1883 H CYS A 191 49.994 56.903 16.199 1.00 0.00 H ATOM 1884 N GLN A 192 50.125 60.819 16.273 1.00 17.87 N ATOM 1885 CA GLN A 192 51.263 61.648 15.884 1.00 18.02 C ATOM 1886 C GLN A 192 52.584 61.058 16.381 1.00 16.97 C ATOM 1887 O GLN A 192 52.722 60.710 17.566 1.00 16.08 O ATOM 1888 CB GLN A 192 51.106 63.063 16.404 1.00 19.64 C ATOM 1889 CG GLN A 192 52.154 64.007 15.860 1.00 21.38 C ATOM 1890 CD GLN A 192 52.120 65.340 16.558 1.00 23.65 C ATOM 1891 OE1 GLN A 192 53.091 65.755 17.178 1.00 27.29 O ATOM 1892 NE2 GLN A 192 50.997 66.010 16.469 1.00 24.52 N ATOM 1893 HE22 GLN A 192 50.198 65.617 15.931 1.00 0.00 H ATOM 1894 HE21 GLN A 192 50.905 66.934 16.936 1.00 0.00 H ATOM 1895 H GLN A 192 49.317 61.256 16.762 1.00 0.00 H ATOM 1896 N GLY A 193 53.545 60.922 15.464 1.00 15.71 N ATOM 1897 CA GLY A 193 54.850 60.328 15.782 1.00 15.15 C ATOM 1898 C GLY A 193 54.983 58.880 15.318 1.00 14.56 C ATOM 1899 O GLY A 193 56.092 58.363 15.224 1.00 14.30 O ATOM 1900 H GLY A 193 53.363 61.247 14.493 1.00 0.00 H ATOM 1901 N ASP A 194 53.851 58.241 15.012 1.00 14.33 N ATOM 1902 CA ASP A 194 53.815 56.882 14.471 1.00 14.08 C ATOM 1903 C ASP A 194 53.892 56.904 12.943 1.00 14.51 C ATOM 1904 O ASP A 194 54.102 55.865 12.323 1.00 14.34 O ATOM 1905 CB ASP A 194 52.541 56.171 14.906 1.00 14.38 C ATOM 1906 CG ASP A 194 52.525 55.863 16.400 1.00 14.68 C ATOM 1907 OD1 ASP A 194 53.585 55.469 16.919 1.00 15.63 O ATOM 1908 OD2 ASP A 194 51.461 56.002 17.038 1.00 14.58 O ATOM 1909 H ASP A 194 52.949 58.735 15.166 1.00 0.00 H ATOM 1910 N SER A 195 53.722 58.076 12.345 1.00 15.14 N ATOM 1911 CA SER A 195 53.851 58.177 10.879 1.00 15.33 C ATOM 1912 C SER A 195 55.139 57.564 10.371 1.00 15.31 C ATOM 1913 O SER A 195 56.184 57.615 11.024 1.00 14.61 O ATOM 1914 CB SER A 195 53.769 59.613 10.408 1.00 16.12 C ATOM 1915 OG SER A 195 52.456 60.117 10.581 1.00 17.04 O ATOM 1916 HG SER A 195 52.420 61.056 10.268 1.00 0.00 H ATOM 1917 H SER A 195 53.498 58.921 12.908 1.00 0.00 H ATOM 1918 N GLY A 196 55.068 56.997 9.164 1.00 15.24 N ATOM 1919 CA GLY A 196 56.209 56.390 8.541 1.00 14.84 C ATOM 1920 C GLY A 196 56.406 54.947 8.931 1.00 15.18 C ATOM 1921 O GLY A 196 57.049 54.183 8.213 1.00 15.47 O ATOM 1922 H GLY A 196 54.158 56.995 8.660 1.00 0.00 H ATOM 1923 N GLY A 197 55.880 54.569 10.090 1.00 15.69 N ATOM 1924 CA GLY A 197 56.030 53.229 10.579 1.00 15.83 C ATOM 1925 C GLY A 197 55.137 52.208 9.892 1.00 15.86 C ATOM 1926 O GLY A 197 54.270 52.557 9.091 1.00 14.96 O ATOM 1927 H GLY A 197 55.347 55.260 10.656 1.00 0.00 H ATOM 1928 N PRO A 198 55.354 50.928 10.215 1.00 16.15 N ATOM 1929 CA PRO A 198 54.745 49.804 9.516 1.00 17.05 C ATOM 1930 C PRO A 198 53.321 49.470 9.925 1.00 17.53 C ATOM 1931 O PRO A 198 52.979 49.529 11.108 1.00 17.83 O ATOM 1932 CB PRO A 198 55.666 48.640 9.886 1.00 16.93 C ATOM 1933 CG PRO A 198 56.142 48.986 11.260 1.00 16.88 C ATOM 1934 CD PRO A 198 56.340 50.479 11.215 1.00 16.86 C ATOM 1935 N LEU A 199 52.499 49.128 8.937 1.00 17.24 N ATOM 1936 CA LEU A 199 51.290 48.345 9.165 1.00 17.94 C ATOM 1937 C LEU A 199 51.608 46.946 8.596 1.00 17.93 C ATOM 1938 O LEU A 199 51.856 46.787 7.393 1.00 16.45 O ATOM 1939 CB LEU A 199 50.076 48.983 8.488 1.00 18.83 C ATOM 1940 CG LEU A 199 48.724 48.251 8.497 1.00 20.40 C ATOM 1941 CD1 LEU A 199 48.093 48.239 9.880 1.00 21.63 C ATOM 1942 CD2 LEU A 199 47.762 48.904 7.523 1.00 21.79 C ATOM 1943 H LEU A 199 52.726 49.429 7.968 1.00 0.00 H ATOM 1944 N VAL A 200 51.641 45.956 9.478 1.00 17.20 N ATOM 1945 CA VAL A 200 52.136 44.608 9.140 1.00 18.53 C ATOM 1946 C VAL A 200 50.986 43.623 9.232 1.00 19.71 C ATOM 1947 O VAL A 200 50.312 43.557 10.251 1.00 18.31 O ATOM 1948 CB VAL A 200 53.231 44.143 10.125 1.00 18.91 C ATOM 1949 CG1 VAL A 200 53.711 42.728 9.803 1.00 19.80 C ATOM 1950 CG2 VAL A 200 54.409 45.099 10.096 1.00 20.12 C ATOM 1951 H VAL A 200 51.305 46.137 10.445 1.00 0.00 H ATOM 1952 N CYS A 201 50.774 42.852 8.175 1.00 21.71 N ATOM 1953 CA CYS A 201 49.728 41.828 8.169 1.00 25.16 C ATOM 1954 C CYS A 201 50.366 40.498 7.777 1.00 28.91 C ATOM 1955 O CYS A 201 51.352 40.474 7.044 1.00 27.22 O ATOM 1956 CB CYS A 201 48.593 42.189 7.198 1.00 25.83 C ATOM 1957 SG CYS A 201 47.935 43.879 7.313 1.00 26.96 S ATOM 1958 H CYS A 201 51.365 42.978 7.329 1.00 0.00 H ATOM 1959 N SER A 202 49.817 39.401 8.291 1.00 34.31 N ATOM 1960 CA SER A 202 50.271 38.066 7.908 1.00 40.62 C ATOM 1961 C SER A 202 49.562 37.670 6.623 1.00 43.41 C ATOM 1962 O SER A 202 48.361 37.402 6.629 1.00 45.94 O ATOM 1963 CB SER A 202 49.994 37.039 9.013 1.00 42.73 C ATOM 1964 OG SER A 202 50.704 35.829 8.768 1.00 46.46 O ATOM 1965 HG SER A 202 50.511 35.182 9.492 1.00 0.00 H ATOM 1966 H SER A 202 49.046 39.496 8.982 1.00 0.00 H ATOM 1967 N LEU A 203 50.311 37.673 5.522 1.00 47.45 N ATOM 1968 CA LEU A 203 49.813 37.265 4.210 1.00 51.41 C ATOM 1969 C LEU A 203 50.478 35.955 3.825 1.00 54.11 C ATOM 1970 O LEU A 203 51.703 35.895 3.683 1.00 53.88 O ATOM 1971 CB LEU A 203 50.136 38.322 3.149 1.00 53.42 C ATOM 1972 CG LEU A 203 49.087 39.376 2.793 1.00 55.17 C ATOM 1973 CD1 LEU A 203 49.686 40.383 1.819 1.00 55.94 C ATOM 1974 CD2 LEU A 203 47.838 38.744 2.190 1.00 56.12 C ATOM 1975 H LEU A 203 51.301 37.982 5.600 1.00 0.00 H ATOM 1976 N GLN A 204 49.673 34.903 3.675 1.00 56.36 N ATOM 1977 CA GLN A 204 50.178 33.583 3.299 1.00 55.97 C ATOM 1978 C GLN A 204 51.196 33.091 4.336 1.00 54.99 C ATOM 1979 O GLN A 204 52.246 32.548 3.986 1.00 55.48 O ATOM 1980 CB GLN A 204 50.795 33.615 1.886 1.00 56.88 C ATOM 1981 CG GLN A 204 49.797 33.493 0.742 1.00 58.94 C ATOM 1982 CD GLN A 204 49.156 34.812 0.346 1.00 60.64 C ATOM 1983 OE1 GLN A 204 49.483 35.388 -0.695 1.00 60.85 O ATOM 1984 NE2 GLN A 204 48.224 35.289 1.164 1.00 62.10 N ATOM 1985 HE22 GLN A 204 47.979 34.771 2.032 1.00 0.00 H ATOM 1986 HE21 GLN A 204 47.739 36.181 0.937 1.00 0.00 H ATOM 1987 H GLN A 204 48.652 35.025 3.831 1.00 0.00 H ATOM 1988 N GLY A 205 50.885 33.309 5.615 1.00 52.42 N ATOM 1989 CA GLY A 205 51.795 32.965 6.711 1.00 50.88 C ATOM 1990 C GLY A 205 53.057 33.820 6.774 1.00 50.17 C ATOM 1991 O GLY A 205 53.861 33.675 7.701 1.00 49.06 O ATOM 1992 H GLY A 205 49.965 33.738 5.842 1.00 0.00 H ATOM 1993 N ARG A 206 53.227 34.711 5.793 1.00 46.96 N ATOM 1994 CA ARG A 206 54.399 35.575 5.694 1.00 42.32 C ATOM 1995 C ARG A 206 54.017 36.946 6.251 1.00 39.05 C ATOM 1996 O ARG A 206 53.037 37.546 5.803 1.00 36.41 O ATOM 1997 CB ARG A 206 54.834 35.707 4.226 1.00 42.78 C ATOM 1998 CG ARG A 206 56.331 35.878 4.007 1.00 43.49 C ATOM 1999 CD ARG A 206 56.664 35.970 2.522 1.00 43.47 C ATOM 2000 NE ARG A 206 57.805 35.131 2.161 1.00 44.20 N ATOM 2001 CZ ARG A 206 58.069 34.716 0.925 1.00 44.70 C ATOM 2002 NH1 ARG A 206 57.275 35.057 -0.082 1.00 44.48 N ATOM 2003 NH2 ARG A 206 59.126 33.950 0.696 1.00 45.13 N ATOM 2004 HE ARG A 206 58.453 34.839 