Browse entries in the PDBbind-CN Database
HEADER 6ITQ_COMPLEX COMPND 6ITQ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 41 GLN VAL GLN LEU GLN GLU SER GLY GLY GLY SER VAL GLN SEQRES 2 A 41 ALA GLY GLY SER LEU ARG LEU SER CYS VAL VAL SER GLY SEQRES 3 A 41 ASN THR GLY SER THR GLY TYR TRP ALA TRP PHE ARG GLN SEQRES 4 A 41 GLY PRO SEQRES 1 A 12 ARG GLU GLY VAL ALA ALA THR TYR THR ALA GLY SER SEQRES 1 A 69 THR SER MET THR TYR TYR ALA ASP SER VAL LYS GLY ARG SEQRES 2 A 69 PHE THR ILE SER GLN ASP ASN ALA LYS LYS THR LEU TYR SEQRES 3 A 69 LEU GLN MET ASN SER LEU LYS PRO GLU ASP THR GLY MET SEQRES 4 A 69 TYR ARG CYS ALA SER THR ARG PHE ALA GLY ARG TRP TYR SEQRES 5 A 69 ARG ASP SER GLU TYR ARG ALA TRP GLY GLN GLY THR GLN SEQRES 6 A 69 VAL THR VAL SER SEQRES 1 B 39 GLN VAL GLN LEU GLN GLU SER GLY GLY GLY SER VAL GLN SEQRES 2 B 39 ALA GLY GLY SER LEU ARG LEU SER CYS VAL VAL SER GLY SEQRES 3 B 39 ASN THR GLY SER THR GLY TYR TRP ALA TRP PHE ARG GLN SEQRES 1 B 12 ARG GLU GLY VAL ALA ALA THR TYR THR ALA GLY SER SEQRES 1 B 69 THR SER MET THR TYR TYR ALA ASP SER VAL LYS GLY ARG SEQRES 2 B 69 PHE THR ILE SER GLN ASP ASN ALA LYS LYS THR LEU TYR SEQRES 3 B 69 LEU GLN MET ASN SER LEU LYS PRO GLU ASP THR GLY MET SEQRES 4 B 69 TYR ARG CYS ALA SER THR ARG PHE ALA GLY ARG TRP TYR SEQRES 5 B 69 ARG ASP SER GLU TYR ARG ALA TRP GLY GLN GLY THR GLN SEQRES 6 B 69 VAL THR VAL SER SEQRES 1 C 56 GLN VAL GLN LEU GLN GLU SER GLY GLY GLY SER VAL GLN SEQRES 2 C 56 ALA GLY GLY SER LEU ARG LEU SER CYS VAL VAL SER GLY SEQRES 3 C 56 ASN THR GLY SER THR GLY TYR TRP ALA TRP PHE ARG GLN SEQRES 4 C 56 GLY PRO GLY THR GLU ARG GLU GLY VAL ALA ALA THR TYR SEQRES 5 C 56 THR ALA GLY SER SEQRES 1 C 69 THR SER MET THR TYR TYR ALA ASP SER VAL LYS GLY ARG SEQRES 2 C 69 PHE THR ILE SER GLN ASP ASN ALA LYS LYS THR LEU TYR SEQRES 3 C 69 LEU GLN MET ASN SER LEU LYS PRO GLU ASP THR GLY MET SEQRES 4 C 69 TYR ARG CYS ALA SER THR ARG PHE ALA GLY ARG TRP TYR SEQRES 5 C 69 ARG ASP SER GLU TYR ARG ALA TRP GLY GLN GLY THR GLN SEQRES 6 C 69 VAL THR VAL SER SEQRES 1 D 41 GLN VAL GLN LEU GLN GLU SER GLY GLY GLY SER VAL GLN SEQRES 2 D 41 ALA GLY GLY SER LEU ARG LEU SER CYS VAL VAL SER GLY SEQRES 3 D 41 ASN THR GLY SER THR GLY TYR TRP ALA TRP PHE ARG GLN SEQRES 4 D 41 GLY PRO SEQRES 1 D 12 ARG GLU GLY VAL ALA ALA THR TYR THR ALA GLY SER SEQRES 1 D 69 THR SER MET THR TYR TYR ALA ASP SER VAL LYS GLY ARG SEQRES 2 D 69 PHE THR ILE SER GLN ASP ASN ALA LYS LYS THR LEU TYR SEQRES 3 D 69 LEU GLN MET ASN SER LEU LYS PRO GLU ASP THR GLY MET SEQRES 4 D 69 TYR ARG CYS ALA SER THR ARG PHE ALA GLY ARG TRP TYR SEQRES 5 D 69 ARG ASP SER GLU TYR ARG ALA TRP GLY GLN GLY THR GLN SEQRES 6 D 69 VAL THR VAL SER HET HCY A1049 58 ATOM 1 N GLN A 1 5.578 -0.585 22.681 1.00 27.45 N ATOM 2 CA GLN A 1 6.806 -1.035 23.327 1.00 25.27 C ATOM 3 C GLN A 1 7.903 0.017 23.221 1.00 20.77 C ATOM 4 O GLN A 1 8.633 0.270 24.190 1.00 21.01 O ATOM 5 CB GLN A 1 7.281 -2.353 22.719 1.00 28.94 C ATOM 6 CG GLN A 1 8.728 -2.708 23.044 1.00 26.57 C ATOM 7 CD GLN A 1 8.886 -3.408 24.380 1.00 33.66 C ATOM 8 OE1 GLN A 1 7.907 -3.830 24.998 1.00 36.14 O ATOM 9 NE2 GLN A 1 10.131 -3.545 24.828 1.00 28.89 N ATOM 10 HE22 GLN A 1 10.927 -3.173 24.272 1.00 0.00 H ATOM 11 HE21 GLN A 1 10.308 -4.024 25.734 1.00 0.00 H ATOM 12 HN3 GLN A 1 5.765 -0.400 21.675 1.00 0.00 H ATOM 13 HN2 GLN A 1 5.246 0.288 23.139 1.00 0.00 H ATOM 14 HN1 GLN A 1 4.850 -1.323 22.770 1.00 0.00 H ATOM 15 N VAL A 2 8.031 0.625 22.045 1.00 15.40 N ATOM 16 CA VAL A 2 9.040 1.660 21.851 1.00 10.97 C ATOM 17 C VAL A 2 8.551 2.943 22.505 1.00 12.98 C ATOM 18 O VAL A 2 7.437 3.410 22.240 1.00 13.53 O ATOM 19 CB VAL A 2 9.341 1.868 20.359 1.00 11.19 C ATOM 20 CG1 VAL A 2 10.216 3.098 20.158 1.00 12.06 C ATOM 21 CG2 VAL A 2 10.016 0.630 19.778 1.00 11.59 C ATOM 22 H VAL A 2 7.406 0.360 21.257 1.00 0.00 H ATOM 23 N GLN A 3 9.393 3.517 23.356 1.00 9.38 N ATOM 24 CA GLN A 3 9.075 4.720 24.107 1.00 7.53 C ATOM 25 C GLN A 3 10.084 5.795 23.743 1.00 9.38 C ATOM 26 O GLN A 3 11.287 5.527 23.702 1.00 8.34 O ATOM 27 CB GLN A 3 9.111 4.408 25.605 1.00 12.27 C ATOM 28 CG GLN A 3 8.878 5.548 26.522 1.00 16.21 C ATOM 29 CD GLN A 3 8.626 5.050 27.925 1.00 18.52 C ATOM 30 OE1 GLN A 3 7.485 4.842 28.317 1.00 18.02 O ATOM 31 NE2 GLN A 3 9.698 4.814 28.673 1.00 20.51 N ATOM 32 HE22 GLN A 3 10.648 5.007 28.296 1.00 0.00 H ATOM 33 HE21 GLN A 3 9.587 4.436 29.636 1.00 0.00 H ATOM 34 H GLN A 3 10.328 3.083 23.492 1.00 0.00 H ATOM 35 N LEU A 4 9.587 6.994 23.435 1.00 6.85 N ATOM 36 CA LEU A 4 10.409 8.137 23.064 1.00 7.90 C ATOM 37 C LEU A 4 10.089 9.301 23.984 1.00 7.97 C ATOM 38 O LEU A 4 8.917 9.572 24.257 1.00 11.44 O ATOM 39 CB LEU A 4 10.145 8.561 21.620 1.00 6.14 C ATOM 40 CG LEU A 4 10.423 7.483 20.568 1.00 8.43 C ATOM 41 CD1 LEU A 4 9.832 7.890 19.235 1.00 8.54 C ATOM 42 CD2 LEU A 4 11.902 7.267 20.400 1.00 9.69 C ATOM 43 H LEU A 4 8.555 7.119 23.461 1.00 0.00 H ATOM 44 N GLN A 5 11.126 10.003 24.443 1.00 6.81 N ATOM 45 CA GLN A 5 10.945 11.113 25.374 1.00 8.33 C ATOM 46 C GLN A 5 11.909 12.241 25.032 1.00 5.60 C ATOM 47 O GLN A 5 13.127 12.062 25.108 1.00 7.74 O ATOM 48 CB GLN A 5 11.131 10.637 26.820 1.00 8.05 C ATOM 49 CG GLN A 5 10.021 9.691 27.231 1.00 13.19 C ATOM 50 CD GLN A 5 10.334 8.857 28.449 1.00 21.43 C ATOM 51 OE1 GLN A 5 9.457 8.179 28.987 1.00 22.60 O ATOM 52 NE2 GLN A 5 11.564 8.905 28.898 1.00 18.91 N ATOM 53 HE22 GLN A 5 12.272 9.491 28.412 1.00 0.00 H ATOM 54 HE21 GLN A 5 11.832 8.357 29.740 1.00 0.00 H ATOM 55 H GLN A 5 12.086 9.754 24.130 1.00 0.00 H ATOM 56 N GLU A 6 11.353 13.396 24.665 1.00 5.02 N ATOM 57 CA GLU A 6 12.095 14.556 24.193 1.00 6.99 C ATOM 58 C GLU A 6 12.405 15.493 25.340 1.00 7.95 C ATOM 59 O GLU A 6 11.683 15.555 26.337 1.00 8.81 O ATOM 60 CB GLU A 6 11.300 15.326 23.127 1.00 5.59 C ATOM 61 CG GLU A 6 10.762 14.481 21.997 1.00 7.39 C ATOM 62 CD GLU A 6 9.371 13.952 22.266 1.00 8.27 C ATOM 63 OE1 GLU A 6 8.984 13.826 23.458 1.00 8.08 O ATOM 64 OE2 GLU A 6 8.685 13.651 21.278 1.00 8.89 O ATOM 65 H GLU A 6 10.317 13.473 24.720 1.00 0.00 H ATOM 66 N SER A 7 13.474 16.264 25.152 1.00 6.47 N ATOM 67 CA SER A 7 13.880 17.266 26.124 1.00 9.97 C ATOM 68 C SER A 7 14.652 18.376 25.421 1.00 8.36 C ATOM 69 O SER A 7 15.029 18.274 24.249 1.00 7.82 O ATOM 70 CB SER A 7 14.722 16.649 27.252 1.00 12.42 C ATOM 71 OG SER A 7 15.934 16.102 26.767 1.00 14.96 O ATOM 72 HG SER A 7 16.468 16.816 26.336 1.00 0.00 H ATOM 73 H SER A 7 14.035 16.146 24.284 1.00 0.00 H ATOM 74 N GLY A 8 14.854 19.462 26.162 1.00 10.05 N ATOM 75 CA GLY A 8 15.765 20.513 25.758 1.00 9.63 C ATOM 76 C GLY A 8 15.124 21.738 25.166 1.00 9.38 C ATOM 77 O GLY A 8 15.829 22.701 24.875 1.00 10.03 O ATOM 78 H GLY A 8 14.341 19.560 27.061 1.00 0.00 H ATOM 79 N GLY A 9 13.815 21.741 24.995 1.00 8.56 N ATOM 80 CA GLY A 9 13.160 22.842 24.334 1.00 9.86 C ATOM 81 C GLY A 9 13.022 24.053 25.225 1.00 9.83 C ATOM 82 O GLY A 9 13.468 24.095 26.375 1.00 10.24 O ATOM 83 H GLY A 9 13.250 20.940 25.341 1.00 0.00 H ATOM 84 N GLY A 10 12.389 25.068 24.657 1.00 7.86 N ATOM 85 CA GLY A 10 12.021 26.236 25.430 1.00 6.74 C ATOM 86 C GLY A 10 11.910 27.454 24.532 1.00 8.88 C ATOM 87 O GLY A 10 11.711 27.344 23.323 1.00 10.04 O ATOM 88 H GLY A 10 12.154 25.026 23.645 1.00 0.00 H ATOM 89 N SER A 11 12.063 28.615 25.154 1.00 6.71 N ATOM 90 CA SER A 11 11.916 29.871 24.443 1.00 6.74 C ATOM 91 C SER A 11 13.289 30.458 24.153 1.00 8.99 C ATOM 92 O SER A 11 14.195 30.403 24.990 1.00 10.06 O ATOM 93 CB SER A 11 11.075 30.858 25.252 1.00 9.66 C ATOM 94 OG SER A 11 9.746 30.369 25.359 1.00 9.92 O ATOM 95 HG SER A 11 9.201 31.009 25.883 1.00 0.00 H ATOM 96 H SER A 11 12.292 28.625 26.168 1.00 0.00 H ATOM 97 N VAL A 12 13.442 30.996 22.951 1.00 7.55 N ATOM 98 CA VAL A 12 14.726 31.459 22.457 1.00 9.43 C ATOM 99 C VAL A 12 14.465 32.639 21.527 1.00 10.25 C ATOM 100 O VAL A 12 13.413 32.732 20.889 1.00 8.79 O ATOM 101 CB VAL A 12 15.476 30.309 21.737 1.00 9.49 C ATOM 102 CG1 VAL A 12 14.629 29.796 20.589 1.00 12.79 C ATOM 103 CG2 VAL A 12 16.840 30.740 21.262 1.00 12.51 C ATOM 104 H VAL A 12 12.608 31.090 22.337 1.00 0.00 H ATOM 105 N GLN A 13 15.415 33.555 21.470 1.00 11.20 N ATOM 106 CA GLN A 13 15.266 34.704 20.592 1.00 11.59 C ATOM 107 C GLN A 13 15.556 34.326 19.148 1.00 11.49 C ATOM 108 O GLN A 13 16.366 33.440 18.866 1.00 12.57 O ATOM 109 CB GLN A 13 16.203 35.824 21.019 1.00 12.99 C ATOM 110 CG GLN A 13 15.847 36.433 22.351 1.00 15.35 C ATOM 111 CD GLN A 13 16.853 37.478 22.777 1.00 16.21 C ATOM 112 OE1 GLN A 13 17.863 37.686 22.110 1.00 20.37 O ATOM 113 NE2 GLN A 13 16.577 38.150 23.894 1.00 16.23 N ATOM 114 HE22 GLN A 13 15.709 37.939 24.427 1.00 0.00 H ATOM 115 HE21 GLN A 13 17.230 38.885 24.233 1.00 0.00 H ATOM 116 H GLN A 13 16.270 33.454 22.054 1.00 0.00 H ATOM 117 N ALA A 14 14.900 35.030 18.227 1.00 13.30 N ATOM 118 CA ALA A 14 15.158 34.819 16.813 1.00 13.17 C ATOM 119 C ALA A 14 16.640 35.026 16.524 1.00 8.62 C ATOM 120 O ALA A 14 17.294 35.893 17.118 1.00 11.88 O ATOM 121 CB ALA A 14 14.304 35.767 15.969 1.00 17.31 C ATOM 122 H ALA A 14 14.197 35.737 18.523 1.00 0.00 H ATOM 123 N GLY A 15 17.178 34.184 15.638 1.00 9.94 N ATOM 124 CA GLY A 15 18.595 34.120 15.368 1.00 10.81 C ATOM 125 C GLY A 15 19.354 33.171 16.268 1.00 10.10 C ATOM 126 O GLY A 15 20.539 32.909 16.007 1.00 14.67 O ATOM 127 H GLY A 15 16.546 33.543 15.117 1.00 0.00 H ATOM 128 N GLY A 16 18.706 32.645 17.310 1.00 9.50 N ATOM 129 CA GLY A 16 19.382 31.845 18.302 1.00 8.20 C ATOM 130 C GLY A 16 19.540 30.393 17.899 1.00 9.85 C ATOM 131 O GLY A 16 19.151 29.954 16.817 1.00 8.99 O ATOM 132 H GLY A 16 17.685 32.817 17.409 1.00 0.00 H ATOM 133 N SER A 17 20.126 29.635 18.821 1.00 9.22 N ATOM 134 CA SER A 17 20.414 28.222 18.636 1.00 9.18 C ATOM 135 C SER A 17 19.798 27.425 19.775 1.00 6.93 C ATOM 136 O SER A 17 19.566 27.944 20.867 1.00 9.91 O ATOM 137 CB SER A 17 21.925 27.950 18.600 1.00 10.68 C ATOM 138 OG SER A 17 22.575 28.632 17.538 1.00 11.15 O ATOM 139 HG SER A 17 22.191 28.338 16.674 1.00 0.00 H ATOM 140 H SER A 17 20.393 30.077 19.724 1.00 0.00 H ATOM 141 N LEU A 18 19.573 26.139 19.525 1.00 5.67 N ATOM 142 CA LEU A 18 18.972 25.245 20.506 1.00 7.76 C ATOM 143 C LEU A 18 19.308 23.825 20.086 1.00 7.20 C ATOM 144 O LEU A 18 19.376 23.552 18.890 1.00 10.52 O ATOM 145 CB LEU A 18 17.446 25.435 20.568 1.00 11.17 C ATOM 146 CG LEU A 18 16.710 24.845 21.764 1.00 16.23 C ATOM 147 CD1 LEU A 18 17.410 25.243 23.042 1.00 16.66 C ATOM 148 CD2 LEU A 18 15.283 25.340 21.748 1.00 14.60 C ATOM 149 H LEU A 18 19.836 25.757 18.594 1.00 0.00 H ATOM 150 N ARG A 19 19.549 22.930 21.043 1.00 6.38 N ATOM 151 CA ARG A 19 19.714 21.518 20.701 1.00 6.01 C ATOM 152 C ARG A 19 18.699 20.691 21.478 1.00 6.10 C ATOM 153 O ARG A 19 18.739 20.659 22.712 1.00 9.20 O ATOM 154 CB ARG A 19 21.138 21.029 20.966 1.00 9.08 C ATOM 155 CG ARG A 19 21.281 19.540 20.743 1.00 10.61 C ATOM 156 CD ARG A 19 22.724 19.050 20.917 1.00 18.03 C ATOM 157 NE ARG A 19 23.657 19.484 19.867 1.00 25.35 N ATOM 158 CZ ARG A 19 23.727 18.939 18.651 1.00 21.57 C ATOM 159 NH1 ARG A 19 24.621 19.368 17.751 1.00 12.38 N ATOM 160 NH2 ARG A 19 22.884 17.968 18.321 1.00 23.67 N ATOM 161 HE ARG A 19 24.305 20.267 20.086 1.00 0.00 H ATOM 162 HH12 ARG A 19 24.661 18.931 16.808 1.00 0.00 H ATOM 163 HH11 ARG A 19 25.276 20.138 17.995 1.00 0.00 H ATOM 164 HH22 ARG A 19 22.931 17.537 17.376 1.00 0.00 H ATOM 165 HH21 ARG A 19 22.176 17.638 19.008 1.00 0.00 H ATOM 166 H ARG A 19 19.620 23.236 22.034 1.00 0.00 H ATOM 167 N LEU A 20 17.809 20.011 20.754 1.00 4.41 N ATOM 168 CA LEU A 20 16.842 19.093 21.336 1.00 5.95 C ATOM 169 C LEU A 20 17.416 17.685 21.418 1.00 5.29 C ATOM 170 O LEU A 20 18.276 17.300 20.625 1.00 6.15 O ATOM 171 CB LEU A 20 15.560 19.049 20.508 1.00 5.45 C ATOM 172 CG LEU A 20 14.981 20.414 20.164 1.00 6.48 C ATOM 173 CD1 LEU A 20 13.675 20.179 19.456 1.00 7.93 C ATOM 174 CD2 LEU A 20 14.744 21.191 21.425 1.00 9.89 C ATOM 175 H LEU A 20 17.806 20.144 19.722 1.00 0.00 H ATOM 176 N SER A 21 16.910 16.915 22.384 1.00 6.80 N ATOM 177 CA SER A 21 17.284 15.517 22.555 1.00 6.26 C ATOM 178 C SER A 21 16.037 14.651 22.642 1.00 6.26 C ATOM 179 O SER A 21 14.969 15.095 23.072 1.00 6.90 O ATOM 180 CB SER A 21 18.122 15.298 23.825 1.00 9.04 C ATOM 181 OG SER A 21 19.220 16.191 23.877 1.00 13.02 O ATOM 182 HG SER A 21 19.739 16.026 24.704 1.00 0.00 H ATOM 183 H SER A 21 16.220 17.330 23.042 1.00 0.00 H ATOM 184 N CYS A 22 16.181 13.393 22.232 1.00 4.62 N ATOM 185 CA CYS A 22 15.148 12.401 22.482 1.00 5.85 C ATOM 186 C CYS A 22 15.795 11.073 22.822 1.00 7.75 C ATOM 187 O CYS A 22 16.651 10.579 22.081 1.00 7.56 O ATOM 188 CB CYS A 22 14.247 12.229 21.277 1.00 6.79 C ATOM 189 SG CYS A 22 12.869 11.133 21.626 1.00 13.57 S ATOM 190 H CYS A 22 17.046 13.115 21.725 1.00 0.00 H ATOM 191 N VAL A 23 15.395 10.517 23.942 1.00 7.51 N ATOM 192 CA VAL A 23 15.877 9.208 24.348 1.00 6.72 C ATOM 193 C VAL A 23 14.865 8.154 23.915 1.00 7.58 C ATOM 194 O VAL A 23 13.651 8.393 23.878 1.00 7.38 O ATOM 195 CB VAL A 23 16.134 9.166 25.869 1.00 7.02 C ATOM 196 CG1 VAL A 23 17.292 10.084 26.253 1.00 10.68 C ATOM 197 CG2 VAL A 23 14.895 9.545 26.636 1.00 8.27 C ATOM 198 H VAL A 23 14.720 11.023 24.550 1.00 0.00 H ATOM 199 N VAL A 24 15.375 6.975 23.566 1.00 6.42 N ATOM 200 CA VAL A 24 14.553 5.853 23.128 1.00 8.61 C ATOM 201 C VAL A 24 14.813 4.658 24.032 1.00 7.60 C ATOM 202 O VAL A 24 15.939 4.446 24.497 1.00 7.46 O ATOM 203 CB VAL A 24 14.813 5.494 21.647 1.00 7.20 C ATOM 204 CG1 VAL A 24 16.242 5.088 21.436 1.00 9.55 C ATOM 205 CG2 VAL A 24 13.895 4.367 21.197 1.00 11.40 C ATOM 206 H VAL A 24 16.406 6.848 23.608 1.00 0.00 H ATOM 207 N SER A 25 13.759 3.896 24.292 1.00 7.00 N ATOM 208 CA SER A 25 13.883 2.628 24.986 1.00 7.60 C ATOM 209 C SER A 25 12.918 1.637 24.363 1.00 9.63 C ATOM 210 O SER A 25 11.975 2.010 23.666 1.00 8.51 O ATOM 211 CB SER A 25 13.597 2.786 26.478 1.00 9.43 C ATOM 212 OG SER A 25 12.269 3.252 26.688 1.00 7.93 O ATOM 213 HG SER A 25 11.628 2.602 26.306 1.00 0.00 H ATOM 214 H SER A 25 12.817 4.217 23.990 1.00 0.00 H ATOM 215 N GLY A 26 13.153 0.361 24.640 1.00 9.80 N ATOM 216 CA GLY A 26 12.284 -0.687 24.145 1.00 9.98 C ATOM 217 C GLY A 26 12.873 -1.421 22.959 1.00 13.23 C ATOM 218 O GLY A 26 13.954 -1.107 22.451 1.00 15.58 O ATOM 219 H GLY A 26 13.976 0.108 25.223 1.00 0.00 H ATOM 220 N ASN A 27 12.125 -2.430 22.518 1.00 18.39 N ATOM 221 CA ASN A 27 12.557 -3.302 21.430 1.00 18.84 C ATOM 222 C ASN A 27 12.283 -2.594 20.112 1.00 18.73 C ATOM 223 O ASN A 27 11.188 -2.659 19.553 1.00 19.83 O ATOM 224 CB ASN A 27 11.841 -4.645 21.506 1.00 20.95 C ATOM 225 CG ASN A 27 12.438 -5.675 20.573 1.00 28.31 C ATOM 226 OD1 ASN A 27 13.529 -5.483 20.024 1.00 27.29 O ATOM 227 ND2 ASN A 27 11.723 -6.781 20.387 1.00 30.08 N ATOM 228 HD22 ASN A 27 10.810 -6.897 20.871 1.00 0.00 H ATOM 229 HD21 ASN A 27 12.077 -7.529 19.757 1.00 0.00 H ATOM 230 H ASN A 27 11.201 -2.603 22.964 1.00 0.00 H ATOM 231 N THR A 28 13.298 -1.886 19.619 1.00 16.30 N ATOM 232 CA THR A 28 13.185 -1.147 18.368 1.00 15.45 C ATOM 233 C THR A 28 13.535 -1.972 17.140 1.00 14.42 C ATOM 234 O THR A 28 13.127 -1.605 16.035 1.00 15.32 O ATOM 235 CB THR A 28 14.113 0.070 18.369 1.00 10.93 C ATOM 236 OG1 THR A 28 15.478 -0.369 18.448 1.00 11.80 O ATOM 237 CG2 THR A 28 13.810 1.008 19.527 1.00 15.10 C ATOM 238 HG1 THR A 28 15.685 -0.942 17.668 1.00 0.00 H ATOM 239 H THR A 28 14.197 -1.860 20.142 1.00 0.00 H ATOM 240 N GLY A 29 14.303 -3.048 17.292 1.00 11.98 N ATOM 241 CA GLY A 29 15.001 -3.620 16.157 1.00 14.13 C ATOM 242 C GLY A 29 16.145 -2.707 15.717 1.00 12.69 C ATOM 243 O GLY A 29 16.380 -1.647 16.285 1.00 14.08 O ATOM 244 H GLY A 29 14.403 -3.482 18.232 1.00 0.00 H ATOM 245 N SER A 30 16.861 -3.133 14.671 1.00 16.60 N ATOM 246 CA SER A 30 18.120 -2.490 14.294 1.00 12.87 C ATOM 247 C SER A 30 18.006 -1.509 13.128 1.00 14.15 C ATOM 248 O SER A 30 18.967 -0.769 12.863 1.00 14.28 O ATOM 249 CB SER A 30 19.169 -3.554 13.944 1.00 19.97 C ATOM 250 OG SER A 30 18.781 -4.279 12.790 1.00 26.40 O ATOM 251 HG SER A 30 19.470 -4.959 12.582 1.00 0.00 H ATOM 252 H SER A 30 16.515 -3.940 14.113 1.00 0.00 H ATOM 253 N THR A 31 16.867 -1.464 12.439 1.00 15.11 N ATOM 254 CA THR A 31 16.775 -0.695 11.207 1.00 13.75 C ATOM 255 C THR A 31 15.488 0.118 11.181 1.00 12.82 C ATOM 256 O THR A 31 14.434 -0.355 11.606 1.00 13.89 O ATOM 257 CB THR A 31 16.859 -1.624 9.986 1.00 19.90 C ATOM 258 OG1 THR A 31 16.798 -0.852 8.781 1.00 23.70 O ATOM 259 CG2 THR A 31 15.742 -2.629 9.995 1.00 19.54 C ATOM 260 HG1 THR A 31 17.555 -0.215 8.760 1.00 0.00 H ATOM 261 H THR A 31 16.035 -1.984 12.785 1.00 0.00 H ATOM 262 N GLY A 32 15.554 1.340 10.673 1.00 9.36 N ATOM 263 CA GLY A 32 14.332 2.107 10.573 1.00 9.62 C ATOM 264 C GLY A 32 14.610 3.596 10.542 1.00 6.47 C ATOM 265 O GLY A 32 15.757 4.039 10.406 1.00 7.13 O ATOM 266 H GLY A 32 16.461 1.737 10.355 1.00 0.00 H ATOM 267 N TYR A 33 13.514 4.346 10.609 1.00 6.74 N ATOM 268 CA TYR A 33 13.535 5.802 10.595 1.00 5.94 C ATOM 269 C TYR A 33 13.378 6.375 11.997 1.00 5.62 C ATOM 270 O TYR A 33 12.530 5.930 12.783 1.00 6.86 O ATOM 271 CB TYR A 33 12.406 6.353 9.720 1.00 7.68 C ATOM 272 CG TYR A 33 12.557 6.094 8.238 1.00 8.47 C ATOM 273 CD1 TYR A 33 12.075 4.923 7.664 1.00 10.23 C ATOM 274 CD2 TYR A 33 13.168 7.030 7.411 1.00 11.36 C ATOM 275 CE1 TYR A 33 12.219 4.690 6.303 1.00 14.35 C ATOM 276 CE2 TYR A 33 13.308 6.805 6.057 1.00 12.37 C ATOM 277 CZ TYR A 33 12.831 5.640 5.511 1.00 17.36 C ATOM 278 OH TYR A 33 12.980 5.422 4.153 1.00 21.67 O ATOM 279 HH TYR A 33 12.516 6.139 3.652 1.00 0.00 H ATOM 280 H TYR A 33 12.593 3.867 10.675 1.00 0.00 H ATOM 281 N TRP A 34 14.149 7.424 12.266 1.00 5.40 N ATOM 282 CA TRP A 34 14.084 8.162 13.521 1.00 8.27 C ATOM 283 C TRP A 34 13.985 9.630 13.138 1.00 4.30 C ATOM 284 O TRP A 34 14.868 10.143 12.443 1.00 5.63 O ATOM 285 CB TRP A 34 15.336 7.878 14.351 1.00 7.16 C ATOM 286 CG TRP A 34 15.230 8.001 15.843 1.00 8.38 C ATOM 287 CD1 TRP A 34 14.138 8.357 16.582 1.00 7.71 C ATOM 288 CD2 TRP A 34 16.281 7.751 16.779 1.00 9.56 C ATOM 289 NE1 TRP A 34 14.449 8.345 17.928 1.00 8.65 N ATOM 290 CE2 TRP A 34 15.765 7.994 18.067 1.00 9.21 C ATOM 291 CE3 TRP A 34 17.624 7.378 16.647 1.00 7.39 C ATOM 292 CZ2 TRP A 34 16.533 7.845 19.218 1.00 9.79 C ATOM 293 CZ3 TRP A 34 18.381 7.233 17.788 1.00 7.09 C ATOM 294 CH2 TRP A 34 17.829 7.479 19.065 1.00 7.72 C ATOM 295 HE1 TRP A 34 13.794 8.565 18.705 1.00 0.00 H ATOM 296 H TRP A 34 14.832 7.733 11.545 1.00 0.00 H ATOM 297 N ALA A 35 12.925 10.308 13.574 1.00 4.58 N ATOM 298 CA ALA A 35 12.570 11.576 12.948 1.00 4.71 C ATOM 299 C ALA A 35 12.131 12.616 13.966 1.00 4.49 C ATOM 300 O ALA A 35 11.694 12.303 15.074 1.00 5.53 O ATOM 301 CB ALA A 35 11.440 11.404 11.936 1.00 6.41 C ATOM 302 H ALA A 35 12.353 9.934 14.358 1.00 0.00 H ATOM 303 N TRP A 36 12.252 13.874 13.547 1.00 5.23 N ATOM 304 CA TRP A 36 11.713 15.021 14.264 1.00 4.81 C ATOM 305 C TRP A 36 10.574 15.613 13.455 1.00 5.43 C ATOM 306 O TRP A 36 10.718 15.824 12.243 1.00 5.68 O ATOM 307 CB TRP A 36 12.781 16.089 14.492 1.00 4.42 C ATOM 308 CG TRP A 36 13.781 15.721 15.535 1.00 4.51 C ATOM 309 CD1 TRP A 36 15.032 15.198 15.327 1.00 6.52 C ATOM 310 CD2 TRP A 36 13.626 15.854 16.957 1.00 5.94 C ATOM 311 NE1 TRP A 36 15.657 14.992 16.533 1.00 6.41 N ATOM 312 CE2 TRP A 36 14.825 15.394 17.547 1.00 4.97 C ATOM 313 CE3 TRP A 36 12.591 16.321 17.790 1.00 6.12 C ATOM 314 CZ2 TRP A 36 15.010 15.367 18.935 1.00 5.20 C ATOM 315 CZ3 TRP A 36 12.785 16.293 19.184 1.00 8.13 C ATOM 316 CH2 TRP A 36 13.988 15.823 19.727 1.00 6.38 C ATOM 317 HE1 TRP A 36 16.610 14.594 16.658 1.00 0.00 H ATOM 318 H TRP A 36 12.761 14.047 12.657 1.00 0.00 H ATOM 319 N PHE A 37 9.472 15.909 14.139 1.00 5.31 N ATOM 320 CA PHE A 37 8.325 16.581 13.561 1.00 3.59 C ATOM 321 C PHE A 37 8.068 17.850 14.350 1.00 7.23 C ATOM 322 O PHE A 37 8.417 17.937 15.525 1.00 6.98 O ATOM 323 CB PHE A 37 7.086 15.676 13.621 1.00 6.99 C ATOM 324 CG PHE A 37 7.083 14.613 12.575 1.00 6.08 C ATOM 325 CD1 PHE A 37 7.803 13.424 12.762 1.00 7.19 C ATOM 326 CD2 PHE A 37 6.400 14.810 11.385 1.00 6.33 C ATOM 327 CE1 PHE A 37 7.827 12.452 11.770 1.00 7.44 C ATOM 328 CE2 PHE A 37 6.423 13.843 10.388 1.00 5.76 C ATOM 329 CZ PHE A 37 7.132 12.663 10.590 1.00 8.01 C ATOM 330 H PHE A 37 9.431 15.644 15.144 1.00 0.00 H ATOM 331 N ARG A 38 7.445 18.841 13.726 1.00 7.32 N ATOM 332 CA ARG A 38 6.988 19.958 14.541 1.00 7.00 C ATOM 333 C ARG A 38 5.500 20.213 14.322 1.00 9.29 C ATOM 334 O ARG A 38 5.002 20.102 13.202 1.00 8.79 O ATOM 335 CB ARG A 38 7.796 21.202 14.277 1.00 10.39 C ATOM 336 CG ARG A 38 7.835 21.650 12.866 1.00 10.80 C ATOM 337 CD ARG A 38 8.883 22.728 12.762 1.00 13.65 C ATOM 338 NE ARG A 38 8.942 23.346 11.447 1.00 20.02 N ATOM 339 CZ ARG A 38 9.929 24.149 11.065 1.00 19.52 C ATOM 340 NH1 ARG A 38 10.940 24.405 11.899 1.00 9.27 N ATOM 341 NH2 ARG A 38 9.914 24.677 9.847 1.00 18.90 N ATOM 342 HE ARG A 38 8.175 23.150 10.773 1.00 0.00 H ATOM 343 HH12 ARG A 38 11.713 25.033 11.601 1.00 0.00 H ATOM 344 HH11 ARG A 38 10.954 23.976 12.846 1.00 0.00 H ATOM 345 HH22 ARG A 38 10.684 25.306 9.543 1.00 0.00 H ATOM 346 HH21 ARG A 38 9.132 24.461 9.196 1.00 0.00 H ATOM 347 H ARG A 38 7.289 18.821 12.698 1.00 0.00 H ATOM 348 N GLN A 39 4.787 20.490 15.410 1.00 11.35 N ATOM 349 CA GLN A 39 3.395 20.944 15.353 1.00 15.84 C ATOM 350 C GLN A 39 3.385 22.432 15.681 1.00 18.40 C ATOM 351 O GLN A 39 3.504 22.804 16.847 1.00 16.89 O ATOM 352 CB GLN A 39 2.516 20.178 16.333 1.00 23.64 C ATOM 353 CG GLN A 39 2.710 18.689 16.348 1.00 17.84 C ATOM 354 CD GLN A 39 1.837 18.006 17.389 1.00 21.89 C ATOM 355 OE1 GLN A 39 1.589 16.807 17.308 1.00 17.77 O ATOM 356 NE2 GLN A 39 1.392 18.761 18.386 1.00 25.48 N ATOM 357 HE22 GLN A 39 1.626 19.774 18.416 1.00 0.00 H ATOM 358 HE21 GLN A 39 0.809 18.340 19.137 1.00 0.00 H ATOM 359 H GLN A 39 5.237 20.380 16.341 1.00 0.00 H ATOM 360 N GLY A 40 3.250 23.282 14.658 1.00 16.73 N ATOM 361 CA GLY A 40 3.236 24.717 14.847 1.00 21.77 C ATOM 362 C GLY A 40 1.852 25.245 15.181 1.00 26.77 C ATOM 363 O GLY A 40 0.853 24.525 15.084 1.00 27.33 O ATOM 364 H GLY A 40 3.152 22.900 13.696 1.00 0.00 H ATOM 365 N PRO A 41 1.760 26.524 15.579 1.00 23.29 N ATOM 366 CA PRO A 41 0.461 27.085 15.987 1.00 25.08 C ATOM 367 C PRO A 41 -0.587 27.085 14.873 1.00 27.94 C ATOM 368 O PRO A 41 -0.770 28.111 14.222 1.00 34.59 O ATOM 369 CB PRO A 41 0.808 28.519 16.402 1.00 24.36 C ATOM 370 CG PRO A 41 2.086 28.827 15.700 1.00 27.82 C ATOM 371 CD PRO A 41 2.836 27.532 15.603 1.00 25.32 C TER 372 PRO A 41 ATOM 373 N ARG A 45 1.405 19.260 11.318 1.00 25.04 N ATOM 374 CA ARG A 45 2.474 18.408 11.836 1.00 21.49 C ATOM 375 C ARG A 45 3.468 18.004 10.746 1.00 16.78 C ATOM 376 O ARG A 45 3.280 16.996 10.058 1.00 20.86 O ATOM 377 CB ARG A 45 1.891 17.162 12.486 1.00 23.94 C ATOM 378 CG ARG A 45 2.952 16.245 13.059 1.00 17.17 C ATOM 379 CD ARG A 45 2.375 15.044 13.792 1.00 24.25 C ATOM 380 NE ARG A 45 1.419 15.415 14.830 1.00 25.40 N ATOM 381 CZ ARG A 45 0.109 15.187 14.754 1.00 25.97 C ATOM 382 NH1 ARG A 45 -0.694 15.542 15.749 1.00 26.25 N ATOM 383 NH2 ARG A 45 -0.399 14.580 13.689 1.00 25.64 N ATOM 384 HE ARG A 45 1.783 15.887 15.682 1.00 0.00 H ATOM 385 HH12 ARG A 45 -1.716 15.361 15.682 1.00 0.00 H ATOM 386 HH11 ARG A 45 -0.301 16.002 16.595 1.00 0.00 H ATOM 387 HH22 ARG A 45 -1.422 14.402 13.630 1.00 0.00 H ATOM 388 HH21 ARG A 45 0.226 14.282 12.913 1.00 0.00 H ATOM 389 HN3 ARG A 45 0.884 18.749 10.577 1.00 0.00 H ATOM 390 HN2 ARG A 45 1.817 20.127 10.918 1.00 0.00 H ATOM 391 HN1 ARG A 45 0.756 19.509 12.092 1.00 0.00 H ATOM 392 N GLU A 46 4.532 18.781 10.590 1.00 12.57 N ATOM 393 CA GLU A 46 5.408 18.637 9.439 1.00 11.84 C ATOM 394 C GLU A 46 6.721 17.971 9.822 1.00 8.98 C ATOM 395 O GLU A 46 7.276 18.213 10.904 1.00 8.77 O ATOM 396 CB GLU A 46 5.697 19.981 8.770 1.00 19.81 C ATOM 397 CG GLU A 46 6.398 20.977 9.651 1.00 20.39 C ATOM 398 CD GLU A 46 7.026 22.113 8.862 1.00 26.70 C ATOM 399 OE1 GLU A 46 6.942 22.092 7.613 1.00 30.31 O ATOM 400 OE2 GLU A 46 7.595 23.031 9.498 1.00 25.80 O ATOM 401 H GLU A 46 4.743 19.507 11.304 1.00 0.00 H ATOM 402 N GLY A 47 7.202 17.136 8.908 1.00 8.71 N ATOM 403 CA GLY A 47 8.508 16.521 9.071 1.00 7.10 C ATOM 404 C GLY A 47 9.611 17.558 8.980 1.00 8.51 C ATOM 405 O GLY A 47 9.647 18.378 8.054 1.00 8.76 O ATOM 406 H GLY A 47 6.635 16.919 8.063 1.00 0.00 H ATOM 407 N VAL A 48 10.520 17.524 9.945 1.00 6.85 N ATOM 408 CA VAL A 48 11.626 18.457 10.022 1.00 6.38 C ATOM 409 C VAL A 48 12.906 17.810 9.519 1.00 5.44 C ATOM 410 O VAL A 48 13.581 18.335 8.637 1.00 6.52 O ATOM 411 CB VAL A 48 11.773 18.953 11.485 1.00 7.06 C ATOM 412 CG1 VAL A 48 12.996 19.821 11.660 1.00 9.05 C ATOM 413 CG2 VAL A 48 10.533 19.727 11.924 1.00 8.72 C ATOM 414 H VAL A 48 10.435 16.794 10.681 1.00 0.00 H ATOM 415 N ALA A 49 13.227 16.636 10.063 1.00 5.09 N ATOM 416 CA ALA A 49 14.436 15.926 9.677 1.00 4.55 C ATOM 417 C ALA A 49 14.283 14.488 10.119 1.00 3.99 C ATOM 418 O ALA A 49 13.509 14.176 11.023 1.00 6.06 O ATOM 419 CB ALA A 49 15.694 16.559 10.291 1.00 5.81 C ATOM 420 H ALA A 49 12.599 16.219 10.779 1.00 0.00 H ATOM 421 N ALA A 50 15.011 13.603 9.443 1.00 3.69 N ATOM 422 CA ALA A 50 14.940 12.196 9.808 1.00 6.09 C ATOM 423 C ALA A 50 16.225 11.499 9.412 1.00 5.46 C ATOM 424 O ALA A 50 16.935 11.935 8.508 1.00 6.84 O ATOM 425 CB ALA A 50 13.750 11.483 9.147 1.00 6.24 C ATOM 426 H ALA A 50 15.624 13.913 8.662 1.00 0.00 H ATOM 427 N THR A 51 16.533 10.428 10.131 1.00 5.93 N ATOM 428 CA THR A 51 17.667 9.580 9.798 1.00 6.54 C ATOM 429 C THR A 51 17.179 8.153 9.642 1.00 7.48 C ATOM 430 O THR A 51 16.435 7.653 10.489 1.00 8.93 O ATOM 431 CB THR A 51 18.748 9.650 10.869 1.00 8.85 C ATOM 432 OG1 THR A 51 19.270 10.980 10.926 1.00 12.47 O ATOM 433 CG2 THR A 51 19.887 8.703 10.524 1.00 11.33 C ATOM 434 HG1 THR A 51 19.973 11.028 11.622 1.00 0.00 H ATOM 435 H THR A 51 15.947 10.188 10.956 1.00 0.00 H ATOM 436 N TYR A 52 17.579 7.521 8.553 1.00 9.96 N ATOM 437 CA TYR A 52 17.343 6.103 8.353 1.00 9.53 C ATOM 438 C TYR A 52 18.613 5.371 8.753 1.00 9.21 C ATOM 439 O TYR A 52 19.696 5.698 8.259 1.00 11.92 O ATOM 440 CB TYR A 52 16.980 5.810 6.897 1.00 9.07 C ATOM 441 CG TYR A 52 16.953 4.352 6.573 1.00 12.80 C ATOM 442 CD1 TYR A 52 15.820 3.588 6.822 1.00 13.49 C ATOM 443 CD2 TYR A 52 18.066 3.734 6.022 1.00 12.63 C ATOM 444 CE1 TYR A 52 15.797 2.225 6.517 1.00 18.73 C ATOM 445 CE2 TYR A 52 18.058 2.394 5.725 1.00 19.02 C ATOM 446 CZ TYR A 52 16.924 1.646 5.967 1.00 16.05 C ATOM 447 OH TYR A 52 16.953 0.307 5.655 1.00 17.93 O ATOM 448 HH TYR A 52 16.080 -0.102 5.879 1.00 0.00 H ATOM 449 H TYR A 52 18.079 8.057 7.815 1.00 0.00 H ATOM 450 N THR A 53 18.492 4.409 9.661 1.00 9.41 N ATOM 451 CA THR A 53 19.632 3.600 10.072 1.00 11.38 C ATOM 452 C THR A 53 19.438 2.215 9.484 1.00 15.44 C ATOM 453 O THR A 53 18.427 1.563 9.760 1.00 13.71 O ATOM 454 CB THR A 53 19.760 3.551 11.593 1.00 13.91 C ATOM 455 OG1 THR A 53 19.996 4.877 12.084 1.00 15.07 O ATOM 456 CG2 THR A 53 20.923 2.639 12.009 1.00 15.77 C ATOM 457 HG1 THR A 53 19.238 5.461 11.831 1.00 0.00 H ATOM 458 H THR A 53 17.561 4.229 10.089 1.00 0.00 H ATOM 459 N ALA A 54 20.401 1.778 8.667 1.00 22.95 N ATOM 460 CA ALA A 54 20.271 0.519 7.943 1.00 22.16 C ATOM 461 C ALA A 54 20.667 -0.679 8.791 1.00 23.90 C ATOM 462 O ALA A 54 20.182 -1.789 8.547 1.00 33.04 O ATOM 463 CB ALA A 54 21.122 0.557 6.671 1.00 27.85 C ATOM 464 H ALA A 54 21.262 2.348 8.545 1.00 0.00 H ATOM 465 N GLY A 55 21.532 -0.483 9.780 1.00 26.21 N ATOM 466 CA GLY A 55 22.014 -1.597 10.573 1.00 33.15 C ATOM 467 C GLY A 55 23.113 -2.390 9.903 1.00 36.73 C ATOM 468 O GLY A 55 23.119 -3.624 9.981 1.00 32.20 O ATOM 469 H GLY A 55 21.867 0.479 9.988 1.00 0.00 H ATOM 470 N SER A 56 24.050 -1.713 9.246 1.00 38.26 N ATOM 471 CA SER A 56 25.090 -2.387 8.482 1.00 34.99 C ATOM 472 C SER A 56 26.312 -1.492 8.326 1.00 37.63 C ATOM 473 O SER A 56 26.974 -1.158 9.309 1.00 41.10 O ATOM 474 CB SER A 56 24.555 -2.807 7.108 1.00 37.59 C ATOM 475 OG SER A 56 23.605 -1.872 6.622 1.00 37.45 O ATOM 476 HG SER A 56 23.277 -2.167 5.736 1.00 0.00 H ATOM 477 H SER A 56 24.040 -0.674 9.279 1.00 0.00 H TER 478 SER A 56 ATOM 479 N THR A 58 24.453 1.187 7.104 1.00 34.23 N ATOM 480 CA THR A 58 24.908 2.531 7.446 1.00 28.69 C ATOM 481 C THR A 58 23.722 3.473 7.694 1.00 29.37 C ATOM 482 O THR A 58 22.838 3.135 8.468 1.00 24.25 O ATOM 483 CB THR A 58 25.833 3.099 6.359 1.00 33.98 C ATOM 484 OG1 THR A 58 25.084 3.347 5.161 1.00 39.16 O ATOM 485 CG2 THR A 58 26.976 2.124 6.075 1.00 37.47 C ATOM 486 HG1 THR A 58 25.687 3.713 4.466 1.00 0.00 H ATOM 487 HN3 THR A 58 23.875 1.227 6.241 1.00 0.00 H ATOM 488 HN2 THR A 58 23.884 0.805 7.886 1.00 0.00 H ATOM 489 HN1 THR A 58 25.277 0.574 6.942 1.00 0.00 H ATOM 490 N SER A 59 23.688 4.638 7.050 1.00 29.76 N ATOM 491 CA SER A 59 22.741 5.651 7.498 1.00 22.45 C ATOM 492 C SER A 59 22.465 6.663 6.393 1.00 24.55 C ATOM 493 O SER A 59 23.344 6.971 5.584 1.00 26.80 O ATOM 494 CB SER A 59 23.286 6.347 8.746 1.00 23.99 C ATOM 495 OG SER A 59 22.290 7.063 9.441 1.00 26.90 O ATOM 496 HG SER A 59 21.575 6.440 9.726 1.00 0.00 H ATOM 497 H SER A 59 24.322 4.821 6.246 1.00 0.00 H ATOM 498 N MET A 60 21.229 7.187 6.377 1.00 15.59 N ATOM 499 CA MET A 60 20.817 8.233 5.449 1.00 14.09 C ATOM 500 C MET A 60 20.020 9.282 6.211 1.00 10.84 C ATOM 501 O MET A 60 19.166 8.939 7.034 1.00 12.93 O ATOM 502 CB MET A 60 19.965 7.673 4.303 1.00 19.87 C ATOM 503 CG MET A 60 20.777 6.911 3.255 1.00 23.95 C ATOM 504 SD MET A 60 19.834 6.508 1.771 1.00 45.12 S ATOM 505 CE MET A 60 19.974 4.723 1.789 1.00 32.86 C ATOM 506 H MET A 60 20.531 6.829 7.060 1.00 0.00 H ATOM 507 N THR A 61 20.276 10.557 5.921 1.00 10.60 N ATOM 508 CA THR A 61 19.604 11.655 6.600 1.00 9.32 C ATOM 509 C THR A 61 18.854 12.521 5.599 1.00 8.92 C ATOM 510 O THR A 61 19.297 12.702 4.459 1.00 11.49 O ATOM 511 CB THR A 61 20.629 12.495 7.381 1.00 13.20 C ATOM 512 OG1 THR A 61 21.042 11.753 8.535 1.00 13.59 O ATOM 513 CG2 THR A 61 20.043 13.798 7.834 1.00 10.70 C ATOM 514 HG1 THR A 61 21.703 12.283 9.048 1.00 0.00 H ATOM 515 H THR A 61 20.979 10.775 5.186 1.00 0.00 H ATOM 516 N TYR A 62 17.716 13.063 6.050 1.00 8.19 N ATOM 517 CA TYR A 62 16.806 13.861 5.239 1.00 9.09 C ATOM 518 C TYR A 62 16.397 15.113 5.997 1.00 7.38 C ATOM 519 O TYR A 62 16.188 15.069 7.212 1.00 6.75 O ATOM 520 CB TYR A 62 15.535 13.077 4.888 1.00 11.32 C ATOM 521 CG TYR A 62 15.747 11.746 4.214 1.00 13.88 C ATOM 522 CD1 TYR A 62 15.888 10.583 4.965 1.00 13.50 C ATOM 523 CD2 TYR A 62 15.769 11.649 2.829 1.00 15.11 C ATOM 524 CE1 TYR A 62 16.063 9.357 4.347 1.00 16.17 C ATOM 525 CE2 TYR A 62 15.949 10.428 2.203 1.00 18.52 C ATOM 526 CZ TYR A 62 16.097 9.290 2.967 1.00 19.59 C ATOM 527 OH TYR A 62 16.270 8.066 2.356 1.00 25.36 O ATOM 528 HH TYR A 62 15.486 7.870 1.784 1.00 0.00 H ATOM 529 H TYR A 62 17.465 12.904 7.046 1.00 0.00 H ATOM 530 N TYR A 63 16.250 16.224 5.267 1.00 7.65 N ATOM 531 CA TYR A 63 15.804 17.485 5.849 1.00 8.43 C ATOM 532 C TYR A 63 14.675 18.087 5.037 1.00 7.80 C ATOM 533 O TYR A 63 14.672 18.004 3.810 1.00 9.53 O ATOM 534 CB TYR A 63 16.924 18.513 5.890 1.00 8.40 C ATOM 535 CG TYR A 63 18.033 18.126 6.808 1.00 6.44 C ATOM 536 CD1 TYR A 63 17.926 18.364 8.171 1.00 5.72 C ATOM 537 CD2 TYR A 63 19.179 17.488 6.320 1.00 7.86 C ATOM 538 CE1 TYR A 63 18.941 17.987 9.054 1.00 6.50 C ATOM 539 CE2 TYR A 63 20.219 17.120 7.187 1.00 6.55 C ATOM 540 CZ TYR A 63 20.087 17.381 8.558 1.00 6.28 C ATOM 541 OH TYR A 63 21.096 17.002 9.419 1.00 8.28 O ATOM 542 HH TYR A 63 20.851 17.255 10.344 1.00 0.00 H ATOM 543 H TYR A 63 16.461 16.188 4.249 1.00 0.00 H ATOM 544 N ALA A 64 13.753 18.743 5.737 1.00 6.46 N ATOM 545 CA ALA A 64 12.756 19.585 5.082 1.00 8.19 C ATOM 546 C ALA A 64 13.442 20.785 4.443 1.00 11.00 C ATOM 547 O ALA A 64 14.411 21.320 4.985 1.00 9.19 O ATOM 548 CB ALA A 64 11.719 20.070 6.095 1.00 8.84 C ATOM 549 H ALA A 64 13.742 18.654 6.773 1.00 0.00 H ATOM 550 N ASP A 65 12.920 21.226 3.294 1.00 10.59 N ATOM 551 CA ASP A 65 13.542 22.343 2.590 1.00 13.54 C ATOM 552 C ASP A 65 13.636 23.590 3.464 1.00 11.36 C ATOM 553 O ASP A 65 14.631 24.320 3.386 1.00 15.56 O ATOM 554 CB ASP A 65 12.775 22.662 1.306 1.00 13.05 C ATOM 555 CG ASP A 65 13.014 21.645 0.204 1.00 22.79 C ATOM 556 OD1 ASP A 65 13.927 20.800 0.340 1.00 21.09 O ATOM 557 OD2 ASP A 65 12.278 21.698 -0.806 1.00 27.09 O ATOM 558 H ASP A 65 12.070 20.773 2.902 1.00 0.00 H ATOM 559 N SER A 66 12.654 23.817 4.339 1.00 11.11 N ATOM 560 CA SER A 66 12.619 25.038 5.138 1.00 13.20 C ATOM 561 C SER A 66 13.656 25.069 6.254 1.00 13.83 C ATOM 562 O SER A 66 13.878 26.133 6.841 1.00 13.32 O ATOM 563 CB SER A 66 11.228 25.222 5.741 1.00 14.91 C ATOM 564 OG SER A 66 10.945 24.167 6.640 1.00 19.17 O ATOM 565 HG SER A 66 10.042 24.296 7.025 1.00 0.00 H ATOM 566 H SER A 66 11.899 23.111 4.454 1.00 0.00 H ATOM 567 N VAL A 67 14.287 23.945 6.575 1.00 9.17 N ATOM 568 CA VAL A 67 15.298 23.907 7.626 1.00 9.33 C ATOM 569 C VAL A 67 16.661 23.477 7.117 1.00 9.45 C ATOM 570 O VAL A 67 17.620 23.511 7.888 1.00 6.40 O ATOM 571 CB VAL A 67 14.864 23.002 8.804 1.00 7.35 C ATOM 572 CG1 VAL A 67 13.449 23.369 9.299 1.00 7.78 C ATOM 573 CG2 VAL A 67 14.954 21.529 8.424 1.00 7.98 C ATOM 574 H VAL A 67 14.054 23.070 6.064 1.00 0.00 H ATOM 575 N LYS A 68 16.783 23.092 5.848 1.00 7.43 N ATOM 576 CA LYS A 68 18.068 22.720 5.262 1.00 10.52 C ATOM 577 C LYS A 68 19.123 23.780 5.538 1.00 10.06 C ATOM 578 O LYS A 68 18.907 24.963 5.281 1.00 13.96 O ATOM 579 CB LYS A 68 17.879 22.546 3.754 1.00 15.23 C ATOM 580 CG LYS A 68 19.127 22.398 2.891 1.00 25.25 C ATOM 581 CD LYS A 68 20.049 21.316 3.378 1.00 27.27 C ATOM 582 CE LYS A 68 21.358 21.367 2.602 1.00 33.65 C ATOM 583 NZ LYS A 68 21.130 21.755 1.181 1.00 32.20 N ATOM 584 HZ1 LYS A 68 20.504 21.059 0.729 1.00 0.00 H ATOM 585 HZ2 LYS A 68 20.687 22.695 1.146 1.00 0.00 H ATOM 586 HZ3 LYS A 68 22.041 21.781 0.680 1.00 0.00 H ATOM 587 H LYS A 68 15.931 23.055 5.252 1.00 0.00 H ATOM 588 N GLY A 69 20.276 23.348 6.048 1.00 10.98 N ATOM 589 CA GLY A 69 21.365 24.256 6.326 1.00 11.65 C ATOM 590 C GLY A 69 21.252 25.017 7.627 1.00 12.49 C ATOM 591 O GLY A 69 22.223 25.658 8.038 1.00 10.59 O ATOM 592 H GLY A 69 20.395 22.335 6.250 1.00 0.00 H ATOM 593 N ARG A 70 20.112 24.967 8.299 1.00 8.10 N ATOM 594 CA ARG A 70 19.986 25.559 9.618 1.00 6.20 C ATOM 595 C ARG A 70 19.858 24.534 10.731 1.00 8.11 C ATOM 596 O ARG A 70 20.228 24.830 11.864 1.00 8.28 O ATOM 597 CB ARG A 70 18.763 26.481 9.679 1.00 8.27 C ATOM 598 CG ARG A 70 18.847 27.682 8.762 1.00 9.22 C ATOM 599 CD ARG A 70 17.668 28.624 8.970 1.00 10.32 C ATOM 600 NE ARG A 70 16.370 27.978 8.765 1.00 11.02 N ATOM 601 CZ ARG A 70 15.433 27.855 9.706 1.00 10.54 C ATOM 602 NH1 ARG A 70 15.644 28.328 10.927 1.00 9.74 N ATOM 603 NH2 ARG A 70 14.278 27.253 9.437 1.00 9.77 N ATOM 604 HE ARG A 70 16.165 27.589 7.822 1.00 0.00 H ATOM 605 HH12 ARG A 70 14.910 28.229 11.657 1.00 0.00 H ATOM 606 HH11 ARG A 70 16.544 28.798 11.154 1.00 0.00 H ATOM 607 HH22 ARG A 70 13.554 27.162 10.178 1.00 0.00 H ATOM 608 HH21 ARG A 70 14.099 26.873 8.486 1.00 0.00 H ATOM 609 H ARG A 70 19.290 24.494 7.873 1.00 0.00 H ATOM 610 N PHE A 71 19.302 23.366 10.448 1.00 7.93 N ATOM 611 CA PHE A 71 19.129 22.313 11.437 1.00 5.46 C ATOM 612 C PHE A 71 20.026 21.140 11.069 1.00 7.56 C ATOM 613 O PHE A 71 20.298 20.901 9.890 1.00 9.08 O ATOM 614 CB PHE A 71 17.679 21.799 11.512 1.00 8.18 C ATOM 615 CG PHE A 71 16.660 22.795 12.067 1.00 7.59 C ATOM 616 CD1 PHE A 71 16.967 24.135 12.271 1.00 8.26 C ATOM 617 CD2 PHE A 71 15.375 22.361 12.365 1.00 8.05 C ATOM 618 CE1 PHE A 71 15.986 25.020 12.768 1.00 7.37 C ATOM 619 CE2 PHE A 71 14.411 23.229 12.863 1.00 7.98 C ATOM 620 CZ PHE A 71 14.722 24.564 13.052 1.00 9.19 C ATOM 621 H PHE A 71 18.975 23.194 9.476 1.00 0.00 H ATOM 622 N THR A 72 20.463 20.401 12.086 1.00 5.30 N ATOM 623 CA THR A 72 21.212 19.157 11.903 1.00 6.19 C ATOM 624 C THR A 72 20.648 18.093 12.831 1.00 6.24 C ATOM 625 O THR A 72 20.545 18.309 14.039 1.00 6.89 O ATOM 626 CB THR A 72 22.720 19.312 12.181 1.00 8.81 C ATOM 627 OG1 THR A 72 23.280 20.315 11.317 1.00 14.91 O ATOM 628 CG2 THR A 72 23.445 17.986 11.930 1.00 9.05 C ATOM 629 HG1 THR A 72 23.149 20.047 10.373 1.00 0.00 H ATOM 630 H THR A 72 20.263 20.722 13.055 1.00 0.00 H ATOM 631 N ILE A 73 20.317 16.940 12.275 1.00 7.00 N ATOM 632 CA ILE A 73 19.895 15.791 13.068 1.00 6.03 C ATOM 633 C ILE A 73 21.091 14.871 13.234 1.00 6.79 C ATOM 634 O ILE A 73 21.841 14.642 12.287 1.00 7.89 O ATOM 635 CB ILE A 73 18.696 15.062 12.426 1.00 5.78 C ATOM 636 CG1 ILE A 73 18.201 13.948 13.325 1.00 5.15 C ATOM 637 CG2 ILE A 73 19.038 14.477 11.052 1.00 5.77 C ATOM 638 CD1 ILE A 73 16.928 13.346 12.784 1.00 6.44 C ATOM 639 H ILE A 73 20.359 16.850 11.240 1.00 0.00 H ATOM 640 N SER A 74 21.269 14.350 14.445 1.00 6.45 N ATOM 641 CA SER A 74 22.350 13.415 14.715 1.00 4.76 C ATOM 642 C SER A 74 21.881 12.471 15.809 1.00 6.31 C ATOM 643 O SER A 74 20.820 12.655 16.412 1.00 6.85 O ATOM 644 CB SER A 74 23.648 14.127 15.128 1.00 9.03 C ATOM 645 OG SER A 74 23.495 14.799 16.364 1.00 11.31 O ATOM 646 HG SER A 74 22.776 15.475 16.284 1.00 0.00 H ATOM 647 H SER A 74 20.622 14.617 15.214 1.00 0.00 H ATOM 648 N GLN A 75 22.673 11.436 16.059 1.00 6.29 N ATOM 649 CA GLN A 75 22.277 10.488 17.083 1.00 7.31 C ATOM 650 C GLN A 75 23.521 9.941 17.751 1.00 7.14 C ATOM 651 O GLN A 75 24.576 9.850 17.131 1.00 7.22 O ATOM 652 CB GLN A 75 21.424 9.350 16.499 1.00 6.19 C ATOM 653 CG GLN A 75 22.062 8.588 15.353 1.00 11.37 C ATOM 654 CD GLN A 75 21.043 7.743 14.626 1.00 13.52 C ATOM 655 OE1 GLN A 75 20.228 8.257 13.850 1.00 13.70 O ATOM 656 NE2 GLN A 75 21.064 6.438 14.884 1.00 12.82 N ATOM 657 HE22 GLN