Browse entries in the PDBbind-CN Database
HEADER 5UXF_COMPLEX COMPND 5UXF_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 224 PHE GLN GLY MET SER SER LYS GLN HIS CYS VAL LYS LEU SEQRES 2 A 224 ASN ASP GLY HIS LEU ILE PRO ALA LEU GLY PHE GLY THR SEQRES 3 A 224 TYR LYS PRO LYS GLU VAL PRO LYS SER LYS SER LEU GLU SEQRES 4 A 224 ALA ALA CYS LEU ALA LEU ASP VAL GLY TYR ARG HIS VAL SEQRES 5 A 224 ASP THR ALA TYR ALA TYR GLN VAL GLU GLU GLU ILE GLY SEQRES 6 A 224 GLN ALA ILE GLN SER ALA ILE ALA ALA GLY VAL VAL LYS SEQRES 7 A 224 ARG GLU ASP LEU PHE VAL THR THR LYS LEU TRP CYS THR SEQRES 8 A 224 CYS PHE ARG PRO GLU LEU VAL LYS PRO ALA LEU GLU LYS SEQRES 9 A 224 SER LEU LYS LYS LEU GLN LEU ASP TYR VAL ASP LEU TYR SEQRES 10 A 224 ILE MET HIS TYR PRO VAL PRO MET LYS SER GLY ASP ASN SEQRES 11 A 224 ASP PHE PRO VAL ASN GLU GLN GLY LYS SER LEU LEU ASP SEQRES 12 A 224 THR VAL ASP PHE CYS ASP THR TRP GLU ARG LEU GLU GLU SEQRES 13 A 224 CYS LYS ASP ALA GLY LEU VAL LYS SER ILE GLY VAL SER SEQRES 14 A 224 ASN PHE ASN HIS ARG GLN LEU GLU ARG ILE LEU ASN LYS SEQRES 15 A 224 PRO GLY LEU LYS TYR LYS PRO VAL CYS ASN GLN VAL GLU SEQRES 16 A 224 CYS HIS LEU TYR LEU ASN GLN ARG LYS LEU LEU ASP TYR SEQRES 17 A 224 CYS GLU SER LYS ASP ILE VAL LEU VAL ALA TYR GLY ALA SEQRES 18 A 224 LEU GLY THR SEQRES 1 A 92 SER PRO VAL LEU LEU ASN ASP PRO VAL LEU CYS ASP VAL SEQRES 2 A 92 ALA LYS LYS ASN LYS ARG SER PRO ALA LEU ILE ALA LEU SEQRES 3 A 92 ARG TYR LEU ILE GLN ARG GLY ILE VAL PRO LEU ALA GLN SEQRES 4 A 92 SER PHE LYS GLU ASN GLU MET ARG GLU ASN LEU GLN VAL SEQRES 5 A 92 PHE GLY PHE GLN LEU SER PRO GLU ASP MET LYS THR LEU SEQRES 6 A 92 ASP GLY LEU ASN LYS ASN PHE ARG TYR LEU PRO ALA GLU SEQRES 7 A 92 PHE LEU VAL ASP HIS PRO GLU TYR PRO PHE VAL GLU GLU SEQRES 8 A 92 TYR HET UNN A 749 66 ATOM 1 N PHE A -2 96.374 74.777 -14.400 1.00 34.61 N ATOM 2 CA PHE A -2 96.730 73.802 -13.376 1.00 30.33 C ATOM 3 C PHE A -2 95.700 73.781 -12.249 1.00 30.64 C ATOM 4 O PHE A -2 95.365 74.824 -11.678 1.00 31.60 O ATOM 5 CB PHE A -2 98.113 74.103 -12.809 1.00 29.01 C ATOM 6 CG PHE A -2 99.199 74.094 -13.837 1.00 24.94 C ATOM 7 CD1 PHE A -2 99.652 75.275 -14.398 1.00 28.42 C ATOM 8 CD2 PHE A -2 99.766 72.901 -14.246 1.00 29.18 C ATOM 9 CE1 PHE A -2 100.654 75.265 -15.349 1.00 30.02 C ATOM 10 CE2 PHE A -2 100.768 72.886 -15.196 1.00 25.59 C ATOM 11 CZ PHE A -2 101.211 74.065 -15.747 1.00 25.71 C ATOM 12 HN3 PHE A -2 96.329 75.725 -13.974 1.00 0.00 H ATOM 13 HN2 PHE A -2 95.447 74.532 -14.803 1.00 0.00 H ATOM 14 HN1 PHE A -2 97.093 74.767 -15.151 1.00 0.00 H ATOM 15 N GLN A -1 95.217 72.580 -11.930 1.00 35.37 N ATOM 16 CA GLN A -1 94.174 72.421 -10.926 1.00 35.35 C ATOM 17 C GLN A -1 94.661 72.872 -9.553 1.00 33.69 C ATOM 18 O GLN A -1 95.739 72.476 -9.097 1.00 31.37 O ATOM 19 CB GLN A -1 93.722 70.962 -10.889 1.00 38.26 C ATOM 20 CG GLN A -1 92.956 70.549 -9.661 1.00 37.53 C ATOM 21 CD GLN A -1 93.124 69.061 -9.382 1.00 48.74 C ATOM 22 OE1 GLN A -1 93.674 68.325 -10.202 1.00 51.31 O ATOM 23 NE2 GLN A -1 92.649 68.617 -8.224 1.00 47.68 N ATOM 24 HE22 GLN A -1 92.192 69.276 -7.562 1.00 0.00 H ATOM 25 HE21 GLN A -1 92.734 67.610 -7.979 1.00 0.00 H ATOM 26 H GLN A -1 95.594 71.737 -12.409 1.00 0.00 H ATOM 27 N GLY A 0 93.856 73.705 -8.898 1.00 32.35 N ATOM 28 CA GLY A 0 94.244 74.240 -7.604 1.00 28.00 C ATOM 29 C GLY A 0 94.105 73.198 -6.508 1.00 32.11 C ATOM 30 O GLY A 0 93.084 72.507 -6.409 1.00 32.56 O ATOM 31 H GLY A 0 92.942 73.975 -9.315 1.00 0.00 H ATOM 32 N MET A 1 95.141 73.083 -5.675 1.00 28.99 N ATOM 33 CA MET A 1 95.148 72.165 -4.537 1.00 33.01 C ATOM 34 C MET A 1 94.456 72.854 -3.360 1.00 27.67 C ATOM 35 O MET A 1 95.061 73.192 -2.338 1.00 25.17 O ATOM 36 CB MET A 1 96.573 71.747 -4.191 1.00 35.02 C ATOM 37 CG MET A 1 96.711 70.324 -3.648 1.00 33.37 C ATOM 38 SD MET A 1 95.564 69.910 -2.316 1.00 42.22 S ATOM 39 CE MET A 1 96.412 70.586 -0.870 1.00 21.42 C ATOM 40 H MET A 1 95.981 73.673 -5.843 1.00 0.00 H ATOM 41 N SER A 2 93.157 73.074 -3.536 1.00 30.86 N ATOM 42 CA SER A 2 92.323 73.754 -2.559 1.00 29.06 C ATOM 43 C SER A 2 91.856 72.771 -1.491 1.00 31.07 C ATOM 44 O SER A 2 92.144 71.568 -1.536 1.00 30.10 O ATOM 45 CB SER A 2 91.121 74.403 -3.248 1.00 33.58 C ATOM 46 OG SER A 2 90.909 75.732 -2.791 1.00 33.18 O ATOM 47 HG SER A 2 91.712 76.278 -2.984 1.00 0.00 H ATOM 48 H SER A 2 92.715 72.743 -4.417 1.00 0.00 H ATOM 49 N SER A 3 91.112 73.296 -0.512 1.00 31.47 N ATOM 50 CA SER A 3 90.437 72.432 0.448 1.00 30.50 C ATOM 51 C SER A 3 89.437 71.508 -0.232 1.00 36.51 C ATOM 52 O SER A 3 89.116 70.446 0.316 1.00 34.35 O ATOM 53 CB SER A 3 89.737 73.274 1.517 1.00 30.12 C ATOM 54 OG SER A 3 90.675 74.066 2.227 1.00 28.24 O ATOM 55 HG SER A 3 90.202 74.601 2.912 1.00 0.00 H ATOM 56 H SER A 3 91.014 74.329 -0.435 1.00 0.00 H ATOM 57 N LYS A 4 88.945 71.888 -1.417 1.00 37.83 N ATOM 58 CA LYS A 4 88.057 71.018 -2.181 1.00 36.02 C ATOM 59 C LYS A 4 88.758 69.736 -2.616 1.00 36.67 C ATOM 60 O LYS A 4 88.099 68.710 -2.826 1.00 42.86 O ATOM 61 CB LYS A 4 87.513 71.780 -3.393 1.00 35.98 C ATOM 62 CG LYS A 4 86.631 70.963 -4.324 1.00 44.69 C ATOM 63 CD LYS A 4 86.531 71.609 -5.700 1.00 44.28 C ATOM 64 CE LYS A 4 86.100 70.605 -6.760 1.00 42.60 C ATOM 65 NZ LYS A 4 87.192 70.229 -7.702 1.00 46.00 N ATOM 66 HZ1 LYS A 4 87.530 71.079 -8.197 1.00 0.00 H ATOM 67 HZ2 LYS A 4 87.976 69.802 -7.169 1.00 0.00 H ATOM 68 HZ3 LYS A 4 86.829 69.544 -8.395 1.00 0.00 H ATOM 69 H LYS A 4 89.200 72.820 -1.800 1.00 0.00 H ATOM 70 N GLN A 5 90.084 69.771 -2.741 1.00 32.80 N ATOM 71 CA GLN A 5 90.862 68.627 -3.212 1.00 33.95 C ATOM 72 C GLN A 5 91.419 67.813 -2.050 1.00 33.26 C ATOM 73 O GLN A 5 91.109 66.626 -1.910 1.00 31.42 O ATOM 74 CB GLN A 5 92.004 69.102 -4.116 1.00 33.81 C ATOM 75 CG GLN A 5 91.576 69.449 -5.521 1.00 37.66 C ATOM 76 CD GLN A 5 90.426 70.424 -5.566 1.00 41.15 C ATOM 77 OE1 GLN A 5 90.585 71.614 -5.297 1.00 41.45 O ATOM 78 NE2 GLN A 5 89.242 69.913 -5.882 1.00 41.05 N ATOM 79 HE22 GLN A 5 89.155 68.900 -6.102 1.00 0.00 H ATOM 80 HE21 GLN A 5 88.402 70.525 -5.909 1.00 0.00 H ATOM 81 H GLN A 5 90.586 70.648 -2.493 1.00 0.00 H ATOM 82 N HIS A 6 92.251 68.441 -1.220 1.00 24.68 N ATOM 83 CA HIS A 6 92.854 67.788 -0.062 1.00 21.87 C ATOM 84 C HIS A 6 92.859 68.799 1.066 1.00 19.94 C ATOM 85 O HIS A 6 93.625 69.769 1.028 1.00 20.56 O ATOM 86 CB HIS A 6 94.269 67.303 -0.361 1.00 18.35 C ATOM 87 CG HIS A 6 94.313 66.203 -1.368 1.00 18.31 C ATOM 88 ND1 HIS A 6 94.655 66.413 -2.687 1.00 22.86 N ATOM 89 CD2 HIS A 6 94.021 64.887 -1.258 1.00 19.73 C ATOM 90 CE1 HIS A 6 94.587 65.267 -3.342 1.00 20.63 C ATOM 91 NE2 HIS A 6 94.205 64.327 -2.498 1.00 21.87 N ATOM 92 H HIS A 6 92.480 69.438 -1.405 1.00 0.00 H ATOM 93 N CYS A 7 91.995 68.590 2.044 1.00 18.04 N ATOM 94 CA CYS A 7 91.876 69.510 3.160 1.00 21.42 C ATOM 95 C CYS A 7 91.994 68.755 4.471 1.00 20.50 C ATOM 96 O CYS A 7 91.902 67.522 4.533 1.00 23.15 O ATOM 97 CB CYS A 7 90.545 70.258 3.131 1.00 23.92 C ATOM 98 SG CYS A 7 89.149 69.228 3.645 1.00 39.21 S ATOM 99 H CYS A 7 91.387 67.747 2.013 1.00 0.00 H ATOM 100 N VAL A 8 92.190 69.533 5.527 1.00 16.29 N ATOM 101 CA VAL A 8 92.090 69.072 6.903 1.00 18.06 C ATOM 102 C VAL A 8 91.067 69.955 7.603 1.00 17.05 C ATOM 103 O VAL A 8 91.083 71.180 7.433 1.00 15.57 O ATOM 104 CB VAL A 8 93.454 69.122 7.614 1.00 18.57 C ATOM 105 CG1 VAL A 8 93.308 68.696 9.056 1.00 20.87 C ATOM 106 CG2 VAL A 8 94.453 68.212 6.899 1.00 19.63 C ATOM 107 H VAL A 8 92.429 70.531 5.362 1.00 0.00 H ATOM 108 N LYS A 9 90.170 69.337 8.370 1.00 16.79 N ATOM 109 CA LYS A 9 89.150 70.072 9.104 1.00 18.12 C ATOM 110 C LYS A 9 89.743 70.667 10.374 1.00 14.88 C ATOM 111 O LYS A 9 90.328 69.949 11.189 1.00 19.71 O ATOM 112 CB LYS A 9 87.984 69.146 9.465 1.00 20.48 C ATOM 113 CG LYS A 9 87.291 68.494 8.285 1.00 29.20 C ATOM 114 CD LYS A 9 86.201 67.538 8.754 1.00 35.56 C ATOM 115 CE LYS A 9 85.489 66.876 7.585 1.00 35.91 C ATOM 116 NZ LYS A 9 85.998 67.369 6.268 1.00 39.25 N ATOM 117 HZ1 LYS A 9 85.847 68.396 6.202 1.00 0.00 H ATOM 118 HZ2 LYS A 9 87.014 67.161 6.191 1.00 0.00 H ATOM 119 HZ3 LYS A 9 85.486 66.892 5.499 1.00 0.00 H ATOM 120 H LYS A 9 90.199 68.300 8.447 1.00 0.00 H ATOM 121 N LEU A 10 89.577 71.973 10.551 1.00 12.90 N ATOM 122 CA LEU A 10 90.015 72.657 11.760 1.00 12.50 C ATOM 123 C LEU A 10 88.917 72.613 12.818 1.00 14.59 C ATOM 124 O LEU A 10 87.740 72.408 12.512 1.00 14.98 O ATOM 125 CB LEU A 10 90.385 74.100 11.435 1.00 13.78 C ATOM 126 CG LEU A 10 91.445 74.271 10.350 1.00 11.75 C ATOM 127 CD1 LEU A 10 91.606 75.737 9.991 1.00 14.76 C ATOM 128 CD2 LEU A 10 92.764 73.686 10.849 1.00 12.35 C ATOM 129 H LEU A 10 89.118 72.527 9.800 1.00 0.00 H ATOM 130 N ASN A 11 89.308 72.822 14.077 1.00 11.22 N ATOM 131 CA ASN A 11 88.353 72.620 15.164 1.00 14.27 C ATOM 132 C ASN A 11 87.347 73.757 15.299 1.00 15.28 C ATOM 133 O ASN A 11 86.492 73.702 16.190 1.00 18.32 O ATOM 134 CB ASN A 11 89.083 72.377 16.498 1.00 12.82 C ATOM 135 CG ASN A 11 89.952 73.538 16.935 1.00 11.89 C ATOM 136 OD1 ASN A 11 89.613 74.702 16.734 1.00 15.10 O ATOM 137 ND2 ASN A 11 91.068 73.223 17.569 1.00 12.32 N ATOM 138 HD22 ASN A 11 91.317 72.224 17.718 1.00 0.00 H ATOM 139 HD21 ASN A 11 91.697 73.974 17.919 1.00 0.00 H ATOM 140 H ASN A 11 90.281 73.125 14.282 1.00 0.00 H ATOM 141 N ASP A 12 87.421 74.775 14.449 1.00 12.77 N ATOM 142 CA ASP A 12 86.414 75.824 14.412 1.00 14.72 C ATOM 143 C ASP A 12 85.511 75.700 13.193 1.00 16.26 C ATOM 144 O ASP A 12 84.740 76.621 12.908 1.00 19.91 O ATOM 145 CB ASP A 12 87.075 77.207 14.463 1.00 14.55 C ATOM 146 CG ASP A 12 87.883 77.536 13.209 1.00 12.83 C ATOM 147 OD1 ASP A 12 88.053 76.664 12.339 1.00 13.41 O ATOM 148 OD2 ASP A 12 88.366 78.683 13.106 1.00 13.84 O ATOM 149 H ASP A 12 88.224 74.824 13.790 1.00 0.00 H ATOM 150 N GLY A 13 85.604 74.590 12.459 1.00 15.83 N ATOM 151 CA GLY A 13 84.777 74.338 11.301 1.00 17.93 C ATOM 152 C GLY A 13 85.405 74.701 9.970 1.00 19.94 C ATOM 153 O GLY A 13 84.918 74.246 8.927 1.00 22.86 O ATOM 154 H GLY A 13 86.305 73.872 12.733 1.00 0.00 H ATOM 155 N HIS A 14 86.464 75.504 9.968 1.00 15.12 N ATOM 156 CA HIS A 14 87.095 75.877 8.715 1.00 15.10 C ATOM 157 C HIS A 14 87.991 74.752 8.198 1.00 15.47 C ATOM 158 O HIS A 14 88.329 73.805 8.916 1.00 17.14 O ATOM 159 CB HIS A 14 87.886 77.172 8.890 1.00 15.41 C ATOM 160 CG HIS A 14 87.012 78.374 9.074 1.00 14.62 C ATOM 161 ND1 HIS A 14 86.219 78.872 8.061 1.00 19.56 N ATOM 162 CD2 HIS A 14 86.788 79.165 10.149 1.00 16.31 C ATOM 163 CE1 HIS A 14 85.551 79.923 8.503 1.00 20.19 C ATOM 164 NE2 HIS A 14 85.879 80.123 9.766 1.00 19.09 N ATOM 165 H HIS A 14 86.842 75.866 10.867 1.00 0.00 H ATOM 166 N LEU A 15 88.343 74.845 6.919 1.00 15.51 N ATOM 167 CA LEU A 15 89.147 73.835 6.242 1.00 14.64 C ATOM 168 C LEU A 15 90.466 74.459 5.820 1.00 15.46 C ATOM 169 O LEU A 15 90.490 75.593 5.329 1.00 18.18 O ATOM 170 CB LEU A 15 88.422 73.276 5.010 1.00 18.79 C ATOM 171 CG LEU A 15 87.042 72.658 5.231 1.00 21.89 C ATOM 172 CD1 LEU A 15 86.387 72.333 3.895 1.00 22.21 C ATOM 173 CD2 LEU A 15 87.163 71.414 6.074 1.00 21.95 C ATOM 174 H LEU A 15 88.031 75.676 6.377 1.00 0.00 H ATOM 175 N ILE A 16 91.558 73.727 5.996 1.00 12.88 N ATOM 176 CA ILE A 16 92.888 74.168 5.587 1.00 10.60 C ATOM 177 C ILE A 16 93.405 73.209 4.524 1.00 12.84 C ATOM 178 O ILE A 16 93.300 71.990 4.703 1.00 13.16 O ATOM 179 CB ILE A 16 93.868 74.262 6.769 1.00 11.66 C ATOM 180 CG1 ILE A 16 95.176 74.915 6.328 1.00 11.73 C ATOM 181 CG2 ILE A 16 94.096 72.889 7.462 1.00 12.18 C ATOM 182 CD1 ILE A 16 96.054 75.375 7.488 1.00 11.83 C ATOM 183 H ILE A 16 91.462 72.795 6.447 1.00 0.00 H ATOM 184 N PRO A 17 93.948 73.685 3.401 1.00 11.32 N ATOM 185 CA PRO A 17 94.539 72.757 2.424 1.00 11.62 C ATOM 186 C PRO A 17 95.689 71.973 3.039 1.00 13.15 C ATOM 187 O PRO A 17 96.507 72.523 3.785 1.00 10.91 O ATOM 188 CB PRO A 17 95.021 73.681 1.302 1.00 11.80 C ATOM 189 CG PRO A 17 94.091 74.883 1.391 1.00 13.02 C ATOM 190 CD PRO A 17 93.892 75.065 2.884 1.00 13.36 C ATOM 191 N ALA A 18 95.743 70.670 2.719 1.00 10.71 N ATOM 192 CA ALA A 18 96.631 69.743 3.411 1.00 12.46 C ATOM 193 C ALA A 18 98.108 69.955 3.106 1.00 12.99 C ATOM 194 O ALA A 18 98.946 69.409 3.830 1.00 13.98 O ATOM 195 CB ALA A 18 96.242 68.301 3.077 1.00 15.14 C ATOM 196 H ALA A 18 95.134 70.312 1.956 1.00 0.00 H ATOM 197 N LEU A 19 98.445 70.711 2.062 1.00 11.31 N ATOM 198 CA LEU A 19 99.813 71.105 1.745 1.00 10.77 C ATOM 199 C LEU A 19 99.840 72.612 1.561 1.00 10.89 C ATOM 200 O LEU A 19 99.027 73.164 0.810 1.00 12.12 O ATOM 201 CB LEU A 19 100.328 70.423 0.471 1.00 11.70 C ATOM 202 CG LEU A 19 101.750 70.775 0.027 1.00 11.92 C ATOM 203 CD1 LEU A 19 102.780 70.198 0.979 1.00 15.14 C ATOM 204 CD2 LEU A 19 101.986 70.252 -1.393 1.00 16.08 C ATOM 205 H LEU A 19 97.685 71.041 1.434 1.00 0.00 H ATOM 206 N GLY A 20 100.765 73.270 2.255 1.00 10.70 N ATOM 207 CA GLY A 20 100.944 74.699 2.100 1.00 10.38 C ATOM 208 C GLY A 20 102.238 75.076 1.416 1.00 10.45 C ATOM 209 O GLY A 20 103.162 74.258 1.307 1.00 11.69 O ATOM 210 H GLY A 20 101.371 72.749 2.921 1.00 0.00 H ATOM 211 N PHE A 21 102.306 76.315 0.938 1.00 9.54 N ATOM 212 CA PHE A 21 103.523 76.889 0.383 1.00 10.46 C ATOM 213 C PHE A 21 104.134 77.836 1.410 1.00 10.55 C ATOM 214 O PHE A 21 103.497 78.819 1.802 1.00 11.62 O ATOM 215 CB PHE A 21 103.222 77.622 -0.927 1.00 12.00 C ATOM 216 CG PHE A 21 104.452 78.071 -1.670 1.00 12.91 C ATOM 217 CD1 PHE A 21 105.271 77.147 -2.312 1.00 12.63 C ATOM 218 CD2 PHE A 21 104.786 79.419 -1.727 1.00 12.85 C ATOM 219 CE1 PHE A 21 106.415 77.556 -2.993 1.00 14.43 C ATOM 220 CE2 PHE A 21 105.929 79.835 -2.413 1.00 13.97 C ATOM 221 CZ PHE A 21 106.747 78.903 -3.040 1.00 13.38 C ATOM 222 H PHE A 21 101.448 76.902 0.962 1.00 0.00 H ATOM 223 N GLY A 22 105.359 77.537 1.850 1.00 10.77 N ATOM 224 CA GLY A 22 106.041 78.419 2.781 1.00 10.56 C ATOM 225 C GLY A 22 106.741 79.564 2.072 1.00 11.52 C ATOM 226 O GLY A 22 107.104 79.477 0.897 1.00 12.86 O ATOM 227 H GLY A 22 105.827 76.668 1.524 1.00 0.00 H ATOM 228 N THR A 23 106.927 80.663 2.804 1.00 9.35 N ATOM 229 CA THR A 23 107.537 81.854 2.219 1.00 10.72 C ATOM 230 C THR A 23 108.644 82.440 3.088 1.00 10.77 C ATOM 231 O THR A 23 108.988 83.621 2.918 1.00 11.61 O ATOM 232 CB THR A 23 106.493 82.937 1.930 1.00 11.13 C ATOM 233 OG1 THR A 23 105.889 83.354 3.165 1.00 11.18 O ATOM 234 CG2 THR A 23 105.417 82.441 0.977 1.00 10.69 C ATOM 235 HG1 THR A 23 105.452 82.577 3.596 1.00 0.00 H ATOM 236 H THR A 23 106.635 80.672 3.802 1.00 0.00 H ATOM 237 N TYR A 24 109.210 81.671 4.023 1.00 11.14 N ATOM 238 CA TYR A 24 110.392 82.152 4.730 1.00 10.91 C ATOM 239 C TYR A 24 111.469 82.549 3.723 1.00 11.51 C ATOM 240 O TYR A 24 111.733 81.823 2.761 1.00 12.95 O ATOM 241 CB TYR A 24 110.940 81.087 5.685 1.00 11.64 C ATOM 242 CG TYR A 24 112.295 81.484 6.220 1.00 14.41 C ATOM 243 CD1 TYR A 24 112.411 82.408 7.250 1.00 13.83 C ATOM 244 CD2 TYR A 24 113.457 80.968 5.668 1.00 13.03 C ATOM 245 CE1 TYR A 24 113.661 82.793 7.724 1.00 16.29 C ATOM 246 CE2 TYR A 24 114.698 81.346 6.128 1.00 16.95 C ATOM 247 CZ TYR A 24 114.799 82.251 7.150 1.00 17.35 C ATOM 248 OH TYR A 24 116.051 82.604 7.596 1.00 23.09 O ATOM 249 HH TYR A 24 116.522 81.798 7.925 1.00 0.00 H ATOM 250 H TYR A 24 108.811 80.737 4.245 1.00 0.00 H ATOM 251 N LYS A 25 112.092 83.718 3.942 1.00 13.38 N ATOM 252 CA LYS A 25 113.092 84.209 2.991 1.00 16.44 C ATOM 253 C LYS A 25 114.483 84.244 3.609 1.00 17.18 C ATOM 254 O LYS A 25 114.726 85.047 4.524 1.00 17.92 O ATOM 255 CB LYS A 25 112.715 85.600 2.481 1.00 15.78 C ATOM 256 CG LYS A 25 113.606 86.068 1.325 1.00 18.30 C ATOM 257 CD LYS A 25 113.431 87.552 1.030 1.00 20.54 C ATOM 258 CE LYS A 25 114.070 88.425 2.106 1.00 19.18 C ATOM 259 NZ LYS A 25 115.553 88.250 2.170 1.00 23.04 N ATOM 260 HZ1 LYS A 25 115.775 87.257 2.386 1.00 0.00 H ATOM 261 HZ2 LYS A 25 115.971 88.509 1.254 1.00 0.00 H ATOM 262 HZ3 LYS A 25 115.941 88.863 2.915 1.00 0.00 H ATOM 263 H LYS A 25 111.864 84.276 4.789 1.00 0.00 H ATOM 264 N PRO A 26 115.426 83.426 3.140 1.00 15.75 N ATOM 265 CA PRO A 26 116.791 83.501 3.662 1.00 19.12 C ATOM 266 C PRO A 26 117.427 84.841 3.334 1.00 22.73 C ATOM 267 O PRO A 26 117.043 85.522 2.381 1.00 22.45 O ATOM 268 CB PRO A 26 117.511 82.351 2.947 1.00 21.27 C ATOM 269 CG PRO A 26 116.410 81.431 2.488 1.00 23.38 C ATOM 270 CD PRO A 26 115.281 82.358 2.137 1.00 19.23 C ATOM 271 N LYS A 27 118.414 85.212 4.154 1.00 24.37 N ATOM 272 CA LYS A 27 119.128 86.476 3.972 1.00 29.39 C ATOM 273 C LYS A 27 119.626 86.646 2.541 1.00 29.86 C ATOM 274 O LYS A 27 119.493 87.726 1.950 1.00 33.05 O ATOM 275 CB LYS A 27 120.301 86.547 4.957 1.00 33.45 