2.920 1.00 0.00 H ATOM 2005 HH12 ARG A 206 57.487 34.729 -1.046 1.00 0.00 H ATOM 2006 HH11 ARG A 206 56.440 35.652 0.093 1.00 0.00 H ATOM 2007 HH22 ARG A 206 59.333 33.625 -0.270 1.00 0.00 H ATOM 2008 HH21 ARG A 206 59.748 33.674 1.482 1.00 0.00 H ATOM 2009 H ARG A 206 52.489 34.793 5.065 1.00 0.00 H ATOM 2010 N MET A 207 54.775 37.426 7.231 1.00 35.23 N ATOM 2011 CA MET A 207 54.593 38.781 7.751 1.00 34.58 C ATOM 2012 C MET A 207 54.979 39.765 6.651 1.00 29.38 C ATOM 2013 O MET A 207 56.089 39.705 6.126 1.00 29.90 O ATOM 2014 CB MET A 207 55.457 38.994 8.991 1.00 36.38 C ATOM 2015 CG MET A 207 55.019 38.157 10.181 1.00 40.82 C ATOM 2016 SD MET A 207 53.695 38.948 11.112 1.00 44.92 S ATOM 2017 CE MET A 207 54.661 39.885 12.282 1.00 44.77 C ATOM 2018 H MET A 207 55.517 36.822 7.639 1.00 0.00 H ATOM 2019 N THR A 208 54.062 40.659 6.294 1.00 25.70 N ATOM 2020 CA THR A 208 54.257 41.534 5.136 1.00 23.85 C ATOM 2021 C THR A 208 53.940 42.999 5.435 1.00 22.02 C ATOM 2022 O THR A 208 53.002 43.294 6.171 1.00 20.64 O ATOM 2023 CB THR A 208 53.369 41.063 3.977 1.00 25.03 C ATOM 2024 OG1 THR A 208 53.595 39.669 3.757 1.00 26.62 O ATOM 2025 CG2 THR A 208 53.667 41.823 2.704 1.00 25.42 C ATOM 2026 HG1 THR A 208 53.368 39.165 4.579 1.00 0.00 H ATOM 2027 H THR A 208 53.186 40.739 6.850 1.00 0.00 H ATOM 2028 N LEU A 209 54.735 43.905 4.858 1.00 20.36 N ATOM 2029 CA LEU A 209 54.516 45.337 5.014 1.00 20.06 C ATOM 2030 C LEU A 209 53.376 45.765 4.116 1.00 20.40 C ATOM 2031 O LEU A 209 53.573 46.014 2.932 1.00 21.85 O ATOM 2032 CB LEU A 209 55.792 46.134 4.654 1.00 19.59 C ATOM 2033 CG LEU A 209 55.698 47.648 4.861 1.00 19.54 C ATOM 2034 CD1 LEU A 209 55.611 47.959 6.352 1.00 19.68 C ATOM 2035 CD2 LEU A 209 56.896 48.361 4.278 1.00 19.15 C ATOM 2036 H LEU A 209 55.535 43.578 4.280 1.00 0.00 H ATOM 2037 N THR A 210 52.180 45.844 4.671 1.00 19.92 N ATOM 2038 CA THR A 210 50.996 46.139 3.886 1.00 20.69 C ATOM 2039 C THR A 210 50.793 47.651 3.740 1.00 19.69 C ATOM 2040 O THR A 210 50.357 48.138 2.694 1.00 18.28 O ATOM 2041 CB THR A 210 49.789 45.456 4.550 1.00 22.23 C ATOM 2042 OG1 THR A 210 49.957 44.035 4.432 1.00 25.08 O ATOM 2043 CG2 THR A 210 48.477 45.863 3.942 1.00 23.21 C ATOM 2044 HG1 THR A 210 50.004 43.788 3.475 1.00 0.00 H ATOM 2045 H THR A 210 52.085 45.691 5.695 1.00 0.00 H ATOM 2046 N GLY A 211 51.123 48.391 4.797 1.00 17.52 N ATOM 2047 CA GLY A 211 50.895 49.822 4.804 1.00 17.21 C ATOM 2048 C GLY A 211 51.956 50.608 5.546 1.00 16.51 C ATOM 2049 O GLY A 211 52.750 50.047 6.299 1.00 15.74 O ATOM 2050 H GLY A 211 51.550 47.936 5.629 1.00 0.00 H ATOM 2051 N ILE A 212 51.935 51.919 5.320 1.00 16.34 N ATOM 2052 CA ILE A 212 52.809 52.878 5.994 1.00 15.91 C ATOM 2053 C ILE A 212 51.910 53.913 6.652 1.00 14.92 C ATOM 2054 O ILE A 212 51.056 54.505 6.013 1.00 14.34 O ATOM 2055 CB ILE A 212 53.781 53.553 4.994 1.00 16.36 C ATOM 2056 CG1 ILE A 212 54.762 52.534 4.441 1.00 17.07 C ATOM 2057 CG2 ILE A 212 54.563 54.696 5.649 1.00 16.54 C ATOM 2058 CD1 ILE A 212 55.318 52.929 3.085 1.00 17.71 C ATOM 2059 H ILE A 212 51.256 52.284 4.622 1.00 0.00 H ATOM 2060 N VAL A 213 52.085 54.139 7.948 1.00 14.17 N ATOM 2061 CA VAL A 213 51.273 55.110 8.628 1.00 13.89 C ATOM 2062 C VAL A 213 51.373 56.486 7.941 1.00 14.19 C ATOM 2063 O VAL A 213 52.462 57.046 7.815 1.00 14.35 O ATOM 2064 CB VAL A 213 51.716 55.270 10.103 1.00 14.13 C ATOM 2065 CG1 VAL A 213 50.781 56.227 10.814 1.00 14.03 C ATOM 2066 CG2 VAL A 213 51.761 53.934 10.824 1.00 14.26 C ATOM 2067 H VAL A 213 52.812 53.612 8.473 1.00 0.00 H ATOM 2068 N SER A 214 50.237 57.045 7.544 1.00 13.90 N ATOM 2069 CA SER A 214 50.234 58.250 6.731 1.00 14.60 C ATOM 2070 C SER A 214 49.454 59.414 7.330 1.00 14.60 C ATOM 2071 O SER A 214 50.019 60.491 7.545 1.00 15.91 O ATOM 2072 CB SER A 214 49.756 57.917 5.316 1.00 14.11 C ATOM 2073 OG SER A 214 49.717 59.090 4.527 1.00 14.67 O ATOM 2074 HG SER A 214 50.624 59.485 4.480 1.00 0.00 H ATOM 2075 H SER A 214 49.332 56.613 7.820 1.00 0.00 H ATOM 2076 N TRP A 215 48.171 59.212 7.602 1.00 14.73 N ATOM 2077 CA TRP A 215 47.327 60.287 8.117 1.00 15.63 C ATOM 2078 C TRP A 215 46.100 59.805 8.863 1.00 16.20 C ATOM 2079 O TRP A 215 45.840 58.598 8.957 1.00 15.54 O ATOM 2080 CB TRP A 215 46.943 61.278 6.982 1.00 15.63 C ATOM 2081 CG TRP A 215 46.107 60.748 5.831 1.00 15.99 C ATOM 2082 CD1 TRP A 215 46.562 60.128 4.697 1.00 16.19 C ATOM 2083 CD2 TRP A 215 44.686 60.882 5.662 1.00 15.63 C ATOM 2084 NE1 TRP A 215 45.521 59.859 3.857 1.00 16.00 N ATOM 2085 CE2 TRP A 215 44.357 60.306 4.422 1.00 15.56 C ATOM 2086 CE3 TRP A 215 43.664 61.445 6.437 1.00 15.88 C ATOM 2087 CZ2 TRP A 215 43.046 60.241 3.955 1.00 16.08 C ATOM 2088 CZ3 TRP A 215 42.367 61.384 5.985 1.00 15.71 C ATOM 2089 CH2 TRP A 215 42.061 60.794 4.737 1.00 15.88 C ATOM 2090 HE1 TRP A 215 45.599 59.388 2.933 1.00 0.00 H ATOM 2091 H TRP A 215 47.759 58.270 7.445 1.00 0.00 H ATOM 2092 N GLY A 216 45.378 60.769 9.427 1.00 17.10 N ATOM 2093 CA GLY A 216 44.082 60.539 10.036 1.00 17.80 C ATOM 2094 C GLY A 216 43.663 61.731 10.876 1.00 18.47 C ATOM 2095 O GLY A 216 44.503 62.504 11.342 1.00 19.56 O ATOM 2096 H GLY A 216 45.762 61.736 9.432 1.00 0.00 H ATOM 2097 N ARG A 217 42.359 61.892 11.044 1.00 19.82 N ATOM 2098 CA ARG A 217 41.810 62.958 11.865 1.00 21.11 C ATOM 2099 C ARG A 217 41.827 62.507 13.316 1.00 20.86 C ATOM 2100 O ARG A 217 41.195 61.518 13.638 1.00 21.32 O ATOM 2101 CB ARG A 217 40.369 63.243 11.449 1.00 23.12 C ATOM 2102 CG ARG A 217 39.611 64.144 12.408 1.00 25.77 C ATOM 2103 CD ARG A 217 39.913 65.606 12.191 1.00 28.55 C ATOM 2104 NE ARG A 217 39.048 66.450 13.014 1.00 30.00 N ATOM 2105 CZ ARG A 217 37.750 66.656 12.801 1.00 31.14 C ATOM 2106 NH1 ARG A 217 37.077 67.445 13.621 1.00 32.33 N ATOM 2107 NH2 ARG A 217 37.112 66.086 11.783 1.00 32.49 N ATOM 2108 HE ARG A 217 39.481 66.927 13.830 1.00 0.00 H ATOM 2109 HH12 ARG A 217 36.063 67.613 13.465 1.00 0.00 H ATOM 2110 HH11 ARG A 217 37.562 67.897 14.422 1.00 0.00 H ATOM 2111 HH22 ARG A 217 36.097 66.264 11.640 1.00 0.00 H ATOM 2112 HH21 ARG A 217 37.628 65.462 11.130 1.00 0.00 H ATOM 2113 H ARG A 217 41.706 61.234 10.573 1.00 0.00 H ATOM 2114 N GLY A 218 42.516 63.252 14.173 1.00 21.18 N ATOM 2115 CA GLY A 218 42.638 62.902 15.589 1.00 22.23 C ATOM 2116 C GLY A 218 43.353 61.570 15.744 1.00 23.01 C ATOM 2117 O GLY A 218 44.040 61.114 14.829 1.00 21.10 O ATOM 2118 H GLY A 218 42.985 64.113 13.826 1.00 0.00 H ATOM 2119 N CYS A 220 43.187 60.939 16.903 1.00 23.42 N ATOM 2120 CA CYS A 220 43.691 59.583 17.115 1.00 24.88 C ATOM 2121 C CYS A 220 42.692 58.802 17.951 1.00 23.54 C ATOM 2122 O CYS A 220 42.279 59.268 19.020 1.00 22.07 O ATOM 2123 CB CYS A 220 45.044 59.589 17.828 1.00 25.98 C ATOM 2124 SG CYS A 220 46.306 60.628 17.060 1.00 30.18 S ATOM 2125 H CYS A 220 42.687 61.422 17.677 1.00 0.00 H ATOM 2126 