A 75 21.768 6.050 15.544 1.00 0.00 H ATOM 658 HE21 GLN A 75 20.377 5.806 14.426 1.00 0.00 H ATOM 659 H GLN A 75 23.560 11.307 15.531 1.00 0.00 H ATOM 660 N ASP A 76 23.399 9.619 19.025 1.00 7.47 N ATOM 661 CA ASP A 76 24.430 8.870 19.726 1.00 9.92 C ATOM 662 C ASP A 76 23.860 7.485 19.981 1.00 8.53 C ATOM 663 O ASP A 76 23.016 7.305 20.866 1.00 9.47 O ATOM 664 CB ASP A 76 24.837 9.557 21.025 1.00 9.96 C ATOM 665 CG ASP A 76 26.066 8.933 21.641 1.00 17.82 C ATOM 666 OD1 ASP A 76 26.031 7.719 21.930 1.00 13.65 O ATOM 667 OD2 ASP A 76 27.078 9.650 21.803 1.00 23.35 O ATOM 668 H ASP A 76 22.544 9.908 19.541 1.00 0.00 H ATOM 669 N ASN A 77 24.332 6.505 19.217 1.00 9.88 N ATOM 670 CA ASN A 77 23.754 5.172 19.332 1.00 10.46 C ATOM 671 C ASN A 77 24.058 4.535 20.681 1.00 10.34 C ATOM 672 O ASN A 77 23.195 3.857 21.251 1.00 11.45 O ATOM 673 CB ASN A 77 24.246 4.292 18.191 1.00 10.84 C ATOM 674 CG ASN A 77 23.685 4.722 16.869 1.00 14.33 C ATOM 675 OD1 ASN A 77 22.637 5.387 16.813 1.00 13.43 O ATOM 676 ND2 ASN A 77 24.353 4.349 15.797 1.00 16.44 N ATOM 677 HD22 ASN A 77 25.226 3.793 15.896 1.00 0.00 H ATOM 678 HD21 ASN A 77 24.007 4.611 14.852 1.00 0.00 H ATOM 679 H ASN A 77 25.105 6.687 18.545 1.00 0.00 H ATOM 680 N ALA A 78 25.269 4.739 21.209 1.00 8.60 N ATOM 681 CA ALA A 78 25.582 4.180 22.521 1.00 11.91 C ATOM 682 C ALA A 78 24.675 4.742 23.607 1.00 13.17 C ATOM 683 O ALA A 78 24.341 4.026 24.557 1.00 14.97 O ATOM 684 CB ALA A 78 27.053 4.418 22.875 1.00 13.39 C ATOM 685 H ALA A 78 25.982 5.291 20.690 1.00 0.00 H ATOM 686 N LYS A 79 24.240 5.999 23.474 1.00 11.93 N ATOM 687 CA LYS A 79 23.384 6.667 24.450 1.00 12.32 C ATOM 688 C LYS A 79 21.899 6.566 24.122 1.00 9.20 C ATOM 689 O LYS A 79 21.075 7.129 24.859 1.00 9.76 O ATOM 690 CB LYS A 79 23.761 8.151 24.566 1.00 13.70 C ATOM 691 CG LYS A 79 25.165 8.432 25.076 1.00 19.06 C ATOM 692 CD LYS A 79 25.360 9.936 25.265 1.00 19.63 C ATOM 693 CE LYS A 79 26.621 10.258 26.049 1.00 27.24 C ATOM 694 NZ LYS A 79 27.625 10.963 25.197 1.00 27.06 N ATOM 695 HZ1 LYS A 79 27.881 10.357 24.392 1.00 0.00 H ATOM 696 HZ2 LYS A 79 27.217 11.853 24.846 1.00 0.00 H ATOM 697 HZ3 LYS A 79 28.474 11.169 25.762 1.00 0.00 H ATOM 698 H LYS A 79 24.527 6.531 22.628 1.00 0.00 H ATOM 699 N LYS A 80 21.550 5.895 23.030 1.00 7.99 N ATOM 700 CA LYS A 80 20.173 5.787 22.551 1.00 8.38 C ATOM 701 C LYS A 80 19.461 7.138 22.556 1.00 8.05 C ATOM 702 O LYS A 80 18.311 7.264 22.985 1.00 8.53 O ATOM 703 CB LYS A 80 19.399 4.752 23.363 1.00 11.16 C ATOM 704 CG LYS A 80 19.684 3.352 22.873 1.00 11.16 C ATOM 705 CD LYS A 80 18.985 2.328 23.720 1.00 11.55 C ATOM 706 CE LYS A 80 19.396 0.939 23.264 1.00 13.88 C ATOM 707 NZ LYS A 80 18.652 -0.133 23.984 1.00 17.21 N ATOM 708 HZ1 LYS A 80 18.840 -0.058 25.004 1.00 0.00 H ATOM 709 HZ2 LYS A 80 17.633 -0.023 23.809 1.00 0.00 H ATOM 710 HZ3 LYS A 80 18.966 -1.063 23.639 1.00 0.00 H ATOM 711 H LYS A 80 22.298 5.420 22.485 1.00 0.00 H ATOM 712 N THR A 81 20.147 8.146 22.007 1.00 8.33 N ATOM 713 CA THR A 81 19.667 9.524 22.022 1.00 6.93 C ATOM 714 C THR A 81 19.747 10.104 20.614 1.00 6.71 C ATOM 715 O THR A 81 20.768 9.969 19.943 1.00 8.14 O ATOM 716 CB THR A 81 20.481 10.384 22.998 1.00 8.78 C ATOM 717 OG1 THR A 81 20.437 9.783 24.308 1.00 12.45 O ATOM 718 CG2 THR A 81 19.892 11.786 23.085 1.00 10.69 C ATOM 719 HG1 THR A 81 20.961 10.335 24.941 1.00 0.00 H ATOM 720 H THR A 81 21.059 7.940 21.551 1.00 0.00 H ATOM 721 N LEU A 82 18.660 10.732 20.173 1.00 4.38 N ATOM 722 CA LEU A 82 18.600 11.474 18.921 1.00 5.97 C ATOM 723 C LEU A 82 18.645 12.959 19.232 1.00 5.28 C ATOM 724 O LEU A 82 18.075 13.409 20.231 1.00 7.14 O ATOM 725 CB LEU A 82 17.318 11.152 18.151 1.00 5.22 C ATOM 726 CG LEU A 82 17.060 11.801 16.782 1.00 5.41 C ATOM 727 CD1 LEU A 82 17.858 11.098 15.713 1.00 7.60 C ATOM 728 CD2 LEU A 82 15.594 11.695 16.458 1.00 6.97 C ATOM 729 H LEU A 82 17.801 10.691 20.758 1.00 0.00 H ATOM 730 N TYR A 83 19.335 13.719 18.385 1.00 5.57 N ATOM 731 CA TYR A 83 19.462 15.153 18.614 1.00 4.84 C ATOM 732 C TYR A 83 18.946 15.948 17.422 1.00 4.25 C ATOM 733 O TYR A 83 19.015 15.509 16.276 1.00 6.56 O ATOM 734 CB TYR A 83 20.916 15.552 18.867 1.00 7.38 C ATOM 735 CG TYR A 83 21.603 14.776 19.954 1.00 7.08 C ATOM 736 CD1 TYR A 83 21.463 15.135 21.286 1.00 8.01 C ATOM 737 CD2 TYR A 83 22.395 13.686 19.644 1.00 10.71 C ATOM 738 CE1 TYR A 83 22.102 14.417 22.280 1.00 11.72 C ATOM 739 CE2 TYR A 83 23.051 12.973 20.632 1.00 11.13 C ATOM 740 CZ TYR A 83 22.892 13.341 21.940 1.00 13.53 C ATOM 741 OH TYR A 83 23.544 12.621 22.919 1.00 15.90 O ATOM 742 HH TYR A 83 24.521 12.665 22.764 1.00 0.00 H ATOM 743 H TYR A 83 19.787 13.287 17.554 1.00 0.00 H ATOM 744 N LEU A 84 18.453 17.150 17.708 1.00 4.42 N ATOM 745 CA LEU A 84 18.144 18.135 16.676 1.00 6.02 C ATOM 746 C LEU A 84 18.877 19.411 17.049 1.00 4.84 C ATOM 747 O LEU A 84 18.474 20.112 17.981 1.00 5.08 O ATOM 748 CB LEU A 84 16.643 18.394 16.554 1.00 4.09 C ATOM 749 CG LEU A 84 16.334 19.262 15.320 1.00 5.08 C ATOM 750 CD1 LEU A 84 16.661 18.544 14.024 1.00 5.30 C ATOM 751 CD2 LEU A 84 14.856 19.628 15.323 1.00 5.41 C ATOM 752 H LEU A 84 18.281 17.397 18.704 1.00 0.00 H ATOM 753 N GLN A 85 19.939 19.723 16.330 1.00 4.32 N ATOM 754 CA GLN A 85 20.610 21.001 16.504 1.00 6.18 C ATOM 755 C GLN A 85 19.935 22.041 15.624 1.00 7.74 C ATOM 756 O GLN A 85 19.764 21.826 14.421 1.00 8.37 O ATOM 757 CB GLN A 85 22.087 20.869 16.148 1.00 5.96 C ATOM 758 CG GLN A 85 22.852 22.164 16.159 1.00 7.42 C ATOM 759 CD GLN A 85 23.090 22.640 17.571 1.00 11.01 C ATOM 760 OE1 GLN A 85 23.683 21.923 18.383 1.00 10.92 O ATOM 761 NE2 GLN A 85 22.593 23.829 17.890 1.00 11.12 N ATOM 762 HE22 GLN A 85 22.101 24.397 17.171 1.00 0.00 H ATOM 763 HE21 GLN A 85 22.696 24.193 18.859 1.00 0.00 H ATOM 764 H GLN A 85 20.301 19.045 15.629 1.00 0.00 H ATOM 765 N MET A 86 19.557 23.163 16.218 1.00 6.38 N ATOM 766 CA MET A 86 18.886 24.231 15.495 1.00 6.04 C ATOM 767 C MET A 86 19.737 25.486 15.578 1.00 6.70 C ATOM 768 O MET A 86 20.240 25.823 16.650 1.00 8.33 O ATOM 769 CB MET A 86 17.497 24.507 16.070 1.00 7.59 C ATOM 770 CG MET A 86 16.662 23.273 16.352 1.00 8.50 C ATOM 771 SD MET A 86 15.310 23.593 17.526 1.00 18.97 S ATOM 772 CE MET A 86 14.045 22.552 16.901 1.00 18.13 C ATOM 773 H MET A 86 19.746 23.284 17.234 1.00 0.00 H ATOM 774 N ASN A 87 19.908 26.162 14.447 1.00 5.54 N ATOM 775 CA ASN A 87 20.596 27.448 14.373 1.00 6.65 C ATOM 776 C ASN A 87 19.719 28.427 13.615 1.00 8.85 C ATOM 777 O ASN A 87 18.778 28.029 12.931 1.00 8.44 O ATOM 778 CB ASN A 87 21.954 27.331 13.674 1.00 8.19 C ATOM 779 CG ASN A 87 22.940 26.560 14.479 1.00 9.17 C ATOM 780 OD1 ASN A 87 23.364 27.007 15.545 1.00 8.97 O ATOM 781 ND2 ASN A 87 23.317 25.388 13.981 1.00 11.34 N ATOM 782 HD22 ASN A 87 22.927 25.058 13.075 1.00 0.00 H ATOM 783 HD21 ASN A 87 24.002 24.800 14.497 1.00 0.00 H ATOM 784 H ASN A 87 19.532 25.754 13.568 1.00 0.00 H ATOM 785 N SER A 88 20.053 29.717 13.729 1.00 8.28 N ATOM 786 CA SER A 88 19.379 30.763 12.968 1.00 7.00 C ATOM 787 C SER A 88 17.861 30.631 13.089 1.00 8.69 C ATOM 788 O SER A 88 17.124 30.660 12.097 1.00 8.56 O ATOM 789 CB SER A 88 19.819 30.724 11.509 1.00 13.01 C ATOM 790 OG SER A 88 21.204 30.990 11.425 1.00 16.75 O ATOM 791 HG SER A 88 21.702 30.305 11.938 1.00 0.00 H ATOM 792 H SER A 88 20.818 29.983 14.381 1.00 0.00 H ATOM 793 N LEU A 89 17.394 30.433 14.321 1.00 8.23 N ATOM 794 CA LEU A 89 15.984 30.157 14.544 1.00 8.21 C ATOM 795 C LEU A 89 15.134 31.329 14.080 1.00 10.67 C ATOM 796 O LEU A 89 15.497 32.492 14.266 1.00 12.81 O ATOM 797 CB LEU A 89 15.739 29.861 16.023 1.00 9.84 C ATOM 798 CG LEU A 89 16.158 28.430 16.376 1.00 10.10 C ATOM 799 CD1 LEU A 89 16.301 28.259 17.876 1.00 11.41 C ATOM 800 CD2 LEU A 89 15.132 27.454 15.821 1.00 12.57 C ATOM 801 H LEU A 89 18.045 30.476 15.131 1.00 0.00 H ATOM 802 N LYS A 90 14.011 31.006 13.462 1.00 8.67 N ATOM 803 CA LYS A 90 13.052 31.970 12.952 1.00 11.23 C ATOM 804 C LYS A 90 11.735 31.773 13.682 1.00 10.32 C ATOM 805 O LYS A 90 11.458 30.682 14.191 1.00 11.10 O ATOM 806 CB LYS A 90 12.828 31.796 11.443 1.00 13.86 C ATOM 807 CG LYS A 90 14.088 31.920 10.611 1.00 15.14 C ATOM 808 CD LYS A 90 13.877 31.414 9.196 1.00 19.98 C ATOM 809 CE LYS A 90 15.156 31.524 8.395 1.00 18.72 C ATOM 810 NZ LYS A 90 14.941 31.250 6.941 1.00 26.16 N ATOM 811 HZ1 LYS A 90 14.568 30.286 6.822 1.00 0.00 H ATOM 812 HZ2 LYS A 90 14.260 31.936 6.557 1.00 0.00 H ATOM 813 HZ3 LYS A 90 15.846 31.338 6.435 1.00 0.00 H ATOM 814 H LYS A 90 13.801 29.996 13.333 1.00 0.00 H ATOM 815 N PRO A 91 10.894 32.811 13.752 1.00 13.18 N ATOM 816 CA PRO A 91 9.595 32.650 14.422 1.00 15.28 C ATOM 817 C PRO A 91 8.763 31.503 13.885 1.00 13.12 C ATOM 818 O PRO A 91 8.085 30.822 14.662 1.00 11.91 O ATOM 819 CB PRO A 91 8.916 34.002 14.171 1.00 14.82 C ATOM 820 CG PRO A 91 10.040 34.967 14.082 1.00 17.86 C ATOM 821 CD PRO A 91 11.211 34.224 13.474 1.00 15.91 C ATOM 822 N GLU A 92 8.812 31.253 12.577 1.00 11.74 N ATOM 823 CA GLU A 92 8.048 30.151 12.007 1.00 15.48 C ATOM 824 C GLU A 92 8.591 28.789 12.422 1.00 12.45 C ATOM 825 O GLU A 92 7.945 27.769 12.144 1.00 14.93 O ATOM 826 CB GLU A 92 8.017 30.266 10.480 1.00 17.40 C ATOM 827 CG GLU A 92 9.379 30.230 9.808 1.00 15.47 C ATOM 828 CD GLU A 92 9.908 31.617 9.459 1.00 22.48 C ATOM 829 OE1 GLU A 92 9.649 32.587 10.210 1.00 19.79 O ATOM 830 OE2 GLU A 92 10.592 31.734 8.421 1.00 27.22 O ATOM 831 H GLU A 92 9.399 31.848 11.959 1.00 0.00 H ATOM 832 N ASP A 93 9.753 28.741 13.075 1.00 8.21 N ATOM 833 CA ASP A 93 10.179 27.482 13.671 1.00 8.81 C ATOM 834 C ASP A 93 9.447 27.161 14.967 1.00 10.55 C ATOM 835 O ASP A 93 9.666 26.090 15.529 1.00 7.79 O ATOM 836 CB ASP A 93 11.686 27.492 13.943 1.00 6.83 C ATOM 837 CG ASP A 93 12.522 27.613 12.667 1.00 9.27 C ATOM 838 OD1 ASP A 93 12.237 26.954 11.644 1.00 9.87 O ATOM 839 OD2 ASP A 93 13.495 28.379 12.694 1.00 11.10 O ATOM 840 H ASP A 93 10.347 29.591 13.158 1.00 0.00 H ATOM 841 N THR A 94 8.597 28.053 15.469 1.00 7.54 N ATOM 842 CA THR A 94 7.885 27.782 16.705 1.00 6.64 C ATOM 843 C THR A 94 6.981 26.563 16.572 1.00 8.57 C ATOM 844 O THR A 94 6.288 26.389 15.566 1.00 10.13 O ATOM 845 CB THR A 94 7.063 29.024 17.081 1.00 9.08 C ATOM 846 OG1 THR A 94 7.958 30.066 17.500 1.00 11.70 O ATOM 847 CG2 THR A 94 6.059 28.726 18.185 1.00 10.24 C ATOM 848 HG1 THR A 94 8.577 30.286 16.759 1.00 0.00 H ATOM 849 H THR A 94 8.441 28.953 14.971 1.00 0.00 H ATOM 850 N GLY A 95 6.981 25.717 17.589 1.00 7.38 N ATOM 851 CA GLY A 95 6.061 24.599 17.586 1.00 8.37 C ATOM 852 C GLY A 95 6.432 23.573 18.632 1.00 8.35 C ATOM 853 O GLY A 95 7.441 23.688 19.327 1.00 6.93 O ATOM 854 H GLY A 95 7.637 25.854 18.385 1.00 0.00 H ATOM 855 N MET A 96 5.585 22.552 18.724 1.00 8.57 N ATOM 856 CA MET A 96 5.854 21.413 19.593 1.00 7.68 C ATOM 857 C MET A 96 6.660 20.416 18.779 1.00 8.49 C ATOM 858 O MET A 96 6.156 19.865 17.792 1.00 10.07 O ATOM 859 CB MET A 96 4.561 20.782 20.099 1.00 10.41 C ATOM 860 CG MET A 96 4.780 19.566 20.978 1.00 11.97 C ATOM 861 SD MET A 96 5.570 19.968 22.537 1.00 13.35 S ATOM 862 CE MET A 96 4.276 20.888 23.371 1.00 15.21 C ATOM 863 H MET A 96 4.710 22.566 18.163 1.00 0.00 H ATOM 864 N TYR A 97 7.914 20.209 19.171 1.00 6.53 N ATOM 865 CA TYR A 97 8.806 19.297 18.465 1.00 7.74 C ATOM 866 C TYR A 97 8.679 17.906 19.062 1.00 5.21 C ATOM 867 O TYR A 97 8.976 17.695 20.245 1.00 10.01 O ATOM 868 CB TYR A 97 10.243 19.799 18.528 1.00 4.62 C ATOM 869 CG TYR A 97 10.475 20.904 17.535 1.00 6.81 C ATOM 870 CD1 TYR A 97 9.931 22.174 17.738 1.00 6.92 C ATOM 871 CD2 TYR A 97 11.190 20.675 16.374 1.00 7.06 C ATOM 872 CE1 TYR A 97 10.131 23.183 16.802 1.00 6.27 C ATOM 873 CE2 TYR A 97 11.388 21.683 15.420 1.00 7.72 C ATOM 874 CZ TYR A 97 10.854 22.929 15.651 1.00 8.13 C ATOM 875 OH TYR A 97 11.057 23.921 14.721 1.00 7.73 O ATOM 876 HH TYR A 97 10.615 24.753 15.026 1.00 0.00 H ATOM 877 H TYR A 97 8.270 20.714 20.008 1.00 0.00 H ATOM 878 N ARG A 98 8.258 16.961 18.228 1.00 5.85 N ATOM 879 CA ARG A 98 8.004 15.595 18.640 1.00 5.98 C ATOM 880 C ARG A 98 8.910 14.671 17.862 1.00 4.81 C ATOM 881 O ARG A 98 9.104 14.833 16.657 1.00 6.53 O ATOM 882 CB ARG A 98 6.555 15.199 18.396 1.00 6.76 C ATOM 883 CG ARG A 98 5.604 16.069 19.167 1.00 9.39 C ATOM 884 CD ARG A 98 4.178 15.665 18.920 1.00 8.25 C ATOM 885 NE ARG A 98 3.876 14.391 19.553 1.00 10.15 N ATOM 886 CZ ARG A 98 2.706 13.774 19.439 1.00 8.46 C ATOM 887 NH1 ARG A 98 1.744 14.320 18.706 1.00 11.90 N ATOM 888 NH2 ARG A 98 2.501 12.613 20.040 1.00 9.77 N ATOM 889 HE ARG A 98 4.617 13.939 20.126 1.00 0.00 H ATOM 890 HH12 ARG A 98 0.826 13.841 18.613 1.00 0.00 H ATOM 891 HH11 ARG A 98 1.908 15.227 18.224 1.00 0.00 H ATOM 892 HH22 ARG A 98 1.582 12.134 19.947 1.00 0.00 H ATOM 893 HH21 ARG A 98 3.259 12.179 20.605 1.00 0.00 H ATOM 894 H ARG A 98 8.103 17.214 17.231 1.00 0.00 H ATOM 895 N CYS A 99 9.443 13.688 18.550 1.00 5.30 N ATOM 896 CA CYS A 99 10.258 12.676 17.917 1.00 4.86 C ATOM 897 C CYS A 99 9.389 11.473 17.602 1.00 4.77 C ATOM 898 O CYS A 99 8.464 11.151 18.355 1.00 5.87 O ATOM 899 CB CYS A 99 11.392 12.301 18.852 1.00 7.25 C ATOM 900 SG CYS A 99 12.549 11.039 18.260 1.00 10.18 S ATOM 901 H CYS A 99 9.275 13.636 19.575 1.00 0.00 H ATOM 902 N ALA A 100 9.666 10.832 16.479 1.00 4.72 N ATOM 903 CA ALA A 100 8.910 9.655 16.070 1.00 7.02 C ATOM 904 C ALA A 100 9.861 8.603 15.511 1.00 5.70 C ATOM 905 O ALA A 100 10.963 8.910 15.050 1.00 5.46 O ATOM 906 CB ALA A 100 7.845 10.019 15.022 1.00 6.73 C ATOM 907 H ALA A 100 10.440 11.175 15.875 1.00 0.00 H ATOM 908 N SER A 101 9.448 7.345 15.570 1.00 6.72 N ATOM 909 CA SER A 101 10.279 6.311 14.981 1.00 5.43 C ATOM 910 C SER A 101 9.390 5.260 14.347 1.00 6.89 C ATOM 911 O SER A 101 8.226 5.099 14.721 1.00 8.18 O ATOM 912 CB SER A 101 11.218 5.674 16.008 1.00 9.32 C ATOM 913 OG SER A 101 10.480 4.917 16.953 1.00 9.13 O ATOM 914 HG SER A 101 9.982 4.201 16.484 1.00 0.00 H ATOM 915 H SER A 101 8.547 7.104 16.029 1.00 0.00 H ATOM 916 N THR A 102 9.966 4.532 13.389 1.00 6.38 N ATOM 917 CA THR A 102 9.231 3.477 12.709 1.00 9.60 C ATOM 918 C THR A 102 10.200 2.572 11.965 1.00 10.56 C ATOM 919 O THR A 102 11.276 2.990 11.548 1.00 10.14 O ATOM 920 CB THR A 102 8.186 4.066 11.756 1.00 12.30 C ATOM 921 OG1 THR A 102 7.297 3.030 11.318 1.00 18.17 O ATOM 922 CG2 THR A 102 8.849 4.739 10.564 1.00 10.77 C ATOM 923 HG1 THR A 102 7.815 2.330 10.847 1.00 0.00 H ATOM 924 H THR A 102 10.954 4.721 13.125 1.00 0.00 H ATOM 925 N ARG A 103 9.788 1.318 11.803 1.00 10.67 N ATOM 926 CA ARG A 103 10.605 0.364 11.072 1.00 11.08 C ATOM 927 C ARG A 103 10.564 0.636 9.570 1.00 10.49 C ATOM 928 O ARG A 103 11.585 0.492 8.882 1.00 13.00 O ATOM 929 CB ARG A 103 10.112 -1.048 11.409 1.00 14.26 C ATOM 930 CG ARG A 103 10.674 -2.195 10.597 1.00 22.85 C ATOM 931 CD ARG A 103 12.171 -2.279 10.555 1.00 24.69 C ATOM 932 NE ARG A 103 12.742 -1.876 11.827 1.00 25.04 N ATOM 933 CZ ARG A 103 13.491 -2.654 12.598 1.00 18.86 C ATOM 934 NH1 ARG A 103 13.760 -3.912 12.256 1.00 27.17 N ATOM 935 NH2 ARG A 103 13.951 -2.152 13.715 1.00 13.57 N ATOM 936 HE ARG A 103 12.551 -0.909 12.158 1.00 0.00 H ATOM 937 HH12 ARG A 103 14.349 -4.505 12.875 1.00 0.00 H ATOM 938 HH11 ARG A 103 13.381 -4.302 11.370 1.00 0.00 H ATOM 939 HH22 ARG A 103 14.541 -2.734 14.343 1.00 0.00 H ATOM 940 HH21 ARG A 103 13.726 -1.170 13.975 1.00 0.00 H ATOM 941 H ARG A 103 8.876 1.018 12.202 1.00 0.00 H ATOM 942 N PHE A 104 9.403 1.059 9.054 1.00 8.85 N ATOM 943 CA PHE A 104 9.184 1.214 7.621 1.00 10.78 C ATOM 944 C PHE A 104 8.450 2.513 7.347 1.00 11.39 C ATOM 945 O PHE A 104 7.477 2.841 8.036 1.00 10.82 O ATOM 946 CB PHE A 104 8.351 0.061 7.009 1.00 12.85 C ATOM 947 CG PHE A 104 8.873 -1.302 7.300 1.00 13.29 C ATOM 948 CD1 PHE A 104 10.076 -1.730 6.748 1.00 15.44 C ATOM 949 CD2 PHE A 104 8.162 -2.172 8.113 1.00 17.08 C ATOM 950 CE1 PHE A 104 10.573 -3.006 7.016 1.00 15.95 C ATOM 951 CE2 PHE A 104 8.646 -3.447 8.376 1.00 18.39 C ATOM 952 CZ PHE A 104 9.852 -3.860 7.829 1.00 17.28 C ATOM 953 H PHE A 104 8.624 1.287 9.704 1.00 0.00 H ATOM 954 N ALA A 105 8.898 3.232 6.322 1.00 9.58 N ATOM 955 CA ALA A 105 8.212 4.439 5.888 1.00 14.35 C ATOM 956 C ALA A 105 8.459 4.639 4.405 1.00 12.36 C ATOM 957 O ALA A 105 9.566 4.390 3.918 1.00 15.15 O ATOM 958 CB ALA A 105 8.685 5.678 6.656 1.00 12.35 C ATOM 959 H ALA A 105 9.756 2.925 5.821 1.00 0.00 H ATOM 960 N GLY A 106 7.432 5.095 3.698 1.00 13.38 N ATOM 961 CA GLY A 106 7.625 5.541 2.333 1.00 12.01 C ATOM 962 C GLY A 106 8.195 6.943 2.310 1.00 13.79 C ATOM 963 O GLY A 106 9.341 7.158 1.900 1.00 16.26 O ATOM 964 H GLY A 106 6.485 5.132 4.126 1.00 0.00 H ATOM 965 N ARG A 107 7.394 7.909 2.755 1.00 12.40 N ATOM 966 CA ARG A 107 7.841 9.285 2.923 1.00 10.80 C ATOM 967 C ARG A 107 8.341 9.472 4.346 1.00 9.92 C ATOM 968 O ARG A 107 7.583 9.288 5.303 1.00 10.10 O ATOM 969 CB ARG A 107 6.705 10.266 2.657 1.00 10.92 C ATOM 970 CG ARG A 107 6.263 10.358 1.210 1.00 14.03 C ATOM 971 CD ARG A 107 4.948 11.128 1.162 1.00 10.67 C ATOM 972 NE ARG A 107 4.489 11.375 -0.200 1.00 18.51 N ATOM 973 CZ ARG A 107 3.834 10.478 -0.933 1.00 21.54 C ATOM 974 NH1 ARG A 107 3.565 9.282 -0.430 1.00 24.29 N ATOM 975 NH2 ARG A 107 3.450 10.775 -2.170 1.00 23.67 N ATOM 976 HE ARG A 107 4.685 12.305 -0.622 1.00 0.00 H ATOM 977 HH12 ARG A 107 3.053 8.580 -1.002 1.00 0.00 H ATOM 978 HH11 ARG A 107 3.866 9.045 0.537 1.00 0.00 H ATOM 979 HH22 ARG A 107 2.938 10.071 -2.739 1.00 0.00 H ATOM 980 HH21 ARG A 107 3.661 11.712 -2.569 1.00 0.00 H ATOM 981 H ARG A 107 6.410 7.671 2.992 1.00 0.00 H ATOM 982 N TRP A 108 9.608 9.866 4.483 1.00 8.43 N ATOM 983 CA TRP A 108 10.155 10.070 5.818 1.00 7.97 C ATOM 984 C TRP A 108 9.399 11.162 6.561 1.00 7.49 C ATOM 985 O TRP A 108 9.370 11.156 7.788 1.00 7.09 O ATOM 986 CB TRP A 108 11.651 10.401 5.738 1.00 8.17 C ATOM 987 CG TRP A 108 11.931 11.736 5.088 1.00 9.00 C ATOM 988 CD1 TRP A 108 12.213 11.975 3.781 1.00 10.54 C ATOM 989 CD2 TRP A 108 11.920 13.012 5.735 1.00 10.34 C ATOM 990 NE1 TRP A 108 12.392 13.328 3.568 1.00 11.57 N ATOM 991 CE2 TRP A 108 12.217 13.982 4.756 1.00 8.99 C ATOM 992 CE3 TRP A 108 11.694 13.426 7.047 1.00 8.30 C ATOM 993 CZ2 TRP A 108 12.286 15.348 5.058 1.00 10.03 C ATOM 994 CZ3 TRP A 108 11.770 14.783 7.346 1.00 9.67 C ATOM 995 CH2 TRP A 108 12.056 15.720 6.355 1.00 8.38 C ATOM 996 HE1 TRP A 108 12.621 13.774 2.657 1.00 0.00 H ATOM 997 H TRP A 108 10.201 10.026 3.644 1.00 0.00 H ATOM 998 N TYR A 109 8.780 12.091 5.838 1.00 9.48 N ATOM 999 CA TYR A 109 8.186 13.286 6.432 1.00 8.59 C ATOM 1000 C TYR A 109 6.689 13.168 6.664 1.00 8.16 C ATOM 1001 O TYR A 109 6.063 14.156 7.078 1.00 10.15 O ATOM 1002 CB TYR A 109 8.463 14.501 5.541 1.00 9.68 C ATOM 1003 CG TYR A 109 8.046 14.301 4.096 1.00 13.61 C ATOM 1004 CD1 TYR A 109 6.742 14.536 3.682 1.00 10.78 C ATOM 1005 CD2 TYR A 109 8.962 13.873 3.152 1.00 12.01 C ATOM 1006 CE1 TYR A 109 6.370 14.352 2.348 1.00 12.62 C ATOM 1007 CE2 TYR A 109 8.605 13.694 1.829 1.00 11.28 C ATOM 1008 CZ TYR A 109 7.313 13.927 1.434 1.00 16.29 C ATOM 1009 OH TYR A 109 6.978 13.740 0.112 1.00 20.96 O ATOM 1010 HH TYR A 109 7.525 14.341 -0.454 1.00 0.00 H ATOM 1011 H TYR A 109 8.716 11.961 4.808 1.00 0.00 H ATOM 1012 N ARG A 110 6.108 12.003 6.400 1.00 8.60 N ATOM 1013 CA ARG A 110 4.678 11.776 6.581 1.00 8.81 C ATOM 1014 C ARG A 110 4.435 11.205 7.975 1.00 9.15 C ATOM 1015 O ARG A 110 4.822 10.073 8.267 1.00 9.07 O ATOM 1016 CB ARG A 110 4.162 10.845 5.488 1.00 12.75 C ATOM 1017 CG ARG A 110 2.657 10.608 5.526 1.00 13.41 C ATOM 1018 CD ARG A 110 2.199 9.962 4.236 1.00 23.47 C ATOM 1019 NE ARG A 110 0.752 9.783 4.190 1.00 30.38 N ATOM 1020 CZ ARG A 110 0.138 8.924 3.383 1.00 28.46 C ATOM 1021 NH1 ARG A 110 0.851 8.164 2.562 1.00 30.14 N ATOM 1022 NH2 ARG A 110 -1.184 8.826 3.398 1.00 29.63 N ATOM 1023 HE ARG A 110 0.167 10.361 4.826 1.00 0.00 H ATOM 1024 HH12 ARG A 110 0.373 7.491 1.929 1.00 0.00 H ATOM 1025 HH11 ARG A 110 1.888 8.241 2.551 1.00 0.00 H ATOM 1026 HH22 ARG A 110 -1.663 8.153 2.766 1.00 0.00 H ATOM 1027 HH21 ARG A 110 -1.742 9.422 4.042 1.00 0.00 H ATOM 1028 H ARG A 110 6.697 11.220 6.050 1.00 0.00 H ATOM 1029 N ASP A 111 3.785 11.996 8.829 1.00 7.51 N ATOM 1030 CA ASP A 111 3.597 11.599 10.224 1.00 8.25 C ATOM 1031 C ASP A 111 2.841 10.279 10.360 1.00 10.25 C ATOM 1032 O ASP A 111 3.144 9.481 11.259 1.00 9.69 O ATOM 1033 CB ASP A 111 2.894 12.721 11.007 1.00 11.06 C ATOM 1034 CG ASP A 111 1.520 13.135 10.422 1.00 16.38 C ATOM 1035 OD1 ASP A 111 1.107 12.675 9.333 1.00 15.18 O ATOM 1036 OD2 ASP A 111 0.834 13.948 11.083 1.00 18.66 O ATOM 1037 H ASP A 111 3.407 12.907 8.499 1.00 0.00 H ATOM 1038 N SER A 112 1.893 10.007 9.460 1.00 11.90 N ATOM 1039 CA SER A 112 1.067 8.811 9.601 1.00 13.42 C ATOM 1040 C SER A 112 1.821 7.517 9.317 1.00 16.69 C ATOM 1041 O SER A 112 1.290 6.441 9.613 1.00 23.40 O ATOM 1042 CB SER A 112 -0.154 8.911 8.692 1.00 19.32 C ATOM 1043 OG SER A 112 0.250 9.076 7.352 1.00 16.76 O ATOM 1044 HG SER A 112 -0.550 9.140 6.773 1.00 0.00 H ATOM 1045 H SER A 112 1.742 10.649 8.656 1.00 0.00 H ATOM 1046 N GLU A 113 3.036 7.586 8.774 1.00 12.40 N ATOM 1047 CA GLU A 113 3.845 6.382 8.614 1.00 12.03 C ATOM 1048 C GLU A 113 4.555 5.965 9.894 1.00 13.33 C ATOM 1049 O GLU A 113 5.159 4.887 9.920 1.00 16.35 O ATOM 1050 CB GLU A 113 4.890 6.585 7.516 1.00 15.71 C ATOM 1051 CG GLU A 113 4.325 7.174 6.246 1.00 21.09 C ATOM 1052 CD GLU A 113 4.673 6.374 5.006 1.00 21.90 C ATOM 1053 OE1 GLU A 113 4.693 6.986 3.913 1.00 26.06 O ATOM 1054 OE2 GLU A 113 4.928 5.148 5.119 1.00 18.95 O ATOM 1055 H GLU A 113 3.410 8.505 8.462 1.00 0.00 H ATOM 1056 N TYR A 114 4.511 6.777 10.941 1.00 9.36 N ATOM 1057 CA TYR A 114 5.281 6.528 12.149 1.00 12.43 C ATOM 1058 C TYR A 114 4.416 5.908 13.231 1.00 10.87 C ATOM 1059 O TYR A 114 3.319 6.405 13.522 1.00 15.34 O ATOM 1060 CB TYR A 114 5.901 7.825 12.651 1.00 9.87 C ATOM 1061 CG TYR A 114 7.076 8.226 11.807 1.00 6.98 C ATOM 1062 CD1 TYR A 114 6.896 8.860 10.586 1.00 6.12 C ATOM 1063 CD2 TYR A 114 8.378 7.937 12.208 1.00 7.54 C ATOM 1064 CE1 TYR A 114 7.991 9.210 9.791 1.00 6.64 C ATOM 1065 CE2 TYR A 114 9.465 8.282 11.426 1.00 6.83 C ATOM 1066 CZ TYR A 114 9.268 8.926 10.222 1.00 5.71 C ATOM 1067 OH TYR A 114 10.372 9.269 9.465 1.00 7.76 O ATOM 1068 HH TYR A 114 10.075 9.721 8.636 1.00 0.00 H ATOM 1069 H TYR A 114 3.905 7.621 10.897 1.00 0.00 H ATOM 1070 N ARG A 115 4.941 4.861 13.864 1.00 13.30 N ATOM 1071 CA ARG A 115 4.161 4.115 14.838 1.00 15.50 C ATOM 1072 C ARG A 115 4.496 4.442 16.286 1.00 15.71 C ATOM 1073 O ARG A 115 3.706 4.112 17.171 1.00 19.07 O ATOM 1074 CB ARG A 115 4.327 2.608 14.603 1.00 19.16 C ATOM 1075 CG ARG A 115 4.128 2.193 13.149 1.00 21.82 C ATOM 1076 CD ARG A 115 2.669 1.788 12.901 1.00 22.64 C ATOM 1077 NE ARG A 115 2.401 1.534 11.489 1.00 25.20 N ATOM 1078 CZ ARG A 115 2.014 2.458 10.613 1.00 22.07 C ATOM 1079 NH1 ARG A 115 1.803 2.117 9.349 1.00 28.38 N ATOM 1080 NH2 ARG A 115 1.841 3.719 10.993 1.00 25.07 N ATOM 1081 HE ARG A 115 2.521 0.561 11.142 1.00 0.00 H ATOM 1082 HH12 ARG A 115 1.500 2.835 8.660 1.00 0.00 H ATOM 1083 HH11 ARG A 115 1.940 1.131 9.046 1.00 0.00 H ATOM 1084 HH22 ARG A 115 1.538 4.434 10.301 1.00 0.00 H ATOM 1085 HH21 ARG A 115 2.008 3.991 11.983 1.00 0.00 H ATOM 1086 H ARG A 115 5.919 4.574 13.660 1.00 0.00 H ATOM 1087 N ALA A 116 5.624 5.086 16.560 1.00 10.70 N ATOM 1088 CA ALA A 116 6.007 5.436 17.919 1.00 10.15 C ATOM 1089 C ALA A 116 6.274 6.932 17.995 1.00 8.38 C ATOM 1090 O ALA A 116 6.960 7.487 17.127 1.00 9.63 O ATOM 1091 CB ALA A 116 7.246 4.658 18.351 1.00 9.01 C ATOM 1092 H ALA A 116 6.255 5.349 15.777 1.00 0.00 H ATOM 1093 N TRP A 117 5.705 7.584 19.013 1.00 8.21 N ATOM 1094 CA TRP A 117 5.779 9.031 19.160 1.00 9.43 C ATOM 1095 C TRP A 117 6.157 9.414 20.579 1.00 7.51 C ATOM 1096 O TRP A 117 5.758 8.757 21.541 1.00 9.58 O ATOM 1097 CB TRP A 117 4.443 9.690 18.818 1.00 10.22 C ATOM 1098 CG TRP A 117 4.153 9.656 17.378 1.00 7.81 C ATOM 1099 CD1 TRP A 117 3.588 8.638 16.679 1.00 8.43 C ATOM 1100 CD2 TRP A 117 4.446 10.677 16.438 1.00 6.34 C ATOM 1101 NE1 TRP A 117 3.500 8.968 15.356 1.00 6.64 N ATOM 1102 CE2 TRP A 117 4.010 10.227 15.179 1.00 8.20 C ATOM 1103 CE3 TRP A 117 5.030 11.944 16.535 1.00 6.68 C ATOM 1104 CZ2 TRP A 117 4.168 10.982 14.022 1.00 7.89 C ATOM 1105 CZ3 TRP A 117 5.150 12.695 15.407 1.00 6.77 C ATOM 1106 CH2 TRP A 117 4.726 12.215 14.158 1.00 8.09 C ATOM 1107 HE1 TRP A 117 3.110 8.362 14.606 1.00 0.00 H ATOM 1108 H TRP A 117 5.188 7.036 19.730 1.00 0.00 H ATOM 1109 N GLY A 118 6.922 10.500 20.713 1.00 7.13 N ATOM 1110 CA GLY A 118 7.044 11.138 22.006 1.00 8.06 C ATOM 1111 C GLY A 118 6.004 12.227 22.170 1.00 9.44 C ATOM 1112 O GLY A 118 5.346 12.605 21.207 1.00 11.07 O ATOM 1113 H GLY A 118 7.429 10.886 19.891 1.00 0.00 H ATOM 1114 N GLN A 119 5.892 12.733 23.399 1.00 9.41 N ATOM 1115 CA GLN A 119 4.905 13.770 23.686 1.00 11.51 C ATOM 1116 C GLN A 119 5.365 15.144 23.202 1.00 11.50 C ATOM 1117 O GLN A 119 4.532 15.986 22.846 1.00 13.81 O ATOM 1118 CB GLN A 119 4.592 13.784 25.186 1.00 14.98 C ATOM 1119 CG GLN A 119 3.747 14.958 25.669 1.00 23.24 C ATOM 1120 CD GLN A 119 3.433 14.880 27.156 1.00 32.46 C ATOM 1121 OE1 GLN A 119 2.305 14.563 27.546 1.00 33.57 O ATOM 1122 NE2 GLN A 119 4.428 15.174 27.994 1.00 29.90 N ATOM 1123 HE22 GLN A 119 5.362 15.436 27.620 1.00 0.00 H ATOM 1124 HE21 GLN A 119 4.269 15.141 29.021 1.00 0.00 H ATOM 1125 H GLN A 119 6.512 12.386 24.158 1.00 0.00 H ATOM 1126 N GLY A 120 6.666 15.385 23.160 1.00 8.51 N ATOM 1127 CA GLY A 120 7.186 16.568 22.518 1.00 7.90 C ATOM 1128 C GLY A 120 7.833 17.536 23.503 1.00 9.26 C ATOM 1129 O GLY A 120 7.658 17.447 24.724 1.00 11.09 O ATOM 1130 H GLY A 120 7.325 14.710 23.597 1.00 0.00 H ATOM 1131 N THR A 121 8.612 18.459 22.949 1.00 10.17 N ATOM 1132 CA THR A 121 9.186 19.558 23.713 1.00 8.12 C ATOM 1133 C THR A 121 8.920 20.840 22.935 1.00 8.27 C ATOM 1134 O THR A 121 9.161 20.898 21.725 1.00 8.48 O ATOM 1135 CB THR A 121 10.691 19.318 23.974 1.00 9.35 C ATOM 1136 OG1 THR A 121 11.241 20.333 24.829 1.00 9.18 O ATOM 1137 CG2 THR A 121 11.483 19.214 22.664 1.00 8.93 C ATOM 1138 HG1 THR A 121 10.765 20.325 25.697 1.00 0.00 H ATOM 1139 H THR A 121 8.820 18.394 21.932 1.00 0.00 H ATOM 1140 N GLN A 122 8.374 21.846 23.623 1.00 8.58 N ATOM 1141 CA GLN A 122 7.938 23.076 22.981 1.00 7.69 C ATOM 1142 C GLN A 122 9.128 23.974 22.682 1.00 7.92 C ATOM 1143 O GLN A 122 10.027 24.134 23.511 1.00 9.12 O ATOM 1144 CB GLN A 122 6.949 23.810 23.883 1.00 10.21 C ATOM 1145 CG GLN A 122 6.503 25.174 23.376 1.00 7.95 C ATOM 1146 CD GLN A 122 5.595 25.064 22.178 1.00 9.49 C ATOM 1147 OE1 GLN A 122 4.768 24.157 22.102 1.00 14.07 O ATOM 1148 NE2 GLN A 122 5.747 25.980 21.228 1.00 11.05 N ATOM 1149 HE22 GLN A 122 6.460 26.729 21.337 1.00 0.00 H ATOM 1150 HE21 GLN A 122 5.153 25.948 20.375 1.00 0.00 H ATOM 1151 H GLN A 122 8.257 21.747 24.652 1.00 0.00 H ATOM 1152 N VAL A 123 9.125 24.551 21.487 1.00 5.43 N ATOM 1153 CA VAL A 123 10.115 25.530 21.067 1.00 5.51 C ATOM 1154 C VAL A 123 9.368 26.780 20.647 1.00 6.55 C ATOM 1155 O VAL A 123 8.539 26.727 19.739 1.00 9.12 O ATOM 1156 CB VAL A 123 10.988 25.011 19.916 1.00 8.28 C ATOM 1157 CG1 VAL A 123 11.981 26.088 19.487 1.00 8.94 C ATOM 1158 CG2 VAL A 123 11.691 23.736 20.353 1.00 9.89 C ATOM 1159 H VAL A 123 8.375 24.289 20.815 1.00 0.00 H ATOM 1160 N THR A 124 9.651 27.897 21.307 1.00 6.62 N ATOM 1161 CA THR A 124 8.986 29.156 21.005 1.00 8.69 C ATOM 1162 C THR A 124 10.046 30.179 20.634 1.00 8.09 C ATOM 1163 O THR A 124 10.906 30.515 21.455 1.00 9.79 O ATOM 1164 CB THR A 124 8.148 29.640 22.190 1.00 8.22 C ATOM 1165 OG1 THR A 124 7.303 28.584 22.666 1.00 11.62 O ATOM 1166 CG2 THR A 124 7.285 30.807 21.749 1.00 15.32 C ATOM 1167 HG1 THR A 124 7.863 27.820 22.956 1.00 0.00 H ATOM 1168 H THR A 124 10.367 27.872 22.060 1.00 0.00 H ATOM 1169 N VAL A 125 10.003 30.663 19.397 1.00 7.62 N ATOM 1170 CA VAL A 125 10.998 31.603 18.894 1.00 9.25 C ATOM 1171 C VAL A 125 10.389 32.993 18.890 1.00 13.15 C ATOM 1172 O VAL A 125 9.428 33.251 18.153 1.00 14.76 O ATOM 1173 CB VAL A 125 11.487 31.210 17.492 1.00 9.15 C ATOM 1174 CG1 VAL A 125 12.573 32.167 17.015 1.00 9.70 C ATOM 1175 CG2 VAL A 125 11.993 29.785 17.502 1.00 9.92 C ATOM 1176 H VAL A 125 9.233 30.361 18.766 1.00 0.00 H ATOM 1177 N SER A 126 10.961 33.877 19.705 1.00 13.91 N ATOM 1178 CA SER A 126 10.538 35.273 19.794 1.00 18.34 C ATOM 1179 C SER A 126 10.675 35.980 18.451 1.00 23.50 C ATOM 1180 O SER A 126 11.601 35.694 17.686 1.00 26.69 O ATOM 1181 CB SER A 126 11.366 36.015 20.853 1.00 20.32 C ATOM 1182 OG SER A 126 11.570 35.216 22.011 1.00 21.75 O ATOM 1183 HG SER A 126 12.106 35.724 22.671 1.00 0.00 H ATOM 1184 H SER A 126 11.747 33.559 20.307 1.00 0.00 H TER 1185 SER A 126 ATOM 1186 N GLN B 1 23.959 23.793 29.797 1.00 29.99 N ATOM 1187 CA GLN B 1 22.630 23.208 29.645 1.00 28.03 C ATOM 1188 C GLN B 1 21.576 24.295 29.425 1.00 21.79 C ATOM 1189 O GLN B 1 20.902 24.326 28.395 1.00 25.99 O ATOM 1190 CB GLN B 1 22.276 22.349 30.874 1.00 28.94 C ATOM 1191 CG GLN B 1 22.723 22.926 32.217 1.00 32.93 C ATOM 1192 CD GLN B 1 22.215 22.122 33.408 1.00 35.98 C ATOM 1193 OE1 GLN B 1 21.218 22.484 34.042 1.00 35.88 O ATOM 1194 NE2 GLN B 1 22.910 21.035 33.727 1.00 37.77 N ATOM 1195 HE22 GLN B 1 23.743 20.767 33.165 1.00 0.00 H ATOM 1196 HE21 GLN B 1 22.621 20.452 34.538 1.00 0.00 H ATOM 1197 HN3 GLN B 1 23.963 24.434 30.616 1.00 0.00 H ATOM 1198 HN2 GLN B 1 24.202 24.326 28.938 1.00 0.00 H ATOM 1199 HN1 GLN B 1 24.655 23.035 29.945 1.00 0.00 H ATOM 1200 N VAL B 2 21.475 25.209 30.383 1.00 18.87 N ATOM 1201 CA VAL B 2 20.389 26.181 30.431 1.00 15.60 C ATOM 1202 C VAL B 2 20.820 27.454 29.716 1.00 14.48 C ATOM 1203 O VAL B 2 21.922 27.969 29.943 1.00 15.86 O ATOM 1204 CB VAL B 2 19.983 26.459 31.888 1.00 13.60 C ATOM 1205 CG1 VAL B 2 18.891 27.510 31.964 1.00 12.54 C ATOM 1206 CG2 VAL B 2 19.516 25.173 32.553 1.00 18.47 C ATOM 1207 H VAL B 2 22.199 25.233 31.129 1.00 0.00 H ATOM 1208 N GLN B 3 19.952 27.957 28.840 1.00 8.12 N ATOM 1209 CA GLN B 3 20.219 29.151 28.046 1.00 11.14 C ATOM 1210 C GLN B 3 19.217 30.222 28.453 1.00 8.99 C ATOM 1211 O GLN B 3 18.006 30.008 28.349 1.00 8.95 O ATOM 1212 CB GLN B 3 20.096 28.849 26.551 1.00 9.30 C ATOM 1213 CG GLN B 3 20.318 30.021 25.634 1.00 12.98 C ATOM 1214 CD GLN B 3 20.409 29.592 24.174 1.00 16.08 C ATOM 1215 OE1 GLN B 3 21.443 29.767 23.520 1.00 17.97 O ATOM 1216 NE2 GLN B 3 19.331 29.015 23.662 1.00 17.16 N ATOM 1217 HE22 GLN B 3 18.481 28.887 24.248 1.00 0.00 H ATOM 1218 HE21 GLN B 3 19.335 28.690 22.674 1.00 0.00 H ATOM 1219 H GLN B 3 19.039 27.475 28.716 1.00 0.00 H ATOM 1220 N LEU B 4 19.716 31.368 28.914 1.00 7.22 N ATOM 1221 CA LEU B 4 18.890 32.506 29.309 1.00 7.88 C ATOM 1222 C LEU B 4 19.189 33.679 28.388 1.00 7.44 C ATOM 1223 O LEU B 4 20.359 33.978 28.144 1.00 11.07 O ATOM 1224 CB LEU B 4 19.181 32.906 30.757 1.00 8.18 C ATOM 1225 CG LEU B 4 18.949 31.784 31.771 1.00 8.45 C ATOM 1226 CD1 LEU B 4 19.632 32.080 33.106 1.00 9.76 C ATOM 1227 CD2 LEU B 4 17.471 31.600 31.958 1.00 10.19 C ATOM 1228 H LEU B 4 20.749 31.457 28.997 1.00 0.00 H ATOM 1229 N GLN B 5 18.142 34.355 27.908 1.00 7.96 N ATOM 1230 CA GLN B 5 18.302 35.485 26.991 1.00 7.65 C ATOM 1231 C GLN B 5 17.356 36.603 27.392 1.00 5.48 C ATOM 1232 O GLN B 5 16.134 36.441 27.305 1.00 7.06 O ATOM 1233 CB GLN B 5 18.036 35.061 25.550 1.00 7.71 C ATOM 1234 CG GLN B 5 18.963 33.943 25.102 1.00 11.91 C ATOM 1235 CD GLN B 5 18.677 33.437 23.709 1.00 16.67 C ATOM 1236 OE1 GLN B 5 17.577 33.578 23.186 1.00 13.97 O ATOM 1237 NE2 GLN B 5 19.683 32.832 23.095 1.00 17.76 N ATOM 1238 HE22 GLN B 5 20.601 32.733 23.574 1.00 0.00 H ATOM 1239 HE21 GLN B 5 19.555 32.456 22.134 1.00 0.00 H ATOM 1240 H GLN B 5 17.184 34.070 28.194 1.00 0.00 H ATOM 1241 N GLU B 6 17.928 37.746 27.790 1.00 6.59 N ATOM 1242 CA GLU B 6 17.161 38.896 28.248 1.00 5.37 C ATOM 1243 C GLU B 6 16.862 39.870 27.118 1.00 8.97 C ATOM 1244 O GLU B 6 17.613 39.970 26.145 1.00 10.24 O ATOM 1245 CB GLU B 6 17.923 39.640 29.347 1.00 6.40 C ATOM 1246 CG GLU B 6 18.388 38.751 30.489 1.00 8.19 C ATOM 1247 CD GLU B 6 19.811 38.266 30.296 1.00 8.58 C ATOM 1248 OE1 GLU B 6 20.209 38.075 29.131 1.00 11.35 O ATOM 1249 OE2 GLU B 6 20.515 38.070 31.305 1.00 10.92 O ATOM 1250 H GLU B 6 18.965 37.816 27.771 1.00 0.00 H ATOM 1251 N SER B 7 15.758 40.605 27.267 1.00 6.40 N ATOM 1252 CA SER B 7 15.430 41.667 26.322 1.00 9.21 C ATOM 1253 C SER B 7 14.580 42.721 27.019 1.00 6.41 C ATOM 1254 O SER B 7 14.128 42.548 28.152 1.00 6.90 O ATOM 1255 CB SER B 7 14.719 41.110 25.083 1.00 15.38 C ATOM 1256 OG SER B 7 13.509 40.467 25.435 1.00 13.19 O ATOM 1257 HG SER B 7 13.702 39.718 26.053 1.00 0.00 H ATOM 1258 H SER B 7 15.122 40.418 28.068 1.00 0.00 H ATOM 1259 N GLY B 8 14.369 43.829 26.315 1.00 8.12 N ATOM 1260 CA GLY B 8 13.440 44.849 26.753 1.00 10.35 C ATOM 1261 C GLY B 8 14.077 46.094 27.320 1.00 10.33 C ATOM 1262 O GLY B 8 13.352 47.040 27.649 1.00 11.28 O ATOM 1263 H GLY B 8 14.887 43.967 25.424 1.00 0.00 H ATOM 1264 N GLY B 9 15.398 46.125 27.444 1.00 9.54 N ATOM 1265 CA GLY B 9 16.064 47.239 28.067 1.00 6.95 C ATOM 1266 C GLY B 9 16.199 48.432 27.151 1.00 9.84 C ATOM 1267 O GLY B 9 15.770 48.439 25.998 1.00 10.84 O ATOM 1268 H GLY B 9 15.963 45.329 27.084 1.00 0.00 H ATOM 1269 N GLY B 10 16.811 49.462 27.696 1.00 9.53 N ATOM 1270 CA GLY B 10 17.207 50.615 26.919 1.00 6.98 C ATOM 1271 C GLY B 10 17.258 51.839 27.801 1.00 9.78 C ATOM 1272 O GLY B 10 17.404 51.746 29.015 1.00 10.62 O ATOM 1273 H GLY B 10 17.016 49.446 28.716 1.00 0.00 H ATOM 1274 N SER B 11 17.093 52.988 27.153 1.00 8.28 N ATOM 1275 CA SER B 11 17.240 54.271 27.807 1.00 9.40 C ATOM 1276 C SER B 11 15.863 54.857 28.064 1.00 7.95 C ATOM 1277 O SER B 11 14.997 54.853 27.181 1.00 11.31 O ATOM 1278 CB SER B 11 18.096 55.205 26.956 1.00 10.55 C ATOM 1279 OG SER B 11 19.437 54.738 26.938 1.00 12.25 O ATOM 1280 HG SER B 11 19.462 53.826 26.554 1.00 0.00 H ATOM 1281 H SER B 11 16.850 52.964 26.142 1.00 0.00 H ATOM 1282 N VAL B 12 15.664 55.322 29.291 1.00 8.67 N ATOM 1283 CA VAL B 12 14.365 55.768 29.762 1.00 9.19 C ATOM 1284 C VAL B 12 14.584 56.922 30.730 1.00 11.68 C ATOM 1285 O VAL B 12 15.640 57.041 31.359 1.00 11.86 O ATOM 1286 CB VAL B 12 13.593 54.598 30.424 1.00 12.68 C ATOM 1287 CG1 VAL B 12 14.272 54.196 31.729 1.00 15.03 C ATOM 1288 CG2 VAL B 12 12.133 54.951 30.637 1.00 17.09 C ATOM 1289 H VAL B 12 16.473 55.369 29.943 1.00 0.00 H ATOM 1290 N GLN B 13 13.585 57.792 30.829 1.00 11.86 N ATOM 1291 CA GLN B 13 13.658 58.906 31.762 1.00 15.09 C ATOM 1292 C GLN B 13 13.218 58.480 33.155 1.00 12.65 C ATOM 1293 O GLN B 13 12.369 57.598 33.312 1.00 14.76 O ATOM 1294 CB GLN B 13 12.778 60.056 31.286 1.00 16.45 C ATOM 1295 CG GLN B 13 13.230 60.664 29.980 1.00 18.29 C ATOM 1296 CD GLN B 13 12.265 61.713 29.480 1.00 19.87 C ATOM 1297 OE1 GLN B 13 11.340 62.099 30.194 1.00 25.66 O ATOM 1298 NE2 GLN B 13 12.481 62.192 28.250 1.00 18.97 N ATOM 1299 HE22 GLN B 13 13.277 61.834 27.685 1.00 0.00 H ATOM 1300 HE21 GLN B 13 11.853 62.923 27.859 1.00 0.00 H ATOM 1301 H GLN B 13 12.741 57.675 30.233 1.00 0.00 H ATOM 1302 N ALA B 14 13.768 59.155 34.168 1.00 15.60 N ATOM 1303 CA ALA B 14 13.342 58.927 35.545 1.00 16.31 C ATOM 1304 C ALA B 14 11.832 59.091 35.680 1.00 15.14 C ATOM 1305 O ALA B 14 11.217 59.950 35.041 1.00 14.66 O ATOM 1306 CB ALA B 14 14.060 59.888 36.496 1.00 16.86 C ATOM 1307 H ALA B 14 14.512 59.855 33.972 1.00 0.00 H ATOM 1308 N GLY B 15 11.230 58.249 36.516 1.00 14.77 N ATOM 1309 CA GLY B 15 9.792 58.187 36.624 1.00 14.34 C ATOM 1310 C GLY B 15 9.131 57.277 35.615 1.00 17.04 C ATOM 1311 O GLY B 15 7.927 56.998 35.746 1.00 16.25 O ATOM 1312 H GLY B 15 11.810 57.620 37.107 1.00 0.00 H ATOM 1313 N GLY B 16 9.882 56.792 34.629 1.00 15.08 N ATOM 1314 CA GLY B 16 9.338 55.952 33.588 1.00 13.97 C ATOM 1315 C GLY B 16 9.190 54.499 34.006 1.00 13.78 C ATOM 1316 O GLY B 16 9.477 54.099 35.139 1.00 15.76 O ATOM 1317 H GLY B 16 10.895 57.026 34.608 1.00 0.00 H ATOM 1318 N SER B 17 8.700 53.708 33.053 1.00 11.45 N ATOM 1319 CA SER B 17 8.459 52.286 33.222 1.00 13.90 C ATOM 1320 C SER B 17 9.186 51.506 32.132 1.00 12.85 C ATOM 1321 O SER B 17 9.465 52.021 31.048 1.00 13.92 O ATOM 1322 CB SER B 17 6.962 51.958 33.175 1.00 16.12 C ATOM 1323 OG SER B 17 6.249 52.643 34.186 1.00 19.94 O ATOM 1324 HG SER B 17 6.360 53.619 34.063 1.00 0.00 H ATOM 1325 H SER B 17 8.476 54.135 32.131 1.00 0.00 H ATOM 1326 N LEU B 18 9.464 50.241 32.427 1.00 10.76 N ATOM 1327 CA LEU B 18 10.093 49.323 31.486 1.00 10.07 C ATOM 1328 C LEU B 18 9.705 47.913 31.898 1.00 10.54 C ATOM 1329 O LEU B 18 9.581 47.630 33.091 1.00 10.82 O ATOM 1330 CB LEU B 18 11.615 49.468 31.500 1.00 14.93 C ATOM 1331 CG LEU B 18 12.364 49.108 30.234 1.00 21.63 C ATOM 1332 CD1 LEU B 18 11.933 50.045 29.138 1.00 17.83 C ATOM 1333 CD2 LEU B 18 13.844 49.226 30.488 1.00 16.11 C ATOM 1334 H LEU B 18 9.221 49.889 33.375 1.00 0.00 H ATOM 1335 N ARG B 19 9.543 47.018 30.927 1.00 7.90 N ATOM 1336 CA ARG B 19 9.364 45.609 31.255 1.00 7.72 C ATOM 1337 C ARG B 19 10.452 44.795 30.578 1.00 7.95 C ATOM 1338 O ARG B 19 10.515 44.733 29.346 1.00 10.48 O ATOM 1339 CB ARG B 19 7.990 45.084 30.851 1.00 12.83 C ATOM 1340 CG ARG B 19 7.750 43.675 31.377 1.00 12.20 C ATOM 1341 CD ARG B 19 6.552 42.988 30.725 1.00 19.91 C ATOM 1342 NE ARG B 19 6.821 42.669 29.324 1.00 27.52 N ATOM 1343 CZ ARG B 19 5.881 42.496 28.398 1.00 32.53 C ATOM 1344 NH1 ARG B 19 6.222 42.212 27.147 1.00 32.54 N ATOM 1345 NH2 ARG B 19 4.603 42.615 28.723 1.00 31.79 N ATOM 1346 HE ARG B 19 7.814 42.571 29.031 1.00 0.00 H ATOM 1347 HH12 ARG B 19 5.486 42.077 26.425 1.00 0.00 H ATOM 1348 HH11 ARG B 19 7.226 42.124 26.889 1.00 0.00 H ATOM 1349 HH22 ARG B 19 3.868 42.480 28.000 