C ATOM 276 CG LYS A 27 121.225 87.733 4.766 1.00 42.32 C ATOM 277 CD LYS A 27 120.520 89.027 5.093 1.00 43.67 C ATOM 278 CE LYS A 27 121.456 89.927 5.888 1.00 40.64 C ATOM 279 NZ LYS A 27 122.503 90.558 5.005 1.00 44.96 N ATOM 280 HZ1 LYS A 27 123.069 89.812 4.553 1.00 0.00 H ATOM 281 HZ2 LYS A 27 122.038 91.132 4.273 1.00 0.00 H ATOM 282 HZ3 LYS A 27 123.122 91.164 5.581 1.00 0.00 H ATOM 283 H LYS A 27 118.681 84.587 4.941 1.00 0.00 H ATOM 284 N GLU A 28 120.185 85.579 1.963 1.00 30.51 N ATOM 285 CA GLU A 28 120.853 85.634 0.668 1.00 33.75 C ATOM 286 C GLU A 28 119.891 85.745 -0.507 1.00 33.59 C ATOM 287 O GLU A 28 120.350 85.920 -1.642 1.00 36.22 O ATOM 288 CB GLU A 28 121.726 84.388 0.490 1.00 35.85 C ATOM 289 CG GLU A 28 120.930 83.090 0.327 1.00 35.17 C ATOM 290 CD GLU A 28 120.726 82.337 1.634 1.00 37.21 C ATOM 291 OE1 GLU A 28 120.740 82.975 2.713 1.00 38.39 O ATOM 292 OE2 GLU A 28 120.548 81.098 1.578 1.00 41.37 O ATOM 293 H GLU A 28 120.142 84.666 2.460 1.00 0.00 H ATOM 294 N VAL A 29 118.588 85.644 -0.274 1.00 28.18 N ATOM 295 CA VAL A 29 117.586 85.616 -1.336 1.00 25.76 C ATOM 296 C VAL A 29 116.945 86.999 -1.424 1.00 24.26 C ATOM 297 O VAL A 29 116.416 87.484 -0.415 1.00 25.32 O ATOM 298 CB VAL A 29 116.527 84.535 -1.073 1.00 23.22 C ATOM 299 CG1 VAL A 29 115.447 84.566 -2.151 1.00 23.18 C ATOM 300 CG2 VAL A 29 117.185 83.157 -1.002 1.00 25.14 C ATOM 301 H VAL A 29 118.265 85.582 0.713 1.00 0.00 H ATOM 302 N PRO A 30 116.970 87.658 -2.582 1.00 24.90 N ATOM 303 CA PRO A 30 116.333 88.977 -2.695 1.00 21.63 C ATOM 304 C PRO A 30 114.813 88.873 -2.689 1.00 22.40 C ATOM 305 O PRO A 30 114.229 87.846 -3.042 1.00 21.00 O ATOM 306 CB PRO A 30 116.847 89.506 -4.041 1.00 22.84 C ATOM 307 CG PRO A 30 117.195 88.278 -4.824 1.00 27.83 C ATOM 308 CD PRO A 30 117.679 87.269 -3.815 1.00 24.15 C ATOM 309 N LYS A 31 114.168 89.977 -2.290 1.00 17.90 N ATOM 310 CA LYS A 31 112.710 89.980 -2.176 1.00 19.37 C ATOM 311 C LYS A 31 112.031 89.782 -3.525 1.00 20.64 C ATOM 312 O LYS A 31 110.897 89.291 -3.580 1.00 19.60 O ATOM 313 CB LYS A 31 112.227 91.274 -1.526 1.00 20.60 C ATOM 314 CG LYS A 31 112.613 91.396 -0.063 1.00 21.32 C ATOM 315 CD LYS A 31 111.855 92.526 0.602 1.00 24.01 C ATOM 316 CE LYS A 31 112.291 92.728 2.042 1.00 28.00 C ATOM 317 NZ LYS A 31 111.531 93.844 2.667 1.00 28.73 N ATOM 318 HZ1 LYS A 31 111.705 94.721 2.135 1.00 0.00 H ATOM 319 HZ2 LYS A 31 110.515 93.622 2.650 1.00 0.00 H ATOM 320 HZ3 LYS A 31 111.844 93.966 3.651 1.00 0.00 H ATOM 321 H LYS A 31 114.707 90.836 -2.060 1.00 0.00 H ATOM 322 N SER A 32 112.695 90.165 -4.618 1.00 19.10 N ATOM 323 CA SER A 32 112.135 89.914 -5.939 1.00 19.90 C ATOM 324 C SER A 32 111.972 88.420 -6.202 1.00 16.72 C ATOM 325 O SER A 32 111.067 88.013 -6.944 1.00 16.96 O ATOM 326 CB SER A 32 113.020 90.550 -7.009 1.00 20.03 C ATOM 327 OG SER A 32 114.346 90.083 -6.901 1.00 22.00 O ATOM 328 HG SER A 32 114.902 90.507 -7.602 1.00 0.00 H ATOM 329 H SER A 32 113.614 90.643 -4.526 1.00 0.00 H ATOM 330 N LYS A 33 112.837 87.593 -5.609 1.00 18.00 N ATOM 331 CA LYS A 33 112.683 86.151 -5.758 1.00 17.20 C ATOM 332 C LYS A 33 111.503 85.627 -4.944 1.00 16.30 C ATOM 333 O LYS A 33 110.815 84.699 -5.386 1.00 14.82 O ATOM 334 CB LYS A 33 113.981 85.441 -5.366 1.00 19.80 C ATOM 335 CG LYS A 33 113.949 83.910 -5.530 1.00 24.21 C ATOM 336 CD LYS A 33 113.666 83.465 -6.960 1.00 27.24 C ATOM 337 CE LYS A 33 114.943 83.324 -7.772 1.00 30.85 C ATOM 338 NZ LYS A 33 114.679 82.854 -9.172 1.00 33.24 N ATOM 339 HZ1 LYS A 33 114.211 81.925 -9.142 1.00 0.00 H ATOM 340 HZ2 LYS A 33 114.063 83.538 -9.656 1.00 0.00 H ATOM 341 HZ3 LYS A 33 115.580 82.774 -9.685 1.00 0.00 H ATOM 342 H LYS A 33 113.619 87.977 -5.042 1.00 0.00 H ATOM 343 N SER A 34 111.239 86.217 -3.776 1.00 16.27 N ATOM 344 CA SER A 34 110.039 85.865 -3.011 1.00 13.61 C ATOM 345 C SER A 34 108.770 86.118 -3.818 1.00 14.95 C ATOM 346 O SER A 34 107.853 85.284 -3.845 1.00 14.17 O ATOM 347 CB SER A 34 109.999 86.659 -1.704 1.00 15.91 C ATOM 348 OG SER A 34 111.112 86.347 -0.887 1.00 16.78 O ATOM 349 HG SER A 34 111.102 85.381 -0.673 1.00 0.00 H ATOM 350 H SER A 34 111.893 86.935 -3.404 1.00 0.00 H ATOM 351 N LEU A 35 108.685 87.285 -4.465 1.00 13.64 N ATOM 352 CA LEU A 35 107.539 87.597 -5.307 1.00 13.89 C ATOM 353 C LEU A 35 107.414 86.604 -6.457 1.00 14.41 C ATOM 354 O LEU A 35 106.332 86.066 -6.711 1.00 14.29 O ATOM 355 CB LEU A 35 107.668 89.028 -5.840 1.00 15.90 C ATOM 356 CG LEU A 35 106.640 89.449 -6.882 1.00 15.75 C ATOM 357 CD1 LEU A 35 105.248 89.419 -6.308 1.00 17.33 C ATOM 358 CD2 LEU A 35 106.970 90.849 -7.431 1.00 19.20 C ATOM 359 H LEU A 35 109.451 87.982 -4.365 1.00 0.00 H ATOM 360 N GLU A 36 108.515 86.364 -7.172 1.00 13.55 N ATOM 361 CA GLU A 36 108.476 85.447 -8.310 1.00 14.96 C ATOM 362 C GLU A 36 108.010 84.064 -7.875 1.00 13.69 C ATOM 363 O GLU A 36 107.130 83.462 -8.506 1.00 14.98 O ATOM 364 CB GLU A 36 109.859 85.362 -8.961 1.00 16.14 C ATOM 365 CG GLU A 36 109.969 84.300 -10.056 1.00 20.00 C ATOM 366 CD GLU A 36 111.399 84.080 -10.528 1.00 27.70 C ATOM 367 OE1 GLU A 36 111.777 84.641 -11.580 1.00 32.83 O ATOM 368 OE2 GLU A 36 112.150 83.346 -9.849 1.00 30.27 O ATOM 369 H GLU A 36 109.408 86.833 -6.918 1.00 0.00 H ATOM 370 N ALA A 37 108.586 83.554 -6.783 1.00 14.78 N ATOM 371 CA ALA A 37 108.260 82.206 -6.329 1.00 11.99 C ATOM 372 C ALA A 37 106.802 82.093 -5.908 1.00 12.26 C ATOM 373 O ALA A 37 106.154 81.074 -6.180 1.00 12.11 O ATOM 374 CB ALA A 37 109.182 81.807 -5.179 1.00 14.00 C ATOM 375 H ALA A 37 109.274 84.124 -6.251 1.00 0.00 H ATOM 376 N ALA A 38 106.265 83.127 -5.242 1.00 11.66 N ATOM 377 CA ALA A 38 104.868 83.096 -4.819 1.00 11.76 C ATOM 378 C ALA A 38 103.917 83.155 -6.010 1.00 12.62 C ATOM 379 O ALA A 38 102.880 82.485 -6.022 1.00 12.60 O ATOM 380 CB ALA A 38 104.597 84.245 -3.846 1.00 13.06 C ATOM 381 H ALA A 38 106.850 83.959 -5.025 1.00 0.00 H ATOM 382 N CYS A 39 104.245 83.964 -7.015 1.00 13.71 N ATOM 383 CA CYS A 39 103.450 83.969 -8.238 1.00 12.95 C ATOM 384 C CYS A 39 103.424 82.590 -8.883 1.00 12.72 C ATOM 385 O CYS A 39 102.361 82.101 -9.282 1.00 13.98 O ATOM 386 CB CYS A 39 104.013 84.993 -9.221 1.00 11.64 C ATOM 387 SG CYS A 39 103.744 86.732 -8.796 1.00 16.57 S ATOM 388 H CYS A 39 105.069 84.593 -6.928 1.00 0.00 H ATOM 389 N LEU A 40 104.598 81.958 -9.010 1.00 12.49 N ATOM 390 CA LEU A 40 104.666 80.638 -9.627 1.00 12.14 C ATOM 391 C LEU A 40 103.913 79.611 -8.793 1.00 12.23 C ATOM 392 O LEU A 40 103.236 78.737 -9.343 1.00 11.85 O ATOM 393 CB LEU A 40 106.121 80.212 -9.818 1.00 13.00 C ATOM 394 CG LEU A 40 106.843 80.962 -10.933 1.00 13.35 C ATOM 395 CD1 LEU A 40 108.327 80.732 -10.810 1.00 15.77 C ATOM 396 CD2 LEU A 40 106.323 80.521 -12.292 1.00 15.43 C ATOM 397 H LEU A 40 105.468 82.412 -8.666 1.00 0.00 H ATOM 398 N ALA A 41 103.995 79.717 -7.461 1.00 11.90 N ATOM 399 CA ALA A 41 103.304 78.745 -6.622 1.00 10.77 C ATOM 400 C ALA A 41 101.801 78.789 -6.854 1.00 12.08 C ATOM 401 O ALA A 41 101.142 77.744 -6.970 1.00 11.61 O ATOM 402 CB ALA A 41 103.635 78.995 -5.152 1.00 11.22 C ATOM 403 H ALA A 41 104.546 80.485 -7.029 1.00 0.00 H ATOM 404 N LEU A 42 101.241 79.990 -6.947 1.00 12.40 N ATOM 405 CA LEU A 42 99.824 80.108 -7.247 1.00 11.59 C ATOM 406 C LEU A 42 99.521 79.577 -8.639 1.00 12.66 C ATOM 407 O LEU A 42 98.530 78.866 -8.835 1.00 14.69 O ATOM 408 CB LEU A 42 99.389 81.566 -7.123 1.00 12.88 C ATOM 409 CG LEU A 42 99.541 82.111 -5.704 1.00 12.28 C ATOM 410 CD1 LEU A 42 99.363 83.612 -5.698 1.00 15.99 C ATOM 411 CD2 LEU A 42 98.517 81.450 -4.797 1.00 16.31 C ATOM 412 H LEU A 42 101.816 80.845 -6.805 1.00 0.00 H ATOM 413 N ASP A 43 100.383 79.901 -9.613 1.00 12.90 N ATOM 414 CA ASP A 43 100.166 79.447 -10.983 1.00 13.15 C ATOM 415 C ASP A 43 100.098 77.930 -11.069 1.00 15.44 C ATOM 416 O ASP A 43 99.263 77.380 -11.800 1.00 14.57 O ATOM 417 CB ASP A 43 101.286 79.948 -11.896 1.00 13.92 C ATOM 418 CG ASP A 43 101.147 81.402 -12.263 1.00 20.89 C ATOM 419 OD1 ASP A 43 100.080 81.992 -12.002 1.00 25.19 O ATOM 420 OD2 ASP A 43 102.122 81.942 -12.829 1.00 22.25 O ATOM 421 H ASP A 43 101.216 80.482 -9.390 1.00 0.00 H ATOM 422 N VAL A 44 100.979 77.225 -10.346 1.00 12.05 N ATOM 423 CA VAL A 44 101.064 75.779 -10.526 1.00 13.17 C ATOM 424 C VAL A 44 100.143 75.022 -9.586 1.00 12.28 C ATOM 425 O VAL A 44 100.056 73.790 -9.682 1.00 14.08 O ATOM 426 CB VAL A 44 102.511 75.266 -10.379 1.00 11.54 C ATOM 427 CG1 VAL A 44 103.406 75.936 -11.411 1.00 13.05 C ATOM 428 CG2 VAL A 44 103.038 75.470 -8.952 1.00 11.93 C ATOM 429 H VAL A 44 101.598 77.705 -9.661 1.00 0.00 H ATOM 430 N GLY A 45 99.431 75.717 -8.697 1.00 11.94 N ATOM 431 CA GLY A 45 98.349 75.067 -7.982 1.00 11.81 C ATOM 432 C GLY A 45 98.304 75.194 -6.470 1.00 11.28 C ATOM 433 O GLY A 45 97.375 74.665 -5.852 1.00 15.16 O ATOM 434 H GLY A 45 99.650 76.718 -8.518 1.00 0.00 H ATOM 435 N TYR A 46 99.262 75.868 -5.848 1.00 11.76 N ATOM 436 CA TYR A 46 99.173 76.045 -4.403 1.00 10.56 C ATOM 437 C TYR A 46 98.022 76.975 -4.059 1.00 12.00 C ATOM 438 O TYR A 46 97.783 77.977 -4.738 1.00 12.74 O ATOM 439 CB TYR A 46 100.476 76.610 -3.837 1.00 12.30 C ATOM 440 CG TYR A 46 101.593 75.600 -3.828 1.00 10.42 C ATOM 441 CD1 TYR A 46 102.390 75.406 -4.952 1.00 10.68 C ATOM 442 CD2 TYR A 46 101.842 74.813 -2.703 1.00 11.09 C ATOM 443 CE1 TYR A 46 103.410 74.476 -4.952 1.00 11.88 C ATOM 444 CE2 TYR A 46 102.865 73.868 -2.695 1.00 11.39 C ATOM 445 CZ TYR A 46 103.638 73.705 -3.829 1.00 11.57 C ATOM 446 OH TYR A 46 104.650 72.772 -3.833 1.00 12.31 O ATOM 447 HH TYR A 46 105.103 72.782 -4.713 1.00 0.00 H ATOM 448 H TYR A 46 100.063 76.263 -6.381 1.00 0.00 H ATOM 449 N ARG A 47 97.316 76.646 -2.980 1.00 12.08 N ATOM 450 CA ARG A 47 96.229 77.494 -2.510 1.00 12.52 C ATOM 451 C ARG A 47 96.377 77.907 -1.061 1.00 15.04 C ATOM 452 O ARG A 47 95.783 78.913 -0.653 1.00 19.73 O ATOM 453 CB ARG A 47 94.879 76.789 -2.717 1.00 14.22 C ATOM 454 CG ARG A 47 94.567 76.527 -4.199 1.00 14.47 C ATOM 455 CD ARG A 47 94.377 77.832 -4.965 1.00 14.94 C ATOM 456 NE ARG A 47 94.118 77.636 -6.396 1.00 17.76 N ATOM 457 CZ ARG A 47 95.027 77.787 -7.357 1.00 16.18 C ATOM 458 NH1 ARG A 47 96.281 78.131 -7.066 1.00 13.68 N ATOM 459 NH2 ARG A 47 94.682 77.596 -8.628 1.00 18.84 N ATOM 460 HE ARG A 47 93.156 77.360 -6.680 1.00 0.00 H ATOM 461 HH12 ARG A 47 96.979 78.245 -7.828 1.00 0.00 H ATOM 462 HH11 ARG A 47 96.562 78.286 -6.077 1.00 0.00 H ATOM 463 HH22 ARG A 47 95.389 77.713 -9.382 1.00 0.00 H ATOM 464 HH21 ARG A 47 93.706 77.330 -8.867 1.00 0.00 H ATOM 465 H ARG A 47 97.544 75.771 -2.465 1.00 0.00 H ATOM 466 N HIS A 48 97.198 77.218 -0.304 1.00 11.34 N ATOM 467 CA HIS A 48 97.519 77.540 1.078 1.00 10.75 C ATOM 468 C HIS A 48 98.879 78.232 1.038 1.00 10.65 C ATOM 469 O HIS A 48 99.867 77.632 0.606 1.00 12.16 O ATOM 470 CB HIS A 48 97.513 76.227 1.863 1.00 10.85 C ATOM 471 CG HIS A 48 98.033 76.290 3.266 1.00 11.27 C ATOM 472 ND1 HIS A 48 98.055 75.169 4.074 1.00 11.00 N ATOM 473 CD2 HIS A 48 98.578 77.293 3.995 1.00 11.00 C ATOM 474 CE1 HIS A 48 98.587 75.484 5.241 1.00 10.54 C ATOM 475 NE2 HIS A 48 98.910 76.764 5.221 1.00 10.47 N ATOM 476 H HIS A 48 97.652 76.381 -0.722 1.00 0.00 H ATOM 477 N VAL A 49 98.914 79.513 1.407 1.00 10.09 N ATOM 478 CA VAL A 49 100.145 80.298 1.404 1.00 10.77 C ATOM 479 C VAL A 49 100.411 80.740 2.833 1.00 11.00 C ATOM 480 O VAL A 49 99.552 81.373 3.462 1.00 11.15 O ATOM 481 CB VAL A 49 100.059 81.508 0.460 1.00 11.97 C ATOM 482 CG1 VAL A 49 101.360 82.306 0.521 1.00 14.27 C ATOM 483 CG2 VAL A 49 99.777 81.045 -0.958 1.00 14.86 C ATOM 484 H VAL A 49 98.030 79.971 1.709 1.00 0.00 H ATOM 485 N ASP A 50 101.588 80.400 3.351 1.00 9.56 N ATOM 486 CA ASP A 50 101.964 80.705 4.725 1.00 9.21 C ATOM 487 C ASP A 50 103.055 81.767 4.723 1.00 10.75 C ATOM 488 O ASP A 50 104.095 81.591 4.079 1.00 10.74 O ATOM 489 CB ASP A 50 102.442 79.437 5.439 1.00 11.07 C ATOM 490 CG ASP A 50 102.852 79.706 6.868 1.00 11.19 C ATOM 491 OD1 ASP A 50 103.989 80.175 7.054 1.00 11.92 O ATOM 492 OD2 ASP A 50 102.044 79.466 7.796 1.00 11.53 O ATOM 493 H ASP A 50 102.269 79.895 2.749 1.00 0.00 H ATOM 494 N THR A 51 102.823 82.869 5.438 1.00 9.64 N ATOM 495 CA THR A 51 103.834 83.921 5.537 1.00 9.92 C ATOM 496 C THR A 51 103.846 84.454 6.972 1.00 11.23 C ATOM 497 O THR A 51 103.218 83.885 7.874 1.00 11.34 O ATOM 498 CB THR A 51 103.598 85.001 4.469 1.00 12.79 C ATOM 499 OG1 THR A 51 104.789 85.785 4.320 1.00 12.66 O ATOM 500 CG2 THR A 51 102.407 85.908 4.811 1.00 13.53 C ATOM 501 HG1 THR A 51 105.536 85.198 4.041 1.00 0.00 H ATOM 502 H THR A 51 101.914 82.981 5.930 1.00 0.00 H ATOM 503 N ALA A 52 104.599 85.532 7.199 1.00 10.24 N ATOM 504 CA ALA A 52 104.763 86.091 8.539 1.00 11.13 C ATOM 505 C ALA A 52 105.202 87.538 8.415 1.00 11.97 C ATOM 506 O ALA A 52 105.865 87.913 7.443 1.00 15.03 O ATOM 507 CB ALA A 52 105.804 85.321 9.361 1.00 10.74 C ATOM 508 H ALA A 52 105.083 85.987 6.399 1.00 0.00 H ATOM 509 N TYR A 53 104.833 88.353 9.406 1.00 12.03 N ATOM 510 CA TYR A 53 105.366 89.710 9.432 1.00 12.36 C ATOM 511 C TYR A 53 106.889 89.694 9.459 1.00 13.49 C ATOM 512 O TYR A 53 107.543 90.461 8.741 1.00 13.87 O ATOM 513 CB TYR A 53 104.831 90.487 10.639 1.00 13.26 C ATOM 514 CG TYR A 53 105.712 91.663 10.971 1.00 12.57 C ATOM 515 CD1 TYR A 53 105.615 92.850 10.255 1.00 13.49 C ATOM 516 CD2 TYR A 53 106.675 91.569 11.966 1.00 12.59 C ATOM 517 CE1 TYR A 53 106.441 93.927 10.551 1.00 15.95 C ATOM 518 CE2 TYR A 53 107.507 92.635 12.262 1.00 16.39 C ATOM 519 CZ TYR A 53 107.386 93.806 11.549 1.00 17.31 C ATOM 520 OH TYR A 53 108.213 94.870 11.840 1.00 22.99 O ATOM 521 HH TYR A 53 109.156 94.600 11.706 1.00 0.00 H ATOM 522 H TYR A 53 104.178 88.026 10.145 1.00 0.00 H ATOM 523 N ALA A 54 107.474 88.818 10.279 1.00 12.70 N ATOM 524 CA ALA A 54 108.912 88.841 10.512 1.00 14.07 C ATOM 525 C ALA A 54 109.728 88.414 9.297 1.00 17.58 C ATOM 526 O ALA A 54 110.938 88.641 9.291 1.00 22.14 O ATOM 527 CB ALA A 54 109.273 87.949 11.700 1.00 17.50 C ATOM 528 H ALA A 54 106.891 88.104 10.761 1.00 0.00 H ATOM 529 N TYR A 55 109.110 87.795 8.284 1.00 17.10 N ATOM 530 CA TYR A 55 109.850 87.428 7.076 1.00 20.33 C ATOM 531 C TYR A 55 110.108 88.640 6.185 1.00 19.43 C ATOM 532 O TYR A 55 110.952 88.566 5.279 1.00 22.64 O ATOM 533 CB TYR A 55 109.100 86.351 6.259 1.00 21.04 C ATOM 534 CG TYR A 55 108.730 85.046 6.973 1.00 18.99 C ATOM 535 CD1 TYR A 55 109.299 84.687 8.195 1.00 15.92 C ATOM 536 CD2 TYR A 55 107.805 84.162 6.395 1.00 19.34 C ATOM 537 CE1 TYR A 55 108.948 83.489 8.829 1.00 23.68 C ATOM 538 CE2 TYR A 55 107.450 82.959 7.012 1.00 15.97 C ATOM 539 CZ TYR A 55 108.023 82.628 8.236 1.00 21.16 C ATOM 540 OH TYR A 55 107.674 81.447 8.883 1.00 24.35 O ATOM 541 HH TYR A 55 108.176 81.377 9.733 1.00 0.00 H ATOM 542 H TYR A 55 108.096 87.573 8.356 1.00 0.00 H ATOM 543 N GLN A 56 109.382 89.738 6.409 1.00 16.73 N ATOM 544 CA GLN A 56 109.524 90.999 5.685 1.00 17.57 C ATOM 545 C GLN A 56 109.086 90.904 4.226 1.00 18.90 C ATOM 546 O GLN A 56 109.463 91.755 3.414 1.00 20.77 O ATOM 547 CB GLN A 56 110.961 91.538 5.761 1.00 23.18 C ATOM 548 CG GLN A 56 111.317 92.171 7.093 1.00 27.97 C ATOM 549 CD GLN A 56 112.824 92.322 7.280 1.00 34.93 C ATOM 550 OE1 GLN A 56 113.593 92.220 6.321 1.00 42.44 O ATOM 551 NE2 GLN A 56 113.244 92.592 8.518 1.00 37.26 N ATOM 552 HE22 GLN A 56 112.557 92.668 9.295 1.00 0.00 H ATOM 553 HE21 GLN A 56 114.258 92.726 8.705 1.00 0.00 H ATOM 554 H GLN A 56 108.660 89.692 7.156 1.00 0.00 H ATOM 555 N VAL A 57 108.268 89.916 3.864 1.00 15.52 N ATOM 556 CA VAL A 57 107.837 89.775 2.476 1.00 15.14 C ATOM 557 C VAL A 57 106.313 89.792 2.333 1.00 13.61 C ATOM 558 O VAL A 57 105.791 89.399 1.304 1.00 13.34 O ATOM 559 CB VAL A 57 108.433 88.512 1.821 1.00 15.89 C ATOM 560 CG1 VAL A 57 109.945 88.646 1.678 1.00 19.69 C ATOM 561 CG2 VAL A 57 108.058 87.270 2.613 1.00 17.19 C ATOM 562 H VAL A 57 107.933 89.238 4.578 1.00 0.00 H ATOM 563 N GLU A 58 105.579 90.239 3.356 1.00 14.56 N ATOM 564 CA GLU A 58 104.127 90.312 3.219 1.00 11.88 C ATOM 565 C GLU A 58 103.715 91.154 2.015 1.00 14.25 C ATOM 566 O GLU A 58 102.742 90.826 1.332 1.00 13.97 O ATOM 567 CB GLU A 58 103.498 90.868 4.498 1.00 14.08 C ATOM 568 CG GLU A 58 103.333 89.837 5.608 1.00 13.04 C ATOM 569 CD GLU A 58 102.885 90.463 6.909 1.00 14.84 C ATOM 570 OE1 GLU A 58 103.323 91.601 7.203 1.00 14.83 O ATOM 571 OE2 GLU A 58 102.096 89.823 7.631 1.00 14.80 O ATOM 572 H GLU A 58 106.038 90.532 4.242 1.00 0.00 H ATOM 573 N GLU A 59 104.442 92.240 1.736 1.00 16.92 N ATOM 574 CA GLU A 59 104.111 93.057 0.572 1.00 17.29 C ATOM 575 C GLU A 59 104.207 92.243 -0.712 1.00 15.54 C ATOM 576 O GLU A 