N ALA A 221 42.309 57.628 17.455 1.00 22.68 N ATOM 2127 CA ALA A 221 41.262 56.813 18.062 1.00 22.91 C ATOM 2128 C ALA A 221 39.958 57.607 18.187 1.00 23.31 C ATOM 2129 O ALA A 221 39.279 57.544 19.213 1.00 23.33 O ATOM 2130 CB ALA A 221 41.712 56.294 19.432 1.00 23.55 C ATOM 2131 H ALA A 221 42.777 57.275 16.596 1.00 0.00 H ATOM 2132 N LEU A 222 39.621 58.374 17.153 1.00 22.14 N ATOM 2133 CA LEU A 222 38.388 59.143 17.160 1.00 22.49 C ATOM 2134 C LEU A 222 37.337 58.330 16.429 1.00 22.25 C ATOM 2135 O LEU A 222 37.610 57.765 15.345 1.00 22.02 O ATOM 2136 CB LEU A 222 38.603 60.508 16.504 1.00 22.92 C ATOM 2137 CG LEU A 222 37.528 61.578 16.676 1.00 22.89 C ATOM 2138 CD1 LEU A 222 37.332 61.948 18.139 1.00 22.84 C ATOM 2139 CD2 LEU A 222 37.923 62.809 15.879 1.00 23.34 C ATOM 2140 H LEU A 222 40.250 58.424 16.326 1.00 0.00 H ATOM 2141 N LYS A 223 36.140 58.259 17.010 1.00 22.54 N ATOM 2142 CA LYS A 223 35.031 57.536 16.385 1.00 23.19 C ATOM 2143 C LYS A 223 34.836 57.955 14.922 1.00 22.12 C ATOM 2144 O LYS A 223 34.804 59.138 14.611 1.00 22.74 O ATOM 2145 CB LYS A 223 33.727 57.753 17.149 1.00 25.24 C ATOM 2146 CG LYS A 223 32.631 56.775 16.770 1.00 27.53 C ATOM 2147 CD LYS A 223 31.293 57.157 17.388 1.00 29.35 C ATOM 2148 CE LYS A 223 30.162 56.265 16.896 1.00 29.35 C ATOM 2149 NZ LYS A 223 30.255 54.890 17.462 1.00 30.34 N ATOM 2150 HZ1 LYS A 223 31.158 54.460 17.178 1.00 0.00 H ATOM 2151 HZ2 LYS A 223 30.205 54.939 18.500 1.00 0.00 H ATOM 2152 HZ3 LYS A 223 29.467 54.314 17.103 1.00 0.00 H ATOM 2153 H LYS A 223 35.990 58.727 17.927 1.00 0.00 H ATOM 2154 N ASP A 223A 34.732 56.958 14.059 1.00 21.66 N ATOM 2155 CA ASP A 223A 34.520 57.111 12.609 1.00 22.43 C ATOM 2156 C ASP A 223A 35.660 57.777 11.837 1.00 21.97 C ATOM 2157 O ASP A 223A 35.472 58.182 10.684 1.00 22.14 O ATOM 2158 CB ASP A 223A 33.190 57.814 12.324 1.00 24.48 C ATOM 2159 CG ASP A 223A 32.006 57.027 12.825 1.00 25.64 C ATOM 2160 OD1 ASP A 223A 32.111 55.791 12.906 1.00 27.50 O ATOM 2161 OD2 ASP A 223A 30.965 57.643 13.114 1.00 28.67 O ATOM 2162 H ASP A 223A 34.806 55.990 14.433 1.00 0.00 H ATOM 2163 N LYS A 224 36.842 57.837 12.444 1.00 20.38 N ATOM 2164 CA LYS A 224 38.019 58.414 11.813 1.00 19.99 C ATOM 2165 C LYS A 224 39.180 57.411 11.878 1.00 19.67 C ATOM 2166 O LYS A 224 40.036 57.506 12.751 1.00 20.46 O ATOM 2167 CB LYS A 224 38.377 59.730 12.487 1.00 19.95 C ATOM 2168 CG LYS A 224 37.221 60.735 12.559 1.00 20.71 C ATOM 2169 CD LYS A 224 36.763 61.183 11.182 1.00 21.14 C ATOM 2170 CE LYS A 224 35.428 61.929 11.240 1.00 21.87 C ATOM 2171 NZ LYS A 224 34.995 62.292 9.865 1.00 22.60 N ATOM 2172 HZ1 LYS A 224 35.713 62.904 9.427 1.00 0.00 H ATOM 2173 HZ2 LYS A 224 34.882 61.427 9.299 1.00 0.00 H ATOM 2174 HZ3 LYS A 224 34.088 62.798 9.911 1.00 0.00 H ATOM 2175 H LYS A 224 36.928 57.456 13.408 1.00 0.00 H ATOM 2176 N PRO A 225 39.207 56.443 10.944 1.00 18.41 N ATOM 2177 CA PRO A 225 40.308 55.477 10.899 1.00 17.81 C ATOM 2178 C PRO A 225 41.684 56.087 10.671 1.00 16.16 C ATOM 2179 O PRO A 225 41.807 57.228 10.205 1.00 15.38 O ATOM 2180 CB PRO A 225 39.951 54.587 9.698 1.00 17.83 C ATOM 2181 CG PRO A 225 38.482 54.729 9.559 1.00 18.86 C ATOM 2182 CD PRO A 225 38.188 56.149 9.927 1.00 18.78 C ATOM 2183 N GLY A 226 42.715 55.302 11.000 1.00 14.84 N ATOM 2184 CA GLY A 226 44.057 55.580 10.561 1.00 13.96 C ATOM 2185 C GLY A 226 44.090 55.316 9.064 1.00 14.13 C ATOM 2186 O GLY A 226 43.424 54.398 8.587 1.00 13.65 O ATOM 2187 H GLY A 226 42.542 54.464 11.592 1.00 0.00 H ATOM 2188 N VAL A 227 44.838 56.135 8.340 1.00 13.59 N ATOM 2189 CA VAL A 227 44.978 55.968 6.895 1.00 14.19 C ATOM 2190 C VAL A 227 46.445 55.670 6.576 1.00 14.86 C ATOM 2191 O VAL A 227 47.355 56.347 7.076 1.00 14.41 O ATOM 2192 CB VAL A 227 44.477 57.199 6.118 1.00 14.51 C ATOM 2193 CG1 VAL A 227 44.450 56.873 4.637 1.00 14.88 C ATOM 2194 CG2 VAL A 227 43.092 57.624 6.596 1.00 14.86 C ATOM 2195 H VAL A 227 45.338 56.916 8.811 1.00 0.00 H ATOM 2196 N TYR A 228 46.655 54.661 5.724 1.00 14.78 N ATOM 2197 CA TYR A 228 47.950 54.060 5.482 1.00 15.19 C ATOM 2198 C TYR A 228 48.202 54.062 3.999 1.00 16.13 C ATOM 2199 O TYR A 228 47.277 53.873 3.229 1.00 16.74 O ATOM 2200 CB TYR A 228 47.990 52.622 6.003 1.00 15.30 C ATOM 2201 CG TYR A 228 47.768 52.598 7.495 1.00 15.80 C ATOM 2202 CD1 TYR A 228 46.499 52.747 8.026 1.00 16.31 C ATOM 2203 CD2 TYR A 228 48.828 52.475 8.361 1.00 16.32 C ATOM 2204 CE1 TYR A 228 46.294 52.764 9.406 1.00 16.73 C ATOM 2205 CE2 TYR A 228 48.634 52.498 9.735 1.00 16.29 C ATOM 2206 CZ TYR A 228 47.377 52.638 10.249 1.00 16.61 C ATOM 2207 OH TYR A 228 47.217 52.673 11.633 1.00 19.07 O ATOM 2208 HH TYR A 228 46.257 52.778 11.850 1.00 0.00 H ATOM 2209 H TYR A 228 45.838 54.285 5.203 1.00 0.00 H ATOM 2210 N THR A 229 49.440 54.299 3.619 1.00 16.66 N ATOM 2211 CA THR A 229 49.829 54.215 2.209 1.00 17.27 C ATOM 2212 C THR A 229 49.785 52.743 1.824 1.00 18.42 C ATOM 2213 O THR A 229 50.297 51.903 2.555 1.00 18.84 O ATOM 2214 CB THR A 229 51.227 54.808 1.988 1.00 17.02 C ATOM 2215 OG1 THR A 229 51.207 56.168 2.413 1.00 17.28 O ATOM 2216 CG2 THR A 229 51.634 54.750 0.509 1.00 18.18 C ATOM 2217 HG1 THR A 229 52.102 56.568 2.278 1.00 0.00 H ATOM 2218 H THR A 229 50.154 54.550 4.332 1.00 0.00 H ATOM 2219 N ARG A 230 49.137 52.435 0.698 1.00 19.34 N ATOM 2220 CA ARG A 230 48.955 51.048 0.261 1.00 21.36 C ATOM 2221 C ARG A 230 50.195 50.600 -0.488 1.00 21.09 C ATOM 2222 O ARG A 230 50.335 50.846 -1.703 1.00 20.86 O ATOM 2223 CB ARG A 230 47.692 50.914 -0.613 1.00 23.65 C ATOM 2224 CG ARG A 230 47.412 49.498 -1.109 1.00 25.89 C ATOM 2225 CD ARG A 230 46.065 49.365 -1.818 1.00 28.32 C ATOM 2226 NE ARG A 230 45.965 50.044 -3.116 1.00 31.03 N ATOM 2227 CZ ARG A 230 46.427 49.578 -4.285 1.00 33.00 C ATOM 2228 NH1 ARG A 230 46.247 50.292 -5.394 1.00 33.79 N ATOM 2229 NH2 ARG A 230 47.094 48.429 -4.361 1.00 33.91 N ATOM 2230 HE ARG A 230 45.493 50.971 -3.130 1.00 0.00 H ATOM 2231 HH12 ARG A 230 46.603 49.937 -6.305 1.00 0.00 H ATOM 2232 HH11 ARG A 230 45.751 51.205 -5.350 1.00 0.00 H ATOM 2233 HH22 ARG A 230 47.442 48.090 -5.280 1.00 0.00 H ATOM 2234 HH21 ARG A 230 47.267 47.870 -3.501 1.00 0.00 H ATOM 2235 H ARG A 230 48.750 53.203 0.113 1.00 0.00 H ATOM 2236 N VAL A 231 51.091 49.932 0.232 1.00 20.49 N ATOM 2237 CA VAL A 231 52.430 49.624 -0.268 1.00 21.14 C ATOM 2238 C VAL A 231 52.377 48.849 -1.587 1.00 22.62 C ATOM 2239 O VAL A 231 53.192 49.098 -2.474 1.00 22.60 O ATOM 2240 CB VAL A 231 53.245 48.837 0.759 1.00 21.21 C ATOM 2241 CG1 VAL A 231 54.586 48.385 0.192 1.00 21.58 C ATOM 2242 CG2 VAL A 231 53.470 49.694 1.997 1.00 20.67 C ATOM 2243 H VAL A 231 50.829 49.616 1.188 1.00 0.00 H ATOM 2244 N SER A 232 51.407 47.944 -1.707 1.00 23.19 N ATOM 2245 CA SER A 232 51.277 47.108 -2.909 1.00 26.02 C ATOM 2246 C SER A 232 51.068 47.919 -4.198 1.00 