1.00 0.00 H ATOM 1350 HH21 ARG B 19 4.334 42.844 29.701 1.00 0.00 H ATOM 1351 H ARG B 19 9.544 47.324 29.933 1.00 0.00 H ATOM 1352 N LEU B 20 11.291 44.164 31.383 1.00 5.96 N ATOM 1353 CA LEU B 20 12.317 43.268 30.871 1.00 5.97 C ATOM 1354 C LEU B 20 11.759 41.862 30.769 1.00 6.04 C ATOM 1355 O LEU B 20 10.904 41.457 31.556 1.00 7.47 O ATOM 1356 CB LEU B 20 13.538 43.245 31.786 1.00 5.86 C ATOM 1357 CG LEU B 20 14.086 44.619 32.161 1.00 6.21 C ATOM 1358 CD1 LEU B 20 15.350 44.489 32.987 1.00 7.88 C ATOM 1359 CD2 LEU B 20 14.336 45.439 30.914 1.00 8.29 C ATOM 1360 H LEU B 20 11.215 44.312 32.410 1.00 0.00 H ATOM 1361 N SER B 21 12.272 41.115 29.794 1.00 7.47 N ATOM 1362 CA SER B 21 11.890 39.724 29.614 1.00 7.94 C ATOM 1363 C SER B 21 13.141 38.864 29.589 1.00 6.10 C ATOM 1364 O SER B 21 14.207 39.300 29.147 1.00 8.34 O ATOM 1365 CB SER B 21 11.106 39.517 28.317 1.00 10.37 C ATOM 1366 OG SER B 21 9.924 40.302 28.295 1.00 15.52 O ATOM 1367 HG SER B 21 10.164 41.260 28.368 1.00 0.00 H ATOM 1368 H SER B 21 12.965 41.538 29.144 1.00 0.00 H ATOM 1369 N CYS B 22 13.015 37.630 30.074 1.00 6.69 N ATOM 1370 CA CYS B 22 14.079 36.663 29.891 1.00 7.42 C ATOM 1371 C CYS B 22 13.461 35.348 29.477 1.00 7.32 C ATOM 1372 O CYS B 22 12.585 34.838 30.169 1.00 6.43 O ATOM 1373 CB CYS B 22 14.895 36.466 31.168 1.00 6.28 C ATOM 1374 SG CYS B 22 16.242 35.256 30.926 1.00 14.90 S ATOM 1375 H CYS B 22 12.151 37.360 30.585 1.00 0.00 H ATOM 1376 N VAL B 23 13.923 34.797 28.369 1.00 5.92 N ATOM 1377 CA VAL B 23 13.432 33.498 27.913 1.00 7.02 C ATOM 1378 C VAL B 23 14.440 32.436 28.316 1.00 7.40 C ATOM 1379 O VAL B 23 15.651 32.689 28.343 1.00 8.48 O ATOM 1380 CB VAL B 23 13.187 33.510 26.393 1.00 7.38 C ATOM 1381 CG1 VAL B 23 12.043 34.465 26.051 1.00 10.70 C ATOM 1382 CG2 VAL B 23 14.438 33.880 25.629 1.00 9.04 C ATOM 1383 H VAL B 23 14.647 35.295 27.813 1.00 0.00 H ATOM 1384 N VAL B 24 13.938 31.255 28.678 1.00 6.22 N ATOM 1385 CA VAL B 24 14.787 30.138 29.071 1.00 5.73 C ATOM 1386 C VAL B 24 14.520 28.939 28.172 1.00 6.25 C ATOM 1387 O VAL B 24 13.399 28.702 27.721 1.00 7.50 O ATOM 1388 CB VAL B 24 14.565 29.763 30.555 1.00 7.26 C ATOM 1389 CG1 VAL B 24 13.140 29.222 30.793 1.00 9.13 C ATOM 1390 CG2 VAL B 24 15.595 28.749 31.031 1.00 10.95 C ATOM 1391 H VAL B 24 12.906 31.127 28.680 1.00 0.00 H ATOM 1392 N SER B 25 15.568 28.161 27.948 1.00 7.06 N ATOM 1393 CA SER B 25 15.458 26.924 27.198 1.00 7.06 C ATOM 1394 C SER B 25 16.486 25.963 27.759 1.00 11.10 C ATOM 1395 O SER B 25 17.461 26.369 28.394 1.00 9.94 O ATOM 1396 CB SER B 25 15.672 27.154 25.702 1.00 7.79 C ATOM 1397 OG SER B 25 16.962 27.701 25.439 1.00 11.10 O ATOM 1398 HG SER B 25 17.053 28.569 25.907 1.00 0.00 H ATOM 1399 H SER B 25 16.497 28.445 28.320 1.00 0.00 H ATOM 1400 N GLY B 26 16.250 24.687 27.532 1.00 11.48 N ATOM 1401 CA GLY B 26 17.164 23.654 27.969 1.00 12.87 C ATOM 1402 C GLY B 26 16.609 22.907 29.165 1.00 11.63 C ATOM 1403 O GLY B 26 15.527 23.201 29.680 1.00 16.85 O ATOM 1404 H GLY B 26 15.384 24.415 27.025 1.00 0.00 H ATOM 1405 N ASN B 27 17.389 21.920 29.603 1.00 17.96 N ATOM 1406 CA ASN B 27 17.009 21.048 30.713 1.00 19.90 C ATOM 1407 C ASN B 27 17.266 21.778 32.023 1.00 20.04 C ATOM 1408 O ASN B 27 18.393 21.817 32.520 1.00 21.61 O ATOM 1409 CB ASN B 27 17.791 19.740 30.653 1.00 20.42 C ATOM 1410 CG ASN B 27 17.101 18.690 29.815 1.00 28.61 C ATOM 1411 OD1 ASN B 27 16.344 19.009 28.896 1.00 26.92 O ATOM 1412 ND2 ASN B 27 17.352 17.424 30.131 1.00 33.66 N ATOM 1413 HD22 ASN B 27 17.998 17.202 30.915 1.00 0.00 H ATOM 1414 HD21 ASN B 27 16.902 16.655 29.594 1.00 0.00 H ATOM 1415 H ASN B 27 18.305 21.763 29.136 1.00 0.00 H ATOM 1416 N THR B 28 16.214 22.362 32.592 1.00 19.03 N ATOM 1417 CA THR B 28 16.348 23.128 33.824 1.00 18.71 C ATOM 1418 C THR B 28 16.020 22.333 35.077 1.00 14.08 C ATOM 1419 O THR B 28 16.455 22.723 36.167 1.00 19.41 O ATOM 1420 CB THR B 28 15.424 24.343 33.798 1.00 16.67 C ATOM 1421 OG1 THR B 28 14.064 23.890 33.698 1.00 16.07 O ATOM 1422 CG2 THR B 28 15.760 25.258 32.636 1.00 17.18 C ATOM 1423 HG1 THR B 28 13.849 23.321 34.479 1.00 0.00 H ATOM 1424 H THR B 28 15.278 22.270 32.148 1.00 0.00 H ATOM 1425 N GLY B 29 15.257 21.250 34.955 1.00 17.93 N ATOM 1426 CA GLY B 29 14.626 20.654 36.113 1.00 19.12 C ATOM 1427 C GLY B 29 13.392 21.448 36.491 1.00 16.81 C ATOM 1428 O GLY B 29 13.073 22.479 35.898 1.00 14.89 O ATOM 1429 H GLY B 29 15.112 20.827 34.016 1.00 0.00 H ATOM 1430 N SER B 30 12.682 20.967 37.513 1.00 14.75 N ATOM 1431 CA SER B 30 11.388 21.542 37.839 1.00 13.73 C ATOM 1432 C SER B 30 11.411 22.517 39.008 1.00 12.74 C ATOM 1433 O SER B 30 10.379 23.147 39.270 1.00 12.31 O ATOM 1434 CB SER B 30 10.375 20.435 38.151 1.00 20.98 C ATOM 1435 OG SER B 30 10.690 19.826 39.385 1.00 19.82 O ATOM 1436 HG SER B 30 10.031 19.113 39.578 1.00 0.00 H ATOM 1437 H SER B 30 13.056 20.178 38.078 1.00 0.00 H ATOM 1438 N THR B 31 12.540 22.679 39.702 1.00 12.76 N ATOM 1439 CA THR B 31 12.556 23.483 40.918 1.00 11.34 C ATOM 1440 C THR B 31 13.831 24.311 40.999 1.00 10.63 C ATOM 1441 O THR B 31 14.896 23.887 40.553 1.00 12.67 O ATOM 1442 CB THR B 31 12.420 22.596 42.169 1.00 17.33 C ATOM 1443 OG1 THR B 31 12.562 23.394 43.348 1.00 27.75 O ATOM 1444 CG2 THR B 31 13.462 21.507 42.165 1.00 14.95 C ATOM 1445 HG1 THR B 31 11.857 24.089 43.361 1.00 0.00 H ATOM 1446 H THR B 31 13.417 22.227 39.372 1.00 0.00 H ATOM 1447 N GLY B 32 13.717 25.502 41.575 1.00 10.59 N ATOM 1448 CA GLY B 32 14.896 26.314 41.771 1.00 10.41 C ATOM 1449 C GLY B 32 14.557 27.791 41.746 1.00 5.98 C ATOM 1450 O GLY B 32 13.403 28.188 41.821 1.00 8.17 O ATOM 1451 H GLY B 32 12.786 25.848 41.883 1.00 0.00 H ATOM 1452 N TYR B 33 15.614 28.590 41.641 1.00 6.33 N ATOM 1453 CA TYR B 33 15.500 30.039 41.672 1.00 7.22 C ATOM 1454 C TYR B 33 15.680 30.616 40.277 1.00 5.80 C ATOM 1455 O TYR B 33 16.526 30.159 39.502 1.00 7.30 O ATOM 1456 CB TYR B 33 16.544 30.655 42.603 1.00 9.21 C ATOM 1457 CG TYR B 33 16.322 30.470 44.084 1.00 7.46 C ATOM 1458 CD1 TYR B 33 15.545 31.370 44.815 1.00 9.30 C ATOM 1459 CD2 TYR B 33 16.898 29.410 44.757 1.00 15.21 C ATOM 1460 CE1 TYR B 33 15.363 31.215 46.170 1.00 13.46 C ATOM 1461 CE2 TYR B 33 16.713 29.248 46.109 1.00 14.62 C ATOM 1462 CZ TYR B 33 15.942 30.151 46.805 1.00 14.28 C ATOM 1463 OH TYR B 33 15.763 29.982 48.162 1.00 20.16 O ATOM 1464 HH TYR B 33 15.188 30.709 48.511 1.00 0.00 H ATOM 1465 H TYR B 33 16.556 28.163 41.533 1.00 0.00 H ATOM 1466 N TRP B 34 14.892 31.645 39.989 1.00 6.04 N ATOM 1467 CA TRP B 34 14.996 32.392 38.744 1.00 6.56 C ATOM 1468 C TRP B 34 15.006 33.849 39.163 1.00 6.54 C ATOM 1469 O TRP B 34 14.052 34.310 39.798 1.00 7.09 O ATOM 1470 CB TRP B 34 13.811 32.074 37.836 1.00 6.67 C ATOM 1471 CG TRP B 34 13.983 32.242 36.392 1.00 8.76 C ATOM 1472 CD1 TRP B 34 15.095 32.652 35.741 1.00 8.22 C ATOM 1473 CD2 TRP B 34 12.990 31.980 35.382 1.00 10.94 C ATOM 1474 NE1 TRP B 34 14.865 32.681 34.380 1.00 9.87 N ATOM 1475 CE2 TRP B 34 13.583 32.267 34.135 1.00 10.52 C ATOM 1476 CE3 TRP B 34 11.665 31.532 35.416 1.00 11.72 C ATOM 1477 CZ2 TRP B 34 12.893 32.131 32.925 1.00 8.96 C ATOM 1478 CZ3 TRP B 34 10.980 31.384 34.206 1.00 10.00 C ATOM 1479 CH2 TRP B 34 11.595 31.694 32.988 1.00 8.85 C ATOM 1480 HE1 TRP B 34 15.554 32.971 33.657 1.00 0.00 H ATOM 1481 H TRP B 34 14.170 31.929 40.682 1.00 0.00 H ATOM 1482 N ALA B 35 16.086 34.560 38.846 1.00 6.05 N ATOM 1483 CA ALA B 35 16.348 35.844 39.484 1.00 8.18 C ATOM 1484 C ALA B 35 16.809 36.897 38.489 1.00 5.14 C ATOM 1485 O ALA B 35 17.341 36.601 37.419 1.00 6.89 O ATOM 1486 CB ALA B 35 17.425 35.711 40.559 1.00 8.88 C ATOM 1487 H ALA B 35 16.751 34.195 38.134 1.00 0.00 H ATOM 1488 N TRP B 36 16.622 38.151 38.892 1.00 6.04 N ATOM 1489 CA TRP B 36 17.164 39.303 38.192 1.00 7.25 C ATOM 1490 C TRP B 36 18.241 39.943 39.053 1.00 7.61 C ATOM 1491 O TRP B 36 18.043 40.154 40.260 1.00 8.12 O ATOM 1492 CB TRP B 36 16.070 40.327 37.886 1.00 6.52 C ATOM 1493 CG TRP B 36 15.142 39.939 36.785 1.00 5.69 C ATOM 1494 CD1 TRP B 36 13.890 39.408 36.910 1.00 9.06 C ATOM 1495 CD2 TRP B 36 15.384 40.072 35.385 1.00 7.64 C ATOM 1496 NE1 TRP B 36 13.343 39.192 35.667 1.00 9.00 N ATOM 1497 CE2 TRP B 36 14.238 39.596 34.716 1.00 7.08 C ATOM 1498 CE3 TRP B 36 16.452 40.561 34.632 1.00 9.02 C ATOM 1499 CZ2 TRP B 36 14.148 39.575 33.320 1.00 6.42 C ATOM 1500 CZ3 TRP B 36 16.353 40.540 33.250 1.00 9.30 C ATOM 1501 CH2 TRP B 36 15.207 40.063 32.618 1.00 7.15 C ATOM 1502 HE1 TRP B 36 12.403 38.788 35.481 1.00 0.00 H ATOM 1503 H TRP B 36 16.060 38.315 39.751 1.00 0.00 H ATOM 1504 N PHE B 37 19.352 40.275 38.415 1.00 8.01 N ATOM 1505 CA PHE B 37 20.489 40.924 39.033 1.00 6.51 C ATOM 1506 C PHE B 37 20.790 42.166 38.220 1.00 10.66 C ATOM 1507 O PHE B 37 20.513 42.217 37.022 1.00 10.00 O ATOM 1508 CB PHE B 37 21.720 40.000 39.039 1.00 7.65 C ATOM 1509 CG PHE B 37 21.681 38.936 40.103 1.00 6.81 C ATOM 1510 CD1 PHE B 37 21.068 37.712 39.867 1.00 8.80 C ATOM 1511 CD2 PHE B 37 22.294 39.152 41.326 1.00 8.94 C ATOM 1512 CE1 PHE B 37 21.053 36.735 40.867 1.00 8.03 C ATOM 1513 CE2 PHE B 37 22.271 38.190 42.326 1.00 10.81 C ATOM 1514 CZ PHE B 37 21.650 36.986 42.099 1.00 8.81 C ATOM 1515 H PHE B 37 19.412 40.055 37.400 1.00 0.00 H ATOM 1516 N ARG B 38 21.356 43.166 38.862 1.00 10.47 N ATOM 1517 CA ARG B 38 21.832 44.303 38.102 1.00 10.12 C ATOM 1518 C ARG B 38 23.288 44.544 38.452 1.00 13.23 C ATOM 1519 O ARG B 38 23.685 44.431 39.614 1.00 14.63 O ATOM 1520 CB ARG B 38 20.980 45.535 38.343 1.00 15.84 C ATOM 1521 CG ARG B 38 20.886 46.013 39.750 1.00 12.52 C ATOM 1522 CD ARG B 38 19.795 47.091 39.839 1.00 16.41 C ATOM 1523 NE ARG B 38 19.652 47.635 41.187 1.00 18.87 N ATOM 1524 CZ ARG B 38 18.599 48.327 41.602 1.00 21.44 C ATOM 1525 NH1 ARG B 38 17.580 48.565 40.769 1.00 13.43 N ATOM 1526 NH2 ARG B 38 18.567 48.779 42.851 1.00 18.94 N ATOM 1527 HE ARG B 38 20.424 47.469 41.864 1.00 0.00 H ATOM 1528 HH12 ARG B 38 16.756 49.108 41.097 1.00 0.00 H ATOM 1529 HH11 ARG B 38 17.612 48.207 39.793 1.00 0.00 H ATOM 1530 HH22 ARG B 38 17.746 49.323 43.186 1.00 0.00 H ATOM 1531 HH21 ARG B 38 19.363 48.589 43.493 1.00 0.00 H ATOM 1532 H ARG B 38 21.459 43.140 39.897 1.00 0.00 H ATOM 1533 N GLN B 39 24.086 44.838 37.436 1.00 17.46 N ATOM 1534 CA GLN B 39 25.497 45.112 37.666 1.00 20.01 C ATOM 1535 C GLN B 39 25.919 46.448 37.063 1.00 25.06 C ATOM 1536 O GLN B 39 25.350 46.904 36.074 1.00 19.12 O ATOM 1537 CB GLN B 39 26.364 43.980 37.110 1.00 27.32 C ATOM 1538 CG GLN B 39 25.927 43.456 35.758 1.00 23.02 C ATOM 1539 CD GLN B 39 27.033 42.691 35.035 1.00 23.62 C ATOM 1540 OE1 GLN B 39 27.469 43.094 33.955 1.00 26.79 O ATOM 1541 NE2 GLN B 39 27.465 41.570 35.611 1.00 19.91 N ATOM 1542 HE22 GLN B 39 27.068 41.268 36.524 1.00 0.00 H ATOM 1543 HE21 GLN B 39 28.199 40.997 35.148 1.00 0.00 H ATOM 1544 H GLN B 39 23.703 44.873 36.470 1.00 0.00 H TER 1545 GLN B 39 ATOM 1546 N ARG B 45 27.291 43.347 41.650 1.00 31.10 N ATOM 1547 CA ARG B 45 26.170 42.583 41.110 1.00 24.21 C ATOM 1548 C ARG B 45 25.096 42.344 42.169 1.00 19.47 C ATOM 1549 O ARG B 45 25.220 41.443 42.997 1.00 21.05 O ATOM 1550 CB ARG B 45 26.654 41.253 40.554 1.00 27.17 C ATOM 1551 CG ARG B 45 25.684 40.627 39.592 1.00 22.16 C ATOM 1552 CD ARG B 45 26.272 39.398 38.927 1.00 24.04 C ATOM 1553 NE ARG B 45 27.457 39.700 38.137 1.00 28.45 N ATOM 1554 CZ ARG B 45 28.692 39.357 38.487 1.00 31.73 C ATOM 1555 NH1 ARG B 45 28.903 38.703 39.621 1.00 34.03 N ATOM 1556 NH2 ARG B 45 29.719 39.669 37.704 1.00 31.46 N ATOM 1557 HE ARG B 45 27.329 40.216 37.243 1.00 0.00 H ATOM 1558 HH12 ARG B 45 29.870 38.435 39.894 1.00 0.00 H ATOM 1559 HH11 ARG B 45 28.102 38.458 40.237 1.00 0.00 H ATOM 1560 HH22 ARG B 45 30.685 39.399 37.981 1.00 0.00 H ATOM 1561 HH21 ARG B 45 29.557 40.183 36.814 1.00 0.00 H ATOM 1562 HN3 ARG B 45 27.717 42.823 42.441 1.00 0.00 H ATOM 1563 HN2 ARG B 45 26.949 44.269 41.988 1.00 0.00 H ATOM 1564 HN1 ARG B 45 28.002 43.491 40.905 1.00 0.00 H ATOM 1565 N GLU B 46 24.034 43.142 42.120 1.00 15.23 N ATOM 1566 CA GLU B 46 23.055 43.229 43.196 1.00 15.84 C ATOM 1567 C GLU B 46 21.803 42.433 42.846 1.00 9.91 C ATOM 1568 O GLU B 46 21.229 42.621 41.768 1.00 14.58 O ATOM 1569 CB GLU B 46 22.677 44.687 43.458 1.00 18.73 C ATOM 1570 CG GLU B 46 21.671 44.884 44.584 1.00 23.00 C ATOM 1571 CD GLU B 46 20.673 45.999 44.298 1.00 26.14 C ATOM 1572 OE1 GLU B 46 19.443 45.762 44.416 1.00 27.29 O ATOM 1573 OE2 GLU B 46 21.118 47.117 43.952 1.00 28.48 O ATOM 1574 H GLU B 46 23.895 43.732 41.275 1.00 0.00 H ATOM 1575 N GLY B 47 21.376 41.570 43.758 1.00 9.02 N ATOM 1576 CA GLY B 47 20.092 40.903 43.609 1.00 8.29 C ATOM 1577 C GLY B 47 18.950 41.903 43.604 1.00 10.70 C ATOM 1578 O GLY B 47 18.843 42.733 44.505 1.00 13.28 O ATOM 1579 H GLY B 47 21.966 41.368 44.590 1.00 0.00 H ATOM 1580 N VAL B 48 18.112 41.851 42.576 1.00 8.66 N ATOM 1581 CA VAL B 48 16.967 42.743 42.422 1.00 7.67 C ATOM 1582 C VAL B 48 15.671 42.063 42.851 1.00 6.57 C ATOM 1583 O VAL B 48 14.922 42.591 43.667 1.00 6.50 O ATOM 1584 CB VAL B 48 16.898 43.225 40.953 1.00 8.57 C ATOM 1585 CG1 VAL B 48 15.610 44.011 40.692 1.00 10.20 C ATOM 1586 CG2 VAL B 48 18.124 44.068 40.609 1.00 12.28 C ATOM 1587 H VAL B 48 18.280 41.136 41.840 1.00 0.00 H ATOM 1588 N ALA B 49 15.398 40.876 42.313 1.00 6.42 N ATOM 1589 CA ALA B 49 14.183 40.145 42.633 1.00 6.62 C ATOM 1590 C ALA B 49 14.412 38.710 42.205 1.00 6.78 C ATOM 1591 O ALA B 49 15.225 38.451 41.318 1.00 5.96 O ATOM 1592 CB ALA B 49 12.953 40.743 41.940 1.00 6.94 C ATOM 1593 H ALA B 49 16.075 40.459 41.643 1.00 0.00 H ATOM 1594 N ALA B 50 13.746 37.777 42.888 1.00 4.77 N ATOM 1595 CA ALA B 50 13.865 36.372 42.519 1.00 5.18 C ATOM 1596 C ALA B 50 12.583 35.624 42.833 1.00 9.15 C ATOM 1597 O ALA B 50 11.825 35.995 43.728 1.00 7.79 O ATOM 1598 CB ALA B 50 15.035 35.692 43.246 1.00 8.16 C ATOM 1599 H ALA B 50 13.140 38.053 43.687 1.00 0.00 H ATOM 1600 N THR B 51 12.369 34.531 42.106 1.00 6.92 N ATOM 1601 CA THR B 51 11.256 33.637 42.414 1.00 8.71 C ATOM 1602 C THR B 51 11.779 32.222 42.574 1.00 8.30 C ATOM 1603 O THR B 51 12.482 31.713 41.697 1.00 7.77 O ATOM 1604 CB THR B 51 10.161 33.680 41.334 1.00 9.82 C ATOM 1605 OG1 THR B 51 9.641 35.018 41.226 1.00 11.53 O ATOM 1606 CG2 THR B 51 8.998 32.735 41.690 1.00 12.45 C ATOM 1607 HG1 THR B 51 8.937 35.042 40.530 1.00 0.00 H ATOM 1608 H THR B 51 13.001 34.311 41.310 1.00 0.00 H ATOM 1609 N TYR B 52 11.422 31.589 43.685 1.00 9.53 N ATOM 1610 CA TYR B 52 11.677 30.170 43.873 1.00 9.52 C ATOM 1611 C TYR B 52 10.440 29.379 43.476 1.00 10.71 C ATOM 1612 O TYR B 52 9.347 29.654 43.961 1.00 11.88 O ATOM 1613 CB TYR B 52 12.035 29.867 45.330 1.00 11.46 C ATOM 1614 CG TYR B 52 12.347 28.409 45.565 1.00 9.87 C ATOM 1615 CD1 TYR B 52 13.599 27.897 45.270 1.00 12.36 C ATOM 1616 CD2 TYR B 52 11.367 27.533 46.038 1.00 14.26 C ATOM 1617 CE1 TYR B 52 13.890 26.560 45.462 1.00 15.75 C ATOM 1618 CE2 TYR B 52 11.650 26.186 46.233 1.00 16.89 C ATOM 1619 CZ TYR B 52 12.907 25.713 45.943 1.00 15.32 C ATOM 1620 OH TYR B 52 13.209 24.381 46.127 1.00 19.19 O ATOM 1621 HH TYR B 52 14.151 24.219 45.870 1.00 0.00 H ATOM 1622 H TYR B 52 10.947 32.122 44.441 1.00 0.00 H ATOM 1623 N THR B 53 10.621 28.377 42.628 1.00 6.95 N ATOM 1624 CA THR B 53 9.530 27.502 42.230 1.00 9.62 C ATOM 1625 C THR B 53 9.765 26.153 42.882 1.00 11.13 C ATOM 1626 O THR B 53 10.799 25.524 42.635 1.00 10.04 O ATOM 1627 CB THR B 53 9.462 27.373 40.712 1.00 9.23 C ATOM 1628 OG1 THR B 53 9.134 28.652 40.160 1.00 11.76 O ATOM 1629 CG2 THR B 53 8.418 26.315 40.285 1.00 10.58 C ATOM 1630 HG1 THR B 53 9.831 29.308 40.412 1.00 0.00 H ATOM 1631 H THR B 53 11.570 28.212 42.236 1.00 0.00 H ATOM 1632 N ALA B 54 8.805 25.714 43.696 1.00 13.94 N ATOM 1633 CA ALA B 54 8.888 24.438 44.397 1.00 17.28 C ATOM 1634 C ALA B 54 8.281 23.307 43.568 1.00 21.53 C ATOM 1635 O ALA B 54 7.629 23.524 42.543 1.00 22.61 O ATOM 1636 CB ALA B 54 8.190 24.533 45.754 1.00 22.40 C ATOM 1637 H ALA B 54 7.962 26.306 43.837 1.00 0.00 H ATOM 1638 N GLY B 55 8.501 22.075 44.039 1.00 26.35 N ATOM 1639 CA GLY B 55 8.016 20.912 43.313 1.00 28.00 C ATOM 1640 C GLY B 55 6.506 20.864 43.187 1.00 29.54 C ATOM 1641 O GLY B 55 5.979 20.404 42.169 1.00 33.73 O ATOM 1642 H GLY B 55 9.022 21.948 44.930 1.00 0.00 H ATOM 1643 N SER B 56 5.791 21.328 44.207 1.00 30.69 N ATOM 1644 CA SER B 56 4.333 21.364 44.156 1.00 32.01 C ATOM 1645 C SER B 56 3.849 22.185 42.964 1.00 31.97 C ATOM 1646 O SER B 56 2.683 22.564 42.887 1.00 37.38 O ATOM 1647 CB SER B 56 3.767 21.936 45.454 1.00 33.97 C ATOM 1648 OG SER B 56 4.324 23.211 45.717 1.00 32.58 O ATOM 1649 HG SER B 56 4.106 23.825 44.972 1.00 0.00 H ATOM 1650 H SER B 56 6.280 21.672 45.058 1.00 0.00 H TER 1651 SER B 56 ATOM 1652 N THR B 58 2.758 27.723 44.644 1.00 30.21 N ATOM 1653 CA THR B 58 3.862 26.830 44.318 1.00 19.38 C ATOM 1654 C THR B 58 5.176 27.592 44.237 1.00 20.40 C ATOM 1655 O THR B 58 6.222 26.994 43.998 1.00 16.86 O ATOM 1656 CB THR B 58 3.630 26.080 42.982 1.00 21.75 C ATOM 1657 OG1 THR B 58 4.586 25.026 42.854 1.00 34.05 O ATOM 1658 CG2 THR B 58 3.783 27.009 41.799 1.00 21.00 C ATOM 1659 HG1 THR B 58 5.499 25.408 42.864 1.00 0.00 H ATOM 1660 HN3 THR B 58 2.675 28.453 43.908 1.00 0.00 H ATOM 1661 HN2 THR B 58 2.939 28.175 45.563 1.00 0.00 H ATOM 1662 HN1 THR B 58 1.874 27.177 44.693 1.00 0.00 H ATOM 1663 N SER B 59 5.128 28.908 44.441 1.00 18.18 N ATOM 1664 CA SER B 59 6.326 29.726 44.326 1.00 14.66 C ATOM 1665 C SER B 59 6.413 30.715 45.475 1.00 14.47 C ATOM 1666 O SER B 59 5.426 31.013 46.155 1.00 14.69 O ATOM 1667 CB SER B 59 6.364 30.482 43.002 1.00 16.20 C ATOM 1668 OG SER B 59 5.408 31.523 43.005 1.00 16.34 O ATOM 1669 HG SER B 59 5.609 32.152 43.743 1.00 0.00 H ATOM 1670 H SER B 59 4.222 29.356 44.686 1.00 0.00 H ATOM 1671 N MET B 60 7.623 31.228 45.674 1.00 13.68 N ATOM 1672 CA MET B 60 7.897 32.287 46.631 1.00 14.03 C ATOM 1673 C MET B 60 8.723 33.359 45.941 1.00 11.59 C ATOM 1674 O MET B 60 9.644 33.051 45.178 1.00 12.13 O ATOM 1675 CB MET B 60 8.636 31.751 47.866 1.00 16.45 C ATOM 1676 CG MET B 60 7.776 30.866 48.758 1.00 23.97 C ATOM 1677 SD MET B 60 8.648 30.311 50.234 1.00 48.38 S ATOM 1678 CE MET B 60 7.625 28.926 50.744 1.00 33.57 C ATOM 1679 H MET B 60 8.415 30.852 45.115 1.00 0.00 H ATOM 1680 N THR B 61 8.398 34.617 46.205 1.00 8.38 N ATOM 1681 CA THR B 61 9.047 35.728 45.528 1.00 8.86 C ATOM 1682 C THR B 61 9.739 36.638 46.532 1.00 9.77 C ATOM 1683 O THR B 61 9.253 36.832 47.649 1.00 10.66 O ATOM 1684 CB THR B 61 8.023 36.501 44.708 1.00 12.36 C ATOM 1685 OG1 THR B 61 7.659 35.713 43.570 1.00 13.33 O ATOM 1686 CG2 THR B 61 8.590 37.806 44.243 1.00 11.76 C ATOM 1687 HG1 THR B 61 6.993 36.206 43.028 1.00 0.00 H ATOM 1688 H THR B 61 7.662 34.814 46.913 1.00 0.00 H ATOM 1689 N TYR B 62 10.890 37.180 46.139 1.00 8.79 N ATOM 1690 CA TYR B 62 11.680 38.061 46.985 1.00 9.15 C ATOM 1691 C TYR B 62 12.081 39.312 46.214 1.00 6.50 C ATOM 1692 O TYR B 62 12.345 39.263 45.009 1.00 7.75 O ATOM 1693 CB TYR B 62 12.952 37.359 47.487 1.00 11.19 C ATOM 1694 CG TYR B 62 12.717 36.046 48.203 1.00 12.00 C ATOM 1695 CD1 TYR B 62 12.492 36.009 49.573 1.00 14.82 C ATOM 1696 CD2 TYR B 62 12.735 34.855 47.510 1.00 12.86 C ATOM 1697 CE1 TYR B 62 12.284 34.796 50.231 1.00 16.43 C ATOM 1698 CE2 TYR B 62 12.534 33.646 48.148 1.00 18.27 C ATOM 1699 CZ TYR B 62 12.308 33.622 49.506 1.00 21.92 C ATOM 1700 OH TYR B 62 12.105 32.412 50.132 1.00 24.60 O ATOM 1701 HH TYR B 62 11.958 32.563 51.099 1.00 0.00 H ATOM 1702 H TYR B 62 11.240 36.964 45.184 1.00 0.00 H ATOM 1703 N TYR B 63 12.169 40.430 46.936 1.00 8.87 N ATOM 1704 CA TYR B 63 12.594 41.708 46.384 1.00 9.46 C ATOM 1705 C TYR B 63 13.667 42.340 47.256 1.00 12.32 C ATOM 1706 O TYR B 63 13.597 42.269 48.486 1.00 10.97 O ATOM 1707 CB TYR B 63 11.418 42.688 46.280 1.00 8.81 C ATOM 1708 CG TYR B 63 10.367 42.242 45.308 1.00 8.40 C ATOM 1709 CD1 TYR B 63 10.529 42.451 43.948 1.00 9.90 C ATOM 1710 CD2 TYR B 63 9.213 41.602 45.745 1.00 7.67 C ATOM 1711 CE1 TYR B 63 9.576 42.033 43.050 1.00 8.67 C ATOM 1712 CE2 TYR B 63 8.246 41.188 44.844 1.00 8.23 C ATOM 1713 CZ TYR B 63 8.449 41.408 43.489 1.00 9.65 C ATOM 1714 OH TYR B 63 7.526 41.000 42.565 1.00 8.24 O ATOM 1715 HH TYR B 63 7.411 40.019 42.626 1.00 0.00 H ATOM 1716 H TYR B 63 11.921 40.386 47.945 1.00 0.00 H ATOM 1717 N ALA B 64 14.635 42.987 46.608 1.00 8.80 N ATOM 1718 CA ALA B 64 15.530 43.903 47.308 1.00 12.49 C ATOM 1719 C ALA B 64 14.733 45.071 47.884 1.00 12.28 C ATOM 1720 O ALA B 64 13.753 45.536 47.295 1.00 11.55 O ATOM 1721 CB ALA B 64 16.609 44.427 46.358 1.00 12.20 C ATOM 1722 H ALA B 64 14.755 42.837 45.586 1.00 0.00 H ATOM 1723 N ASP B 65 15.162 45.561 49.051 1.00 15.04 N ATOM 1724 CA ASP B 65 14.415 46.645 49.687 1.00 14.66 C ATOM 1725 C ASP B 65 14.315 47.877 48.787 1.00 12.77 C ATOM 1726 O ASP B 65 13.286 48.564 48.792 1.00 15.89 O ATOM 1727 CB ASP B 65 15.053 47.007 51.029 1.00 20.63 C ATOM 1728 CG ASP B 65 14.966 45.873 52.042 1.00 27.61 C ATOM 1729 OD1 ASP B 65 14.062 45.022 51.910 1.00 28.09 O ATOM 1730 OD2 ASP B 65 15.802 45.831 52.971 1.00 36.49 O ATOM 1731 H ASP B 65 16.017 45.176 49.501 1.00 0.00 H ATOM 1732 N SER B 66 15.343 48.141 47.975 1.00 14.61 N ATOM 1733 CA SER B 66 15.379 49.364 47.177 1.00 19.30 C ATOM 1734 C SER B 66 14.387 49.350 46.019 1.00 16.93 C ATOM 1735 O SER B 66 14.079 50.413 45.471 1.00 17.74 O ATOM 1736 CB SER B 66 16.795 49.603 46.654 1.00 19.99 C ATOM 1737 OG SER B 66 17.178 48.611 45.719 1.00 21.93 O ATOM 1738 HG SER B 66 18.097 48.796 45.402 1.00 0.00 H ATOM 1739 H SER B 66 16.130 47.465 47.910 1.00 0.00 H ATOM 1740 N VAL B 67 13.849 48.191 45.650 1.00 15.48 N ATOM 1741 CA VAL B 67 12.904 48.112 44.541 1.00 12.59 C ATOM 1742 C VAL B 67 11.506 47.699 44.975 1.00 9.21 C ATOM 1743 O VAL B 67 10.597 47.710 44.136 1.00 11.50 O ATOM 1744 CB VAL B 67 13.415 47.175 43.421 1.00 8.20 C ATOM 1745 CG1 VAL B 67 14.844 47.559 43.025 1.00 12.98 C ATOM 1746 CG2 VAL B 67 13.362 45.728 43.855 1.00 11.10 C ATOM 1747 H VAL B 67 14.107 47.323 46.162 1.00 0.00 H ATOM 1748 N LYS B 68 11.286 47.357 46.247 1.00 10.52 N ATOM 1749 CA LYS B 68 9.962 46.929 46.682 1.00 11.61 C ATOM 1750 C LYS B 68 8.937 48.020 46.397 1.00 15.50 C ATOM 1751 O LYS B 68 9.174 49.208 46.657 1.00 17.93 O ATOM 1752 CB LYS B 68 9.981 46.570 48.179 1.00 15.06 C ATOM 1753 CG LYS B 68 8.694 45.905 48.687 1.00 21.75 C ATOM 1754 CD LYS B 68 8.905 44.965 49.883 1.00 31.10 C ATOM 1755 CE LYS B 68 10.205 45.238 50.613 1.00 29.83 C ATOM 1756 NZ LYS B 68 10.154 44.630 51.977 1.00 30.92 N ATOM 1757 HZ1 LYS B 68 9.364 45.045 52.511 1.00 0.00 H ATOM 1758 HZ2 LYS B 68 10.015 43.603 51.892 1.00 0.00 H ATOM 1759 HZ3 LYS B 68 11.048 44.820 52.474 1.00 0.00 H ATOM 1760 H LYS B 68 12.066 47.396 46.934 1.00 0.00 H ATOM 1761 N GLY B 69 7.796 47.611 45.842 1.00 12.58 N ATOM 1762 CA GLY B 69 6.747 48.548 45.508 1.00 15.75 C ATOM 1763 C GLY B 69 6.919 49.233 44.176 1.00 16.81 C ATOM 1764 O GLY B 69 5.979 49.899 43.708 1.00 18.99 O ATOM 1765 H GLY B 69 7.658 46.599 45.646 1.00 0.00 H ATOM 1766 N ARG B 70 8.081 49.090 43.549 1.00 12.09 N ATOM 1767 CA ARG B 70 8.356 49.652 42.238 1.00 9.45 C ATOM 1768 C ARG B 70 8.562 48.588 41.178 1.00 10.04 C ATOM 1769 O ARG B 70 8.136 48.778 40.039 1.00 11.77 O ATOM 1770 CB ARG B 70 9.591 50.553 42.291 1.00 12.11 C ATOM 1771 CG ARG B 70 9.392 51.804 43.147 1.00 15.86 C ATOM 1772 CD ARG B 70 10.522 52.810 42.976 1.00 12.26 C ATOM 1773 NE ARG B 70 11.809 52.198 43.282 1.00 11.56 N ATOM 1774 CZ ARG B 70 12.800 52.033 42.408 1.00 13.41 C ATOM 1775 NH1 ARG B 70 12.672 52.460 41.158 1.00 13.40 N ATOM 1776 NH2 ARG B 70 13.914 51.435 42.789 1.00 12.20 N ATOM 1777 HE ARG B 70 11.965 51.866 44.255 1.00 0.00 H ATOM 1778 HH12 ARG B 70 13.450 52.328 40.481 1.00 0.00 H ATOM 1779 HH11 ARG B 70 11.793 52.927 40.855 1.00 0.00 H ATOM 1780 HH22 ARG B 70 14.692 51.303 42.111 1.00 0.00 H ATOM 1781 HH21 ARG B 70 14.014 51.096 43.767 1.00 0.00 H ATOM 1782 H ARG B 70 8.833 48.548 44.021 1.00 0.00 H ATOM 1783 N PHE B 71 9.204 47.470 41.515 1.00 9.99 N ATOM 1784 CA PHE B 71 9.410 46.389 40.567 1.00 9.33 C ATOM 1785 C PHE B 71 8.532 45.200 40.934 1.00 8.09 C ATOM 1786 O PHE B 71 8.229 44.966 42.103 1.00 9.85 O ATOM 1787 CB PHE B 71 10.871 45.916 40.514 1.00 8.15 C ATOM 1788 CG PHE B 71 11.875 46.965 40.043 1.00 8.35 C ATOM 1789 CD1 PHE B 71 11.509 48.282 39.779 1.00 10.03 C ATOM 1790 CD2 PHE B 71 13.204 46.615 39.888 1.00 10.18 C ATOM 1791 CE1 PHE B 71 12.453 49.222 39.382 1.00 9.03 C ATOM 1792 CE2 PHE B 71 14.155 47.549 39.468 1.00 10.30 C ATOM 1793 CZ PHE B 71 13.775 48.854 39.224 1.00 11.86 C ATOM 1794 H PHE B 71 9.568 47.369 42.484 1.00 0.00 H ATOM 1795 N THR B 72 8.145 44.440 39.915 1.00 8.75 N ATOM 1796 CA THR B 72 7.410 43.194 40.095 1.00 8.08 C ATOM 1797 C THR B 72 8.022 42.138 39.198 1.00 6.53 C ATOM 1798 O THR B 72 8.196 42.350 37.990 1.00 7.12 O ATOM 1799 CB THR B 72 5.914 43.337 39.780 1.00 9.14 C ATOM 1800 OG1 THR B 72 5.335 44.345 40.620 1.00 15.26 O ATOM 1801 CG2 THR B 72 5.186 42.015 40.020 1.00 10.15 C ATOM 1802 HG1 THR B 72 4.371 44.432 40.412 1.00 0.00 H ATOM 1803 H THR B 72 8.376 44.747 38.949 1.00 0.00 H ATOM 1804 N ILE B 73 8.335 40.996 39.785 1.00 6.08 N ATOM 1805 CA ILE B 73 8.850 39.862 39.036 1.00 5.96 C ATOM 1806 C ILE B 73 7.716 38.876 38.826 1.00 5.62 C ATOM 1807 O ILE B 73 6.909 38.647 39.727 1.00 8.66 O ATOM 1808 CB ILE B 73 10.033 39.209 39.771 1.00 6.50 C ATOM 1809 CG1 ILE B 73 10.733 38.198 38.872 1.00 6.47 C ATOM 1810 CG2 ILE B 73 9.554 38.556 41.078 1.00 8.41 C ATOM 1811 CD1 ILE B 73 11.961 37.553 39.535 1.00 8.55 C ATOM 1812 H ILE B 73 8.209 40.906 40.813 1.00 0.00 H ATOM 1813 N SER B 74 7.618 38.328 37.621 1.00 5.37 N ATOM 1814 CA SER B 74 6.590 37.327 37.370 1.00 7.74 C ATOM 1815 C SER B 74 7.093 36.396 36.285 1.00 9.52 C ATOM 1816 O SER B 74 8.059 36.698 35.584 1.00 9.46 O ATOM 1817 CB SER B 74 5.268 37.965 36.947 1.00 9.69 C ATOM 1818 OG SER B 74 5.462 38.716 35.772 1.00 9.82 O ATOM 1819 HG SER B 74 4.604 39.128 35.500 1.00 0.00 H ATOM 1820 H SER B 74 8.270 38.611 36.862 1.00 0.00 H ATOM 1821 N GLN B 75 6.450 35.243 36.160 1.00 9.60 N ATOM 1822 CA GLN B 75 6.917 34.305 35.159 1.00 9.45 C ATOM 1823 C GLN B 75 5.739 33.629 34.486 1.00 10.43 C ATOM 1824 O GLN B 75 4.785 33.220 35.147 1.00 9.98 O ATOM 1825 CB GLN B 75 7.853 33.261 35.758 1.00 11.44 C ATOM 1826 CG GLN B 75 7.267 32.466 36.889 1.00 13.09 C ATOM 1827 CD GLN B 75 8.320 31.634 37.562 1.00 14.85 C ATOM 1828 OE1 GLN B 75 9.172 32.166 38.269 1.00 14.44 O ATOM 1829 NE2 GLN B 75 8.296 30.330 37.318 1.00 12.49 N ATOM 1830 HE22 GLN B 75 7.553 29.928 36.712 1.00 0.00 H ATOM 1831 HE21 GLN B 75 9.021 29.710 37.733 1.00 0.00 H ATOM 1832 H GLN B 75 5.633 35.018 36.763 1.00 0.00 H ATOM 1833 N ASP B 76 5.809 33.538 33.168 1.00 11.61 N ATOM 1834 CA ASP B 76 4.831 32.801 32.369 1.00 13.91 C ATOM 1835 C ASP B 76 5.424 31.416 32.153 1.00 13.45 C ATOM 1836 O ASP B 76 6.304 31.232 31.307 1.00 15.84 O ATOM 1837 CB ASP B 76 4.551 33.516 31.052 1.00 18.36 C ATOM 1838 CG ASP B 76 3.389 32.901 30.281 1.00 19.41 C ATOM 1839 OD1 ASP B 76 3.187 31.680 30.387 1.00 21.56 O ATOM 1840 OD2 ASP B 76 2.674 33.646 29.575 1.00 26.55 O ATOM 1841 H ASP B 76 6.595 34.012 32.678 1.00 0.00 H ATOM 1842 N ASN B 77 4.947 30.434 32.928 1.00 12.19 N ATOM 1843 CA ASN B 77 5.561 29.112 32.844 1.00 10.93 C ATOM 1844 C ASN B 77 5.284 28.447 31.502 1.00 16.33 C ATOM 1845 O ASN B 77 6.114 27.657 31.029 1.00 19.44 O ATOM 1846 CB ASN B 77 5.088 28.232 34.002 1.00 14.13 C ATOM 1847 CG ASN B 77 5.732 28.626 35.308 1.00 15.28 C ATOM 1848 OD1 ASN B 77 6.710 29.375 35.311 1.00 14.58 O ATOM 1849 ND2 ASN B 77 5.203 28.125 36.419 1.00 19.30 N ATOM 1850 HD22 ASN B 77 4.376 27.496 36.364 1.00 0.00 H ATOM 1851 HD21 ASN B 77 5.616 28.361 37.344 1.00 0.00 H ATOM 1852 H ASN B 77 4.154 30.610 33.578 1.00 0.00 H ATOM 1853 N ALA B 78 4.157 28.776 30.861 1.00 14.48 N ATOM 1854 CA ALA B 78 3.855 28.184 29.559 1.00 16.84 C ATOM 1855 C ALA B 78 4.776 28.725 28.472 1.00 19.05 C ATOM 1856 O ALA B 78 5.137 27.999 27.538 1.00 20.63 O ATOM 1857 CB ALA B 78 2.396 28.446 29.187 1.00 17.28 C ATOM 1858 H ALA B 78 3.495 29.454 31.289 1.00 0.00 H ATOM 1859 N LYS B 79 5.141 30.001 28.562 1.00 15.78 N ATOM 1860 CA LYS B 79 6.018 30.652 27.596 1.00 14.56 C ATOM 1861 C LYS B 79 7.480 30.647 28.024 1.00 13.31 C ATOM 1862 O LYS B 79 8.317 31.220 27.314 1.00 12.88 O ATOM 1863 CB LYS B 79 5.566 32.100 27.357 1.00 17.32 C ATOM 1864 CG LYS B 79 4.198 32.242 26.701 1.00 23.78 C ATOM 1865 CD LYS B 79 4.270 33.134 25.463 1.00 27.60 C ATOM 1866 CE LYS B 79 5.026 32.447 24.320 1.00 25.76 C ATOM 1867 NZ LYS B 79 5.159 33.320 23.114 1.00 32.04 N ATOM 1868 HZ1 LYS B 79 4.213 33.574 22.765 1.00 0.00 H ATOM 1869 HZ2 LYS B 79 5.679 34.184 23.369 1.00 0.00 H ATOM 1870 HZ3 LYS B 79 5.677 32.808 22.372 1.00 0.00 H ATOM 1871 H LYS B 79 4.783 30.562 29.361 1.00 0.00 H ATOM 1872 N LYS B 80 7.802 30.016 29.156 1.00 10.67 N ATOM 1873 CA LYS B 80 9.164 29.936 29.684 1.00 8.74 C ATOM 1874 C LYS B 80 9.835 31.308 29.680 1.00 10.07 C ATOM 1875 O LYS B 80 10.963 31.488 29.207 1.00 9.38 O ATOM 1876 CB LYS B 80 9.985 28.907 28.916 1.00 12.19 C ATOM 1877 CG LYS B 80 9.548 27.495 29.221 1.00 11.83 C ATOM 1878 CD LYS B 80 10.566 26.502 28.749 1.00 12.46 C ATOM 1879 CE LYS B 80 10.169 25.080 29.108 1.00 13.62 C ATOM 1880 NZ LYS B 80 11.185 24.101 28.654 1.00 18.31 N ATOM 1881 HZ1 LYS B 80 11.288 24.164 27.621 1.00 0.00 H ATOM 1882 HZ2 LYS B 80 12.096 24.313 29.108 1.00 0.00 H ATOM 1883 HZ3 LYS B 80 10.881 23.141 28.916 1.00 0.00 H ATOM 1884 H LYS B 80 7.040 29.555 29.693 1.00 0.00 H ATOM 1885 N THR B 81 9.119 32.282 30.234 1.00 10.71 N ATOM 1886 CA THR B 81 9.555 33.672 30.221 1.00 7.97 C ATOM 1887 C THR B 81 9.428 34.261 31.616 1.00 10.28 C ATOM 1888 O THR B 81 8.381 34.125 32.264 1.00 11.18 O ATOM 1889 CB THR B 81 8.740 34.500 29.226 1.00 12.09 C ATOM 1890 OG1 THR B 81 8.883 33.937 27.920 1.00 13.56 O ATOM 1891 CG2 THR B 81 9.264 35.927 29.186 1.00 13.51 C ATOM 1892 HG1 THR B 81 8.357 34.470 27.273 1.00 0.00 H ATOM 1893 H THR B 81 8.217 32.043 30.692 1.00 0.00 H ATOM 1894 N LEU B 82 10.508 34.896 32.071 1.00 5.76 N ATOM 1895 CA LEU B 82 10.548 35.646 33.312 1.00 6.53 C ATOM 1896 C LEU B 82 10.452 37.127 32.975 1.00 7.75 C ATOM 1897 O LEU B 82 11.097 37.599 32.033 1.00 8.79 O ATOM 1898 CB LEU B 82 11.835 35.357 34.094 1.00 5.47 C ATOM 1899 CG LEU B 82 11.959 35.944 35.514 1.00 6.89 C ATOM 1900 CD1 LEU B 82 11.070 35.162 36.456 1.00 8.02 C ATOM 1901 CD2 LEU B 82 13.404 35.882 36.012 1.00 7.57 C ATOM 1902 H LEU B 82 11.376 34.851 31.501 1.00 0.00 H ATOM 1903 N TYR B 83 9.640 37.856 33.738 1.00 6.77 N ATOM 1904 CA TYR B 83 9.458 39.282 33.514 1.00 6.17 C ATOM 1905 C TYR B 83 9.953 40.075 34.707 1.00 5.99 C ATOM 1906 O TYR B 83 9.817 39.655 35.857 1.00 7.59 O ATOM 1907 CB TYR B 83 7.989 39.639 33.275 1.00 6.71 C ATOM 1908 CG TYR B 83 7.391 38.961 32.082 1.00 9.73 C ATOM 1909 CD1 TYR B 83 7.641 39.421 30.797 1.00 13.59 C ATOM 1910 CD2 TYR B 83 6.574 37.852 32.245 1.00 14.99 C ATOM 1911 CE1 TYR B 83 7.087 38.787 29.701 1.00 15.87 C ATOM 1912 CE2 TYR B 83 6.016 37.211 31.160 1.00 15.59 C ATOM 1913 CZ TYR B 83 6.270 37.686 29.896 1.00 15.81 C ATOM 1914 OH TYR B 83 5.721 37.035 28.817 1.00 24.15 O ATOM 1915 HH TYR B 83 5.994 37.493 27.983 1.00 0.00 H ATOM 1916 H TYR B 83 9.123 37.395 34.513 1.00 0.00 H ATOM 1917 N LEU B 84 10.496 41.251 34.422 1.00 6.40 N ATOM 1918 CA LEU B 84 10.748 42.243 35.451 1.00 6.25 C ATOM 1919 C LEU B 84 10.035 43.511 35.024 1.00 6.41 C ATOM 1920 O LEU B 84 10.486 44.207 34.104 1.00 6.31 O ATOM 1921 CB LEU B 84 12.235 42.483 35.676 1.00 6.38 C ATOM 1922 CG LEU B 84 12.498 43.365 36.904 1.00 6.66 C ATOM 1923 CD1 LEU B 84 12.101 42.675 38.224 1.00 8.60 C ATOM 1924 CD2 LEU B 84 13.959 43.776 36.940 1.00 6.73 C ATOM 1925 H LEU B 84 10.748 41.468 33.436 1.00 0.00 H ATOM 1926 N GLN B 85 8.941 43.814 35.708 1.00 7.30 N ATOM 1927 CA GLN B 85 8.183 45.034 35.469 1.00 8.26 C ATOM 1928 C GLN B 85 8.757 46.125 36.354 1.00 7.99 C ATOM 1929 O GLN B 85 8.745 46.007 37.582 1.00 10.14 O ATOM 1930 CB GLN B 85 6.701 44.835 35.768 1.00 8.78 C ATOM 1931 CG GLN B 85 5.880 46.107 35.575 1.00 8.48 C ATOM 1932 CD GLN B 85 5.829 46.499 34.122 1.00 9.71 C ATOM 1933 OE1 GLN B 85 5.398 45.712 33.280 1.00 15.32 O ATOM 1934 NE2 GLN B 85 6.308 47.711 33.808 1.00 12.39 N ATOM 1935 HE22 GLN B 85 6.661 48.340 34.557 1.00 0.00 H ATOM 1936 HE21 GLN B 85 6.326 48.022 32.816 1.00 0.00 H ATOM 1937 H GLN B 85 8.612 43.156 36.443 1.00 0.00 H ATOM 1938 N MET B 86 9.266 47.175 35.733 1.00 8.13 N ATOM 1939 CA MET B 86 9.908 48.266 36.451 1.00 9.42 C ATOM 1940 C MET B 86 9.029 49.495 36.303 1.00 13.32 C ATOM 1941 O MET B 86 8.764 49.939 35.183 1.00 15.61 O ATOM 1942 CB MET B 86 11.317 48.515 35.907 1.00 9.75 C ATOM 1943 CG MET B 86 12.163 47.254 35.831 1.00 9.64 C ATOM 1944 SD MET B 86 13.619 47.453 34.750 1.00 19.63 S ATOM 1945 CE MET B 86 14.788 48.126 35.918 1.00 21.49 C ATOM 1946 H MET B 86 9.206 47.223 34.696 1.00 0.00 H ATOM 1947 N ASN B 87 8.541 50.012 37.417 1.00 8.56 N ATOM 1948 CA ASN B 87 7.820 51.276 37.417 1.00 11.47 C ATOM 1949 C ASN B 87 8.588 52.281 38.262 1.00 12.80 C ATOM 1950 O ASN B 87 9.464 51.914 39.045 1.00 13.22 O ATOM 1951 CB ASN B 87 6.387 51.106 37.934 1.00 13.98 C ATOM 1952 CG ASN B 87 5.522 50.306 36.980 1.00 14.14 C ATOM 1953 OD1 ASN B 87 5.366 50.656 35.805 1.00 17.10 O ATOM 1954 ND2 ASN B 87 4.942 49.235 37.486 1.00 13.58 N ATOM 1955 HD22 ASN B 87 5.102 48.978 38.481 1.00 0.00 H ATOM 1956 HD21 ASN B 87 4.325 48.647 36.890 1.00 0.00 H ATOM 1957 H ASN B 87 8.675 49.504 38.314 1.00 0.00 H ATOM 1958 N SER B 88 8.275 53.559 38.060 1.00 13.73 N ATOM 1959 CA SER B 88 8.857 54.640 38.857 1.00 15.28 C ATOM 1960 C SER B 88 10.382 54.544 38.896 1.00 14.46 C ATOM 1961 O SER B 88 11.010 54.573 39.957 1.00 15.92 O ATOM 1962 CB SER B 88 8.256 54.643 40.264 1.00 18.08 C ATOM 1963 OG SER B 88 6.859 54.877 40.193 1.00 24.87 O ATOM 1964 HG SER B 88 6.694 55.754 39.765 1.00 0.00 H ATOM 1965 H SER B 88 7.594 53.797 37.311 1.00 0.00 H ATOM 1966 N LEU B 89 10.978 54.420 37.711 1.00 12.20 N ATOM 1967 CA LEU B 89 12.412 54.204 37.609 1.00 13.40 C ATOM 1968 C LEU B 89 13.177 55.407 38.145 1.00 14.45 C ATOM 1969 O LEU B 89 12.728 56.551 38.034 1.00 18.04 O ATOM 1970 CB LEU B 89 12.795 53.915 36.155 1.00 11.10 C ATOM 1971 CG LEU B 89 12.558 52.451 35.742 1.00 12.56 C ATOM 1972 CD1 LEU B 89 12.503 52.295 34.242 1.00 12.75 C ATOM 1973 CD2 LEU B 89 13.625 51.552 36.319 1.00 13.62 C ATOM 1974 H LEU B 89 10.407 54.479 36.844 1.00 0.00 H ATOM 1975 N LYS B 90 14.309 55.137 38.775 1.00 13.22 N ATOM 1976 CA LYS B 90 15.196 56.139 39.345 1.00 13.60 C ATOM 1977 C LYS B 90 16.565 55.980 38.712 1.00 15.21 C ATOM 1978 O LYS B 90 16.905 54.893 38.242 1.00 12.36 O ATOM 1979 CB LYS B 90 15.334 55.971 40.866 1.00 17.82 C ATOM 1980 CG LYS B 90 14.055 56.130 41.653 1.00 18.78 C ATOM 1981 CD LYS B 90 14.259 55.637 43.082 1.00 21.05 C ATOM 1982 CE LYS B 90 12.979 55.701 43.885 1.00 22.94 C ATOM 1983 NZ LYS B 90 13.230 55.434 45.329 1.00 29.66 N ATOM 1984 HZ1 LYS B 90 13.642 54.485 45.438 1.00 0.00 H ATOM 1985 HZ2 LYS B 90 13.891 56.145 45.702 1.00 0.00 H ATOM 1986 HZ3 LYS B 90 12.332 55.485 45.851 1.00 0.00 H ATOM 1987 H LYS B 90 14.584 54.138 38.869 1.00 0.00 H ATOM 1988 N PRO B 91 17.388 57.031 38.697 1.00 15.68 N ATOM 1989 CA PRO B 91 18.711 56.903 38.071 1.00 12.53 C ATOM 1990 C PRO B 91 19.573 55.806 38.664 1.00 14.53 C ATOM 1991 O PRO B 91 20.346 55.180 37.925 1.00 14.28 O ATOM 1992 CB PRO B 91 19.336 58.285 38.292 1.00 16.22 C ATOM 1993 CG PRO B 91 18.178 59.188 38.403 1.00 14.86 C ATOM 1994 CD PRO B 91 17.103 58.419 39.098 1.00 17.39 C ATOM 1995 N GLU B 92 19.469 55.547 39.969 1.00 15.55 N ATOM 1996 CA GLU B 92 20.297 54.498 40.550 1.00 18.24 C ATOM 1997 C GLU B 92 19.849 53.106 40.135 1.00 15.44 C ATOM 1998 O GLU B 92 20.531 52.131 40.461 1.00 16.76 O ATOM 1999 CB GLU B 92 20.313 54.599 42.078 1.00 18.35 C ATOM 2000 CG GLU B 92 18.948 54.533 42.721 1.00 21.31 C ATOM 2001 CD GLU B 92 18.377 55.909 43.034 1.00 28.43 C ATOM 2002 OE1 GLU B 92 18.664 56.872 42.280 1.00 24.46 O ATOM 2003 OE2 GLU B 92 17.639 56.022 44.040 1.00 30.20 O ATOM 2004 H GLU B 92 18.807 56.086 40.563 1.00 0.00 H ATOM 2005 N ASP B 93 18.725 52.988 39.436 1.00 13.21 N ATOM 2006 CA ASP B 93 18.353 51.715 38.833 1.00 12.87 C ATOM 2007 C ASP B 93 19.144 51.406 37.574 1.00 12.29 C ATOM 2008 O ASP B 93 19.011 50.305 37.043 1.00 11.46 O ATOM 2009 CB ASP B 93 16.865 51.703 38.477 1.00 10.20 C ATOM 2010 CG ASP B 93 15.954 51.756 39.699 1.00 13.32 C ATOM 2011 OD1 ASP B 93 16.227 51.080 40.710 1.00 12.48 O ATOM 2012 OD2 ASP B 93 14.940 52.469 39.633 1.00 13.67 O ATOM 2013 H ASP B 93 18.104 53.814 39.318 1.00 0.00 H ATOM 2014 N THR B 94 19.938 52.351 37.075 1.00 10.84 N ATOM 2015 CA THR B 94 20.740 52.117 35.882 1.00 10.12 C ATOM 2016 C THR B 94 21.684 50.948 36.113 1.00 11.74 C ATOM 2017 O THR B 94 22.280 50.828 37.183 1.00 13.15 O ATOM 2018 CB THR B 94 21.547 53.376 35.552 1.00 12.50 C ATOM 2019 OG1 THR B 94 20.656 54.417 35.160 1.00 14.22 O ATOM 2020 CG2 THR B 94 22.571 53.127 34.439 1.00 7.84 C ATOM 2021 HG1 THR B 94 20.029 54.609 35.901 1.00 0.00 H ATOM 2022 H THR B 94 19.987 53.276 37.547 1.00 0.00 H ATOM 2023 N GLY B 95 21.801 50.081 35.113 1.00 9.72 N ATOM 2024 CA GLY B 95 22.728 48.968 35.194 1.00 9.13 C ATOM 2025 C GLY B 95 22.482 47.972 34.082 1.00 10.74 C ATOM 2026 O GLY B 95 21.544 48.102 33.290 1.00 10.70 O ATOM 2027 H GLY B 95 21.219 50.202 34.259 1.00 0.00 H ATOM 2028 N MET B 96 23.337 46.952 34.051 1.00 12.46 N ATOM 2029 CA MET B 96 23.145 45.824 33.152 1.00 14.05 C ATOM 2030 C MET B 96 22.313 44.783 33.895 1.00 10.47 C ATOM 2031 O MET B 96 22.769 44.209 34.890 1.00 12.48 O ATOM 2032 CB MET B 96 24.486 45.251 32.697 1.00 12.25 C ATOM 2033 CG MET B 