59 103.304 92.286 -1.557 1.00 14.90 O ATOM 577 CB GLU A 59 105.032 94.274 0.497 1.00 18.61 C ATOM 578 CG GLU A 59 104.662 95.391 1.440 1.00 26.31 C ATOM 579 CD GLU A 59 105.264 96.711 1.008 1.00 37.55 C ATOM 580 OE1 GLU A 59 106.024 97.308 1.801 1.00 43.37 O ATOM 581 OE2 GLU A 59 104.987 97.135 -0.139 1.00 41.56 O ATOM 582 H GLU A 59 105.242 92.503 2.347 1.00 0.00 H ATOM 583 N GLU A 60 105.301 91.492 -0.869 1.00 17.08 N ATOM 584 CA GLU A 60 105.501 90.684 -2.070 1.00 15.48 C ATOM 585 C GLU A 60 104.474 89.557 -2.175 1.00 15.79 C ATOM 586 O GLU A 60 103.971 89.264 -3.268 1.00 14.39 O ATOM 587 CB GLU A 60 106.921 90.121 -2.084 1.00 15.31 C ATOM 588 CG GLU A 60 108.004 91.133 -2.459 1.00 17.67 C ATOM 589 CD GLU A 60 108.309 92.145 -1.360 1.00 23.02 C ATOM 590 OE1 GLU A 60 108.040 91.860 -0.173 1.00 21.18 O ATOM 591 OE2 GLU A 60 108.830 93.235 -1.684 1.00 28.69 O ATOM 592 H GLU A 60 106.024 91.482 -0.122 1.00 0.00 H ATOM 593 N ILE A 61 104.151 88.909 -1.054 1.00 14.04 N ATOM 594 CA ILE A 61 103.138 87.860 -1.085 1.00 14.93 C ATOM 595 C ILE A 61 101.787 88.446 -1.464 1.00 13.31 C ATOM 596 O ILE A 61 101.048 87.869 -2.268 1.00 15.25 O ATOM 597 CB ILE A 61 103.086 87.127 0.269 1.00 13.47 C ATOM 598 CG1 ILE A 61 104.459 86.551 0.628 1.00 19.07 C ATOM 599 CG2 ILE A 61 101.987 86.066 0.286 1.00 18.42 C ATOM 600 CD1 ILE A 61 105.174 85.852 -0.494 1.00 18.09 C ATOM 601 H ILE A 61 104.621 89.152 -0.159 1.00 0.00 H ATOM 602 N GLY A 62 101.460 89.626 -0.929 1.00 13.19 N ATOM 603 CA GLY A 62 100.209 90.262 -1.297 1.00 14.51 C ATOM 604 C GLY A 62 100.161 90.667 -2.756 1.00 13.13 C ATOM 605 O GLY A 62 99.096 90.596 -3.384 1.00 16.04 O ATOM 606 H GLY A 62 102.100 90.087 -0.251 1.00 0.00 H ATOM 607 N GLN A 63 101.300 91.088 -3.312 1.00 14.76 N ATOM 608 CA GLN A 63 101.351 91.419 -4.736 1.00 15.32 C ATOM 609 C GLN A 63 101.144 90.179 -5.592 1.00 15.44 C ATOM 610 O GLN A 63 100.444 90.230 -6.608 1.00 16.45 O ATOM 611 CB GLN A 63 102.681 92.087 -5.080 1.00 15.02 C ATOM 612 CG GLN A 63 102.782 93.521 -4.602 1.00 17.32 C ATOM 613 CD GLN A 63 104.217 93.987 -4.471 1.00 23.44 C ATOM 614 OE1 GLN A 63 105.133 93.391 -5.037 1.00 26.91 O ATOM 615 NE2 GLN A 63 104.421 95.063 -3.715 1.00 25.14 N ATOM 616 HE22 GLN A 63 103.617 95.535 -3.255 1.00 0.00 H ATOM 617 HE21 GLN A 63 105.385 95.431 -3.584 1.00 0.00 H ATOM 618 H GLN A 63 102.156 91.181 -2.729 1.00 0.00 H ATOM 619 N ALA A 64 101.734 89.053 -5.185 1.00 15.81 N ATOM 620 CA ALA A 64 101.539 87.814 -5.928 1.00 13.01 C ATOM 621 C ALA A 64 100.077 87.386 -5.899 1.00 17.02 C ATOM 622 O ALA A 64 99.515 86.988 -6.927 1.00 16.37 O ATOM 623 CB ALA A 64 102.446 86.727 -5.351 1.00 13.83 C ATOM 624 H ALA A 64 102.334 89.060 -4.336 1.00 0.00 H ATOM 625 N ILE A 65 99.435 87.486 -4.731 1.00 15.66 N ATOM 626 CA ILE A 65 98.029 87.112 -4.620 1.00 15.15 C ATOM 627 C ILE A 65 97.163 88.032 -5.475 1.00 17.72 C ATOM 628 O ILE A 65 96.294 87.571 -6.221 1.00 18.76 O ATOM 629 CB ILE A 65 97.583 87.116 -3.146 1.00 14.68 C ATOM 630 CG1 ILE A 65 98.214 85.941 -2.392 1.00 15.10 C ATOM 631 CG2 ILE A 65 96.056 87.061 -3.046 1.00 16.63 C ATOM 632 CD1 ILE A 65 98.005 86.023 -0.895 1.00 17.12 C ATOM 633 H ILE A 65 99.943 87.834 -3.893 1.00 0.00 H ATOM 634 N GLN A 66 97.396 89.347 -5.392 1.00 17.95 N ATOM 635 CA GLN A 66 96.575 90.283 -6.158 1.00 21.78 C ATOM 636 C GLN A 66 96.756 90.085 -7.658 1.00 21.29 C ATOM 637 O GLN A 66 95.786 90.155 -8.420 1.00 22.46 O ATOM 638 CB GLN A 66 96.896 91.723 -5.766 1.00 24.73 C ATOM 639 CG GLN A 66 96.179 92.173 -4.508 1.00 25.60 C ATOM 640 CD GLN A 66 94.744 91.665 -4.427 1.00 28.49 C ATOM 641 OE1 GLN A 66 93.914 91.964 -5.294 1.00 32.14 O ATOM 642 NE2 GLN A 66 94.444 90.890 -3.377 1.00 27.08 N ATOM 643 HE22 GLN A 66 95.174 90.664 -2.672 1.00 0.00 H ATOM 644 HE21 GLN A 66 93.481 90.514 -3.267 1.00 0.00 H ATOM 645 H GLN A 66 98.160 89.703 -4.783 1.00 0.00 H ATOM 646 N SER A 67 97.985 89.820 -8.103 1.00 21.16 N ATOM 647 CA SER A 67 98.194 89.614 -9.531 1.00 21.70 C ATOM 648 C SER A 67 97.588 88.297 -10.001 1.00 21.92 C ATOM 649 O SER A 67 97.082 88.218 -11.127 1.00 25.04 O ATOM 650 CB SER A 67 99.683 89.674 -9.866 1.00 24.51 C ATOM 651 OG SER A 67 100.425 88.771 -9.076 1.00 28.89 O ATOM 652 HG SER A 67 100.308 88.998 -8.120 1.00 0.00 H ATOM 653 H SER A 67 98.784 89.761 -7.440 1.00 0.00 H ATOM 654 N ALA A 68 97.613 87.260 -9.159 1.00 21.47 N ATOM 655 CA ALA A 68 96.988 85.999 -9.541 1.00 21.56 C ATOM 656 C ALA A 68 95.476 86.141 -9.649 1.00 23.82 C ATOM 657 O ALA A 68 94.856 85.561 -10.548 1.00 23.52 O ATOM 658 CB ALA A 68 97.345 84.904 -8.539 1.00 18.97 C ATOM 659 H ALA A 68 98.077 87.352 -8.233 1.00 0.00 H ATOM 660 N ILE A 69 94.865 86.899 -8.736 1.00 21.73 N ATOM 661 CA ILE A 69 93.420 87.095 -8.777 1.00 23.99 C ATOM 662 C ILE A 69 93.029 87.881 -10.020 1.00 25.50 C ATOM 663 O ILE A 69 92.068 87.531 -10.716 1.00 27.20 O ATOM 664 CB ILE A 69 92.938 87.792 -7.491 1.00 26.05 C ATOM 665 CG1 ILE A 69 93.117 86.873 -6.279 1.00 22.79 C ATOM 666 CG2 ILE A 69 91.475 88.202 -7.619 1.00 27.17 C ATOM 667 CD1 ILE A 69 92.763 87.545 -4.960 1.00 22.42 C ATOM 668 H ILE A 69 95.425 87.355 -7.987 1.00 0.00 H ATOM 669 N ALA A 70 93.779 88.940 -10.330 1.00 26.48 N ATOM 670 CA ALA A 70 93.449 89.768 -11.485 1.00 29.00 C ATOM 671 C ALA A 70 93.587 88.986 -12.782 1.00 30.36 C ATOM 672 O ALA A 70 92.826 89.202 -13.732 1.00 33.02 O ATOM 673 CB ALA A 70 94.337 91.008 -11.508 1.00 28.83 C ATOM 674 H ALA A 70 94.605 89.177 -9.744 1.00 0.00 H ATOM 675 N ALA A 71 94.549 88.067 -12.839 1.00 28.03 N ATOM 676 CA ALA A 71 94.747 87.225 -14.008 1.00 28.47 C ATOM 677 C ALA A 71 93.737 86.090 -14.096 1.00 24.56 C ATOM 678 O ALA A 71 93.747 85.350 -15.086 1.00 31.67 O ATOM 679 CB ALA A 71 96.167 86.656 -14.007 1.00 30.43 C ATOM 680 H ALA A 71 95.179 87.948 -12.021 1.00 0.00 H ATOM 681 N GLY A 72 92.874 85.934 -13.094 1.00 27.99 N ATOM 682 CA GLY A 72 91.896 84.866 -13.094 1.00 23.89 C ATOM 683 C GLY A 72 92.424 83.511 -12.689 1.00 26.51 C ATOM 684 O GLY A 72 91.723 82.511 -12.878 1.00 29.30 O ATOM 685 H GLY A 72 92.903 86.595 -12.292 1.00 0.00 H ATOM 686 N VAL A 73 93.640 83.447 -12.143 1.00 23.24 N ATOM 687 CA VAL A 73 94.213 82.177 -11.696 1.00 24.90 C ATOM 688 C VAL A 73 93.396 81.587 -10.552 1.00 25.77 C ATOM 689 O VAL A 73 93.158 80.373 -10.492 1.00 24.24 O ATOM 690 CB VAL A 73 95.685 82.380 -11.282 1.00 26.45 C ATOM 691 CG1 VAL A 73 96.263 81.097 -10.694 1.00 23.54 C ATOM 692 CG2 VAL A 73 96.522 82.860 -12.464 1.00 28.59 C ATOM 693 H VAL A 73 94.194 84.321 -12.033 1.00 0.00 H ATOM 694 N VAL A 74 92.968 82.433 -9.618 1.00 23.26 N ATOM 695 CA VAL A 74 92.319 81.986 -8.395 1.00 24.63 C ATOM 696 C VAL A 74 91.406 83.102 -7.916 1.00 21.97 C ATOM 697 O VAL A 74 91.586 84.271 -8.264 1.00 23.03 O ATOM 698 CB VAL A 74 93.362 81.616 -7.310 1.00 22.51 C ATOM 699 CG1 VAL A 74 94.039 82.867 -6.772 1.00 23.78 C ATOM 700 CG2 VAL A 74 92.727 80.806 -6.191 1.00 23.24 C ATOM 701 H VAL A 74 93.103 83.453 -9.768 1.00 0.00 H ATOM 702 N LYS A 75 90.399 82.728 -7.134 1.00 21.27 N ATOM 703 CA LYS A 75 89.557 83.676 -6.423 1.00 22.98 C ATOM 704 C LYS A 75 89.939 83.680 -4.944 1.00 22.64 C ATOM 705 O LYS A 75 90.474 82.696 -4.424 1.00 21.90 O ATOM 706 CB LYS A 75 88.079 83.322 -6.602 1.00 29.09 C ATOM 707 CG LYS A 75 87.668 83.228 -8.068 1.00 33.05 C ATOM 708 CD LYS A 75 86.169 83.070 -8.243 1.00 37.80 C ATOM 709 CE LYS A 75 85.720 81.648 -7.954 1.00 37.46 C ATOM 710 NZ LYS A 75 84.358 81.386 -8.511 1.00 44.88 N ATOM 711 HZ1 LYS A 75 83.676 82.043 -8.081 1.00 0.00 H ATOM 712 HZ2 LYS A 75 84.373 81.526 -9.541 1.00 0.00 H ATOM 713 HZ3 LYS A 75 84.080 80.407 -8.297 1.00 0.00 H ATOM 714 H LYS A 75 90.205 81.712 -7.026 1.00 0.00 H ATOM 715 N ARG A 76 89.669 84.805 -4.274 1.00 21.68 N ATOM 716 CA ARG A 76 90.099 84.958 -2.885 1.00 20.09 C ATOM 717 C ARG A 76 89.559 83.840 -2.000 1.00 20.05 C ATOM 718 O ARG A 76 90.287 83.297 -1.160 1.00 16.02 O ATOM 719 CB ARG A 76 89.660 86.315 -2.339 1.00 18.66 C ATOM 720 CG ARG A 76 89.907 86.482 -0.828 1.00 18.55 C ATOM 721 CD ARG A 76 91.395 86.512 -0.538 1.00 17.56 C ATOM 722 NE ARG A 76 91.747 86.573 0.884 1.00 16.03 N ATOM 723 CZ ARG A 76 91.967 85.507 1.653 1.00 15.50 C ATOM 724 NH1 ARG A 76 91.847 84.279 1.157 1.00 15.69 N ATOM 725 NH2 ARG A 76 92.324 85.661 2.926 1.00 14.77 N ATOM 726 HE ARG A 76 91.831 87.512 1.323 1.00 0.00 H ATOM 727 HH12 ARG A 76 92.021 83.453 1.765 1.00 0.00 H ATOM 728 HH11 ARG A 76 91.579 84.144 0.161 1.00 0.00 H ATOM 729 HH22 ARG A 76 92.495 84.827 3.523 1.00 0.00 H ATOM 730 HH21 ARG A 76 92.432 86.616 3.324 1.00 0.00 H ATOM 731 H ARG A 76 89.151 85.575 -4.743 1.00 0.00 H ATOM 732 N GLU A 77 88.288 83.479 -2.169 1.00 19.73 N ATOM 733 CA GLU A 77 87.671 82.471 -1.314 1.00 19.51 C ATOM 734 C GLU A 77 88.290 81.085 -1.476 1.00 18.56 C ATOM 735 O GLU A 77 88.070 80.223 -0.619 1.00 23.30 O ATOM 736 CB GLU A 77 86.171 82.406 -1.599 1.00 24.58 C ATOM 737 CG GLU A 77 85.849 82.129 -3.064 1.00 28.69 C ATOM 738 CD GLU A 77 85.389 83.367 -3.822 1.00 36.90 C ATOM 739 OE1 GLU A 77 84.341 83.277 -4.502 1.00 39.64 O ATOM 740 OE2 GLU A 77 86.064 84.424 -3.737 1.00 30.61 O ATOM 741 H GLU A 77 87.726 83.923 -2.923 1.00 0.00 H ATOM 742 N ASP A 78 89.046 80.842 -2.547 1.00 19.55 N ATOM 743 CA ASP A 78 89.697 79.554 -2.753 1.00 22.61 C ATOM 744 C ASP A 78 91.143 79.542 -2.281 1.00 17.29 C ATOM 745 O ASP A 78 91.816 78.513 -2.410 1.00 18.12 O ATOM 746 CB ASP A 78 89.630 79.155 -4.226 1.00 26.46 C ATOM 747 CG ASP A 78 88.205 78.966 -4.709 1.00 28.70 C ATOM 748 OD1 ASP A 78 87.405 78.352 -3.969 1.00 32.75 O ATOM 749 OD2 ASP A 78 87.887 79.443 -5.816 1.00 34.34 O ATOM 750 H ASP A 78 89.175 81.592 -3.255 1.00 0.00 H ATOM 751 N LEU A 79 91.627 80.649 -1.733 1.00 15.17 N ATOM 752 CA LEU A 79 92.949 80.729 -1.133 1.00 13.66 C ATOM 753 C LEU A 79 92.841 80.641 0.381 1.00 13.62 C ATOM 754 O LEU A 79 91.857 81.084 0.981 1.00 16.32 O ATOM 755 CB LEU A 79 93.649 82.038 -1.493 1.00 16.20 C ATOM 756 CG LEU A 79 94.056 82.291 -2.934 1.00 19.05 C ATOM 757 CD1 LEU A 79 94.665 83.677 -3.019 1.00 21.10 C ATOM 758 CD2 LEU A 79 95.046 81.230 -3.382 1.00 20.35 C ATOM 759 H LEU A 79 91.031 81.502 -1.733 1.00 0.00 H ATOM 760 N PHE A 80 93.874 80.076 0.991 1.00 10.68 N ATOM 761 CA PHE A 80 94.033 80.040 2.440 1.00 9.91 C ATOM 762 C PHE A 80 95.341 80.745 2.770 1.00 10.39 C ATOM 763 O PHE A 80 96.422 80.219 2.472 1.00 13.23 O ATOM 764 CB PHE A 80 94.044 78.596 2.941 1.00 11.51 C ATOM 765 CG PHE A 80 93.944 78.466 4.429 1.00 10.30 C ATOM 766 CD1 PHE A 80 95.032 78.748 5.241 1.00 10.89 C ATOM 767 CD2 PHE A 80 92.753 78.064 5.019 1.00 10.59 C ATOM 768 CE1 PHE A 80 94.936 78.632 6.613 1.00 9.91 C ATOM 769 CE2 PHE A 80 92.647 77.942 6.393 1.00 11.33 C ATOM 770 CZ PHE A 80 93.740 78.227 7.189 1.00 11.62 C ATOM 771 H PHE A 80 94.611 79.635 0.404 1.00 0.00 H ATOM 772 N VAL A 81 95.248 81.931 3.377 1.00 9.50 N ATOM 773 CA VAL A 81 96.406 82.770 3.675 1.00 9.81 C ATOM 774 C VAL A 81 96.611 82.810 5.180 1.00 9.96 C ATOM 775 O VAL A 81 95.687 83.145 5.934 1.00 10.49 O ATOM 776 CB VAL A 81 96.236 84.202 3.132 1.00 9.65 C ATOM 777 CG1 VAL A 81 97.506 85.017 3.403 1.00 11.55 C ATOM 778 CG2 VAL A 81 95.902 84.160 1.643 1.00 11.57 C ATOM 779 H VAL A 81 94.305 82.274 3.651 1.00 0.00 H ATOM 780 N THR A 82 97.817 82.460 5.613 1.00 10.17 N ATOM 781 CA THR A 82 98.245 82.552 7.000 1.00 9.79 C ATOM 782 C THR A 82 99.287 83.649 7.144 1.00 9.41 C ATOM 783 O THR A 82 100.205 83.753 6.324 1.00 10.32 O ATOM 784 CB THR A 82 98.866 81.236 7.463 1.00 9.76 C ATOM 785 OG1 THR A 82 97.897 80.190 7.357 1.00 11.33 O ATOM 786 CG2 THR A 82 99.343 81.360 8.895 1.00 10.45 C ATOM 787 HG1 THR A 82 98.300 79.337 7.657 1.00 0.00 H ATOM 788 H THR A 82 98.498 82.097 4.916 1.00 0.00 H ATOM 789 N THR A 83 99.160 84.476 8.177 1.00 11.36 N ATOM 790 CA THR A 83 100.324 85.238 8.609 1.00 9.04 C ATOM 791 C THR A 83 100.418 85.172 10.131 1.00 8.75 C ATOM 792 O THR A 83 99.633 84.478 10.792 1.00 9.72 O ATOM 793 CB THR A 83 100.307 86.671 8.048 1.00 12.15 C ATOM 794 OG1 THR A 83 101.596 87.271 8.254 1.00 11.61 O ATOM 795 CG2 THR A 83 99.227 87.521 8.685 1.00 12.84 C ATOM 796 HG1 THR A 83 101.591 88.193 7.895 1.00 0.00 H ATOM 797 H THR A 83 98.248 84.577 8.667 1.00 0.00 H ATOM 798 N LYS A 84 101.444 85.836 10.680 1.00 8.71 N ATOM 799 CA LYS A 84 101.842 85.622 12.066 1.00 9.09 C ATOM 800 C LYS A 84 102.117 86.937 12.778 1.00 10.13 C ATOM 801 O LYS A 84 102.726 87.852 12.216 1.00 11.37 O ATOM 802 CB LYS A 84 103.086 84.720 12.156 1.00 9.63 C ATOM 803 CG LYS A 84 102.995 83.486 11.263 1.00 10.88 C ATOM 804 CD LYS A 84 104.030 82.431 11.598 1.00 10.21 C ATOM 805 CE LYS A 84 103.973 81.264 10.614 1.00 13.03 C ATOM 806 NZ LYS A 84 104.490 81.623 9.269 1.00 13.47 N ATOM 807 HZ1 LYS A 84 103.921 82.400 8.876 1.00 0.00 H ATOM 808 HZ2 LYS A 84 105.482 81.925 9.349 1.00 0.00 H ATOM 809 HZ3 LYS A 84 104.428 80.795 8.643 1.00 0.00 H ATOM 810 H LYS A 84 101.970 86.522 10.102 1.00 0.00 H ATOM 811 N LEU A 85 101.654 86.993 14.026 1.00 9.40 N ATOM 812 CA LEU A 85 101.934 88.075 14.957 1.00 10.21 C ATOM 813 C LEU A 85 103.331 87.908 15.551 1.00 8.82 C ATOM 814 O LEU A 85 103.644 86.853 16.116 1.00 8.97 O ATOM 815 CB LEU A 85 100.883 88.052 16.065 1.00 9.92 C ATOM 816 CG LEU A 85 101.041 89.046 17.203 1.00 7.73 C ATOM 817 CD1 LEU A 85 100.700 90.457 16.720 1.00 9.27 C ATOM 818 CD2 LEU A 85 100.185 88.664 18.392 1.00 10.40 C ATOM 819 H LEU A 85 101.053 86.211 14.356 1.00 0.00 H ATOM 820 N TRP A 86 104.162 88.948 15.437 1.00 9.07 N ATOM 821 CA TRP A 86 105.546 88.871 15.888 1.00 9.75 C ATOM 822 C TRP A 86 105.683 89.236 17.365 1.00 11.08 C ATOM 823 O TRP A 86 104.902 90.017 17.917 1.00 10.19 O ATOM 824 CB TRP A 86 106.444 89.796 15.060 1.00 10.11 C ATOM 825 CG TRP A 86 107.919 89.645 15.404 1.00 12.29 C ATOM 826 CD1 TRP A 86 108.774 90.626 15.834 1.00 13.80 C ATOM 827 CD2 TRP A 86 108.690 88.436 15.350 1.00 11.85 C ATOM 828 NE1 TRP A 86 110.030 90.095 16.045 1.00 14.29 N ATOM 829 CE2 TRP A 86 110.005 88.756 15.755 1.00 12.38 C ATOM 830 CE3 TRP A 86 108.397 87.113 14.999 1.00 10.83 C ATOM 831 CZ2 TRP A 86 111.019 87.805 15.805 1.00 15.60 C ATOM 832 CZ3 TRP A 86 109.405 86.172 15.047 1.00 14.27 C ATOM 833 CH2 TRP A 86 110.701 86.522 15.451 1.00 14.00 C ATOM 834 HE1 TRP A 86 110.862 90.626 16.372 1.00 0.00 H ATOM 835 H TRP A 86 103.813 89.833 15.017 1.00 0.00 H ATOM 836 N CYS A 87 106.748 88.700 17.977 1.00 10.45 N ATOM 837 CA CYS A 87 107.045 88.854 19.408 1.00 10.33 C ATOM 838 C CYS A 87 106.963 90.284 19.930 1.00 10.21 C ATOM 839 O CYS A 87 106.615 90.486 21.104 1.00 10.54 O ATOM 840 CB CYS A 87 108.451 88.328 19.696 1.00 11.29 C ATOM 841 SG CYS A 87 108.798 86.681 19.086 1.00 11.62 S ATOM 842 H CYS A 87 107.407 88.138 17.402 1.00 0.00 H ATOM 843 N THR A 88 107.348 91.277 19.116 1.00 10.38 N ATOM 844 CA THR A 88 107.369 92.658 19.587 1.00 11.16 C ATOM 845 C THR A 88 105.982 93.277 19.672 1.00 10.82 C ATOM 846 O THR A 88 105.869 94.415 20.138 1.00 11.81 O ATOM 847 CB THR A 88 108.233 93.528 18.676 1.00 10.68 C ATOM 848 OG1 THR A 88 107.725 93.434 17.343 1.00 11.88 O ATOM 849 CG2 THR A 88 109.686 93.074 18.697 1.00 12.44 C ATOM 850 HG1 THR A 88 108.276 93.994 16.741 1.00 0.00 H ATOM 851 H THR A 88 107.634 91.061 18.140 1.00 0.00 H ATOM 852 N CYS A 89 104.934 92.554 19.265 1.00 9.98 N ATOM 853 CA CYS A 89 103.565 93.063 19.266 1.00 11.58 C ATOM 854 C CYS A 89 102.628 92.188 20.083 1.00 10.46 C ATOM 855 O CYS A 89 101.413 92.184 19.841 1.00 10.63 O ATOM 856 CB CYS A 89 103.036 93.189 17.840 1.00 9.86 C ATOM 857 SG CYS A 89 103.909 94.452 16.898 1.00 14.57 S ATOM 858 H CYS A 89 105.101 91.583 18.932 1.00 0.00 H ATOM 859 N PHE A 90 103.175 91.439 21.043 1.00 8.92 N ATOM 860 CA PHE A 90 102.360 90.582 21.894 1.00 8.30 C ATOM 861 C PHE A 90 101.629 91.354 22.988 1.00 9.91 C ATOM 862 O PHE A 90 100.664 90.821 23.550 1.00 10.78 O ATOM 863 CB PHE A 90 103.221 89.486 22.537 1.00 9.79 C ATOM 864 CG PHE A 90 103.633 88.377 21.589 1.00 9.82 C ATOM 865 CD1 PHE A 90 103.255 88.380 20.250 1.00 10.02 C ATOM 866 CD2 PHE A 90 104.417 87.331 22.058 1.00 9.23 C ATOM 867 CE1 PHE A 90 103.645 87.353 19.397 1.00 8.91 C ATOM 868 CE2 PHE A 90 104.821 86.303 21.203 1.00 10.09 C ATOM 869 CZ PHE A 90 104.429 86.312 19.883 1.00 9.69 C ATOM 870 H PHE A 90 104.205 91.468 21.187 1.00 0.00 H ATOM 871 N ARG A 91 102.060 92.566 23.327 1.00 9.84 N ATOM 872 CA ARG A 91 101.298 93.322 24.312 1.00 10.31 C ATOM 873 C ARG A 91 99.867 93.466 23.805 1.00 8.68 C ATOM 874 O ARG A 91 99.666 93.763 22.618 1.00 10.47 O ATOM 875 CB ARG A 91 101.907 94.703 24.577 1.00 12.65 C ATOM 876 CG ARG A 91 103.196 94.625 25.384 1.00 15.17 C ATOM 877 CD ARG A 91 103.289 95.648 26.500 1.00 26.95 