27.62 C ATOM 2247 O SER A 232 51.418 47.447 -5.287 1.00 31.75 O ATOM 2248 CB SER A 232 50.156 46.084 -2.731 1.00 26.62 C ATOM 2249 OG SER A 232 48.884 46.694 -2.683 1.00 27.60 O ATOM 2250 HG SER A 232 48.190 45.998 -2.567 1.00 0.00 H ATOM 2251 H SER A 232 50.725 47.826 -0.931 1.00 0.00 H ATOM 2252 N HIS A 233 50.503 49.119 -4.091 1.00 27.61 N ATOM 2253 CA HIS A 233 50.380 49.998 -5.253 1.00 29.66 C ATOM 2254 C HIS A 233 51.700 50.598 -5.715 1.00 28.00 C ATOM 2255 O HIS A 233 51.843 50.932 -6.890 1.00 30.73 O ATOM 2256 CB HIS A 233 49.407 51.150 -5.006 1.00 31.78 C ATOM 2257 CG HIS A 233 49.261 52.056 -6.191 1.00 35.59 C ATOM 2258 ND1 HIS A 233 50.030 53.189 -6.360 1.00 38.16 N ATOM 2259 CD2 HIS A 233 48.482 51.963 -7.297 1.00 35.95 C ATOM 2260 CE1 HIS A 233 49.709 53.771 -7.503 1.00 36.56 C ATOM 2261 NE2 HIS A 233 48.771 53.047 -8.089 1.00 37.90 N ATOM 2262 H HIS A 233 50.144 49.436 -3.168 1.00 0.00 H ATOM 2263 N PHE A 234 52.656 50.750 -4.806 1.00 24.70 N ATOM 2264 CA PHE A 234 53.892 51.464 -5.104 1.00 23.38 C ATOM 2265 C PHE A 234 55.087 50.579 -5.448 1.00 23.67 C ATOM 2266 O PHE A 234 56.219 51.049 -5.471 1.00 24.53 O ATOM 2267 CB PHE A 234 54.225 52.384 -3.930 1.00 22.01 C ATOM 2268 CG PHE A 234 53.234 53.480 -3.755 1.00 20.72 C ATOM 2269 CD1 PHE A 234 52.065 53.269 -3.044 1.00 20.37 C ATOM 2270 CD2 PHE A 234 53.438 54.706 -4.344 1.00 20.22 C ATOM 2271 CE1 PHE A 234 51.130 54.280 -2.901 1.00 20.50 C ATOM 2272 CE2 PHE A 234 52.508 55.719 -4.205 1.00 20.24 C ATOM 2273 CZ PHE A 234 51.349 55.509 -3.493 1.00 20.13 C ATOM 2274 H PHE A 234 52.520 50.349 -3.856 1.00 0.00 H ATOM 2275 N LEU A 235 54.845 49.307 -5.747 1.00 25.07 N ATOM 2276 CA LEU A 235 55.953 48.392 -6.009 1.00 26.55 C ATOM 2277 C LEU A 235 56.796 48.825 -7.211 1.00 26.28 C ATOM 2278 O LEU A 235 58.018 48.774 -7.144 1.00 27.23 O ATOM 2279 CB LEU A 235 55.451 46.960 -6.172 1.00 27.90 C ATOM 2280 CG LEU A 235 54.886 46.350 -4.887 1.00 29.15 C ATOM 2281 CD1 LEU A 235 54.027 45.151 -5.238 1.00 30.33 C ATOM 2282 CD2 LEU A 235 55.977 45.965 -3.900 1.00 29.51 C ATOM 2283 H LEU A 235 53.865 48.962 -5.795 1.00 0.00 H ATOM 2284 N PRO A 236 56.155 49.271 -8.306 1.00 27.43 N ATOM 2285 CA PRO A 236 56.977 49.749 -9.423 1.00 27.78 C ATOM 2286 C PRO A 236 57.876 50.922 -9.021 1.00 27.51 C ATOM 2287 O PRO A 236 59.052 50.960 -9.403 1.00 26.61 O ATOM 2288 CB PRO A 236 55.940 50.181 -10.468 1.00 27.77 C ATOM 2289 CG PRO A 236 54.726 49.381 -10.147 1.00 27.92 C ATOM 2290 CD PRO A 236 54.721 49.279 -8.641 1.00 27.52 C ATOM 2291 N TRP A 237 57.337 51.857 -8.234 1.00 26.36 N ATOM 2292 CA TRP A 237 58.129 52.990 -7.736 1.00 25.65 C ATOM 2293 C TRP A 237 59.272 52.528 -6.840 1.00 25.63 C ATOM 2294 O TRP A 237 60.389 53.037 -6.937 1.00 27.11 O ATOM 2295 CB TRP A 237 57.234 53.974 -6.978 1.00 25.16 C ATOM 2296 CG TRP A 237 57.942 55.186 -6.463 1.00 24.69 C ATOM 2297 CD1 TRP A 237 58.149 56.359 -7.135 1.00 24.52 C ATOM 2298 CD2 TRP A 237 58.495 55.372 -5.149 1.00 23.78 C ATOM 2299 NE1 TRP A 237 58.820 57.254 -6.330 1.00 24.69 N ATOM 2300 CE2 TRP A 237 59.038 56.677 -5.105 1.00 23.82 C ATOM 2301 CE3 TRP A 237 58.589 54.563 -4.009 1.00 23.57 C ATOM 2302 CZ2 TRP A 237 59.671 57.186 -3.974 1.00 23.22 C ATOM 2303 CZ3 TRP A 237 59.222 55.074 -2.877 1.00 23.02 C ATOM 2304 CH2 TRP A 237 59.755 56.370 -2.871 1.00 23.27 C ATOM 2305 HE1 TRP A 237 59.114 58.212 -6.607 1.00 0.00 H ATOM 2306 H TRP A 237 56.334 51.781 -7.968 1.00 0.00 H ATOM 2307 N ILE A 238 58.988 51.576 -5.956 1.00 26.71 N ATOM 2308 CA ILE A 238 59.996 51.036 -5.046 1.00 27.61 C ATOM 2309 C ILE A 238 61.081 50.319 -5.852 1.00 29.17 C ATOM 2310 O ILE A 238 62.274 50.556 -5.650 1.00 28.19 O ATOM 2311 CB ILE A 238 59.372 50.064 -4.013 1.00 27.21 C ATOM 2312 CG1 ILE A 238 58.420 50.810 -3.068 1.00 26.90 C ATOM 2313 CG2 ILE A 238 60.453 49.361 -3.197 1.00 27.02 C ATOM 2314 CD1 ILE A 238 57.493 49.900 -2.285 1.00 27.06 C ATOM 2315 H ILE A 238 58.018 51.204 -5.911 1.00 0.00 H ATOM 2316 N ARG A 239 60.660 49.464 -6.782 1.00 31.21 N ATOM 2317 CA ARG A 239 61.609 48.710 -7.602 1.00 33.97 C ATOM 2318 C ARG A 239 62.483 49.638 -8.464 1.00 35.16 C ATOM 2319 O ARG A 239 63.698 49.440 -8.546 1.00 37.14 O ATOM 2320 CB ARG A 239 60.882 47.633 -8.433 1.00 35.52 C ATOM 2321 CG ARG A 239 60.127 46.621 -7.561 1.00 35.49 C ATOM 2322 CD ARG A 239 59.972 45.236 -8.179 1.00 36.29 C ATOM 2323 NE ARG A 239 58.644 44.986 -8.740 1.00 36.71 N ATOM 2324 CZ ARG A 239 57.682 44.301 -8.126 1.00 36.22 C ATOM 2325 NH1 ARG A 239 57.876 43.808 -6.911 1.00 36.17 N ATOM 2326 NH2 ARG A 239 56.516 44.115 -8.726 1.00 36.23 N ATOM 2327 HE ARG A 239 58.437 45.370 -9.684 1.00 0.00 H ATOM 2328 HH12 ARG A 239 57.118 43.274 -6.439 1.00 0.00 H ATOM 2329 HH11 ARG A 239 58.786 43.955 -6.429 1.00 0.00 H ATOM 2330 HH22 ARG A 239 55.764 43.580 -8.247 1.00 0.00 H ATOM 2331 HH21 ARG A 239 56.352 44.504 -9.676 1.00 0.00 H ATOM 2332 H ARG A 239 59.639 49.330 -6.928 1.00 0.00 H ATOM 2333 N SER A 240 61.891 50.677 -9.050 1.00 37.13 N ATOM 2334 CA SER A 240 62.644 51.582 -9.937 1.00 36.72 C ATOM 2335 C SER A 240 63.636 52.489 -9.198 1.00 38.11 C ATOM 2336 O SER A 240 64.599 52.968 -9.800 1.00 35.00 O ATOM 2337 CB SER A 240 61.696 52.431 -10.799 1.00 37.97 C ATOM 2338 OG SER A 240 61.259 53.603 -10.127 1.00 38.67 O ATOM 2339 HG SER A 240 60.777 53.348 -9.301 1.00 0.00 H ATOM 2340 H SER A 240 60.880 50.853 -8.879 1.00 0.00 H ATOM 2341 N HIS A 241 63.406 52.729 -7.904 1.00 37.93 N ATOM 2342 CA HIS A 241 64.241 53.655 -7.136 1.00 38.38 C ATOM 2343 C HIS A 241 65.285 52.976 -6.269 1.00 39.20 C ATOM 2344 O HIS A 241 66.165 53.652 -5.740 1.00 40.49 O ATOM 2345 CB HIS A 241 63.376 54.590 -6.282 1.00 38.64 C ATOM 2346 CG HIS A 241 62.776 55.718 -7.060 1.00 38.30 C ATOM 2347 ND1 HIS A 241 61.585 55.600 -7.741 1.00 38.50 N ATOM 2348 CD2 HIS A 241 63.219 56.977 -7.289 1.00 38.37 C ATOM 2349 CE1 HIS A 241 61.308 56.744 -8.342 1.00 38.64 C ATOM 2350 NE2 HIS A 241 62.284 57.597 -8.082 1.00 39.22 N ATOM 2351 H HIS A 241 62.615 52.247 -7.431 1.00 0.00 H ATOM 2352 N THR A 242 65.203 51.655 -6.133 1.00 39.35 N ATOM 2353 CA THR A 242 66.181 50.902 -5.351 1.00 40.62 C ATOM 2354 C THR A 242 67.166 50.169 -6.257 1.00 43.38 C ATOM 2355 O THR A 242 67.031 50.162 -7.479 1.00 46.53 O ATOM 2356 CB THR A 242 65.498 49.885 -4.418 1.00 39.56 C ATOM 2357 OG1 THR A 242 64.581 49.083 -5.169 1.00 39.21 O ATOM 2358 CG2 THR A 242 64.748 50.600 -3.301 1.00 39.16 C ATOM 2359 OXT THR A 242 68.126 49.568 -5.782 1.00 45.98 O ATOM 2360 HG1 THR A 242 63.894 49.666 -5.580 1.00 0.00 H ATOM 2361 H THR A 242 64.423 51.145 -6.595 1.00 0.00 H TER 2362 THR A 242 HETATM 2363 O HOH 1 49.848 57.791 0.432 1.00 22.07 O HETATM 2364 O HOH 2 49.360 56.812 -9.624 1.00 45.05 O HETATM 2365 O HOH 3 79.031 55.939 15.706 1.00 53.27 O HETATM 2366 O HOH 4 55.921 54.243 13.718 1.00 15.92 O HETATM 2367 O HOH 5 