96 24.369 44.042 31.775 1.00 14.56 C ATOM 2034 SD MET B 96 23.681 44.419 30.157 1.00 15.76 S ATOM 2035 CE MET B 96 24.954 45.490 29.489 1.00 17.93 C ATOM 2036 H MET B 96 24.162 46.962 34.684 1.00 0.00 H ATOM 2037 N TYR B 97 21.090 44.552 33.433 1.00 7.04 N ATOM 2038 CA TYR B 97 20.187 43.636 34.123 1.00 7.27 C ATOM 2039 C TYR B 97 20.348 42.245 33.539 1.00 8.29 C ATOM 2040 O TYR B 97 20.149 42.038 32.342 1.00 9.83 O ATOM 2041 CB TYR B 97 18.742 44.102 34.014 1.00 8.09 C ATOM 2042 CG TYR B 97 18.420 45.179 35.003 1.00 7.51 C ATOM 2043 CD1 TYR B 97 18.927 46.459 34.833 1.00 9.16 C ATOM 2044 CD2 TYR B 97 17.642 44.921 36.122 1.00 8.68 C ATOM 2045 CE1 TYR B 97 18.639 47.450 35.739 1.00 7.11 C ATOM 2046 CE2 TYR B 97 17.348 45.926 37.041 1.00 10.49 C ATOM 2047 CZ TYR B 97 17.866 47.180 36.844 1.00 11.01 C ATOM 2048 OH TYR B 97 17.590 48.201 37.729 1.00 10.11 O ATOM 2049 HH TYR B 97 18.045 49.028 37.429 1.00 0.00 H ATOM 2050 H TYR B 97 20.771 45.031 32.567 1.00 0.00 H ATOM 2051 N ARG B 98 20.731 41.299 34.384 1.00 6.20 N ATOM 2052 CA ARG B 98 21.027 39.953 33.942 1.00 7.71 C ATOM 2053 C ARG B 98 20.124 39.012 34.692 1.00 6.93 C ATOM 2054 O ARG B 98 19.897 39.167 35.891 1.00 10.16 O ATOM 2055 CB ARG B 98 22.484 39.563 34.190 1.00 8.60 C ATOM 2056 CG ARG B 98 23.475 40.485 33.536 1.00 10.63 C ATOM 2057 CD ARG B 98 24.901 40.041 33.805 1.00 12.68 C ATOM 2058 NE ARG B 98 25.248 38.820 33.098 1.00 12.37 N ATOM 2059 CZ ARG B 98 26.453 38.265 33.173 1.00 15.58 C ATOM 2060 NH1 ARG B 98 27.371 38.832 33.946 1.00 16.77 N ATOM 2061 NH2 ARG B 98 26.739 37.166 32.499 1.00 15.59 N ATOM 2062 HE ARG B 98 24.524 38.362 32.509 1.00 0.00 H ATOM 2063 HH12 ARG B 98 28.320 38.413 34.019 1.00 0.00 H ATOM 2064 HH11 ARG B 98 27.141 39.695 34.479 1.00 0.00 H ATOM 2065 HH22 ARG B 98 27.687 36.745 32.569 1.00 0.00 H ATOM 2066 HH21 ARG B 98 26.016 36.722 31.898 1.00 0.00 H ATOM 2067 H ARG B 98 20.822 41.530 35.394 1.00 0.00 H ATOM 2068 N CYS B 99 19.620 38.036 33.984 1.00 6.74 N ATOM 2069 CA CYS B 99 18.828 37.019 34.629 1.00 6.39 C ATOM 2070 C CYS B 99 19.718 35.820 34.919 1.00 5.63 C ATOM 2071 O CYS B 99 20.670 35.536 34.185 1.00 7.52 O ATOM 2072 CB CYS B 99 17.653 36.684 33.722 1.00 9.71 C ATOM 2073 SG CYS B 99 16.612 35.316 34.157 1.00 12.36 S ATOM 2074 H CYS B 99 19.790 37.993 32.959 1.00 0.00 H ATOM 2075 N ALA B 100 19.421 35.145 36.028 1.00 4.95 N ATOM 2076 CA ALA B 100 20.211 33.999 36.454 1.00 7.84 C ATOM 2077 C ALA B 100 19.266 32.938 36.990 1.00 7.70 C ATOM 2078 O ALA B 100 18.157 33.232 37.439 1.00 6.60 O ATOM 2079 CB ALA B 100 21.269 34.378 37.515 1.00 6.53 C ATOM 2080 H ALA B 100 18.607 35.443 36.602 1.00 0.00 H ATOM 2081 N SER B 101 19.716 31.688 36.946 1.00 8.37 N ATOM 2082 CA SER B 101 18.899 30.613 37.478 1.00 7.66 C ATOM 2083 C SER B 101 19.798 29.573 38.123 1.00 8.03 C ATOM 2084 O SER B 101 20.985 29.452 37.802 1.00 10.02 O ATOM 2085 CB SER B 101 18.020 29.967 36.399 1.00 8.06 C ATOM 2086 OG SER B 101 18.828 29.322 35.431 1.00 10.00 O ATOM 2087 HG SER B 101 18.249 28.910 34.741 1.00 0.00 H ATOM 2088 H SER B 101 20.648 31.482 36.533 1.00 0.00 H ATOM 2089 N THR B 102 19.205 28.825 39.044 1.00 6.68 N ATOM 2090 CA THR B 102 19.931 27.752 39.710 1.00 10.73 C ATOM 2091 C THR B 102 18.930 26.813 40.355 1.00 9.01 C ATOM 2092 O THR B 102 17.845 27.227 40.776 1.00 7.79 O ATOM 2093 CB THR B 102 20.920 28.277 40.758 1.00 12.37 C ATOM 2094 OG1 THR B 102 21.605 27.161 41.342 1.00 19.30 O ATOM 2095 CG2 THR B 102 20.217 29.081 41.860 1.00 10.80 C ATOM 2096 HG1 THR B 102 22.093 26.668 40.635 1.00 0.00 H ATOM 2097 H THR B 102 18.212 29.006 39.293 1.00 0.00 H ATOM 2098 N ARG B 103 19.331 25.539 40.444 1.00 10.09 N ATOM 2099 CA ARG B 103 18.509 24.547 41.121 1.00 13.05 C ATOM 2100 C ARG B 103 18.465 24.766 42.624 1.00 11.38 C ATOM 2101 O ARG B 103 17.470 24.414 43.260 1.00 14.54 O ATOM 2102 CB ARG B 103 19.028 23.138 40.814 1.00 17.18 C ATOM 2103 CG ARG B 103 18.516 22.551 39.510 1.00 20.13 C ATOM 2104 CD ARG B 103 18.843 21.050 39.390 1.00 27.66 C ATOM 2105 NE ARG B 103 18.583 20.306 40.624 1.00 29.52 N ATOM 2106 CZ ARG B 103 17.443 19.675 40.908 1.00 29.49 C ATOM 2107 NH1 ARG B 103 16.432 19.677 40.043 1.00 28.80 N ATOM 2108 NH2 ARG B 103 17.313 19.031 42.061 1.00 31.53 N ATOM 2109 HE ARG B 103 19.344 20.267 41.332 1.00 0.00 H ATOM 2110 HH12 ARG B 103 15.548 19.181 40.276 1.00 0.00 H ATOM 2111 HH11 ARG B 103 16.526 20.174 39.134 1.00 0.00 H ATOM 2112 HH22 ARG B 103 16.425 18.538 42.284 1.00 0.00 H ATOM 2113 HH21 ARG B 103 18.099 19.019 42.741 1.00 0.00 H ATOM 2114 H ARG B 103 20.240 25.255 40.025 1.00 0.00 H ATOM 2115 N PHE B 104 19.521 25.327 43.214 1.00 8.82 N ATOM 2116 CA PHE B 104 19.557 25.492 44.659 1.00 14.30 C ATOM 2117 C PHE B 104 20.385 26.710 45.017 1.00 15.29 C ATOM 2118 O PHE B 104 21.388 27.010 44.361 1.00 13.29 O ATOM 2119 CB PHE B 104 20.120 24.241 45.366 1.00 14.76 C ATOM 2120 CG PHE B 104 21.547 23.907 45.002 1.00 17.62 C ATOM 2121 CD1 PHE B 104 22.611 24.440 45.710 1.00 18.61 C ATOM 2122 CD2 PHE B 104 21.823 23.043 43.956 1.00 16.73 C ATOM 2123 CE1 PHE B 104 23.938 24.119 45.369 1.00 18.06 C ATOM 2124 CE2 PHE B 104 23.135 22.722 43.617 1.00 18.95 C ATOM 2125 CZ PHE B 104 24.189 23.263 44.329 1.00 17.84 C ATOM 2126 H PHE B 104 20.324 25.649 42.637 1.00 0.00 H ATOM 2127 N ALA B 105 19.966 27.395 46.075 1.00 11.73 N ATOM 2128 CA ALA B 105 20.738 28.505 46.605 1.00 13.29 C ATOM 2129 C ALA B 105 20.325 28.707 48.051 1.00 11.82 C ATOM 2130 O ALA B 105 19.198 28.388 48.435 1.00 16.55 O ATOM 2131 CB ALA B 105 20.531 29.789 45.794 1.00 15.40 C ATOM 2132 H ALA B 105 19.070 27.132 46.532 1.00 0.00 H ATOM 2133 N GLY B 106 21.252 29.213 48.849 1.00 14.85 N ATOM 2134 CA GLY B 106 20.910 29.566 50.208 1.00 17.61 C ATOM 2135 C GLY B 106 20.258 30.930 50.252 1.00 15.57 C ATOM 2136 O GLY B 106 19.136 31.091 50.743 1.00 20.98 O ATOM 2137 H GLY B 106 22.221 29.356 48.500 1.00 0.00 H ATOM 2138 N ARG B 107 20.960 31.929 49.738 1.00 13.75 N ATOM 2139 CA ARG B 107 20.466 33.296 49.688 1.00 12.24 C ATOM 2140 C ARG B 107 20.145 33.618 48.240 1.00 11.33 C ATOM 2141 O ARG B 107 21.014 33.503 47.371 1.00 12.09 O ATOM 2142 CB ARG B 107 21.502 34.277 50.237 1.00 14.93 C ATOM 2143 CG ARG B 107 21.819 34.084 51.717 1.00 19.95 C ATOM 2144 CD ARG B 107 22.922 35.038 52.133 1.00 24.21 C ATOM 2145 NE ARG B 107 23.257 34.980 53.554 1.00 32.40 N ATOM 2146 CZ ARG B 107 23.993 35.902 54.174 1.00 33.19 C ATOM 2147 NH1 ARG B 107 24.453 36.948 53.497 1.00 35.82 N ATOM 2148 NH2 ARG B 107 24.264 35.789 55.467 1.00 36.83 N ATOM 2149 HE ARG B 107 22.902 34.177 54.111 1.00 0.00 H ATOM 2150 HH12 ARG B 107 25.027 37.668 53.980 1.00 0.00 H ATOM 2151 HH11 ARG B 107 24.239 37.047 52.484 1.00 0.00 H ATOM 2152 HH22 ARG B 107 24.839 36.513 55.943 1.00 0.00 H ATOM 2153 HH21 ARG B 107 23.901 34.976 56.005 1.00 0.00 H ATOM 2154 H ARG B 107 21.905 31.727 49.354 1.00 0.00 H ATOM 2155 N TRP B 108 18.900 34.024 47.992 1.00 11.14 N ATOM 2156 CA TRP B 108 18.472 34.287 46.623 1.00 10.37 C ATOM 2157 C TRP B 108 19.263 35.419 45.999 1.00 9.51 C ATOM 2158 O TRP B 108 19.393 35.479 44.776 1.00 10.16 O ATOM 2159 CB TRP B 108 16.986 34.622 46.587 1.00 9.70 C ATOM 2160 CG TRP B 108 16.673 35.952 47.213 1.00 12.58 C ATOM 2161 CD1 TRP B 108 16.291 36.173 48.498 1.00 11.19 C ATOM 2162 CD2 TRP B 108 16.709 37.241 46.580 1.00 11.59 C ATOM 2163 NE1 TRP B 108 16.087 37.509 48.711 1.00 11.52 N ATOM 2164 CE2 TRP B 108 16.342 38.189 47.551 1.00 12.44 C ATOM 2165 CE3 TRP B 108 17.025 37.683 45.290 1.00 10.45 C ATOM 2166 CZ2 TRP B 108 16.272 39.555 47.275 1.00 9.10 C ATOM 2167 CZ3 TRP B 108 16.948 39.039 45.019 1.00 10.22 C ATOM 2168 CH2 TRP B 108 16.578 39.956 46.008 1.00 11.06 C ATOM 2169 HE1 TRP B 108 15.787 37.938 49.609 1.00 0.00 H ATOM 2170 H TRP B 108 18.231 34.154 48.778 1.00 0.00 H ATOM 2171 N TYR B 109 19.783 36.331 46.812 1.00 10.31 N ATOM 2172 CA TYR B 109 20.430 37.528 46.304 1.00 9.90 C ATOM 2173 C TYR B 109 21.933 37.375 46.118 1.00 10.62 C ATOM 2174 O TYR B 109 22.592 38.341 45.728 1.00 13.93 O ATOM 2175 CB TYR B 109 20.148 38.706 47.245 1.00 10.83 C ATOM 2176 CG TYR B 109 20.468 38.427 48.700 1.00 16.03 C ATOM 2177 CD1 TYR B 109 21.764 38.577 49.199 1.00 13.49 C ATOM 2178 CD2 TYR B 109 19.474 37.999 49.570 1.00 14.20 C ATOM 2179 CE1 TYR B 109 22.044 38.303 50.545 1.00 15.24 C ATOM 2180 CE2 TYR B 109 19.738 37.738 50.898 1.00 18.77 C ATOM 2181 CZ TYR B 109 21.016 37.885 51.379 1.00 18.04 C ATOM 2182 OH TYR B 109 21.236 37.610 52.713 1.00 22.27 O ATOM 2183 HH TYR B 109 20.678 38.210 53.269 1.00 0.00 H ATOM 2184 H TYR B 109 19.725 36.184 47.840 1.00 0.00 H ATOM 2185 N ARG B 110 22.498 36.207 46.394 1.00 10.32 N ATOM 2186 CA ARG B 110 23.940 36.028 46.280 1.00 13.12 C ATOM 2187 C ARG B 110 24.252 35.519 44.879 1.00 12.85 C ATOM 2188 O ARG B 110 23.944 34.372 44.546 1.00 10.40 O ATOM 2189 CB ARG B 110 24.455 35.067 47.345 1.00 16.29 C ATOM 2190 CG ARG B 110 24.647 35.723 48.701 1.00 23.33 C ATOM 2191 CD ARG B 110 25.342 34.791 49.672 1.00 28.05 C ATOM 2192 NE ARG B 110 26.797 34.867 49.572 1.00 32.30 N ATOM 2193 CZ ARG B 110 27.560 33.898 49.076 1.00 29.17 C ATOM 2194 NH1 ARG B 110 27.002 32.779 48.636 1.00 27.41 N ATOM 2195 NH2 ARG B 110 28.881 34.044 49.025 1.00 33.17 N ATOM 2196 HE ARG B 110 27.265 35.732 49.910 1.00 0.00 H ATOM 2197 HH12 ARG B 110 27.597 32.019 48.247 1.00 0.00 H ATOM 2198 HH11 ARG B 110 25.970 32.661 48.679 1.00 0.00 H ATOM 2199 HH22 ARG B 110 29.474 33.283 48.636 1.00 0.00 H ATOM 2200 HH21 ARG B 110 29.321 34.919 49.374 1.00 0.00 H ATOM 2201 H ARG B 110 21.904 35.408 46.696 1.00 0.00 H ATOM 2202 N ASP B 111 24.885 36.369 44.068 1.00 11.34 N ATOM 2203 CA ASP B 111 25.137 36.009 42.676 1.00 11.29 C ATOM 2204 C ASP B 111 26.029 34.781 42.545 1.00 12.69 C ATOM 2205 O ASP B 111 25.884 34.010 41.590 1.00 11.71 O ATOM 2206 CB ASP B 111 25.740 37.198 41.928 1.00 13.37 C ATOM 2207 CG ASP B 111 27.135 37.592 42.436 1.00 20.00 C ATOM 2208 OD1 ASP B 111 27.528 37.193 43.556 1.00 20.57 O ATOM 2209 OD2 ASP B 111 27.834 38.323 41.706 1.00 22.72 O ATOM 2210 H ASP B 111 25.200 37.292 44.429 1.00 0.00 H ATOM 2211 N SER B 112 26.937 34.563 43.503 1.00 13.02 N ATOM 2212 CA SER B 112 27.859 33.437 43.399 1.00 16.22 C ATOM 2213 C SER B 112 27.168 32.085 43.503 1.00 14.10 C ATOM 2214 O SER B 112 27.796 31.070 43.198 1.00 17.82 O ATOM 2215 CB SER B 112 28.946 33.530 44.477 1.00 14.90 C ATOM 2216 OG SER B 112 28.404 33.360 45.773 1.00 16.58 O ATOM 2217 HG SER B 112 27.731 34.066 45.943 1.00 0.00 H ATOM 2218 H SER B 112 26.986 35.198 44.325 1.00 0.00 H ATOM 2219 N GLU B 113 25.906 32.036 43.920 1.00 14.36 N ATOM 2220 CA GLU B 113 25.203 30.769 44.043 1.00 13.92 C ATOM 2221 C GLU B 113 24.490 30.365 42.766 1.00 14.47 C ATOM 2222 O GLU B 113 23.907 29.279 42.716 1.00 14.07 O ATOM 2223 CB GLU B 113 24.214 30.842 45.204 1.00 18.08 C ATOM 2224 CG GLU B 113 24.931 31.084 46.529 1.00 21.52 C ATOM 2225 CD GLU B 113 24.108 30.665 47.731 1.00 22.83 C ATOM 2226 OE1 GLU B 113 23.653 31.557 48.487 1.00 25.85 O ATOM 2227 OE2 GLU B 113 23.921 29.445 47.930 1.00 23.38 O ATOM 2228 H GLU B 113 25.413 32.919 44.162 1.00 0.00 H ATOM 2229 N TYR B 114 24.533 31.194 41.732 1.00 11.90 N ATOM 2230 CA TYR B 114 23.778 30.924 40.524 1.00 10.33 C ATOM 2231 C TYR B 114 24.645 30.249 39.473 1.00 11.73 C ATOM 2232 O TYR B 114 25.776 30.667 39.220 1.00 16.68 O ATOM 2233 CB TYR B 114 23.180 32.212 39.983 1.00 10.15 C ATOM 2234 CG TYR B 114 21.959 32.599 40.758 1.00 8.42 C ATOM 2235 CD1 TYR B 114 22.061 33.205 42.007 1.00 8.63 C ATOM 2236 CD2 TYR B 114 20.684 32.317 40.275 1.00 8.50 C ATOM 2237 CE1 TYR B 114 20.947 33.533 42.726 1.00 6.98 C ATOM 2238 CE2 TYR B 114 19.579 32.662 40.979 1.00 6.76 C ATOM 2239 CZ TYR B 114 19.703 33.272 42.211 1.00 6.59 C ATOM 2240 OH TYR B 114 18.602 33.620 42.940 1.00 8.18 O ATOM 2241 HH TYR B 114 18.889 34.042 43.788 1.00 0.00 H ATOM 2242 H TYR B 114 25.118 32.052 41.788 1.00 0.00 H ATOM 2243 N ARG B 115 24.085 29.219 38.840 1.00 13.11 N ATOM 2244 CA ARG B 115 24.810 28.379 37.898 1.00 16.39 C ATOM 2245 C ARG B 115 24.638 28.800 36.447 1.00 15.03 C ATOM 2246 O ARG B 115 25.494 28.482 35.618 1.00 20.22 O ATOM 2247 CB ARG B 115 24.360 26.923 38.048 1.00 19.24 C ATOM 2248 CG ARG B 115 24.923 26.219 39.281 1.00 25.96 C ATOM 2249 CD ARG B 115 26.260 25.518 39.023 1.00 24.50 C ATOM 2250 NE ARG B 115 26.541 25.267 37.603 1.00 30.41 N ATOM 2251 CZ ARG B 115 25.955 24.326 36.866 1.00 33.50 C ATOM 2252 NH1 ARG B 115 26.287 24.185 35.590 1.00 29.32 N ATOM 2253 NH2 ARG B 115 25.035 23.527 37.398 1.00 34.82 N ATOM 2254 HE ARG B 115 27.251 25.869 37.139 1.00 0.00 H ATOM 2255 HH12 ARG B 115 25.831 23.451 35.012 1.00 0.00 H ATOM 2256 HH11 ARG B 115 27.004 24.809 35.167 1.00 0.00 H ATOM 2257 HH22 ARG B 115 24.582 22.795 36.815 1.00 0.00 H ATOM 2258 HH21 ARG B 115 24.768 23.634 38.397 1.00 0.00 H ATOM 2259 H ARG B 115 23.085 29.006 39.027 1.00 0.00 H ATOM 2260 N ALA B 116 23.551 29.482 36.111 1.00 12.79 N ATOM 2261 CA ALA B 116 23.285 29.854 34.731 1.00 10.70 C ATOM 2262 C ALA B 116 23.009 31.347 34.658 1.00 7.28 C ATOM 2263 O ALA B 116 22.260 31.876 35.482 1.00 9.11 O ATOM 2264 CB ALA B 116 22.093 29.069 34.169 1.00 11.92 C ATOM 2265 H ALA B 116 22.874 29.757 36.851 1.00 0.00 H ATOM 2266 N TRP B 117 23.618 32.018 33.660 1.00 8.24 N ATOM 2267 CA TRP B 117 23.508 33.464 33.484 1.00 9.83 C ATOM 2268 C TRP B 117 23.195 33.832 32.043 1.00 9.69 C ATOM 2269 O TRP B 117 23.734 33.236 31.106 1.00 12.12 O ATOM 2270 CB TRP B 117 24.814 34.163 33.874 1.00 10.13 C ATOM 2271 CG TRP B 117 25.033 34.136 35.336 1.00 10.39 C ATOM 2272 CD1 TRP B 117 25.586 33.132 36.069 1.00 9.73 C ATOM 2273 CD2 TRP B 117 24.668 35.153 36.258 1.00 6.33 C ATOM 2274 NE1 TRP B 117 25.604 33.472 37.393 1.00 9.52 N ATOM 2275 CE2 TRP B 117 25.033 34.708 37.540 1.00 8.95 C ATOM 2276 CE3 TRP B 117 24.043 36.399 36.125 1.00 9.52 C ATOM 2277 CZ2 TRP B 117 24.800 35.461 38.682 1.00 7.68 C ATOM 2278 CZ3 TRP B 117 23.834 37.147 37.248 1.00 6.89 C ATOM 2279 CH2 TRP B 117 24.204 36.680 38.516 1.00 8.41 C ATOM 2280 HE1 TRP B 117 25.988 32.888 38.163 1.00 0.00 H ATOM 2281 H TRP B 117 24.194 31.480 32.982 1.00 0.00 H ATOM 2282 N GLY B 118 22.350 34.846 31.874 1.00 7.49 N ATOM 2283 CA GLY B 118 22.236 35.506 30.585 1.00 10.28 C ATOM 2284 C GLY B 118 23.291 36.590 30.410 1.00 13.19 C ATOM 2285 O GLY B 118 23.992 36.946 31.351 1.00 14.67 O ATOM 2286 H GLY B 118 21.766 35.169 32.672 1.00 0.00 H ATOM 2287 N GLN B 119 23.380 37.119 29.185 1.00 8.76 N ATOM 2288 CA GLN B 119 24.334 38.187 28.901 1.00 16.10 C ATOM 2289 C GLN B 119 23.847 39.536 29.411 1.00 15.52 C ATOM 2290 O GLN B 119 24.665 40.411 29.718 1.00 16.85 O ATOM 2291 CB GLN B 119 24.613 38.255 27.400 1.00 18.49 C ATOM 2292 CG GLN B 119 25.572 37.165 26.935 1.00 20.62 C ATOM 2293 CD GLN B 119 26.876 37.190 27.713 1.00 27.04 C ATOM 2294 OE1 GLN B 119 27.222 36.235 28.414 1.00 29.76 O ATOM 2295 NE2 GLN B 119 27.606 38.294 27.598 1.00 28.80 N ATOM 2296 HE22 GLN B 119 27.276 39.075 26.996 1.00 0.00 H ATOM 2297 HE21 GLN B 119 28.507 38.377 28.110 1.00 0.00 H ATOM 2298 H GLN B 119 22.763 36.766 28.426 1.00 0.00 H ATOM 2299 N GLY B 120 22.541 39.721 29.495 1.00 10.28 N ATOM 2300 CA GLY B 120 21.957 40.893 30.108 1.00 11.24 C ATOM 2301 C GLY B 120 21.364 41.853 29.090 1.00 7.90 C ATOM 2302 O GLY B 120 21.598 41.765 27.880 1.00 12.41 O ATOM 2303 H GLY B 120 21.908 38.994 29.104 1.00 0.00 H ATOM 2304 N THR B 121 20.557 42.780 29.612 1.00 10.48 N ATOM 2305 CA THR B 121 19.986 43.886 28.852 1.00 12.15 C ATOM 2306 C THR B 121 20.233 45.180 29.630 1.00 8.35 C ATOM 2307 O THR B 121 19.961 45.254 30.833 1.00 10.75 O ATOM 2308 CB THR B 121 18.484 43.633 28.571 1.00 11.47 C ATOM 2309 OG1 THR B 121 17.925 44.659 27.723 1.00 12.17 O ATOM 2310 CG2 THR B 121 17.675 43.518 29.868 1.00 10.86 C ATOM 2311 HG1 THR B 121 18.409 44.671 26.859 1.00 0.00 H ATOM 2312 H THR B 121 20.321 42.709 30.622 1.00 0.00 H ATOM 2313 N GLN B 122 20.785 46.188 28.955 1.00 10.42 N ATOM 2314 CA GLN B 122 21.185 47.416 29.634 1.00 9.75 C ATOM 2315 C GLN B 122 19.982 48.323 29.887 1.00 9.44 C ATOM 2316 O GLN B 122 19.112 48.474 29.032 1.00 9.81 O ATOM 2317 CB GLN B 122 22.236 48.154 28.799 1.00 12.77 C ATOM 2318 CG GLN B 122 22.588 49.554 29.284 1.00 12.46 C ATOM 2319 CD GLN B 122 23.410 49.529 30.550 1.00 13.16 C ATOM 2320 OE1 GLN B 122 24.257 48.651 30.730 1.00 21.09 O ATOM 2321 NE2 GLN B 122 23.172 50.484 31.434 1.00 14.73 N ATOM 2322 HE22 GLN B 122 22.447 51.204 31.239 1.00 0.00 H ATOM 2323 HE21 GLN B 122 23.709 50.515 32.324 1.00 0.00 H ATOM 2324 H GLN B 122 20.933 46.098 27.929 1.00 0.00 H ATOM 2325 N VAL B 123 19.942 48.930 31.069 1.00 9.39 N ATOM 2326 CA VAL B 123 18.903 49.885 31.439 1.00 9.36 C ATOM 2327 C VAL B 123 19.612 51.155 31.875 1.00 10.10 C ATOM 2328 O VAL B 123 20.414 51.128 32.812 1.00 10.14 O ATOM 2329 CB VAL B 123 18.000 49.351 32.560 1.00 9.03 C ATOM 2330 CG1 VAL B 123 17.005 50.433 32.998 1.00 11.26 C ATOM 2331 CG2 VAL B 123 17.306 48.049 32.115 1.00 9.65 C ATOM 2332 H VAL B 123 20.686 48.714 31.763 1.00 0.00 H ATOM 2333 N THR B 124 19.342 52.262 31.186 1.00 9.36 N ATOM 2334 CA THR B 124 19.927 53.544 31.557 1.00 13.15 C ATOM 2335 C THR B 124 18.810 54.528 31.844 1.00 9.29 C ATOM 2336 O THR B 124 18.015 54.840 30.952 1.00 12.80 O ATOM 2337 CB THR B 124 20.829 54.082 30.455 1.00 10.57 C ATOM 2338 OG1 THR B 124 21.785 53.074 30.091 1.00 14.96 O ATOM 2339 CG2 THR B 124 21.562 55.318 30.957 1.00 16.26 C ATOM 2340 HG1 THR B 124 21.307 52.270 29.767 1.00 0.00 H ATOM 2341 H THR B 124 18.702 52.211 30.368 1.00 0.00 H ATOM 2342 N VAL B 125 18.752 55.010 33.080 1.00 11.12 N ATOM 2343 CA VAL B 125 17.693 55.895 33.548 1.00 11.16 C ATOM 2344 C VAL B 125 18.278 57.297 33.674 1.00 16.49 C ATOM 2345 O VAL B 125 19.166 57.536 34.503 1.00 17.66 O ATOM 2346 CB VAL B 125 17.099 55.414 34.879 1.00 10.52 C ATOM 2347 CG1 VAL B 125 15.945 56.301 35.277 1.00 15.77 C ATOM 2348 CG2 VAL B 125 16.649 53.960 34.764 1.00 14.75 C ATOM 2349 H VAL B 125 19.502 54.742 33.749 1.00 0.00 H ATOM 2350 N SER B 126 17.780 58.219 32.853 1.00 16.46 N ATOM 2351 CA SER B 126 18.237 59.609 32.853 1.00 20.95 C ATOM 2352 C SER B 126 17.348 60.497 33.708 1.00 22.80 C ATOM 2353 O SER B 126 16.347 60.044 34.263 1.00 22.60 O ATOM 2354 CB SER B 126 18.287 60.161 31.428 1.00 20.57 C ATOM 2355 OG SER B 126 17.132 59.798 30.687 1.00 25.61 O ATOM 2356 HG SER B 126 17.198 60.171 29.772 1.00 0.00 H ATOM 2357 H SER B 126 17.035 57.940 32.183 1.00 0.00 H TER 2358 SER B 126 ATOM 2359 N GLN C 1 44.589 35.598 16.031 1.00 24.19 N ATOM 2360 CA GLN C 1 43.319 36.118 16.536 1.00 20.11 C ATOM 2361 C GLN C 1 42.261 35.015 16.701 1.00 19.06 C ATOM 2362 O GLN C 1 41.749 34.846 17.799 1.00 22.12 O ATOM 2363 CB GLN C 1 42.791 37.219 15.626 1.00 30.77 C ATOM 2364 CG GLN C 1 41.398 37.765 15.962 1.00 28.47 C ATOM 2365 CD GLN C 1 41.268 38.418 17.328 1.00 31.81 C ATOM 2366 OE1 GLN C 1 40.159 38.695 17.787 1.00 33.75 O ATOM 2367 NE2 GLN C 1 42.396 38.706 17.966 1.00 33.10 N ATOM 2368 HE22 GLN C 1 43.312 38.454 17.542 1.00 0.00 H ATOM 2369 HE21 GLN C 1 42.364 39.183 18.889 1.00 0.00 H ATOM 2370 HN3 GLN C 1 44.436 35.156 15.102 1.00 0.00 H ATOM 2371 HN2 GLN C 1 44.962 34.891 16.696 1.00 0.00 H ATOM 2372 HN1 GLN C 1 45.269 36.379 15.937 1.00 0.00 H ATOM 2373 N VAL C 2 41.948 34.279 15.629 1.00 19.99 N ATOM 2374 CA VAL C 2 41.056 33.131 15.754 1.00 15.84 C ATOM 2375 C VAL C 2 41.741 32.053 16.579 1.00 17.03 C ATOM 2376 O VAL C 2 42.878 31.658 16.294 1.00 18.69 O ATOM 2377 CB VAL C 2 40.658 32.576 14.379 1.00 13.62 C ATOM 2378 CG1 VAL C 2 39.850 31.263 14.552 1.00 13.61 C ATOM 2379 CG2 VAL C 2 39.859 33.590 13.592 1.00 18.18 C ATOM 2380 H VAL C 2 42.343 34.527 14.699 1.00 0.00 H ATOM 2381 N GLN C 3 41.050 31.560 17.602 1.00 14.30 N ATOM 2382 CA GLN C 3 41.573 30.491 18.442 1.00 12.94 C ATOM 2383 C GLN C 3 40.572 29.346 18.480 1.00 11.66 C ATOM 2384 O GLN C 3 39.365 29.574 18.596 1.00 12.78 O ATOM 2385 CB GLN C 3 41.864 30.983 19.869 1.00 13.85 C ATOM 2386 CG GLN C 3 42.824 32.185 19.936 1.00 22.76 C ATOM 2387 CD GLN C 3 44.283 31.796 19.746 1.00 22.93 C ATOM 2388 OE1 GLN C 3 45.170 32.657 19.727 1.00 31.14 O ATOM 2389 NE2 GLN C 3 44.543 30.501 19.619 1.00 20.26 N ATOM 2390 HE22 GLN C 3 43.766 29.810 19.641 1.00 0.00 H ATOM 2391 HE21 GLN C 3 45.524 30.177 19.498 1.00 0.00 H ATOM 2392 H GLN C 3 40.108 31.949 17.809 1.00 0.00 H ATOM 2393 N LEU C 4 41.092 28.125 18.404 1.00 9.89 N ATOM 2394 CA LEU C 4 40.294 26.905 18.380 1.00 10.60 C ATOM 2395 C LEU C 4 40.770 25.948 19.461 1.00 11.72 C ATOM 2396 O LEU C 4 41.973 25.707 19.590 1.00 12.42 O ATOM 2397 CB LEU C 4 40.399 26.213 17.021 1.00 10.17 C ATOM 2398 CG LEU C 4 39.813 26.962 15.828 1.00 12.24 C ATOM 2399 CD1 LEU C 4 40.379 26.408 14.528 1.00 12.41 C ATOM 2400 CD2 LEU C 4 38.308 26.852 15.832 1.00 14.93 C ATOM 2401 H LEU C 4 42.127 28.035 18.359 1.00 0.00 H ATOM 2402 N GLN C 5 39.829 25.358 20.202 1.00 10.05 N ATOM 2403 CA GLN C 5 40.180 24.413 21.261 1.00 10.06 C ATOM 2404 C GLN C 5 39.236 23.224 21.223 1.00 10.57 C ATOM 2405 O GLN C 5 38.032 23.379 21.453 1.00 10.10 O ATOM 2406 CB GLN C 5 40.144 25.068 22.648 1.00 15.27 C ATOM 2407 CG GLN C 5 40.497 24.112 23.808 1.00 14.77 C ATOM 2408 CD GLN C 5 41.861 23.445 23.652 1.00 17.10 C ATOM 2409 OE1 GLN C 5 42.884 24.117 23.523 1.00 19.44 O ATOM 2410 NE2 GLN C 5 41.878 22.118 23.658 1.00 17.45 N ATOM 2411 HE22 GLN C 5 40.991 21.587 23.770 1.00 0.00 H ATOM 2412 HE21 GLN C 5 42.779 21.609 23.551 1.00 0.00 H ATOM 2413 H GLN C 5 38.828 25.575 20.023 1.00 0.00 H ATOM 2414 N GLU C 6 39.794 22.048 20.964 1.00 11.33 N ATOM 2415 CA GLU C 6 39.040 20.810 20.880 1.00 11.60 C ATOM 2416 C GLU C 6 38.952 20.125 22.229 1.00 14.21 C ATOM 2417 O GLU C 6 39.826 20.265 23.087 1.00 17.67 O ATOM 2418 CB GLU C 6 39.685 19.837 19.889 1.00 12.18 C ATOM 2419 CG GLU C 6 39.949 20.427 18.519 1.00 11.54 C ATOM 2420 CD GLU C 6 41.329 21.031 18.409 1.00 14.19 C ATOM 2421 OE1 GLU C 6 41.894 21.437 19.449 1.00 15.17 O ATOM 2422 OE2 GLU C 6 41.852 21.108 17.280 1.00 14.08 O ATOM 2423 H GLU C 6 40.822 22.011 20.814 1.00 0.00 H ATOM 2424 N SER C 7 37.888 19.350 22.395 1.00 10.53 N ATOM 2425 CA SER C 7 37.736 18.518 23.574 1.00 9.66 C ATOM 2426 C SER C 7 36.851 17.338 23.216 1.00 12.35 C ATOM 2427 O SER C 7 36.281 17.267 22.125 1.00 11.03 O ATOM 2428 CB SER C 7 37.132 19.308 24.733 1.00 14.84 C ATOM 2429 OG SER C 7 35.868 19.830 24.355 1.00 18.36 O ATOM 2430 HG SER C 7 35.262 19.084 24.117 1.00 0.00 H ATOM 2431 H SER C 7 37.147 19.339 21.665 1.00 0.00 H ATOM 2432 N GLY C 8 36.735 16.413 24.158 1.00 8.92 N ATOM 2433 CA GLY C 8 35.859 15.277 24.022 1.00 8.88 C ATOM 2434 C GLY C 8 36.540 14.018 23.556 1.00 14.15 C ATOM 2435 O GLY C 8 35.892 12.969 23.505 1.00 12.77 O ATOM 2436 H GLY C 8 37.297 16.511 25.028 1.00 0.00 H ATOM 2437 N GLY C 9 37.827 14.081 23.233 1.00 9.51 N ATOM 2438 CA GLY C 9 38.517 12.879 22.812 1.00 8.50 C ATOM 2439 C GLY C 9 38.574 11.847 23.919 1.00 13.31 C ATOM 2440 O GLY C 9 38.370 12.141 25.092 1.00 11.60 O ATOM 2441 H GLY C 9 38.336 14.987 23.282 1.00 0.00 H ATOM 2442 N GLY C 10 38.877 10.615 23.536 1.00 11.78 N ATOM 2443 CA GLY C 10 39.037 9.578 24.532 1.00 13.00 C ATOM 2444 C GLY C 10 39.287 8.240 23.878 1.00 14.36 C ATOM 2445 O GLY C 10 39.526 8.149 22.670 1.00 14.51 O ATOM 2446 H GLY C 10 38.999 10.395 22.527 1.00 0.00 H ATOM 2447 N SER C 11 39.235 7.199 24.705 1.00 15.53 N ATOM 2448 CA SER C 11 39.374 5.818 24.264 1.00 18.47 C ATOM 2449 C SER C 11 38.002 5.159 24.188 1.00 14.67 C ATOM 2450 O SER C 11 37.140 5.394 25.040 1.00 20.48 O ATOM 2451 CB SER C 11 40.275 5.035 25.220 1.00 19.28 C ATOM 2452 OG SER C 11 41.509 5.712 25.420 1.00 26.29 O ATOM 2453 HG SER C 11 41.334 6.607 25.806 1.00 0.00 H ATOM 2454 H SER C 11 39.088 7.381 25.718 1.00 0.00 H ATOM 2455 N VAL C 12 37.799 4.328 23.167 1.00 14.88 N ATOM 2456 CA VAL C 12 36.499 3.712 22.946 1.00 17.71 C ATOM 2457 C VAL C 12 36.705 2.337 22.330 1.00 18.09 C ATOM 2458 O VAL C 12 37.690 2.093 21.627 1.00 18.81 O ATOM 2459 CB VAL C 12 35.607 4.612 22.053 1.00 21.83 C ATOM 2460 CG1 VAL C 12 36.199 4.730 20.664 1.00 19.05 C ATOM 2461 CG2 VAL C 12 34.179 4.083 21.995 1.00 21.65 C ATOM 2462 H VAL C 12 38.583 4.116 22.517 1.00 0.00 H ATOM 2463 N GLN C 13 35.779 1.427 22.626 1.00 18.05 N ATOM 2464 CA GLN C 13 35.760 0.121 21.985 1.00 19.35 C ATOM 2465 C GLN C 13 35.197 0.240 20.577 1.00 22.09 C ATOM 2466 O GLN C 13 34.290 1.038 20.318 1.00 19.51 O ATOM 2467 CB GLN C 13 34.909 -0.867 22.784 1.00 24.16 C ATOM 2468 CG GLN C 13 35.103 -0.834 24.288 1.00 32.39 C ATOM 2469 CD GLN C 13 36.257 -1.700 24.744 1.00 37.04 C ATOM 2470 OE1 GLN C 13 37.308 -1.742 24.103 1.00 36.66 O ATOM 2471 NE2 GLN C 13 36.065 -2.406 25.854 1.00 36.23 N ATOM 2472 HE22 GLN C 13 35.160 -2.339 26.363 1.00 0.00 H ATOM 2473 HE21 GLN C 13 36.819 -3.025 26.213 1.00 0.00 H ATOM 2474 H GLN C 13 35.051 1.655 23.333 1.00 0.00 H ATOM 2475 N ALA C 14 35.740 -0.557 19.664 1.00 17.13 N ATOM 2476 CA ALA C 14 35.175 -0.645 18.327 1.00 15.62 C ATOM 2477 C ALA C 14 33.663 -0.836 18.388 1.00 17.72 C ATOM 2478 O ALA C 14 33.143 -1.608 19.199 1.00 19.86 O ATOM 2479 CB ALA C 14 35.825 -1.798 17.557 1.00 20.37 C ATOM 2480 H ALA C 14 36.577 -1.124 19.908 1.00 0.00 H ATOM 2481 N GLY C 15 32.959 -0.111 17.522 1.00 16.00 N ATOM 2482 CA GLY C 15 31.515 -0.093 17.514 1.00 17.10 C ATOM 2483 C GLY C 15 30.902 0.993 18.365 1.00 16.59 C ATOM 2484 O GLY C 15 29.686 1.194 18.305 1.00 16.83 O ATOM 2485 H GLY C 15 33.469 0.466 16.823 1.00 0.00 H ATOM 2486 N GLY C 16 31.707 1.696 19.155 1.00 13.94 N ATOM 2487 CA GLY C 16 31.202 2.672 20.088 1.00 15.15 C ATOM 2488 C GLY C 16 30.987 4.038 19.473 1.00 14.81 C ATOM 2489 O GLY C 16 31.186 4.270 18.277 1.00 12.52 O ATOM 2490 H GLY C 16 32.733 1.537 19.098 1.00 0.00 H ATOM 2491 N SER C 17 30.601 4.965 20.349 1.00 13.46 N ATOM 2492 CA SER C 17 30.210 6.316 19.987 1.00 12.41 C ATOM 2493 C SER C 17 31.044 7.317 20.776 1.00 12.09 C ATOM 2494 O SER C 17 31.505 7.034 21.884 1.00 14.50 O ATOM 2495 CB SER C 17 28.715 6.552 20.271 1.00 11.95 C ATOM 2496 OG SER C 17 27.903 5.689 19.492 1.00 12.15 O ATOM 2497 HG SER C 17 28.073 5.856 18.531 1.00 0.00 H ATOM 2498 H SER C 17 30.578 4.705 21.356 1.00 0.00 H ATOM 2499 N LEU C 18 31.192 8.517 20.212 1.00 11.58 N ATOM 2500 CA LEU C 18 31.955 9.583 20.847 1.00 10.08 C ATOM 2501 C LEU C 18 31.600 10.894 20.161 1.00 7.87 C ATOM 2502 O LEU C 18 31.394 10.913 18.953 1.00 10.26 O ATOM 2503 CB LEU C 18 33.461 9.305 20.732 1.00 12.48 C ATOM 2504 CG LEU C 18 34.366 10.061 21.694 1.00 14.87 C ATOM 2505 CD1 LEU C 18 34.086 9.638 23.128 1.00 18.60 C ATOM 2506 CD2 LEU C 18 35.828 9.795 21.323 1.00 15.60 C ATOM 2507 H LEU C 18 30.748 8.697 19.289 1.00 0.00 H ATOM 2508 N ARG C 19 31.521 11.978 20.929 1.00 9.21 N ATOM 2509 CA ARG C 19 31.244 13.304 20.384 1.00 9.29 C ATOM 2510 C ARG C 19 32.387 14.250 20.723 1.00 7.83 C ATOM 2511 O ARG C 19 32.671 14.489 21.905 1.00 11.18 O ATOM 2512 CB ARG C 19 29.925 13.872 20.918 1.00 9.65 C ATOM 2513 CG ARG C 19 29.553 15.208 20.272 1.00 11.61 C ATOM 2514 CD ARG C 19 28.291 15.795 20.875 1.00 16.74 C ATOM 2515 NE ARG C 19 28.630 16.725 21.945 1.00 22.11 N ATOM 2516 CZ ARG C 19 27.818 17.055 22.942 1.00 30.14 C ATOM 2517 NH1 ARG C 19 28.231 17.917 23.866 1.00 32.68 N ATOM 2518 NH2 ARG C 19 26.602 16.516 23.027 1.00 25.65 N ATOM 2519 HE ARG C 19 29.574 17.161 21.926 1.00 0.00 H ATOM 2520 HH12 ARG C 19 27.601 18.180 24.650 1.00 0.00 H ATOM 2521 HH11 ARG C 19 29.184 18.328 23.805 1.00 0.00 H ATOM 2522 HH22 ARG C 19 25.970 16.779 23.810 1.00 0.00 H ATOM 2523 HH21 ARG C 19 26.285 15.833 22.310 1.00 0.00 H ATOM 2524 H ARG C 19 31.662 11.877 21.954 1.00 0.00 H ATOM 2525 N LEU C 20 33.025 14.794 19.693 1.00 6.99 N ATOM 2526 CA LEU C 20 34.060 15.805 19.848 1.00 7.29 C ATOM 2527 C LEU C 20 33.455 17.193 19.749 1.00 9.70 C ATOM 2528 O LEU C 20 32.405 17.389 19.132 1.00 10.11 O ATOM 2529 CB LEU C 20 35.144 15.662 18.789 1.00 8.41 C ATOM 2530 CG LEU C 20 35.713 14.266 18.631 1.00 8.77 C ATOM 2531 CD1 LEU C 20 36.839 14.315 17.631 1.00 13.65 C ATOM 2532 CD2 LEU C 20 36.189 13.760 19.987 1.00 9.52 C ATOM 2533 H LEU C 20 32.774 14.484 18.733 1.00 0.00 H ATOM 2534 N SER C 21 34.101 18.155 20.400 1.00 7.94 N ATOM 2535 CA SER C 21 33.666 19.539 20.366 1.00 9.68 C ATOM 2536 C SER C 21 34.862 20.423 20.071 1.00 8.90 C ATOM 2537 O SER C 21 36.001 20.087 20.401 1.00 11.66 O ATOM 2538 CB SER C 21 33.035 19.978 21.697 1.00 12.93 C ATOM 2539 OG SER C 21 31.883 19.219 22.020 1.00 21.39 O ATOM 2540 HG SER C 21 32.130 18.263 22.097 1.00 0.00 H ATOM 2541 H SER C 21 34.947 17.908 20.952 1.00 0.00 H ATOM 2542 N CYS C 22 34.607 21.548 19.425 1.00 7.68 N ATOM 2543 CA CYS C 22 35.639 22.563 19.308 1.00 11.78 C ATOM 2544 C CYS C 22 35.005 23.929 19.474 1.00 10.56 C ATOM 2545 O CYS C 22 34.067 24.261 18.752 1.00 10.95 O ATOM 2546 CB CYS C 22 36.352 22.494 17.961 1.00 9.21 C ATOM 2547 SG CYS C 22 37.621 23.770 17.868 1.00 17.69 S ATOM 2548 H CYS C 22 33.670 21.706 19.002 1.00 0.00 H ATOM 2549 N VAL C 23 35.518 24.719 20.412 1.00 8.30 N ATOM 2550 CA VAL C 23 35.073 26.092 20.621 1.00 11.72 C ATOM 2551 C VAL C 23 36.009 27.058 19.901 1.00 10.89 C ATOM 2552 O VAL C 23 37.236 26.893 19.921 1.00 12.75 O ATOM 2553 CB VAL C 23 34.992 26.419 22.124 1.00 10.89 C ATOM 2554 CG1 VAL C 23 34.439 27.817 22.331 1.00 14.26 C ATOM 2555 CG2 VAL C 23 34.130 25.392 22.830 1.00 16.18 C ATOM 2556 H VAL C 23 36.270 24.341 21.024 1.00 0.00 H ATOM 2557 N VAL C 24 35.428 28.070 19.260 1.00 9.16 N ATOM 2558 CA VAL C 24 36.179 29.122 18.581 1.00 11.00 C ATOM 2559 C VAL C 24 35.988 30.437 19.326 1.00 12.13 C ATOM 2560 O VAL C 24 34.941 30.697 19.927 1.00 13.17 O ATOM 2561 CB VAL C 24 35.755 29.279 17.100 1.00 9.84 C ATOM 2562 CG1 VAL C 24 34.318 29.786 16.993 1.00 11.01 C ATOM 2563 CG2 VAL C 24 36.686 30.247 16.351 1.00 10.95 C ATOM 2564 H VAL C 24 34.389 28.113 19.242 1.00 0.00 H ATOM 2565 N SER C 25 37.022 31.272 19.278 1.00 10.45 N ATOM 2566 CA SER C 25 36.928 32.664 19.674 1.00 17.53 C ATOM 2567 C SER C 25 37.811 33.471 18.734 1.00 15.55 C ATOM 2568 O SER C 25 38.613 32.919 17.977 1.00 13.76 O ATOM 2569 CB SER C 25 37.345 32.871 21.134 1.00 18.60 C ATOM 2570 OG SER C 25 38.645 32.351 21.354 1.00 20.45 O ATOM 2571 HG SER C 25 39.290 32.817 20.764 1.00 0.00 H ATOM 2572 H SER C 25 37.938 30.911 18.942 1.00 0.00 H ATOM 2573 N GLY C 26 37.627 34.779 18.759 1.00 19.37 N ATOM 2574 CA GLY C 26 38.424 35.681 17.951 1.00 17.92 C ATOM 2575 C GLY C 26 37.646 36.207 16.758 1.00 21.10 C ATOM 2576 O GLY C 26 36.466 35.913 16.560 1.00 19.31 O ATOM 2577 H GLY C 26 36.889 35.173 19.376 1.00 0.00 H ATOM 2578 N ASN C 27 38.346 36.997 15.944 1.00 18.54 N ATOM 2579 CA ASN C 27 37.725 37.662 14.798 1.00 24.58 C ATOM 2580 C ASN C 27 37.686 36.684 13.633 1.00 20.37 C ATOM 2581 O ASN C 27 38.590 36.630 12.797 1.00 21.94 O ATOM 2582 CB ASN C 27 38.476 38.937 14.436 1.00 24.47 C ATOM 2583 CG ASN C 27 38.025 40.127 15.259 1.00 33.30 C ATOM 2584 OD1 ASN C 27 37.501 39.972 16.365 1.00 34.82 O ATOM 2585 ND2 ASN C 27 38.223 41.329 14.720 1.00 36.17 N ATOM 2586 HD22 ASN C 27 38.669 41.412 13.784 1.00 0.00 H ATOM 2587 HD21 ASN C 27 37.932 42.184 15.235 1.00 0.00 H ATOM 2588 H ASN C 27 39.359 37.144 16.128 1.00 0.00 H ATOM 2589 N THR C 28 36.612 35.895 13.589 1.00 16.88 N ATOM 2590 CA THR C 28 36.431 34.896 12.542 1.00 18.06 C ATOM 2591 C THR C 28 35.881 35.483 11.254 1.00 13.13 C ATOM 2592 O THR C 28 36.137 34.940 10.175 1.00 18.39 O ATOM 2593 CB THR C 28 35.474 33.802 13.020 1.00 13.97 C ATOM 2594 OG1 THR C 28 34.210 34.387 13.344 1.00 14.83 O ATOM 2595 CG2 THR C 28 36.019 33.115 14.253 1.00 15.51 C ATOM 2596 HG1 THR C 28 33.836 34.827 12.540 1.00 0.00 H ATOM 2597 H THR C 28 35.882 35.995 14.323 1.00 0.00 H ATOM 2598 N GLY C 29 35.109 36.559 11.340 1.00 18.29 N ATOM 2599 CA GLY C 29 34.269 36.947 10.229 1.00 17.49 C ATOM 2600 C GLY C 29 33.061 36.033 10.177 1.00 17.90 C ATOM 2601 O GLY C 29 32.894 35.127 10.993 1.00 17.93 O ATOM 2602 H GLY C 29 35.108 37.126 12.212 1.00 0.00 H ATOM 2603 N SER C 30 32.193 36.276 9.195 1.00 19.53 N ATOM 2604 CA SER C 30 30.887 35.628 9.178 1.00 14.06 C ATOM 2605 C SER C 30 30.810 34.394 8.285 1.00 16.41 C ATOM 2606 O SER C 30 29.834 33.648 8.388 1.00 15.46 O ATOM 2607 CB SER C 30 29.807 36.625 8.735 1.00 19.25 C ATOM 2608 OG SER C 30 30.019 37.056 7.399 1.00 20.99 O ATOM 2609 HG SER C 30 30.902 37.498 7.332 1.00 0.00 H ATOM 2610 H SER C 30 32.450 36.935 8.433 1.00 0.00 H ATOM 2611 N THR C 31 31.801 34.150 7.431 1.00 14.20 N ATOM 2612 CA THR C 31 31.670 33.159 6.372 1.00 12.70 C ATOM 2613 C THR C 31 32.950 32.339 6.236 1.00 14.08 C ATOM 2614 O THR C 31 34.052 32.866 6.393 1.00 14.56 O ATOM 2615 CB THR C 31 31.321 33.868 5.045 1.00 20.59 C ATOM 2616 OG1 THR C 31 31.271 32.927 3.969 1.00 27.36 O ATOM 2617 CG2 THR C 31 32.344 34.941 4.728 1.00 20.27 C ATOM 2618 HG1 THR C 31 30.579 32.245 4.160 1.00 0.00 H ATOM 2619 H THR C 31 32.691 34.680 7.522 1.00 0.00 H ATOM 2620 N GLY C 32 32.813 31.045 5.962 1.00 11.78 N ATOM 2621 CA GLY C 32 33.971 30.224 5.678 1.00 11.51 C ATOM 2622 C GLY C 32 33.778 28.786 6.120 1.00 8.00 C ATOM 2623 O GLY C 32 32.667 28.337 6.409 1.00 8.37 O ATOM 2624 H GLY C 32 31.865 30.619 5.952 1.00 0.00 H ATOM 2625 N TYR C 33 34.906 28.077 6.152 1.00 6.72 N ATOM 2626 CA TYR C 33 34.973 26.644 6.407 1.00 8.00 C ATOM 2627 C TYR C 33 35.403 26.366 7.838 1.00 7.13 C ATOM 2628 O TYR C 33 36.288 27.034 8.383 1.00 8.86 O ATOM 2629 CB TYR C 33 35.950 25.955 5.445 1.00 10.76 C ATOM 2630 CG TYR C 33 35.521 25.952 3.991 1.00 9.16 C ATOM 2631 CD1 TYR C 33 34.768 24.906 3.474 1.00 13.14 C ATOM 2632 CD2 TYR C 33 35.876 26.990 3.137 1.00 11.20 C ATOM 2633 CE1 TYR C 33 34.376 24.896 2.150 1.00 15.86 C ATOM 2634 CE2 TYR C 33 35.490 26.982 1.810 1.00 15.58 C ATOM 2635 CZ TYR C 33 34.741 25.936 1.330 1.00 16.59 C ATOM 2636 OH TYR C 33 34.353 25.929 0.013 1.00 21.99 O ATOM 2637 HH TYR C 33 35.156 25.940 -0.566 1.00 0.00 H ATOM 2638 H TYR C 33 35.800 28.581 5.983 1.00 0.00 H ATOM 2639 N TRP C 34 34.782 25.354 8.426 1.00 7.52 N ATOM 2640 CA TRP C 34 35.070 24.890 9.778 1.00 7.44 C ATOM 2641 C TRP C 34 35.122 23.376 9.681 1.00 7.96 C ATOM 2642 O TRP C 34 34.110 22.750 9.345 1.00 6.38 O ATOM 2643 CB TRP C 34 33.965 25.356 10.725 1.00 7.42 C ATOM 2644 CG TRP C 34 34.304 25.564 12.161 1.00 7.07 C ATOM 2645 CD1 TRP C 34 35.514 25.362 12.767 1.00 7.47 C ATOM 2646 CD2 TRP C 34 33.399 26.003 13.187 1.00 7.22 C ATOM 2647 NE1 TRP C 34 35.405 25.675 14.117 1.00 7.74 N ATOM 2648 CE2 TRP C 34 34.120 26.053 14.391 1.00 10.14 C ATOM 2649 CE3 TRP C 34 32.039 26.353 13.199 1.00 8.16 C ATOM 2650 CZ2 TRP C 34 33.532 26.440 15.606 1.00 11.34 C ATOM 2651 CZ3 TRP C 34 31.458 26.754 14.408 1.00 9.68 C ATOM 2652 CH2 TRP C 34 32.206 26.782 15.592 1.00 9.39 C ATOM 2653 HE1 TRP C 34 36.179 25.629 14.810 1.00 0.00 H ATOM 2654 H TRP C 34 34.042 24.859 7.889 1.00 0.00 H ATOM 2655 N ALA C 35 36.284 22.776 9.936 1.00 7.00 N ATOM 2656 CA ALA C 35 36.522 21.398 9.545 1.00 6.96 C ATOM 2657 C ALA C 35 37.160 20.589 10.667 1.00 7.56 C ATOM 2658 O ALA C 35 37.770 21.123 11.593 1.00 8.74 O ATOM 2659 CB ALA C 35 37.417 21.320 8.295 1.00 7.44 C ATOM 2660 H ALA C 35 37.035 23.305 10.424 1.00 0.00 H ATOM 2661 N TRP C 36 36.999 19.278 10.552 1.00 8.44 N ATOM 2662 CA TRP C 36 37.698 18.299 11.366 1.00 7.50 C ATOM 2663 C TRP C 36 38.686 17.548 10.490 1.00 9.34 C ATOM 2664 O TRP C 36 38.319 17.027 9.427 1.00 9.04 O ATOM 2665 CB TRP C 36 36.713 17.327 12.006 1.00 8.31 C ATOM 2666 CG TRP C 36 35.946 17.904 13.148 1.00 7.76 C ATOM 2667 CD1 TRP C 36 34.654 18.357 13.131 1.00 9.24 C ATOM 2668 CD2 TRP C 36 36.402 18.047 14.500 1.00 8.92 C ATOM 2669 NE1 TRP C 36 34.290 18.792 14.387 1.00 8.18 N ATOM 2670 CE2 TRP C 36 35.348 18.619 15.242 1.00 9.40 C ATOM 2671 CE3 TRP C 36 37.611 17.755 15.150 1.00 10.43 C ATOM 2672 CZ2 TRP C 36 35.462 18.898 16.610 1.00 8.06 C ATOM 2673 CZ3 TRP C 36 37.725 18.045 16.512 1.00 10.61 C ATOM 2674 CH2 TRP C 36 36.655 18.603 17.218 1.00 8.84 C ATOM 2675 HE1 TRP C 36 33.363 19.187 14.645 1.00 0.00 H ATOM 2676 H TRP C 36 36.331 18.929 9.835 1.00 0.00 H ATOM 2677 N PHE C 37 39.930 17.492 10.941 1.00 8.54 N ATOM 2678 CA PHE C 37 40.986 16.730 10.296 1.00 10.04 C ATOM 2679 C PHE C 37 41.476 15.684 11.274 1.00 13.34 C ATOM 2680 O PHE C 37 41.371 15.856 12.490 1.00 13.19 O ATOM 2681 CB PHE C 37 42.157 17.631 9.865 1.00 12.12 C ATOM 2682 CG PHE C 37 41.855 18.465 8.658 1.00 10.39 C ATOM 2683 CD1 PHE C 37 41.287 19.719 8.790 1.00 10.80 C ATOM 2684 CD2 PHE C 37 42.117 17.982 7.385 1.00 13.23 C ATOM 2685 CE1 PHE C 37 40.987 20.476 7.678 1.00 8.84 C ATOM 2686 CE2 PHE C 37 41.820 18.747 6.259 1.00 11.03 C ATOM 2687 CZ PHE C 37 41.256 19.979 6.406 1.00 9.09 C ATOM 2688 H PHE C 37 40.164 18.023 11.804 1.00 0.00 H ATOM 2689 N ARG C 38 41.997 14.588 10.750 1.00 10.59 N ATOM 2690 CA ARG C 38 42.599 13.613 11.636 1.00 11.70 C ATOM 2691 C ARG C 38 43.961 13.215 11.096 1.00 13.18 C ATOM 2692 O ARG C 38 44.187 13.182 9.883 1.00 11.30 O ATOM 2693 CB ARG C 38 41.707 12.397 11.831 1.00 10.34 C ATOM 2694 CG ARG C 38 41.433 11.590 10.602 1.00 9.88 C ATOM 2695 CD ARG C 38 40.404 10.515 10.908 1.00 14.03 C ATOM 2696 NE ARG C 38 40.083 9.712 9.738 1.00 18.61 N ATOM 2697 CZ ARG C 38 39.130 8.789 9.714 1.00 14.91 C ATOM 2698 NH1 ARG C 38 38.399 8.556 10.799 1.00 17.86 N ATOM 2699 NH2 ARG C 38 38.902 8.096 8.606 1.00 18.61 N ATOM 2700 HE ARG C 38 40.633 9.871 8.870 1.00 0.00 H ATOM 2701 HH12 ARG C 38 37.653 7.832 10.778 1.00 0.00 H ATOM 2702 HH11 ARG C 38 38.573 9.098 11.670 1.00 0.00 H ATOM 2703 HH22 ARG C 38 38.155 7.373 8.589 1.00 0.00 H ATOM 2704 HH21 ARG C 38 39.471 8.276 7.754 1.00 0.00 H ATOM 2705 H ARG C 38 41.975 14.429 9.722 1.00 0.00 H ATOM 2706 N GLN C 39 44.871 12.922 12.025 1.00 17.42 N ATOM 2707 CA GLN C 39 46.238 12.557 11.689 1.00 20.75 C ATOM 2708 C GLN C 39 46.726 11.505 12.667 1.00 