C ATOM 878 NE ARG A 91 104.231 95.201 27.526 1.00 25.61 N ATOM 879 CZ ARG A 91 103.947 95.086 28.821 1.00 27.17 C ATOM 880 NH1 ARG A 91 102.744 95.414 29.281 1.00 27.74 N ATOM 881 NH2 ARG A 91 104.880 94.660 29.664 1.00 27.87 N ATOM 882 HE ARG A 91 105.194 94.955 27.221 1.00 0.00 H ATOM 883 HH12 ARG A 91 102.532 95.321 30.295 1.00 0.00 H ATOM 884 HH11 ARG A 91 102.015 95.764 28.627 1.00 0.00 H ATOM 885 HH22 ARG A 91 104.663 94.568 30.677 1.00 0.00 H ATOM 886 HH21 ARG A 91 105.828 94.418 29.311 1.00 0.00 H ATOM 887 H ARG A 91 102.920 92.964 22.899 1.00 0.00 H ATOM 888 N PRO A 92 98.853 93.223 24.649 1.00 10.27 N ATOM 889 CA PRO A 92 97.474 93.191 24.136 1.00 10.20 C ATOM 890 C PRO A 92 97.089 94.398 23.294 1.00 10.82 C ATOM 891 O PRO A 92 96.432 94.226 22.258 1.00 10.86 O ATOM 892 CB PRO A 92 96.642 93.085 25.424 1.00 11.25 C ATOM 893 CG PRO A 92 97.521 92.264 26.315 1.00 13.44 C ATOM 894 CD PRO A 92 98.924 92.759 26.044 1.00 13.05 C ATOM 895 N GLU A 93 97.496 95.607 23.699 1.00 11.98 N ATOM 896 CA GLU A 93 97.126 96.818 22.978 1.00 10.87 C ATOM 897 C GLU A 93 97.767 96.907 21.599 1.00 11.28 C ATOM 898 O GLU A 93 97.344 97.749 20.802 1.00 14.00 O ATOM 899 CB GLU A 93 97.500 98.055 23.800 1.00 12.34 C ATOM 900 CG GLU A 93 98.994 98.242 24.071 1.00 14.46 C ATOM 901 CD GLU A 93 99.507 97.560 25.337 1.00 15.68 C ATOM 902 OE1 GLU A 93 98.861 96.611 25.849 1.00 15.17 O ATOM 903 OE2 GLU A 93 100.580 97.987 25.826 1.00 19.90 O ATOM 904 H GLU A 93 98.091 95.684 24.549 1.00 0.00 H ATOM 905 N LEU A 94 98.758 96.062 21.300 1.00 10.51 N ATOM 906 CA LEU A 94 99.459 96.105 20.019 1.00 10.99 C ATOM 907 C LEU A 94 98.985 95.049 19.029 1.00 12.23 C ATOM 908 O LEU A 94 99.373 95.103 17.859 1.00 11.99 O ATOM 909 CB LEU A 94 100.971 95.954 20.239 1.00 11.54 C ATOM 910 CG LEU A 94 101.590 96.999 21.169 1.00 12.04 C ATOM 911 CD1 LEU A 94 103.106 96.810 21.275 1.00 13.84 C ATOM 912 CD2 LEU A 94 101.260 98.428 20.709 1.00 12.03 C ATOM 913 H LEU A 94 99.040 95.349 22.003 1.00 0.00 H ATOM 914 N VAL A 95 98.141 94.114 19.459 1.00 10.59 N ATOM 915 CA VAL A 95 97.804 92.958 18.628 1.00 10.46 C ATOM 916 C VAL A 95 96.971 93.368 17.419 1.00 11.21 C ATOM 917 O VAL A 95 97.340 93.081 16.276 1.00 10.92 O ATOM 918 CB VAL A 95 97.079 91.892 19.465 1.00 9.22 C ATOM 919 CG1 VAL A 95 96.604 90.741 18.567 1.00 10.19 C ATOM 920 CG2 VAL A 95 97.996 91.375 20.563 1.00 9.58 C ATOM 921 H VAL A 95 97.713 94.207 20.403 1.00 0.00 H ATOM 922 N LYS A 96 95.813 93.989 17.646 1.00 11.91 N ATOM 923 CA LYS A 96 94.962 94.340 16.515 1.00 12.32 C ATOM 924 C LYS A 96 95.621 95.351 15.583 1.00 12.43 C ATOM 925 O LYS A 96 95.502 95.175 14.360 1.00 11.56 O ATOM 926 CB LYS A 96 93.592 94.831 17.002 1.00 11.51 C ATOM 927 CG LYS A 96 92.560 94.962 15.875 1.00 16.19 C ATOM 928 CD LYS A 96 91.186 95.362 16.408 1.00 19.99 C ATOM 929 CE LYS A 96 90.190 95.577 15.278 1.00 25.20 C ATOM 930 NZ LYS A 96 88.830 95.932 15.785 1.00 27.96 N ATOM 931 HZ1 LYS A 96 88.475 95.163 16.388 1.00 0.00 H ATOM 932 HZ2 LYS A 96 88.886 96.811 16.339 1.00 0.00 H ATOM 933 HZ3 LYS A 96 88.186 96.069 14.980 1.00 0.00 H ATOM 934 H LYS A 96 95.521 94.220 18.617 1.00 0.00 H ATOM 935 N PRO A 97 96.329 96.389 16.055 1.00 11.24 N ATOM 936 CA PRO A 97 97.034 97.248 15.085 1.00 11.70 C ATOM 937 C PRO A 97 98.047 96.481 14.249 1.00 11.53 C ATOM 938 O PRO A 97 98.190 96.761 13.053 1.00 13.31 O ATOM 939 CB PRO A 97 97.705 98.315 15.964 1.00 12.99 C ATOM 940 CG PRO A 97 96.876 98.374 17.181 1.00 13.15 C ATOM 941 CD PRO A 97 96.366 96.962 17.416 1.00 12.87 C ATOM 942 N ALA A 98 98.750 95.512 14.843 1.00 10.86 N ATOM 943 CA ALA A 98 99.719 94.739 14.073 1.00 11.29 C ATOM 944 C ALA A 98 99.021 93.894 13.017 1.00 12.76 C ATOM 945 O ALA A 98 99.521 93.755 11.892 1.00 11.53 O ATOM 946 CB ALA A 98 100.547 93.853 15.013 1.00 11.03 C ATOM 947 H ALA A 98 98.607 95.309 15.853 1.00 0.00 H ATOM 948 N LEU A 99 97.875 93.307 13.365 1.00 10.81 N ATOM 949 CA LEU A 99 97.112 92.544 12.383 1.00 11.33 C ATOM 950 C LEU A 99 96.656 93.435 11.236 1.00 13.09 C ATOM 951 O LEU A 99 96.792 93.073 10.065 1.00 11.45 O ATOM 952 CB LEU A 99 95.912 91.867 13.039 1.00 9.86 C ATOM 953 CG LEU A 99 94.964 91.176 12.054 1.00 11.03 C ATOM 954 CD1 LEU A 99 95.691 90.146 11.180 1.00 12.09 C ATOM 955 CD2 LEU A 99 93.825 90.516 12.807 1.00 13.69 C ATOM 956 H LEU A 99 97.524 93.394 14.340 1.00 0.00 H ATOM 957 N GLU A 100 96.100 94.606 11.556 1.00 11.75 N ATOM 958 CA GLU A 100 95.646 95.512 10.507 1.00 11.92 C ATOM 959 C GLU A 100 96.808 95.970 9.629 1.00 12.30 C ATOM 960 O GLU A 100 96.644 96.144 8.413 1.00 12.77 O ATOM 961 CB GLU A 100 94.930 96.704 11.140 1.00 13.69 C ATOM 962 CG GLU A 100 93.604 96.314 11.772 1.00 15.39 C ATOM 963 CD GLU A 100 92.992 97.428 12.606 1.00 27.37 C ATOM 964 OE1 GLU A 100 93.749 98.277 13.129 1.00 31.27 O ATOM 965 OE2 GLU A 100 91.754 97.439 12.757 1.00 27.78 O ATOM 966 H GLU A 100 95.990 94.873 12.555 1.00 0.00 H ATOM 967 N LYS A 101 97.987 96.170 10.222 1.00 12.56 N ATOM 968 CA LYS A 101 99.170 96.504 9.430 1.00 14.74 C ATOM 969 C LYS A 101 99.531 95.369 8.477 1.00 16.27 C ATOM 970 O LYS A 101 99.846 95.606 7.301 1.00 16.12 O ATOM 971 CB LYS A 101 100.344 96.826 10.353 1.00 17.20 C ATOM 972 CG LYS A 101 101.667 97.109 9.656 1.00 22.85 C ATOM 973 CD LYS A 101 102.667 97.665 10.659 1.00 27.28 C ATOM 974 CE LYS A 101 103.989 96.934 10.600 1.00 29.48 C ATOM 975 NZ LYS A 101 104.992 97.532 11.522 1.00 25.11 N ATOM 976 HZ1 LYS A 101 105.155 98.525 11.258 1.00 0.00 H ATOM 977 HZ2 LYS A 101 104.635 97.485 12.498 1.00 0.00 H ATOM 978 HZ3 LYS A 101 105.884 97.003 11.452 1.00 0.00 H ATOM 979 H LYS A 101 98.065 96.088 11.256 1.00 0.00 H ATOM 980 N SER A 102 99.488 94.126 8.963 1.00 13.84 N ATOM 981 CA SER A 102 99.749 92.987 8.086 1.00 12.34 C ATOM 982 C SER A 102 98.732 92.921 6.955 1.00 13.68 C ATOM 983 O SER A 102 99.090 92.653 5.802 1.00 13.40 O ATOM 984 CB SER A 102 99.740 91.681 8.889 1.00 13.35 C ATOM 985 OG SER A 102 100.981 91.459 9.535 1.00 15.94 O ATOM 986 HG SER A 102 101.700 91.405 8.856 1.00 0.00 H ATOM 987 H SER A 102 99.268 93.968 9.967 1.00 0.00 H ATOM 988 N LEU A 103 97.459 93.154 7.268 1.00 12.73 N ATOM 989 CA LEU A 103 96.421 93.084 6.247 1.00 13.31 C ATOM 990 C LEU A 103 96.625 94.154 5.185 1.00 13.32 C ATOM 991 O LEU A 103 96.447 93.892 3.987 1.00 14.34 O ATOM 992 CB LEU A 103 95.043 93.217 6.893 1.00 12.33 C ATOM 993 CG LEU A 103 94.596 92.015 7.725 1.00 13.58 C ATOM 994 CD1 LEU A 103 93.284 92.313 8.437 1.00 15.18 C ATOM 995 CD2 LEU A 103 94.471 90.782 6.849 1.00 15.13 C ATOM 996 H LEU A 103 97.203 93.388 8.249 1.00 0.00 H ATOM 997 N LYS A 104 97.017 95.361 5.604 1.00 13.72 N ATOM 998 CA LYS A 104 97.296 96.422 4.642 1.00 15.97 C ATOM 999 C LYS A 104 98.461 96.043 3.733 1.00 17.91 C ATOM 1000 O LYS A 104 98.379 96.189 2.506 1.00 16.85 O ATOM 1001 CB LYS A 104 97.583 97.727 5.382 1.00 16.53 C ATOM 1002 CG LYS A 104 97.769 98.928 4.469 1.00 20.14 C ATOM 1003 CD LYS A 104 97.987 100.182 5.290 1.00 27.43 C ATOM 1004 CE LYS A 104 97.994 101.428 4.425 1.00 32.69 C ATOM 1005 NZ LYS A 104 98.074 102.648 5.282 1.00 40.04 N ATOM 1006 HZ1 LYS A 104 97.252 102.678 5.918 1.00 0.00 H ATOM 1007 HZ2 LYS A 104 98.948 102.618 5.845 1.00 0.00 H ATOM 1008 HZ3 LYS A 104 98.078 103.495 4.678 1.00 0.00 H ATOM 1009 H LYS A 104 97.124 95.545 6.622 1.00 0.00 H ATOM 1010 N LYS A 105 99.552 95.537 4.317 1.00 14.69 N ATOM 1011 CA LYS A 105 100.699 95.120 3.512 1.00 15.65 C ATOM 1012 C LYS A 105 100.326 94.004 2.546 1.00 16.73 C ATOM 1013 O LYS A 105 100.777 93.989 1.395 1.00 18.68 O ATOM 1014 CB LYS A 105 101.843 94.656 4.410 1.00 19.23 C ATOM 1015 CG LYS A 105 102.592 95.757 5.093 1.00 22.12 C ATOM 1016 CD LYS A 105 103.769 95.193 5.866 1.00 27.20 C ATOM 1017 CE LYS A 105 104.453 96.270 6.685 1.00 32.67 C ATOM 1018 NZ LYS A 105 105.409 95.667 7.651 1.00 31.28 N ATOM 1019 HZ1 LYS A 105 104.896 95.030 8.293 1.00 0.00 H ATOM 1020 HZ2 LYS A 105 106.132 95.129 7.132 1.00 0.00 H ATOM 1021 HZ3 LYS A 105 105.866 96.422 8.201 1.00 0.00 H ATOM 1022 H LYS A 105 99.585 95.439 5.352 1.00 0.00 H ATOM 1023 N LEU A 106 99.524 93.049 3.002 1.00 15.90 N ATOM 1024 CA LEU A 106 99.085 91.946 2.161 1.00 15.10 C ATOM 1025 C LEU A 106 98.011 92.344 1.160 1.00 16.12 C ATOM 1026 O LEU A 106 97.688 91.537 0.284 1.00 16.93 O ATOM 1027 CB LEU A 106 98.549 90.814 3.035 1.00 14.10 C ATOM 1028 CG LEU A 106 99.544 90.016 3.867 1.00 14.93 C ATOM 1029 CD1 LEU A 106 98.797 89.279 4.977 1.00 14.35 C ATOM 1030 CD2 LEU A 106 100.274 89.031 2.968 1.00 14.84 C ATOM 1031 H LEU A 106 99.200 93.091 3.989 1.00 0.00 H ATOM 1032 N GLN A 107 97.440 93.548 1.282 1.00 15.84 N ATOM 1033 CA GLN A 107 96.308 93.976 0.451 1.00 17.11 C ATOM 1034 C GLN A 107 95.130 93.018 0.581 1.00 17.64 C ATOM 1035 O GLN A 107 94.448 92.705 -0.399 1.00 19.46 O ATOM 1036 CB GLN A 107 96.710 94.125 -1.018 1.00 18.02 C ATOM 1037 CG GLN A 107 97.826 95.108 -1.253 1.00 21.46 C ATOM 1038 CD GLN A 107 98.167 95.224 -2.724 1.00 23.96 C ATOM 1039 OE1 GLN A 107 99.213 94.753 -3.167 1.00 24.27 O ATOM 1040 NE2 GLN A 107 97.277 95.841 -3.488 1.00 28.34 N ATOM 1041 HE22 GLN A 107 96.406 96.223 -3.067 1.00 0.00 H ATOM 1042 HE21 GLN A 107 97.449 95.943 -4.509 1.00 0.00 H ATOM 1043 H GLN A 107 97.813 94.207 1.994 1.00 0.00 H ATOM 1044 N LEU A 108 94.894 92.530 1.799 1.00 13.76 N ATOM 1045 CA LEU A 108 93.786 91.638 2.072 1.00 15.50 C ATOM 1046 C LEU A 108 92.858 92.278 3.093 1.00 13.58 C ATOM 1047 O LEU A 108 93.282 93.093 3.924 1.00 15.40 O ATOM 1048 CB LEU A 108 94.280 90.281 2.596 1.00 14.12 C ATOM 1049 CG LEU A 108 95.166 89.478 1.644 1.00 15.22 C ATOM 1050 CD1 LEU A 108 95.633 88.222 2.349 1.00 15.23 C ATOM 1051 CD2 LEU A 108 94.402 89.126 0.375 1.00 16.01 C ATOM 1052 H LEU A 108 95.527 92.799 2.579 1.00 0.00 H ATOM 1053 N ASP A 109 91.590 91.891 3.031 1.00 13.99 N ATOM 1054 CA ASP A 109 90.610 92.336 4.009 1.00 15.13 C ATOM 1055 C ASP A 109 90.532 91.410 5.212 1.00 14.10 C ATOM 1056 O ASP A 109 90.078 91.833 6.284 1.00 15.75 O ATOM 1057 CB ASP A 109 89.237 92.438 3.349 1.00 18.59 C ATOM 1058 CG ASP A 109 89.232 93.393 2.174 1.00 25.21 C ATOM 1059 OD1 ASP A 109 89.856 94.476 2.278 1.00 23.43 O ATOM 1060 OD2 ASP A 109 88.619 93.046 1.144 1.00 33.20 O ATOM 1061 H ASP A 109 91.290 91.255 2.265 1.00 0.00 H ATOM 1062 N TYR A 110 90.957 90.159 5.047 1.00 12.96 N ATOM 1063 CA TYR A 110 91.035 89.184 6.120 1.00 13.73 C ATOM 1064 C TYR A 110 92.125 88.185 5.770 1.00 12.18 C ATOM 1065 O TYR A 110 92.520 88.053 4.607 1.00 13.19 O ATOM 1066 CB TYR A 110 89.707 88.446 6.315 1.00 14.47 C ATOM 1067 CG TYR A 110 89.387 87.496 5.179 1.00 14.59 C ATOM 1068 CD1 TYR A 110 88.833 87.960 3.993 1.00 18.32 C ATOM 1069 CD2 TYR A 110 89.644 86.135 5.295 1.00 14.71 C ATOM 1070 CE1 TYR A 110 88.552 87.090 2.953 1.00 18.91 C ATOM 1071 CE2 TYR A 110 89.356 85.258 4.266 1.00 15.05 C ATOM 1072 CZ TYR A 110 88.814 85.738 3.100 1.00 17.78 C ATOM 1073 OH TYR A 110 88.537 84.861 2.080 1.00 18.79 O ATOM 1074 HH TYR A 110 88.153 85.358 1.314 1.00 0.00 H ATOM 1075 H TYR A 110 91.250 89.863 4.094 1.00 0.00 H ATOM 1076 N VAL A 111 92.628 87.498 6.791 1.00 11.95 N ATOM 1077 CA VAL A 111 93.435 86.308 6.558 1.00 11.09 C ATOM 1078 C VAL A 111 92.672 85.095 7.067 1.00 11.48 C ATOM 1079 O VAL A 111 91.830 85.185 7.969 1.00 12.12 O ATOM 1080 CB VAL A 111 94.834 86.384 7.204 1.00 9.54 C ATOM 1081 CG1 VAL A 111 95.705 87.383 6.459 1.00 10.96 C ATOM 1082 CG2 VAL A 111 94.745 86.739 8.676 1.00 11.67 C ATOM 1083 H VAL A 111 92.444 87.813 7.765 1.00 0.00 H ATOM 1084 N ASP A 112 92.986 83.935 6.489 1.00 10.32 N ATOM 1085 CA ASP A 112 92.329 82.713 6.927 1.00 9.68 C ATOM 1086 C ASP A 112 92.852 82.208 8.256 1.00 9.32 C ATOM 1087 O ASP A 112 92.113 81.562 9.007 1.00 10.78 O ATOM 1088 CB ASP A 112 92.484 81.657 5.851 1.00 11.36 C ATOM 1089 CG ASP A 112 91.834 82.100 4.563 1.00 11.62 C ATOM 1090 OD1 ASP A 112 92.499 82.787 3.757 1.00 12.38 O ATOM 1091 OD2 ASP A 112 90.625 81.823 4.412 1.00 15.02 O ATOM 1092 H ASP A 112 93.696 83.904 5.730 1.00 0.00 H ATOM 1093 N LEU A 113 94.099 82.523 8.582 1.00 9.41 N ATOM 1094 CA LEU A 113 94.701 82.026 9.807 1.00 9.68 C ATOM 1095 C LEU A 113 95.702 83.062 10.299 1.00 9.54 C ATOM 1096 O LEU A 113 96.509 83.576 9.518 1.00 9.81 O ATOM 1097 CB LEU A 113 95.360 80.658 9.551 1.00 8.31 C ATOM 1098 CG LEU A 113 96.103 79.991 10.708 1.00 7.86 C ATOM 1099 CD1 LEU A 113 95.199 79.807 11.927 1.00 9.41 C ATOM 1100 CD2 LEU A 113 96.646 78.641 10.232 1.00 9.12 C ATOM 1101 H LEU A 113 94.654 83.135 7.951 1.00 0.00 H ATOM 1102 N TYR A 114 95.636 83.384 11.585 1.00 8.46 N ATOM 1103 CA TYR A 114 96.571 84.317 12.210 1.00 8.24 C ATOM 1104 C TYR A 114 97.083 83.654 13.472 1.00 9.30 C ATOM 1105 O TYR A 114 96.283 83.195 14.295 1.00 10.03 O ATOM 1106 CB TYR A 114 95.897 85.652 12.543 1.00 8.99 C ATOM 1107 CG TYR A 114 96.814 86.807 12.896 1.00 8.99 C ATOM 1108 CD1 TYR A 114 97.853 87.187 12.046 1.00 10.38 C ATOM 1109 CD2 TYR A 114 96.592 87.563 14.049 1.00 9.31 C ATOM 1110 CE1 TYR A 114 98.657 88.269 12.338 1.00 10.95 C ATOM 1111 CE2 TYR A 114 97.393 88.655 14.353 1.00 10.41 C ATOM 1112 CZ TYR A 114 98.426 89.005 13.488 1.00 10.48 C ATOM 1113 OH TYR A 114 99.228 90.093 13.785 1.00 11.07 O ATOM 1114 HH TYR A 114 99.908 90.204 13.074 1.00 0.00 H ATOM 1115 H TYR A 114 94.890 82.956 12.170 1.00 0.00 H ATOM 1116 N ILE A 115 98.402 83.574 13.618 1.00 8.06 N ATOM 1117 CA ILE A 115 98.962 82.801 14.721 1.00 8.70 C ATOM 1118 C ILE A 115 100.048 83.587 15.439 1.00 8.31 C ATOM 1119 O ILE A 115 100.746 84.415 14.843 1.00 9.11 O ATOM 1120 CB ILE A 115 99.498 81.424 14.248 1.00 10.44 C ATOM 1121 CG1 ILE A 115 100.733 81.565 13.359 1.00 10.13 C ATOM 1122 CG2 ILE A 115 98.402 80.633 13.529 1.00 11.81 C ATOM 1123 CD1 ILE A 115 101.276 80.190 12.851 1.00 11.30 C ATOM 1124 H ILE A 115 99.032 84.061 12.949 1.00 0.00 H ATOM 1125 N MET A 116 100.183 83.330 16.743 1.00 9.15 N ATOM 1126 CA MET A 116 101.333 83.841 17.485 1.00 7.93 C ATOM 1127 C MET A 116 102.593 83.139 17.003 1.00 9.05 C ATOM 1128 O MET A 116 102.654 81.907 16.973 1.00 10.29 O ATOM 1129 CB MET A 116 101.170 83.624 18.992 1.00 10.50 C ATOM 1130 CG MET A 116 100.030 84.395 19.616 1.00 10.70 C ATOM 1131 SD MET A 116 99.970 84.208 21.412 1.00 11.08 S ATOM 1132 CE MET A 116 101.554 84.873 21.880 1.00 11.90 C ATOM 1133 H MET A 116 99.464 82.762 17.234 1.00 0.00 H ATOM 1134 N HIS A 117 103.615 83.912 16.646 1.00 8.57 N ATOM 1135 CA HIS A 117 104.800 83.304 16.047 1.00 9.55 C ATOM 1136 C HIS A 117 105.583 82.453 17.051 1.00 8.51 C ATOM 1137 O HIS A 117 106.229 81.473 16.665 1.00 9.40 O ATOM 1138 CB HIS A 117 105.672 84.412 15.464 1.00 9.47 C ATOM 1139 CG HIS A 117 106.524 83.995 14.306 1.00 10.14 C ATOM 1140 ND1 HIS A 117 106.706 84.807 13.208 1.00 10.54 N ATOM 1141 CD2 HIS A 117 107.276 82.888 14.089 1.00 12.06 C ATOM 1142 CE1 HIS A 117 107.524 84.216 12.356 1.00 12.97 C ATOM 1143 NE2 HIS A 117 107.882 83.048 12.862 1.00 13.80 N ATOM 1144 H HIS A 117 103.571 84.941 16.792 1.00 0.00 H ATOM 1145 N TYR A 118 105.547 82.832 18.322 1.00 8.22 N ATOM 1146 CA TYR A 118 106.255 82.165 19.406 1.00 9.41 C ATOM 1147 C TYR A 118 105.443 82.405 20.666 1.00 9.61 C ATOM 1148 O TYR A 118 104.542 83.251 20.672 1.00 9.45 O ATOM 1149 CB TYR A 118 107.675 82.722 19.583 1.00 8.78 C ATOM 1150 CG TYR A 118 108.665 82.240 18.564 1.00 8.60 C ATOM 1151 CD1 TYR A 118 109.250 80.994 18.692 1.00 10.77 C ATOM 1152 CD2 TYR A 118 109.024 83.032 17.479 1.00 11.97 C ATOM 1153 CE1 TYR A 118 110.155 80.518 17.758 1.00 14.92 C ATOM 1154 CE2 TYR A 118 109.949 82.563 16.531 1.00 14.15 C ATOM 1155 CZ TYR A 118 110.508 81.307 16.692 1.00 15.68 C ATOM 1156 OH TYR A 118 111.409 80.791 15.769 1.00 17.07 O ATOM 1157 HH TYR A 118 111.694 79.888 16.057 1.00 0.00 H ATOM 1158 H TYR A 118 104.972 83.665 18.561 1.00 0.00 H ATOM 1159 N PRO A 119 105.749 81.698 21.758 1.00 8.93 N ATOM 1160 CA PRO A 119 105.134 82.041 23.052 1.00 8.84 C ATOM 1161 C PRO A 119 105.873 83.108 23.848 1.00 9.63 C ATOM 1162 O PRO A 119 105.432 83.427 24.958 1.00 12.11 O ATOM 1163 CB PRO A 119 105.157 80.699 23.804 1.00 10.70 C ATOM 1164 CG PRO A 119 106.381 79.997 23.259 1.00 8.61 C ATOM 1165 CD PRO A 119 106.444 80.394 21.796 1.00 9.42 C ATOM 1166 N VAL A 120 106.961 83.660 23.322 1.00 9.25 N ATOM 1167 CA VAL A 120 107.862 84.554 24.046 1.00 10.25 C ATOM 1168 C VAL A 120 107.738 85.964 23.471 1.00 9.78 C ATOM 1169 O VAL A 120 107.983 86.157 22.274 1.00 10.28 O ATOM 1170 CB VAL A 120 109.317 84.079 23.959 1.00 9.90 C ATOM 1171 CG1 VAL A 120 110.235 85.112 24.578 1.00 11.16 C ATOM 1172 CG2 VAL A 120 109.484 82.723 24.633 1.00 10.65 C ATOM 1173 H VAL A 120 107.186 83.442 22.330 1.00 0.00 H ATOM 1174 N PRO A 121 107.440 86.969 24.285 