72.096 61.354 7.597 1.00 23.10 O HETATM 2368 O HOH 6 59.240 63.621 22.746 1.00 31.68 O HETATM 2369 O HOH 7 64.717 50.602 16.108 1.00 19.10 O HETATM 2370 O HOH 8 57.830 63.660 15.217 1.00 20.82 O HETATM 2371 O HOH 9 65.765 65.023 -0.161 1.00 48.97 O HETATM 2372 O HOH 10 47.588 54.987 25.310 1.00 23.36 O HETATM 2373 O HOH 11 57.398 51.833 7.048 1.00 16.73 O HETATM 2374 O HOH 12 72.050 43.762 16.322 1.00 28.79 O HETATM 2375 O HOH 13 41.319 58.952 14.622 1.00 22.04 O HETATM 2376 O HOH 14 46.346 61.954 13.252 1.00 24.47 O HETATM 2377 O HOH 15 35.180 47.361 6.471 1.00 28.37 O HETATM 2378 O HOH 16 49.435 64.413 -5.405 1.00 28.34 O HETATM 2379 O HOH 17 40.585 53.058 16.101 1.00 18.65 O HETATM 2380 O HOH 18 59.184 59.935 -7.371 1.00 23.65 O HETATM 2381 O HOH 19 40.657 55.541 14.759 1.00 23.58 O HETATM 2382 O HOH 20 64.153 73.175 5.517 1.00 31.34 O HETATM 2383 O HOH 21 53.703 54.874 20.966 1.00 17.23 O HETATM 2384 O HOH 22 57.132 55.902 15.544 1.00 14.65 O HETATM 2385 O HOH 23 48.383 65.904 18.354 1.00 44.48 O HETATM 2386 O HOH 24 58.143 72.101 2.215 1.00 32.59 O HETATM 2387 O HOH 25 49.030 61.046 -7.909 1.00 42.70 O HETATM 2388 O HOH 26 69.982 46.425 0.289 1.00 36.97 O HETATM 2389 O HOH 27 54.156 55.847 -7.837 1.00 25.72 O HETATM 2390 O HOH 28 44.811 52.687 12.632 1.00 21.17 O HETATM 2391 O HOH 29 54.932 73.446 7.222 1.00 31.25 O HETATM 2392 O HOH 30 63.678 62.952 -3.418 1.00 28.42 O HETATM 2393 O HOH 31 69.048 51.485 -9.062 1.00 43.85 O HETATM 2394 O HOH 32 40.623 50.948 2.994 1.00 28.39 O HETATM 2395 O HOH 33 44.493 65.100 12.801 1.00 35.25 O HETATM 2396 O HOH 34 76.037 51.682 15.343 1.00 39.15 O HETATM 2397 O HOH 35 65.271 47.377 13.945 1.00 18.35 O HETATM 2398 O HOH 36 34.036 64.118 -0.037 1.00 24.70 O HETATM 2399 O HOH 37 40.565 62.738 -3.076 1.00 26.35 O HETATM 2400 O HOH 38 40.109 56.742 -5.407 1.00 42.38 O HETATM 2401 O HOH 39 40.329 40.268 12.456 1.00 36.39 O HETATM 2402 O HOH 40 53.944 40.742 -7.766 1.00 50.19 O HETATM 2403 O HOH 41 37.732 48.027 12.561 1.00 30.53 O HETATM 2404 O HOH 42 42.141 63.345 -1.009 1.00 25.82 O HETATM 2405 O HOH 43 60.219 41.616 -0.120 1.00 42.34 O HETATM 2406 O HOH 44 36.538 50.605 13.436 1.00 36.10 O HETATM 2407 O HOH 45 53.666 43.495 23.798 1.00 33.04 O HETATM 2408 O HOH 46 77.083 54.753 11.983 1.00 34.95 O HETATM 2409 O HOH 47 73.377 43.794 13.745 1.00 37.21 O HETATM 2410 O HOH 48 41.586 46.529 17.273 1.00 31.77 O HETATM 2411 O HOH 49 52.868 68.193 3.907 1.00 21.15 O HETATM 2412 O HOH 50 70.381 41.571 18.982 1.00 29.88 O HETATM 2413 O HOH 51 35.760 59.162 19.599 1.00 26.08 O HETATM 2414 O HOH 52 50.890 69.953 4.907 1.00 35.66 O HETATM 2415 O HOH 53 32.527 63.611 3.954 1.00 44.96 O HETATM 2416 O HOH 54 75.231 47.216 22.104 1.00 43.73 O HETATM 2417 O HOH 55 69.149 45.509 19.566 1.00 29.04 O HETATM 2418 O HOH 56 64.620 62.176 21.137 1.00 41.06 O HETATM 2419 O HOH 57 47.774 63.491 16.930 1.00 41.76 O HETATM 2420 O HOH 58 70.643 43.533 -0.331 1.00 47.90 O HETATM 2421 O HOH 59 70.198 57.722 23.410 1.00 46.46 O HETATM 2422 O HOH 60 40.574 53.311 1.252 1.00 33.48 O HETATM 2423 O HOH 61 50.410 68.474 23.542 1.00 37.02 O HETATM 2424 O HOH 62 57.837 57.562 28.588 1.00 47.27 O HETATM 2425 O HOH 63 33.866 50.861 12.185 1.00 40.77 O HETATM 2426 O HOH 64 47.808 55.566 28.254 1.00 50.13 O HETATM 2427 O HOH 65 60.504 64.818 18.727 1.00 45.45 O HETATM 2428 O HOH 66 54.293 52.766 -8.369 1.00 32.82 O HETATM 2429 O HOH 67 42.043 53.694 24.792 1.00 46.74 O HETATM 2430 O HOH 68 60.114 60.709 26.211 1.00 40.22 O HETATM 2431 O HOH 69 74.127 51.930 1.834 1.00 35.72 O HETATM 2432 O HOH 70 66.736 71.894 5.482 1.00 38.11 O HETATM 2433 O HOH 71 31.666 63.364 1.316 1.00 38.52 O HETATM 2434 O HOH 72 42.007 62.506 18.774 1.00 36.98 O HETATM 2435 O HOH 73 54.993 42.793 21.501 1.00 26.07 O HETATM 2436 O HOH 74 58.304 65.392 -2.981 1.00 30.06 O HETATM 2437 O HOH 75 31.623 52.091 15.432 1.00 43.37 O HETATM 2438 O HOH 76 74.295 61.620 5.543 1.00 54.99 O HETATM 2439 O HOH 77 44.238 46.103 19.779 1.00 34.72 O HETATM 2440 O HOH 78 43.253 72.512 1.417 1.00 24.32 O HETATM 2441 O HOH 79 44.107 48.740 23.601 1.00 31.26 O HETATM 2442 O HOH 80 38.383 59.235 -3.697 1.00 33.79 O HETATM 2443 O HOH 81 47.148 65.909 7.700 1.00 34.41 O HETATM 2444 O HOH 82 34.235 61.687 15.698 1.00 35.81 O HETATM 2445 O HOH 83 55.424 41.669 15.187 1.00 33.44 O HETATM 2446 O HOH 84 54.113 69.804 1.835 1.00 31.61 O HETATM 2447 O HOH 85 57.161 54.626 27.862 1.00 32.69 O HETATM 2448 O HOH 86 41.806 66.027 2.851 1.00 21.34 O HETATM 2449 O HOH 87 49.639 46.869 0.367 1.00 26.55 O HETATM 2450 O HOH 88 53.869 63.863 27.874 1.00 31.75 O HETATM 2451 O HOH 89 64.129 43.400 22.301 1.00 26.51 O HETATM 2452 O HOH 90 72.595 66.636 3.161 1.00 21.39 O HETATM 2453 O HOH 91 36.961 64.253 8.978 1.00 36.96 O HETATM 2454 O HOH 92 61.535 43.221 1.908 1.00 33.33 O HETATM 2455 O HOH 93 62.028 63.459 20.807 1.00 44.33 O HETATM 2456 O HOH 94 70.695 49.294 -3.972 1.00 42.64 O HETATM 2457 O HOH 95 51.055 50.016 -9.266 1.00 37.73 O HETATM 2458 O HOH 96 47.951 58.571 2.179 1.00 29.18 O HETATM 2459 O HOH 97 33.532 48.423 10.663 1.00 41.22 O HETATM 2460 O HOH 98 50.800 69.744 -1.145 1.00 31.14 O HETATM 2461 O HOH 99 62.454 48.711 28.983 1.00 34.58 O HETATM 2462 O HOH 100 81.203 57.811 7.074 1.00 30.60 O HETATM 2463 O HOH 101 55.282 46.264 12.975 1.00 36.14 O HETATM 2464 O HOH 102 48.810 47.333 27.735 1.00 43.79 O HETATM 2465 O HOH 103 49.723 43.797 1.216 1.00 37.31 O HETATM 2466 O HOH 104 30.047 54.312 13.688 1.00 39.18 O HETATM 2467 O HOH 105 32.470 63.808 9.202 1.00 43.81 O HETATM 2468 O HOH 106 78.148 58.744 16.050 1.00 51.21 O HETATM 2469 O HOH 107 54.702 72.100 4.091 1.00 40.07 O HETATM 2470 O HOH 108 52.992 70.637 -2.695 1.00 50.80 O HETATM 2471 O HOH 109 53.244 67.624 19.093 1.00 40.32 O HETATM 2472 O HOH 110 67.606 68.645 -0.244 1.00 29.77 O HETATM 2473 O HOH 111 48.421 58.274 -2.611 1.00 29.66 O HETATM 2474 O HOH 112 43.149 38.614 11.077 1.00 34.79 O HETATM 2475 O HOH 113 66.951 51.979 22.750 1.00 38.26 O HETATM 2476 O HOH 114 45.058 63.644 8.533 1.00 28.58 O HETATM 2477 O HOH 115 71.437 38.248 17.475 1.00 38.93 O HETATM 2478 O HOH 116 58.926 39.297 6.557 1.00 31.06 O HETATM 2479 O HOH 117 68.415 64.392 -0.959 1.00 34.05 O HETATM 2480 O HOH 118 57.292 66.447 14.763 1.00 23.12 O HETATM 2481 O HOH 119 58.548 67.361 6.944 1.00 16.03 O HETATM 2482 O HOH 120 45.738 68.757 10.555 1.00 29.93 O HETATM 2483 O HOH 121 48.864 74.908 12.076 1.00 28.66 O HETATM 2484 O HOH 122 60.511 76.003 2.825 1.00 36.88 O HETATM 2485 O HOH 123 47.543 77.227 12.819 1.00 42.39 O HETATM 2486 O HOH 124 61.405 67.559 13.939 1.00 39.09 O HETATM 2487 O HOH 125 46.561 64.983 10.361 1.00 36.93 O HETATM 2488 N GLY A 126 45.478 73.951 13.851 1.00 0.24 N HETATM 2489 CA GLY A 126 45.567 73.801 12.365 1.00 0.05 C HETATM 2490 C GLY A 126 46.163 72.465 11.952 1.00 0.22 C HETATM 