17.55 C ATOM 2709 O GLN C 39 46.558 11.663 13.880 1.00 16.51 O ATOM 2710 CB GLN C 39 47.164 13.777 11.729 1.00 22.12 C ATOM 2711 CG GLN C 39 48.448 13.599 10.942 1.00 27.83 C ATOM 2712 CD GLN C 39 49.410 14.764 11.095 1.00 28.03 C ATOM 2713 OE1 GLN C 39 49.321 15.541 12.046 1.00 31.77 O ATOM 2714 NE2 GLN C 39 50.344 14.886 10.155 1.00 31.66 N ATOM 2715 HE22 GLN C 39 50.382 14.206 9.369 1.00 0.00 H ATOM 2716 HE21 GLN C 39 51.036 15.661 10.207 1.00 0.00 H ATOM 2717 H GLN C 39 44.593 12.956 13.027 1.00 0.00 H ATOM 2718 N GLY C 40 47.322 10.439 12.136 1.00 20.06 N ATOM 2719 CA GLY C 40 47.988 9.451 12.949 1.00 24.23 C ATOM 2720 C GLY C 40 49.476 9.716 12.932 1.00 24.30 C ATOM 2721 O GLY C 40 49.959 10.529 12.139 1.00 26.63 O ATOM 2722 H GLY C 40 47.307 10.315 11.104 1.00 0.00 H ATOM 2723 N PRO C 41 50.239 9.046 13.796 1.00 24.22 N ATOM 2724 CA PRO C 41 51.679 9.340 13.870 1.00 24.54 C ATOM 2725 C PRO C 41 52.358 9.019 12.546 1.00 22.18 C ATOM 2726 O PRO C 41 52.213 7.925 12.002 1.00 20.32 O ATOM 2727 CB PRO C 41 52.169 8.439 15.013 1.00 22.45 C ATOM 2728 CG PRO C 41 51.147 7.366 15.131 1.00 25.06 C ATOM 2729 CD PRO C 41 49.838 7.978 14.732 1.00 22.72 C ATOM 2730 N GLY C 42 53.060 10.009 12.003 1.00 24.09 N ATOM 2731 CA GLY C 42 53.777 9.852 10.757 1.00 26.05 C ATOM 2732 C GLY C 42 52.939 9.955 9.502 1.00 29.48 C ATOM 2733 O GLY C 42 53.495 9.870 8.401 1.00 31.22 O ATOM 2734 H GLY C 42 53.095 10.927 12.491 1.00 0.00 H ATOM 2735 N THR C 43 51.629 10.142 9.624 1.00 27.92 N ATOM 2736 CA THR C 43 50.730 10.177 8.480 1.00 28.89 C ATOM 2737 C THR C 43 50.371 11.614 8.119 1.00 24.90 C ATOM 2738 O THR C 43 50.590 12.553 8.888 1.00 28.01 O ATOM 2739 CB THR C 43 49.452 9.386 8.768 1.00 30.63 C ATOM 2740 OG1 THR C 43 48.500 10.235 9.429 1.00 28.12 O ATOM 2741 CG2 THR C 43 49.760 8.193 9.660 1.00 31.13 C ATOM 2742 HG1 THR C 43 48.886 10.561 10.281 1.00 0.00 H ATOM 2743 H THR C 43 51.230 10.269 10.576 1.00 0.00 H ATOM 2744 N GLU C 44 49.811 11.781 6.923 1.00 26.12 N ATOM 2745 CA GLU C 44 49.306 13.086 6.528 1.00 25.80 C ATOM 2746 C GLU C 44 47.949 13.341 7.179 1.00 24.31 C ATOM 2747 O GLU C 44 47.227 12.413 7.556 1.00 26.47 O ATOM 2748 CB GLU C 44 49.178 13.190 5.005 1.00 28.52 C ATOM 2749 CG GLU C 44 50.498 13.179 4.254 1.00 30.15 C ATOM 2750 CD GLU C 44 51.409 14.320 4.663 1.00 32.90 C ATOM 2751 OE1 GLU C 44 52.480 14.041 5.244 1.00 33.67 O ATOM 2752 OE2 GLU C 44 51.058 15.494 4.407 1.00 34.39 O ATOM 2753 H GLU C 44 49.734 10.976 6.269 1.00 0.00 H ATOM 2754 N ARG C 45 47.609 14.618 7.312 1.00 22.10 N ATOM 2755 CA ARG C 45 46.274 14.978 7.765 1.00 21.10 C ATOM 2756 C ARG C 45 45.236 14.612 6.714 1.00 21.76 C ATOM 2757 O ARG C 45 45.436 14.815 5.512 1.00 23.05 O ATOM 2758 CB ARG C 45 46.192 16.468 8.070 1.00 21.15 C ATOM 2759 CG ARG C 45 47.078 16.928 9.201 1.00 26.59 C ATOM 2760 CD ARG C 45 46.560 18.230 9.775 1.00 28.05 C ATOM 2761 NE ARG C 45 47.638 19.113 10.202 1.00 29.69 N ATOM 2762 CZ ARG C 45 48.233 20.001 9.413 1.00 30.14 C ATOM 2763 NH1 ARG C 45 49.207 20.767 9.889 1.00 30.53 N ATOM 2764 NH2 ARG C 45 47.859 20.119 8.146 1.00 31.33 N ATOM 2765 HE ARG C 45 47.962 19.044 11.188 1.00 0.00 H ATOM 2766 HH12 ARG C 45 49.672 21.462 9.270 1.00 0.00 H ATOM 2767 HH11 ARG C 45 49.505 20.672 10.881 1.00 0.00 H ATOM 2768 HH22 ARG C 45 48.325 20.814 7.529 1.00 0.00 H ATOM 2769 HH21 ARG C 45 47.100 19.516 7.770 1.00 0.00 H ATOM 2770 H ARG C 45 48.300 15.364 7.091 1.00 0.00 H ATOM 2771 N GLU C 46 44.118 14.066 7.177 1.00 18.04 N ATOM 2772 CA GLU C 46 43.036 13.650 6.299 1.00 22.28 C ATOM 2773 C GLU C 46 41.765 14.362 6.725 1.00 17.22 C ATOM 2774 O GLU C 46 41.376 14.294 7.897 1.00 12.97 O ATOM 2775 CB GLU C 46 42.836 12.131 6.344 1.00 21.89 C ATOM 2776 CG GLU C 46 41.499 11.678 5.793 1.00 21.10 C ATOM 2777 CD GLU C 46 41.240 10.201 6.001 1.00 28.37 C ATOM 2778 OE1 GLU C 46 41.231 9.747 7.167 1.00 26.57 O ATOM 2779 OE2 GLU C 46 41.038 9.490 4.992 1.00 38.08 O ATOM 2780 H GLU C 46 44.012 13.931 8.203 1.00 0.00 H ATOM 2781 N GLY C 47 41.130 15.055 5.781 1.00 12.79 N ATOM 2782 CA GLY C 47 39.850 15.687 6.048 1.00 7.64 C ATOM 2783 C GLY C 47 38.777 14.680 6.400 1.00 10.07 C ATOM 2784 O GLY C 47 38.592 13.677 5.708 1.00 12.86 O ATOM 2785 H GLY C 47 41.558 15.145 4.837 1.00 0.00 H ATOM 2786 N VAL C 48 38.073 14.942 7.489 1.00 8.33 N ATOM 2787 CA VAL C 48 37.025 14.059 7.978 1.00 9.84 C ATOM 2788 C VAL C 48 35.677 14.626 7.554 1.00 8.02 C ATOM 2789 O VAL C 48 34.886 13.956 6.882 1.00 6.90 O ATOM 2790 CB VAL C 48 37.105 13.908 9.510 1.00 9.39 C ATOM 2791 CG1 VAL C 48 35.993 13.007 10.010 1.00 14.17 C ATOM 2792 CG2 VAL C 48 38.484 13.386 9.924 1.00 12.39 C ATOM 2793 H VAL C 48 38.277 15.814 8.017 1.00 0.00 H ATOM 2794 N ALA C 49 35.405 15.865 7.952 1.00 6.22 N ATOM 2795 CA ALA C 49 34.127 16.503 7.678 1.00 6.65 C ATOM 2796 C ALA C 49 34.329 17.996 7.828 1.00 7.89 C ATOM 2797 O ALA C 49 35.275 18.449 8.475 1.00 7.86 O ATOM 2798 CB ALA C 49 33.019 15.997 8.616 1.00 7.18 C ATOM 2799 H ALA C 49 36.130 16.395 8.476 1.00 0.00 H ATOM 2800 N ALA C 50 33.445 18.760 7.198 1.00 6.74 N ATOM 2801 CA ALA C 50 33.556 20.200 7.262 1.00 7.16 C ATOM 2802 C ALA C 50 32.201 20.819 7.034 1.00 6.68 C ATOM 2803 O ALA C 50 31.303 20.208 6.457 1.00 6.34 O ATOM 2804 CB ALA C 50 34.530 20.756 6.217 1.00 6.84 C ATOM 2805 H ALA C 50 32.672 18.322 6.658 1.00 0.00 H ATOM 2806 N THR C 51 32.063 22.046 7.495 1.00 7.57 N ATOM 2807 CA THR C 51 30.905 22.850 7.174 1.00 7.66 C ATOM 2808 C THR C 51 31.377 24.141 6.546 1.00 10.07 C ATOM 2809 O THR C 51 32.441 24.662 6.900 1.00 10.02 O ATOM 2810 CB THR C 51 30.056 23.147 8.398 1.00 9.88 C ATOM 2811 OG1 THR C 51 29.595 21.918 8.960 1.00 13.18 O ATOM 2812 CG2 THR C 51 28.868 23.941 8.012 1.00 15.23 C ATOM 2813 HG1 THR C 51 29.041 22.109 9.758 1.00 0.00 H ATOM 2814 H THR C 51 32.805 22.446 8.104 1.00 0.00 H ATOM 2815 N TYR C 52 30.606 24.619 5.575 1.00 6.57 N ATOM 2816 CA TYR C 52 30.734 25.964 5.038 1.00 8.28 C ATOM 2817 C TYR C 52 29.537 26.786 5.485 1.00 9.90 C ATOM 2818 O TYR C 52 28.382 26.400 5.258 1.00 9.54 O ATOM 2819 CB TYR C 52 30.814 25.958 3.510 1.00 9.41 C ATOM 2820 CG TYR C 52 31.075 27.336 2.973 1.00 11.12 C ATOM 2821 CD1 TYR C 52 32.367 27.823 2.913 1.00 12.89 C ATOM 2822 CD2 TYR C 52 30.031 28.161 2.557 1.00 14.29 C ATOM 2823 CE1 TYR C 52 32.634 29.077 2.438 1.00 15.77 C ATOM 2824 CE2 TYR C 52 30.293 29.435 2.076 1.00 16.79 C ATOM 2825 CZ TYR C 52 31.605 29.875 2.022 1.00 17.76 C ATOM 2826 OH TYR C 52 31.920 31.125 1.554 1.00 19.98 O ATOM 2827 HH TYR C 52 32.901 31.253 1.593 1.00 0.00 H ATOM 2828 H TYR C 52 29.872 23.998 5.178 1.00 0.00 H ATOM 2829 N THR C 53 29.803 27.913 6.124 1.00 10.33 N ATOM 2830 CA THR C 53 28.738 28.762 6.622 1.00 10.23 C ATOM 2831 C THR C 53 28.731 30.051 5.817 1.00 14.09 C ATOM 2832 O THR C 53 29.781 30.678 5.630 1.00 12.78 O ATOM 2833 CB THR C 53 28.910 29.035 8.116 1.00 11.10 C ATOM 2834 OG1 THR C 53 28.916 27.787 8.823 1.00 10.35 O ATOM 2835 CG2 THR C 53 27.777 29.909 8.641 1.00 14.49 C ATOM 2836 HG1 THR C 53 28.059 27.316 8.666 1.00 0.00 H ATOM 2837 H THR C 53 30.793 28.195 6.272 1.00 0.00 H ATOM 2838 N ALA C 54 27.551 30.429 5.328 1.00 17.35 N ATOM 2839 CA ALA C 54 27.361 31.673 4.602 1.00 23.41 C ATOM 2840 C ALA C 54 26.901 32.779 5.552 1.00 25.64 C ATOM 2841 O ALA C 54 26.809 32.600 6.769 1.00 28.21 O ATOM 2842 CB ALA C 54 26.365 31.477 3.457 1.00 27.38 C ATOM 2843 H ALA C 54 26.730 29.807 5.472 1.00 0.00 H ATOM 2844 N GLY C 55 26.609 33.946 4.974 1.00 31.23 N ATOM 2845 CA GLY C 55 26.282 35.106 5.788 1.00 31.48 C ATOM 2846 C GLY C 55 25.046 34.906 6.643 1.00 36.39 C ATOM 2847 O GLY C 55 24.971 35.408 7.767 1.00 40.72 O ATOM 2848 H GLY C 55 26.615 34.026 3.937 1.00 0.00 H ATOM 2849 N SER C 56 24.064 34.175 6.128 1.00 38.63 N ATOM 2850 CA SER C 56 22.843 33.899 6.876 1.00 33.81 C ATOM 2851 C SER C 56 23.135 33.005 8.076 1.00 37.50 C ATOM 2852 O SER C 56 22.352 32.945 9.027 1.00 39.75 O ATOM 2853 CB SER C 56 21.795 33.245 5.973 1.00 36.81 C ATOM 2854 OG SER C 56 21.801 33.826 4.679 1.00 42.78 O ATOM 2855 HG SER C 56 21.115 33.385 4.117 1.00 0.00 H ATOM 2856 H SER C 56 24.168 33.790 5.168 1.00 0.00 H TER 2857 SER C 56 ATOM 2858 N THR C 58 23.333 30.074 7.221 1.00 23.58 N ATOM 2859 CA THR C 58 23.017 28.740 6.718 1.00 19.78 C ATOM 2860 C THR C 58 24.311 28.031 6.335 1.00 16.25 C ATOM 2861 O THR C 58 25.280 28.668 5.932 1.00 16.62 O ATOM 2862 CB THR C 58 22.045 28.801 5.516 1.00 21.90 C ATOM 2863 OG1 THR C 58 21.400 27.535 5.347 1.00 27.97 O ATOM 2864 CG2 THR C 58 22.768 29.158 4.234 1.00 25.74 C ATOM 2865 HG1 THR C 58 20.780 27.582 4.577 1.00 0.00 H ATOM 2866 HN3 THR C 58 23.823 30.615 6.480 1.00 0.00 H ATOM 2867 HN2 THR C 58 23.948 29.992 8.056 1.00 0.00 H ATOM 2868 HN1 THR C 58 22.453 30.562 7.484 1.00 0.00 H ATOM 2869 N SER C 59 24.327 26.708 6.486 1.00 12.95 N ATOM 2870 CA SER C 59 25.542 25.927 6.363 1.00 13.64 C ATOM 2871 C SER C 59 25.346 24.774 5.389 1.00 15.11 C ATOM 2872 O SER C 59 24.252 24.219 5.262 1.00 21.45 O ATOM 2873 CB SER C 59 25.967 25.392 7.719 1.00 16.31 C ATOM 2874 OG SER C 59 26.487 26.420 8.543 1.00 15.84 O ATOM 2875 HG SER C 59 27.276 26.826 8.104 1.00 0.00 H ATOM 2876 H SER C 59 23.435 26.217 6.700 1.00 0.00 H ATOM 2877 N MET C 60 26.423 24.420 4.705 1.00 13.15 N ATOM 2878 CA MET C 60 26.503 23.205 3.914 1.00 12.61 C ATOM 2879 C MET C 60 27.528 22.289 4.554 1.00 14.05 C ATOM 2880 O MET C 60 28.438 22.744 5.238 1.00 14.17 O ATOM 2881 CB MET C 60 26.908 23.503 2.471 1.00 15.95 C ATOM 2882 CG MET C 60 26.006 24.503 1.772 1.00 18.90 C ATOM 2883 SD MET C 60 26.522 24.786 0.067 1.00 36.02 S ATOM 2884 CE MET C 60 25.984 23.255 -0.695 1.00 31.84 C ATOM 2885 H MET C 60 27.254 25.044 4.736 1.00 0.00 H ATOM 2886 N THR C 61 27.390 21.000 4.307 1.00 11.56 N ATOM 2887 CA THR C 61 28.189 20.000 4.989 1.00 10.78 C ATOM 2888 C THR C 61 28.887 19.101 3.980 1.00 10.22 C ATOM 2889 O THR C 61 28.337 18.801 2.918 1.00 13.49 O ATOM 2890 CB THR C 61 27.293 19.195 5.921 1.00 14.89 C ATOM 2891 OG1 THR C 61 26.752 20.076 6.914 1.00 21.56 O ATOM 2892 CG2 THR C 61 28.053 18.149 6.586 1.00 13.05 C ATOM 2893 HG1 THR C 61 26.167 19.562 7.526 1.00 0.00 H ATOM 2894 H THR C 61 26.689 20.693 3.603 1.00 0.00 H ATOM 2895 N TYR C 62 30.108 18.671 4.329 1.00 7.92 N ATOM 2896 CA TYR C 62 30.963 17.823 3.505 1.00 9.60 C ATOM 2897 C TYR C 62 31.541 16.699 4.359 1.00 7.97 C ATOM 2898 O TYR C 62 31.864 16.911 5.529 1.00 8.51 O ATOM 2899 CB TYR C 62 32.109 18.638 2.877 1.00 8.87 C ATOM 2900 CG TYR C 62 31.654 19.905 2.172 1.00 9.64 C ATOM 2901 CD1 TYR C 62 31.553 21.100 2.863 1.00 12.03 C ATOM 2902 CD2 TYR C 62 31.317 19.893 0.827 1.00 18.17 C ATOM 2903 CE1 TYR C 62 31.131 22.250 2.238 1.00 15.03 C ATOM 2904 CE2 TYR C 62 30.895 21.054 0.186 1.00 13.29 C ATOM 2905 CZ TYR C 62 30.804 22.216 0.899 1.00 19.78 C ATOM 2906 OH TYR C 62 30.384 23.369 0.275 1.00 28.51 O ATOM 2907 HH TYR C 62 30.375 24.112 0.929 1.00 0.00 H ATOM 2908 H TYR C 62 30.473 18.964 5.258 1.00 0.00 H ATOM 2909 N TYR C 63 31.653 15.504 3.781 1.00 7.85 N ATOM 2910 CA TYR C 63 32.168 14.324 4.466 1.00 8.08 C ATOM 2911 C TYR C 63 33.159 13.574 3.597 1.00 8.33 C ATOM 2912 O TYR C 63 32.977 13.456 2.381 1.00 10.85 O ATOM 2913 CB TYR C 63 31.058 13.327 4.838 1.00 7.71 C ATOM 2914 CG TYR C 63 30.109 13.851 5.884 1.00 5.67 C ATOM 2915 CD1 TYR C 63 30.465 13.863 7.214 1.00 8.66 C ATOM 2916 CD2 TYR C 63 28.872 14.363 5.531 1.00 9.69 C ATOM 2917 CE1 TYR C 63 29.612 14.362 8.179 1.00 7.63 C ATOM 2918 CE2 TYR C 63 27.991 14.845 6.493 1.00 8.53 C ATOM 2919 CZ TYR C 63 28.368 14.852 7.815 1.00 8.65 C ATOM 2920 OH TYR C 63 27.511 15.346 8.781 1.00 10.43 O ATOM 2921 HH TYR C 63 27.941 15.274 9.670 1.00 0.00 H ATOM 2922 H TYR C 63 31.357 15.407 2.789 1.00 0.00 H ATOM 2923 N ALA C 64 34.187 13.031 4.235 1.00 9.01 N ATOM 2924 CA ALA C 64 35.017 12.027 3.580 1.00 10.61 C ATOM 2925 C ALA C 64 34.208 10.756 3.366 1.00 13.48 C ATOM 2926 O ALA C 64 33.411 10.362 4.220 1.00 12.43 O ATOM 2927 CB ALA C 64 36.252 11.728 4.425 1.00 15.41 C ATOM 2928 H ALA C 64 34.403 13.323 5.209 1.00 0.00 H ATOM 2929 N ASP C 65 34.442 10.086 2.233 1.00 11.78 N ATOM 2930 CA ASP C 65 33.668 8.882 1.942 1.00 16.03 C ATOM 2931 C ASP C 65 33.851 7.827 3.029 1.00 17.63 C ATOM 2932 O ASP C 65 32.937 7.033 3.281 1.00 18.89 O ATOM 2933 CB ASP C 65 34.067 8.304 0.581 1.00 14.93 C ATOM 2934 CG ASP C 65 33.601 9.163 -0.585 1.00 23.35 C ATOM 2935 OD1 ASP C 65 32.880 10.157 -0.353 1.00 25.29 O ATOM 2936 OD2 ASP C 65 33.954 8.842 -1.739 1.00 30.98 O ATOM 2937 H ASP C 65 35.167 10.419 1.566 1.00 0.00 H ATOM 2938 N SER C 66 35.009 7.820 3.698 1.00 14.82 N ATOM 2939 CA SER C 66 35.290 6.775 4.677 1.00 18.14 C ATOM 2940 C SER C 66 34.514 6.949 5.977 1.00 14.22 C ATOM 2941 O SER C 66 34.460 6.010 6.777 1.00 15.26 O ATOM 2942 CB SER C 66 36.777 6.732 4.994 1.00 18.32 C ATOM 2943 OG SER C 66 37.147 7.890 5.693 1.00 19.65 O ATOM 2944 HG SER C 66 38.115 7.856 5.896 1.00 0.00 H ATOM 2945 H SER C 66 35.714 8.564 3.519 1.00 0.00 H ATOM 2946 N VAL C 67 33.912 8.114 6.214 1.00 12.56 N ATOM 2947 CA VAL C 67 33.152 8.358 7.435 1.00 12.16 C ATOM 2948 C VAL C 67 31.688 8.643 7.165 1.00 13.36 C ATOM 2949 O VAL C 67 30.921 8.810 8.116 1.00 9.00 O ATOM 2950 CB VAL C 67 33.765 9.508 8.261 1.00 12.36 C ATOM 2951 CG1 VAL C 67 35.196 9.178 8.669 1.00 14.17 C ATOM 2952 CG2 VAL C 67 33.723 10.823 7.470 1.00 13.85 C ATOM 2953 H VAL C 67 33.986 8.873 5.507 1.00 0.00 H ATOM 2954 N LYS C 68 31.283 8.728 5.901 1.00 12.43 N ATOM 2955 CA LYS C 68 29.905 9.069 5.573 1.00 14.80 C ATOM 2956 C LYS C 68 28.951 8.040 6.158 1.00 15.61 C ATOM 2957 O LYS C 68 29.185 6.833 6.064 1.00 15.26 O ATOM 2958 CB LYS C 68 29.745 9.145 4.056 1.00 18.34 C ATOM 2959 CG LYS C 68 28.419 9.704 3.585 1.00 24.88 C ATOM 2960 CD LYS C 68 28.384 9.755 2.064 1.00 29.81 C ATOM 2961 CE LYS C 68 29.681 10.334 1.512 1.00 24.93 C ATOM 2962 NZ LYS C 68 29.663 10.508 0.025 1.00 31.87 N ATOM 2963 HZ1 LYS C 68 29.512 9.585 -0.429 1.00 0.00 H ATOM 2964 HZ2 LYS C 68 28.892 11.155 -0.238 1.00 0.00 H ATOM 2965 HZ3 LYS C 68 30.572 10.905 -0.287 1.00 0.00 H ATOM 2966 H LYS C 68 31.962 8.548 5.134 1.00 0.00 H ATOM 2967 N GLY C 69 27.874 8.523 6.766 1.00 13.47 N ATOM 2968 CA GLY C 69 26.895 7.654 7.381 1.00 16.23 C ATOM 2969 C GLY C 69 27.260 7.151 8.757 1.00 17.73 C ATOM 2970 O GLY C 69 26.417 6.513 9.407 1.00 19.44 O ATOM 2971 H GLY C 69 27.731 9.552 6.801 1.00 0.00 H ATOM 2972 N ARG C 70 28.479 7.414 9.227 1.00 10.53 N ATOM 2973 CA ARG C 70 28.917 7.057 10.568 1.00 12.05 C ATOM 2974 C ARG C 70 29.232 8.263 11.429 1.00 10.59 C ATOM 2975 O ARG C 70 29.014 8.213 12.639 1.00 11.85 O ATOM 2976 CB ARG C 70 30.170 6.171 10.519 1.00 12.40 C ATOM 2977 CG ARG C 70 29.982 4.811 9.876 1.00 13.88 C ATOM 2978 CD ARG C 70 31.248 3.932 10.049 1.00 13.07 C ATOM 2979 NE ARG C 70 32.461 4.544 9.509 1.00 13.67 N ATOM 2980 CZ ARG C 70 33.538 4.860 10.225 1.00 12.18 C ATOM 2981 NH1 ARG C 70 33.581 4.610 11.526 1.00 14.19 N ATOM 2982 NH2 ARG C 70 34.585 5.431 9.636 1.00 15.71 N ATOM 2983 HE ARG C 70 32.484 4.748 8.489 1.00 0.00 H ATOM 2984 HH12 ARG C 70 34.427 4.861 12.076 1.00 0.00 H ATOM 2985 HH11 ARG C 70 32.769 4.163 11.997 1.00 0.00 H ATOM 2986 HH22 ARG C 70 35.426 5.678 10.196 1.00 0.00 H ATOM 2987 HH21 ARG C 70 34.563 5.631 8.616 1.00 0.00 H ATOM 2988 H ARG C 70 29.153 7.900 8.602 1.00 0.00 H ATOM 2989 N PHE C 71 29.761 9.327 10.835 1.00 9.96 N ATOM 2990 CA PHE C 71 30.061 10.557 11.546 1.00 9.88 C ATOM 2991 C PHE C 71 29.092 11.628 11.083 1.00 6.57 C ATOM 2992 O PHE C 71 28.676 11.646 9.920 1.00 11.03 O ATOM 2993 CB PHE C 71 31.485 11.078 11.280 1.00 9.33 C ATOM 2994 CG PHE C 71 32.606 10.197 11.792 1.00 10.88 C ATOM 2995 CD1 PHE C 71 32.372 8.945 12.340 1.00 10.83 C ATOM 2996 CD2 PHE C 71 33.916 10.653 11.721 1.00 10.16 C ATOM 2997 CE1 PHE C 71 33.425 8.162 12.794 1.00 10.53 C ATOM 2998 CE2 PHE C 71 34.968 9.877 12.170 1.00 12.07 C ATOM 2999 CZ PHE C 71 34.721 8.633 12.704 1.00 13.84 C ATOM 3000 H PHE C 71 29.969 9.277 9.817 1.00 0.00 H ATOM 3001 N THR C 72 28.776 12.547 11.985 1.00 7.94 N ATOM 3002 CA THR C 72 27.905 13.662 11.646 1.00 7.98 C ATOM 3003 C THR C 72 28.504 14.919 12.237 1.00 6.91 C ATOM 3004 O THR C 72 28.782 14.967 13.435 1.00 8.82 O ATOM 3005 CB THR C 72 26.480 13.444 12.176 1.00 8.36 C ATOM 3006 OG1 THR C 72 25.929 12.269 11.569 1.00 13.41 O ATOM 3007 CG2 THR C 72 25.574 14.629 11.862 1.00 10.78 C ATOM 3008 HG1 THR C 72 25.905 12.387 10.586 1.00 0.00 H ATOM 3009 H THR C 72 29.157 12.470 12.950 1.00 0.00 H ATOM 3010 N ILE C 73 28.697 15.928 11.396 1.00 6.04 N ATOM 3011 CA ILE C 73 29.228 17.214 11.829 1.00 6.23 C ATOM 3012 C ILE C 73 28.050 18.159 12.040 1.00 6.67 C ATOM 3013 O ILE C 73 27.032 18.085 11.339 1.00 9.57 O ATOM 3014 CB ILE C 73 30.253 17.778 10.823 1.00 4.91 C ATOM 3015 CG1 ILE C 73 30.981 18.982 11.421 1.00 4.92 C ATOM 3016 CG2 ILE C 73 29.586 18.163 9.505 1.00 7.89 C ATOM 3017 CD1 ILE C 73 32.136 19.459 10.579 1.00 8.62 C ATOM 3018 H ILE C 73 28.461 15.796 10.392 1.00 0.00 H ATOM 3019 N SER C 74 28.163 19.008 13.050 1.00 5.16 N ATOM 3020 CA SER C 74 27.131 19.989 13.342 1.00 6.33 C ATOM 3021 C SER C 74 27.790 21.141 14.076 1.00 7.64 C ATOM 3022 O SER C 74 28.945 21.061 14.491 1.00 7.50 O ATOM 3023 CB SER C 74 26.001 19.391 14.180 1.00 8.61 C ATOM 3024 OG SER C 74 26.459 19.040 15.486 1.00 8.64 O ATOM 3025 HG SER C 74 27.186 18.372 15.411 1.00 0.00 H ATOM 3026 H SER C 74 29.012 18.972 13.650 1.00 0.00 H ATOM 3027 N GLN C 75 27.069 22.241 14.195 1.00 7.10 N ATOM 3028 CA GLN C 75 27.608 23.361 14.940 1.00 5.93 C ATOM 3029 C GLN C 75 26.485 24.023 15.715 1.00 7.61 C ATOM 3030 O GLN C 75 25.320 23.956 15.324 1.00 7.19 O ATOM 3031 CB GLN C 75 28.315 24.371 14.022 1.00 9.42 C ATOM 3032 CG GLN C 75 27.393 25.066 13.051 1.00 10.86 C ATOM 3033 CD GLN C 75 28.115 25.509 11.809 1.00 12.07 C ATOM 3034 OE1 GLN C 75 28.538 24.686 11.001 1.00 14.10 O ATOM 3035 NE2 GLN C 75 28.276 26.813 11.652 1.00 10.59 N ATOM 3036 HE22 GLN C 75 27.900 27.473 12.363 1.00 0.00 H ATOM 3037 HE21 GLN C 75 28.778 27.178 10.818 1.00 0.00 H ATOM 3038 H GLN C 75 26.127 22.303 13.760 1.00 0.00 H ATOM 3039 N ASP C 76 26.849 24.655 16.828 1.00 8.78 N ATOM 3040 CA ASP C 76 25.934 25.502 17.587 1.00 7.76 C ATOM 3041 C ASP C 76 26.503 26.910 17.520 1.00 11.02 C ATOM 3042 O ASP C 76 27.490 27.222 18.194 1.00 10.36 O ATOM 3043 CB ASP C 76 25.779 25.015 19.026 1.00 10.14 C ATOM 3044 CG ASP C 76 24.789 25.836 19.809 1.00 15.26 C ATOM 3045 OD1 ASP C 76 24.865 27.084 19.759 1.00 14.66 O ATOM 3046 OD2 ASP C 76 23.916 25.233 20.479 1.00 17.79 O ATOM 3047 H ASP C 76 27.824 24.541 17.171 1.00 0.00 H ATOM 3048 N ASN C 77 25.884 27.763 16.709 1.00 9.39 N ATOM 3049 CA ASN C 77 26.508 29.052 16.439 1.00 11.64 C ATOM 3050 C ASN C 77 26.479 29.954 17.661 1.00 12.61 C ATOM 3051 O ASN C 77 27.426 30.715 17.891 1.00 12.17 O ATOM 3052 CB ASN C 77 25.830 29.724 15.254 1.00 10.53 C ATOM 3053 CG ASN C 77 26.069 28.983 13.975 1.00 13.20 C ATOM 3054 OD1 ASN C 77 27.083 28.291 13.836 1.00 11.98 O ATOM 3055 ND2 ASN C 77 25.132 29.096 13.033 1.00 14.42 N ATOM 3056 HD22 ASN C 77 24.296 29.692 13.200 1.00 0.00 H ATOM 3057 HD21 ASN C 77 25.237 28.588 12.132 1.00 0.00 H ATOM 3058 H ASN C 77 24.972 27.515 16.276 1.00 0.00 H ATOM 3059 N ALA C 78 25.409 29.887 18.455 1.00 10.67 N ATOM 3060 CA ALA C 78 25.343 30.692 19.671 1.00 14.31 C ATOM 3061 C ALA C 78 26.457 30.329 20.649 1.00 16.72 C ATOM 3062 O ALA C 78 26.974 31.200 21.359 1.00 19.99 O ATOM 3063 CB ALA C 78 23.975 30.526 20.334 1.00 14.84 C ATOM 3064 H ALA C 78 24.618 29.259 18.207 1.00 0.00 H ATOM 3065 N LYS C 79 26.823 29.049 20.715 1.00 11.54 N ATOM 3066 CA LYS C 79 27.898 28.554 21.567 1.00 14.00 C ATOM 3067 C LYS C 79 29.261 28.601 20.886 1.00 11.48 C ATOM 3068 O LYS C 79 30.254 28.198 21.496 1.00 13.13 O ATOM 3069 CB LYS C 79 27.612 27.106 22.007 1.00 16.32 C ATOM 3070 CG LYS C 79 26.381 26.927 22.863 1.00 19.00 C ATOM 3071 CD LYS C 79 26.217 25.475 23.277 1.00 20.59 C ATOM 3072 CE LYS C 79 24.890 25.270 23.997 1.00 24.59 C ATOM 3073 NZ LYS C 79 24.859 23.989 24.759 1.00 33.01 N ATOM 3074 HZ1 LYS C 79 24.999 23.194 24.104 1.00 0.00 H ATOM 3075 HZ2 LYS C 79 25.618 23.992 25.470 1.00 0.00 H ATOM 3076 HZ3 LYS C 79 23.938 23.891 25.233 1.00 0.00 H ATOM 3077 H LYS C 79 26.312 28.363 20.124 1.00 0.00 H ATOM 3078 N LYS C 80 29.321 29.046 19.635 1.00 12.47 N ATOM 3079 CA LYS C 80 30.560 29.088 18.858 1.00 7.99 C ATOM 3080 C LYS C 80 31.301 27.750 18.919 1.00 10.32 C ATOM 3081 O LYS C 80 32.521 27.686 19.113 1.00 11.12 O ATOM 3082 CB LYS C 80 31.452 30.240 19.324 1.00 10.99 C ATOM 3083 CG LYS C 80 30.882 31.618 18.989 1.00 14.20 C ATOM 3084 CD LYS C 80 31.843 32.734 19.431 1.00 16.57 C ATOM 3085 CE LYS C 80 31.498 34.047 18.762 1.00 23.54 C ATOM 3086 NZ LYS C 80 32.241 35.177 19.380 1.00 27.28 N ATOM 3087 HZ1 LYS C 80 31.994 35.243 20.388 1.00 0.00 H ATOM 3088 HZ2 LYS C 80 33.263 35.013 19.282 1.00 0.00 H ATOM 3089 HZ3 LYS C 80 31.984 36.063 18.900 1.00 0.00 H ATOM 3090 H LYS C 80 28.444 29.381 19.187 1.00 0.00 H ATOM 3091 N THR C 81 30.555 26.664 18.714 1.00 9.27 N ATOM 3092 CA THR C 81 31.080 25.319 18.912 1.00 10.23 C ATOM 3093 C THR C 81 30.761 24.440 17.715 1.00 9.45 C ATOM 3094 O THR C 81 29.634 24.459 17.217 1.00 9.12 O ATOM 3095 CB THR C 81 30.514 24.719 20.203 1.00 10.41 C ATOM 3096 OG1 THR C 81 30.959 25.515 21.307 1.00 12.80 O ATOM 3097 CG2 THR C 81 30.991 23.282 20.408 1.00 12.45 C ATOM 3098 HG1 THR C 81 30.635 26.444 21.195 1.00 0.00 H ATOM 3099 H THR C 81 29.569 26.780 18.404 1.00 0.00 H ATOM 3100 N LEU C 82 31.766 23.699 17.248 1.00 7.80 N ATOM 3101 CA LEU C 82 31.654 22.701 16.195 1.00 6.69 C ATOM 3102 C LEU C 82 31.710 21.319 16.829 1.00 9.65 C ATOM 3103 O LEU C 82 32.534 21.081 17.716 1.00 9.67 O ATOM 3104 CB LEU C 82 32.791 22.866 15.179 1.00 6.42 C ATOM 3105 CG LEU C 82 32.713 21.945 13.971 1.00 6.20 C ATOM 3106 CD1 LEU C 82 31.634 22.465 13.039 1.00 8.64 C ATOM 3107 CD2 LEU C 82 34.044 21.932 13.257 1.00 7.55 C ATOM 3108 H LEU C 82 32.705 23.846 17.670 1.00 0.00 H ATOM 3109 N TYR C 83 30.836 20.409 16.389 1.00 5.57 N ATOM 3110 CA TYR C 83 30.753 19.059 16.935 1.00 5.52 C ATOM 3111 C TYR C 83 31.041 18.009 15.869 1.00 7.57 C ATOM 3112 O TYR C 83 30.753 18.193 14.685 1.00 8.55 O ATOM 3113 CB TYR C 83 29.361 18.776 17.529 1.00 6.71 C ATOM 3114 CG TYR C 83 28.898 19.769 18.570 1.00 9.81 C ATOM 3115 CD1 TYR C 83 29.324 19.683 19.886 1.00 9.91 C ATOM 3116 CD2 TYR C 83 28.006 20.766 18.237 1.00 8.64 C ATOM 3117 CE1 TYR C 83 28.876 20.597 20.841 1.00 10.92 C ATOM 3118 CE2 TYR C 83 27.556 21.693 19.179 1.00 13.64 C ATOM 3119 CZ TYR C 83 27.996 21.597 20.475 1.00 14.13 C ATOM 3120 OH TYR C 83 27.552 22.507 21.403 1.00 18.08 O ATOM 3121 HH TYR C 83 27.958 22.304 22.283 1.00 0.00 H ATOM 3122 H TYR C 83 30.185 20.675 15.623 1.00 0.00 H ATOM 3123 N LEU C 84 31.616 16.886 16.292 1.00 5.97 N ATOM 3124 CA LEU C 84 31.745 15.714 15.428 1.00 5.83 C ATOM 3125 C LEU C 84 31.168 14.556 16.223 1.00 6.93 C ATOM 3126 O LEU C 84 31.791 14.085 17.180 1.00 8.35 O ATOM 3127 CB LEU C 84 33.189 15.445 15.020 1.00 6.69 C ATOM 3128 CG LEU C 84 33.384 14.344 13.971 1.00 7.78 C ATOM 3129 CD1 LEU C 84 32.833 14.726 12.627 1.00 7.50 C ATOM 3130 CD2 LEU C 84 34.862 14.040 13.854 1.00 9.91 C ATOM 3131 H LEU C 84 31.984 16.841 17.264 1.00 0.00 H ATOM 3132 N GLN C 85 29.964 14.132 15.846 1.00 5.12 N ATOM 3133 CA GLN C 85 29.339 12.955 16.444 1.00 7.33 C ATOM 3134 C GLN C 85 29.827 11.706 15.722 1.00 7.61 C ATOM 3135 O GLN C 85 29.639 11.572 14.508 1.00 10.96 O ATOM 3136 CB GLN C 85 27.815 13.042 16.368 1.00 7.99 C ATOM 3137 CG GLN C 85 27.100 11.776 16.897 1.00 9.54 C ATOM 3138 CD GLN C 85 27.239 11.643 18.399 1.00 10.31 C ATOM 3139 OE1 GLN C 85 26.802 12.517 19.144 1.00 12.04 O ATOM 3140 NE2 GLN C 85 27.873 10.563 18.851 1.00 12.73 N ATOM 3141 HE22 GLN C 85 28.226 9.849 18.182 1.00 0.00 H ATOM 3142 HE21 GLN C 85 28.015 10.433 19.873 1.00 0.00 H ATOM 3143 H GLN C 85 29.454 14.653 15.105 1.00 0.00 H ATOM 3144 N MET C 86 30.431 10.784 16.458 1.00 7.78 N ATOM 3145 CA MET C 86 30.955 9.565 15.861 1.00 9.43 C ATOM 3146 C MET C 86 30.144 8.380 16.351 1.00 9.82 C ATOM 3147 O MET C 86 29.799 8.292 17.537 1.00 12.19 O ATOM 3148 CB MET C 86 32.435 9.362 16.196 1.00 8.27 C ATOM 3149 CG MET C 86 33.295 10.568 15.908 1.00 10.10 C ATOM 3150 SD MET C 86 34.886 10.474 16.773 1.00 23.67 S ATOM 3151 CE MET C 86 36.000 10.231 15.422 1.00 23.25 C ATOM 3152 H MET C 86 30.532 10.935 17.482 1.00 0.00 H ATOM 3153 N ASN C 87 29.790 7.507 15.424 1.00 7.85 N ATOM 3154 CA ASN C 87 29.124 6.259 15.741 1.00 9.77 C ATOM 3155 C ASN C 87 29.852 5.159 14.994 1.00 12.19 C ATOM 3156 O ASN C 87 30.595 5.434 14.057 1.00 9.07 O ATOM 3157 CB ASN C 87 27.650 6.272 15.342 1.00 12.73 C ATOM 3158 CG ASN C 87 26.820 7.110 16.261 1.00 10.55 C ATOM 3159 OD1 ASN C 87 26.766 6.883 17.474 1.00 11.14 O ATOM 3160 ND2 ASN C 87 26.159 8.110 15.688 1.00 11.39 N ATOM 3161 HD22 ASN C 87 26.235 8.263 14.662 1.00 0.00 H ATOM 3162 HD21 ASN C 87 25.566 8.740 16.265 1.00 0.00 H ATOM 3163 H ASN C 87 29.997 7.724 14.428 1.00 0.00 H ATOM 3164 N SER C 88 29.618 3.913 15.411 1.00 14.34 N ATOM 3165 CA SER C 88 30.170 2.745 14.719 1.00 14.48 C ATOM 3166 C SER C 88 31.676 2.893 14.518 1.00 14.96 C ATOM 3167 O SER C 88 32.213 2.678 13.426 1.00 13.37 O ATOM 3168 CB SER C 88 29.457 2.517 13.384 1.00 15.29 C ATOM 3169 OG SER C 88 28.049 2.516 13.550 1.00 21.47 O ATOM 3170 HG SER C 88 27.792 1.792 14.174 1.00 0.00 H ATOM 3171 H SER C 88 29.026 3.766 16.253 1.00 0.00 H ATOM 3172 N LEU C 89 32.356 3.274 15.592 1.00 11.12 N ATOM 3173 CA LEU C 89 33.770 3.589 15.507 1.00 12.52 C ATOM 3174 C LEU C 89 34.579 2.348 15.143 1.00 10.26 C ATOM 3175 O LEU C 89 34.257 1.233 15.565 1.00 13.19 O ATOM 3176 CB LEU C 89 34.245 4.186 16.834 1.00 13.00 C ATOM 3177 CG LEU C 89 33.944 5.680 16.892 1.00 11.36 C ATOM 3178 CD1 LEU C 89 33.920 6.179 18.328 1.00 11.25 C ATOM 3179 CD2 LEU C 89 34.974 6.426 16.080 1.00 10.73 C ATOM 3180 H LEU C 89 31.869 3.348 16.508 1.00 0.00 H ATOM 3181 N LYS C 90 35.601 2.545 14.309 1.00 11.75 N ATOM 3182 CA LYS C 90 36.498 1.496 13.841 1.00 14.76 C ATOM 3183 C LYS C 90 37.926 1.790 14.282 1.00 14.46 C ATOM 3184 O LYS C 90 38.284 2.952 14.473 1.00 12.90 O ATOM 3185 CB LYS C 90 36.460 1.377 12.313 1.00 15.72 C ATOM 3186 CG LYS C 90 35.095 1.011 11.732 1.00 16.63 C ATOM 3187 CD LYS C 90 35.105 1.185 10.220 1.00 22.60 C ATOM 3188 CE LYS C 90 33.742 0.886 9.622 1.00 26.16 C ATOM 3189 NZ LYS C 90 33.750 0.972 8.139 1.00 31.45 N ATOM 3190 HZ1 LYS C 90 34.027 1.932 7.850 1.00 0.00 H ATOM 3191 HZ2 LYS C 90 34.430 0.284 7.757 1.00 0.00 H ATOM 3192 HZ3 LYS C 90 32.799 0.760 7.776 1.00 0.00 H ATOM 3193 H LYS C 90 35.769 3.513 13.969 1.00 0.00 H ATOM 3194 N PRO C 91 38.777 0.764 14.434 1.00 15.00 N ATOM 3195 CA PRO C 91 40.159 1.046 14.853 1.00 14.68 C ATOM 3196 C PRO C 91 40.867 2.032 13.944 1.00 13.04 C ATOM 3197 O PRO C 91 41.644 2.860 14.432 1.00 14.27 O ATOM 3198 CB PRO C 91 40.823 -0.338 14.822 1.00 15.40 C ATOM 3199 CG PRO C 91 39.696 -1.288 15.052 1.00 15.28 C ATOM 3200 CD PRO C 91 38.503 -0.680 14.357 1.00 18.04 C ATOM 3201 N GLU C 92 40.597 1.991 12.632 1.00 13.87 N ATOM 3202 CA GLU C 92 41.221 2.919 11.692 1.00 14.82 C ATOM 3203 C GLU C 92 40.752 4.358 11.871 1.00 16.24 C ATOM 3204 O GLU C 92 41.332 5.260 11.255 1.00 15.82 O ATOM 3205 CB GLU C 92 40.969 2.471 10.249 1.00 18.02 C ATOM 3206 CG GLU C 92 39.524 2.155 9.912 1.00 21.05 C ATOM 3207 CD GLU C 92 39.168 0.693 10.114 1.00 22.57 C ATOM 3208 OE1 GLU C 92 39.658 0.074 11.085 1.00 23.75 O ATOM 3209 OE2 GLU C 92 38.390 0.162 9.293 1.00 32.13 O ATOM 3210 H GLU C 92 39.927 1.281 12.274 1.00 0.00 H ATOM 3211 N ASP C 93 39.730 4.604 12.696 1.00 14.23 N ATOM 3212 CA ASP C 93 39.399 5.977 13.056 1.00 12.65 C ATOM 3213 C ASP C 93 40.313 6.545 14.132 1.00 9.81 C ATOM 3214 O ASP C 93 40.176 7.722 14.469 1.00 13.69 O ATOM 3215 CB ASP C 93 37.948 6.080 13.543 1.00 10.98 C ATOM 3216 CG ASP C 93 36.935 5.609 12.509 1.00 15.03 C ATOM 3217 OD1 ASP C 93 37.011 6.031 11.334 1.00 14.79 O ATOM 3218 OD2 ASP C 93 36.046 4.818 12.888 1.00 14.66 O ATOM 3219 H ASP C 93 39.171 3.816 13.081 1.00 0.00 H ATOM 3220 N THR C 94 41.189 5.731 14.720 1.00 10.13 N ATOM 3221 CA THR C 94 42.150 6.232 15.697 1.00 13.70 C ATOM 3222 C THR C 94 43.004 7.345 15.095 1.00 14.96 C ATOM 3223 O THR C 94 43.446 7.259 13.944 1.00 13.94 O ATOM 3224 CB THR C 94 43.037 5.070 16.173 1.00 13.47 C ATOM 3225 OG1 THR C 94 42.229 4.094 16.839 1.00 14.46 O ATOM 3226 CG2 THR C 94 44.143 5.553 17.110 1.00 15.76 C ATOM 3227 HG1 THR C 94 41.544 3.751 16.212 1.00 0.00 H ATOM 3228 H THR C 94 41.188 4.720 14.478 1.00 0.00 H ATOM 3229 N GLY C 95 43.216 8.409 15.865 1.00 11.72 N ATOM 3230 CA GLY C 95 44.050 9.506 15.411 1.00 12.11 C ATOM 3231 C GLY C 95 43.865 10.725 16.281 1.00 12.50 C ATOM 3232 O GLY C 95 43.002 10.768 17.162 1.00 12.48 O ATOM 3233 H GLY C 95 42.777 8.455 16.807 1.00 0.00 H ATOM 3234 N MET C 96 44.710 11.724 16.023 1.00 14.69 N ATOM 3235 CA MET C 96 44.572 13.034 16.642 1.00 15.07 C ATOM 3236 C MET C 96 43.624 13.880 15.801 1.00 13.96 C ATOM 3237 O MET C 96 43.904 14.169 14.629 1.00 13.60 O ATOM 3238 CB MET C 96 45.922 13.732 16.785 1.00 14.34 C ATOM 3239 CG MET C 96 45.827 15.121 17.393 1.00 17.31 C ATOM 3240 SD MET C 96 45.400 15.096 19.152 1.00 18.99 S ATOM 3241 CE MET C 96 46.684 14.006 19.764 1.00 17.91 C ATOM 3242 H MET C 96 45.493 11.562 15.358 1.00 0.00 H ATOM 3243 N TYR C 97 42.501 14.265 16.390 1.00 10.54 N ATOM 3244 CA TYR C 97 41.471 15.002 15.674 1.00 9.07 C ATOM 3245 C TYR C 97 41.651 16.481 15.967 1.00 12.12 C ATOM 3246 O TYR C 97 41.618 16.901 17.126 1.00 15.21 O ATOM 3247 CB TYR C 97 40.074 14.518 16.056 1.00 10.49 C ATOM 3248 CG TYR C 97 39.696 13.225 15.387 1.00 9.24 C ATOM 3249 CD1 TYR C 97 40.301 12.027 15.752 1.00 11.62 C ATOM 3250 CD2 TYR C 97 38.733 13.192 14.385 1.00 12.14 C ATOM 3251 CE1 TYR C 97 39.961 10.846 15.134 1.00 11.84 C ATOM 3252 CE2 TYR C 97 38.387 12.008 13.763 1.00 12.03 C ATOM 3253 CZ TYR C 97 39.003 10.834 14.140 1.00 12.73 C ATOM 3254 OH TYR C 97 38.655 9.639 13.543 1.00 11.67 O ATOM 3255 HH TYR C 97 39.194 8.907 13.934 1.00 0.00 H ATOM 3256 H TYR C 97 42.352 14.034 17.393 1.00 0.00 H ATOM 3257 N ARG C 98 41.876 17.251 14.917 1.00 10.46 N ATOM 3258 CA ARG C 98 42.156 18.667 15.019 1.00 11.82 C ATOM 3259 C ARG C 98 41.117 19.423 14.224 1.00 12.27 C ATOM 3260 O ARG C 98 40.737 19.016 13.121 1.00 13.00 O ATOM 3261 CB ARG C 98 43.546 18.999 14.490 1.00 14.39 C ATOM 3262 CG ARG C 98 44.651 18.211 15.164 1.00 15.88 C ATOM 3263 CD ARG C 98 46.011 18.473 14.540 1.00 21.74 C ATOM 3264 NE ARG C 98 47.008 17.505 14.997 1.00 30.19 N ATOM 3265 CZ ARG C 98 47.759 16.754 14.195 1.00 32.00 C ATOM 3266 NH1 ARG C 98 47.648 16.857 12.873 1.00 27.43 N ATOM 3267 NH2 ARG C 98 48.633 15.901 14.718 1.00 29.95 N ATOM 3268 HE ARG C 98 47.139 17.396 16.023 1.00 0.00 H ATOM 3269 HH12 ARG C 98 48.239 16.266 12.254 1.00 0.00 H ATOM 3270 HH11 ARG C 98 46.970 17.528 12.459 1.00 0.00 H ATOM 3271 HH22 ARG C 98 49.222 15.312 14.095 1.00 0.00 H ATOM 3272 HH21 ARG C 98 48.728 15.822 15.751 1.00 0.00 H ATOM 3273 H ARG C 98 41.851 16.818 13.972 1.00 0.00 H ATOM 3274 N CYS C 99 40.647 20.508 14.797 1.00 10.53 N ATOM 3275 CA CYS C 99 39.698 21.365 14.130 1.00 9.29 C ATOM 3276 C CYS C 99 40.438 22.526 13.482 1.00 10.19 C ATOM 3277 O CYS C 99 41.443 23.011 14.011 1.00 10.43 O ATOM 3278 CB CYS C 99 38.657 21.837 15.147 1.00 10.06 C ATOM 3279 SG CYS C 99 37.457 23.000 14.573 1.00 13.26 S ATOM 3280 H CYS C 99 40.967 20.755 15.755 1.00 0.00 H ATOM 3281 N ALA C 100 39.953 22.955 12.321 1.00 9.23 N ATOM 3282 CA ALA C 100 40.599 24.010 11.557 1.00 11.01 C ATOM 3283 C ALA C 100 39.535 24.928 10.978 1.00 9.26 C ATOM 3284 O ALA C 100 38.386 24.523 10.782 1.00 9.08 O ATOM 3285 CB ALA C 100 41.475 23.427 10.437 1.00 8.21 C ATOM 3286 H ALA C 100 39.084 22.522 11.947 1.00 0.00 H ATOM 3287 N SER C 101 39.913 26.168 10.702 1.00 9.55 N ATOM 3288 CA SER C 101 38.971 27.087 10.099 1.00 8.98 C ATOM 3289 C SER C 101 39.710 27.997 9.125 1.00 9.85 C ATOM 3290 O SER C 101 40.925 28.209 9.226 1.00 11.68 O ATOM 3291 CB SER C 101 38.210 27.888 11.166 1.00 10.18 C ATOM 3292 OG SER C 101 39.013 28.889 11.785 1.00 11.28 O ATOM 3293 HG SER C 101 39.331 29.527 11.098 1.00 0.00 H ATOM 3294 H SER C 101 40.882 26.479 10.918 1.00 0.00 H ATOM 3295 N THR C 102 38.953 28.528 8.172 1.00 11.06 N ATOM 3296 CA THR C 102 39.476 29.483 7.205 1.00 10.30 C ATOM 3297 C THR C 102 38.311 30.176 6.522 1.00 14.83 C ATOM 3298 O THR C 102 37.245 29.581 6.334 1.00 11.19 O ATOM 3299 CB THR C 102 40.372 28.818 6.152 1.00 15.10 C ATOM 3300 OG1 THR C 102 40.829 29.819 5.236 1.00 17.26 O ATOM 3301 CG2 THR C 102 39.610 27.771 5.382 1.00 12.50 C ATOM 3302 HG1 THR C 102 41.344 30.506 5.729 1.00 0.00 H ATOM 3303 H THR C 102 37.952 28.252 8.114 1.00 0.00 H ATOM 3304 N ARG C 103 38.526 31.440 6.150 1.00 11.84 N ATOM 3305 CA ARG C 103 37.544 32.137 5.332 1.00 15.68 C ATOM 3306 C ARG C 103 37.487 31.565 3.923 1.00 13.63 C ATOM 3307 O ARG C 103 36.437 31.631 3.275 1.00 16.45 O ATOM 3308 CB ARG C 103 37.865 33.632 5.266 1.00 18.52 C ATOM 3309 CG ARG C 103 38.062 34.301 6.615 1.00 21.47 C ATOM 3310 CD ARG C 103 38.328 35.798 6.449 1.00 23.92 C ATOM 3311 NE ARG C 103 39.740 36.085 6.198 1.00 29.68 N ATOM 3312 CZ ARG C 103 40.179 37.123 5.489 1.00 31.24 C ATOM 3313 NH1 ARG C 103 39.318 37.980 4.957 1.00 35.26 N ATOM 3314 NH2 ARG C 103 41.479 37.304 5.308 1.00 32.71 N ATOM 3315 HE ARG C 103 40.447 35.436 6.599 1.00 0.00 H ATOM 3316 HH12 ARG C 103 39.665 38.790 4.404 1.00 0.00 H ATOM 3317 HH11 ARG C 103 38.296 37.842 5.093 1.00 0.00 H ATOM 3318 HH22 ARG C 103 41.819 38.116 4.754 1.00 0.00 H ATOM 3319 HH21 ARG C 103 42.160 36.634 5.720 1.00 0.00 H ATOM 3320 H ARG C 103 39.396 31.927 6.445 1.00 0.00 H ATOM 3321 N PHE C 104 38.589 30.986 3.450 1.00 13.71 N ATOM 3322 CA PHE C 104 38.787 30.695 2.035 1.00 15.82 C ATOM 3323 C PHE C 104 39.443 29.337 1.860 1.00 17.01 C ATOM 3324 O PHE C 104 40.500 29.072 2.442 1.00 17.45 O ATOM 3325 CB PHE C 104 39.665 31.762 1.366 1.00 15.18 C ATOM 3326 CG PHE C 104 39.151 33.161 1.523 1.00 15.94 C ATOM 3327 CD1 PHE C 104 37.944 33.531 0.960 1.00 15.84 C ATOM 3328 CD2 PHE C 104 39.888 34.111 2.216 1.00 18.75 C ATOM 3329 CE1 PHE C 104 37.460 34.827 1.097 1.00 18.65 C ATOM 3330 CE2 PHE C 104 39.411 35.402 2.355 1.00 19.11 C ATOM 3331 CZ PHE C 104 38.200 35.760 1.795 1.00 18.99 C ATOM 3332 H PHE C 104 39.342 30.730 4.120 1.00 0.00 H ATOM 3333 N ALA C 105 38.832 28.497 1.029 1.00 14.03 N ATOM 3334 CA ALA C 105 39.420 27.219 0.654 1.00 12.22 C ATOM 3335 C ALA C 105 38.806 26.780 -0.665 1.00 10.03 C ATOM 3336 O ALA C 105 37.577 26.782 -0.810 1.00 14.62 O ATOM 3337 CB ALA C 105 39.197 26.153 1.737 1.00 13.21 C ATOM 3338 H ALA C 105 37.906 28.761 0.635 1.00 0.00 H ATOM 3339 N GLY C 106 39.664 26.399 -1.613 1.00 12.03 N ATOM 3340 CA GLY C 106 39.168 25.897 -2.884 1.00 12.60 C ATOM 3341 C GLY C 106 38.472 24.555 -2.754 1.00 12.18 C ATOM 3342 O GLY C 106 37.440 24.317 -3.387 1.00 14.72 O ATOM 3343 H GLY C 106 40.688 26.461 -1.443 1.00 0.00 H ATOM 3344 N ARG C 107 39.019 23.661 -1.929 1.00 12.29 N ATOM 3345 CA ARG C 107 38.375 22.391 -1.627 1.00 10.71 C ATOM 3346 C ARG C 107 38.399 22.175 -0.120 1.00 12.76 C ATOM 3347 O ARG C 107 39.379 22.516 0.546 1.00 12.99 O ATOM 3348 CB ARG C 107 39.056 21.232 -2.372 1.00 13.99 C ATOM 3349 CG ARG C 107 39.155 21.484 -3.881 1.00 19.19 C ATOM 3350 CD ARG C 107 39.214 20.215 -4.706 1.00 24.18 C ATOM 3351 NE ARG C 107 37.941 19.505 -4.698 1.00 19.37 N ATOM 3352 CZ ARG C 107 37.667 18.454 -5.460 1.00 21.45 C ATOM 3353 NH1 ARG C 107 36.481 17.864 -5.382 1.00 25.95 N ATOM 3354 NH2 ARG C 107 38.575 18.004 -6.311 1.00 23.61 N ATOM 3355 HE ARG C 107 37.199 19.844 -4.053 1.00 0.00 H ATOM 3356 HH12 ARG C 107 36.270 17.040 -5.981 1.00 0.00 H ATOM 3357 HH11 ARG C 107 35.763 18.225 -4.722 1.00 0.00 H ATOM 3358 HH22 ARG C 107 38.363 17.180 -6.910 1.00 0.00 H ATOM 3359 HH21 ARG C 107 39.500 18.474 -6.381 1.00 0.00 H ATOM 3360 H ARG C 107 39.935 23.878 -1.487 1.00 0.00 H ATOM 3361 N TRP C 108 37.299 21.630 0.418 1.00 11.83 N ATOM 3362 CA TRP C 108 37.121 21.622 1.869 1.00 7.67 C ATOM 3363 C TRP C 108 38.171 20.785 2.580 1.00 9.25 C ATOM 3364 O TRP C 108 38.478 21.055 3.746 1.00 8.01 O ATOM 3365 CB TRP C 108 35.733 21.105 2.247 1.00 10.08 C ATOM 3366 CG TRP C 108 35.535 19.632 2.026 1.00 9.09 C ATOM 3367 CD1 TRP C 108 35.011 19.045 0.915 1.00 10.31 C ATOM 3368 CD2 TRP C 108 35.810 18.556 2.951 1.00 8.67 C ATOM 3369 NE1 TRP C 108 34.957 17.686 1.073 1.00 12.10 N ATOM 3370 CE2 TRP C 108 35.432 17.357 2.312 1.00 9.10 C ATOM 3371 CE3 TRP C 108 36.350 18.495 4.240 1.00 7.46 C ATOM 3372 CZ2 TRP C 108 35.572 16.105 2.916 1.00 8.44 C ATOM 3373 CZ3 TRP C 108 36.484 17.242 4.845 1.00 7.46 C ATOM 3374 CH2 TRP C 108 36.098 16.073 4.183 1.00 9.96 C ATOM 3375 HE1 TRP C 108 34.609 17.011 0.363 1.00 0.00 H ATOM 3376 H TRP C 108 36.572 21.213 -0.197 1.00 0.00 H ATOM 3377 N TYR C 109 38.734 19.788 1.907 1.00 10.93 N ATOM 3378 CA TYR C 109 39.568 18.784 2.548 1.00 9.12 C ATOM 3379 C TYR C 109 41.054 19.093 2.434 1.00 12.22 C ATOM 3380 O TYR C 109 41.878 18.294 2.895 1.00 13.73 O ATOM 3381 CB TYR C 109 39.255 17.403 1.959 1.00 9.65 C ATOM 3382 CG TYR C 109 39.372 17.317 0.460 1.00 12.11 C ATOM 3383 CD1 TYR C 109 40.605 17.152 -0.135 1.00 13.18 C ATOM 3384 CD2 TYR C 109 38.244 17.385 -0.354 1.00 11.17 C ATOM 3385 CE1 TYR C 109 40.726 17.076 -1.509 1.00 13.31 C ATOM 3386 CE2 TYR C 109 38.353 17.304 -1.726 1.00 15.93 C ATOM 3387 CZ TYR C 109 39.596 17.148 -2.292 1.00 14.89 C ATOM 3388 OH TYR C 109 39.734 17.064 -3.659 1.00 22.54 O ATOM 3389 HH TYR C 109 40.691 16.955 -3.887 1.00 0.00 H ATOM 3390 H TYR C 109 38.572 19.723 0.882 1.00 0.00 H ATOM 3391 N ARG C 110 41.409 20.237 1.853 1.00 12.92 N ATOM 3392 CA ARG C 110 42.808 20.600 