1.00 9.68 N ATOM 1175 CA PRO A 121 107.408 88.351 23.794 1.00 9.69 C ATOM 1176 C PRO A 121 108.767 89.023 23.880 1.00 9.75 C ATOM 1177 O PRO A 121 109.603 88.695 24.725 1.00 12.10 O ATOM 1178 CB PRO A 121 106.418 89.021 24.757 1.00 11.21 C ATOM 1179 CG PRO A 121 106.661 88.303 26.066 1.00 12.63 C ATOM 1180 CD PRO A 121 107.027 86.870 25.700 1.00 9.03 C ATOM 1181 N MET A 122 108.969 90.005 23.000 1.00 11.52 N ATOM 1182 CA MET A 122 110.153 90.850 23.049 1.00 11.81 C ATOM 1183 C MET A 122 109.746 92.312 23.173 1.00 10.19 C ATOM 1184 O MET A 122 108.591 92.680 22.938 1.00 13.05 O ATOM 1185 CB MET A 122 111.050 90.631 21.823 1.00 13.54 C ATOM 1186 CG MET A 122 111.750 89.277 21.889 1.00 14.94 C ATOM 1187 SD MET A 122 113.085 89.064 20.691 1.00 17.73 S ATOM 1188 CE MET A 122 112.146 89.264 19.189 1.00 15.32 C ATOM 1189 H MET A 122 108.260 90.172 22.258 1.00 0.00 H ATOM 1190 N LYS A 123 110.717 93.144 23.553 1.00 10.99 N ATOM 1191 CA LYS A 123 110.476 94.569 23.755 1.00 12.84 C ATOM 1192 C LYS A 123 109.809 95.194 22.535 1.00 12.68 C ATOM 1193 O LYS A 123 110.245 94.986 21.402 1.00 12.24 O ATOM 1194 CB LYS A 123 111.806 95.272 24.038 1.00 12.24 C ATOM 1195 CG LYS A 123 111.668 96.758 24.346 1.00 15.58 C ATOM 1196 CD LYS A 123 113.029 97.437 24.350 1.00 22.70 C ATOM 1197 CE LYS A 123 112.949 98.830 24.956 1.00 26.16 C ATOM 1198 NZ LYS A 123 113.314 98.813 26.399 1.00 34.35 N ATOM 1199 HZ1 LYS A 123 112.660 98.189 26.913 1.00 0.00 H ATOM 1200 HZ2 LYS A 123 114.287 98.460 26.505 1.00 0.00 H ATOM 1201 HZ3 LYS A 123 113.250 99.777 26.783 1.00 0.00 H ATOM 1202 H LYS A 123 111.673 92.766 23.710 1.00 0.00 H ATOM 1203 N SER A 124 108.759 95.977 22.774 1.00 13.17 N ATOM 1204 CA SER A 124 108.030 96.591 21.675 1.00 14.56 C ATOM 1205 C SER A 124 108.867 97.675 21.007 1.00 15.83 C ATOM 1206 O SER A 124 109.681 98.346 21.644 1.00 16.25 O ATOM 1207 CB SER A 124 106.705 97.175 22.163 1.00 17.62 C ATOM 1208 OG SER A 124 106.917 98.208 23.117 1.00 22.25 O ATOM 1209 HG SER A 124 106.043 98.566 23.414 1.00 0.00 H ATOM 1210 H SER A 124 108.458 96.151 23.754 1.00 0.00 H ATOM 1211 N GLY A 125 108.671 97.823 19.714 1.00 15.76 N ATOM 1212 CA GLY A 125 109.398 98.812 18.941 1.00 19.74 C ATOM 1213 C GLY A 125 109.551 98.354 17.505 1.00 20.51 C ATOM 1214 O GLY A 125 109.129 97.266 17.122 1.00 20.02 O ATOM 1215 H GLY A 125 107.977 97.215 19.234 1.00 0.00 H ATOM 1216 N ASP A 126 110.197 99.214 16.712 1.00 23.25 N ATOM 1217 CA ASP A 126 110.336 98.942 15.283 1.00 21.71 C ATOM 1218 C ASP A 126 111.316 97.806 15.014 1.00 18.64 C ATOM 1219 O ASP A 126 111.120 97.024 14.076 1.00 26.43 O ATOM 1220 CB ASP A 126 110.774 100.210 14.546 1.00 24.84 C ATOM 1221 CG ASP A 126 109.660 101.239 14.439 1.00 35.53 C ATOM 1222 OD1 ASP A 126 108.482 100.831 14.354 1.00 36.86 O ATOM 1223 OD2 ASP A 126 109.965 102.454 14.436 1.00 35.42 O ATOM 1224 H ASP A 126 110.603 100.083 17.114 1.00 0.00 H ATOM 1225 N ASN A 127 112.367 97.687 15.823 1.00 21.64 N ATOM 1226 CA ASN A 127 113.337 96.615 15.635 1.00 24.42 C ATOM 1227 C ASN A 127 112.691 95.277 15.976 1.00 18.55 C ATOM 1228 O ASN A 127 112.203 95.088 17.098 1.00 18.51 O ATOM 1229 CB ASN A 127 114.569 96.857 16.509 1.00 24.20 C ATOM 1230 CG ASN A 127 115.742 95.938 16.156 1.00 27.39 C ATOM 1231 OD1 ASN A 127 115.566 94.824 15.651 1.00 27.15 O ATOM 1232 ND2 ASN A 127 116.954 96.415 16.427 1.00 33.17 N ATOM 1233 HD22 ASN A 127 117.058 97.358 16.852 1.00 0.00 H ATOM 1234 HD21 ASN A 127 117.797 95.845 16.213 1.00 0.00 H ATOM 1235 H ASN A 127 112.498 98.367 16.599 1.00 0.00 H ATOM 1236 N ASP A 128 112.690 94.352 15.012 1.00 19.38 N ATOM 1237 CA ASP A 128 112.111 93.029 15.238 1.00 17.53 C ATOM 1238 C ASP A 128 112.960 92.171 16.166 1.00 15.54 C ATOM 1239 O ASP A 128 112.447 91.200 16.736 1.00 17.54 O ATOM 1240 CB ASP A 128 111.924 92.278 13.916 1.00 20.10 C ATOM 1241 CG ASP A 128 110.997 92.995 12.958 1.00 21.13 C ATOM 1242 OD1 ASP A 128 110.315 93.962 13.372 1.00 21.20 O ATOM 1243 OD2 ASP A 128 110.958 92.578 11.776 1.00 26.47 O ATOM 1244 H ASP A 128 113.108 94.577 14.086 1.00 0.00 H ATOM 1245 N PHE A 129 114.245 92.490 16.323 1.00 16.80 N ATOM 1246 CA PHE A 129 115.161 91.715 17.159 1.00 18.47 C ATOM 1247 C PHE A 129 115.929 92.657 18.078 1.00 19.26 C ATOM 1248 O PHE A 129 117.143 92.841 17.924 1.00 19.89 O ATOM 1249 CB PHE A 129 116.112 90.886 16.292 1.00 19.51 C ATOM 1250 CG PHE A 129 115.430 89.772 15.540 1.00 16.72 C ATOM 1251 CD1 PHE A 129 115.312 88.507 16.102 1.00 18.01 C ATOM 1252 CD2 PHE A 129 114.901 89.993 14.278 1.00 20.56 C ATOM 1253 CE1 PHE A 129 114.674 87.476 15.418 1.00 17.13 C ATOM 1254 CE2 PHE A 129 114.267 88.971 13.584 1.00 17.12 C ATOM 1255 CZ PHE A 129 114.153 87.714 14.152 1.00 19.80 C ATOM 1256 H PHE A 129 114.613 93.328 15.829 1.00 0.00 H ATOM 1257 N PRO A 130 115.254 93.257 19.061 1.00 16.83 N ATOM 1258 CA PRO A 130 115.937 94.219 19.941 1.00 14.77 C ATOM 1259 C PRO A 130 116.951 93.521 20.836 1.00 16.88 C ATOM 1260 O PRO A 130 116.706 92.422 21.340 1.00 14.91 O ATOM 1261 CB PRO A 130 114.787 94.824 20.756 1.00 17.84 C ATOM 1262 CG PRO A 130 113.760 93.717 20.796 1.00 14.45 C ATOM 1263 CD PRO A 130 113.843 93.059 19.451 1.00 16.59 C ATOM 1264 N VAL A 131 118.114 94.161 21.018 1.00 16.93 N ATOM 1265 CA VAL A 131 119.194 93.600 21.825 1.00 16.43 C ATOM 1266 C VAL A 131 119.845 94.706 22.645 1.00 16.10 C ATOM 1267 O VAL A 131 119.717 95.894 22.342 1.00 18.13 O ATOM 1268 CB VAL A 131 120.267 92.886 20.969 1.00 16.65 C ATOM 1269 CG1 VAL A 131 119.689 91.648 20.264 1.00 17.66 C ATOM 1270 CG2 VAL A 131 120.861 93.850 19.952 1.00 16.85 C ATOM 1271 H VAL A 131 118.252 95.089 20.569 1.00 0.00 H ATOM 1272 N ASN A 132 120.554 94.298 23.700 1.00 16.87 N ATOM 1273 CA ASN A 132 121.341 95.233 24.486 1.00 15.57 C ATOM 1274 C ASN A 132 122.766 95.298 23.939 1.00 19.76 C ATOM 1275 O ASN A 132 123.101 94.680 22.929 1.00 20.16 O ATOM 1276 CB ASN A 132 121.307 94.850 25.970 1.00 18.61 C ATOM 1277 CG ASN A 132 122.059 93.555 26.294 1.00 19.02 C ATOM 1278 OD1 ASN A 132 122.737 92.959 25.454 1.00 19.54 O ATOM 1279 ND2 ASN A 132 121.936 93.123 27.544 1.00 24.10 N ATOM 1280 HD22 ASN A 132 121.355 93.654 28.223 1.00 0.00 H ATOM 1281 HD21 ASN A 132 122.421 92.253 27.844 1.00 0.00 H ATOM 1282 H ASN A 132 120.543 93.292 23.964 1.00 0.00 H ATOM 1283 N GLU A 133 123.624 96.055 24.626 1.00 19.94 N ATOM 1284 CA GLU A 133 124.996 96.229 24.161 1.00 22.54 C ATOM 1285 C GLU A 133 125.755 94.906 24.095 1.00 22.34 C ATOM 1286 O GLU A 133 126.651 94.753 23.258 1.00 26.20 O ATOM 1287 CB GLU A 133 125.723 97.215 25.075 1.00 22.77 C ATOM 1288 CG GLU A 133 126.957 97.844 24.464 1.00 29.34 C ATOM 1289 CD GLU A 133 126.629 98.744 23.284 1.00 33.68 C ATOM 1290 OE1 GLU A 133 127.548 99.023 22.487 1.00 40.45 O ATOM 1291 OE2 GLU A 133 125.461 99.175 23.157 1.00 35.58 O ATOM 1292 H GLU A 133 123.312 96.525 25.500 1.00 0.00 H ATOM 1293 N GLN A 134 125.417 93.943 24.957 1.00 21.70 N ATOM 1294 CA GLN A 134 126.054 92.628 24.916 1.00 23.76 C ATOM 1295 C GLN A 134 125.433 91.690 23.893 1.00 24.30 C ATOM 1296 O GLN A 134 125.850 90.528 23.818 1.00 27.43 O ATOM 1297 CB GLN A 134 126.001 91.940 26.281 1.00 25.45 C ATOM 1298 CG GLN A 134 127.056 92.407 27.240 1.00 30.43 C ATOM 1299 CD GLN A 134 126.790 93.807 27.687 1.00 26.76 C ATOM 1300 OE1 GLN A 134 125.639 94.165 27.952 1.00 29.90 O ATOM 1301 NE2 GLN A 134 127.841 94.630 27.752 1.00 25.98 N ATOM 1302 HE22 GLN A 134 128.792 94.279 27.518 1.00 0.00 H ATOM 1303 HE21 GLN A 134 127.708 95.622 28.036 1.00 0.00 H ATOM 1304 H GLN A 134 124.686 94.133 25.672 1.00 0.00 H ATOM 1305 N GLY A 135 124.453 92.147 23.121 1.00 21.98 N ATOM 1306 CA GLY A 135 123.813 91.293 22.146 1.00 24.39 C ATOM 1307 C GLY A 135 122.715 90.406 22.685 1.00 22.07 C ATOM 1308 O GLY A 135 122.191 89.581 21.928 1.00 23.77 O ATOM 1309 H GLY A 135 124.142 93.134 23.220 1.00 0.00 H ATOM 1310 N LYS A 136 122.354 90.542 23.962 1.00 21.87 N ATOM 1311 CA LYS A 136 121.274 89.754 24.544 1.00 20.31 C ATOM 1312 C LYS A 136 119.928 90.347 24.152 1.00 20.13 C ATOM 1313 O LYS A 136 119.772 91.566 24.079 1.00 17.31 O ATOM 1314 CB LYS A 136 121.391 89.712 26.069 1.00 23.59 C ATOM 1315 CG LYS A 136 122.705 89.154 26.597 1.00 27.73 C ATOM 1316 CD LYS A 136 123.040 87.826 25.962 1.00 31.14 C ATOM 1317 CE LYS A 136 124.238 87.196 26.652 1.00 36.87 C ATOM 1318 NZ LYS A 136 124.067 87.183 28.137 1.00 41.15 N ATOM 1319 HZ1 LYS A 136 123.962 88.159 28.481 1.00 0.00 H ATOM 1320 HZ2 LYS A 136 123.218 86.635 28.382 1.00 0.00 H ATOM 1321 HZ3 LYS A 136 124.902 86.746 28.577 1.00 0.00 H ATOM 1322 H LYS A 136 122.857 91.229 24.559 1.00 0.00 H ATOM 1323 N SER A 137 118.946 89.479 23.914 1.00 17.57 N ATOM 1324 CA SER A 137 117.636 89.951 23.486 1.00 17.28 C ATOM 1325 C SER A 137 116.961 90.757 24.587 1.00 14.15 C ATOM 1326 O SER A 137 117.065 90.434 25.774 1.00 16.07 O ATOM 1327 CB SER A 137 116.738 88.780 23.099 1.00 17.20 C ATOM 1328 OG SER A 137 117.299 88.048 22.030 1.00 19.40 O ATOM 1329 HG SER A 137 116.700 87.295 21.797 1.00 0.00 H ATOM 1330 H SER A 137 119.115 88.460 24.034 1.00 0.00 H ATOM 1331 N LEU A 138 116.272 91.819 24.184 1.00 13.75 N ATOM 1332 CA LEU A 138 115.458 92.610 25.097 1.00 13.21 C ATOM 1333 C LEU A 138 114.073 91.974 25.142 1.00 13.46 C ATOM 1334 O LEU A 138 113.298 92.072 24.184 1.00 14.10 O ATOM 1335 CB LEU A 138 115.410 94.073 24.657 1.00 15.17 C ATOM 1336 CG LEU A 138 116.787 94.746 24.624 1.00 17.64 C ATOM 1337 CD1 LEU A 138 116.658 96.168 24.138 1.00 17.34 C ATOM 1338 CD2 LEU A 138 117.438 94.710 25.997 1.00 20.41 C ATOM 1339 H LEU A 138 116.315 92.095 23.182 1.00 0.00 H ATOM 1340 N LEU A 139 113.776 91.300 26.239 1.00 14.17 N ATOM 1341 CA LEU A 139 112.552 90.538 26.359 1.00 14.34 C ATOM 1342 C LEU A 139 111.489 91.378 27.046 1.00 14.87 C ATOM 1343 O LEU A 139 111.726 92.516 27.463 1.00 19.85 O ATOM 1344 CB LEU A 139 112.825 89.236 27.116 1.00 16.03 C ATOM 1345 CG LEU A 139 113.970 88.405 26.533 1.00 16.91 C ATOM 1346 CD1 LEU A 139 114.338 87.265 27.473 1.00 19.15 C ATOM 1347 CD2 LEU A 139 113.589 87.871 25.177 1.00 18.36 C ATOM 1348 H LEU A 139 114.441 91.318 27.039 1.00 0.00 H ATOM 1349 N ASP A 140 110.300 90.801 27.176 1.00 12.99 N ATOM 1350 CA ASP A 140 109.180 91.435 27.855 1.00 12.21 C ATOM 1351 C ASP A 140 108.496 90.366 28.699 1.00 12.93 C ATOM 1352 O ASP A 140 108.824 89.180 28.614 1.00 13.92 O ATOM 1353 CB ASP A 140 108.220 92.063 26.836 1.00 12.23 C ATOM 1354 CG ASP A 140 107.320 93.139 27.432 1.00 14.59 C ATOM 1355 OD1 ASP A 140 107.378 93.412 28.658 1.00 15.74 O ATOM 1356 OD2 ASP A 140 106.515 93.686 26.651 1.00 15.81 O ATOM 1357 H ASP A 140 110.163 89.852 26.774 1.00 0.00 H ATOM 1358 N THR A 141 107.570 90.790 29.548 1.00 12.88 N ATOM 1359 CA THR A 141 106.735 89.874 30.318 1.00 12.96 C ATOM 1360 C THR A 141 105.295 90.126 29.894 1.00 11.94 C ATOM 1361 O THR A 141 104.698 91.145 30.257 1.00 14.47 O ATOM 1362 CB THR A 141 106.930 90.069 31.816 1.00 15.84 C ATOM 1363 OG1 THR A 141 108.277 89.717 32.159 1.00 21.60 O ATOM 1364 CG2 THR A 141 105.967 89.185 32.591 1.00 18.36 C ATOM 1365 HG1 THR A 141 108.906 90.297 31.661 1.00 0.00 H ATOM 1366 H THR A 141 107.434 91.814 29.670 1.00 0.00 H ATOM 1367 N VAL A 142 104.754 89.213 29.093 1.00 11.46 N ATOM 1368 CA VAL A 142 103.381 89.277 28.603 1.00 11.20 C ATOM 1369 C VAL A 142 102.862 87.845 28.584 1.00 12.56 C ATOM 1370 O VAL A 142 103.357 87.013 27.814 1.00 12.28 O ATOM 1371 CB VAL A 142 103.275 89.901 27.199 1.00 11.25 C ATOM 1372 CG1 VAL A 142 101.808 90.033 26.791 1.00 13.03 C ATOM 1373 CG2 VAL A 142 103.994 91.246 27.124 1.00 13.94 C ATOM 1374 H VAL A 142 105.343 88.408 28.799 1.00 0.00 H ATOM 1375 N ASP A 143 101.893 87.547 29.445 1.00 10.16 N ATOM 1376 CA ASP A 143 101.243 86.244 29.419 1.00 10.13 C ATOM 1377 C ASP A 143 100.652 86.005 28.032 1.00 9.59 C ATOM 1378 O ASP A 143 99.846 86.810 27.548 1.00 10.99 O ATOM 1379 CB ASP A 143 100.163 86.212 30.504 1.00 11.34 C ATOM 1380 CG ASP A 143 99.571 84.833 30.722 1.00 14.17 C ATOM 1381 OD1 ASP A 143 99.720 83.948 29.862 1.00 12.95 O ATOM 1382 OD2 ASP A 143 98.923 84.643 31.770 1.00 16.14 O ATOM 1383 H ASP A 143 101.595 88.254 30.147 1.00 0.00 H ATOM 1384 N PHE A 144 101.059 84.912 27.381 1.00 9.34 N ATOM 1385 CA PHE A 144 100.499 84.642 26.058 1.00 9.78 C ATOM 1386 C PHE A 144 98.997 84.371 26.100 1.00 8.81 C ATOM 1387 O PHE A 144 98.335 84.476 25.058 1.00 9.21 O ATOM 1388 CB PHE A 144 101.260 83.499 25.353 1.00 8.42 C ATOM 1389 CG PHE A 144 101.360 82.219 26.148 1.00 9.39 C ATOM 1390 CD1 PHE A 144 100.251 81.412 26.321 1.00 9.00 C ATOM 1391 CD2 PHE A 144 102.574 81.812 26.689 1.00 9.97 C ATOM 1392 CE1 PHE A 144 100.334 80.239 27.055 1.00 10.43 C ATOM 1393 CE2 PHE A 144 102.666 80.631 27.431 1.00 9.71 C ATOM 1394 CZ PHE A 144 101.541 79.842 27.606 1.00 10.80 C ATOM 1395 H PHE A 144 101.757 84.269 27.805 1.00 0.00 H ATOM 1396 N CYS A 145 98.427 84.071 27.277 1.00 9.22 N ATOM 1397 CA CYS A 145 96.974 83.984 27.376 1.00 10.37 C ATOM 1398 C CYS A 145 96.318 85.358 27.233 1.00 10.19 C ATOM 1399 O CYS A 145 95.213 85.462 26.681 1.00 11.24 O ATOM 1400 CB CYS A 145 96.575 83.335 28.703 1.00 10.83 C ATOM 1401 SG CYS A 145 96.887 81.552 28.769 1.00 13.31 S ATOM 1402 H CYS A 145 99.019 83.901 28.115 1.00 0.00 H ATOM 1403 N ASP A 146 96.978 86.419 27.717 1.00 11.29 N ATOM 1404 CA ASP A 146 96.485 87.777 27.488 1.00 11.31 C ATOM 1405 C ASP A 146 96.550 88.142 26.010 1.00 11.23 C ATOM 1406 O ASP A 146 95.628 88.770 25.475 1.00 11.50 O ATOM 1407 CB ASP A 146 97.300 88.783 28.306 1.00 12.79 C ATOM 1408 CG ASP A 146 97.108 88.640 29.807 1.00 15.45 C ATOM 1409 OD1 ASP A 146 96.192 87.919 30.245 1.00 17.33 O ATOM 1410 OD2 ASP A 146 97.884 89.286 30.550 1.00 19.87 O ATOM 1411 H ASP A 146 97.852 86.275 28.262 1.00 0.00 H ATOM 1412 N THR A 147 97.648 87.783 25.339 1.00 9.87 N ATOM 1413 CA THR A 147 97.723 87.974 23.892 1.00 10.25 C ATOM 1414 C THR A 147 96.633 87.170 23.189 1.00 10.02 C ATOM 1415 O THR A 147 95.964 87.674 22.274 1.00 9.71 O ATOM 1416 CB THR A 147 99.116 87.571 23.389 1.00 10.37 C ATOM 1417 OG1 THR A 147 100.125 88.226 24.174 1.00 9.95 O ATOM 1418 CG2 THR A 147 99.328 87.933 21.909 1.00 10.08 C ATOM 1419 HG1 THR A 147 100.019 89.207 24.094 1.00 0.00 H ATOM 1420 H THR A 147 98.453 87.366 25.849 1.00 0.00 H ATOM 1421 N TRP A 148 96.413 85.928 23.640 1.00 10.28 N ATOM 1422 CA TRP A 148 95.424 85.064 23.006 1.00 10.32 C ATOM 1423 C TRP A 148 94.037 85.700 23.006 1.00 11.34 C ATOM 1424 O TRP A 148 93.314 85.616 22.010 1.00 10.29 O ATOM 1425 CB TRP A 148 95.374 83.708 23.709 1.00 9.37 C ATOM 1426 CG TRP A 148 94.461 82.772 22.981 1.00 7.77 C ATOM 1427 CD1 TRP A 148 93.212 82.351 23.367 1.00 10.11 C ATOM 1428 CD2 TRP A 148 94.700 82.198 21.698 1.00 9.87 C ATOM 1429 NE1 TRP A 148 92.676 81.526 22.398 1.00 9.85 N ATOM 1430 CE2 TRP A 148 93.579 81.416 21.369 1.00 9.53 C ATOM 1431 CE3 TRP A 148 95.768 82.253 20.804 1.00 10.03 C ATOM 1432 CZ2 TRP A 148 93.496 80.705 20.177 1.00 10.84 C ATOM 1433 CZ3 TRP A 148 95.683 81.546 19.629 1.00 10.98 C ATOM 1434 CH2 TRP A 148 94.563 80.779 19.325 1.00 9.89 C ATOM 1435 HE1 TRP A 148 91.745 81.065 22.440 1.00 0.00 H ATOM 1436 H TRP A 148 96.955 85.575 24.454 1.00 0.00 H ATOM 1437 N GLU A 149 93.647 86.336 24.118 1.00 10.37 N ATOM 1438 CA GLU A 149 92.345 86.990 24.179 1.00 10.83 C ATOM 1439 C GLU A 149 92.175 88.024 23.073 1.00 11.99 C ATOM 1440 O GLU A 149 91.066 88.188 22.535 1.00 11.46 O ATOM 1441 CB GLU A 149 92.163 87.624 25.558 1.00 11.64 C ATOM 1442 CG GLU A 149 92.023 86.572 26.647 1.00 12.84 C ATOM 1443 CD GLU A 149 92.120 87.128 28.054 1.00 18.08 C ATOM 1444 OE1 GLU A 149 92.414 88.333 28.209 1.00 18.94 O ATOM 1445 OE2 GLU A 149 91.921 86.346 29.010 1.00 18.10 O ATOM 1446 H GLU A 149 94.278 86.364 24.945 1.00 0.00 H ATOM 1447 N ARG A 150 93.255 88.715 22.695 1.00 11.10 N ATOM 1448 CA ARG A 150 93.119 89.692 21.621 1.00 12.54 C ATOM 1449 C ARG A 150 93.036 89.020 20.253 1.00 13.18 C ATOM 1450 O ARG A 150 92.337 89.520 19.366 1.00 11.81 O ATOM 1451 CB ARG A 150 94.270 90.698 21.666 1.00 11.87 C ATOM 1452 CG ARG A 150 94.346 91.492 22.963 1.00 11.62 C ATOM 1453 CD ARG A 150 92.967 91.917 23.480 1.00 12.22 C ATOM 1454 NE ARG A 150 93.123 92.852 24.594 1.00 12.49 N ATOM 1455 CZ ARG A 150 93.149 94.174 24.449 1.00 13.91 C ATOM 1456 NH1 ARG A 150 93.006 94.722 23.252 1.00 13.95 N ATOM 1457 NH2 ARG A 150 93.314 94.947 25.509 1.00 15.75 N ATOM 1458 HE ARG A 150 93.219 92.461 25.553 1.00 0.00 H ATOM 1459 HH12 ARG A 150 93.028 95.757 23.148 1.00 0.00 H ATOM 1460 HH11 ARG A 150 92.872 94.118 22.416 1.00 0.00 H ATOM 1461 HH22 ARG A 150 93.335 95.981 25.400 1.00 0.00 H ATOM 1462 HH21 ARG A 150 93.423 94.521 26.451 1.00 0.00 H ATOM 1463 H ARG