2491 O GLY A 126 45.453 71.465 11.883 1.00 -0.39 O HETATM 2492 N GLY A 126 47.472 72.449 11.710 1.00 -0.26 N HETATM 2493 CA GLY A 126 48.160 71.297 11.094 1.00 0.13 C HETATM 2494 CB GLY A 126 49.310 71.752 10.316 1.00 0.00 C HETATM 2495 CG GLY A 126 50.141 70.676 9.750 1.00 0.03 C HETATM 2496 CD1 GLY A 126 49.581 70.119 8.436 1.00 0.02 C HETATM 2497 SE GLY A 126 50.191 68.585 8.071 1.00 -0.09 S HETATM 2498 SG GLY A 126 49.656 67.598 9.776 1.00 -0.09 S HETATM 2499 CB GLY A 126 51.133 67.509 10.816 1.00 0.04 C HETATM 2500 CA GLY A 126 52.243 66.692 10.153 1.00 0.14 C HETATM 2501 N GLY A 126 51.710 65.364 9.850 1.00 -0.26 N HETATM 2502 C GLY A 126 51.572 64.928 8.599 1.00 0.20 C HETATM 2503 CA GLY A 126 50.818 63.639 8.409 1.00 0.12 C HETATM 2504 N GLY A 126 50.685 62.932 9.673 1.00 -0.27 N HETATM 2505 C GLY A 126 49.520 62.781 10.285 1.00 0.20 C HETATM 2506 CA GLY A 126 49.556 62.069 11.623 1.00 0.13 C HETATM 2507 N GLY A 126 48.894 62.870 12.650 1.00 -0.26 N HETATM 2508 C GLY A 126 49.305 64.091 12.962 1.00 0.20 C HETATM 2509 CA GLY A 126 48.474 64.849 13.988 1.00 0.12 C HETATM 2510 N GLY A 126 48.715 66.300 14.010 1.00 -0.27 N HETATM 2511 C GLY A 126 47.987 67.152 13.292 1.00 0.20 C HETATM 2512 CA GLY A 126 48.120 68.626 13.648 1.00 0.13 C HETATM 2513 N GLY A 126 47.840 69.483 12.492 1.00 -0.26 N HETATM 2514 C GLY A 126 48.557 70.574 12.201 1.00 0.20 C HETATM 2515 O GLY A 126 49.528 70.919 12.882 1.00 -0.39 O HETATM 2516 H GLY A 126 47.077 69.240 11.893 1.00 0.19 H HETATM 2517 CB GLY A 126 47.104 68.897 14.753 1.00 -0.01 C HETATM 2518 CG GLY A 126 47.271 70.069 15.713 1.00 -0.04 C HETATM 2519 CD1 GLY A 126 45.990 70.158 16.521 1.00 -0.06 C HETATM 2520 H GLY A 126 46.062 70.994 17.232 1.00 0.02 H HETATM 2521 H GLY A 126 45.839 69.219 17.073 1.00 0.02 H HETATM 2522 H GLY A 126 45.140 70.326 15.843 1.00 0.02 H HETATM 2523 CD2 GLY A 126 48.456 69.845 16.633 1.00 -0.06 C HETATM 2524 H GLY A 126 49.377 69.782 16.035 1.00 0.02 H HETATM 2525 H GLY A 126 48.316 68.907 17.190 1.00 0.02 H HETATM 2526 H GLY A 126 48.534 70.683 17.341 1.00 0.02 H HETATM 2527 H GLY A 126 47.424 70.999 15.146 1.00 0.03 H HETATM 2528 H GLY A 126 47.069 67.989 15.373 1.00 0.03 H HETATM 2529 H GLY A 126 46.133 69.038 14.255 1.00 0.03 H HETATM 2530 H GLY A 126 49.138 68.832 14.011 1.00 0.08 H HETATM 2531 O GLY A 126 47.216 66.794 12.397 1.00 -0.39 O HETATM 2532 H GLY A 126 49.451 66.659 14.584 1.00 0.19 H HETATM 2533 H GLY A 126 47.411 64.680 13.763 1.00 0.08 H HETATM 2534 H GLY A 126 48.706 64.446 14.985 1.00 0.08 H HETATM 2535 O GLY A 126 50.311 64.592 12.490 1.00 -0.39 O HETATM 2536 H GLY A 126 48.107 62.485 13.132 1.00 0.19 H HETATM 2537 CB GLY A 126 48.862 60.735 11.462 1.00 -0.01 C HETATM 2538 CG GLY A 126 49.058 59.817 12.646 1.00 -0.02 C HETATM 2539 CD GLY A 126 48.100 58.651 12.563 1.00 0.06 C HETATM 2540 NE GLY A 126 46.735 59.046 12.892 1.00 -0.27 N HETATM 2541 CZ GLY A 126 45.741 58.186 13.094 1.00 0.29 C HETATM 2542 NH1 GLY A 126 45.949 56.873 12.983 1.00 -0.28 N HETATM 2543 H GLY A 126 45.174 56.214 13.141 1.00 0.26 H HETATM 2544 H GLY A 126 46.885 56.519 12.739 1.00 0.26 H HETATM 2545 NH2 GLY A 126 44.533 58.637 13.397 1.00 -0.28 N HETATM 2546 H GLY A 126 44.368 59.650 13.484 1.00 0.26 H HETATM 2547 H GLY A 126 43.758 57.975 13.546 1.00 0.26 H HETATM 2548 H GLY A 126 46.529 60.052 12.973 1.00 0.26 H HETATM 2549 H GLY A 126 48.425 57.872 13.269 1.00 0.07 H HETATM 2550 H GLY A 126 48.117 58.248 11.539 1.00 0.07 H HETATM 2551 H GLY A 126 48.871 60.376 13.575 1.00 0.03 H HETATM 2552 H GLY A 126 50.091 59.440 12.647 1.00 0.03 H HETATM 2553 H GLY A 126 49.261 60.239 10.565 1.00 0.03 H HETATM 2554 H GLY A 126 47.784 60.914 11.333 1.00 0.03 H HETATM 2555 H GLY A 126 50.602 61.903 11.920 1.00 0.08 H HETATM 2556 O GLY A 126 48.462 63.166 9.827 1.00 -0.39 O HETATM 2557 H GLY A 126 51.504 62.545 10.096 1.00 0.19 H HETATM 2558 H GLY A 126 49.816 63.861 8.012 1.00 0.08 H HETATM 2559 H GLY A 126 51.363 63.004 7.695 1.00 0.08 H HETATM 2560 O GLY A 126 52.060 65.508 7.638 1.00 -0.39 O HETATM 2561 H GLY A 126 51.441 64.766 10.605 1.00 0.19 H HETATM 2562 C GLY A 126 53.533 66.725 11.003 1.00 0.20 C HETATM 2563 O GLY A 126 54.038 67.805 11.332 1.00 -0.39 O HETATM 2564 N GLY A 126 54.095 65.555 11.297 1.00 -0.26 N HETATM 2565 CA GLY A 126 55.397 65.456 11.963 1.00 0.13 C HETATM 2566 C GLY A 126 56.464 66.252 11.212 1.00 0.20 C HETATM 2567 O GLY A 126 56.504 66.243 9.958 1.00 -0.39 O HETATM 2568 N GLY A 126 57.315 66.939 11.965 1.00 -0.26 N HETATM 2569 CA GLY A 126 58.525 67.560 11.402 1.00 0.15 C HETATM 2570 C GLY A 126 58.162 68.581 10.315 1.00 0.21 C HETATM 2571 O GLY A 126 58.827 68.665 9.270 1.00 -0.39 O HETATM 2572 N GLY A 126 57.084 69.327 10.570 1.00 -0.26 N HETATM 2573 CA GLY A 126 56.609 70.416 9.715 1.00 0.14 C HETATM 2574 C GLY A 126 56.739 71.732 10.436 1.00 0.21 C HETATM 2575 O GLY A 126 56.484 71.818 11.653 1.00 -0.39 O HETATM 2576 N GLY A 126 57.067 72.775 9.685 1.00 -0.26 N HETATM 2577 CA GLY A 126 57.052 74.130 10.242 1.00 0.13 C HETATM 2578 C GLY A 126 55.655 74.544 10.706 1.00 0.20 C HETATM 2579 O GLY A 126 55.535 75.286 11.672 1.00 -0.39 O HETATM 2580 N GLY A 126 54.606 74.052 10.046 1.00 -0.26 N HETATM 2581 CA GLY A 126 53.223 74.430 10.394 1.00 0.14 C HETATM 2582 C GLY A 126 52.638 73.698 11.609 1.00 0.20 C HETATM 2583 O GLY A 126 51.532 74.006 12.033 1.00 -0.39 O HETATM 2584 N GLY A 126 53.376 72.746 12.170 1.00 -0.26 N HETATM 2585 CA GLY A 126 52.819 71.807 13.130 1.00 0.13 C HETATM 2586 C GLY A 126 52.291 72.534 14.364 1.00 0.20 C HETATM 2587 O GLY A 126 52.970 73.397 14.895 1.00 -0.39 O HETATM 2588 N GLY A 126 51.067 72.150 14.832 1.00 -0.30 N HETATM 2589 H GLY A 126 50.677 72.596 15.638 1.00 0.18 H HETATM 2590 H GLY A 126 50.560 71.423 14.369 1.00 0.18 H HETATM 2591 CB GLY A 126 53.886 70.793 13.547 1.00 -0.01 C HETATM 2592 CG GLY A 126 53.534 69.766 14.630 1.00 -0.04 C HETATM 2593 CD1 GLY A 126 52.370 68.892 14.225 1.00 -0.06 C HETATM 2594 H GLY A 126 52.154 68.173 15.029 1.00 0.02 H HETATM 2595 H GLY A 126 52.624 68.346 13.304 1.00 0.02 H HETATM 2596 H GLY A 126 51.485 69.520 14.047 1.00 0.02 H HETATM 2597 CD2 GLY A 126 54.744 68.899 14.945 1.00 -0.06 C HETATM 2598 H GLY A 126 55.588 69.540 15.239 1.00 0.02 H HETATM 2599 H GLY A 126 55.020 68.316 14.054 1.00 0.02 H HETATM 2600 H GLY A 126 54.499 68.214 15.770 1.00 0.02 H HETATM 2601 H GLY A 126 53.251 70.314 15.541 1.00 0.03 H HETATM 2602 H GLY A 126 54.753 71.364 13.910 1.00 0.03 H HETATM 2603 H GLY A 126 54.169 70.230 12.645 1.00 0.03 H HETATM 2604 H GLY A 126 51.985 71.271 12.653 1.00 0.08 H HETATM 2605 H GLY A 126 54.343 72.673 11.925 1.00 0.19 H HETATM 2606 CB GLY A 126 52.279 74.269 9.176 1.00 0.04 C HETATM 2607 SG GLY A 126 52.172 72.641 8.360 1.00 -0.09 S HETATM 2608 SD2 GLY A 126 51.770 71.090 9.615 1.00 -0.09 S HETATM 2609 H GLY