1.627 1.00 16.14 C ATOM 3393 C ARG C 110 43.300 21.353 2.853 1.00 13.18 C ATOM 3394 O ARG C 110 43.092 22.561 2.974 1.00 15.63 O ATOM 3395 CB ARG C 110 42.955 21.435 0.361 1.00 20.62 C ATOM 3396 CG ARG C 110 42.306 20.789 -0.848 1.00 20.41 C ATOM 3397 CD ARG C 110 42.926 21.257 -2.156 1.00 24.74 C ATOM 3398 NE ARG C 110 42.293 22.459 -2.687 1.00 28.21 N ATOM 3399 CZ ARG C 110 42.337 22.811 -3.968 1.00 25.73 C ATOM 3400 NH1 ARG C 110 42.977 22.041 -4.839 1.00 32.33 N ATOM 3401 NH2 ARG C 110 41.738 23.921 -4.378 1.00 25.33 N ATOM 3402 HE ARG C 110 41.778 23.075 -2.026 1.00 0.00 H ATOM 3403 HH12 ARG C 110 43.015 22.311 -5.843 1.00 0.00 H ATOM 3404 HH11 ARG C 110 43.441 21.167 -4.518 1.00 0.00 H ATOM 3405 HH22 ARG C 110 41.775 24.192 -5.381 1.00 0.00 H ATOM 3406 HH21 ARG C 110 41.231 24.521 -3.696 1.00 0.00 H ATOM 3407 H ARG C 110 40.665 20.897 1.549 1.00 0.00 H ATOM 3408 N ASP C 111 43.987 20.629 3.742 1.00 16.98 N ATOM 3409 CA ASP C 111 44.440 21.208 5.003 1.00 16.68 C ATOM 3410 C ASP C 111 45.382 22.386 4.793 1.00 14.71 C ATOM 3411 O ASP C 111 45.427 23.295 5.632 1.00 14.74 O ATOM 3412 CB ASP C 111 45.119 20.136 5.854 1.00 19.55 C ATOM 3413 CG ASP C 111 46.361 19.568 5.197 1.00 27.10 C ATOM 3414 OD1 ASP C 111 46.385 19.466 3.950 1.00 30.69 O ATOM 3415 OD2 ASP C 111 47.318 19.235 5.924 1.00 28.02 O ATOM 3416 H ASP C 111 44.203 19.634 3.531 1.00 0.00 H ATOM 3417 N SER C 112 46.122 22.408 3.678 1.00 16.30 N ATOM 3418 CA SER C 112 47.050 23.505 3.431 1.00 13.75 C ATOM 3419 C SER C 112 46.351 24.854 3.283 1.00 16.84 C ATOM 3420 O SER C 112 46.996 25.895 3.441 1.00 22.28 O ATOM 3421 CB SER C 112 47.901 23.201 2.189 1.00 23.27 C ATOM 3422 OG SER C 112 47.153 22.481 1.220 1.00 27.20 O ATOM 3423 HG SER C 112 47.724 22.299 0.432 1.00 0.00 H ATOM 3424 H SER C 112 46.035 21.638 2.984 1.00 0.00 H ATOM 3425 N GLU C 113 45.046 24.870 3.021 1.00 14.41 N ATOM 3426 CA GLU C 113 44.319 26.119 2.847 1.00 17.56 C ATOM 3427 C GLU C 113 43.775 26.687 4.154 1.00 14.26 C ATOM 3428 O GLU C 113 43.344 27.841 4.175 1.00 19.41 O ATOM 3429 CB GLU C 113 43.168 25.916 1.855 1.00 19.37 C ATOM 3430 CG GLU C 113 43.632 25.435 0.480 1.00 19.34 C ATOM 3431 CD GLU C 113 42.582 25.591 -0.598 1.00 22.18 C ATOM 3432 OE1 GLU C 113 41.977 24.558 -0.984 1.00 22.94 O ATOM 3433 OE2 GLU C 113 42.365 26.736 -1.063 1.00 21.52 O ATOM 3434 H GLU C 113 44.534 23.969 2.939 1.00 0.00 H ATOM 3435 N TYR C 114 43.802 25.918 5.236 1.00 14.46 N ATOM 3436 CA TYR C 114 43.230 26.364 6.500 1.00 14.52 C ATOM 3437 C TYR C 114 44.210 27.233 7.283 1.00 15.15 C ATOM 3438 O TYR C 114 45.416 26.968 7.311 1.00 25.28 O ATOM 3439 CB TYR C 114 42.796 25.152 7.319 1.00 12.46 C ATOM 3440 CG TYR C 114 41.491 24.567 6.794 1.00 11.78 C ATOM 3441 CD1 TYR C 114 41.449 23.855 5.605 1.00 9.18 C ATOM 3442 CD2 TYR C 114 40.298 24.768 7.470 1.00 9.39 C ATOM 3443 CE1 TYR C 114 40.252 23.334 5.115 1.00 11.28 C ATOM 3444 CE2 TYR C 114 39.093 24.242 6.998 1.00 10.01 C ATOM 3445 CZ TYR C 114 39.076 23.540 5.825 1.00 8.75 C ATOM 3446 OH TYR C 114 37.868 23.026 5.382 1.00 9.15 O ATOM 3447 HH TYR C 114 38.008 22.546 4.527 1.00 0.00 H ATOM 3448 H TYR C 114 44.241 24.977 5.180 1.00 0.00 H ATOM 3449 N ARG C 115 43.671 28.269 7.928 1.00 17.58 N ATOM 3450 CA ARG C 115 44.453 29.352 8.515 1.00 19.31 C ATOM 3451 C ARG C 115 44.504 29.334 10.034 1.00 23.16 C ATOM 3452 O ARG C 115 45.410 29.942 10.606 1.00 23.86 O ATOM 3453 CB ARG C 115 43.900 30.711 8.066 1.00 22.86 C ATOM 3454 H ARG C 115 42.636 28.307 8.017 1.00 0.00 H ATOM 3455 N ALA C 116 43.549 28.689 10.700 1.00 16.08 N ATOM 3456 CA ALA C 116 43.576 28.537 12.147 1.00 15.00 C ATOM 3457 C ALA C 116 43.437 27.068 12.513 1.00 12.50 C ATOM 3458 O ALA C 116 42.626 26.348 11.926 1.00 12.35 O ATOM 3459 CB ALA C 116 42.467 29.340 12.808 1.00 13.26 C ATOM 3460 H ALA C 116 42.755 28.279 10.167 1.00 0.00 H ATOM 3461 N TRP C 117 44.207 26.635 13.500 1.00 12.60 N ATOM 3462 CA TRP C 117 44.264 25.239 13.905 1.00 10.24 C ATOM 3463 C TRP C 117 44.205 25.139 15.418 1.00 13.07 C ATOM 3464 O TRP C 117 44.857 25.916 16.122 1.00 13.83 O ATOM 3465 CB TRP C 117 45.555 24.564 13.420 1.00 12.72 C ATOM 3466 CG TRP C 117 45.549 24.290 11.953 1.00 11.53 C ATOM 3467 CD1 TRP C 117 45.913 25.151 10.959 1.00 15.66 C ATOM 3468 CD2 TRP C 117 45.112 23.090 11.303 1.00 9.10 C ATOM 3469 NE1 TRP C 117 45.756 24.554 9.731 1.00 14.46 N ATOM 3470 CE2 TRP C 117 45.263 23.290 9.914 1.00 11.98 C ATOM 3471 CE3 TRP C 117 44.609 21.868 11.758 1.00 12.44 C ATOM 3472 CZ2 TRP C 117 44.932 22.312 8.977 1.00 13.36 C ATOM 3473 CZ3 TRP C 117 44.288 20.894 10.822 1.00 13.48 C ATOM 3474 CH2 TRP C 117 44.440 21.130 9.445 1.00 12.78 C ATOM 3475 HE1 TRP C 117 45.976 24.991 8.813 1.00 0.00 H ATOM 3476 H TRP C 117 44.797 27.324 14.008 1.00 0.00 H ATOM 3477 N GLY C 118 43.425 24.181 15.909 1.00 12.31 N ATOM 3478 CA GLY C 118 43.520 23.784 17.297 1.00 13.29 C ATOM 3479 C GLY C 118 44.629 22.765 17.485 1.00 16.15 C ATOM 3480 O GLY C 118 45.172 22.213 16.529 1.00 16.24 O ATOM 3481 H GLY C 118 42.737 23.710 15.287 1.00 0.00 H ATOM 3482 N GLN C 119 44.958 22.497 18.748 1.00 17.08 N ATOM 3483 CA GLN C 119 46.015 21.528 19.023 1.00 16.76 C ATOM 3484 C GLN C 119 45.549 20.085 18.872 1.00 17.84 C ATOM 3485 O GLN C 119 46.369 19.208 18.575 1.00 19.58 O ATOM 3486 CB GLN C 119 46.598 21.757 20.420 1.00 20.94 C ATOM 3487 CG GLN C 119 47.537 22.945 20.477 1.00 28.32 C ATOM 3488 CD GLN C 119 48.645 22.847 19.436 1.00 29.43 C ATOM 3489 OE1 GLN C 119 49.614 22.104 19.611 1.00 35.69 O ATOM 3490 NE2 GLN C 119 48.498 23.586 18.341 1.00 31.51 N ATOM 3491 HE22 GLN C 119 47.664 24.199 18.235 1.00 0.00 H ATOM 3492 HE21 GLN C 119 49.217 23.551 17.590 1.00 0.00 H ATOM 3493 H GLN C 119 44.466 22.974 19.531 1.00 0.00 H ATOM 3494 N GLY C 120 44.268 19.813 19.053 1.00 14.94 N ATOM 3495 CA GLY C 120 43.766 18.488 18.773 1.00 12.91 C ATOM 3496 C GLY C 120 43.301 17.767 20.029 1.00 15.59 C ATOM 3497 O GLY C 120 43.637 18.128 21.162 1.00 17.62 O ATOM 3498 H GLY C 120 43.622 20.552 19.397 1.00 0.00 H ATOM 3499 N THR C 121 42.496 16.733 19.807 1.00 11.37 N ATOM 3500 CA THR C 121 42.068 15.825 20.858 1.00 11.92 C ATOM 3501 C THR C 121 42.196 14.403 20.323 1.00 10.98 C ATOM 3502 O THR C 121 41.812 14.125 19.182 1.00 12.24 O ATOM 3503 CB THR C 121 40.631 16.167 21.324 1.00 12.71 C ATOM 3504 OG1 THR C 121 40.292 15.439 22.515 1.00 13.29 O ATOM 3505 CG2 THR C 121 39.586 15.911 20.250 1.00 10.30 C ATOM 3506 HG1 THR C 121 40.926 15.676 23.237 1.00 0.00 H ATOM 3507 H THR C 121 42.157 16.566 18.838 1.00 0.00 H ATOM 3508 N GLN C 122 42.778 13.512 21.128 1.00 13.94 N ATOM 3509 CA GLN C 122 43.082 12.165 20.666 1.00 13.51 C ATOM 3510 C GLN C 122 41.871 11.252 20.785 1.00 10.89 C ATOM 3511 O GLN C 122 41.152 11.267 21.788 1.00 13.91 O ATOM 3512 CB GLN C 122 44.256 11.580 21.459 1.00 15.03 C ATOM 3513 CG GLN C 122 44.578 10.122 21.195 1.00 15.61 C ATOM 3514 CD GLN C 122 45.233 9.888 19.841 1.00 14.24 C ATOM 3515 OE1 GLN C 122 45.926 10.759 19.317 1.00 20.20 O ATOM 3516 NE2 GLN C 122 45.011 8.710 19.276 1.00 16.51 N ATOM 3517 HE22 GLN C 122 44.417 8.005 19.759 1.00 0.00 H ATOM 3518 HE21 GLN C 122 45.430 8.490 18.350 1.00 0.00 H ATOM 3519 H GLN C 122 43.019 13.784 22.102 1.00 0.00 H ATOM 3520 N VAL C 123 41.636 10.468 19.738 1.00 10.80 N ATOM 3521 CA VAL C 123 40.607 9.442 19.731 1.00 11.50 C ATOM 3522 C VAL C 123 41.315 8.124 19.479 1.00 13.41 C ATOM 3523 O VAL C 123 41.988 7.960 18.455 1.00 13.07 O ATOM 3524 CB VAL C 123 39.533 9.694 18.656 1.00 11.82 C ATOM 3525 CG1 VAL C 123 38.601 8.492 18.542 1.00 11.15 C ATOM 3526 CG2 VAL C 123 38.747 10.972 18.950 1.00 12.92 C ATOM 3527 H VAL C 123 42.216 10.595 18.884 1.00 0.00 H ATOM 3528 N THR C 124 41.187 7.192 20.411 1.00 11.63 N ATOM 3529 CA THR C 124 41.768 5.870 20.234 1.00 13.08 C ATOM 3530 C THR C 124 40.648 4.844 20.240 1.00 16.58 C ATOM 3531 O THR C 124 39.844 4.805 21.175 1.00 16.54 O ATOM 3532 CB THR C 124 42.801 5.576 21.320 1.00 15.84 C ATOM 3533 OG1 THR C 124 43.807 6.592 21.275 1.00 18.13 O ATOM 3534 CG2 THR C 124 43.469 4.239 21.057 1.00 17.32 C ATOM 3535 HG1 THR C 124 44.485 6.415 21.974 1.00 0.00 H ATOM 3536 H THR C 124 40.663 7.408 21.283 1.00 0.00 H ATOM 3537 N VAL C 125 40.585 4.038 19.185 1.00 11.71 N ATOM 3538 CA VAL C 125 39.586 2.990 19.044 1.00 12.45 C ATOM 3539 C VAL C 125 40.304 1.649 19.105 1.00 18.18 C ATOM 3540 O VAL C 125 41.195 1.372 18.289 1.00 17.67 O ATOM 3541 CB VAL C 125 38.793 3.135 17.738 1.00 13.91 C ATOM 3542 CG1 VAL C 125 37.639 2.164 17.719 1.00 15.92 C ATOM 3543 CG2 VAL C 125 38.305 4.574 17.577 1.00 13.13 C ATOM 3544 H VAL C 125 41.283 4.162 18.424 1.00 0.00 H ATOM 3545 N SER C 126 39.926 0.831 20.079 1.00 18.58 N ATOM 3546 CA SER C 126 40.538 -0.479 20.267 1.00 16.25 C ATOM 3547 C SER C 126 39.676 -1.597 19.693 1.00 21.84 C ATOM 3548 O SER C 126 38.448 -1.542 19.736 1.00 25.53 O ATOM 3549 CB SER C 126 40.795 -0.726 21.749 1.00 22.61 C ATOM 3550 OG SER C 126 39.573 -0.705 22.460 1.00 26.12 O ATOM 3551 HG SER C 126 38.976 -1.413 22.109 1.00 0.00 H ATOM 3552 H SER C 126 39.171 1.133 20.727 1.00 0.00 H TER 3553 SER C 126 ATOM 3554 N GLN D 1 30.255 32.553 32.137 1.00 34.31 N ATOM 3555 CA GLN D 1 31.528 33.225 31.917 1.00 35.45 C ATOM 3556 C GLN D 1 32.640 32.196 31.753 1.00 29.51 C ATOM 3557 O GLN D 1 33.377 32.214 30.771 1.00 31.79 O ATOM 3558 CB GLN D 1 31.846 34.181 33.074 1.00 37.68 C ATOM 3559 CG GLN D 1 31.322 33.718 34.434 1.00 36.89 C ATOM 3560 CD GLN D 1 32.047 34.371 35.603 1.00 41.28 C ATOM 3561 OE1 GLN D 1 33.118 34.959 35.439 1.00 38.46 O ATOM 3562 NE2 GLN D 1 31.463 34.266 36.793 1.00 43.47 N ATOM 3563 HE22 GLN D 1 30.559 33.761 36.886 1.00 0.00 H ATOM 3564 HE21 GLN D 1 31.910 34.689 37.631 1.00 0.00 H ATOM 3565 HN3 GLN D 1 30.315 31.973 32.998 1.00 0.00 H ATOM 3566 HN2 GLN D 1 30.040 31.944 31.322 1.00 0.00 H ATOM 3567 HN1 GLN D 1 29.504 33.264 32.248 1.00 0.00 H ATOM 3568 N VAL D 2 32.742 31.291 32.722 1.00 29.82 N ATOM 3569 CA VAL D 2 33.774 30.262 32.729 1.00 24.34 C ATOM 3570 C VAL D 2 33.264 29.039 31.982 1.00 23.05 C ATOM 3571 O VAL D 2 32.150 28.563 32.236 1.00 24.86 O ATOM 3572 CB VAL D 2 34.173 29.895 34.168 1.00 23.75 C ATOM 3573 CG1 VAL D 2 35.147 28.719 34.164 1.00 20.75 C ATOM 3574 CG2 VAL D 2 34.788 31.093 34.867 1.00 25.80 C ATOM 3575 H VAL D 2 32.059 31.319 33.505 1.00 0.00 H ATOM 3576 N GLN D 3 34.079 28.526 31.062 1.00 21.18 N ATOM 3577 CA GLN D 3 33.797 27.274 30.376 1.00 22.78 C ATOM 3578 C GLN D 3 34.903 26.273 30.671 1.00 18.69 C ATOM 3579 O GLN D 3 36.091 26.614 30.641 1.00 18.68 O ATOM 3580 CB GLN D 3 33.665 27.470 28.860 1.00 22.81 C ATOM 3581 CG GLN D 3 33.444 26.162 28.108 1.00 27.19 C ATOM 3582 CD GLN D 3 33.019 26.362 26.667 1.00 26.36 C ATOM 3583 OE1 GLN D 3 33.001 27.486 26.158 1.00 31.07 O ATOM 3584 NE2 GLN D 3 32.664 25.267 26.002 1.00 26.16 N ATOM 3585 HE22 GLN D 3 32.695 24.340 26.472 1.00 0.00 H ATOM 3586 HE21 GLN D 3 32.355 25.337 25.011 1.00 0.00 H ATOM 3587 H GLN D 3 34.951 29.040 30.825 1.00 0.00 H ATOM 3588 N LEU D 4 34.497 25.035 30.940 1.00 16.97 N ATOM 3589 CA LEU D 4 35.397 23.925 31.227 1.00 17.40 C ATOM 3590 C LEU D 4 35.153 22.833 30.195 1.00 14.89 C ATOM 3591 O LEU D 4 34.018 22.368 30.039 1.00 17.29 O ATOM 3592 CB LEU D 4 35.169 23.399 32.644 1.00 12.76 C ATOM 3593 CG LEU D 4 35.427 24.386 33.784 1.00 17.25 C ATOM 3594 CD1 LEU D 4 34.912 23.822 35.111 1.00 18.08 C ATOM 3595 CD2 LEU D 4 36.900 24.705 33.890 1.00 16.53 C ATOM 3596 H LEU D 4 33.474 24.848 30.946 1.00 0.00 H ATOM 3597 N GLN D 5 36.217 22.422 29.506 1.00 14.65 N ATOM 3598 CA GLN D 5 36.169 21.451 28.411 1.00 15.63 C ATOM 3599 C GLN D 5 37.030 20.250 28.770 1.00 16.10 C ATOM 3600 O GLN D 5 38.252 20.382 28.858 1.00 15.27 O ATOM 3601 CB GLN D 5 36.712 22.055 27.113 1.00 19.07 C ATOM 3602 CG GLN D 5 35.795 22.926 26.288 1.00 21.66 C ATOM 3603 CD GLN D 5 36.502 23.417 25.024 1.00 21.40 C ATOM 3604 OE1 GLN D 5 36.401 22.802 23.952 1.00 20.76 O ATOM 3605 NE2 GLN D 5 37.247 24.512 25.153 1.00 23.18 N ATOM 3606 HE22 GLN D 5 37.304 24.997 26.071 1.00 0.00 H ATOM 3607 HE21 GLN D 5 37.773 24.883 24.336 1.00 0.00 H ATOM 3608 H GLN D 5 37.144 22.817 29.763 1.00 0.00 H ATOM 3609 N GLU D 6 36.423 19.075 28.902 1.00 12.63 N ATOM 3610 CA GLU D 6 37.186 17.894 29.294 1.00 15.83 C ATOM 3611 C GLU D 6 37.479 16.968 28.116 1.00 16.52 C ATOM 3612 O GLU D 6 36.789 16.980 27.096 1.00 16.34 O ATOM 3613 CB GLU D 6 36.446 17.130 30.386 1.00 16.12 C ATOM 3614 CG GLU D 6 36.075 18.033 31.541 1.00 15.88 C ATOM 3615 CD GLU D 6 34.993 17.457 32.377 1.00 24.69 C ATOM 3616 OE1 GLU D 6 34.275 18.244 33.013 1.00 20.28 O ATOM 3617 OE2 GLU D 6 34.878 16.218 32.394 1.00 27.18 O ATOM 3618 H GLU D 6 35.401 18.997 28.725 1.00 0.00 H ATOM 3619 N SER D 7 38.525 16.153 28.287 1.00 11.91 N ATOM 3620 CA SER D 7 38.954 15.145 27.319 1.00 16.04 C ATOM 3621 C SER D 7 39.740 14.067 28.049 1.00 11.05 C ATOM 3622 O SER D 7 40.182 14.256 29.185 1.00 13.29 O ATOM 3623 CB SER D 7 39.835 15.731 26.206 1.00 12.98 C ATOM 3624 OG SER D 7 39.443 17.038 25.838 1.00 19.34 O ATOM 3625 HG SER D 7 39.508 17.635 26.625 1.00 0.00 H ATOM 3626 H SER D 7 39.070 16.242 29.168 1.00 0.00 H ATOM 3627 N GLY D 8 39.919 12.931 27.387 1.00 10.99 N ATOM 3628 CA GLY D 8 40.929 11.978 27.809 1.00 14.36 C ATOM 3629 C GLY D 8 40.420 10.734 28.497 1.00 16.23 C ATOM 3630 O GLY D 8 41.232 9.840 28.795 1.00 18.35 O ATOM 3631 H GLY D 8 39.329 12.721 26.557 1.00 0.00 H ATOM 3632 N GLY D 9 39.127 10.634 28.762 1.00 16.65 N ATOM 3633 CA GLY D 9 38.584 9.458 29.405 1.00 18.68 C ATOM 3634 C GLY D 9 38.433 8.291 28.451 1.00 19.20 C ATOM 3635 O GLY D 9 39.080 8.209 27.404 1.00 17.45 O ATOM 3636 H GLY D 9 38.491 11.415 28.503 1.00 0.00 H ATOM 3637 N GLY D 10 37.577 7.356 28.843 1.00 19.73 N ATOM 3638 CA GLY D 10 37.199 6.282 27.960 1.00 18.88 C ATOM 3639 C GLY D 10 37.352 4.947 28.639 1.00 21.14 C ATOM 3640 O GLY D 10 37.316 4.841 29.870 1.00 23.19 O ATOM 3641 H GLY D 10 37.173 7.399 29.801 1.00 0.00 H ATOM 3642 N SER D 11 37.518 3.917 27.820 1.00 18.90 N ATOM 3643 CA SER D 11 37.587 2.547 28.301 1.00 20.49 C ATOM 3644 C SER D 11 39.040 2.134 28.480 1.00 23.71 C ATOM 3645 O SER D 11 39.919 2.556 27.722 1.00 26.90 O ATOM 3646 CB SER D 11 36.889 1.590 27.335 1.00 27.94 C ATOM 3647 OG SER D 11 35.508 1.885 27.251 1.00 32.35 O ATOM 3648 HG SER D 11 35.097 1.793 28.147 1.00 0.00 H ATOM 3649 H SER D 11 37.602 4.096 26.799 1.00 0.00 H ATOM 3650 N VAL D 12 39.279 1.308 29.495 1.00 21.93 N ATOM 3651 CA VAL D 12 40.606 0.794 29.795 1.00 23.97 C ATOM 3652 C VAL D 12 40.409 -0.405 30.706 1.00 23.30 C ATOM 3653 O VAL D 12 39.371 -0.539 31.359 1.00 26.10 O ATOM 3654 CB VAL D 12 41.488 1.895 30.442 1.00 23.63 C ATOM 3655 CG1 VAL D 12 40.839 2.401 31.709 1.00 23.52 C ATOM 3656 CG2 VAL D 12 42.891 1.400 30.719 1.00 23.86 C ATOM 3657 H VAL D 12 38.484 1.018 30.099 1.00 0.00 H ATOM 3658 N GLN D 13 41.386 -1.304 30.713 1.00 24.84 N ATOM 3659 CA GLN D 13 41.347 -2.438 31.617 1.00 25.80 C ATOM 3660 C GLN D 13 41.883 -2.044 32.989 1.00 27.63 C ATOM 3661 O GLN D 13 42.623 -1.068 33.140 1.00 24.04 O ATOM 3662 CB GLN D 13 42.160 -3.604 31.056 1.00 31.26 C ATOM 3663 CG GLN D 13 41.695 -4.091 29.691 1.00 35.71 C ATOM 3664 CD GLN D 13 42.837 -4.616 28.839 1.00 38.03 C ATOM 3665 OE1 GLN D 13 43.929 -4.890 29.342 1.00 41.38 O ATOM 3666 NE2 GLN D 13 42.590 -4.756 27.542 1.00 40.42 N ATOM 3667 HE22 GLN D 13 41.653 -4.512 27.162 1.00 0.00 H ATOM 3668 HE21 GLN D 13 43.333 -5.109 26.906 1.00 0.00 H ATOM 3669 H GLN D 13 42.190 -1.194 30.062 1.00 0.00 H ATOM 3670 N ALA D 14 41.492 -2.820 33.997 1.00 25.38 N ATOM 3671 CA ALA D 14 42.026 -2.630 35.337 1.00 25.37 C ATOM 3672 C ALA D 14 43.547 -2.740 35.319 1.00 27.28 C ATOM 3673 O ALA D 14 44.119 -3.589 34.628 1.00 23.07 O ATOM 3674 CB ALA D 14 41.427 -3.656 36.300 1.00 22.10 C ATOM 3675 H ALA D 14 40.795 -3.573 33.825 1.00 0.00 H ATOM 3676 N GLY D 15 44.199 -1.868 36.088 1.00 23.22 N ATOM 3677 CA GLY D 15 45.634 -1.710 36.044 1.00 25.70 C ATOM 3678 C GLY D 15 46.121 -0.755 34.980 1.00 22.34 C ATOM 3679 O GLY D 15 47.332 -0.519 34.887 1.00 22.09 O ATOM 3680 H GLY D 15 43.652 -1.277 36.747 1.00 0.00 H ATOM 3681 N GLY D 16 45.221 -0.202 34.172 1.00 23.06 N ATOM 3682 CA GLY D 16 45.609 0.661 33.082 1.00 22.02 C ATOM 3683 C GLY D 16 45.807 2.095 33.525 1.00 16.80 C ATOM 3684 O GLY D 16 45.697 2.439 34.702 1.00 20.73 O ATOM 3685 H GLY D 16 44.212 -0.396 34.330 1.00 0.00 H ATOM 3686 N SER D 17 46.111 2.938 32.541 1.00 17.91 N ATOM 3687 CA SER D 17 46.359 4.359 32.728 1.00 18.10 C ATOM 3688 C SER D 17 45.421 5.174 31.851 1.00 17.64 C ATOM 3689 O SER D 17 45.142 4.800 30.707 1.00 20.32 O ATOM 3690 CB SER D 17 47.814 4.728 32.374 1.00 18.15 C ATOM 3691 OG SER D 17 48.734 3.869 33.015 1.00 24.85 O ATOM 3692 HG SER D 17 48.621 3.939 33.996 1.00 0.00 H ATOM 3693 H SER D 17 46.175 2.556 31.576 1.00 0.00 H ATOM 3694 N LEU D 18 44.943 6.295 32.388 1.00 19.08 N ATOM 3695 CA LEU D 18 44.252 7.303 31.600 1.00 17.09 C ATOM 3696 C LEU D 18 44.719 8.673 32.049 1.00 16.42 C ATOM 3697 O LEU D 18 45.093 8.865 33.206 1.00 17.06 O ATOM 3698 CB LEU D 18 42.727 7.229 31.741 1.00 16.16 C ATOM 3699 CG LEU D 18 42.023 6.070 31.048 1.00 18.64 C ATOM 3700 CD1 LEU D 18 40.529 6.108 31.367 1.00 19.59 C ATOM 3701 CD2 LEU D 18 42.264 6.122 29.554 1.00 20.00 C ATOM 3702 H LEU D 18 45.068 6.455 33.408 1.00 0.00 H ATOM 3703 N ARG D 19 44.661 9.630 31.128 1.00 16.33 N ATOM 3704 CA ARG D 19 45.102 11.001 31.366 1.00 12.72 C ATOM 3705 C ARG D 19 43.963 11.947 31.005 1.00 14.51 C ATOM 3706 O ARG D 19 43.738 12.232 29.825 1.00 17.33 O ATOM 3707 CB ARG D 19 46.345 11.322 30.551 1.00 21.13 C ATOM 3708 CG ARG D 19 47.129 12.511 31.060 1.00 25.46 C ATOM 3709 CD ARG D 19 47.880 13.160 29.917 1.00 25.88 C ATOM 3710 NE ARG D 19 48.720 14.258 30.369 1.00 33.90 N ATOM 3711 CZ ARG D 19 49.011 15.320 29.628 1.00 31.20 C ATOM 3712 NH1 ARG D 19 49.783 16.275 30.125 1.00 31.78 N ATOM 3713 NH2 ARG D 19 48.518 15.433 28.401 1.00 31.54 N ATOM 3714 HE ARG D 19 49.116 14.208 31.329 1.00 0.00 H ATOM 3715 HH12 ARG D 19 50.014 17.109 29.549 1.00 0.00 H ATOM 3716 HH11 ARG D 19 50.158 16.190 31.091 1.00 0.00 H ATOM 3717 HH22 ARG D 19 48.748 16.266 27.823 1.00 0.00 H ATOM 3718 HH21 ARG D 19 47.902 14.688 28.018 1.00 0.00 H ATOM 3719 H ARG D 19 44.282 9.390 30.190 1.00 0.00 H ATOM 3720 N LEU D 20 43.247 12.439 32.012 1.00 11.63 N ATOM 3721 CA LEU D 20 42.186 13.404 31.761 1.00 10.65 C ATOM 3722 C LEU D 20 42.761 14.808 31.663 1.00 13.07 C ATOM 3723 O LEU D 20 43.787 15.138 32.271 1.00 13.14 O ATOM 3724 CB LEU D 20 41.121 13.359 32.860 1.00 12.62 C ATOM 3725 CG LEU D 20 40.571 12.013 33.330 1.00 15.03 C ATOM 3726 CD1 LEU D 20 39.436 12.258 34.314 1.00 12.54 C ATOM 3727 CD2 LEU D 20 40.105 11.163 32.167 1.00 16.51 C ATOM 3728 H LEU D 20 43.446 12.132 32.986 1.00 0.00 H ATOM 3729 N SER D 21 42.106 15.628 30.857 1.00 14.15 N ATOM 3730 CA SER D 21 42.478 17.016 30.687 1.00 12.17 C ATOM 3731 C SER D 21 41.228 17.867 30.782 1.00 12.94 C ATOM 3732 O SER D 21 40.122 17.422 30.463 1.00 16.50 O ATOM 3733 CB SER D 21 43.168 17.257 29.348 1.00 15.37 C ATOM 3734 OG SER D 21 44.294 16.413 29.227 1.00 27.22 O ATOM 3735 HG SER D 21 44.004 15.468 29.279 1.00 0.00 H ATOM 3736 H SER D 21 41.292 15.260 30.325 1.00 0.00 H ATOM 3737 N CYS D 22 41.411 19.098 31.229 1.00 11.89 N ATOM 3738 CA CYS D 22 40.324 20.059 31.201 1.00 12.32 C ATOM 3739 C CYS D 22 40.924 21.416 30.906 1.00 13.74 C ATOM 3740 O CYS D 22 41.847 21.845 31.604 1.00 15.72 O ATOM 3741 CB CYS D 22 39.553 20.092 32.519 1.00 12.65 C ATOM 3742 SG CYS D 22 38.335 21.431 32.542 1.00 21.63 S ATOM 3743 H CYS D 22 42.340 19.379 31.603 1.00 0.00 H ATOM 3744 N VAL D 23 40.416 22.077 29.872 1.00 13.72 N ATOM 3745 CA VAL D 23 40.867 23.415 29.507 1.00 12.97 C ATOM 3746 C VAL D 23 39.813 24.412 29.962 1.00 15.32 C ATOM 3747 O VAL D 23 38.613 24.217 29.723 1.00 16.04 O ATOM 3748 CB VAL D 23 41.132 23.535 27.995 1.00 16.29 C ATOM 3749 CG1 VAL D 23 41.669 24.939 27.668 1.00 13.14 C ATOM 3750 CG2 VAL D 23 42.127 22.470 27.539 1.00 17.51 C ATOM 3751 H VAL D 23 39.672 21.625 29.303 1.00 0.00 H ATOM 3752 N VAL D 24 40.256 25.458 30.659 1.00 15.38 N ATOM 3753 CA VAL D 24 39.371 26.497 31.164 1.00 17.04 C ATOM 3754 C VAL D 24 39.500 27.727 30.281 1.00 17.52 C ATOM 3755 O VAL D 24 40.585 28.040 29.771 1.00 18.11 O ATOM 3756 CB VAL D 24 39.685 26.839 32.636 1.00 16.79 C ATOM 3757 CG1 VAL D 24 41.068 27.470 32.763 1.00 16.99 C ATOM 3758 CG2 VAL D 24 38.624 27.773 33.195 1.00 19.94 C ATOM 3759 H VAL D 24 41.275 25.535 30.850 1.00 0.00 H ATOM 3760 N SER D 25 38.383 28.421 30.089 1.00 17.51 N ATOM 3761 CA SER D 25 38.383 29.728 29.461 1.00 20.61 C ATOM 3762 C SER D 25 37.383 30.605 30.196 1.00 19.32 C ATOM 3763 O SER D 25 36.528 30.115 30.938 1.00 19.49 O ATOM 3764 CB SER D 25 38.037 29.638 27.972 1.00 23.58 C ATOM 3765 OG SER D 25 36.828 28.929 27.789 1.00 21.92 O ATOM 3766 HG SER D 25 36.619 28.880 26.823 1.00 0.00 H ATOM 3767 H SER D 25 37.478 28.013 30.400 1.00 0.00 H ATOM 3768 N GLY D 26 37.508 31.910 29.995 1.00 23.47 N ATOM 3769 CA GLY D 26 36.610 32.874 30.596 1.00 22.09 C ATOM 3770 C GLY D 26 37.273 33.629 31.735 1.00 27.16 C ATOM 3771 O GLY D 26 38.451 33.448 32.048 1.00 27.33 O ATOM 3772 H GLY D 26 38.277 32.253 29.385 1.00 0.00 H ATOM 3773 N ASN D 27 36.475 34.497 32.351 1.00 27.81 N ATOM 3774 CA ASN D 27 36.937 35.331 33.457 1.00 26.74 C ATOM 3775 C ASN D 27 36.883 34.502 34.732 1.00 29.19 C ATOM 3776 O ASN D 27 35.842 34.401 35.383 1.00 32.85 O ATOM 3777 CB ASN D 27 36.084 36.591 33.568 1.00 33.57 C ATOM 3778 CG ASN D 27 36.529 37.507 34.695 1.00 37.96 C ATOM 3779 OD1 ASN D 27 37.542 37.267 35.353 1.00 40.06 O ATOM 3780 ND2 ASN D 27 35.772 38.575 34.916 1.00 41.79 N ATOM 3781 HD22 ASN D 27 34.924 38.740 34.337 1.00 0.00 H ATOM 3782 HD21 ASN D 27 36.027 39.246 35.668 1.00 0.00 H ATOM 3783 H ASN D 27 35.488 34.585 32.034 1.00 0.00 H ATOM 3784 N THR D 28 38.017 33.910 35.098 1.00 25.51 N ATOM 3785 CA THR D 28 38.085 33.053 36.272 1.00 27.04 C ATOM 3786 C THR D 28 38.486 33.794 37.539 1.00 26.43 C ATOM 3787 O THR D 28 38.086 33.390 38.637 1.00 28.28 O ATOM 3788 CB THR D 28 39.086 31.921 36.036 1.00 23.62 C ATOM 3789 OG1 THR D 28 40.392 32.479 35.834 1.00 24.46 O ATOM 3790 CG2 THR D 28 38.689 31.092 34.823 1.00 26.16 C ATOM 3791 HG1 THR D 28 40.657 32.995 36.636 1.00 0.00 H ATOM 3792 H THR D 28 38.875 34.063 34.531 1.00 0.00 H ATOM 3793 N GLY D 29 39.261 34.866 37.419 1.00 26.28 N ATOM 3794 CA GLY D 29 39.964 35.402 38.564 1.00 24.64 C ATOM 3795 C GLY D 29 41.308 34.725 38.728 1.00 26.83 C ATOM 3796 O GLY D 29 41.705 33.852 37.951 1.00 25.26 O ATOM 3797 H GLY D 29 39.364 35.325 36.491 1.00 0.00 H ATOM 3798 N SER D 30 42.028 35.129 39.778 1.00 22.64 N ATOM 3799 CA SER D 30 43.398 34.674 39.967 1.00 22.37 C ATOM 3800 C SER D 30 43.556 33.577 41.015 1.00 21.45 C ATOM 3801 O SER D 30 44.601 32.916 41.036 1.00 18.62 O ATOM 3802 CB SER D 30 44.301 35.858 40.345 1.00 23.69 C ATOM 3803 OG SER D 30 44.037 36.305 41.662 1.00 32.33 O ATOM 3804 HG SER D 30 43.093 36.594 41.728 1.00 0.00 H ATOM 3805 H SER D 30 41.604 35.778 40.471 1.00 0.00 H ATOM 3806 N THR D 31 42.565 33.355 41.877 1.00 22.38 N ATOM 3807 CA THR D 31 42.724 32.417 42.981 1.00 21.42 C ATOM 3808 C THR D 31 41.484 31.543 43.116 1.00 17.89 C ATOM 3809 O THR D 31 40.374 31.950 42.765 1.00 20.29 O ATOM 3810 CB THR D 31 42.989 33.141 44.309 1.00 21.70 C ATOM 3811 OG1 THR D 31 41.881 33.993 44.615 1.00 25.37 O ATOM 3812 CG2 THR D 31 44.259 33.984 44.224 1.00 25.39 C ATOM 3813 HG1 THR D 31 41.059 33.448 44.694 1.00 0.00 H ATOM 3814 H THR D 31 41.663 33.859 41.760 1.00 0.00 H ATOM 3815 N GLY D 32 41.683 30.331 43.625 1.00 17.16 N ATOM 3816 CA GLY D 32 40.577 29.449 43.918 1.00 15.61 C ATOM 3817 C GLY D 32 40.918 27.993 43.661 1.00 12.59 C ATOM 3818 O GLY D 32 42.081 27.606 43.516 1.00 14.60 O ATOM 3819 H GLY D 32 42.654 30.012 43.816 1.00 0.00 H ATOM 3820 N TYR D 33 39.858 27.190 43.628 1.00 11.76 N ATOM 3821 CA TYR D 33 39.946 25.744 43.515 1.00 13.77 C ATOM 3822 C TYR D 33 39.673 25.284 42.093 1.00 10.70 C ATOM 3823 O TYR D 33 38.762 25.783 41.430 1.00 13.14 O ATOM 3824 CB TYR D 33 38.939 25.074 44.448 1.00 12.24 C ATOM 3825 CG TYR D 33 39.231 25.207 45.917 1.00 15.40 C ATOM 3826 CD1 TYR D 33 40.053 24.291 46.571 1.00 14.08 C ATOM 3827 CD2 TYR D 33 38.644 26.219 46.667 1.00 19.99 C ATOM 3828 CE1 TYR D 33 40.300 24.403 47.933 1.00 20.24 C ATOM 3829 CE2 TYR D 33 38.890 26.339 48.021 1.00 19.90 C ATOM 3830 CZ TYR D 33 39.718 25.435 48.644 1.00 22.99 C ATOM 3831 OH TYR D 33 39.952 25.571 49.990 1.00 27.86 O ATOM 3832 HH TYR D 33 40.562 24.852 50.292 1.00 0.00 H ATOM 3833 H TYR D 33 38.913 27.621 43.686 1.00 0.00 H ATOM 3834 N TRP D 34 40.426 24.278 41.664 1.00 11.40 N ATOM 3835 CA TRP D 34 40.241 23.603 40.386 1.00 11.35 C ATOM 3836 C TRP D 34 40.250 22.111 40.676 1.00 7.71 C ATOM 3837 O TRP D 34 41.254 21.577 41.163 1.00 9.64 O ATOM 3838 CB TRP D 34 41.347 24.002 39.404 1.00 15.76 C ATOM 3839 CG TRP D 34 40.972 23.929 37.963 1.00 13.41 C ATOM 3840 CD1 TRP D 34 39.788 23.517 37.443 1.00 14.68 C ATOM 3841 CD2 TRP D 34 41.807 24.274 36.848 1.00 14.22 C ATOM 3842 NE1 TRP D 34 39.824 23.590 36.067 1.00 17.30 N ATOM 3843 CE2 TRP D 34 41.054 24.052 35.681 1.00 12.64 C ATOM 3844 CE3 TRP D 34 43.110 24.751 36.732 1.00 16.59 C ATOM 3845 CZ2 TRP D 34 41.570 24.283 34.408 1.00 15.66 C ATOM 3846 CZ3 TRP D 34 43.619 24.985 35.471 1.00 15.67 C ATOM 3847 CH2 TRP D 34 42.849 24.756 34.331 1.00 14.18 C ATOM 3848 HE1 TRP D 34 39.045 23.336 35.427 1.00 0.00 H ATOM 3849 H TRP D 34 41.198 23.951 42.280 1.00 0.00 H ATOM 3850 N ALA D 35 39.139 21.439 40.411 1.00 9.57 N ATOM 3851 CA ALA D 35 38.907 20.134 41.004 1.00 9.63 C ATOM 3852 C ALA D 35 38.393 19.145 39.975 1.00 10.15 C ATOM 3853 O ALA D 35 37.809 19.512 38.949 1.00 11.68 O ATOM 3854 CB ALA D 35 37.904 20.223 42.161 1.00 9.47 C ATOM 3855 H ALA D 35 38.428 21.850 39.773 1.00 0.00 H ATOM 3856 N TRP D 36 38.613 17.872 40.282 1.00 9.13 N ATOM 3857 CA TRP D 36 37.993 16.758 39.587 1.00 10.18 C ATOM 3858 C TRP D 36 37.034 16.069 40.544 1.00 10.64 C ATOM 3859 O TRP D 36 37.383 15.819 41.699 1.00 9.98 O ATOM 3860 CB TRP D 36 39.047 15.764 39.107 1.00 9.48 C ATOM 3861 CG TRP D 36 39.833 16.244 37.941 1.00 11.60 C ATOM 3862 CD1 TRP D 36 41.082 16.774 37.971 1.00 12.10 C ATOM 3863 CD2 TRP D 36 39.432 16.229 36.566 1.00 15.25 C ATOM 3864 NE1 TRP D 36 41.495 17.090 36.700 1.00 15.16 N ATOM 3865 CE2 TRP D 36 40.497 16.765 35.819 1.00 12.30 C ATOM 3866 CE3 TRP D 36 38.278 15.808 35.894 1.00 11.41 C ATOM 3867 CZ2 TRP D 36 40.448 16.899 34.430 1.00 13.59 C ATOM 3868 CZ3 TRP D 36 38.232 15.939 34.512 1.00 17.08 C ATOM 3869 CH2 TRP D 36 39.312 16.485 33.803 1.00 13.00 C ATOM 3870 HE1 TRP D 36 42.414 17.507 36.448 1.00 0.00 H ATOM 3871 H TRP D 36 39.266 17.661 41.064 1.00 0.00 H ATOM 3872 N PHE D 37 35.838 15.768 40.061 1.00 9.68 N ATOM 3873 CA PHE D 37 34.809 15.032 40.772 1.00 12.92 C ATOM 3874 C PHE D 37 34.432 13.821 39.938 1.00 14.08 C ATOM 3875 O PHE D 37 34.564 13.834 38.713 1.00 16.19 O ATOM 3876 CB PHE D 37 33.557 15.900 40.992 1.00 11.58 C ATOM 3877 CG PHE D 37 33.724 16.942 42.055 1.00 9.32 C ATOM 3878 CD1 PHE D 37 33.394 16.653 43.364 1.00 11.56 C ATOM 3879 CD2 PHE D 37 34.230 18.195 41.753 1.00 11.31 C ATOM 3880 CE1 PHE D 37 33.557 17.594 44.351 1.00 12.80 C ATOM 3881 CE2 PHE D 37 34.390 19.152 42.744 1.00 12.31 C ATOM 3882 CZ PHE D 37 34.063 18.843 44.043 1.00 12.26 C ATOM 3883 H PHE D 37 35.619 16.084 39.095 1.00 0.00 H ATOM 3884 N ARG D 38 33.958 12.770 40.584 1.00 13.24 N ATOM 3885 CA ARG D 38 33.439 11.642 39.833 1.00 14.27 C ATOM 3886 C ARG D 38 31.998 11.408 40.252 1.00 20.03 C ATOM 3887 O ARG D 38 31.678 11.403 41.448 1.00 18.01 O ATOM 3888 CB ARG D 38 34.294 10.375 39.992 1.00 17.18 C ATOM 3889 CG ARG D 38 34.628 9.933 41.381 1.00 21.00 C ATOM 3890 CD ARG D 38 35.567 8.736 41.289 1.00 18.55 C ATOM 3891 NE ARG D 38 35.962 8.223 42.594 1.00 22.15 N ATOM 3892 CZ ARG D 38 37.066 7.519 42.801 1.00 22.97 C ATOM 3893 NH1 ARG D 38 37.876 7.251 41.780 1.00 18.94 N ATOM 3894 NH2 ARG D 38 37.356 7.080 44.021 1.00 27.07 N ATOM 3895 HE ARG D 38 35.344 8.420 43.407 1.00 0.00 H ATOM 3896 HH12 ARG D 38 38.744 6.699 41.936 1.00 0.00 H ATOM 3897 HH11 ARG D 38 37.641 7.593 40.826 1.00 0.00 H ATOM 3898 HH22 ARG D 38 38.222 6.528 44.183 1.00 0.00 H ATOM 3899 HH21 ARG D 38 36.717 7.289 44.814 1.00 0.00 H ATOM 3900 H ARG D 38 33.957 12.751 41.624 1.00 0.00 H ATOM 3901 N GLN D 39 31.142 11.241 39.250 1.00 23.57 N ATOM 3902 CA GLN D 39 29.697 11.228 39.404 1.00 24.65 C ATOM 3903 C GLN D 39 29.183 9.882 38.920 1.00 28.23 C ATOM 3904 O GLN D 39 29.484 9.467 37.796 1.00 26.02 O ATOM 3905 CB GLN D 39 29.066 12.376 38.609 1.00 29.27 C ATOM 3906 CG GLN D 39 27.606 12.176 38.226 1.00 31.35 C ATOM 3907 CD GLN D 39 26.654 12.472 39.367 1.00 35.97 C ATOM 3908 OE1 GLN D 39 26.308 13.627 39.620 1.00 41.06 O ATOM 3909 NE2 GLN D 39 26.225 11.427 40.064 1.00 36.81 N ATOM 3910 HE22 GLN D 39 26.544 10.469 39.814 1.00 0.00 H ATOM 3911 HE21 GLN D 39 25.570 11.566 40.860 1.00 0.00 H ATOM 3912 H GLN D 39 31.531 11.111 38.294 1.00 0.00 H ATOM 3913 N GLY D 40 28.438 9.194 39.780 1.00 32.12 N ATOM 3914 CA GLY D 40 27.715 8.008 39.393 1.00 34.90 C ATOM 3915 C GLY D 40 26.229 8.283 39.478 1.00 33.77 C ATOM 3916 O GLY D 40 25.764 8.973 40.391 1.00 37.30 O ATOM 3917 H GLY D 40 28.375 9.522 40.765 1.00 0.00 H ATOM 3918 N PRO D 41 25.452 7.756 38.516 1.00 33.80 N ATOM 3919 CA PRO D 41 24.011 7.998 38.354 1.00 32.82 C ATOM 3920 C PRO D 41 23.224 8.003 39.662 1.00 25.38 C ATOM 3921 O PRO D 41 23.445 7.105 40.475 1.00 27.50 O ATOM 3922 CB PRO D 41 23.564 6.829 37.476 1.00 31.06 C ATOM 3923 CG PRO D 41 24.758 6.496 36.663 1.00 30.84 C ATOM 3924 CD PRO D 41 25.952 6.760 37.550 1.00 34.42 C TER 3925 PRO D 41 ATOM 3926 N ARG D 45 28.207 13.556 43.633 1.00 31.87 N ATOM 3927 CA ARG D 45 29.547 13.789 43.105 1.00 27.64 C ATOM 3928 C ARG D 45 30.568 13.801 44.226 1.00 27.62 C ATOM 3929 O ARG D 45 30.513 14.667 45.101 1.00 29.63 O ATOM 3930 CB ARG D 45 29.614 15.114 42.352 1.00 26.05 C ATOM 3931 CG ARG D 45 28.627 15.241 41.224 1.00 30.92 C ATOM 3932 CD ARG D 45 28.217 16.683 41.043 1.00 29.75 C ATOM 3933 NE ARG D 45 26.784 16.805 40.802 1.00 34.78 N ATOM 3934 CZ ARG D 45 26.260 17.028 39.602 1.00 43.04 C ATOM 3935 NH1 ARG D 45 24.947 17.128 39.443 1.00 41.14 N ATOM 3936 NH2 ARG D 45 27.061 17.140 38.556 1.00 37.88 N ATOM 3937 HE ARG D 45 26.138 16.713 41.612 1.00 0.00 H ATOM 3938 HH12 ARG D 45 24.549 17.303 38.498 1.00 0.00 H ATOM 3939 HH11 ARG D 45 24.315 17.032 40.263 1.00 0.00 H ATOM 3940 HH22 ARG D 45 26.662 17.315 37.612 1.00 0.00 H ATOM 3941 HH21 ARG D 45 28.090 17.053 38.678 1.00 0.00 H ATOM 3942 HN3 ARG D 45 27.963 14.313 44.303 1.00 0.00 H ATOM 3943 HN2 ARG D 45 28.183 12.638 44.121 1.00 0.00 H ATOM 3944 HN1 ARG D 45 27.523 13.551 42.850 1.00 0.00 H ATOM 3945 N GLU D 46 31.507 12.859 44.199 1.00 21.51 N ATOM 3946 CA GLU D 46 32.552 12.805 45.207 1.00 20.76 C ATOM 3947 C GLU D 46 33.845 13.404 44.666 1.00 15.02 C ATOM 3948 O GLU D 46 34.201 13.215 43.499 1.00 16.11 O ATOM 3949 CB GLU D 46 32.782 11.374 45.701 1.00 25.60 C ATOM 3950 CG GLU D 46 33.517 10.450 44.757 1.00 25.65 C ATOM 3951 CD GLU D 46 33.923 9.155 45.437 1.00 30.28 C ATOM 3952 OE1 GLU D 46 33.460 8.915 46.576 1.00 32.87 O ATOM 3953 OE2 GLU D 46 34.697 8.377 44.835 1.00 33.35 O ATOM 3954 H GLU D 46 31.493 12.147 43.441 1.00 0.00 H ATOM 3955 N GLY D 47 34.535 14.145 45.525 1.00 14.39 N ATOM 3956 CA GLY D 47 35.783 14.762 45.121 1.00 13.16 C ATOM 3957 C GLY D 47 36.853 13.703 44.928 1.00 11.98 C ATOM 3958 O GLY D 47 36.995 12.786 45.747 1.00 12.94 O ATOM 3959 H GLY D 47 34.178 14.283 46.492 1.00 0.00 H ATOM 3960 N VAL D 48 37.598 13.804 43.833 1.00 11.14 N ATOM 3961 CA VAL D 48 38.751 12.934 43.623 1.00 9.69 C ATOM 3962 C VAL D 48 40.062 13.664 43.887 1.00 7.08 C ATOM 3963 O VAL D 48 40.920 13.146 44.598 1.00 8.78 O ATOM 3964 CB VAL D 48 38.717 12.273 42.221 1.00 14.37 C ATOM 3965 CG1 VAL D 48 38.422 13.213 41.189 1.00 16.34 C ATOM 3966 CG2 VAL D 48 40.023 11.596 41.868 1.00 12.83 C ATOM 3967 H VAL D 48 37.356 14.515 43.113 1.00 0.00 H ATOM 3968 N ALA D 49 40.217 14.884 43.367 1.00 7.08 N ATOM 3969 CA ALA D 49 41.447 15.636 43.579 1.00 9.01 C ATOM 3970 C ALA D 49 41.173 17.097 43.283 1.00 9.41 C ATOM 3971 O ALA D 49 40.258 17.421 42.525 1.00 11.14 O ATOM 3972 CB ALA D 49 42.601 15.139 42.703 1.00 9.24 C ATOM 3973 H ALA D 49 39.450 15.303 42.803 1.00 0.00 H ATOM 3974 N ALA D 50 41.963 17.974 43.894 1.00 8.35 N ATOM 3975 CA ALA D 50 41.792 19.397 43.642 1.00 9.06 C ATOM 3976 C ALA D 50 43.100 20.125 43.879 1.00 10.42 C ATOM 3977 O ALA D 50 43.993 19.647 44.582 1.00 10.72 O ATOM 3978 CB ALA D 50 40.702 20.016 44.523 1.00 9.48 C ATOM 3979 H ALA D 50 42.700 17.645 44.549 1.00 0.00 H ATOM 3980 N THR D 51 43.186 21.310 43.295 1.00 9.20 N ATOM 3981 CA THR D 51 44.294 22.215 43.538 1.00 12.40 C ATOM 3982 C THR D 51 43.731 23.569 43.920 1.00 10.33 C ATOM 3983 O THR D 51 42.803 24.056 43.270 1.00 15.46 O ATOM 3984 CB THR D 51 45.188 22.350 42.307 1.00 14.51 C ATOM 3985 OG1 THR D 51 45.835 21.100 42.049 1.00 17.04 O ATOM 3986 CG2 THR D 51 46.253 23.412 42.536 1.00 19.86 C ATOM 3987 HG1 THR D 51 46.414 21.188 41.251 1.00 0.00 H ATOM 3988 H THR D 51 42.433 21.602 42.639 1.00 0.00 H ATOM 3989 N TYR D 52 44.286 24.173 44.970 1.00 10.53 N ATOM 3990 CA TYR D 52 44.024 25.567 45.296 1.00 12.97 C ATOM 3991 C TYR D 52 45.211 26.416 44.857 1.00 12.21 C ATOM 3992 O TYR D 52 46.352 26.126 45.215 1.00 15.80 O ATOM 3993 CB TYR D 52 43.777 25.753 46.795 1.00 11.74 C ATOM 3994 CG TYR D 52 43.337 27.151 47.152 1.00 14.81 C ATOM 3995 CD1 TYR D 52 41.997 27.513 47.059 1.00 16.34 C ATOM 3996 CD2 TYR D 52 44.255 28.113 47.573 1.00 15.57 C ATOM 3997 CE1 TYR D 52 41.575 28.787 47.379 1.00 18.12 C ATOM 3998 CE2 TYR D 52 43.835 29.405 47.891 1.00 17.90 C ATOM 3999 CZ TYR D 52 42.494 29.727 47.796 1.00 18.83 C ATOM 4000 OH TYR D 52 42.042 30.990 48.113 1.00 19.77 O ATOM 4001 HH TYR D 52 41.061 31.030 47.984 1.00 0.00 H ATOM 4002 H TYR D 52 44.930 23.628 45.579 1.00 0.00 H ATOM 4003 N THR D 53 44.942 27.456 44.076 1.00 12.75 N ATOM 4004 CA THR D 53 45.970 28.396 43.651 1.00 15.63 C ATOM 4005 C THR D 53 45.753 29.692 44.412 1.00 19.47 C ATOM 4006 O THR D 53 44.687 30.309 44.299 1.00 16.52 O ATOM 4007 CB THR D 53 45.913 28.632 42.145 1.00 16.64 C ATOM 4008 OG1 THR D 53 46.070 27.379 41.468 1.00 17.05 O ATOM 4009 CG2 THR D 53 47.023 29.577 41.719 1.00 19.99 C ATOM 4010 HG1 THR D 53 45.341 26.766 41.737 1.00 0.00 H ATOM 4011 H THR D 53 43.963 27.604 43.757 1.00 0.00 H ATOM 4012 N ALA D 54 46.751 30.080 45.201 1.00 19.79 N ATOM 4013 CA ALA D 54 46.722 31.315 45.969 1.00 23.20 C ATOM 4014 C ALA D 54 47.214 32.518 45.178 1.00 29.45 C ATOM 4015 O ALA D 54 47.091 33.649 45.663 1.00 30.49 O ATOM 4016 CB ALA D 54 47.560 31.164 47.243 1.00 27.49 C ATOM 4017 H ALA D 54 47.592 29.472 45.272 1.00 0.00 H ATOM 4018 N GLY D 55 47.768 32.309 43.987 1.00 24.46 N ATOM 4019 CA GLY D 55 48.111 33.428 43.124 1.00 36.17 C ATOM 4020 C GLY D 55 49.241 34.287 43.643 1.00 39.78 C ATOM 4021 O GLY D 55 49.171 35.520 43.555 1.00 41.60 O ATOM 4022 H GLY D 55 47.958 31.337 43.670 1.00 0.00 H ATOM 4023 N SER D 56 50.284 33.666 44.182 1.00 41.23 N ATOM 4024 CA SER D 56 51.413 34.403 44.721 1.00 39.29 C ATOM 4025 C SER D 56 52.640 33.506 44.752 1.00 36.79 C ATOM 4026 O SER D 56 52.778 32.609 43.920 1.00 41.53 O ATOM 4027 CB SER D 56 51.097 34.931 46.122 1.00 40.91 C ATOM 4028 OG SER D 56 52.079 35.857 46.551 1.00 41.67 O ATOM 4029 HG SER D 56 51.851 36.182 47.458 1.00 0.00 H ATOM 4030 H SER D 56 50.292 32.627 44.219 1.00 0.00 H TER 4031 SER D 56 ATOM 4032 N THR D 58 51.698 30.243 44.352 1.00 29.78 N ATOM 4033 CA THR D 58 51.908 28.827 44.627 1.00 27.17 C ATOM 4034 C THR D 58 50.577 28.117 44.861 1.00 25.35 C ATOM 4035 O THR D 58 49.546 28.763 45.030 1.00 20.32 O ATOM 4036 CB THR D 58 52.813 28.629 45.843 1.00 29.16 C ATOM 4037 OG1 THR D 58 52.152 29.137 47.008 1.00 32.88 O ATOM 4038 CG2 THR D 58 54.136 29.370 45.643 1.00 30.62 C ATOM 4039 HG1 THR D 58 52.735 29.011 47.798 1.00 0.00 H ATOM 4040 HN3 THR D 58 51.220 30.685 45.163 1.00 0.00 H ATOM 4041 HN2 THR D 58 51.108 30.346 43.502 1.00 0.00 H ATOM 4042 HN1 THR D 58 52.617 30.705 44.196 1.00 0.00 H ATOM 4043 N SER D 59 50.606 26.787 44.882 1.00 22.34 N ATOM 4044 CA SER D 59 49.391 25.993 44.953 1.00 19.29 C ATOM 4045 C SER D 59 49.478 24.981 46.086 1.00 19.97 C ATOM 4046 O SER D 59 50.558 24.664 46.592 1.00 23.35 O ATOM 4047 CB SER D 59 49.128 25.269 43.628 1.00 20.66 C ATOM 4048 OG SER D 59 48.859 26.193 42.583 1.00 27.36 O ATOM 4049 HG SER D 59 48.693 25.699 41.741 1.00 0.00 H ATOM 4050 H SER D 59 51.525 26.301 44.847 1.00 0.00 H ATOM 4051 N MET D 60 48.311 24.472 46.477 1.00 16.38 N ATOM 4052 CA MET D 60 48.204 23.331 47.367 1.00 17.14 C ATOM 4053 C MET D 60 47.336 22.287 46.684 1.00 15.40 C ATOM 4054 O MET D 60 46.420 22.624 45.936 1.00 14.98 O ATOM 4055 CB MET D 60 47.607 23.714 48.734 1.00 19.84 C ATOM 4056 CG MET D 60 47.486 22.554 49.716 1.00 22.87 C ATOM 4057 SD MET D 60 49.059 22.025 50.444 1.00 41.39 S ATOM 4058 CE MET D 60 49.478 20.580 49.466 1.00 26.71 C ATOM 4059 H MET D 60 47.436 24.913 46.128 1.00 0.00 H ATOM 4060 N THR D 61 47.632 21.019 46.939 1.00 13.64 N ATOM 4061 CA THR D 61 46.963 19.918 46.264 1.00 10.60 C ATOM 4062 C THR D 61 46.283 19.011 47.279 1.00 12.87 C ATOM 4063 O THR D 61 46.802 18.795 48.378 1.00 15.23 O ATOM 4064 CB THR D 61 47.962 19.127 45.418 1.00 12.76 C ATOM 4065 OG1 THR D 61 48.388 19.957 44.330 1.00 15.65 O ATOM 4066 CG2 THR D 61 47.321 17.898 44.855 1.00 13.65 C ATOM 4067 HG1 THR D 61 48.818 20.774 44.688 1.00 0.00 H ATOM 4068 H THR D 61 48.366 20.806 47.644 1.00 0.00 H ATOM 4069 N TYR D 62 45.107 18.498 46.907 1.00 9.81 N ATOM 4070 CA TYR D 62 44.296 17.654 47.774 1.00 10.81 C ATOM 4071 