A 150 94.173 88.559 23.157 1.00 0.00 H ATOM 1464 N LEU A 151 93.698 87.877 20.059 1.00 10.01 N ATOM 1465 CA LEU A 151 93.462 87.136 18.823 1.00 11.20 C ATOM 1466 C LEU A 151 92.010 86.680 18.731 1.00 9.91 C ATOM 1467 O LEU A 151 91.419 86.701 17.645 1.00 10.73 O ATOM 1468 CB LEU A 151 94.416 85.945 18.706 1.00 11.46 C ATOM 1469 CG LEU A 151 95.798 86.283 18.135 1.00 14.44 C ATOM 1470 CD1 LEU A 151 96.689 86.777 19.221 1.00 15.82 C ATOM 1471 CD2 LEU A 151 96.433 85.066 17.437 1.00 16.93 C ATOM 1472 H LEU A 151 94.367 87.522 20.772 1.00 0.00 H ATOM 1473 N GLU A 152 91.415 86.279 19.861 1.00 9.84 N ATOM 1474 CA GLU A 152 89.991 85.951 19.872 1.00 11.41 C ATOM 1475 C GLU A 152 89.146 87.139 19.425 1.00 13.41 C ATOM 1476 O GLU A 152 88.199 86.977 18.645 1.00 12.55 O ATOM 1477 CB GLU A 152 89.573 85.494 21.268 1.00 10.67 C ATOM 1478 CG GLU A 152 90.222 84.178 21.685 1.00 11.56 C ATOM 1479 CD GLU A 152 89.828 83.759 23.083 1.00 13.90 C ATOM 1480 OE1 GLU A 152 89.661 84.647 23.952 1.00 14.47 O ATOM 1481 OE2 GLU A 152 89.672 82.538 23.320 1.00 12.29 O ATOM 1482 H GLU A 152 91.970 86.200 20.737 1.00 0.00 H ATOM 1483 N GLU A 153 89.477 88.340 19.906 1.00 11.44 N ATOM 1484 CA GLU A 153 88.747 89.534 19.487 1.00 12.25 C ATOM 1485 C GLU A 153 88.925 89.805 17.999 1.00 13.59 C ATOM 1486 O GLU A 153 87.988 90.257 17.331 1.00 15.63 O ATOM 1487 CB GLU A 153 89.193 90.742 20.313 1.00 15.58 C ATOM 1488 CG GLU A 153 88.804 90.625 21.775 1.00 17.01 C ATOM 1489 CD GLU A 153 89.204 91.826 22.611 1.00 22.03 C ATOM 1490 OE1 GLU A 153 89.578 92.878 22.041 1.00 28.67 O ATOM 1491 OE2 GLU A 153 89.127 91.718 23.855 1.00 27.23 O ATOM 1492 H GLU A 153 90.261 88.426 20.584 1.00 0.00 H ATOM 1493 N CYS A 154 90.118 89.543 17.460 1.00 10.80 N ATOM 1494 CA CYS A 154 90.335 89.741 16.030 1.00 13.29 C ATOM 1495 C CYS A 154 89.476 88.791 15.202 1.00 12.91 C ATOM 1496 O CYS A 154 88.958 89.179 14.148 1.00 13.66 O ATOM 1497 CB CYS A 154 91.812 89.571 15.689 1.00 13.60 C ATOM 1498 SG CYS A 154 92.890 90.901 16.331 1.00 16.34 S ATOM 1499 H CYS A 154 90.894 89.197 18.060 1.00 0.00 H ATOM 1500 N LYS A 155 89.304 87.551 15.671 1.00 12.51 N ATOM 1501 CA LYS A 155 88.410 86.618 14.996 1.00 11.90 C ATOM 1502 C LYS A 155 86.967 87.107 15.048 1.00 14.65 C ATOM 1503 O LYS A 155 86.256 87.083 14.036 1.00 14.84 O ATOM 1504 CB LYS A 155 88.551 85.225 15.614 1.00 14.72 C ATOM 1505 CG LYS A 155 87.618 84.174 15.017 1.00 14.81 C ATOM 1506 CD LYS A 155 88.056 82.778 15.454 1.00 14.84 C ATOM 1507 CE LYS A 155 86.922 81.756 15.377 1.00 19.04 C ATOM 1508 NZ LYS A 155 86.493 81.455 13.982 1.00 21.58 N ATOM 1509 HZ1 LYS A 155 86.159 82.329 13.527 1.00 0.00 H ATOM 1510 HZ2 LYS A 155 87.299 81.071 13.448 1.00 0.00 H ATOM 1511 HZ3 LYS A 155 85.723 80.756 14.001 1.00 0.00 H ATOM 1512 H LYS A 155 89.813 87.249 16.526 1.00 0.00 H ATOM 1513 N ASP A 156 86.528 87.588 16.213 1.00 14.13 N ATOM 1514 CA ASP A 156 85.163 88.078 16.335 1.00 15.28 C ATOM 1515 C ASP A 156 84.930 89.343 15.522 1.00 16.27 C ATOM 1516 O ASP A 156 83.790 89.605 15.125 1.00 20.88 O ATOM 1517 CB ASP A 156 84.833 88.298 17.808 1.00 17.34 C ATOM 1518 CG ASP A 156 84.551 86.989 18.525 1.00 19.09 C ATOM 1519 OD1 ASP A 156 84.121 86.044 17.840 1.00 21.58 O ATOM 1520 OD2 ASP A 156 84.761 86.903 19.752 1.00 25.21 O ATOM 1521 H ASP A 156 87.163 87.613 17.036 1.00 0.00 H ATOM 1522 N ALA A 157 85.978 90.103 15.229 1.00 14.92 N ATOM 1523 CA ALA A 157 85.859 91.274 14.370 1.00 15.62 C ATOM 1524 C ALA A 157 85.865 90.927 12.887 1.00 17.75 C ATOM 1525 O ALA A 157 85.660 91.820 12.061 1.00 18.38 O ATOM 1526 CB ALA A 157 86.989 92.259 14.669 1.00 17.48 C ATOM 1527 H ALA A 157 86.908 89.856 15.623 1.00 0.00 H ATOM 1528 N GLY A 158 86.098 89.667 12.530 1.00 14.01 N ATOM 1529 CA GLY A 158 86.113 89.261 11.138 1.00 17.57 C ATOM 1530 C GLY A 158 87.405 89.518 10.392 1.00 17.74 C ATOM 1531 O GLY A 158 87.441 89.333 9.171 1.00 19.47 O ATOM 1532 H GLY A 158 86.274 88.955 13.268 1.00 0.00 H ATOM 1533 N LEU A 159 88.466 89.941 11.076 1.00 14.05 N ATOM 1534 CA LEU A 159 89.735 90.189 10.407 1.00 12.80 C ATOM 1535 C LEU A 159 90.484 88.896 10.130 1.00 11.46 C ATOM 1536 O LEU A 159 91.389 88.876 9.291 1.00 12.16 O ATOM 1537 CB LEU A 159 90.616 91.105 11.255 1.00 14.68 C ATOM 1538 CG LEU A 159 90.112 92.530 11.511 1.00 16.33 C ATOM 1539 CD1 LEU A 159 91.007 93.228 12.522 1.00 21.75 C ATOM 1540 CD2 LEU A 159 90.082 93.314 10.212 1.00 21.60 C ATOM 1541 H LEU A 159 88.387 90.096 12.101 1.00 0.00 H ATOM 1542 N VAL A 160 90.140 87.832 10.834 1.00 12.10 N ATOM 1543 CA VAL A 160 90.790 86.539 10.668 1.00 11.58 C ATOM 1544 C VAL A 160 89.726 85.462 10.843 1.00 12.57 C ATOM 1545 O VAL A 160 88.829 85.584 11.687 1.00 13.03 O ATOM 1546 CB VAL A 160 91.966 86.373 11.658 1.00 12.95 C ATOM 1547 CG1 VAL A 160 91.500 86.526 13.094 1.00 14.97 C ATOM 1548 CG2 VAL A 160 92.612 85.051 11.471 1.00 16.91 C ATOM 1549 H VAL A 160 89.376 87.921 11.534 1.00 0.00 H ATOM 1550 N LYS A 161 89.795 84.423 10.008 1.00 10.72 N ATOM 1551 CA LYS A 161 88.808 83.356 10.114 1.00 11.56 C ATOM 1552 C LYS A 161 89.143 82.380 11.235 1.00 11.28 C ATOM 1553 O LYS A 161 88.245 81.912 11.946 1.00 14.55 O ATOM 1554 CB LYS A 161 88.694 82.598 8.790 1.00 13.08 C ATOM 1555 CG LYS A 161 88.308 83.445 7.598 1.00 17.99 C ATOM 1556 CD LYS A 161 86.857 83.870 7.669 1.00 24.87 C ATOM 1557 CE LYS A 161 86.386 84.378 6.315 1.00 27.25 C ATOM 1558 NZ LYS A 161 84.963 84.819 6.348 1.00 39.09 N ATOM 1559 HZ1 LYS A 161 84.359 84.018 6.623 1.00 0.00 H ATOM 1560 HZ2 LYS A 161 84.856 85.589 7.039 1.00 0.00 H ATOM 1561 HZ3 LYS A 161 84.684 85.157 5.405 1.00 0.00 H ATOM 1562 H LYS A 161 90.545 84.375 9.289 1.00 0.00 H ATOM 1563 N SER A 162 90.425 82.049 11.401 1.00 10.35 N ATOM 1564 CA SER A 162 90.863 81.075 12.392 1.00 9.84 C ATOM 1565 C SER A 162 92.109 81.594 13.087 1.00 10.51 C ATOM 1566 O SER A 162 92.900 82.326 12.493 1.00 10.82 O ATOM 1567 CB SER A 162 91.194 79.706 11.760 1.00 10.78 C ATOM 1568 OG SER A 162 90.064 79.124 11.144 1.00 11.92 O ATOM 1569 HG SER A 162 89.353 78.991 11.820 1.00 0.00 H ATOM 1570 H SER A 162 91.140 82.505 10.799 1.00 0.00 H ATOM 1571 N ILE A 163 92.300 81.186 14.337 1.00 10.20 N ATOM 1572 CA ILE A 163 93.478 81.601 15.087 1.00 9.28 C ATOM 1573 C ILE A 163 94.216 80.384 15.636 1.00 9.46 C ATOM 1574 O ILE A 163 93.629 79.329 15.898 1.00 10.12 O ATOM 1575 CB ILE A 163 93.118 82.605 16.209 1.00 8.99 C ATOM 1576 CG1 ILE A 163 91.982 82.089 17.098 1.00 10.58 C ATOM 1577 CG2 ILE A 163 92.735 83.936 15.585 1.00 10.54 C ATOM 1578 CD1 ILE A 163 91.678 83.017 18.297 1.00 11.83 C ATOM 1579 H ILE A 163 91.599 80.562 14.786 1.00 0.00 H ATOM 1580 N GLY A 164 95.529 80.534 15.782 1.00 9.14 N ATOM 1581 CA GLY A 164 96.356 79.450 16.267 1.00 10.40 C ATOM 1582 C GLY A 164 97.675 79.963 16.796 1.00 8.34 C ATOM 1583 O GLY A 164 97.847 81.161 17.040 1.00 8.98 O ATOM 1584 H GLY A 164 95.969 81.446 15.544 1.00 0.00 H ATOM 1585 N VAL A 165 98.617 79.034 16.990 1.00 8.19 N ATOM 1586 CA VAL A 165 99.906 79.382 17.576 1.00 8.49 C ATOM 1587 C VAL A 165 101.021 78.681 16.815 1.00 8.11 C ATOM 1588 O VAL A 165 100.792 77.793 15.986 1.00 8.62 O ATOM 1589 CB VAL A 165 100.001 79.039 19.086 1.00 7.63 C ATOM 1590 CG1 VAL A 165 98.952 79.809 19.913 1.00 10.96 C ATOM 1591 CG2 VAL A 165 99.917 77.527 19.323 1.00 8.90 C ATOM 1592 H VAL A 165 98.427 78.048 16.719 1.00 0.00 H ATOM 1593 N SER A 166 102.248 79.093 17.124 1.00 7.95 N ATOM 1594 CA SER A 166 103.448 78.504 16.551 1.00 7.90 C ATOM 1595 C SER A 166 104.502 78.371 17.642 1.00 8.53 C ATOM 1596 O SER A 166 104.668 79.269 18.480 1.00 9.03 O ATOM 1597 CB SER A 166 103.983 79.355 15.387 1.00 9.72 C ATOM 1598 OG SER A 166 105.082 78.731 14.742 1.00 10.93 O ATOM 1599 HG SER A 166 104.797 77.854 14.382 1.00 0.00 H ATOM 1600 H SER A 166 102.354 79.871 17.806 1.00 0.00 H ATOM 1601 N ASN A 167 105.204 77.232 17.627 1.00 7.98 N ATOM 1602 CA ASN A 167 106.330 76.985 18.530 1.00 8.95 C ATOM 1603 C ASN A 167 105.909 76.954 19.995 1.00 9.20 C ATOM 1604 O ASN A 167 106.687 77.324 20.876 1.00 9.93 O ATOM 1605 CB ASN A 167 107.438 78.016 18.300 1.00 9.11 C ATOM 1606 CG ASN A 167 107.953 77.967 16.891 1.00 8.03 C ATOM 1607 OD1 ASN A 167 108.388 76.911 16.418 1.00 9.83 O ATOM 1608 ND2 ASN A 167 107.854 79.080 16.185 1.00 10.00 N ATOM 1609 HD22 ASN A 167 107.482 79.945 16.627 1.00 0.00 H ATOM 1610 HD21 ASN A 167 108.149 79.091 15.188 1.00 0.00 H ATOM 1611 H ASN A 167 104.939 76.492 16.946 1.00 0.00 H ATOM 1612 N PHE A 168 104.683 76.507 20.267 1.00 9.59 N ATOM 1613 CA PHE A 168 104.238 76.256 21.630 1.00 8.43 C ATOM 1614 C PHE A 168 104.549 74.812 22.013 1.00 8.51 C ATOM 1615 O PHE A 168 104.496 73.894 21.180 1.00 9.95 O ATOM 1616 CB PHE A 168 102.728 76.498 21.778 1.00 9.13 C ATOM 1617 CG PHE A 168 102.348 77.936 21.989 1.00 9.62 C ATOM 1618 CD1 PHE A 168 102.860 78.940 21.182 1.00 9.86 C ATOM 1619 CD2 PHE A 168 101.448 78.276 22.995 1.00 9.70 C ATOM 1620 CE1 PHE A 168 102.489 80.268 21.395 1.00 9.68 C ATOM 1621 CE2 PHE A 168 101.080 79.592 23.200 1.00 9.95 C ATOM 1622 CZ PHE A 168 101.604 80.582 22.402 1.00 10.04 C ATOM 1623 H PHE A 168 104.024 76.332 19.481 1.00 0.00 H ATOM 1624 N ASN A 169 104.859 74.608 23.290 1.00 7.19 N ATOM 1625 CA ASN A 169 105.015 73.253 23.787 1.00 8.25 C ATOM 1626 C ASN A 169 103.730 72.798 24.485 1.00 8.79 C ATOM 1627 O ASN A 169 102.739 73.530 24.559 1.00 9.10 O ATOM 1628 CB ASN A 169 106.260 73.139 24.680 1.00 9.00 C ATOM 1629 CG ASN A 169 106.147 73.906 25.990 1.00 9.26 C ATOM 1630 OD1 ASN A 169 105.059 74.131 26.522 1.00 9.51 O ATOM 1631 ND2 ASN A 169 107.292 74.276 26.534 1.00 10.57 N ATOM 1632 HD22 ASN A 169 108.189 74.066 26.051 1.00 0.00 H ATOM 1633 HD21 ASN A 169 107.297 74.777 27.445 1.00 0.00 H ATOM 1634 H ASN A 169 104.989 75.417 23.931 1.00 0.00 H ATOM 1635 N HIS A 170 103.756 71.556 24.983 1.00 8.69 N ATOM 1636 CA HIS A 170 102.585 70.937 25.599 1.00 10.77 C ATOM 1637 C HIS A 170 102.039 71.777 26.752 1.00 10.87 C ATOM 1638 O HIS A 170 100.833 72.049 26.818 1.00 11.38 O ATOM 1639 CB HIS A 170 102.967 69.526 26.073 1.00 11.19 C ATOM 1640 CG HIS A 170 101.938 68.871 26.937 1.00 12.29 C ATOM 1641 ND1 HIS A 170 102.251 68.287 28.146 1.00 23.64 N ATOM 1642 CD2 HIS A 170 100.605 68.701 26.772 1.00 12.54 C ATOM 1643 CE1 HIS A 170 101.154 67.787 28.689 1.00 24.60 C ATOM 1644 NE2 HIS A 170 100.140 68.025 27.875 1.00 15.50 N ATOM 1645 H HIS A 170 104.641 71.012 24.930 1.00 0.00 H ATOM 1646 N ARG A 171 102.913 72.185 27.675 1.00 10.11 N ATOM 1647 CA ARG A 171 102.473 72.970 28.827 1.00 10.85 C ATOM 1648 C ARG A 171 101.826 74.266 28.370 1.00 10.35 C ATOM 1649 O ARG A 171 100.818 74.705 28.934 1.00 10.10 O ATOM 1650 CB ARG A 171 103.670 73.252 29.740 1.00 12.30 C ATOM 1651 CG ARG A 171 103.407 74.211 30.888 1.00 12.01 C ATOM 1652 CD ARG A 171 104.685 74.499 31.681 1.00 12.38 C ATOM 1653 NE ARG A 171 105.786 74.976 30.840 1.00 12.05 N ATOM 1654 CZ ARG A 171 105.868 76.207 30.332 1.00 12.67 C ATOM 1655 NH1 ARG A 171 104.904 77.093 30.561 1.00 11.21 N ATOM 1656 NH2 ARG A 171 106.909 76.545 29.577 1.00 13.66 N ATOM 1657 HE ARG A 171 106.555 74.310 30.625 1.00 0.00 H ATOM 1658 HH12 ARG A 171 104.973 78.051 30.163 1.00 0.00 H ATOM 1659 HH11 ARG A 171 104.081 76.828 31.139 1.00 0.00 H ATOM 1660 HH22 ARG A 171 106.974 77.504 29.180 1.00 0.00 H ATOM 1661 HH21 ARG A 171 107.658 75.850 29.383 1.00 0.00 H ATOM 1662 H ARG A 171 103.919 71.941 27.573 1.00 0.00 H ATOM 1663 N GLN A 172 102.374 74.870 27.319 1.00 8.84 N ATOM 1664 CA GLN A 172 101.864 76.159 26.873 1.00 8.95 C ATOM 1665 C GLN A 172 100.517 76.012 26.175 1.00 9.08 C ATOM 1666 O GLN A 172 99.613 76.832 26.383 1.00 9.67 O ATOM 1667 CB GLN A 172 102.908 76.819 25.981 1.00 8.68 C ATOM 1668 CG GLN A 172 104.165 77.174 26.781 1.00 8.58 C ATOM 1669 CD GLN A 172 105.349 77.520 25.908 1.00 10.00 C ATOM 1670 OE1 GLN A 172 105.491 77.011 24.791 1.00 9.11 O ATOM 1671 NE2 GLN A 172 106.221 78.390 26.415 1.00 9.77 N ATOM 1672 HE22 GLN A 172 106.062 78.794 27.360 1.00 0.00 H ATOM 1673 HE21 GLN A 172 107.060 78.665 25.866 1.00 0.00 H ATOM 1674 H GLN A 172 103.166 74.422 26.816 1.00 0.00 H ATOM 1675 N LEU A 173 100.351 74.957 25.370 1.00 8.44 N ATOM 1676 CA LEU A 173 99.038 74.687 24.792 1.00 9.80 C ATOM 1677 C LEU A 173 98.002 74.437 25.884 1.00 9.42 C ATOM 1678 O LEU A 173 96.872 74.929 25.795 1.00 10.14 O ATOM 1679 CB LEU A 173 99.109 73.492 23.838 1.00 10.41 C ATOM 1680 CG LEU A 173 99.898 73.753 22.556 1.00 9.81 C ATOM 1681 CD1 LEU A 173 100.055 72.464 21.776 1.00 11.98 C ATOM 1682 CD2 LEU A 173 99.201 74.795 21.689 1.00 12.52 C ATOM 1683 H LEU A 173 101.154 74.332 25.157 1.00 0.00 H ATOM 1684 N GLU A 174 98.377 73.689 26.928 1.00 9.48 N ATOM 1685 CA GLU A 174 97.455 73.444 28.033 1.00 10.47 C ATOM 1686 C GLU A 174 97.064 74.746 28.727 1.00 9.93 C ATOM 1687 O GLU A 174 95.910 74.906 29.136 1.00 11.01 O ATOM 1688 CB GLU A 174 98.073 72.460 29.030 1.00 12.74 C ATOM 1689 CG GLU A 174 97.908 70.998 28.621 1.00 12.67 C ATOM 1690 CD GLU A 174 96.480 70.526 28.803 1.00 13.88 C ATOM 1691 OE1 GLU A 174 96.052 70.354 29.970 1.00 17.72 O ATOM 1692 OE2 GLU A 174 95.775 70.365 27.794 1.00 15.06 O ATOM 1693 H GLU A 174 99.332 73.279 26.952 1.00 0.00 H ATOM 1694 N ARG A 175 97.997 75.702 28.845 1.00 9.58 N ATOM 1695 CA ARG A 175 97.638 76.987 29.443 1.00 10.63 C ATOM 1696 C ARG A 175 96.529 77.677 28.653 1.00 11.83 C ATOM 1697 O ARG A 175 95.585 78.220 29.244 1.00 11.52 O ATOM 1698 CB ARG A 175 98.868 77.898 29.552 1.00 11.87 C ATOM 1699 CG ARG A 175 99.809 77.583 30.728 1.00 13.75 C ATOM 1700 CD ARG A 175 99.759 78.660 31.833 1.00 14.54 C ATOM 1701 NE ARG A 175 100.072 80.003 31.344 1.00 12.09 N ATOM 1702 CZ ARG A 175 101.300 80.456 31.086 1.00 12.32 C ATOM 1703 NH1 ARG A 175 101.460 81.700 30.647 1.00 12.70 N ATOM 1704 NH2 ARG A 175 102.362 79.679 31.257 1.00 12.31 N ATOM 1705 HE ARG A 175 99.277 80.654 31.185 1.00 0.00 H ATOM 1706 HH12 ARG A 175 102.414 82.061 30.443 1.00 0.00 H ATOM 1707 HH11 ARG A 175 100.631 82.313 30.507 1.00 0.00 H ATOM 1708 HH22 ARG A 175 103.313 80.046 31.052 1.00 0.00 H ATOM 1709 HH21 ARG A 175 102.243 78.703 31.596 1.00 0.00 H ATOM 1710 H ARG A 175 98.968 75.531 28.514 1.00 0.00 H ATOM 1711 N ILE A 176 96.601 77.652 27.316 1.00 10.02 N ATOM 1712 CA ILE A 176 95.518 78.238 26.529 1.00 9.58 C ATOM 1713 C ILE A 176 94.236 77.435 26.708 1.00 11.75 C ATOM 1714 O ILE A 176 93.166 77.996 26.971 1.00 11.08 O ATOM 1715 CB ILE A 176 95.908 78.351 25.043 1.00 10.18 C ATOM 1716 CG1 ILE A 176 97.071 79.327 24.879 1.00 14.98 C ATOM 1717 CG2 ILE A 176 94.714 78.816 24.218 1.00 12.35 C ATOM 1718 CD1 ILE A 176 97.432 79.599 23.444 1.00 15.57 C ATOM 1719 H ILE A 176 97.420 77.220 26.842 1.00 0.00 H ATOM 1720 N LEU A 177 94.320 76.110 26.565 1.00 11.65 N ATOM 1721 CA LEU A 177 93.109 75.291 26.595 1.00 11.57 C ATOM 1722 C LEU A 177 92.406 75.371 27.939 1.00 9.86 C ATOM 1723 O LEU A 177 91.175 75.245 28.005 1.00 13.91 O ATOM 1724 CB LEU A 177 93.447 73.836 26.279 1.00 11.00 C ATOM 1725 CG LEU A 177 93.275 73.428 24.813 1.00 17.41 C ATOM 1726 CD1 LEU A 177 93.923 74.392 23.847 1.00 19.48 C ATOM 1727 CD2 LEU A 177 93.797 72.015 24.577 1.00 15.31 C ATOM 1728 H LEU A 177 95.248 75.660 26.432 1.00 0.00 H ATOM 1729 N ASN A 178 93.165 75.586 29.012 1.00 10.43 N ATOM 1730 CA ASN A 178 92.616 75.632 30.360 1.00 11.28 C ATOM 1731 C ASN A 178 92.406 77.052 30.861 1.00 15.55 C ATOM 1732 O ASN A 178 92.118 77.243 32.048 1.00 15.63 O ATOM 1733 CB ASN A 178 93.531 74.878 31.319 1.00 12.44 C ATOM 1734 CG ASN A 178 93.683 73.419 30.950 1.00 14.16 C ATOM 1735 OD1 ASN A 178 92.768 72.811 30.393 1.00 17.02 O ATOM 1736 ND2 ASN A 178 94.840 72.853 31.255 1.00 14.19 N ATOM 1737 HD22 ASN A 178 95.583 73.409 31.726 1.00 0.00 H ATOM 1738 HD21 ASN A 178 95.006 71.853 31.024 1.00 0.00 H ATOM 1739 H ASN A 178 94.187 75.726 28.882 1.00 0.00 H ATOM 1740 N LYS A 179 92.558 78.057 30.005 1.00 12.40 N ATOM 1741 CA LYS A 179 92.463 79.415 30.511 1.00 12.92 C ATOM 1742 C LYS A 179 91.010 79.757 30.836 1.00 13.35 C ATOM 1743 O LYS A 179 90.094 79.370 30.109 1.00 14.52 O ATOM 1744 CB LYS A 179 93.057 80.413 29.522 1.00 15.05 C ATOM 1745 CG LYS A 179 92.181 80.865 28.394 1.00 18.95 C ATOM 1746 CD LYS A 179 92.790 82.131 27.756 1.00 21.16 C ATOM 1747 CE LYS A 179 92.469 83.371 28.542 1.00 22.75 C ATOM 1748 NZ LYS A 179 91.021 83.758 28.445 1.00 18.57 N ATOM 1749 HZ1 LYS A 179 90.777 83.938 27.450 1.00 0.00 H ATOM 1750 HZ2 LYS A 179 90.431 82.984 28.813 1.00 0.00 H ATOM 1751 HZ3 LYS A 179 90.855 84.619 29.005 1.00 0.00 H ATOM 1752 H LYS A 179 92.741 77.876 28.997 1.00 0.00 H ATOM 1753 N PRO A 180 90.760 80.443 31.946 1.00 13.82 N ATOM 1754 CA PRO A 180 89.383 80.832 32.252 1.00 13.86 