A 126 52.607 74.992 8.415 1.00 0.04 H HETATM 2610 H GLY A 126 51.265 74.528 9.515 1.00 0.04 H HETATM 2611 H GLY A 126 53.248 75.499 10.652 1.00 0.08 H HETATM 2612 H GLY A 126 54.761 73.410 9.295 1.00 0.19 H HETATM 2613 CB GLY A 126 57.604 75.148 9.235 1.00 -0.01 C HETATM 2614 CG GLY A 126 59.121 75.230 9.244 1.00 -0.02 C HETATM 2615 CD GLY A 126 59.660 76.179 8.187 1.00 0.06 C HETATM 2616 NE GLY A 126 59.419 75.621 6.873 1.00 -0.27 N HETATM 2617 CZ GLY A 126 60.141 74.644 6.326 1.00 0.29 C HETATM 2618 NH1 GLY A 126 61.187 74.125 6.969 1.00 -0.28 N HETATM 2619 H GLY A 126 61.736 73.370 6.534 1.00 0.26 H HETATM 2620 H GLY A 126 61.446 74.479 7.901 1.00 0.26 H HETATM 2621 NH2 GLY A 126 59.818 74.189 5.121 1.00 -0.28 N HETATM 2622 H GLY A 126 59.011 74.587 4.620 1.00 0.26 H HETATM 2623 H GLY A 126 60.375 73.439 4.688 1.00 0.26 H HETATM 2624 H GLY A 126 58.637 76.005 6.324 1.00 0.26 H HETATM 2625 H GLY A 126 60.741 76.317 8.335 1.00 0.07 H HETATM 2626 H GLY A 126 59.151 77.151 8.272 1.00 0.07 H HETATM 2627 H GLY A 126 59.529 74.226 9.057 1.00 0.03 H HETATM 2628 H GLY A 126 59.449 75.581 10.233 1.00 0.03 H HETATM 2629 H GLY A 126 57.198 76.140 9.481 1.00 0.03 H HETATM 2630 H GLY A 126 57.275 74.857 8.226 1.00 0.03 H HETATM 2631 H GLY A 126 57.712 74.134 11.122 1.00 0.08 H HETATM 2632 H GLY A 126 57.327 72.635 8.730 1.00 0.19 H HETATM 2633 CB GLY A 126 55.123 70.266 9.383 1.00 0.01 C HETATM 2634 CG GLY A 126 54.841 69.381 8.214 1.00 -0.00 C HETATM 2635 ND1 GLY A 126 55.177 68.044 8.194 1.00 -0.33 N HETATM 2636 CE1 GLY A 126 54.794 67.515 7.043 1.00 0.09 C HETATM 2637 NE2 GLY A 126 54.222 68.460 6.318 1.00 -0.28 N HETATM 2638 CD2 GLY A 126 54.235 69.637 7.028 1.00 0.03 C HETATM 2639 H GLY A 126 53.834 70.595 6.700 1.00 0.07 H HETATM 2640 H GLY A 126 53.830 68.335 5.374 1.00 0.24 H HETATM 2641 H GLY A 126 54.928 66.476 6.744 1.00 0.12 H HETATM 2642 H GLY A 126 54.716 71.264 9.165 1.00 0.04 H HETATM 2643 H GLY A 126 54.614 69.847 10.263 1.00 0.04 H HETATM 2644 H GLY A 126 57.200 70.430 8.788 1.00 0.08 H HETATM 2645 H GLY A 126 56.566 69.128 11.402 1.00 0.19 H HETATM 2646 CB GLY A 126 59.449 66.453 10.872 1.00 0.08 C HETATM 2647 CG GLY A 126 60.870 66.921 10.604 1.00 0.18 C HETATM 2648 OD1 GLY A 126 61.440 67.678 11.376 1.00 -0.40 O HETATM 2649 ND2 GLY A 126 61.452 66.457 9.487 1.00 -0.30 N HETATM 2650 H GLY A 126 62.386 66.731 9.259 1.00 0.18 H HETATM 2651 H GLY A 126 60.951 65.837 8.883 1.00 0.18 H HETATM 2652 H GLY A 126 59.027 66.068 9.932 1.00 0.06 H HETATM 2653 H GLY A 126 59.484 65.644 11.616 1.00 0.06 H HETATM 2654 H GLY A 126 59.051 68.095 12.206 1.00 0.08 H HETATM 2655 H GLY A 126 57.129 67.037 12.943 1.00 0.19 H HETATM 2656 CB GLY A 126 55.866 64.002 12.055 1.00 -0.00 C HETATM 2657 CG GLY A 126 55.019 63.086 12.928 1.00 0.00 C HETATM 2658 CD GLY A 126 53.828 62.457 12.223 1.00 0.04 C HETATM 2659 OE1 GLY A 126 53.491 62.852 11.065 1.00 -0.57 O HETATM 2660 OE2 GLY A 126 53.213 61.536 12.831 1.00 -0.57 O HETATM 2661 H GLY A 126 54.642 63.675 13.777 1.00 0.04 H HETATM 2662 H GLY A 126 55.663 62.276 13.300 1.00 0.04 H HETATM 2663 H GLY A 126 56.889 64.002 12.459 1.00 0.03 H HETATM 2664 H GLY A 126 55.874 63.585 11.037 1.00 0.03 H HETATM 2665 H GLY A 126 55.297 65.864 12.980 1.00 0.08 H HETATM 2666 H GLY A 126 53.612 64.714 11.055 1.00 0.19 H HETATM 2667 H GLY A 126 52.489 67.168 9.192 1.00 0.08 H HETATM 2668 H GLY A 126 51.502 68.529 10.999 1.00 0.04 H HETATM 2669 H GLY A 126 50.867 67.038 11.774 1.00 0.04 H HETATM 2670 H GLY A 126 49.846 70.807 7.620 1.00 0.04 H HETATM 2671 H GLY A 126 48.486 70.053 8.519 1.00 0.04 H HETATM 2672 H GLY A 126 50.097 69.850 10.475 1.00 0.04 H HETATM 2673 H GLY A 126 49.945 72.365 10.972 1.00 0.03 H HETATM 2674 H GLY A 126 48.938 72.369 9.485 1.00 0.03 H HETATM 2675 H GLY A 126 47.483 70.713 10.453 1.00 0.08 H HETATM 2676 H GLY A 126 48.013 73.253 11.956 1.00 0.19 H HETATM 2677 H GLY A 126 46.199 74.608 11.966 1.00 0.11 H HETATM 2678 H GLY A 126 44.556 73.883 11.941 1.00 0.11 H HETATM 2679 H GLY A 126 45.078 74.849 14.075 1.00 0.20 H HETATM 2680 H GLY A 126 46.401 73.885 14.251 1.00 0.20 H HETATM 2681 H GLY A 126 44.895 73.220 14.228 1.00 0.20 H CONECT 303 302 435 CONECT 361 360 1075 CONECT 435 303 434 CONECT 1075 361 1074 CONECT 1306 1305 1957 CONECT 1623 1622 1780 CONECT 1780 1623 1779 CONECT 1882 1881 2124 CONECT 1957 1306 1956 CONECT 2124 1882 2123 CONECT 2488 2489 2679 2680 2681 CONECT 2489 2488 2490 2677 2678 CONECT 2490 2489 2491 2492 CONECT 2491 2490 CONECT 2492 2490 2493 2676 CONECT 2493 2492 2494 2514 2675 CONECT 2494 2493 2495 2673 2674 CONECT 2495 2494 2496 2608 2672 CONECT 2496 2495 2497 2670 2671 CONECT 2497 2496 2498 CONECT 2498 2497 2499 CONECT 2499 2498 2500 2668 2669 CONECT 2500 2499 2501 2562 2667 CONECT 2501 2500 2502 2561 CONECT 2502 2501 2503 2560 CONECT 2503 2502 2504 2558 2559 CONECT 2504 2503 2505 2557 CONECT 2505 2504 2506 2556 CONECT 2506 2505 2507 2537 2555 CONECT 2507 2506 2508 2536 CONECT 2508 2507 2509 2535 CONECT 2509 2508 2510 2533 2534 CONECT 2510 2509 2511 2532 CONECT 2511 2510 2512 2531 CONECT 2512 2511 2513 2517 2530 CONECT 2513 2512 2514 2516 CONECT 2514 2493 2513 2515 CONECT 2515 2514 CONECT 2516 2513 CONECT 2517 2512 2518 2528 2529 CONECT 2518 2517 2519 2523 2527 CONECT 2519 2518 2520 2521 2522 CONECT 2520 2519 CONECT 2521 2519 CONECT 2522 2519 CONECT 2523 2518 2524 2525 2526 CONECT 2524 2523 CONECT 2525 2523 CONECT 2526 2523 CONECT 2527 2518 CONECT 2528 2517 CONECT 2529 2517 CONECT 2530 2512 CONECT 2531 2511 CONECT 2532 2510 CONECT 2533 2509 CONECT 2534 2509 CONECT 2535 2508 CONECT 2536 2507 CONECT 2537 2506 2538 2553 2554 CONECT 2538 2537 2539 2551 2552 CONECT 2539 2538 2540 2549 2550 CONECT 2540 2539 2541 2548 CONECT 2541 2540 2542 2545 CONECT 2542 2541 2543 2544 CONECT 2543 2542 CONECT 2544 2542 CONECT 2545 2541 2546 2547 CONECT 2546 2545 CONECT 2547 2545 CONECT 2548 2540 CONECT 2549 2539 CONECT 2550 2539 CONECT 2551 2538 CONECT 2552 2538 CONECT 2553 2537 CONECT 2554 2537 CONECT 2555 2506 CONECT 2556 2505 CONECT 2557 2504 CONECT 2558 2503 CONECT 2559 2503 CONECT 2560 2502 CONECT 2561 2501 CONECT 2562 2500 2563 2564 CONECT 2563 2562 CONECT 2564 2562 2565 2666 CONECT 2565 2564 2566 2656 2665 CONECT 2566 2565 2567 2568 CONECT 2567 2566 CONECT 2568 2566 2569 2655 CONECT 2569 2568 2570 2646 2654 CONECT 2570 2569 2571 2572 CONECT 2571 2570 CONECT 2572 2570 2573 2645 CONECT 2573 2572 2574 2633 2644 CONECT 2574 2573 2575 2576 CONECT 2575 2574 CONECT 2576 2574 2577 2632 CONECT 2577 2576 2578 2613 2631 CONECT 2578 2577 2579 2580 CONECT 2579 2578 CONECT 2580 2578 2581 2612 CONECT 2581 2580 2582 2606 2611 CONECT 2582 2581 2583 2584 CONECT 2583 2582 CONECT 2584 2582 2585 2605 CONECT 2585 2584 2586 2591 2604 CONECT 2586 2585 2587 2588 CONECT 2587 2586 CONECT 2588 2586 2589 2590 CONECT 2589 2588 CONECT 2590 2588 CONECT 