C TYR D 62 43.845 16.409 47.029 1.00 11.49 C ATOM 4072 O TYR D 62 43.514 16.466 45.839 1.00 8.67 O ATOM 4073 CB TYR D 62 43.061 18.417 48.303 1.00 11.20 C ATOM 4074 CG TYR D 62 43.403 19.736 48.963 1.00 12.68 C ATOM 4075 CD1 TYR D 62 43.850 19.778 50.278 1.00 14.70 C ATOM 4076 CD2 TYR D 62 43.295 20.932 48.267 1.00 13.67 C ATOM 4077 CE1 TYR D 62 44.173 20.982 50.879 1.00 15.33 C ATOM 4078 CE2 TYR D 62 43.611 22.145 48.868 1.00 15.75 C ATOM 4079 CZ TYR D 62 44.053 22.156 50.172 1.00 18.91 C ATOM 4080 OH TYR D 62 44.384 23.343 50.789 1.00 22.30 O ATOM 4081 HH TYR D 62 44.679 23.161 51.716 1.00 0.00 H ATOM 4082 H TYR D 62 44.754 18.711 45.953 1.00 0.00 H ATOM 4083 N TYR D 63 43.817 15.286 47.737 1.00 10.66 N ATOM 4084 CA TYR D 63 43.383 14.020 47.173 1.00 8.65 C ATOM 4085 C TYR D 63 42.380 13.344 48.086 1.00 11.75 C ATOM 4086 O TYR D 63 42.494 13.412 49.313 1.00 13.90 O ATOM 4087 CB TYR D 63 44.566 13.063 46.968 1.00 8.72 C ATOM 4088 CG TYR D 63 45.518 13.528 45.899 1.00 8.12 C ATOM 4089 CD1 TYR D 63 45.237 13.333 44.559 1.00 10.05 C ATOM 4090 CD2 TYR D 63 46.704 14.163 46.226 1.00 9.64 C ATOM 4091 CE1 TYR D 63 46.112 13.770 43.573 1.00 9.44 C ATOM 4092 CE2 TYR D 63 47.586 14.588 45.248 1.00 11.31 C ATOM 4093 CZ TYR D 63 47.293 14.384 43.926 1.00 9.48 C ATOM 4094 OH TYR D 63 48.167 14.826 42.955 1.00 10.71 O ATOM 4095 HH TYR D 63 48.274 15.807 43.031 1.00 0.00 H ATOM 4096 H TYR D 63 44.117 15.314 48.732 1.00 0.00 H ATOM 4097 N ALA D 64 41.416 12.666 47.470 1.00 10.60 N ATOM 4098 CA ALA D 64 40.610 11.699 48.199 1.00 10.98 C ATOM 4099 C ALA D 64 41.481 10.514 48.594 1.00 13.87 C ATOM 4100 O ALA D 64 42.388 10.115 47.857 1.00 12.14 O ATOM 4101 CB ALA D 64 39.439 11.222 47.348 1.00 13.83 C ATOM 4102 H ALA D 64 41.237 12.828 46.459 1.00 0.00 H ATOM 4103 N ASP D 65 41.190 9.945 49.770 1.00 15.10 N ATOM 4104 CA ASP D 65 42.016 8.855 50.277 1.00 18.69 C ATOM 4105 C ASP D 65 42.039 7.667 49.322 1.00 13.95 C ATOM 4106 O ASP D 65 43.050 6.965 49.242 1.00 19.16 O ATOM 4107 CB ASP D 65 41.517 8.407 51.653 1.00 21.33 C ATOM 4108 CG ASP D 65 41.726 9.465 52.729 1.00 28.74 C ATOM 4109 OD1 ASP D 65 42.495 10.424 52.496 1.00 30.69 O ATOM 4110 OD2 ASP D 65 41.111 9.341 53.811 1.00 35.56 O ATOM 4111 H ASP D 65 40.375 10.280 50.322 1.00 0.00 H ATOM 4112 N SER D 66 40.939 7.424 48.602 1.00 16.46 N ATOM 4113 CA SER D 66 40.836 6.243 47.752 1.00 16.99 C ATOM 4114 C SER D 66 41.635 6.355 46.460 1.00 16.59 C ATOM 4115 O SER D 66 41.760 5.356 45.748 1.00 18.57 O ATOM 4116 CB SER D 66 39.372 5.959 47.406 1.00 17.03 C ATOM 4117 OG SER D 66 38.841 6.972 46.567 1.00 22.98 O ATOM 4118 HG SER D 66 38.894 7.845 47.031 1.00 0.00 H ATOM 4119 H SER D 66 40.141 8.090 48.649 1.00 0.00 H ATOM 4120 N VAL D 67 42.169 7.526 46.126 1.00 13.74 N ATOM 4121 CA VAL D 67 42.994 7.674 44.931 1.00 14.01 C ATOM 4122 C VAL D 67 44.417 8.097 45.242 1.00 10.85 C ATOM 4123 O VAL D 67 45.246 8.109 44.327 1.00 11.80 O ATOM 4124 CB VAL D 67 42.367 8.653 43.915 1.00 12.07 C ATOM 4125 CG1 VAL D 67 40.893 8.309 43.672 1.00 16.41 C ATOM 4126 CG2 VAL D 67 42.525 10.100 44.381 1.00 11.67 C ATOM 4127 H VAL D 67 41.995 8.355 46.730 1.00 0.00 H ATOM 4128 N LYS D 68 44.732 8.440 46.488 1.00 12.42 N ATOM 4129 CA LYS D 68 46.091 8.837 46.837 1.00 12.27 C ATOM 4130 C LYS D 68 47.095 7.778 46.403 1.00 14.21 C ATOM 4131 O LYS D 68 46.923 6.585 46.670 1.00 15.72 O ATOM 4132 CB LYS D 68 46.201 9.069 48.347 1.00 13.87 C ATOM 4133 CG LYS D 68 45.582 10.357 48.832 1.00 19.60 C ATOM 4134 CD LYS D 68 45.609 10.474 50.347 1.00 22.99 C ATOM 4135 CE LYS D 68 45.040 11.823 50.790 1.00 22.82 C ATOM 4136 NZ LYS D 68 46.081 12.888 50.864 1.00 28.17 N ATOM 4137 HZ1 LYS D 68 46.813 12.609 51.549 1.00 0.00 H ATOM 4138 HZ2 LYS D 68 46.512 13.015 49.926 1.00 0.00 H ATOM 4139 HZ3 LYS D 68 45.642 13.780 51.169 1.00 0.00 H ATOM 4140 H LYS D 68 43.998 8.425 47.224 1.00 0.00 H ATOM 4141 N GLY D 69 48.152 8.222 45.730 1.00 12.98 N ATOM 4142 CA GLY D 69 49.174 7.314 45.274 1.00 15.62 C ATOM 4143 C GLY D 69 48.865 6.626 43.968 1.00 15.47 C ATOM 4144 O GLY D 69 49.721 5.891 43.456 1.00 17.22 O ATOM 4145 H GLY D 69 48.243 9.239 45.530 1.00 0.00 H ATOM 4146 N ARG D 70 47.678 6.829 43.415 1.00 10.84 N ATOM 4147 CA ARG D 70 47.313 6.300 42.110 1.00 11.31 C ATOM 4148 C ARG D 70 46.965 7.396 41.122 1.00 10.75 C ATOM 4149 O ARG D 70 47.282 7.274 39.943 1.00 15.54 O ATOM 4150 CB ARG D 70 46.122 5.317 42.219 1.00 13.61 C ATOM 4151 CG ARG D 70 46.397 4.102 43.116 1.00 16.45 C ATOM 4152 CD ARG D 70 45.251 3.063 43.062 1.00 14.87 C ATOM 4153 NE ARG D 70 43.960 3.646 43.419 1.00 15.01 N ATOM 4154 CZ ARG D 70 42.941 3.819 42.575 1.00 14.85 C ATOM 4155 NH1 ARG D 70 43.036 3.429 41.313 1.00 16.11 N ATOM 4156 NH2 ARG D 70 41.817 4.380 42.995 1.00 16.82 N ATOM 4157 HE ARG D 70 43.825 3.949 44.405 1.00 0.00 H ATOM 4158 HH12 ARG D 70 42.236 3.569 40.664 1.00 0.00 H ATOM 4159 HH11 ARG D 70 43.911 2.983 40.971 1.00 0.00 H ATOM 4160 HH22 ARG D 70 41.024 4.514 42.335 1.00 0.00 H ATOM 4161 HH21 ARG D 70 41.727 4.687 43.985 1.00 0.00 H ATOM 4162 H ARG D 70 46.976 7.392 43.937 1.00 0.00 H ATOM 4163 N PHE D 71 46.305 8.465 41.570 1.00 12.35 N ATOM 4164 CA PHE D 71 45.973 9.596 40.716 1.00 11.14 C ATOM 4165 C PHE D 71 46.858 10.784 41.065 1.00 8.69 C ATOM 4166 O PHE D 71 47.207 10.990 42.230 1.00 11.62 O ATOM 4167 CB PHE D 71 44.506 10.026 40.871 1.00 10.33 C ATOM 4168 CG PHE D 71 43.493 9.000 40.424 1.00 11.65 C ATOM 4169 CD1 PHE D 71 43.859 7.730 39.990 1.00 12.12 C ATOM 4170 CD2 PHE D 71 42.153 9.325 40.454 1.00 12.95 C ATOM 4171 CE1 PHE D 71 42.896 6.809 39.610 1.00 15.30 C ATOM 4172 CE2 PHE D 71 41.198 8.428 40.066 1.00 13.17 C ATOM 4173 CZ PHE D 71 41.555 7.168 39.649 1.00 15.12 C ATOM 4174 H PHE D 71 46.016 8.491 42.569 1.00 0.00 H ATOM 4175 N THR D 72 47.184 11.589 40.058 1.00 9.49 N ATOM 4176 CA THR D 72 47.973 12.797 40.263 1.00 9.35 C ATOM 4177 C THR D 72 47.314 13.953 39.531 1.00 10.79 C ATOM 4178 O THR D 72 47.040 13.861 38.330 1.00 11.48 O ATOM 4179 CB THR D 72 49.413 12.619 39.778 1.00 11.04 C ATOM 4180 OG1 THR D 72 50.003 11.519 40.482 1.00 13.41 O ATOM 4181 CG2 THR D 72 50.231 13.889 40.017 1.00 12.30 C ATOM 4182 HG1 THR D 72 50.936 11.395 40.175 1.00 0.00 H ATOM 4183 H THR D 72 46.867 11.350 39.097 1.00 0.00 H ATOM 4184 N ILE D 73 47.071 15.039 40.242 1.00 7.05 N ATOM 4185 CA ILE D 73 46.515 16.233 39.626 1.00 6.72 C ATOM 4186 C ILE D 73 47.632 17.244 39.410 1.00 9.81 C ATOM 4187 O ILE D 73 48.510 17.414 40.265 1.00 10.32 O ATOM 4188 CB ILE D 73 45.371 16.817 40.477 1.00 8.31 C ATOM 4189 CG1 ILE D 73 44.646 17.908 39.701 1.00 9.15 C ATOM 4190 CG2 ILE D 73 45.878 17.372 41.786 1.00 8.80 C ATOM 4191 CD1 ILE D 73 43.447 18.475 40.450 1.00 11.91 C ATOM 4192 H ILE D 73 47.281 15.040 41.261 1.00 0.00 H ATOM 4193 N SER D 74 47.630 17.876 38.238 1.00 8.07 N ATOM 4194 CA SER D 74 48.596 18.920 37.931 1.00 12.82 C ATOM 4195 C SER D 74 47.926 19.953 37.038 1.00 12.90 C ATOM 4196 O SER D 74 46.898 19.685 36.412 1.00 13.77 O ATOM 4197 CB SER D 74 49.846 18.344 37.262 1.00 15.09 C ATOM 4198 OG SER D 74 49.509 17.657 36.079 1.00 17.24 O ATOM 4199 HG SER D 74 48.891 16.914 36.295 1.00 0.00 H ATOM 4200 H SER D 74 46.920 17.617 37.524 1.00 0.00 H ATOM 4201 N GLN D 75 48.494 21.152 36.991 1.00 11.19 N ATOM 4202 CA GLN D 75 47.925 22.158 36.111 1.00 14.25 C ATOM 4203 C GLN D 75 49.028 22.920 35.400 1.00 11.87 C ATOM 4204 O GLN D 75 50.078 23.203 35.982 1.00 11.62 O ATOM 4205 CB GLN D 75 46.999 23.133 36.858 1.00 16.12 C ATOM 4206 CG GLN D 75 47.635 23.979 37.929 1.00 19.78 C ATOM 4207 CD GLN D 75 46.601 24.805 38.675 1.00 19.32 C ATOM 4208 OE1 GLN D 75 45.718 24.258 39.339 1.00 22.61 O ATOM 4209 NE2 GLN D 75 46.685 26.126 38.548 1.00 16.06 N ATOM 4210 HE22 GLN D 75 47.447 26.546 37.978 1.00 0.00 H ATOM 4211 HE21 GLN D 75 45.989 26.739 39.019 1.00 0.00 H ATOM 4212 H GLN D 75 49.329 21.367 37.572 1.00 0.00 H ATOM 4213 N ASP D 76 48.775 23.240 34.128 1.00 14.84 N ATOM 4214 CA ASP D 76 49.639 24.102 33.324 1.00 19.11 C ATOM 4215 C ASP D 76 48.979 25.476 33.277 1.00 17.76 C ATOM 4216 O ASP D 76 47.996 25.685 32.557 1.00 16.47 O ATOM 4217 CB ASP D 76 49.850 23.518 31.930 1.00 17.97 C ATOM 4218 CG ASP D 76 50.848 24.324 31.090 1.00 22.48 C ATOM 4219 OD1 ASP D 76 50.840 25.574 31.150 1.00 19.27 O ATOM 4220 OD2 ASP D 76 51.644 23.700 30.356 1.00 29.29 O ATOM 4221 H ASP D 76 47.916 22.855 33.686 1.00 0.00 H ATOM 4222 N ASN D 77 49.527 26.415 34.053 1.00 16.74 N ATOM 4223 CA ASN D 77 48.935 27.744 34.139 1.00 19.45 C ATOM 4224 C ASN D 77 49.074 28.505 32.829 1.00 24.15 C ATOM 4225 O ASN D 77 48.253 29.383 32.536 1.00 22.56 O ATOM 4226 CB ASN D 77 49.576 28.535 35.283 1.00 20.11 C ATOM 4227 CG ASN D 77 49.183 28.001 36.659 1.00 17.98 C ATOM 4228 OD1 ASN D 77 48.192 27.281 36.792 1.00 19.32 O ATOM 4229 ND2 ASN D 77 49.944 28.373 37.683 1.00 19.67 N ATOM 4230 HD22 ASN D 77 50.771 28.982 37.522 1.00 0.00 H ATOM 4231 HD21 ASN D 77 49.712 28.055 38.646 1.00 0.00 H ATOM 4232 H ASN D 77 50.384 26.196 34.601 1.00 0.00 H ATOM 4233 N ALA D 78 50.102 28.185 32.039 1.00 25.76 N ATOM 4234 CA ALA D 78 50.282 28.848 30.754 1.00 26.14 C ATOM 4235 C ALA D 78 49.240 28.385 29.747 1.00 21.96 C ATOM 4236 O ALA D 78 48.727 29.193 28.964 1.00 25.36 O ATOM 4237 CB ALA D 78 51.693 28.595 30.224 1.00 23.85 C ATOM 4238 H ALA D 78 50.779 27.457 32.343 1.00 0.00 H ATOM 4239 N LYS D 79 48.921 27.094 29.746 1.00 20.60 N ATOM 4240 CA LYS D 79 47.927 26.538 28.840 1.00 22.88 C ATOM 4241 C LYS D 79 46.529 26.508 29.435 1.00 20.26 C ATOM 4242 O LYS D 79 45.606 26.025 28.769 1.00 20.75 O ATOM 4243 CB LYS D 79 48.314 25.116 28.424 1.00 26.95 C ATOM 4244 CG LYS D 79 49.757 24.952 28.006 1.00 30.42 C ATOM 4245 CD LYS D 79 49.931 23.728 27.127 1.00 32.13 C ATOM 4246 CE LYS D 79 49.971 22.455 27.953 1.00 33.77 C ATOM 4247 NZ LYS D 79 50.883 21.431 27.354 1.00 31.04 N ATOM 4248 HZ1 LYS D 79 50.551 21.190 26.398 1.00 0.00 H ATOM 4249 HZ2 LYS D 79 51.848 21.816 27.301 1.00 0.00 H ATOM 4250 HZ3 LYS D 79 50.882 20.577 27.948 1.00 0.00 H ATOM 4251 H LYS D 79 49.399 26.459 30.417 1.00 0.00 H ATOM 4252 N LYS D 80 46.363 26.991 30.667 1.00 19.32 N ATOM 4253 CA LYS D 80 45.078 26.986 31.354 1.00 18.31 C ATOM 4254 C LYS D 80 44.425 25.606 31.293 1.00 17.48 C ATOM 4255 O LYS D 80 43.237 25.462 30.997 1.00 18.67 O ATOM 4256 CB LYS D 80 44.161 28.068 30.779 1.00 18.30 C ATOM 4257 CG LYS D 80 44.589 29.482 31.167 1.00 27.74 C ATOM 4258 CD LYS D 80 44.202 30.522 30.121 1.00 27.27 C ATOM 4259 CE LYS D 80 42.701 30.606 29.937 1.00 24.49 C ATOM 4260 NZ LYS D 80 42.301 31.732 29.036 1.00 30.78 N ATOM 4261 HZ1 LYS D 80 42.627 32.632 29.442 1.00 0.00 H ATOM 4262 HZ2 LYS D 80 42.734 31.596 28.100 1.00 0.00 H ATOM 4263 HZ3 LYS D 80 41.265 31.748 28.942 1.00 0.00 H ATOM 4264 H LYS D 80 47.188 27.389 31.160 1.00 0.00 H ATOM 4265 N THR D 81 45.219 24.573 31.588 1.00 14.41 N ATOM 4266 CA THR D 81 44.765 23.192 31.503 1.00 13.27 C ATOM 4267 C THR D 81 45.020 22.484 32.825 1.00 14.52 C ATOM 4268 O THR D 81 46.054 22.696 33.461 1.00 13.27 O ATOM 4269 CB THR D 81 45.459 22.461 30.347 1.00 19.09 C ATOM 4270 OG1 THR D 81 45.230 23.195 29.140 1.00 22.91 O ATOM 4271 CG2 THR D 81 44.906 21.050 30.174 1.00 17.56 C ATOM 4272 HG1 THR D 81 45.602 24.108 29.234 1.00 0.00 H ATOM 4273 H THR D 81 46.196 24.762 31.889 1.00 0.00 H ATOM 4274 N LEU D 82 44.052 21.681 33.254 1.00 12.72 N ATOM 4275 CA LEU D 82 44.175 20.857 34.449 1.00 12.53 C ATOM 4276 C LEU D 82 44.208 19.399 34.021 1.00 13.41 C ATOM 4277 O LEU D 82 43.475 18.996 33.114 1.00 14.02 O ATOM 4278 CB LEU D 82 43.006 21.114 35.406 1.00 10.91 C ATOM 4279 CG LEU D 82 43.002 20.450 36.786 1.00 10.91 C ATOM 4280 CD1 LEU D 82 44.101 21.061 37.638 1.00 10.42 C ATOM 4281 CD2 LEU D 82 41.650 20.602 37.474 1.00 10.05 C ATOM 4282 H LEU D 82 43.166 21.639 32.712 1.00 0.00 H ATOM 4283 N TYR D 83 45.071 18.612 34.656 1.00 12.21 N ATOM 4284 CA TYR D 83 45.245 17.218 34.290 1.00 13.25 C ATOM 4285 C TYR D 83 44.965 16.318 35.478 1.00 9.34 C ATOM 4286 O TYR D 83 45.239 16.674 36.625 1.00 12.37 O ATOM 4287 CB TYR D 83 46.671 16.930 33.797 1.00 12.49 C ATOM 4288 CG TYR D 83 47.052 17.666 32.530 1.00 17.91 C ATOM 4289 CD1 TYR D 83 46.682 17.174 31.287 1.00 18.52 C ATOM 4290 CD2 TYR D 83 47.781 18.851 32.580 1.00 19.29 C ATOM 4291 CE1 TYR D 83 47.018 17.845 30.125 1.00 22.71 C ATOM 4292 CE2 TYR D 83 48.131 19.526 31.417 1.00 21.11 C ATOM 4293 CZ TYR D 83 47.746 19.014 30.195 1.00 26.14 C ATOM 4294 OH TYR D 83 48.083 19.684 29.037 1.00 29.45 O ATOM 4295 HH TYR D 83 47.733 19.187 28.256 1.00 0.00 H ATOM 4296 H TYR D 83 45.636 19.005 35.435 1.00 0.00 H ATOM 4297 N LEU D 84 44.396 15.160 35.189 1.00 9.41 N ATOM 4298 CA LEU D 84 44.251 14.082 36.160 1.00 8.67 C ATOM 4299 C LEU D 84 44.901 12.844 35.556 1.00 12.35 C ATOM 4300 O LEU D 84 44.364 12.230 34.626 1.00 10.86 O ATOM 4301 CB LEU D 84 42.783 13.833 36.521 1.00 10.57 C ATOM 4302 CG LEU D 84 42.611 12.846 37.679 1.00 12.27 C ATOM 4303 CD1 LEU D 84 43.231 13.437 38.952 1.00 12.47 C ATOM 4304 CD2 LEU D 84 41.140 12.497 37.900 1.00 11.78 C ATOM 4305 H LEU D 84 44.035 15.011 34.225 1.00 0.00 H ATOM 4306 N GLN D 85 46.073 12.493 36.064 1.00 12.22 N ATOM 4307 CA GLN D 85 46.768 11.298 35.628 1.00 11.68 C ATOM 4308 C GLN D 85 46.305 10.138 36.487 1.00 9.72 C ATOM 4309 O GLN D 85 46.508 10.144 37.706 1.00 12.28 O ATOM 4310 CB GLN D 85 48.273 11.480 35.752 1.00 11.66 C ATOM 4311 CG GLN D 85 49.030 10.243 35.361 1.00 12.13 C ATOM 4312 CD GLN D 85 48.817 9.910 33.907 1.00 14.32 C ATOM 4313 OE1 GLN D 85 49.002 10.764 33.045 1.00 19.26 O ATOM 4314 NE2 GLN D 85 48.409 8.673 33.627 1.00 13.76 N ATOM 4315 HE22 GLN D 85 48.267 7.986 34.395 1.00 0.00 H ATOM 4316 HE21 GLN D 85 48.233 8.394 32.641 1.00 0.00 H ATOM 4317 H GLN D 85 46.506 13.091 36.796 1.00 0.00 H ATOM 4318 N MET D 86 45.679 9.154 35.862 1.00 12.41 N ATOM 4319 CA MET D 86 45.098 8.025 36.576 1.00 11.95 C ATOM 4320 C MET D 86 45.878 6.777 36.192 1.00 15.00 C ATOM 4321 O MET D 86 45.715 6.242 35.092 1.00 21.88 O ATOM 4322 CB MET D 86 43.612 7.869 36.259 1.00 13.89 C ATOM 4323 CG MET D 86 42.823 9.163 36.267 1.00 13.19 C ATOM 4324 SD MET D 86 41.251 8.948 35.389 1.00 24.33 S ATOM 4325 CE MET D 86 40.249 8.205 36.661 1.00 18.67 C ATOM 4326 H MET D 86 45.599 9.188 34.826 1.00 0.00 H ATOM 4327 N ASN D 87 46.713 6.311 37.098 1.00 9.65 N ATOM 4328 CA ASN D 87 47.385 5.034 36.943 1.00 11.77 C ATOM 4329 C ASN D 87 46.720 3.995 37.829 1.00 16.91 C ATOM 4330 O ASN D 87 45.936 4.324 38.722 1.00 15.02 O ATOM 4331 CB ASN D 87 48.868 5.169 37.285 1.00 11.01 C ATOM 4332 CG ASN D 87 49.594 6.074 36.324 1.00 11.32 C ATOM 4333 OD1 ASN D 87 49.456 5.941 35.119 1.00 13.27 O ATOM 4334 ND2 ASN D 87 50.373 7.001 36.858 1.00 12.25 N ATOM 4335 HD22 ASN D 87 50.459 7.076 37.892 1.00 0.00 H ATOM 4336 HD21 ASN D 87 50.899 7.655 36.244 1.00 0.00 H ATOM 4337 H ASN D 87 46.897 6.876 37.952 1.00 0.00 H ATOM 4338 N SER D 88 47.033 2.728 37.554 1.00 18.10 N ATOM 4339 CA SER D 88 46.606 1.611 38.393 1.00 18.20 C ATOM 4340 C SER D 88 45.095 1.625 38.591 1.00 16.38 C ATOM 4341 O SER D 88 44.589 1.508 39.712 1.00 17.15 O ATOM 4342 CB SER D 88 47.325 1.642 39.738 1.00 18.96 C ATOM 4343 OG SER D 88 48.724 1.707 39.541 1.00 28.49 O ATOM 4344 HG SER D 88 49.179 1.727 40.420 1.00 0.00 H ATOM 4345 H SER D 88 47.604 2.527 36.708 1.00 0.00 H ATOM 4346 N LEU D 89 44.374 1.783 37.485 1.00 16.38 N ATOM 4347 CA LEU D 89 42.934 1.986 37.563 1.00 16.83 C ATOM 4348 C LEU D 89 42.228 0.715 38.017 1.00 19.27 C ATOM 4349 O LEU D 89 42.622 -0.397 37.660 1.00 19.66 O ATOM 4350 CB LEU D 89 42.392 2.428 36.210 1.00 19.22 C ATOM 4351 CG LEU D 89 42.511 3.923 35.942 1.00 12.79 C ATOM 4352 CD1 LEU D 89 42.346 4.231 34.463 1.00 17.61 C ATOM 4353 CD2 LEU D 89 41.509 4.721 36.775 1.00 19.65 C ATOM 4354 H LEU D 89 44.842 1.761 36.557 1.00 0.00 H ATOM 4355 N LYS D 90 41.175 0.889 38.806 1.00 20.22 N ATOM 4356 CA LYS D 90 40.359 -0.199 39.318 1.00 22.26 C ATOM 4357 C LYS D 90 38.934 -0.049 38.803 1.00 20.05 C ATOM 4358 O LYS D 90 38.519 1.051 38.421 1.00 20.25 O ATOM 4359 CB LYS D 90 40.359 -0.207 40.856 1.00 18.55 C ATOM 4360 CG LYS D 90 41.736 -0.073 41.478 1.00 21.39 C ATOM 4361 CD LYS D 90 41.658 0.501 42.890 1.00 24.84 C ATOM 4362 CE LYS D 90 42.855 0.080 43.721 1.00 27.31 C ATOM 4363 NZ LYS D 90 42.809 -1.376 44.025 1.00 28.08 N ATOM 4364 HZ1 LYS D 90 41.941 -1.591 44.557 1.00 0.00 H ATOM 4365 HZ2 LYS D 90 42.814 -1.915 43.136 1.00 0.00 H ATOM 4366 HZ3 LYS D 90 43.639 -1.636 44.594 1.00 0.00 H ATOM 4367 H LYS D 90 40.919 1.861 39.073 1.00 0.00 H ATOM 4368 N PRO D 91 38.151 -1.135 38.772 1.00 22.49 N ATOM 4369 CA PRO D 91 36.755 -1.000 38.319 1.00 19.66 C ATOM 4370 C PRO D 91 35.957 0.044 39.081 1.00 20.01 C ATOM 4371 O PRO D 91 35.114 0.721 38.481 1.00 24.10 O ATOM 4372 CB PRO D 91 36.183 -2.406 38.535 1.00 21.27 C ATOM 4373 CG PRO D 91 37.369 -3.306 38.410 1.00 25.01 C ATOM 4374 CD PRO D 91 38.524 -2.541 39.005 1.00 22.12 C ATOM 4375 N GLU D 92 36.197 0.201 40.384 1.00 22.03 N ATOM 4376 CA GLU D 92 35.470 1.172 41.194 1.00 20.40 C ATOM 4377 C GLU D 92 35.821 2.617 40.857 1.00 24.63 C ATOM 4378 O GLU D 92 35.152 3.530 41.354 1.00 24.40 O ATOM 4379 CB GLU D 92 35.730 0.910 42.676 1.00 22.51 C ATOM 4380 CG GLU D 92 35.786 -0.572 43.042 1.00 28.58 C ATOM 4381 CD GLU D 92 37.168 -1.179 42.849 1.00 31.49 C ATOM 4382 OE1 GLU D 92 37.332 -2.006 41.925 1.00 32.96 O ATOM 4383 OE2 GLU D 92 38.091 -0.828 43.621 1.00 36.45 O ATOM 4384 H GLU D 92 36.925 -0.388 40.836 1.00 0.00 H ATOM 4385 N ASP D 93 36.852 2.853 40.045 1.00 21.12 N ATOM 4386 CA ASP D 93 37.092 4.192 39.528 1.00 18.92 C ATOM 4387 C ASP D 93 36.143 4.557 38.396 1.00 16.18 C ATOM 4388 O ASP D 93 36.161 5.704 37.945 1.00 17.95 O ATOM 4389 CB ASP D 93 38.540 4.334 39.034 1.00 15.24 C ATOM 4390 CG ASP D 93 39.562 4.126 40.135 1.00 21.51 C ATOM 4391 OD1 ASP D 93 39.375 4.667 41.244 1.00 17.68 O ATOM 4392 OD2 ASP D 93 40.561 3.422 39.890 1.00 20.13 O ATOM 4393 H ASP D 93 37.489 2.075 39.779 1.00 0.00 H ATOM 4394 N THR D 94 35.336 3.611 37.919 1.00 17.36 N ATOM 4395 CA THR D 94 34.393 3.894 36.845 1.00 16.27 C ATOM 4396 C THR D 94 33.420 4.992 37.256 1.00 20.58 C ATOM 4397 O THR D 94 32.915 5.011 38.380 1.00 23.80 O ATOM 4398 CB THR D 94 33.627 2.619 36.474 1.00 23.68 C ATOM 4399 OG1 THR D 94 34.521 1.677 35.871 1.00 22.57 O ATOM 4400 CG2 THR D 94 32.483 2.914 35.514 1.00 24.24 C ATOM 4401 HG1 THR D 94 35.243 1.453 36.511 1.00 0.00 H ATOM 4402 H THR D 94 35.380 2.653 38.321 1.00 0.00 H ATOM 4403 N GLY D 95 33.175 5.919 36.344 1.00 18.01 N ATOM 4404 CA GLY D 95 32.243 6.995 36.598 1.00 19.80 C ATOM 4405 C GLY D 95 32.411 8.098 35.586 1.00 18.73 C ATOM 4406 O GLY D 95 33.311 8.080 34.739 1.00 21.15 O ATOM 4407 H GLY D 95 33.662 5.873 35.426 1.00 0.00 H ATOM 4408 N MET D 96 31.508 9.068 35.673 1.00 20.25 N ATOM 4409 CA MET D 96 31.620 10.278 34.877 1.00 20.81 C ATOM 4410 C MET D 96 32.482 11.262 35.654 1.00 22.77 C ATOM 4411 O MET D 96 32.117 11.675 36.762 1.00 21.09 O ATOM 4412 CB MET D 96 30.244 10.864 34.562 1.00 25.16 C ATOM 4413 CG MET D 96 30.283 12.176 33.796 1.00 22.75 C ATOM 4414 SD MET D 96 30.805 12.034 32.068 1.00 32.81 S ATOM 4415 CE MET D 96 29.308 11.390 31.320 1.00 25.38 C ATOM 4416 H MET D 96 30.704 8.959 36.324 1.00 0.00 H ATOM 4417 N TYR D 97 33.636 11.604 35.095 1.00 24.07 N ATOM 4418 CA TYR D 97 34.569 12.514 35.745 1.00 17.01 C ATOM 4419 C TYR D 97 34.327 13.914 35.215 1.00 19.39 C ATOM 4420 O TYR D 97 34.417 14.151 34.007 1.00 26.58 O ATOM 4421 CB TYR D 97 36.014 12.093 35.504 1.00 19.09 C ATOM 4422 CG TYR D 97 36.427 10.958 36.384 1.00 17.38 C ATOM 4423 CD1 TYR D 97 35.946 9.679 36.164 1.00 16.59 C ATOM 4424 CD2 TYR D 97 37.297 11.159 37.445 1.00 15.71 C ATOM 4425 CE1 TYR D 97 36.317 8.635 36.967 1.00 17.16 C ATOM 4426 CE2 TYR D 97 37.671 10.123 38.256 1.00 15.26 C ATOM 4427 CZ TYR D 97 37.182 8.863 38.016 1.00 13.36 C ATOM 4428 OH TYR D 97 37.553 7.827 38.812 1.00 14.73 O ATOM 4429 HH TYR D 97 37.111 6.998 38.500 1.00 0.00 H ATOM 4430 H TYR D 97 33.882 11.210 34.164 1.00 0.00 H ATOM 4431 N ARG D 98 34.010 14.833 36.112 1.00 13.61 N ATOM 4432 CA ARG D 98 33.703 16.196 35.729 1.00 16.14 C ATOM 4433 C ARG D 98 34.685 17.130 36.406 1.00 15.79 C ATOM 4434 O ARG D 98 35.019 16.957 37.584 1.00 15.12 O ATOM 4435 CB ARG D 98 32.266 16.592 36.108 1.00 19.06 C ATOM 4436 CG ARG D 98 31.209 15.544 35.822 1.00 23.61 C ATOM 4437 CD ARG D 98 29.817 16.149 35.966 1.00 25.48 C ATOM 4438 NE ARG D 98 29.604 17.240 35.018 1.00 24.11 N ATOM 4439 CZ ARG D 98 28.648 18.157 35.126 1.00 28.26 C ATOM 4440 NH1 ARG D 98 27.803 18.125 36.140 1.00 33.26 N ATOM 4441 NH2 ARG D 98 28.536 19.110 34.211 1.00 29.08 N ATOM 4442 HE ARG D 98 30.245 17.304 34.202 1.00 0.00 H ATOM 4443 HH12 ARG D 98 27.057 18.846 36.218 1.00 0.00 H ATOM 4444 HH11 ARG D 98 27.883 17.379 36.860 1.00 0.00 H ATOM 4445 HH22 ARG D 98 27.788 19.827 34.296 1.00 0.00 H ATOM 4446 HH21 ARG D 98 29.196 19.140 33.408 1.00 0.00 H ATOM 4447 H ARG D 98 33.980 14.570 37.118 1.00 0.00 H ATOM 4448 N CYS D 99 35.127 18.121 35.657 1.00 14.92 N ATOM 4449 CA CYS D 99 35.953 19.175 36.204 1.00 13.71 C ATOM 4450 C CYS D 99 35.074 20.305 36.726 1.00 13.96 C ATOM 4451 O CYS D 99 33.990 20.571 36.198 1.00 17.24 O ATOM 4452 CB CYS D 99 36.920 19.683 35.139 1.00 16.04 C ATOM 4453 SG CYS D 99 38.142 20.802 35.773 1.00 18.89 S ATOM 4454 H CYS D 99 34.876 18.145 34.648 1.00 0.00 H ATOM 4455 N ALA D 100 35.544 20.959 37.785 1.00 11.55 N ATOM 4456 CA ALA D 100 34.798 22.041 38.405 1.00 11.33 C ATOM 4457 C ALA D 100 35.790 23.059 38.936 1.00 11.35 C ATOM 4458 O ALA D 100 36.942 22.727 39.243 1.00 12.23 O ATOM 4459 CB ALA D 100 33.887 21.540 39.534 1.00 10.68 C ATOM 4460 H ALA D 100 36.468 20.689 38.179 1.00 0.00 H ATOM 4461 N SER D 101 35.341 24.306 39.037 1.00 11.88 N ATOM 4462 CA SER D 101 36.199 25.356 39.558 1.00 11.92 C ATOM 4463 C SER D 101 35.352 26.349 40.339 1.00 10.71 C ATOM 4464 O SER D 101 34.140 26.469 40.126 1.00 13.09 O ATOM 4465 CB SER D 101 36.978 26.049 38.438 1.00 16.39 C ATOM 4466 OG SER D 101 36.113 26.725 37.551 1.00 16.21 O ATOM 4467 HG SER D 101 35.601 27.411 38.049 1.00 0.00 H ATOM 4468 H SER D 101 34.370 24.531 38.741 1.00 0.00 H ATOM 4469 N THR D 102 36.018 27.061 41.248 1.00 12.32 N ATOM 4470 CA THR D 102 35.354 28.027 42.112 1.00 14.81 C ATOM 4471 C THR D 102 36.404 28.882 42.807 1.00 16.60 C ATOM 4472 O THR D 102 37.531 28.437 43.055 1.00 15.82 O ATOM 4473 CB THR D 102 34.453 27.340 43.151 1.00 15.00 C ATOM 4474 OG1 THR D 102 33.674 28.333 43.829 1.00 17.01 O ATOM 4475 CG2 THR D 102 35.286 26.576 44.170 1.00 17.01 C ATOM 4476 HG1 THR D 102 33.092 27.894 44.499 1.00 0.00 H ATOM 4477 H THR D 102 37.044 26.922 41.343 1.00 0.00 H ATOM 4478 N ARG D 103 36.010 30.116 43.122 1.00 15.00 N ATOM 4479 CA ARG D 103 36.873 31.022 43.866 1.00 18.25 C ATOM 4480 C ARG D 103 36.928 30.687 45.354 1.00 16.44 C ATOM 4481 O ARG D 103 37.974 30.872 45.985 1.00 17.68 O ATOM 4482 CB ARG D 103 36.390 32.458 43.664 1.00 24.05 C ATOM 4483 CG ARG D 103 37.114 33.496 44.492 1.00 27.52 C ATOM 4484 CD ARG D 103 36.795 34.898 43.998 1.00 29.32 C ATOM 4485 NE ARG D 103 36.955 35.012 42.550 1.00 36.56 N ATOM 4486 CZ ARG D 103 35.943 35.119 41.693 1.00 36.94 C ATOM 4487 NH1 ARG D 103 34.693 35.124 42.141 1.00 38.72 N ATOM 4488 NH2 ARG D 103 36.180 35.219 40.391 1.00 33.52 N ATOM 4489 HE ARG D 103 37.921 35.009 42.165 1.00 0.00 H ATOM 4490 HH12 ARG D 103 33.901 35.208 41.472 1.00 0.00 H ATOM 4491 HH11 ARG D 103 34.506 35.044 43.161 1.00 0.00 H ATOM 4492 HH22 ARG D 103 35.387 35.303 39.723 1.00 0.00 H ATOM 4493 HH21 ARG D 103 37.158 35.214 40.039 1.00 0.00 H ATOM 4494 H ARG D 103 35.065 30.438 42.830 1.00 0.00 H ATOM 4495 N PHE D 104 35.830 30.203 45.933 1.00 15.34 N ATOM 4496 CA PHE D 104 35.752 29.938 47.366 1.00 17.34 C ATOM 4497 C PHE D 104 35.061 28.605 47.606 1.00 17.74 C ATOM 4498 O PHE D 104 34.085 28.279 46.926 1.00 16.84 O ATOM 4499 CB PHE D 104 34.945 31.000 48.130 1.00 22.10 C ATOM 4500 CG PHE D 104 35.458 32.406 48.003 1.00 19.11 C ATOM 4501 CD1 PHE D 104 36.556 32.836 48.737 1.00 20.83 C ATOM 4502 CD2 PHE D 104 34.794 33.320 47.203 1.00 22.44 C ATOM 4503 CE1 PHE D 104 37.002 34.145 48.636 1.00 21.74 C ATOM 4504 CE2 PHE D 104 35.233 34.630 47.107 1.00 22.07 C ATOM 4505 CZ PHE D 104 36.336 35.040 47.820 1.00 19.60 C ATOM 4506 H PHE D 104 34.997 30.007 45.342 1.00 0.00 H ATOM 4507 N ALA D 105 35.532 27.863 48.610 1.00 14.70 N ATOM 4508 CA ALA D 105 34.853 26.638 49.015 1.00 12.93 C ATOM 4509 C ALA D 105 35.264 26.271 50.435 1.00 16.61 C ATOM 4510 O ALA D 105 36.455 26.283 50.759 1.00 15.57 O ATOM 4511 CB ALA D 105 35.167 25.489 48.053 1.00 15.16 C ATOM 4512 H ALA D 105 36.394 28.162 49.110 1.00 0.00 H ATOM 4513 N GLY D 106 34.279 25.908 51.263 1.00 14.85 N ATOM 4514 CA GLY D 106 34.576 25.521 52.634 1.00 13.09 C ATOM 4515 C GLY D 106 35.409 24.257 52.729 1.00 14.55 C ATOM 4516 O GLY D 106 36.247 24.121 53.622 1.00 15.73 O ATOM 4517 H GLY D 106 33.295 25.902 50.925 1.00 0.00 H ATOM 4518 N ARG D 107 35.180 23.310 51.824 1.00 14.10 N ATOM 4519 CA ARG D 107 36.033 22.140 51.668 1.00 14.62 C ATOM 4520 C ARG D 107 36.251 21.919 50.186 1.00 11.05 C ATOM 4521 O ARG D 107 35.341 22.159 49.387 1.00 14.33 O ATOM 4522 CB ARG D 107 35.419 20.874 52.271 1.00 15.85 C ATOM 4523 CG ARG D 107 34.981 21.015 53.700 1.00 15.31 C ATOM 4524 CD ARG D 107 36.181 21.093 54.617 1.00 16.59 C ATOM 4525 NE ARG D 107 35.797 20.755 55.986 1.00 16.34 N ATOM 4526 CZ ARG D 107 36.634 20.772 57.018 1.00 18.35 C ATOM 4527 NH1 ARG D 107 37.901 21.111 56.839 1.00 21.13 N ATOM 4528 NH2 ARG D 107 36.204 20.449 58.229 1.00 17.34 N ATOM 4529 HE ARG D 107 34.809 20.485 56.163 1.00 0.00 H ATOM 4530 HH12 ARG D 107 38.555 21.124 57.647 1.00 0.00 H ATOM 4531 HH11 ARG D 107 38.242 21.364 55.890 1.00 0.00 H ATOM 4532 HH22 ARG D 107 36.861 20.463 59.035 1.00 0.00 H ATOM 4533 HH21 ARG D 107 35.209 20.181 58.373 1.00 0.00 H ATOM 4534 H ARG D 107 34.354 23.409 51.199 1.00 0.00 H ATOM 4535 N TRP D 108 37.451 21.454 49.826 1.00 11.55 N ATOM 4536 CA TRP D 108 37.767 21.255 48.416 1.00 11.26 C ATOM 4537 C TRP D 108 36.816 20.266 47.756 1.00 10.56 C ATOM 4538 O TRP D 108 36.567 20.366 46.551 1.00 9.76 O ATOM 4539 CB TRP D 108 39.218 20.798 48.256 1.00 10.54 C ATOM 4540 CG TRP D 108 39.517 19.388 48.711 1.00 9.48 C ATOM 4541 CD1 TRP D 108 40.009 18.997 49.926 1.00 9.73 C ATOM 4542 CD2 TRP D 108 39.363 18.190 47.942 1.00 9.55 C ATOM 4543 NE1 TRP D 108 40.159 17.634 49.961 1.00 11.85 N ATOM 4544 CE2 TRP D 108 39.769 17.113 48.756 1.00 11.33 C ATOM 4545 CE3 TRP D 108 38.912 17.922 46.646 1.00 9.59 C ATOM 4546 CZ2 TRP D 108 39.745 15.793 48.313 1.00 9.77 C ATOM 4547 CZ3 TRP D 108 38.889 16.617 46.206 1.00 10.36 C ATOM 4548 CH2 TRP D 108 39.302 15.564 47.035 1.00 10.62 C ATOM 4549 HE1 TRP D 108 40.512 17.085 50.771 1.00 0.00 H ATOM 4550 H TRP D 108 38.161 21.233 50.553 1.00 0.00 H ATOM 4551 N TYR D 109 36.278 19.310 48.514 1.00 9.38 N ATOM 4552 CA TYR D 109 35.463 18.231 47.964 1.00 10.18 C ATOM 4553 C TYR D 109 33.970 18.506 48.038 1.00 13.06 C ATOM 4554 O TYR D 109 33.178 17.614 47.730 1.00 16.40 O ATOM 4555 CB TYR D 109 35.774 16.915 48.689 1.00 10.69 C ATOM 4556 CG TYR D 109 35.694 17.024 50.199 1.00 15.50 C ATOM 4557 CD1 TYR D 109 34.482 16.887 50.860 1.00 17.28 C ATOM 4558 CD2 TYR D 109 36.833 17.269 50.958 1.00 11.78 C ATOM 4559 CE1 TYR D 109 34.404 17.009 52.244 1.00 15.66 C ATOM 4560 CE2 TYR D 109 36.763 17.385 52.332 1.00 14.38 C ATOM 4561 CZ TYR D 109 35.552 17.251 52.966 1.00 19.26 C ATOM 4562 OH TYR D 109 35.505 17.374 54.338 1.00 23.62 O ATOM 4563 HH TYR D 109 36.082 16.683 54.750 1.00 0.00 H ATOM 4564 H TYR D 109 36.446 19.334 49.540 1.00 0.00 H ATOM 4565 N ARG D 110 33.566 19.693 48.456 1.00 14.51 N ATOM 4566 CA ARG D 110 32.144 20.001 48.560 1.00 17.07 C ATOM 4567 C ARG D 110 31.684 20.550 47.221 1.00 13.30 C ATOM 4568 O ARG D 110 31.834 21.741 46.935 1.00 13.61 O ATOM 4569 CB ARG D 110 31.876 20.964 49.704 1.00 20.84 C ATOM 4570 CG ARG D 110 31.243 20.240 50.844 1.00 25.73 C ATOM 4571 CD ARG D 110 30.264 21.113 51.570 1.00 20.41 C ATOM 4572 NE ARG D 110 30.925 21.959 52.551 1.00 24.94 N ATOM 4573 CZ ARG D 110 31.555 21.500 53.627 1.00 22.16 C ATOM 4574 NH1 ARG D 110 31.622 20.199 53.871 1.00 23.57 N ATOM 4575 NH2 ARG D 110 32.116 22.349 54.463 1.00 22.88 N ATOM 4576 HE ARG D 110 30.903 22.988 52.401 1.00 0.00 H ATOM 4577 HH12 ARG D 110 32.118 19.853 54.717 1.00 0.00 H ATOM 4578 HH11 ARG D 110 31.178 19.524 53.216 1.00 0.00 H ATOM 4579 HH22 ARG D 110 32.611 21.997 55.307 1.00 0.00 H ATOM 4580 HH21 ARG D 110 32.064 23.371 54.279 1.00 0.00 H ATOM 4581 H ARG D 110 34.269 20.415 48.713 1.00 0.00 H ATOM 4582 N ASP D 111 31.119 19.666 46.403 1.00 13.02 N ATOM 4583 CA ASP D 111 30.726 20.042 45.052 1.00 17.22 C ATOM 4584 C ASP D 111 29.619 21.088 45.026 1.00 17.00 C ATOM 4585 O ASP D 111 29.497 21.801 44.026 1.00 15.42 O ATOM 4586 CB ASP D 111 30.287 18.808 44.270 1.00 17.18 C ATOM 4587 CG ASP D 111 29.172 18.060 44.953 1.00 22.92 C ATOM 4588 OD1 ASP D 111 29.456 17.335 45.932 1.00 27.73 O ATOM 4589 OD2 ASP D 111 28.012 18.202 44.520 1.00 26.07 O ATOM 4590 H ASP D 111 30.956 18.693 46.733 1.00 0.00 H ATOM 4591 N SER D 112 28.818 21.206 46.091 1.00 16.51 N ATOM 4592 CA SER D 112 27.754 22.206 46.073 1.00 14.02 C ATOM 4593 C SER D 112 28.299 23.626 46.098 1.00 16.52 C ATOM 4594 O SER D 112 27.569 24.562 45.760 1.00 20.78 O ATOM 4595 CB SER D 112 26.802 21.993 47.245 1.00 15.44 C ATOM 4596 OG SER D 112 27.505 22.041 48.463 1.00 18.17 O ATOM 4597 HG SER D 112 28.194 21.330 48.473 1.00 0.00 H ATOM 4598 H SER D 112 28.951 20.594 46.921 1.00 0.00 H ATOM 4599 N GLU D 113 29.555 23.816 46.487 1.00 13.58 N ATOM 4600 CA GLU D 113 30.150 25.142 46.498 1.00 17.45 C ATOM 4601 C GLU D 113 30.788 25.513 45.165 1.00 11.76 C ATOM 4602 O GLU D 113 31.264 26.635 45.020 1.00 16.81 O ATOM 4603 CB GLU D 113 31.194 25.236 47.616 1.00 17.93 C ATOM 4604 CG GLU D 113 30.629 24.922 48.997 1.00 23.78 C ATOM 4605 CD GLU D 113 31.574 25.307 50.120 1.00 27.39 C ATOM 4606 OE1 GLU D 113 32.274 24.404 50.631 1.00 28.52 O ATOM 4607 OE2 GLU D 113 31.624 26.501 50.492 1.00 28.68 O ATOM 4608 H GLU D 113 30.124 23.000 46.790 1.00 0.00 H ATOM 4609 N TYR D 114 30.808 24.598 44.199 1.00 13.75 N ATOM 4610 CA TYR D 114 31.378 24.850 42.883 1.00 11.80 C ATOM 4611 C TYR D 114 30.291 25.289 41.908 1.00 13.94 C ATOM 4612 O TYR D 114 29.281 24.596 41.744 1.00 16.26 O ATOM 4613 CB TYR D 114 32.067 23.597 42.348 1.00 14.89 C ATOM 4614 CG TYR D 114 33.376 23.269 43.019 1.00 12.81 C ATOM 4615 CD1 TYR D 114 33.412 22.707 44.298 1.00 10.98 C ATOM 4616 CD2 TYR D 114 34.572 23.500 42.367 1.00 10.35 C ATOM 4617 CE1 TYR D 114 34.634 22.405 44.901 1.00 10.87 C ATOM 4618 CE2 TYR D 114 35.781 23.194 42.954 1.00 9.83 C ATOM 4619 CZ TYR D 114 35.803 22.647 44.210 1.00 8.62 C ATOM 4620 OH TYR D 114 37.017 22.349 44.765 1.00 10.46 O ATOM 4621 HH TYR D 114 36.881 21.963 45.667 1.00 0.00 H ATOM 4622 H TYR D 114 30.399 23.662 44.392 1.00 0.00 H ATOM 4623 N ARG D 115 30.521 26.415 41.230 1.00 16.83 N ATOM 4624 CA ARG D 115 29.518 26.968 40.326 1.00 22.24 C ATOM 4625 C ARG D 115 29.818 26.730 38.854 1.00 23.25 C ATOM 4626 O ARG D 115 28.903 26.823 38.030 1.00 22.48 O ATOM 4627 CB ARG D 115 29.372 28.476 40.552 1.00 24.02 C ATOM 4628 CG ARG D 115 29.692 28.921 41.969 1.00 28.24 C ATOM 4629 CD ARG D 115 28.811 28.218 42.989 1.00 26.23 C ATOM 4630 NE ARG D 115 28.765 28.944 44.253 1.00 27.95 N ATOM 4631 CZ ARG D 115 27.939 28.649 45.250 1.00 29.69 C ATOM 4632 NH1 ARG D 115 27.958 29.368 46.364 1.00 25.99 N ATOM 4633 NH2 ARG D 115 27.083 27.642 45.125 1.00 29.13 N ATOM 4634 HE ARG D 115 29.419 29.742 44.381 1.00 0.00 H ATOM 4635 HH12 ARG D 115 27.310 29.136 47.144 1.00 0.00 H ATOM 4636 HH11 ARG D 115 28.620 30.164 46.458 1.00 0.00 H ATOM 4637 HH22 ARG D 115 26.436 27.410 45.905 1.00 0.00 H ATOM 4638 HH21 ARG D 115 27.060 27.085 44.247 1.00 0.00 H ATOM 4639 H ARG D 115 31.430 26.906 41.348 1.00 0.00 H ATOM 4640 N ALA D 116 31.064 26.451 38.493 1.00 18.78 N ATOM 4641 CA ALA D 116 31.438 26.209 37.107 1.00 18.34 C ATOM 4642 C ALA D 116 31.778 24.739 36.935 1.00 17.17 C ATOM 4643 O ALA D 116 32.603 24.205 37.679 1.00 15.08 O ATOM 4644 CB ALA D 116 32.622 27.083 36.693 1.00 18.49 C ATOM 4645 H ALA D 116 31.800 26.404 39.226 1.00 0.00 H ATOM 4646 N TRP D 117 31.155 24.097 35.948 1.00 19.45 N ATOM 4647 CA TRP D 117 31.286 22.668 35.721 1.00 16.67 C ATOM 4648 C TRP D 117 31.528 22.378 34.248 1.00 20.88 C ATOM 4649 O TRP D 117 31.032 23.087 33.371 1.00 22.57 O ATOM 4650 CB TRP D 117 30.025 21.907 36.172 1.00 18.77 C ATOM 4651 CG TRP D 117 29.883 21.881 37.639 1.00 17.98 C ATOM 4652 CD1 TRP D 117 29.328 22.843 38.423 1.00 18.11 C ATOM 4653 CD2 TRP D 117 30.358 20.860 38.522 1.00 16.80 C ATOM 4654 NE1 TRP D 117 29.408 22.476 39.748 1.00 17.52 N ATOM 4655 CE2 TRP D 117 30.033 21.258 39.833 1.00 14.69 C ATOM 4656 CE3 TRP D 117 31.010 19.635 38.327 1.00 17.09 C ATOM 4657 CZ2 TRP D 117 30.344 20.479 40.953 1.00 15.83 C ATOM 4658 CZ3 TRP D 117 31.321 18.861 39.439 1.00 15.81 C ATOM 4659 CH2 TRP D 117 30.989 19.287 40.734 1.00 16.99 C ATOM 4660 HE1 TRP D 117 29.053 23.031 40.552 1.00 0.00 H ATOM 4661 H TRP D 117 30.545 24.645 35.309 1.00 0.00 H ATOM 4662 N GLY D 118 32.288 21.305 33.993 1.00 19.40 N ATOM 4663 CA GLY D 118 32.385 20.741 32.663 1.00 17.90 C ATOM 4664 C GLY D 118 31.318 19.678 32.447 1.00 23.29 C ATOM 4665 O GLY D 118 30.669 19.218 33.383 1.00 20.27 O ATOM 4666 H GLY D 118 32.822 20.866 34.770 1.00 0.00 H ATOM 4667 N GLN D 119 31.137 19.286 31.184 1.00 25.81 N ATOM 4668 CA GLN D 119 30.097 18.308 30.874 1.00 24.50 C ATOM 4669 C GLN D 119 30.446 16.930 31.410 1.00 26.34 C ATOM 4670 O GLN D 119 29.551 16.150 31.758 1.00 30.08 O ATOM 4671 CB GLN D 119 29.871 18.231 29.365 1.00 28.42 C ATOM 4672 CG GLN D 119 30.174 19.516 28.619 1.00 34.48 C ATOM 4673 CD GLN D 119 29.758 19.446 27.161 1.00 36.40 C ATOM 4674 OE1 GLN D 119 28.641 19.032 26.842 1.00 39.88 O ATOM 4675 NE2 GLN D 119 30.655 19.850 26.267 1.00 37.14 N ATOM 4676 HE22 GLN D 119 31.585 20.192 26.582 1.00 0.00 H ATOM 4677 HE21 GLN D 119 30.426 19.824 25.253 1.00 0.00 H ATOM 4678 H GLN D 119 31.733 19.674 30.425 1.00 0.00 H ATOM 4679 N GLY D 120 31.730 16.613 31.490 1.00 22.31 N ATOM 4680 CA GLY D 120 32.128 15.302 31.938 1.00 23.37 C ATOM 4681 C GLY D 120 32.873 14.520 30.878 1.00 25.73 C ATOM 4682 O GLY D 120 32.715 14.755 29.678 1.00 23.24 O ATOM 4683 H GLY D 120 32.454 17.313 31.229 1.00 0.00 H ATOM 4684 N THR D 121 33.709 13.592 31.319 1.00 25.37 N ATOM 4685 CA THR D 121 34.270 12.576 30.446 1.00 25.11 C ATOM 4686 C THR D 121 34.038 11.234 31.123 1.00 22.19 C ATOM 4687 O THR D 121 34.250 11.094 32.332 1.00 21.80 O ATOM 4688 CB THR D 121 35.760 12.828 30.151 1.00 24.99 C ATOM 4689 OG1 THR D 121 36.291 11.761 29.351 1.00 27.42 O ATOM 4690 CG2 THR D 121 36.569 12.961 31.431 1.00 25.87 C ATOM 4691 HG1 THR D 121 35.794 11.712 28.496 1.00 0.00 H ATOM 4692 H THR D 121 33.973 13.591 32.325 1.00 0.00 H ATOM 4693 N GLN D 122 33.542 10.268 30.361 1.00 21.70 N ATOM 4694 CA GLN D 122 33.233 8.965 30.924 1.00 19.83 C ATOM 4695 C GLN D 122 34.496 8.126 31.038 1.00 18.96 C ATOM 4696 O GLN D 122 35.317 8.091 30.118 1.00 19.68 O ATOM 4697 CB GLN D 122 32.205 8.236 30.061 1.00 22.48 C ATOM 4698 CG GLN D 122 31.751 6.913 30.642 1.00 21.90 C ATOM 4699 CD GLN D 122 31.097 7.062 32.000 1.00 26.29 C ATOM 4700 OE1 GLN D 122 30.373 8.029 32.257 1.00 28.39 O ATOM 4701 NE2 GLN D 122 31.347 6.098 32.884 1.00 27.01 N ATOM 4702 HE22 GLN D 122 31.963 5.301 32.624 1.00 0.00 H ATOM 4703 HE21 GLN D 122 30.926 6.142 33.834 1.00 0.00 H ATOM 4704 H GLN D 122 33.373 10.445 29.350 1.00 0.00 H ATOM 4705 N VAL D 123 34.641 7.449 32.176 1.00 16.97 N ATOM 4706 CA VAL D 123 35.750 6.542 32.436 1.00 21.14 C ATOM 4707 C VAL D 123 35.146 5.206 32.836 1.00 19.49 C ATOM 4708 O VAL D 123 34.375 5.134 33.801 1.00 22.73 O ATOM 4709 CB VAL D 123 36.687 7.072 33.536 1.00 15.36 C ATOM 4710 CG1 VAL D 123 37.738 6.027 33.896 1.00 19.27 C ATOM 4711 CG2 VAL D 123 37.341 8.375 33.087 1.00 18.76 C ATOM 4712 H VAL D 123 33.924 7.575 32.918 1.00 0.00 H ATOM 4713 N THR D 124 35.468 4.159 32.086 1.00 17.49 N ATOM 4714 CA THR D 124 34.930 2.829 32.346 1.00 22.13 C ATOM 4715 C THR D 124 36.100 1.866 32.459 1.00 20.84 C ATOM 4716 O THR D 124 36.825 1.650 31.482 1.00 21.86 O ATOM 4717 CB THR D 124 33.955 2.397 31.248 1.00 25.03 C ATOM 4718 OG1 THR D 124 32.970 3.421 31.053 1.00 24.47 O ATOM 4719 CG2 THR D 124 33.250 1.110 31.650 1.00 26.67 C ATOM 4720 HG1 THR D 124 32.340 3.140 30.343 1.00 0.00 H ATOM 4721 H THR D 124 36.123 4.291 31.289 1.00 0.00 H ATOM 4722 N VAL D 125 36.298 1.311 33.649 1.00 18.52 N ATOM 4723 CA VAL D 125 37.385 0.380 33.913 1.00 22.16 C ATOM 4724 C VAL D 125 36.774 -1.012 34.020 1.00 23.83 C ATOM 4725 O VAL D 125 36.029 -1.301 34.962 1.00 27.12 O ATOM 4726 CB VAL D 125 38.160 0.762 35.183 1.00 21.41 C ATOM 4727 CG1 VAL D 125 39.424 -0.078 35.318 1.00 22.28 C ATOM 4728 CG2 VAL D 125 38.491 2.254 35.178 1.00 21.22 C ATOM 4729 H VAL D 125 35.649 1.552 34.425 1.00 0.00 H ATOM 4730 N SER D 126 37.081 -1.873 33.055 1.00 25.08 N ATOM 4731 CA SER D 126 36.529 -3.228 33.037 1.00 29.33 C ATOM 4732 C SER D 126 37.143 -4.104 34.127 1.00 28.71 C ATOM 4733 O SER D 126 38.069 -4.876 33.870 1.00 37.75 O ATOM 4734 CB SER D 126 36.739 -3.873 31.665 1.00 33.19 C ATOM 4735 OG SER D 126 38.090 -3.777 31.248 1.00 38.10 O ATOM 4736 HG SER D 126 38.670 -4.238 31.904 1.00 0.00 H ATOM 4737 H SER D 126 37.728 -1.577 32.296 1.00 0.00 H TER 4738 SER D 126 HETATM 4739 O HOH 1 8.318 9.915 29.809 1.00 32.30 O HETATM 4740 O HOH 2 17.074 -1.933 5.323 1.00 28.34 O HETATM 4741 O HOH 3 -0.101 22.729 16.093 1.00 26.41 O HETATM 4742 O HOH 4 21.287 7.433 27.113 1.00 28.82 O HETATM 4743 O HOH 5 11.282 16.467 28.406 1.00 31.40 O HETATM 4744 O HOH 6 25.078 