C ATOM 1755 C PRO A 180 88.797 81.676 31.129 1.00 15.79 C ATOM 1756 O PRO A 180 89.466 82.550 30.573 1.00 16.16 O ATOM 1757 CB PRO A 180 89.522 81.636 33.550 1.00 17.03 C ATOM 1758 CG PRO A 180 90.788 81.139 34.170 1.00 19.13 C ATOM 1759 CD PRO A 180 91.704 80.825 33.006 1.00 17.27 C ATOM 1760 N GLY A 181 87.543 81.390 30.784 1.00 16.28 N ATOM 1761 CA GLY A 181 86.849 82.189 29.795 1.00 16.33 C ATOM 1762 C GLY A 181 87.301 82.011 28.365 1.00 15.82 C ATOM 1763 O GLY A 181 86.966 82.842 27.518 1.00 17.33 O ATOM 1764 H GLY A 181 87.057 80.585 31.229 1.00 0.00 H ATOM 1765 N LEU A 182 88.042 80.941 28.068 1.00 14.35 N ATOM 1766 CA LEU A 182 88.459 80.660 26.698 1.00 14.57 C ATOM 1767 C LEU A 182 87.269 80.703 25.746 1.00 14.44 C ATOM 1768 O LEU A 182 86.225 80.102 26.009 1.00 16.91 O ATOM 1769 CB LEU A 182 89.130 79.285 26.636 1.00 13.87 C ATOM 1770 CG LEU A 182 89.649 78.869 25.261 1.00 12.70 C ATOM 1771 CD1 LEU A 182 90.860 79.698 24.890 1.00 14.41 C ATOM 1772 CD2 LEU A 182 89.977 77.388 25.240 1.00 13.58 C ATOM 1773 H LEU A 182 88.328 80.293 28.830 1.00 0.00 H ATOM 1774 N LYS A 183 87.426 81.444 24.651 1.00 13.14 N ATOM 1775 CA LYS A 183 86.422 81.510 23.599 1.00 12.79 C ATOM 1776 C LYS A 183 86.725 80.539 22.472 1.00 15.44 C ATOM 1777 O LYS A 183 85.832 79.811 22.020 1.00 18.22 O ATOM 1778 CB LYS A 183 86.330 82.924 23.016 1.00 17.78 C ATOM 1779 CG LYS A 183 85.892 83.996 23.991 1.00 20.71 C ATOM 1780 CD LYS A 183 85.970 85.380 23.339 1.00 26.62 C ATOM 1781 CE LYS A 183 85.745 86.497 24.359 1.00 31.83 C ATOM 1782 NZ LYS A 183 86.198 87.834 23.854 1.00 31.05 N ATOM 1783 HZ1 LYS A 183 87.215 87.796 23.639 1.00 0.00 H ATOM 1784 HZ2 LYS A 183 85.669 88.075 22.992 1.00 0.00 H ATOM 1785 HZ3 LYS A 183 86.024 88.556 24.582 1.00 0.00 H ATOM 1786 H LYS A 183 88.300 81.997 24.543 1.00 0.00 H ATOM 1787 N TYR A 184 87.972 80.527 22.001 1.00 13.09 N ATOM 1788 CA TYR A 184 88.349 79.716 20.851 1.00 12.23 C ATOM 1789 C TYR A 184 89.650 78.987 21.132 1.00 11.53 C ATOM 1790 O TYR A 184 90.637 79.614 21.514 1.00 12.85 O ATOM 1791 CB TYR A 184 88.513 80.580 19.597 1.00 13.25 C ATOM 1792 CG TYR A 184 87.293 81.401 19.254 1.00 14.47 C ATOM 1793 CD1 TYR A 184 86.102 80.783 18.908 1.00 17.77 C ATOM 1794 CD2 TYR A 184 87.333 82.783 19.277 1.00 14.06 C ATOM 1795 CE1 TYR A 184 84.982 81.514 18.587 1.00 19.23 C ATOM 1796 CE2 TYR A 184 86.206 83.536 18.959 1.00 16.33 C ATOM 1797 CZ TYR A 184 85.033 82.887 18.619 1.00 18.91 C ATOM 1798 OH TYR A 184 83.902 83.604 18.295 1.00 24.38 O ATOM 1799 HH TYR A 184 84.089 84.176 17.509 1.00 0.00 H ATOM 1800 H TYR A 184 88.695 81.112 22.467 1.00 0.00 H ATOM 1801 N LYS A 185 89.654 77.676 20.922 1.00 11.46 N ATOM 1802 CA LYS A 185 90.894 76.918 20.970 1.00 12.33 C ATOM 1803 C LYS A 185 91.789 77.313 19.797 1.00 11.36 C ATOM 1804 O LYS A 185 91.299 77.732 18.750 1.00 13.44 O ATOM 1805 CB LYS A 185 90.604 75.423 20.896 1.00 12.03 C ATOM 1806 CG LYS A 185 89.887 74.888 22.128 1.00 16.68 C ATOM 1807 CD LYS A 185 89.277 73.522 21.872 1.00 21.28 C ATOM 1808 CE LYS A 185 90.335 72.500 21.537 1.00 17.72 C ATOM 1809 NZ LYS A 185 89.691 71.167 21.321 1.00 16.44 N ATOM 1810 HZ1 LYS A 185 89.193 70.880 22.187 1.00 0.00 H ATOM 1811 HZ2 LYS A 185 89.013 71.234 20.536 1.00 0.00 H ATOM 1812 HZ3 LYS A 185 90.422 70.464 21.090 1.00 0.00 H ATOM 1813 H LYS A 185 88.759 77.185 20.721 1.00 0.00 H ATOM 1814 N PRO A 186 93.104 77.173 19.932 1.00 10.47 N ATOM 1815 CA PRO A 186 93.949 77.278 18.739 1.00 10.55 C ATOM 1816 C PRO A 186 93.599 76.159 17.770 1.00 9.80 C ATOM 1817 O PRO A 186 93.368 75.019 18.179 1.00 10.86 O ATOM 1818 CB PRO A 186 95.372 77.128 19.283 1.00 11.64 C ATOM 1819 CG PRO A 186 95.216 76.471 20.611 1.00 16.50 C ATOM 1820 CD PRO A 186 93.870 76.860 21.149 1.00 12.17 C ATOM 1821 N VAL A 187 93.542 76.501 16.480 1.00 8.18 N ATOM 1822 CA VAL A 187 93.277 75.465 15.477 1.00 8.28 C ATOM 1823 C VAL A 187 94.542 74.725 15.080 1.00 10.41 C ATOM 1824 O VAL A 187 94.459 73.620 14.521 1.00 9.88 O ATOM 1825 CB VAL A 187 92.623 76.018 14.198 1.00 9.86 C ATOM 1826 CG1 VAL A 187 91.292 76.700 14.522 1.00 11.34 C ATOM 1827 CG2 VAL A 187 93.559 76.961 13.452 1.00 10.06 C ATOM 1828 H VAL A 187 93.684 77.490 16.191 1.00 0.00 H ATOM 1829 N CYS A 188 95.714 75.290 15.366 1.00 9.11 N ATOM 1830 CA CYS A 188 96.961 74.686 14.934 1.00 8.07 C ATOM 1831 C CYS A 188 98.070 75.053 15.903 1.00 8.57 C ATOM 1832 O CYS A 188 97.973 76.017 16.671 1.00 8.22 O ATOM 1833 CB CYS A 188 97.362 75.123 13.518 1.00 10.06 C ATOM 1834 SG CYS A 188 97.805 76.877 13.407 1.00 11.11 S ATOM 1835 H CYS A 188 95.736 76.178 15.907 1.00 0.00 H ATOM 1836 N ASN A 189 99.132 74.266 15.835 1.00 7.66 N ATOM 1837 CA ASN A 189 100.429 74.589 16.413 1.00 7.18 C ATOM 1838 C ASN A 189 101.430 74.357 15.296 1.00 7.44 C ATOM 1839 O ASN A 189 101.650 73.209 14.885 1.00 9.00 O ATOM 1840 CB ASN A 189 100.728 73.710 17.628 1.00 9.02 C ATOM 1841 CG ASN A 189 101.979 74.142 18.382 1.00 9.56 C ATOM 1842 OD1 ASN A 189 102.455 75.276 18.248 1.00 9.27 O ATOM 1843 ND2 ASN A 189 102.513 73.225 19.197 1.00 9.65 N ATOM 1844 HD22 ASN A 189 102.078 72.284 19.277 1.00 0.00 H ATOM 1845 HD21 ASN A 189 103.363 73.453 19.750 1.00 0.00 H ATOM 1846 H ASN A 189 99.034 73.358 15.337 1.00 0.00 H ATOM 1847 N GLN A 190 101.978 75.441 14.756 1.00 8.36 N ATOM 1848 CA GLN A 190 102.953 75.344 13.678 1.00 8.55 C ATOM 1849 C GLN A 190 104.344 75.203 14.290 1.00 7.85 C ATOM 1850 O GLN A 190 104.795 76.084 15.036 1.00 8.93 O ATOM 1851 CB GLN A 190 102.877 76.558 12.752 1.00 8.31 C ATOM 1852 CG GLN A 190 103.975 76.520 11.689 1.00 9.74 C ATOM 1853 CD GLN A 190 103.922 77.644 10.675 1.00 11.24 C ATOM 1854 OE1 GLN A 190 104.967 78.149 10.254 1.00 12.51 O ATOM 1855 NE2 GLN A 190 102.720 77.996 10.224 1.00 11.37 N ATOM 1856 HE22 GLN A 190 101.867 77.543 10.609 1.00 0.00 H ATOM 1857 HE21 GLN A 190 102.634 78.724 9.487 1.00 0.00 H ATOM 1858 H GLN A 190 101.705 76.379 15.111 1.00 0.00 H ATOM 1859 N VAL A 191 105.001 74.072 14.025 1.00 8.17 N ATOM 1860 CA VAL A 191 106.292 73.763 14.634 1.00 7.31 C ATOM 1861 C VAL A 191 107.250 73.234 13.574 1.00 7.74 C ATOM 1862 O VAL A 191 106.842 72.784 12.502 1.00 8.27 O ATOM 1863 CB VAL A 191 106.165 72.731 15.791 1.00 8.75 C ATOM 1864 CG1 VAL A 191 105.374 73.324 16.948 1.00 8.30 C ATOM 1865 CG2 VAL A 191 105.503 71.453 15.293 1.00 9.25 C ATOM 1866 H VAL A 191 104.580 73.389 13.364 1.00 0.00 H ATOM 1867 N GLU A 192 108.545 73.278 13.892 1.00 7.65 N ATOM 1868 CA GLU A 192 109.521 72.522 13.109 1.00 6.68 C ATOM 1869 C GLU A 192 109.196 71.036 13.203 1.00 8.48 C ATOM 1870 O GLU A 192 109.012 70.509 14.302 1.00 9.19 O ATOM 1871 CB GLU A 192 110.935 72.787 13.642 1.00 7.50 C ATOM 1872 CG GLU A 192 112.020 72.124 12.811 1.00 9.32 C ATOM 1873 CD GLU A 192 113.407 72.241 13.395 1.00 11.11 C ATOM 1874 OE1 GLU A 192 113.622 73.068 14.300 1.00 11.19 O ATOM 1875 OE2 GLU A 192 114.289 71.494 12.925 1.00 12.66 O ATOM 1876 H GLU A 192 108.861 73.852 14.700 1.00 0.00 H ATOM 1877 N CYS A 193 109.123 70.347 12.064 1.00 7.99 N ATOM 1878 CA CYS A 193 108.796 68.926 12.092 1.00 7.84 C ATOM 1879 C CYS A 193 109.271 68.272 10.806 1.00 8.85 C ATOM 1880 O CYS A 193 108.980 68.771 9.718 1.00 9.56 O ATOM 1881 CB CYS A 193 107.288 68.715 12.267 1.00 9.60 C ATOM 1882 SG CYS A 193 106.814 66.979 12.513 1.00 10.48 S ATOM 1883 H CYS A 193 109.299 70.823 11.156 1.00 0.00 H ATOM 1884 N HIS A 194 109.971 67.149 10.935 1.00 8.50 N ATOM 1885 CA HIS A 194 110.578 66.456 9.800 1.00 8.34 C ATOM 1886 C HIS A 194 111.071 65.112 10.314 1.00 10.28 C ATOM 1887 O HIS A 194 110.939 64.793 11.498 1.00 9.87 O ATOM 1888 CB HIS A 194 111.718 67.274 9.187 1.00 9.22 C ATOM 1889 CG HIS A 194 112.652 67.832 10.211 1.00 10.08 C ATOM 1890 ND1 HIS A 194 113.586 67.060 10.871 1.00 9.98 N ATOM 1891 CD2 HIS A 194 112.750 69.075 10.734 1.00 9.78 C ATOM 1892 CE1 HIS A 194 114.236 67.813 11.739 1.00 9.71 C ATOM 1893 NE2 HIS A 194 113.751 69.041 11.674 1.00 9.98 N ATOM 1894 H HIS A 194 110.092 66.746 11.886 1.00 0.00 H ATOM 1895 N LEU A 195 111.659 64.330 9.412 1.00 10.00 N ATOM 1896 CA LEU A 195 112.092 62.983 9.770 1.00 9.66 C ATOM 1897 C LEU A 195 113.093 62.948 10.921 1.00 9.78 C ATOM 1898 O LEU A 195 113.199 61.920 11.601 1.00 11.41 O ATOM 1899 CB LEU A 195 112.695 62.305 8.550 1.00 11.74 C ATOM 1900 CG LEU A 195 111.675 61.839 7.510 1.00 11.28 C ATOM 1901 CD1 LEU A 195 112.374 61.568 6.203 1.00 13.69 C ATOM 1902 CD2 LEU A 195 110.974 60.579 7.988 1.00 13.55 C ATOM 1903 H LEU A 195 111.811 64.681 8.445 1.00 0.00 H ATOM 1904 N TYR A 196 113.866 64.014 11.141 1.00 10.30 N ATOM 1905 CA TYR A 196 114.831 64.005 12.236 1.00 9.80 C ATOM 1906 C TYR A 196 114.290 64.635 13.514 1.00 12.15 C ATOM 1907 O TYR A 196 114.972 64.606 14.540 1.00 12.17 O ATOM 1908 CB TYR A 196 116.120 64.718 11.824 1.00 11.81 C ATOM 1909 CG TYR A 196 117.029 63.965 10.868 1.00 11.23 C ATOM 1910 CD1 TYR A 196 116.886 62.596 10.638 1.00 11.13 C ATOM 1911 CD2 TYR A 196 118.052 64.634 10.223 1.00 12.40 C ATOM 1912 CE1 TYR A 196 117.749 61.927 9.770 1.00 12.80 C ATOM 1913 CE2 TYR A 196 118.907 63.982 9.353 1.00 13.05 C ATOM 1914 CZ TYR A 196 118.751 62.629 9.136 1.00 14.01 C ATOM 1915 OH TYR A 196 119.615 61.983 8.280 1.00 16.06 O ATOM 1916 HH TYR A 196 119.374 61.024 8.231 1.00 0.00 H ATOM 1917 H TYR A 196 113.780 64.852 10.531 1.00 0.00 H ATOM 1918 N LEU A 197 113.082 65.199 13.473 1.00 9.46 N ATOM 1919 CA LEU A 197 112.395 65.788 14.629 1.00 11.07 C ATOM 1920 C LEU A 197 110.906 65.506 14.411 1.00 10.77 C ATOM 1921 O LEU A 197 110.116 66.372 14.013 1.00 10.83 O ATOM 1922 CB LEU A 197 112.678 67.289 14.748 1.00 10.15 C ATOM 1923 CG LEU A 197 112.071 68.066 15.918 1.00 9.74 C ATOM 1924 CD1 LEU A 197 112.801 67.733 17.216 1.00 13.57 C ATOM 1925 CD2 LEU A 197 112.096 69.565 15.660 1.00 11.46 C ATOM 1926 H LEU A 197 112.592 65.223 12.556 1.00 0.00 H ATOM 1927 N ASN A 198 110.483 64.253 14.625 1.00 10.45 N ATOM 1928 CA ASN A 198 109.186 63.860 14.088 1.00 10.38 C ATOM 1929 C ASN A 198 108.021 64.196 15.015 1.00 11.44 C ATOM 1930 O ASN A 198 106.865 64.014 14.618 1.00 12.54 O ATOM 1931 CB ASN A 198 109.185 62.371 13.664 1.00 10.78 C ATOM 1932 CG ASN A 198 109.250 61.392 14.819 1.00 12.63 C ATOM 1933 OD1 ASN A 198 108.916 61.703 15.957 1.00 12.96 O ATOM 1934 ND2 ASN A 198 109.643 60.162 14.507 1.00 14.44 N ATOM 1935 HD22 ASN A 198 109.919 59.936 13.530 1.00 0.00 H ATOM 1936 HD21 ASN A 198 109.675 59.425 15.240 1.00 0.00 H ATOM 1937 H ASN A 198 111.065 63.578 15.161 1.00 0.00 H ATOM 1938 N GLN A 199 108.295 64.744 16.203 1.00 9.89 N ATOM 1939 CA GLN A 199 107.269 65.352 17.059 1.00 10.84 C ATOM 1940 C GLN A 199 106.175 64.367 17.457 1.00 10.88 C ATOM 1941 O GLN A 199 105.019 64.749 17.630 1.00 11.93 O ATOM 1942 CB GLN A 199 106.638 66.587 16.392 1.00 10.32 C ATOM 1943 CG GLN A 199 107.590 67.744 16.071 1.00 10.25 C ATOM 1944 CD GLN A 199 107.879 68.626 17.269 1.00 10.41 C ATOM 1945 OE1 GLN A 199 107.569 68.269 18.416 1.00 11.43 O ATOM 1946 NE2 GLN A 199 108.473 69.781 17.019 1.00 10.03 N ATOM 1947 HE22 GLN A 199 108.715 70.040 16.041 1.00 0.00 H ATOM 1948 HE21 GLN A 199 108.698 70.430 17.800 1.00 0.00 H ATOM 1949 H GLN A 199 109.280 64.739 16.536 1.00 0.00 H ATOM 1950 N ARG A 200 106.517 63.085 17.612 1.00 11.58 N ATOM 1951 CA ARG A 200 105.500 62.089 17.938 1.00 11.29 C ATOM 1952 C ARG A 200 104.714 62.468 19.195 1.00 11.99 C ATOM 1953 O ARG A 200 103.481 62.346 19.220 1.00 11.55 O ATOM 1954 CB ARG A 200 106.166 60.713 18.081 1.00 13.88 C ATOM 1955 CG ARG A 200 105.321 59.596 18.687 1.00 21.04 C ATOM 1956 CD ARG A 200 103.906 59.509 18.130 1.00 25.84 C ATOM 1957 NE ARG A 200 103.848 59.323 16.686 1.00 28.16 N ATOM 1958 CZ ARG A 200 102.797 59.662 15.944 1.00 30.69 C ATOM 1959 NH1 ARG A 200 101.733 60.217 16.515 1.00 26.44 N ATOM 1960 NH2 ARG A 200 102.812 59.457 14.633 1.00 30.72 N ATOM 1961 HE ARG A 200 104.672 58.903 16.210 1.00 0.00 H ATOM 1962 HH12 ARG A 200 100.911 60.482 15.936 1.00 0.00 H ATOM 1963 HH11 ARG A 200 101.722 60.386 17.541 1.00 0.00 H ATOM 1964 HH22 ARG A 200 101.989 59.723 14.056 1.00 0.00 H ATOM 1965 HH21 ARG A 200 103.647 59.030 14.183 1.00 0.00 H ATOM 1966 H ARG A 200 107.510 62.796 17.500 1.00 0.00 H ATOM 1967 N LYS A 201 105.398 62.928 20.247 1.00 11.73 N ATOM 1968 CA LYS A 201 104.687 63.208 21.493 1.00 13.22 C ATOM 1969 C LYS A 201 103.794 64.434 21.364 1.00 11.09 C ATOM 1970 O LYS A 201 102.640 64.416 21.808 1.00 10.98 O ATOM 1971 CB LYS A 201 105.675 63.383 22.645 1.00 12.71 C ATOM 1972 CG LYS A 201 106.442 62.098 22.926 1.00 19.65 C ATOM 1973 CD LYS A 201 107.295 62.180 24.165 1.00 22.34 C ATOM 1974 CE LYS A 201 107.495 60.771 24.719 1.00 27.91 C ATOM 1975 NZ LYS A 201 108.169 60.770 26.039 1.00 34.10 N ATOM 1976 HZ1 LYS A 201 109.105 61.215 25.949 1.00 0.00 H ATOM 1977 HZ2 LYS A 201 107.594 61.304 26.721 1.00 0.00 H ATOM 1978 HZ3 LYS A 201 108.280 59.790 26.369 1.00 0.00 H ATOM 1979 H LYS A 201 106.424 63.085 20.180 1.00 0.00 H ATOM 1980 N LEU A 202 104.305 65.510 20.760 1.00 11.31 N ATOM 1981 CA LEU A 202 103.487 66.704 20.598 1.00 10.59 C ATOM 1982 C LEU A 202 102.341 66.442 19.629 1.00 10.54 C ATOM 1983 O LEU A 202 101.223 66.925 19.841 1.00 10.04 O ATOM 1984 CB LEU A 202 104.364 67.870 20.137 1.00 10.18 C ATOM 1985 CG LEU A 202 103.733 69.265 20.075 1.00 10.65 C ATOM 1986 CD1 LEU A 202 103.143 69.680 21.419 1.00 11.22 C ATOM 1987 CD2 LEU A 202 104.782 70.279 19.597 1.00 11.07 C ATOM 1988 H LEU A 202 105.283 65.495 20.407 1.00 0.00 H ATOM 1989 N LEU A 203 102.592 65.652 18.574 1.00 9.42 N ATOM 1990 CA LEU A 203 101.534 65.305 17.631 1.00 10.70 C ATOM 1991 C LEU A 203 100.416 64.534 18.320 1.00 11.63 C ATOM 1992 O LEU A 203 99.232 64.814 18.105 1.00 11.36 O ATOM 1993 CB LEU A 203 102.115 64.492 16.465 1.00 10.61 C ATOM 1994 CG LEU A 203 101.105 64.020 15.430 1.00 11.09 C ATOM 1995 CD1 LEU A 203 100.453 65.211 14.725 1.00 13.22 C ATOM 1996 CD2 LEU A 203 101.785 63.097 14.431 1.00 16.92 C ATOM 1997 H LEU A 203 103.553 65.282 18.426 1.00 0.00 H ATOM 1998 N ASP A 204 100.779 63.546 19.146 1.00 10.79 N ATOM 1999 CA ASP A 204 99.780 62.808 19.914 1.00 10.85 C ATOM 2000 C ASP A 204 98.911 63.762 20.719 1.00 10.00 C ATOM 2001 O ASP A 204 97.674 63.695 20.673 1.00 11.50 O ATOM 2002 CB ASP A 204 100.452 61.818 20.875 1.00 10.97 C ATOM 2003 CG ASP A 204 100.927 60.524 20.213 1.00 16.04 C ATOM 2004 OD1 ASP A 204 100.611 60.246 19.036 1.00 15.33 O ATOM 2005 OD2 ASP A 204 101.635 59.779 20.935 1.00 17.55 O ATOM 2006 H ASP A 204 101.785 63.301 19.242 1.00 0.00 H ATOM 2007 N TYR A 205 99.548 64.674 21.461 1.00 10.62 N ATOM 2008 CA TYR A 205 98.778 65.606 22.273 1.00 9.83 C ATOM 2009 C TYR A 205 97.871 66.465 21.406 1.00 10.93 C ATOM 2010 O TYR A 205 96.685 66.650 21.706 1.00 10.01 O ATOM 2011 CB TYR A 205 99.708 66.487 23.104 1.00 10.50 C ATOM 2012 CG TYR A 205 98.949 67.610 23.763 1.00 10.86 C ATOM 2013 CD1 TYR A 205 98.229 67.403 24.928 1.00 13.14 C ATOM 2014 CD2 TYR A 205 98.906 68.867 23.178 1.00 13.58 C ATOM 2015 CE1 TYR A 205 97.511 68.435 25.507 1.00 14.49 C ATOM 2016 CE2 TYR A 205 98.194 69.891 23.734 1.00 12.16 C ATOM 2017 CZ TYR A 205 97.508 69.677 24.900 1.00 12.44 C ATOM 2018 OH TYR A 205 96.794 70.714 25.438 1.00 14.57 O ATOM 2019 HH TYR A 205 96.355 70.413 26.273 1.00 0.00 H ATOM 2020 H TYR A 205 100.587 64.717 21.458 1.00 0.00 H ATOM 2021 N CYS A 206 98.414 67.013 20.322 1.00 10.11 N ATOM 2022 CA CYS A 206 97.599 67.861 19.461 1.00 9.99 C ATOM 2023 C CYS A 206 96.415 67.092 18.896 1.00 10.25 C ATOM 2024 O CYS A 206 95.289 67.599 18.880 1.00 11.09 O ATOM 2025 CB CYS A 206 98.454 68.452 18.338 1.00 9.68 C ATOM 2026 SG CYS A 206 99.551 69.774 18.905 1.00 13.51 S ATOM 2027 H CYS A 206 99.413 66.838 20.091 1.00 0.00 H ATOM 2028 N GLU A 207 96.644 65.851 18.459 1.00 10.57 N ATOM 2029 CA GLU A 207 95.540 65.017 17.991 1.00 10.03 C ATOM 2030 C GLU A 207 94.483 64.834 19.071 1.00 10.35 C ATOM 2031 O GLU A 207 93.281 64.883 18.785 1.00 12.64 O ATOM 2032 CB GLU A 207 96.067 63.658 17.541 1.00 12.77 C ATOM 2033 CG GLU A 207 96.805 63.676 16.222 1.00 13.27 C ATOM 2034 CD GLU A 207 97.428 62.338 15.894 1.00 21.97 C ATOM 2035 OE1 GLU A 207 97.621 61.525 16.826 1.00 24.54 O ATOM 2036 OE2 GLU A 207 97.721 62.096 14.700 1.00 26.35 O ATOM 2037 H GLU A 207 97.614 65.476 18.452 1.00 0.00 H ATOM 2038 N SER A 208 94.911 64.631 20.318 1.00 10.20 N ATOM 2039 CA SER A 208 93.954 64.414 21.399 1.00 11.81 C ATOM 2040 C SER A 208 93.078 65.634 21.643 1.00 11.79 C ATOM 2041 O SER A 208 91.994 65.498 22.214 1.00 15.25 O ATOM 2042 CB SER A 208 94.688 64.029 22.684 1.00 12.88 C ATOM 2043 OG SER A 208 95.233 65.157 23.355 1.00 12.26 O ATOM 2044 HG SER A 208 95.878 65.614 22.759 1.00 0.00 H ATOM 2045 H SER A 