2591 2585 2592 2602 2603 CONECT 2592 2591 2593 2597 2601 CONECT 2593 2592 2594 2595 2596 CONECT 2594 2593 CONECT 2595 2593 CONECT 2596 2593 CONECT 2597 2592 2598 2599 2600 CONECT 2598 2597 CONECT 2599 2597 CONECT 2600 2597 CONECT 2601 2592 CONECT 2602 2591 CONECT 2603 2591 CONECT 2604 2585 CONECT 2605 2584 CONECT 2606 2581 2607 2609 2610 CONECT 2607 2606 2608 CONECT 2608 2495 2607 CONECT 2609 2606 CONECT 2610 2606 CONECT 2611 2581 CONECT 2612 2580 CONECT 2613 2577 2614 2629 2630 CONECT 2614 2613 2615 2627 2628 CONECT 2615 2614 2616 2625 2626 CONECT 2616 2615 2617 2624 CONECT 2617 2616 2618 2621 CONECT 2618 2617 2619 2620 CONECT 2619 2618 CONECT 2620 2618 CONECT 2621 2617 2622 2623 CONECT 2622 2621 CONECT 2623 2621 CONECT 2624 2616 CONECT 2625 2615 CONECT 2626 2615 CONECT 2627 2614 CONECT 2628 2614 CONECT 2629 2613 CONECT 2630 2613 CONECT 2631 2577 CONECT 2632 2576 CONECT 2633 2573 2634 2642 2643 CONECT 2634 2633 2635 2638 CONECT 2635 2634 2636 CONECT 2636 2635 2637 2641 CONECT 2637 2636 2638 2640 CONECT 2638 2634 2637 2639 CONECT 2639 2638 CONECT 2640 2637 CONECT 2641 2636 CONECT 2642 2633 CONECT 2643 2633 CONECT 2644 2573 CONECT 2645 2572 CONECT 2646 2569 2647 2652 2653 CONECT 2647 2646 2648 2649 CONECT 2648 2647 CONECT 2649 2647 2650 2651 CONECT 2650 2649 CONECT 2651 2649 CONECT 2652 2646 CONECT 2653 2646 CONECT 2654 2569 CONECT 2655 2568 CONECT 2656 2565 2657 2663 2664 CONECT 2657 2656 2658 2661 2662 CONECT 2658 2657 2659 2660 CONECT 2659 2658 CONECT 2660 2658 CONECT 2661 2657 CONECT 2662 2657 CONECT 2663 2656 CONECT 2664 2656 CONECT 2665 2565 CONECT 2666 2564 CONECT 2667 2500 CONECT 2668 2499 CONECT 2669 2499 CONECT 2670 2496 CONECT 2671 2496 CONECT 2672 2495 CONECT 2673 2494 CONECT 2674 2494 CONECT 2675 2493 CONECT 2676 2492 CONECT 2677 2489 CONECT 2678 2489 CONECT 2679 2488 CONECT 2680 2488 CONECT 2681 2488 MASTER 0 0 0 0 0 0 0 0 2680 1 204 19 END
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Related entries of code: 4os2
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4os6
RCSB PDB
PDBbind
14aa, >4OS6_2|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
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RCSB PDB
PDBbind
14-mer
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RCSB PDB
PDBbind
14-mer
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PDBbind
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PDBbind
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PDBbind
14-mer
2ltw
RCSB PDB
PDBbind
14-mer
2n8t
RCSB PDB
PDBbind
14-mer
2oi3
RCSB PDB
PDBbind
14-mer
2w2u
RCSB PDB
PDBbind
14-mer
2xl2
RCSB PDB
PDBbind
14-mer
2xl3
RCSB PDB
PDBbind
14-mer
2xrw
RCSB PDB
PDBbind
14-mer
2xs0
RCSB PDB
PDBbind
14-mer
2y8o
RCSB PDB
PDBbind
14-mer
3d9k
RCSB PDB
PDBbind
14-mer
3d9l
RCSB PDB
PDBbind
14-mer
3d9m
RCSB PDB
PDBbind
14-mer
3d9n
RCSB PDB
PDBbind
14-mer
3d9o
RCSB PDB
PDBbind
14-mer
3d9p
RCSB PDB
PDBbind
14-mer
3g2w
RCSB PDB
PDBbind
14-mer
3lrh
RCSB PDB
PDBbind
14-mer
3meu
RCSB PDB
PDBbind
14-mer
3pkn
RCSB PDB
PDBbind
14-mer
3rqe
RCSB PDB
PDBbind
14-mer
3so6
RCSB PDB
PDBbind
14-mer
3ual
RCSB PDB
PDBbind
14-mer
3wdz
RCSB PDB
PDBbind
14-mer
3wut
RCSB PDB
PDBbind
14-mer
3wuu
RCSB PDB
PDBbind
14-mer
3wuv
RCSB PDB
PDBbind
14-mer
4aza
RCSB PDB
PDBbind
14-mer
4ch2
RCSB PDB
PDBbind
14-mer
4ch8
RCSB PDB
PDBbind
14-mer
4erq
RCSB PDB
PDBbind
14-mer
4ery
RCSB PDB
PDBbind
14-mer
4erz
RCSB PDB
PDBbind
14-mer
4es0
RCSB PDB
PDBbind
14-mer
4ewr
RCSB PDB
PDBbind
14-mer
4fi9
RCSB PDB
PDBbind
14-mer
4gly
RCSB PDB
PDBbind
14-mer
4gxl
RCSB PDB
PDBbind
14-mer
4hgc
RCSB PDB
PDBbind
14-mer
4i7b
RCSB PDB
PDBbind
14-mer
4i7c
RCSB PDB
PDBbind
14-mer
4i7d
RCSB PDB
PDBbind
14-mer
4k1e
RCSB PDB
PDBbind
14-mer
4ktu
RCSB PDB
PDBbind
14-mer
4m1d
RCSB PDB
PDBbind
14-mer
4mnv
RCSB PDB
PDBbind
14-mer
4mnw
RCSB PDB
PDBbind
14-mer
4mnx
RCSB PDB
PDBbind
14-mer
4mny
RCSB PDB
PDBbind
14-mer
4o4y
RCSB PDB
PDBbind
14-mer
4ofb
RCSB PDB
PDBbind
14-mer
4os6
RCSB PDB
PDBbind
14-mer
4ov5
RCSB PDB
PDBbind
14-mer
4wv6
RCSB PDB
PDBbind
14-mer
5aer
RCSB PDB
PDBbind
14-mer
5dpw
RCSB PDB
PDBbind
14-mer
5e0l
RCSB PDB
PDBbind
14-mer
5eoc
RCSB PDB
PDBbind
14-mer
5h5s
RCSB PDB
PDBbind
14-mer
5ixf
RCSB PDB
PDBbind
14-mer
5ly1
RCSB PDB
PDBbind
14-mer
5ly2
RCSB PDB
PDBbind
14-mer
5n8w
RCSB PDB
PDBbind
14-mer
5unj
RCSB PDB
PDBbind
14-mer
5vlh
RCSB PDB
PDBbind
14-mer
5vll
RCSB PDB
PDBbind
14-mer
5wbk
RCSB PDB
PDBbind
14-mer
5zoo
RCSB PDB
PDBbind
14-mer
6axk
RCSB PDB
PDBbind
14-mer
6axl
RCSB PDB
PDBbind
14-mer
6b27
RCSB PDB
PDBbind
14-mer
6co4
RCSB PDB
PDBbind
14-mer
6qcg
RCSB PDB
PDBbind
14-mer
6qc0
RCSB PDB
PDBbind
14-mer
6pxc
RCSB PDB
PDBbind
14-mer
6o3w
RCSB PDB
PDBbind
14-mer
6o21
RCSB PDB
PDBbind
14-mer
6nk1
RCSB PDB
PDBbind
14-mer
6fzp
RCSB PDB
PDBbind
14-mer
6fzj
RCSB PDB
PDBbind
14-mer
6fzf
RCSB PDB
PDBbind
14-mer
6d3x
RCSB PDB
PDBbind
14-mer
6bvh
RCSB PDB
PDBbind
14-mer
6bcr
RCSB PDB
PDBbind
14-mer
5zk7
RCSB PDB
PDBbind
14-mer
5zjy
RCSB PDB
PDBbind
14-mer
5y21
RCSB PDB
PDBbind
14-mer
5xvw
RCSB PDB
PDBbind
14-mer
5vk0
RCSB PDB
PDBbind
14-mer
5ok6
RCSB PDB
PDBbind
14-mer
6bd1
RCSB PDB
PDBbind
14-mer
Entry Information
PDB ID
4os2
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Urokinase-type plasminogen activator
Ligand Name
14-mer
EC.Number
E.C.3.4.21.73
Resolution
1.79(Å)
Affinity (Kd/Ki/IC50)
Ki=0.20uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Nat Chem Vol. 6: pp. 1009-1016
Ligand Properties
Formula
C
5
6
H
9
6
N
2
3
O
1
6
S
4
Molecular Weight
1475.770
Exact Mass
1474.630
No. of atoms
195
No. of bonds
197
Polar Surface Area
762.22
LOGP Value
-4.02 (
Computed with XLOGP3
)
-4.32 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 16
No. of Hydrogen Bond Acceptors: 17
No. of Rotatable Bonds: 25
No. of Nitrogen and Oxygen Atoms: 39
No. of Rings: 3
Canonical SMILES
[NH3+]CC(=O)N[C@H]1C[C@H]2CSSC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC1=O)CC(C)C)CCC[NH+]=C(N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSS2)C(=O)N[C@H](C(=O)N)CC(C)C)CCC[NH+]=C(N)N)Cc1c[nH]cn1
InChI String
InChI=1S/C56H93N23O16S4/c1-26(2)13-33(45(59)86)75-54(95)39-24-98-99-29-16-36(71-41(81)18-57)51(92)76-34(14-27(3)4)47(88)68-20-42(82)70-30(7-5-11-65-55(60)61)46(87)67-21-43(83)72-38(23-97-96-22-29)53(94)74-32(9-10-44(84)85)49(90)78-37(17-40(58)80)52(93)77-35(15-28-19-64-25-69-28)50(91)73-31(48(89)79-39)8-6-12-66-56(62)63/h19,25-27,29-39H,5-18,20-24,57H2,1-4H3,(H2,58,80)(H2,59,86)(H,64,69)(H,67,87)(H,68,88)(H,70,82)(H,71,81)(H,72,83)(H,73,91)(H,74,94)(H,75,95)(H,76,92)(H,77,93)(H,78,90)(H,79,89)(H,84,85)(H4,60,61,65)(H4,62,63,66)/p+3/t29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-/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):
P00749
Entrez Gene ID
NCBI Entrez Gene ID:
5328
ASD
Information of known allosteric effects of PDB entries
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