0.375 16.569 1.00 31.30 O HETATM 4745 O HOH 7 2.072 21.279 10.379 1.00 23.70 O HETATM 4746 O HOH 8 2.539 2.844 7.237 1.00 32.82 O HETATM 4747 O HOH 9 22.572 5.933 11.551 1.00 26.06 O HETATM 4748 O HOH 10 28.409 0.676 9.947 1.00 31.90 O HETATM 4749 O HOH 11 6.144 16.638 27.084 1.00 35.70 O HETATM 4750 O HOH 12 -1.335 16.848 13.272 1.00 35.09 O HETATM 4751 O HOH 13 22.231 3.567 5.332 1.00 31.40 O HETATM 4752 O HOH 14 26.350 2.296 3.274 1.00 37.59 O HETATM 4753 O HOH 15 9.225 2.550 16.577 1.00 19.69 O HETATM 4754 O HOH 16 19.347 -0.840 26.305 1.00 16.58 O HETATM 4755 O HOH 17 25.007 8.203 4.136 1.00 25.33 O HETATM 4756 O HOH 18 2.461 23.862 21.076 1.00 20.08 O HETATM 4757 O HOH 19 22.816 17.394 15.845 1.00 12.99 O HETATM 4758 O HOH 20 20.653 11.008 13.070 1.00 12.14 O HETATM 4759 O HOH 21 18.157 6.530 12.760 1.00 14.45 O HETATM 4760 O HOH 22 19.158 18.669 24.569 1.00 14.78 O HETATM 4761 O HOH 23 21.088 -0.463 20.924 1.00 27.56 O HETATM 4762 O HOH 24 7.174 25.493 13.111 1.00 18.62 O HETATM 4763 O HOH 25 13.563 7.284 2.437 1.00 23.10 O HETATM 4764 O HOH 26 6.716 0.633 10.484 1.00 20.34 O HETATM 4765 O HOH 27 10.446 32.970 22.796 1.00 16.83 O HETATM 4766 O HOH 28 8.635 14.634 -1.740 1.00 28.44 O HETATM 4767 O HOH 29 24.613 22.261 12.520 1.00 11.35 O HETATM 4768 O HOH 30 6.267 23.991 11.584 1.00 24.07 O HETATM 4769 O HOH 31 22.971 1.322 22.003 1.00 20.56 O HETATM 4770 O HOH 32 16.622 26.094 4.528 1.00 19.21 O HETATM 4771 O HOH 33 21.995 30.688 15.786 1.00 15.49 O HETATM 4772 O HOH 34 0.255 11.175 19.855 1.00 25.54 O HETATM 4773 O HOH 35 -0.655 15.996 10.189 1.00 28.57 O HETATM 4774 O HOH 36 8.645 27.779 24.851 1.00 16.18 O HETATM 4775 O HOH 37 22.669 13.120 10.182 1.00 16.42 O HETATM 4776 O HOH 38 6.716 7.254 23.555 1.00 13.46 O HETATM 4777 O HOH 39 18.014 17.798 26.950 1.00 26.92 O HETATM 4778 O HOH 40 -1.554 12.469 9.672 1.00 25.88 O HETATM 4779 O HOH 41 10.650 5.249 0.528 1.00 19.08 O HETATM 4780 O HOH 42 14.807 -1.261 6.077 1.00 19.89 O HETATM 4781 O HOH 43 13.089 17.582 1.674 1.00 25.11 O HETATM 4782 O HOH 44 -2.177 10.433 5.318 1.00 27.29 O HETATM 4783 O HOH 45 21.060 11.002 26.628 1.00 21.37 O HETATM 4784 O HOH 46 19.542 36.370 18.535 1.00 24.19 O HETATM 4785 O HOH 47 17.347 0.376 20.250 1.00 15.18 O HETATM 4786 O HOH 48 20.380 15.058 26.040 1.00 21.91 O HETATM 4787 O HOH 49 20.582 20.702 7.206 1.00 11.94 O HETATM 4788 O HOH 50 25.572 14.915 18.109 1.00 16.36 O HETATM 4789 O HOH 51 18.526 22.528 25.148 1.00 17.66 O HETATM 4790 O HOH 52 5.582 6.461 27.234 1.00 27.20 O HETATM 4791 O HOH 53 24.100 4.680 13.105 1.00 26.99 O HETATM 4792 O HOH 54 10.985 27.029 8.984 1.00 18.62 O HETATM 4793 O HOH 55 19.279 -2.270 18.273 1.00 32.25 O HETATM 4794 O HOH 56 16.060 24.510 1.062 1.00 23.57 O HETATM 4795 O HOH 57 15.776 -3.966 19.658 1.00 18.01 O HETATM 4796 O HOH 58 16.886 30.450 25.508 1.00 12.50 O HETATM 4797 O HOH 59 0.629 5.763 12.388 1.00 23.77 O HETATM 4798 O HOH 60 15.942 0.785 22.744 1.00 12.93 O HETATM 4799 O HOH 61 12.296 37.211 23.778 1.00 20.73 O HETATM 4800 O HOH 62 4.594 29.095 22.939 1.00 21.81 O HETATM 4801 O HOH 63 12.735 0.396 6.359 1.00 15.14 O HETATM 4802 O HOH 64 8.313 18.194 5.628 1.00 15.62 O HETATM 4803 O HOH 65 -1.278 18.555 11.442 1.00 32.91 O HETATM 4804 O HOH 66 4.755 2.508 8.539 1.00 23.22 O HETATM 4805 O HOH 67 7.111 11.284 25.525 1.00 18.03 O HETATM 4806 O HOH 68 13.339 28.799 6.199 1.00 23.80 O HETATM 4807 O HOH 69 7.969 6.293 30.662 1.00 19.61 O HETATM 4808 O HOH 70 15.967 28.218 6.000 1.00 20.16 O HETATM 4809 O HOH 71 9.109 14.479 26.639 1.00 21.43 O HETATM 4810 O HOH 72 16.320 38.437 17.795 1.00 29.19 O HETATM 4811 O HOH 73 22.029 34.466 14.201 1.00 25.06 O HETATM 4812 O HOH 74 1.758 15.759 22.441 1.00 23.98 O HETATM 4813 O HOH 75 11.332 9.129 2.162 1.00 16.98 O HETATM 4814 O HOH 76 11.072 20.087 27.639 1.00 30.76 O HETATM 4815 O HOH 77 15.127 13.395 26.663 1.00 16.81 O HETATM 4816 O HOH 78 8.047 21.022 5.241 1.00 22.25 O HETATM 4817 O HOH 79 5.728 17.147 6.487 1.00 14.25 O HETATM 4818 O HOH 80 3.971 5.926 20.526 1.00 18.64 O HETATM 4819 O HOH 81 13.037 21.932 28.161 1.00 20.52 O HETATM 4820 O HOH 82 -1.125 6.869 0.975 1.00 33.05 O HETATM 4821 O HOH 83 22.538 22.608 9.456 1.00 16.78 O HETATM 4822 O HOH 84 16.347 34.543 12.478 1.00 21.51 O HETATM 4823 O HOH 85 22.996 9.741 7.867 1.00 19.93 O HETATM 4824 O HOH 86 3.223 24.390 24.528 1.00 26.61 O HETATM 4825 O HOH 87 23.552 24.619 11.207 1.00 16.04 O HETATM 4826 O HOH 88 -3.773 7.621 2.962 1.00 31.37 O HETATM 4827 O HOH 89 17.136 16.031 2.521 1.00 18.06 O HETATM 4828 O HOH 90 23.397 19.822 8.467 1.00 21.21 O HETATM 4829 O HOH 91 1.254 8.483 13.226 1.00 18.52 O HETATM 4830 O HOH 92 20.784 23.993 23.449 1.00 18.84 O HETATM 4831 O HOH 93 10.236 1.182 26.525 1.00 17.11 O HETATM 4832 O HOH 94 3.252 9.877 22.505 1.00 21.71 O HETATM 4833 O HOH 95 1.114 21.149 20.025 1.00 24.69 O HETATM 4834 O HOH 96 3.314 14.759 8.034 1.00 16.10 O HETATM 4835 O HOH 97 5.404 5.131 23.457 1.00 23.07 O HETATM 4836 O HOH 98 10.483 20.009 2.212 1.00 16.30 O HETATM 4837 O HOH 99 24.768 11.079 14.034 1.00 10.85 O HETATM 4838 O HOH 100 12.458 14.660 0.937 1.00 26.27 O HETATM 4839 O HOH 101 9.988 22.644 3.812 1.00 19.16 O HETATM 4840 O HOH 102 10.668 35.342 9.754 1.00 33.10 O HETATM 4841 O HOH 103 21.889 -0.586 13.384 1.00 24.41 O HETATM 4842 O HOH 104 3.603 23.033 11.711 1.00 24.24 O HETATM 4843 O HOH 105 -1.407 15.841 18.647 1.00 25.66 O HETATM 4844 O HOH 106 14.029 37.837 18.947 1.00 22.33 O HETATM 4845 O HOH 107 7.790 21.644 26.619 1.00 22.25 O HETATM 4846 O HOH 108 19.231 -0.497 3.775 1.00 24.80 O HETATM 4847 O HOH 109 4.792 18.091 25.690 1.00 24.82 O HETATM 4848 O HOH 110 24.882 1.779 10.373 1.00 33.96 O HETATM 4849 O HOH 111 7.253 0.394 13.387 1.00 20.59 O HETATM 4850 O HOH 112 1.034 2.912 16.066 1.00 21.99 O HETATM 4851 O HOH 113 22.689 11.180 3.996 1.00 21.88 O HETATM 4852 O HOH 114 6.381 32.672 18.784 1.00 22.55 O HETATM 4853 O HOH 115 19.652 -2.857 5.578 1.00 31.80 O HETATM 4854 O HOH 116 16.586 -2.414 21.179 1.00 20.71 O HETATM 4855 O HOH 117 0.442 11.515 14.084 1.00 23.88 O HETATM 4856 O HOH 118 -0.580 20.452 9.104 1.00 33.46 O HETATM 4857 O HOH 119 22.143 14.239 4.183 1.00 24.77 O HETATM 4858 O HOH 120 17.467 33.190 10.051 1.00 25.38 O HETATM 4859 O HOH 121 4.857 14.763 -2.206 1.00 27.31 O HETATM 4860 O HOH 122 0.470 7.777 15.946 1.00 24.46 O HETATM 4861 O HOH 123 24.639 10.026 5.581 1.00 25.19 O HETATM 4862 O HOH 124 8.269 33.232 24.460 1.00 21.66 O HETATM 4863 O HOH 125 11.109 28.597 7.348 1.00 24.56 O HETATM 4864 O HOH 126 12.050 39.102 17.877 1.00 33.19 O HETATM 4865 O HOH 127 16.439 4.578 1.820 1.00 24.26 O HETATM 4866 O HOH 128 -0.317 23.078 12.044 1.00 26.22 O HETATM 4867 O HOH 129 1.513 18.102 21.920 1.00 36.65 O HETATM 4868 O HOH 130 -1.056 12.276 20.482 1.00 22.11 O HETATM 4869 O HOH 131 31.003 9.496 25.338 1.00 34.66 O HETATM 4870 O HOH 132 4.835 -5.579 23.728 1.00 33.51 O HETATM 4871 O HOH 133 -2.470 22.726 15.000 1.00 29.78 O HETATM 4872 O HOH 134 2.898 28.337 20.364 1.00 27.40 O HETATM 4873 O HOH 135 -1.280 10.832 11.834 1.00 24.08 O HETATM 4874 O HOH 136 9.501 37.093 24.689 1.00 26.17 O HETATM 4875 O HOH 137 3.977 3.371 24.000 1.00 35.56 O HETATM 4876 O HOH 138 23.954 1.562 13.047 1.00 31.33 O HETATM 4877 O HOH 139 23.576 33.909 18.378 1.00 27.38 O HETATM 4878 O HOH 140 20.983 36.742 24.492 1.00 23.45 O HETATM 4879 O HOH 141 6.130 21.531 3.614 1.00 30.93 O HETATM 4880 O HOH 142 2.523 14.595 1.519 1.00 31.81 O HETATM 4881 O HOH 143 -0.356 22.768 9.797 1.00 32.66 O HETATM 4882 O HOH 144 0.688 25.473 22.355 1.00 37.96 O HETATM 4883 O HOH 145 2.419 15.063 -1.146 1.00 33.17 O HETATM 4884 O HOH 146 9.647 36.875 11.110 1.00 37.97 O HETATM 4885 O HOH 147 14.708 35.583 7.840 1.00 30.74 O HETATM 4886 O HOH 148 22.500 19.234 5.841 1.00 22.40 O HETATM 4887 O HOH 149 27.640 2.819 1.455 1.00 37.50 O HETATM 4888 O HOH 150 9.655 17.679 3.150 1.00 20.06 O HETATM 4889 O HOH 151 0.468 21.461 22.357 1.00 38.68 O HETATM 4890 O HOH 152 16.859 36.049 6.512 1.00 40.94 O HETATM 4891 O HOH 153 23.446 36.877 21.436 1.00 28.02 O HETATM 4892 O HOH 154 5.710 23.161 1.759 1.00 29.18 O HETATM 4893 O HOH 155 2.441 17.491 2.296 1.00 40.10 O HETATM 4894 O HOH 156 22.435 25.162 41.746 1.00 20.96 O HETATM 4895 O HOH 157 0.998 24.116 43.046 1.00 30.33 O HETATM 4896 O HOH 158 19.191 47.349 46.277 1.00 29.51 O HETATM 4897 O HOH 159 0.761 31.903 30.612 1.00 23.21 O HETATM 4898 O HOH 160 27.742 30.872 37.773 1.00 29.74 O HETATM 4899 O HOH 161 6.325 25.309 30.316 1.00 23.98 O HETATM 4900 O HOH 162 26.625 48.194 34.395 1.00 26.16 O HETATM 4901 O HOH 163 14.866 41.978 50.590 1.00 24.69 O HETATM 4902 O HOH 164 8.540 35.008 39.001 1.00 13.38 O HETATM 4903 O HOH 165 27.777 35.751 46.049 1.00 34.88 O HETATM 4904 O HOH 166 26.119 37.130 51.622 1.00 35.25 O HETATM 4905 O HOH 167 23.828 25.411 27.871 1.00 33.71 O HETATM 4906 O HOH 168 26.396 48.485 32.052 1.00 25.38 O HETATM 4907 O HOH 169 24.042 27.312 44.306 1.00 19.75 O HETATM 4908 O HOH 170 3.977 43.733 33.987 1.00 19.85 O HETATM 4909 O HOH 171 11.639 50.331 47.993 1.00 28.27 O HETATM 4910 O HOH 172 10.214 42.875 27.630 1.00 16.55 O HETATM 4911 O HOH 173 5.979 58.108 36.975 1.00 32.42 O HETATM 4912 O HOH 174 10.952 30.395 39.624 1.00 13.22 O HETATM 4913 O HOH 175 15.450 22.037 38.841 1.00 22.85 O HETATM 4914 O HOH 176 19.080 23.894 36.604 1.00 28.78 O HETATM 4915 O HOH 177 5.614 44.033 43.188 1.00 23.59 O HETATM 4916 O HOH 178 7.810 22.742 39.538 1.00 21.43 O HETATM 4917 O HOH 179 25.975 27.608 33.200 1.00 28.31 O HETATM 4918 O HOH 180 17.367 44.747 50.205 1.00 20.13 O HETATM 4919 O HOH 181 18.841 44.424 25.276 1.00 20.99 O HETATM 4920 O HOH 182 8.141 35.204 25.738 1.00 23.18 O HETATM 4921 O HOH 183 22.272 32.070 24.521 1.00 24.01 O HETATM 4922 O HOH 184 6.150 41.237 36.208 1.00 10.82 O HETATM 4923 O HOH 185 24.458 31.528 51.011 1.00 28.84 O HETATM 4924 O HOH 186 3.244 39.236 34.410 1.00 20.86 O HETATM 4925 O HOH 187 14.179 37.919 25.776 1.00 16.75 O HETATM 4926 O HOH 188 6.185 36.911 41.712 1.00 16.40 O HETATM 4927 O HOH 189 14.194 55.178 47.793 1.00 29.80 O HETATM 4928 O HOH 190 5.460 39.528 43.367 1.00 20.74 O HETATM 4929 O HOH 191 21.503 57.756 35.765 1.00 35.84 O HETATM 4930 O HOH 192 6.439 54.720 35.864 1.00 32.37 O HETATM 4931 O HOH 193 17.442 51.508 43.073 1.00 23.51 O HETATM 4932 O HOH 194 27.461 32.727 39.637 1.00 22.14 O HETATM 4933 O HOH 195 27.304 40.349 30.267 1.00 23.44 O HETATM 4934 O HOH 196 5.661 34.002 44.195 1.00 16.30 O HETATM 4935 O HOH 197 13.495 25.199 29.534 1.00 14.60 O HETATM 4936 O HOH 198 7.702 44.938 44.759 1.00 15.64 O HETATM 4937 O HOH 199 20.746 31.081 21.256 1.00 11.57 O HETATM 4938 O HOH 200 22.521 41.201 46.186 1.00 18.90 O HETATM 4939 O HOH 201 19.871 42.592 47.009 1.00 18.13 O HETATM 4940 O HOH 202 19.414 38.429 54.547 1.00 28.20 O HETATM 4941 O HOH 203 10.063 23.576 26.226 1.00 16.65 O HETATM 4942 O HOH 204 22.109 35.734 27.011 1.00 15.05 O HETATM 4943 O HOH 205 20.169 39.036 25.924 1.00 22.65 O HETATM 4944 O HOH 206 12.068 24.525 31.943 1.00 18.51 O HETATM 4945 O HOH 207 17.949 41.827 24.167 1.00 26.33 O HETATM 4946 O HOH 208 17.366 18.383 37.816 1.00 30.70 O HETATM 4947 O HOH 209 22.583 31.538 29.288 1.00 15.54 O HETATM 4948 O HOH 210 25.587 34.191 29.234 1.00 30.47 O HETATM 4949 O HOH 211 7.425 23.789 31.627 1.00 34.06 O HETATM 4950 O HOH 212 20.642 52.360 27.598 1.00 16.64 O HETATM 4951 O HOH 213 5.620 57.328 40.001 1.00 34.40 O HETATM 4952 O HOH 214 16.360 48.129 54.387 1.00 33.31 O HETATM 4953 O HOH 215 16.704 61.469 28.530 1.00 24.26 O HETATM 4954 O HOH 216 12.331 54.947 26.412 1.00 11.83 O HETATM 4955 O HOH 217 11.661 58.394 39.828 1.00 29.00 O HETATM 4956 O HOH 218 2.672 45.191 40.704 1.00 26.45 O HETATM 4957 O HOH 219 25.179 39.257 44.747 1.00 15.80 O HETATM 4958 O HOH 220 3.101 26.266 36.500 1.00 23.95 O HETATM 4959 O HOH 221 16.307 21.870 42.906 1.00 21.03 O HETATM 4960 O HOH 222 15.993 24.177 45.677 1.00 17.63 O HETATM 4961 O HOH 223 10.561 47.398 27.931 1.00 18.98 O HETATM 4962 O HOH 224 15.482 44.379 23.767 1.00 19.91 O HETATM 4963 O HOH 225 18.378 57.482 29.629 1.00 20.58 O HETATM 4964 O HOH 226 24.187 26.949 31.330 1.00 32.30 O HETATM 4965 O HOH 227 6.095 46.970 39.222 1.00 18.97 O HETATM 4966 O HOH 228 3.805 46.026 38.900 1.00 18.17 O HETATM 4967 O HOH 229 14.711 53.087 46.230 1.00 27.42 O HETATM 4968 O HOH 230 15.174 38.282 51.300 1.00 29.77 O HETATM 4969 O HOH 231 13.882 20.085 32.730 1.00 26.03 O HETATM 4970 O HOH 232 17.548 29.154 52.136 1.00 22.57 O HETATM 4971 O HOH 233 25.251 30.298 32.048 1.00 21.62 O HETATM 4972 O HOH 234 25.723 48.720 28.264 1.00 27.18 O HETATM 4973 O HOH 235 16.538 46.455 24.061 1.00 18.48 O HETATM 4974 O HOH 236 5.827 46.650 42.292 1.00 22.12 O HETATM 4975 O HOH 237 13.556 19.772 28.747 1.00 24.52 O HETATM 4976 O HOH 238 17.068 53.343 44.987 1.00 29.40 O HETATM 4977 O HOH 239 4.245 34.938 38.018 1.00 12.17 O HETATM 4978 O HOH 240 4.051 32.326 48.354 1.00 22.75 O HETATM 4979 O HOH 241 5.369 32.047 40.131 1.00 23.36 O HETATM 4980 O HOH 242 6.993 38.716 47.795 1.00 22.38 O HETATM 4981 O HOH 243 22.039 25.270 34.574 1.00 27.15 O HETATM 4982 O HOH 244 8.390 39.573 25.874 1.00 22.88 O HETATM 4983 O HOH 245 24.226 42.468 26.716 1.00 31.52 O HETATM 4984 O HOH 246 16.926 33.040 49.968 1.00 19.65 O HETATM 4985 O HOH 247 9.531 59.849 32.605 1.00 23.07 O HETATM 4986 O HOH 248 11.708 52.420 46.249 1.00 24.55 O HETATM 4987 O HOH 249 10.830 40.321 49.598 1.00 18.71 O HETATM 4988 O HOH 250 6.334 28.885 39.072 1.00 19.13 O HETATM 4989 O HOH 251 6.085 35.138 48.028 1.00 21.87 O HETATM 4990 O HOH 252 8.013 47.883 28.493 1.00 22.49 O HETATM 4991 O HOH 253 28.277 41.967 44.182 1.00 25.91 O HETATM 4992 O HOH 254 26.614 34.252 30.969 1.00 29.76 O HETATM 4993 O HOH 255 28.225 45.510 32.209 1.00 30.05 O HETATM 4994 O HOH 256 25.167 50.719 33.774 1.00 18.12 O HETATM 4995 O HOH 257 19.254 25.640 25.551 1.00 18.49 O HETATM 4996 O HOH 258 21.589 24.626 38.518 1.00 25.03 O HETATM 4997 O HOH 259 18.121 46.877 48.633 1.00 24.45 O HETATM 4998 O HOH 260 12.998 22.052 31.114 1.00 20.22 O HETATM 4999 O HOH 261 7.631 26.243 26.813 1.00 19.62 O HETATM 5000 O HOH 262 30.158 44.036 40.570 1.00 31.51 O HETATM 5001 O HOH 263 32.842 39.609 38.046 1.00 37.29 O HETATM 5002 O HOH 264 10.020 21.608 30.184 1.00 30.09 O HETATM 5003 O HOH 265 27.320 38.184 46.546 1.00 28.24 O HETATM 5004 O HOH 266 19.180 21.250 27.088 1.00 26.63 O HETATM 5005 O HOH 267 23.192 32.994 27.051 1.00 27.70 O HETATM 5006 O HOH 268 20.152 45.052 47.535 1.00 24.70 O HETATM 5007 O HOH 269 21.990 33.392 20.741 1.00 21.18 O HETATM 5008 O HOH 270 10.672 22.076 46.754 1.00 27.96 O HETATM 5009 O HOH 271 10.604 61.066 38.469 1.00 24.73 O HETATM 5010 O HOH 272 9.282 21.080 28.223 1.00 31.95 O HETATM 5011 O HOH 273 30.553 41.966 40.753 1.00 37.18 O HETATM 5012 O HOH 274 27.779 49.604 30.234 1.00 33.75 O HETATM 5013 O HOH 275 15.210 33.244 51.971 1.00 30.54 O HETATM 5014 O HOH 276 26.108 51.906 29.626 1.00 32.11 O HETATM 5015 O HOH 277 12.858 27.941 49.588 1.00 26.23 O HETATM 5016 O HOH 278 19.167 61.491 27.865 1.00 28.12 O HETATM 5017 O HOH 279 27.731 22.848 29.862 1.00 29.81 O HETATM 5018 O HOH 280 11.457 41.590 54.028 1.00 33.40 O HETATM 5019 O HOH 281 20.416 58.348 28.937 1.00 26.71 O HETATM 5020 O HOH 282 29.979 34.439 40.817 1.00 32.93 O HETATM 5021 O HOH 283 16.974 40.767 50.989 1.00 26.53 O HETATM 5022 O HOH 284 8.182 61.255 27.670 1.00 23.59 O HETATM 5023 O HOH 285 30.876 37.533 32.053 1.00 31.25 O HETATM 5024 O HOH 286 11.752 51.556 51.342 1.00 31.72 O HETATM 5025 O HOH 287 26.107 38.988 48.828 1.00 32.23 O HETATM 5026 O HOH 288 20.320 17.202 33.258 1.00 33.87 O HETATM 5027 O HOH 289 4.237 31.451 19.333 1.00 28.33 O HETATM 5028 O HOH 290 9.751 63.094 37.619 1.00 31.75 O HETATM 5029 O HOH 291 6.711 42.687 49.827 1.00 33.82 O HETATM 5030 O HOH 292 10.589 52.393 49.598 1.00 27.99 O HETATM 5031 O HOH 293 13.016 17.481 33.419 1.00 30.76 O HETATM 5032 O HOH 294 18.630 42.250 49.221 1.00 20.70 O HETATM 5033 O HOH 295 23.105 45.227 47.874 1.00 33.13 O HETATM 5034 O HOH 296 2.875 16.323 40.707 1.00 36.09 O HETATM 5035 O HOH 297 19.984 42.898 22.264 1.00 35.97 O HETATM 5036 O HOH 298 9.953 39.065 53.676 1.00 37.39 O HETATM 5037 O HOH 299 21.699 14.646 33.613 1.00 36.54 O HETATM 5038 O HOH 300 0.845 16.707 39.151 1.00 31.81 O HETATM 5039 O HOH 301 49.830 24.650 16.900 1.00 32.75 O HETATM 5040 O HOH 302 41.439 31.916 4.645 1.00 26.75 O HETATM 5041 O HOH 303 25.041 4.887 10.245 1.00 36.41 O HETATM 5042 O HOH 304 45.364 31.842 11.893 1.00 25.82 O HETATM 5043 O HOH 305 27.208 33.500 8.885 1.00 26.20 O HETATM 5044 O HOH 306 35.534 27.523 -1.834 1.00 19.04 O HETATM 5045 O HOH 307 29.240 34.930 16.271 1.00 27.86 O HETATM 5046 O HOH 308 40.079 30.953 10.676 1.00 19.66 O HETATM 5047 O HOH 309 42.284 7.615 11.703 1.00 20.07 O HETATM 5048 O HOH 310 33.005 33.841 15.524 1.00 18.66 O HETATM 5049 O HOH 311 43.717 26.383 24.368 1.00 33.74 O HETATM 5050 O HOH 312 27.722 33.240 18.221 1.00 23.78 O HETATM 5051 O HOH 313 31.324 5.486 5.573 1.00 27.42 O HETATM 5052 O HOH 314 43.703 0.746 18.267 1.00 31.09 O HETATM 5053 O HOH 315 27.990 -0.479 17.257 1.00 27.61 O HETATM 5054 O HOH 316 49.181 16.537 5.891 1.00 33.34 O HETATM 5055 O HOH 317 33.419 12.977 24.382 1.00 19.48 O HETATM 5056 O HOH 318 44.710 32.320 14.530 1.00 23.86 O HETATM 5057 O HOH 319 26.155 37.614 8.567 1.00 38.55 O HETATM 5058 O HOH 320 35.167 33.923 3.548 1.00 35.41 O HETATM 5059 O HOH 321 41.893 8.104 26.469 1.00 19.41 O HETATM 5060 O HOH 322 41.173 37.094 12.504 1.00 26.35 O HETATM 5061 O HOH 323 27.846 2.707 19.445 1.00 22.73 O HETATM 5062 O HOH 324 30.339 32.807 0.269 1.00 25.97 O HETATM 5063 O HOH 325 22.366 26.669 22.103 1.00 19.29 O HETATM 5064 O HOH 326 32.104 16.805 23.190 1.00 19.64 O HETATM 5065 O HOH 327 27.001 16.399 15.421 1.00 11.41 O HETATM 5066 O HOH 328 34.940 35.055 7.710 1.00 15.62 O HETATM 5067 O HOH 329 25.143 18.879 9.559 1.00 18.56 O HETATM 5068 O HOH 330 33.850 1.843 24.503 1.00 29.39 O HETATM 5069 O HOH 331 31.279 28.569 24.005 1.00 23.57 O HETATM 5070 O HOH 332 25.447 12.078 8.870 1.00 32.43 O HETATM 5071 O HOH 333 47.725 10.266 17.292 1.00 22.16 O HETATM 5072 O HOH 334 43.159 30.045 2.532 1.00 30.06 O HETATM 5073 O HOH 335 28.547 22.410 23.972 1.00 27.93 O HETATM 5074 O HOH 336 27.142 10.095 13.396 1.00 17.29 O HETATM 5075 O HOH 337 34.648 31.294 1.162 1.00 21.59 O HETATM 5076 O HOH 338 24.770 26.986 10.633 1.00 17.47 O HETATM 5077 O HOH 339 33.855 -4.127 20.086 1.00 32.52 O HETATM 5078 O HOH 340 44.084 24.358 20.764 1.00 17.65 O HETATM 5079 O HOH 341 34.083 31.238 22.504 1.00 19.32 O HETATM 5080 O HOH 342 27.517 11.442 7.401 1.00 16.94 O HETATM 5081 O HOH 343 35.824 26.142 -4.732 1.00 14.22 O HETATM 5082 O HOH 344 34.636 34.087 17.616 1.00 18.76 O HETATM 5083 O HOH 345 43.850 27.838 17.905 1.00 18.85 O HETATM 5084 O HOH 346 38.030 5.416 8.789 1.00 19.42 O HETATM 5085 O HOH 347 42.664 29.470 -0.469 1.00 25.42 O HETATM 5086 O HOH 348 31.543 26.766 8.726 1.00 12.06 O HETATM 5087 O HOH 349 30.691 24.257 23.829 1.00 26.50 O HETATM 5088 O HOH 350 35.408 41.652 14.844 1.00 33.91 O HETATM 5089 O HOH 351 39.332 10.732 3.089 1.00 26.34 O HETATM 5090 O HOH 352 23.051 30.943 13.632 1.00 19.09 O HETATM 5091 O HOH 353 41.816 11.736 24.521 1.00 18.85 O HETATM 5092 O HOH 354 26.397 12.547 21.980 1.00 18.48 O HETATM 5093 O HOH 355 42.559 39.520 6.783 1.00 36.84 O HETATM 5094 O HOH 356 24.559 22.494 21.147 1.00 17.39 O HETATM 5095 O HOH 357 46.674 6.295 20.923 1.00 27.94 O HETATM 5096 O HOH 358 26.490 22.748 10.245 1.00 16.44 O HETATM 5097 O HOH 359 39.061 13.425 2.837 1.00 20.52 O HETATM 5098 O HOH 360 49.578 20.579 22.106 1.00 39.99 O HETATM 5099 O HOH 361 36.388 11.244 0.378 1.00 18.92 O HETATM 5100 O HOH 362 40.390 34.578 20.591 1.00 24.50 O HETATM 5101 O HOH 363 46.021 28.682 14.555 1.00 20.62 O HETATM 5102 O HOH 364 36.524 -0.704 7.204 1.00 32.87 O HETATM 5103 O HOH 365 29.107 37.832 4.718 1.00 31.76 O HETATM 5104 O HOH 366 27.161 2.964 16.713 1.00 22.47 O HETATM 5105 O HOH 367 44.298 14.369 23.492 1.00 21.95 O HETATM 5106 O HOH 368 47.535 24.597 7.212 1.00 23.54 O HETATM 5107 O HOH 369 32.950 38.454 7.373 1.00 27.33 O HETATM 5108 O HOH 370 33.267 18.179 24.400 1.00 22.14 O HETATM 5109 O HOH 371 25.104 21.755 8.693 1.00 27.89 O HETATM 5110 O HOH 372 26.741 4.685 12.038 1.00 26.89 O HETATM 5111 O HOH 373 38.804 28.726 21.619 1.00 18.17 O HETATM 5112 O HOH 374 40.736 32.882 7.498 1.00 21.49 O HETATM 5113 O HOH 375 42.437 16.464 24.303 1.00 23.39 O HETATM 5114 O HOH 376 30.515 3.992 23.164 1.00 19.51 O HETATM 5115 O HOH 377 31.047 -1.158 21.271 1.00 29.17 O HETATM 5116 O HOH 378 24.817 20.349 2.919 1.00 19.57 O HETATM 5117 O HOH 379 45.394 10.359 8.744 1.00 28.82 O HETATM 5118 O HOH 380 26.430 16.494 3.131 1.00 23.23 O HETATM 5119 O HOH 381 30.757 11.435 23.823 1.00 21.14 O HETATM 5120 O HOH 382 43.089 34.710 12.838 1.00 25.68 O HETATM 5121 O HOH 383 36.157 3.479 6.706 1.00 25.98 O HETATM 5122 O HOH 384 28.757 17.075 0.441 1.00 24.14 O HETATM 5123 O HOH 385 46.428 6.822 14.423 1.00 24.42 O HETATM 5124 O HOH 386 44.557 16.294 12.503 1.00 17.88 O HETATM 5125 O HOH 387 46.537 17.831 22.182 1.00 32.29 O HETATM 5126 O HOH 388 45.515 12.618 3.339 1.00 25.58 O HETATM 5127 O HOH 389 37.398 9.192 2.083 1.00 22.11 O HETATM 5128 O HOH 390 47.712 21.612 14.871 1.00 24.31 O HETATM 5129 O HOH 391 35.471 36.159 20.494 1.00 33.62 O HETATM 5130 O HOH 392 46.866 7.997 16.861 1.00 19.64 O HETATM 5131 O HOH 393 29.818 15.240 1.257 1.00 19.01 O HETATM 5132 O HOH 394 41.814 14.426 2.786 1.00 23.22 O HETATM 5133 O HOH 395 34.624 37.655 18.407 1.00 31.02 O HETATM 5134 O HOH 396 31.650 -0.270 12.513 1.00 33.63 O HETATM 5135 O HOH 397 25.844 7.925 12.545 1.00 21.39 O HETATM 5136 O HOH 398 40.464 2.257 23.162 1.00 25.90 O HETATM 5137 O HOH 399 35.559 39.523 18.841 1.00 35.23 O HETATM 5138 O HOH 400 48.433 20.139 13.917 1.00 29.72 O HETATM 5139 O HOH 401 27.116 -0.518 13.850 1.00 33.63 O HETATM 5140 O HOH 402 38.966 1.275 24.919 1.00 28.16 O HETATM 5141 O HOH 403 36.696 44.042 15.542 1.00 33.94 O HETATM 5142 O HOH 404 32.043 14.654 25.063 1.00 24.68 O HETATM 5143 O HOH 405 23.069 10.851 12.144 1.00 17.19 O HETATM 5144 O HOH 406 50.468 17.010 7.638 1.00 32.10 O HETATM 5145 O HOH 407 43.531 8.401 9.119 1.00 29.06 O HETATM 5146 O HOH 408 33.881 34.629 22.286 1.00 28.58 O HETATM 5147 O HOH 409 47.456 6.284 18.952 1.00 31.54 O HETATM 5148 O HOH 410 31.837 30.707 23.339 1.00 22.93 O HETATM 5149 O HOH 411 35.395 14.867 -0.979 1.00 38.61 O HETATM 5150 O HOH 412 35.985 5.923 -1.641 1.00 34.92 O HETATM 5151 O HOH 413 31.310 26.081 -2.002 1.00 29.89 O HETATM 5152 O HOH 414 49.025 19.180 1.398 1.00 33.36 O HETATM 5153 O HOH 415 26.993 30.347 24.990 1.00 32.28 O HETATM 5154 O HOH 416 50.976 23.355 15.559 1.00 35.17 O HETATM 5155 O HOH 417 31.825 0.384 23.057 1.00 26.13 O HETATM 5156 O HOH 418 19.724 35.498 7.311 1.00 33.51 O HETATM 5157 O HOH 419 35.726 14.731 -3.456 1.00 28.69 O HETATM 5158 O HOH 420 48.134 7.428 6.949 1.00 38.50 O HETATM 5159 O HOH 421 55.997 12.693 7.757 1.00 31.95 O HETATM 5160 O HOH 422 29.855 -0.829 14.211 1.00 30.57 O HETATM 5161 O HOH 423 46.269 25.496 22.243 1.00 32.86 O HETATM 5162 O HOH 424 48.212 8.570 21.554 1.00 24.10 O HETATM 5163 O HOH 425 41.286 28.119 22.659 1.00 23.11 O HETATM 5164 O HOH 426 44.996 17.325 0.624 1.00 33.49 O HETATM 5165 O HOH 427 34.610 2.971 4.035 1.00 31.69 O HETATM 5166 O HOH 428 33.558 37.175 22.723 1.00 36.00 O HETATM 5167 O HOH 429 34.005 34.368 0.071 1.00 24.15 O HETATM 5168 O HOH 430 46.150 8.008 6.704 1.00 34.31 O HETATM 5169 O HOH 431 44.404 19.569 25.937 1.00 23.57 O HETATM 5170 O HOH 432 42.571 33.189 10.892 1.00 29.05 O HETATM 5171 O HOH 433 36.400 3.850 2.640 1.00 30.67 O HETATM 5172 O HOH 434 29.407 27.422 -0.987 1.00 32.68 O HETATM 5173 O HOH 435 24.227 17.457 2.312 1.00 30.30 O HETATM 5174 O HOH 436 27.491 32.930 25.427 1.00 30.29 O HETATM 5175 O HOH 437 36.856 41.189 3.049 1.00 34.99 O HETATM 5176 O HOH 438 31.140 15.809 -1.067 1.00 32.09 O HETATM 5177 O HOH 439 37.340 13.623 0.985 1.00 23.91 O HETATM 5178 O HOH 440 47.517 3.829 21.723 1.00 33.04 O HETATM 5179 O HOH 441 38.139 6.019 0.710 1.00 36.45 O HETATM 5180 O HOH 442 37.571 0.002 4.621 1.00 38.85 O HETATM 5181 O HOH 443 37.965 3.388 4.322 1.00 31.27 O HETATM 5182 O HOH 444 39.852 13.317 -0.448 1.00 29.33 O HETATM 5183 O HOH 445 25.513 14.248 4.137 1.00 30.22 O HETATM 5184 O HOH 446 46.995 8.270 4.036 1.00 33.00 O HETATM 5185 O HOH 447 42.428 44.835 15.000 1.00 37.12 O HETATM 5186 O HOH 448 32.041 -5.929 28.359 1.00 34.35 O HETATM 5187 O HOH 449 47.834 7.719 1.850 1.00 29.31 O HETATM 5188 O HOH 450 25.734 37.769 19.599 1.00 30.88 O HETATM 5189 O HOH 451 26.950 20.064 26.251 1.00 31.11 O HETATM 5190 O HOH 452 30.769 16.011 47.001 1.00 25.67 O HETATM 5191 O HOH 453 53.040 21.292 26.842 1.00 37.97 O HETATM 5192 O HOH 454 51.944 22.076 25.448 1.00 36.48 O HETATM 5193 O HOH 455 28.001 33.072 31.929 1.00 29.76 O HETATM 5194 O HOH 456 54.723 32.933 42.602 1.00 35.84 O HETATM 5195 O HOH 457 39.942 18.933 27.177 1.00 28.97 O HETATM 5196 O HOH 458 50.116 20.686 25.229 1.00 34.38 O HETATM 5197 O HOH 459 48.036 19.144 26.691 1.00 32.33 O HETATM 5198 O HOH 460 32.273 28.041 40.301 1.00 25.43 O HETATM 5199 O HOH 461 31.530 24.551 31.442 1.00 23.20 O HETATM 5200 O HOH 462 43.710 14.832 27.384 1.00 23.57 O HETATM 5201 O HOH 463 27.297 23.153 42.226 1.00 20.97 O HETATM 5202 O HOH 464 36.456 11.418 26.869 1.00 27.13 O HETATM 5203 O HOH 465 30.844 35.479 38.905 1.00 35.54 O HETATM 5204 O HOH 466 42.016 32.160 33.921 1.00 26.47 O HETATM 5205 O HOH 467 32.991 34.300 43.841 1.00 34.73 O HETATM 5206 O HOH 468 28.619 22.690 32.653 1.00 30.94 O HETATM 5207 O HOH 469 48.840 15.229 36.472 1.00 14.74 O HETATM 5208 O HOH 470 35.577 32.959 38.867 1.00 33.82 O HETATM 5209 O HOH 471 43.777 -5.707 33.231 1.00 30.91 O HETATM 5210 O HOH 472 34.841 29.091 37.954 1.00 21.72 O HETATM 5211 O HOH 473 40.330 31.692 31.814 1.00 25.77 O HETATM 5212 O HOH 474 36.421 28.709 25.247 1.00 27.13 O HETATM 5213 O HOH 475 49.595 18.817 42.145 1.00 22.90 O HETATM 5214 O HOH 476 43.727 9.363 28.295 1.00 18.90 O HETATM 5215 O HOH 477 39.490 31.029 48.561 1.00 24.77 O HETATM 5216 O HOH 478 45.204 15.306 50.404 1.00 22.36 O HETATM 5217 O HOH 479 41.231 13.119 51.588 1.00 24.32 O HETATM 5218 O HOH 480 48.195 10.837 44.662 1.00 14.43 O HETATM 5219 O HOH 481 41.166 36.847 41.583 1.00 36.75 O HETATM 5220 O HOH 482 38.427 4.395 43.690 1.00 22.77 O HETATM 5221 O HOH 483 50.339 16.139 43.674 1.00 20.94 O HETATM 5222 O HOH 484 50.145 10.977 43.060 1.00 26.13 O HETATM 5223 O HOH 485 28.634 19.647 48.447 1.00 26.69 O HETATM 5224 O HOH 486 47.305 20.984 39.841 1.00 23.64 O HETATM 5225 O HOH 487 33.551 14.192 47.993 1.00 22.24 O HETATM 5226 O HOH 488 49.468 9.128 39.434 1.00 24.44 O HETATM 5227 O HOH 489 48.620 1.815 35.011 1.00 24.69 O HETATM 5228 O HOH 490 50.919 16.479 32.532 1.00 24.86 O HETATM 5229 O HOH 491 41.680 28.665 27.397 1.00 27.34 O HETATM 5230 O HOH 492 50.095 22.030 44.574 1.00 23.89 O HETATM 5231 O HOH 493 32.154 29.033 49.731 1.00 34.70 O HETATM 5232 O HOH 494 34.972 6.760 47.164 1.00 30.56 O HETATM 5233 O HOH 495 30.281 28.354 34.172 1.00 24.63 O HETATM 5234 O HOH 496 37.634 17.684 55.974 1.00 32.68 O HETATM 5235 O HOH 497 37.845 25.861 54.965 1.00 15.45 O HETATM 5236 O HOH 498 31.444 29.063 46.927 1.00 28.13 O HETATM 5237 O HOH 499 27.026 24.383 49.839 1.00 29.52 O HETATM 5238 O HOH 500 30.854 24.683 53.103 1.00 29.73 O HETATM 5239 O HOH 501 33.852 0.166 28.677 1.00 30.70 O HETATM 5240 O HOH 502 43.790 25.818 41.153 1.00 16.61 O HETATM 5241 O HOH 503 45.929 23.553 53.103 1.00 24.37 O HETATM 5242 O HOH 504 39.447 34.085 41.209 1.00 28.58 O HETATM 5243 O HOH 505 48.689 27.457 40.016 1.00 25.72 O HETATM 5244 O HOH 506 44.841 9.868 53.936 1.00 39.89 O HETATM 5245 O HOH 507 44.305 2.913 46.109 1.00 32.02 O HETATM 5246 O HOH 508 38.444 8.438 49.509 1.00 21.68 O HETATM 5247 O HOH 509 37.132 25.840 27.916 1.00 22.99 O HETATM 5248 O HOH 510 26.586 15.738 44.511 1.00 27.85 O HETATM 5249 O HOH 511 52.341 23.619 48.577 1.00 31.40 O HETATM 5250 O HOH 512 42.778 2.631 27.176 1.00 27.85 O HETATM 5251 O HOH 513 52.058 30.382 37.732 1.00 24.96 O HETATM 5252 O HOH 514 42.117 25.552 51.946 1.00 28.51 O HETATM 5253 O HOH 515 45.608 22.006 26.488 1.00 26.43 O HETATM 5254 O HOH 516 41.570 10.819 56.307 1.00 31.47 O HETATM 5255 O HOH 517 36.290 13.058 48.596 1.00 21.99 O HETATM 5256 O HOH 518 30.246 26.382 32.796 1.00 29.20 O HETATM 5257 O HOH 519 38.737 10.792 51.175 1.00 24.37 O HETATM 5258 O HOH 520 25.260 14.778 42.328 1.00 32.88 O HETATM 5259 O HOH 521 50.239 7.050 39.986 1.00 22.00 O HETATM 5260 O HOH 522 49.116 16.898 48.373 1.00 23.17 O HETATM 5261 O HOH 523 46.247 1.578 29.867 1.00 23.73 O HETATM 5262 O HOH 524 39.758 34.739 29.634 1.00 32.70 O HETATM 5263 O HOH 525 39.655 11.979 54.294 1.00 34.80 O HETATM 5264 O HOH 526 39.548 33.025 27.999 1.00 33.01 O HETATM 5265 O HOH 527 38.735 26.967 52.822 1.00 22.53 O HETATM 5266 O HOH 528 25.267 11.712 43.075 1.00 32.01 O HETATM 5267 O HOH 529 52.958 10.364 39.844 1.00 18.61 O HETATM 5268 O HOH 530 46.520 17.131 51.358 1.00 33.56 O HETATM 5269 O HOH 531 26.185 20.767 32.227 1.00 35.95 O HETATM 5270 O HOH 532 29.769 17.081 49.492 1.00 30.74 O HETATM 5271 O HOH 533 31.699 -0.461 37.909 1.00 36.66 O HETATM 5272 O HOH 534 28.465 25.089 31.558 1.00 29.04 O HETATM 5273 O HOH 535 41.193 38.813 41.062 1.00 32.57 O HETATM 5274 O HOH 536 43.585 27.098 50.866 1.00 34.18 O HETATM 5275 O HOH 537 36.257 4.945 48.759 1.00 34.99 O HETATM 5276 O HOH 538 38.156 5.685 50.814 1.00 30.38 O HETATM 5277 O HOH 539 36.159 30.757 24.222 1.00 23.78 O HETATM 5278 O HOH 540 22.067 15.571 41.937 1.00 33.18 O HETATM 5279 O HOH 541 36.378 13.604 52.917 1.00 31.74 O HETATM 5280 O HOH 542 33.360 38.253 31.479 1.00 36.52 O HETATM 5281 O HOH 543 37.532 3.367 48.331 1.00 32.79 O HETATM 5282 O HOH 544 30.064 26.056 29.436 1.00 33.73 O HETATM 5283 O HOH 545 51.658 14.714 45.828 1.00 26.86 O HETATM 5284 O HOH 546 44.113 14.802 54.519 1.00 41.09 O HETATM 5285 O HOH 547 42.854 12.747 56.452 1.00 40.61 O HETATM 5286 O HOH 548 50.708 17.447 50.459 1.00 38.31 O HETATM 5287 O HOH 549 30.890 1.611 26.448 1.00 38.47 O HETATM 5288 O HOH 550 30.862 4.249 26.887 1.00 34.80 O HETATM 5289 O HOH 551 50.410 12.376 46.371 1.00 26.61 O HETATM 5290 O HOH 552 21.947 13.186 41.528 1.00 39.54 O HETATM 5291 O HOH 553 37.753 13.571 50.773 1.00 30.47 O HETATM 5292 O HOH 554 39.537 4.874 53.057 1.00 32.03 O HETATM 5293 O HOH 555 28.437 29.021 25.904 1.00 33.93 O HETATM 5294 O HOH 556 34.910 13.531 51.454 1.00 29.68 O HETATM 5295 O HOH 557 43.999 38.055 46.541 1.00 30.02 O HETATM 5296 O HOH 558 33.038 -4.210 30.590 1.00 31.27 O HETATM 5297 O HOH 559 31.507 -3.268 38.954 1.00 35.89 O HETATM 5298 C1 HCY A 560 14.779 1.436 14.492 1.00 -0.03 C HETATM 5299 C2 HCY A 560 13.295 1.670 14.034 1.00 0.02 C HETATM 5300 C3 HCY A 560 12.369 2.048 15.212 1.00 0.11 C HETATM 5301 C4 HCY A 560 12.995 2.813 16.389 1.00 0.02 C HETATM 5302 C5 HCY A 560 14.411 3.307 16.196 1.00 -0.02 C HETATM 5303 C6 HCY A 560 15.039 4.469 17.080 1.00 -0.05 C HETATM 5304 C7 HCY A 560 16.451 4.015 17.723 1.00 -0.05 C HETATM 5305 C8 HCY A 560 17.432 3.328 16.773 1.00 -0.03 C HETATM 5306 C9 HCY A 560 16.668 2.145 15.938 1.00 -0.01 C HETATM 5307 C10 HCY A 560 15.402 2.642 15.181 1.00 -0.02 C HETATM 5308 C19 HCY A 560 15.736 3.715 14.117 1.00 -0.06 C HETATM 5309 H25 HCY A 560 14.811 4.032 13.613 1.00 0.02 H HETATM 5310 H26 HCY A 560 16.431 3.293 13.376 1.00 0.02 H HETATM 5311 H27 HCY A 560 16.203 4.583 14.605 1.00 0.02 H HETATM 5312 C11 HCY A 560 17.588 1.301 15.107 1.00 0.06 C HETATM 5313 C12 HCY A 560 18.932 0.792 15.942 1.00 -0.02 C HETATM 5314 C13 HCY A 560 19.550 1.852 16.806 1.00 0.01 C HETATM 5315 C14 HCY A 560 18.540 2.708 17.606 1.00 -0.03 C HETATM 5316 C15 HCY A 560 19.446 3.601 18.601 1.00 -0.05 C HETATM 5317 C16 HCY A 560 20.722 2.734 18.954 1.00 -0.02 C HETATM 5318 C17 HCY A 560 20.590 1.364 17.991 1.00 0.14 C HETATM 5319 C20 HCY A 560 21.759 0.892 17.518 1.00 0.18 C HETATM 5320 C21 HCY A 560 21.891 -0.622 17.208 1.00 0.12 C HETATM 5321 O5 HCY A 560 23.242 -0.958 17.007 1.00 -0.38 O HETATM 5322 H32 HCY A 560 23.586 -0.458 16.276 1.00 0.21 H HETATM 5323 H28 HCY A 560 21.318 -0.859 16.299 1.00 0.08 H HETATM 5324 H29 HCY A 560 21.494 -1.203 18.054 1.00 0.08 H HETATM 5325 O4 HCY A 560 22.693 1.585 17.346 1.00 -0.33 O HETATM 5326 O3 HCY A 560 19.933 0.333 18.748 1.00 -0.39 O HETATM 5327 H31 HCY A 560 20.445 0.136 19.523 1.00 0.21 H HETATM 5328 H20 HCY A 560 20.722 2.460 20.019 1.00 0.03 H HETATM 5329 H21 HCY A 560 21.643 3.286 18.718 1.00 0.03 H HETATM 5330 H18 HCY A 560 18.884 3.838 19.516 1.00 0.03 H HETATM 5331 H19 HCY A 560 19.748 4.535 18.104 1.00 0.03 H HETATM 5332 H17 HCY A 560 17.998 2.012 18.264 1.00 0.03 H HETATM 5333 C18 HCY A 560 20.308 2.850 15.861 1.00 -0.06 C HETATM 5334 H22 HCY A 560 19.630 3.187 15.063 1.00 0.02 H HETATM 5335 H23 HCY A 560 21.177 2.344 15.414 1.00 0.02 H HETATM 5336 H24 HCY A 560 20.649 3.719 16.443 1.00 0.02 H HETATM 5337 H14 HCY A 560 19.685 0.456 15.214 1.00 0.03 H HETATM 5338 H15 HCY A 560 18.641 -0.052 16.584 1.00 0.03 H HETATM 5339 O2 HCY A 560 18.071 1.915 13.994 1.00 -0.39 O HETATM 5340 H30 HCY A 560 18.583 1.295 13.488 1.00 0.21 H HETATM 5341 H16 HCY A 560 17.013 0.417 14.793 1.00 0.06 H HETATM 5342 H13 HCY A 560 16.283 1.461 16.708 1.00 0.03 H HETATM 5343 H12 HCY A 560 17.853 4.064 16.073 1.00 0.03 H HETATM 5344 H10 HCY A 560 16.237 3.318 18.547 1.00 0.03 H HETATM 5345 H11 HCY A 560 16.943 4.914 18.122 1.00 0.03 H HETATM 5346 H8 HCY A 560 14.340 4.721 17.891 1.00 0.03 H HETATM 5347 H9 HCY A 560 15.201 5.354 16.447 1.00 0.03 H HETATM 5348 H7 HCY A 560 14.063 4.025 15.439 1.00 0.03 H HETATM 5349 H5 HCY A 560 12.991 2.144 17.262 1.00 0.05 H HETATM 5350 H6 HCY A 560 12.361 3.688 16.594 1.00 0.05 H HETATM 5351 O1 HCY A 560 11.205 1.790 15.219 1.00 -0.39 O HETATM 5352 H3 HCY A 560 12.918 0.746 13.571 1.00 0.05 H HETATM 5353 H4 HCY A 560 13.277 2.485 13.295 1.00 0.05 H HETATM 5354 H1 HCY A 560 15.382 1.192 13.605 1.00 0.03 H HETATM 5355 H2 HCY A 560 14.797 0.588 15.192 1.00 0.03 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 373 374 389 390 391 CONECT 389 373 CONECT 390 373 CONECT 391 373 CONECT 479 480 487 488 489 CONECT 487 479 CONECT 488 479 CONECT 489 479 CONECT 1186 1187 1197 1198 1199 CONECT 1197 1186 CONECT 1198 1186 CONECT 1199 1186 CONECT 1546 1547 1562 1563 1564 CONECT 1562 1546 CONECT 1563 1546 CONECT 1564 1546 CONECT 1652 1653 1660 1661 1662 CONECT 1660 1652 CONECT 1661 1652 CONECT 1662 1652 CONECT 2359 2360 2370 2371 2372 CONECT 2370 2359 CONECT 2371 2359 CONECT 2372 2359 CONECT 2858 2859 2866 2867 2868 CONECT 2866 2858 CONECT 2867 2858 CONECT 2868 2858 CONECT 3554 3555 3565 3566 3567 CONECT 3565 3554 CONECT 3566 3554 CONECT 3567 3554 CONECT 3926 3927 3942 3943 3944 CONECT 3942 3926 CONECT 3943 3926 CONECT 3944 3926 CONECT 4032 4033 4040 4041 4042 CONECT 4040 4032 CONECT 4041 4032 CONECT 4042 4032 CONECT 5298 5299 5307 5354 5355 CONECT 5299 5298 5300 5352 5353 CONECT 5300 5299 5301 5351 CONECT 5301 5300 5302 5349 5350 CONECT 5302 5301 5303 5307 5348 CONECT 5303 5302 5304 5346 5347 CONECT 5304 5303 5305 5344 5345 CONECT 5305 5304 5306 5315 5343 CONECT 5306 5305 5307 5312 5342 CONECT 5307 5298 5302 5306 5308 CONECT 5308 5307 5309 5310 5311 CONECT 5309 5308 CONECT 5310 5308 CONECT 5311 5308 CONECT 5312 5306 5313 5339 5341 CONECT 5313 5312 5314 5337 5338 CONECT 5314 5313 5315 5318 5333 CONECT 5315 5305 5314 5316 5332 CONECT 5316 5315 5317 5330 5331 CONECT 5317 5316 5318 5328 5329 CONECT 5318 5314 5317 5319 5326 CONECT 5319 5318 5320 5325 CONECT 5320 5319 5321 5323 5324 CONECT 5321 5320 5322 CONECT 5322 5321 CONECT 5323 5320 CONECT 5324 5320 CONECT 5325 5319 CONECT 5326 5318 5327 CONECT 5327 5326 CONECT 5328 5317 CONECT 5329 5317 CONECT 5330 5316 CONECT 5331 5316 CONECT 5332 5315 CONECT 5333 5314 5334 5335 5336 CONECT 5334 5333 CONECT 5335 5333 CONECT 5336 5333 CONECT 5337 5313 CONECT 5338 5313 CONECT 5339 5312 5340 CONECT 5340 5339 CONECT 5341 5312 CONECT 5342 5306 CONECT 5343 5305 CONECT 5344 5304 CONECT 5345 5304 CONECT 5346 5303 CONECT 5347 5303 CONECT 5348 5302 CONECT 5349 5301 CONECT 5350 5301 CONECT 5351 5300 CONECT 5352 5299 CONECT 5353 5299 CONECT 5354 5298 CONECT 5355 5298 MASTER 0 0 0 0 0 0 0 0 5344 11 102 43 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 6itq
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6itp
RCSB PDB
PDBbind
127aa, >6ITP_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
2v95
RCSB PDB
PDBbind
HCY
4p6x
RCSB PDB
PDBbind
HCY
5hgc
RCSB PDB
PDBbind
HCY
6nwl
RCSB PDB
PDBbind
HCY
6itp
RCSB PDB
PDBbind
HCY
6hgg
RCSB PDB
PDBbind
HCY
6hgf
RCSB PDB
PDBbind
HCY
Entry Information
PDB ID
6itq
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
NbCor
Ligand Name
HCY
EC.Number
E.C.-.-.-.-
Resolution
1.53(Å)
Affinity (Kd/Ki/IC50)
Kd=20.5uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Febs Lett. Vol. 593: pp. 1248-1256
Ligand Properties
Formula
C
2
1
H
3
2
O
5
Molecular Weight
364.476
Exact Mass
364.225
No. of atoms
58
No. of bonds
61
Polar Surface Area
94.83
LOGP Value
2.05 (
Computed with XLOGP3
)
1.86 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 4
Canonical SMILES
OCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)C[C@H](O)[C@H]1[C@H]2CC[C@H]2[C@]1(C)CCC(=O)C2
InChI String
InChI=1S/C21H32O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12,14-16,18,22,24,26H,3-11H2,1-2H3/t12-,14+,15+,16+,18-,19+,20+,21+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
No matched UniProt accession number (AC) found!
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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