208 95.931 64.627 20.521 1.00 0.00 H ATOM 2046 N LYS A 209 93.509 66.815 21.201 1.00 9.96 N ATOM 2047 CA LYS A 209 92.778 68.059 21.392 1.00 11.46 C ATOM 2048 C LYS A 209 92.252 68.636 20.080 1.00 11.40 C ATOM 2049 O LYS A 209 91.794 69.783 20.059 1.00 12.86 O ATOM 2050 CB LYS A 209 93.675 69.092 22.087 1.00 12.70 C ATOM 2051 CG LYS A 209 94.289 68.632 23.390 1.00 11.52 C ATOM 2052 CD LYS A 209 93.221 68.272 24.413 1.00 14.08 C ATOM 2053 CE LYS A 209 93.846 67.853 25.737 1.00 16.37 C ATOM 2054 NZ LYS A 209 92.811 67.423 26.721 1.00 22.77 N ATOM 2055 HZ1 LYS A 209 92.157 68.211 26.901 1.00 0.00 H ATOM 2056 HZ2 LYS A 209 92.283 66.614 26.336 1.00 0.00 H ATOM 2057 HZ3 LYS A 209 93.274 67.145 27.610 1.00 0.00 H ATOM 2058 H LYS A 209 94.416 66.850 20.693 1.00 0.00 H ATOM 2059 N ASP A 210 92.311 67.875 18.984 1.00 12.29 N ATOM 2060 CA ASP A 210 91.857 68.349 17.677 1.00 13.86 C ATOM 2061 C ASP A 210 92.588 69.627 17.264 1.00 13.14 C ATOM 2062 O ASP A 210 91.997 70.553 16.710 1.00 12.23 O ATOM 2063 CB ASP A 210 90.342 68.567 17.649 1.00 15.54 C ATOM 2064 CG ASP A 210 89.565 67.275 17.706 1.00 29.30 C ATOM 2065 OD1 ASP A 210 89.952 66.309 17.009 1.00 38.70 O ATOM 2066 OD2 ASP A 210 88.559 67.232 18.445 1.00 34.43 O ATOM 2067 H ASP A 210 92.693 66.911 19.063 1.00 0.00 H ATOM 2068 N ILE A 211 93.886 69.682 17.547 1.00 10.56 N ATOM 2069 CA ILE A 211 94.757 70.761 17.095 1.00 10.28 C ATOM 2070 C ILE A 211 95.613 70.195 15.971 1.00 11.11 C ATOM 2071 O ILE A 211 96.212 69.124 16.124 1.00 12.22 O ATOM 2072 CB ILE A 211 95.630 71.289 18.247 1.00 8.92 C ATOM 2073 CG1 ILE A 211 94.754 71.884 19.353 1.00 10.70 C ATOM 2074 CG2 ILE A 211 96.653 72.305 17.738 1.00 10.81 C ATOM 2075 CD1 ILE A 211 95.534 72.204 20.604 1.00 11.36 C ATOM 2076 H ILE A 211 94.300 68.918 18.119 1.00 0.00 H ATOM 2077 N VAL A 212 95.650 70.888 14.842 1.00 9.58 N ATOM 2078 CA VAL A 212 96.435 70.428 13.698 1.00 9.52 C ATOM 2079 C VAL A 212 97.885 70.845 13.879 1.00 9.37 C ATOM 2080 O VAL A 212 98.174 71.999 14.211 1.00 9.92 O ATOM 2081 CB VAL A 212 95.866 70.993 12.388 1.00 10.47 C ATOM 2082 CG1 VAL A 212 96.753 70.597 11.205 1.00 12.65 C ATOM 2083 CG2 VAL A 212 94.454 70.489 12.169 1.00 14.93 C ATOM 2084 H VAL A 212 95.111 71.775 14.769 1.00 0.00 H ATOM 2085 N LEU A 213 98.804 69.912 13.663 1.00 10.85 N ATOM 2086 CA LEU A 213 100.222 70.235 13.653 1.00 10.18 C ATOM 2087 C LEU A 213 100.606 70.642 12.234 1.00 11.03 C ATOM 2088 O LEU A 213 100.394 69.881 11.278 1.00 11.49 O ATOM 2089 CB LEU A 213 101.055 69.050 14.159 1.00 11.06 C ATOM 2090 CG LEU A 213 102.509 69.325 14.547 1.00 13.07 C ATOM 2091 CD1 LEU A 213 103.044 68.252 15.504 1.00 15.38 C ATOM 2092 CD2 LEU A 213 103.394 69.387 13.305 1.00 19.27 C ATOM 2093 H LEU A 213 98.504 68.930 13.498 1.00 0.00 H ATOM 2094 N VAL A 214 101.121 71.861 12.088 1.00 7.94 N ATOM 2095 CA VAL A 214 101.607 72.382 10.810 1.00 9.20 C ATOM 2096 C VAL A 214 103.126 72.408 10.870 1.00 10.06 C ATOM 2097 O VAL A 214 103.697 72.918 11.838 1.00 10.22 O ATOM 2098 CB VAL A 214 101.045 73.782 10.530 1.00 8.12 C ATOM 2099 CG1 VAL A 214 101.645 74.355 9.239 1.00 9.72 C ATOM 2100 CG2 VAL A 214 99.513 73.745 10.466 1.00 9.85 C ATOM 2101 H VAL A 214 101.181 72.475 12.926 1.00 0.00 H ATOM 2102 N ALA A 215 103.785 71.861 9.848 1.00 9.77 N ATOM 2103 CA ALA A 215 105.230 71.627 9.891 1.00 9.23 C ATOM 2104 C ALA A 215 105.961 72.636 9.019 1.00 10.85 C ATOM 2105 O ALA A 215 105.692 72.729 7.820 1.00 11.93 O ATOM 2106 CB ALA A 215 105.560 70.203 9.431 1.00 9.90 C ATOM 2107 H ALA A 215 103.256 71.592 8.994 1.00 0.00 H ATOM 2108 N TYR A 216 106.893 73.379 9.610 1.00 9.29 N ATOM 2109 CA TYR A 216 107.912 74.048 8.808 1.00 8.57 C ATOM 2110 C TYR A 216 109.249 73.340 8.980 1.00 8.98 C ATOM 2111 O TYR A 216 109.415 72.469 9.842 1.00 8.94 O ATOM 2112 CB TYR A 216 108.035 75.541 9.150 1.00 10.59 C ATOM 2113 CG TYR A 216 108.566 75.877 10.525 1.00 10.62 C ATOM 2114 CD1 TYR A 216 109.927 76.044 10.755 1.00 11.51 C ATOM 2115 CD2 TYR A 216 107.692 76.064 11.595 1.00 11.08 C ATOM 2116 CE1 TYR A 216 110.403 76.366 12.032 1.00 12.83 C ATOM 2117 CE2 TYR A 216 108.161 76.383 12.859 1.00 10.24 C ATOM 2118 CZ TYR A 216 109.505 76.533 13.071 1.00 9.56 C ATOM 2119 OH TYR A 216 109.966 76.850 14.333 1.00 11.42 O ATOM 2120 HH TYR A 216 109.697 76.141 14.969 1.00 0.00 H ATOM 2121 H TYR A 216 106.895 73.483 10.645 1.00 0.00 H ATOM 2122 N GLY A 217 110.206 73.699 8.124 1.00 11.19 N ATOM 2123 CA GLY A 217 111.442 72.937 8.080 1.00 10.54 C ATOM 2124 C GLY A 217 111.228 71.494 7.691 1.00 9.97 C ATOM 2125 O GLY A 217 111.998 70.618 8.106 1.00 11.26 O ATOM 2126 H GLY A 217 110.069 74.516 7.495 1.00 0.00 H ATOM 2127 N ALA A 218 110.201 71.226 6.874 1.00 9.30 N ATOM 2128 CA ALA A 218 109.731 69.866 6.621 1.00 10.68 C ATOM 2129 C ALA A 218 110.742 69.010 5.874 1.00 10.36 C ATOM 2130 O ALA A 218 110.612 67.784 5.879 1.00 9.50 O ATOM 2131 CB ALA A 218 108.426 69.916 5.828 1.00 10.60 C ATOM 2132 H ALA A 218 109.719 72.017 6.401 1.00 0.00 H ATOM 2133 N LEU A 219 111.722 69.623 5.210 1.00 10.83 N ATOM 2134 CA LEU A 219 112.766 68.898 4.499 1.00 9.63 C ATOM 2135 C LEU A 219 114.112 69.012 5.202 1.00 14.08 C ATOM 2136 O LEU A 219 115.150 68.709 4.603 1.00 13.33 O ATOM 2137 CB LEU A 219 112.867 69.387 3.055 1.00 10.80 C ATOM 2138 CG LEU A 219 111.602 69.215 2.213 1.00 9.31 C ATOM 2139 CD1 LEU A 219 111.845 69.659 0.769 1.00 11.14 C ATOM 2140 CD2 LEU A 219 111.118 67.771 2.254 1.00 13.45 C ATOM 2141 H LEU A 219 111.742 70.663 5.199 1.00 0.00 H ATOM 2142 N GLY A 220 114.115 69.439 6.462 1.00 11.82 N ATOM 2143 CA GLY A 220 115.346 69.539 7.222 1.00 12.61 C ATOM 2144 C GLY A 220 116.072 70.859 7.112 1.00 15.36 C ATOM 2145 O GLY A 220 117.240 70.933 7.516 1.00 15.98 O ATOM 2146 H GLY A 220 113.216 69.707 6.911 1.00 0.00 H ATOM 2147 N THR A 221 115.425 71.896 6.574 1.00 13.39 N ATOM 2148 CA THR A 221 116.000 73.240 6.395 1.00 14.56 C ATOM 2149 C THR A 221 117.249 73.235 5.513 1.00 18.64 C ATOM 2150 O THR A 221 117.557 74.246 4.880 1.00 26.75 O ATOM 2151 CB THR A 221 116.355 73.912 7.742 1.00 17.27 C ATOM 2152 OG1 THR A 221 117.484 73.253 8.325 1.00 24.42 O ATOM 2153 CG2 THR A 221 115.189 73.857 8.692 1.00 14.63 C ATOM 2154 HG1 THR A 221 117.265 72.300 8.480 1.00 0.00 H ATOM 2155 H THR A 221 114.446 71.744 6.259 1.00 0.00 H TER 2156 THR A 221 ATOM 2157 N SER A 232 125.836 69.867 11.070 1.00 44.09 N ATOM 2158 CA SER A 232 124.544 69.218 11.273 1.00 34.86 C ATOM 2159 C SER A 232 124.203 68.315 10.084 1.00 31.15 C ATOM 2160 O SER A 232 124.522 68.643 8.940 1.00 33.85 O ATOM 2161 CB SER A 232 123.447 70.264 11.485 1.00 34.10 C ATOM 2162 OG SER A 232 123.312 71.099 10.349 1.00 38.75 O ATOM 2163 HG SER A 232 123.076 70.547 9.562 1.00 0.00 H ATOM 2164 HN3 SER A 232 125.800 70.445 10.206 1.00 0.00 H ATOM 2165 HN2 SER A 232 126.575 69.142 10.973 1.00 0.00 H ATOM 2166 HN1 SER A 232 126.049 70.475 11.887 1.00 0.00 H ATOM 2167 N PRO A 233 123.558 67.180 10.355 1.00 33.64 N ATOM 2168 CA PRO A 233 123.251 66.233 9.275 1.00 29.49 C ATOM 2169 C PRO A 233 122.335 66.850 8.227 1.00 27.29 C ATOM 2170 O PRO A 233 121.536 67.744 8.515 1.00 26.39 O ATOM 2171 CB PRO A 233 122.563 65.073 10.007 1.00 30.18 C ATOM 2172 CG PRO A 233 122.022 65.688 11.272 1.00 33.15 C ATOM 2173 CD PRO A 233 123.024 66.736 11.656 1.00 31.68 C ATOM 2174 N VAL A 234 122.474 66.374 6.992 1.00 23.53 N ATOM 2175 CA VAL A 234 121.658 66.823 5.868 1.00 19.84 C ATOM 2176 C VAL A 234 120.563 65.783 5.649 1.00 18.11 C ATOM 2177 O VAL A 234 120.817 64.699 5.113 1.00 17.71 O ATOM 2178 CB VAL A 234 122.493 67.028 4.596 1.00 20.86 C ATOM 2179 CG1 VAL A 234 121.610 67.498 3.457 1.00 22.93 C ATOM 2180 CG2 VAL A 234 123.635 68.009 4.859 1.00 27.31 C ATOM 2181 H VAL A 234 123.198 65.648 6.820 1.00 0.00 H ATOM 2182 N LEU A 235 119.332 66.119 6.047 1.00 14.59 N ATOM 2183 CA LEU A 235 118.245 65.142 6.013 1.00 15.15 C ATOM 2184 C LEU A 235 118.039 64.556 4.619 1.00 12.85 C ATOM 2185 O LEU A 235 117.856 63.342 4.472 1.00 13.46 O ATOM 2186 CB LEU A 235 116.953 65.785 6.524 1.00 14.09 C ATOM 2187 CG LEU A 235 115.681 64.947 6.369 1.00 14.84 C ATOM 2188 CD1 LEU A 235 115.839 63.561 7.004 1.00 17.83 C ATOM 2189 CD2 LEU A 235 114.503 65.671 6.991 1.00 17.62 C ATOM 2190 H LEU A 235 119.146 67.085 6.384 1.00 0.00 H ATOM 2191 N LEU A 236 118.046 65.398 3.583 1.00 14.87 N ATOM 2192 CA LEU A 236 117.748 64.910 2.241 1.00 14.75 C ATOM 2193 C LEU A 236 118.790 63.931 1.714 1.00 15.98 C ATOM 2194 O LEU A 236 118.503 63.221 0.746 1.00 17.55 O ATOM 2195 CB LEU A 236 117.588 66.091 1.280 1.00 15.77 C ATOM 2196 CG LEU A 236 116.268 66.834 1.519 1.00 15.40 C ATOM 2197 CD1 LEU A 236 116.150 68.073 0.643 1.00 18.27 C ATOM 2198 CD2 LEU A 236 115.087 65.893 1.303 1.00 17.18 C ATOM 2199 H LEU A 236 118.264 66.404 3.733 1.00 0.00 H ATOM 2200 N ASN A 237 119.962 63.838 2.343 1.00 14.37 N ATOM 2201 CA ASN A 237 120.983 62.882 1.928 1.00 17.10 C ATOM 2202 C ASN A 237 120.998 61.627 2.792 1.00 16.85 C ATOM 2203 O ASN A 237 121.920 60.812 2.674 1.00 16.43 O ATOM 2204 CB ASN A 237 122.362 63.548 1.943 1.00 19.08 C ATOM 2205 CG ASN A 237 122.489 64.641 0.902 1.00 19.36 C ATOM 2206 OD1 ASN A 237 121.736 64.672 -0.070 1.00 23.29 O ATOM 2207 ND2 ASN A 237 123.438 65.549 1.103 1.00 21.46 N ATOM 2208 HD22 ASN A 237 124.052 65.483 1.940 1.00 0.00 H ATOM 2209 HD21 ASN A 237 123.567 66.326 0.424 1.00 0.00 H ATOM 2210 H ASN A 237 120.154 64.464 3.151 1.00 0.00 H ATOM 2211 N ASP A 238 120.002 61.454 3.653 1.00 14.74 N ATOM 2212 CA ASP A 238 119.988 60.317 4.555 1.00 13.39 C ATOM 2213 C ASP A 238 119.916 59.019 3.750 1.00 14.20 C ATOM 2214 O ASP A 238 119.074 58.900 2.852 1.00 13.29 O ATOM 2215 CB ASP A 238 118.795 60.442 5.501 1.00 14.60 C ATOM 2216 CG ASP A 238 118.725 59.324 6.492 1.00 14.49 C ATOM 2217 OD1 ASP A 238 118.285 58.226 6.101 1.00 14.40 O ATOM 2218 OD2 ASP A 238 119.086 59.549 7.668 1.00 17.39 O ATOM 2219 H ASP A 238 119.222 62.142 3.681 1.00 0.00 H ATOM 2220 N PRO A 239 120.774 58.028 4.033 1.00 14.47 N ATOM 2221 CA PRO A 239 120.775 56.812 3.201 1.00 16.64 C ATOM 2222 C PRO A 239 119.512 55.978 3.324 1.00 13.68 C ATOM 2223 O PRO A 239 119.105 55.357 2.335 1.00 13.79 O ATOM 2224 CB PRO A 239 122.010 56.045 3.696 1.00 16.15 C ATOM 2225 CG PRO A 239 122.273 56.577 5.052 1.00 17.58 C ATOM 2226 CD PRO A 239 121.811 57.999 5.077 1.00 13.66 C ATOM 2227 N VAL A 240 118.872 55.940 4.496 1.00 12.83 N ATOM 2228 CA VAL A 240 117.636 55.173 4.624 1.00 13.14 C ATOM 2229 C VAL A 240 116.501 55.870 3.884 1.00 12.21 C ATOM 2230 O VAL A 240 115.713 55.231 3.176 1.00 12.82 O ATOM 2231 CB VAL A 240 117.297 54.954 6.108 1.00 14.65 C ATOM 2232 CG1 VAL A 240 115.931 54.314 6.236 1.00 15.85 C ATOM 2233 CG2 VAL A 240 118.364 54.096 6.767 1.00 18.40 C ATOM 2234 H VAL A 240 119.253 56.455 5.315 1.00 0.00 H ATOM 2235 N LEU A 241 116.392 57.188 4.047 1.00 11.81 N ATOM 2236 CA LEU A 241 115.437 57.967 3.269 1.00 10.88 C ATOM 2237 C LEU A 241 115.620 57.733 1.772 1.00 12.48 C ATOM 2238 O LEU A 241 114.649 57.530 1.033 1.00 11.10 O ATOM 2239 CB LEU A 241 115.600 59.451 3.597 1.00 10.71 C ATOM 2240 CG LEU A 241 114.737 60.390 2.757 1.00 10.51 C ATOM 2241 CD1 LEU A 241 113.272 60.064 2.964 1.00 13.30 C ATOM 2242 CD2 LEU A 241 115.021 61.835 3.115 1.00 11.88 C ATOM 2243 H LEU A 241 116.999 57.669 4.741 1.00 0.00 H ATOM 2244 N CYS A 242 116.864 57.734 1.303 1.00 11.77 N ATOM 2245 CA CYS A 242 117.058 57.598 -0.130 1.00 13.70 C ATOM 2246 C CYS A 242 116.735 56.185 -0.607 1.00 13.42 C ATOM 2247 O CYS A 242 116.253 56.019 -1.733 1.00 13.57 O ATOM 2248 CB CYS A 242 118.472 58.050 -0.484 1.00 16.98 C ATOM 2249 SG CYS A 242 118.648 59.869 -0.235 1.00 19.70 S ATOM 2250 H CYS A 242 117.677 57.830 1.945 1.00 0.00 H ATOM 2251 N ASP A 243 116.909 55.174 0.251 1.00 14.65 N ATOM 2252 CA ASP A 243 116.476 53.824 -0.103 1.00 14.27 C ATOM 2253 C ASP A 243 114.953 53.733 -0.200 1.00 13.60 C ATOM 2254 O ASP A 243 114.418 53.128 -1.139 1.00 14.81 O ATOM 2255 CB ASP A 243 117.012 52.820 0.916 1.00 17.28 C ATOM 2256 CG ASP A 243 116.656 51.393 0.564 1.00 28.46 C ATOM 2257 OD1 ASP A 243 116.948 50.975 -0.577 1.00 32.25 O ATOM 2258 OD2 ASP A 243 116.073 50.693 1.420 1.00 33.59 O ATOM 2259 H ASP A 243 117.354 55.349 1.174 1.00 0.00 H ATOM 2260 N VAL A 244 114.235 54.326 0.757 1.00 13.25 N ATOM 2261 CA VAL A 244 112.777 54.344 0.662 1.00 12.43 C ATOM 2262 C VAL A 244 112.346 55.083 -0.594 1.00 11.78 C ATOM 2263 O VAL A 244 111.403 54.678 -1.286 1.00 12.55 O ATOM 2264 CB VAL A 244 112.160 54.977 1.922 1.00 11.92 C ATOM 2265 CG1 VAL A 244 110.640 55.078 1.766 1.00 11.98 C ATOM 2266 CG2 VAL A 244 112.538 54.190 3.166 1.00 13.82 C ATOM 2267 H VAL A 244 114.711 54.773 1.566 1.00 0.00 H ATOM 2268 N ALA A 245 113.027 56.187 -0.902 1.00 11.21 N ATOM 2269 CA ALA A 245 112.728 56.941 -2.114 1.00 10.82 C ATOM 2270 C ALA A 245 112.880 56.072 -3.359 1.00 11.54 C ATOM 2271 O ALA A 245 111.982 56.023 -4.211 1.00 12.59 O ATOM 2272 CB ALA A 245 113.638 58.168 -2.173 1.00 11.23 C ATOM 2273 H ALA A 245 113.783 56.516 -0.268 1.00 0.00 H ATOM 2274 N LYS A 246 114.012 55.372 -3.478 1.00 13.19 N ATOM 2275 CA LYS A 246 114.227 54.517 -4.641 1.00 14.95 C ATOM 2276 C LYS A 246 113.172 53.420 -4.724 1.00 14.27 C ATOM 2277 O LYS A 246 112.649 53.140 -5.808 1.00 15.59 O ATOM 2278 CB LYS A 246 115.625 53.907 -4.591 1.00 15.46 C ATOM 2279 CG LYS A 246 116.756 54.905 -4.545 1.00 23.32 C ATOM 2280 CD LYS A 246 117.295 55.259 -5.913 1.00 32.81 C ATOM 2281 CE LYS A 246 118.711 55.814 -5.789 1.00 31.12 C ATOM 2282 NZ LYS A 246 118.875 56.667 -4.568 1.00 34.61 N ATOM 2283 HZ1 LYS A 246 118.214 57.469 -4.615 1.00 0.00 H ATOM 2284 HZ2 LYS A 246 118.673 56.099 -3.720 1.00 0.00 H ATOM 2285 HZ3 LYS A 246 119.851 57.023 -4.524 1.00 0.00 H ATOM 2286 H LYS A 246 114.742 55.437 -2.740 1.00 0.00 H ATOM 2287 N LYS A 247 112.836 52.806 -3.585 1.00 14.07 N ATOM 2288 CA LYS A 247 111.838 51.737 -3.563 1.00 14.71 C ATOM 2289 C LYS A 247 110.485 52.218 -4.084 1.00 14.55 C ATOM 2290 O LYS A 247 109.783 51.479 -4.788 1.00 18.90 O ATOM 2291 CB LYS A 247 111.717 51.189 -2.139 1.00 17.09 C ATOM 2292 CG LYS A 247 110.530 50.288 -1.876 1.00 22.66 C ATOM 2293 CD LYS A 247 110.592 49.782 -0.441 1.00 25.66 C ATOM 2294 CE LYS A 247 109.332 49.046 -0.033 1.00 26.58 C ATOM 2295 NZ LYS A 247 109.451 48.548 1.371 1.00 26.02 N ATOM 2296 HZ1 LYS A 247 110.261 47.899 1.440 1.00 0.00 H ATOM 2297 HZ2 LYS A 247 109.596 49.354 2.012 1.00 0.00 H ATOM 2298 HZ3 LYS A 247 108.579 48.046 1.635 1.00 0.00 H ATOM 2299 H LYS A 247 113.293 53.094 -2.697 1.00 0.00 H ATOM 2300 N ASN A 248 110.111 53.458 -3.767 1.00 13.64 N ATOM 2301 CA ASN A 248 108.826 54.023 -4.146 1.00 12.75 C ATOM 2302 C ASN A 248 108.881 54.819 -5.441 1.00 13.04 C ATOM 2303 O ASN A 248 107.854 55.364 -5.860 1.00 13.65 O ATOM 2304 CB ASN A 248 108.297 54.924 -3.021 1.00 12.17 C ATOM 2305 CG ASN A 248 107.795 54.133 -1.825 1.00 14.25 C ATOM 2306 OD1 ASN A 248 106.615 53.790 -1.755 1.00 16.73 O ATOM 2307 ND2 ASN A 248 108.685 53.844 -0.884 1.00 13.93 N ATOM 2308 HD22 ASN A 248 109.672 54.156 -0.988 1.00 0.00 H ATOM 2309 HD21 ASN A 248 108.396 53.306 -0.042 1.00 0.00 H ATOM 2310 H ASN A 248 110.770 54.050 -3.222 1.00 0.00 H ATOM 2311 N LYS A 249 110.051 54.906 -6.069 1.00 13.15 N ATOM 2312 CA LYS A 249 110.248 55.679 -7.297 1.00 13.66 C ATOM 2313 C LYS A 249 109.778 57.121 -7.128 1.00 11.32 C ATOM 2314 O LYS A 249 109.065 57.678 -7.966 1.00 14.44 O ATOM 2315 CB LYS A 249 109.558 55.011 -8.485 1.00 17.54 C ATOM 2316 CG LYS A 249 110.066 53.611 -8.751 1.00 20.66 C ATOM 2317 CD LYS A 249 109.541 53.085 -10.075 1.00 28.89 C ATOM 2318 CE LYS A 249 109.401 51.578 -10.033 1.00 36.46 C ATOM 2319 NZ LYS A 249 110.584 50.941 -9.398 1.00 38.19 N ATOM 2320 HZ1 LYS A 249 111.438 51.179 -9.942 1.00 0.00 H ATOM 2321 HZ2 LYS A 249 110.684 51.291 -8.424 1.00 0.00 H ATOM 2322 HZ3 LYS A 249 110.456 49.909 -9.385 1.00 0.00 H ATOM 2323 H LYS A 249 110.866 54.400 -5.668 1.00 0.00 H ATOM 2324 N ARG A 250 110.198 57.731 -6.022 1.00 11.55 N ATOM 2325 CA ARG A 250 109.939 59.135 -5.746 1.00 11.54 C ATOM 2326 C ARG A 250 111.212 59.770 -5.203 1.00 10.56 C ATOM 2327 O ARG A 250 112.133 59.081 -4.772 1.00 14.42 O ATOM 2328 CB ARG A 250 108.795 59.314 -4.736 1.00 13.01 C ATOM 2329 CG ARG A 250 107.452 58.744 -5.176 1.00 12.94 C ATOM 2330 CD ARG A 250 106.801 59.632 -6.210 1.00 14.37 C ATOM 2331 NE ARG A 250 105.613 58.991 -6.750 1.00 15.55 N ATOM 2332 CZ ARG A 250 104.584 59.634 -7.282 1.00 18.64 C ATOM 2333 NH1 ARG A 250 104.575 60.961 -7.340 1.00 23.21 N ATOM 2334 NH2 ARG A 250 103.554 58.934 -7.752 1.00 20.78 N ATOM 2335 HE ARG A 250 105.568 57.953 -6.716 1.00 0.00 H ATOM 2336 HH12 ARG A 250 103.763 61.458 -7.759 1.00 0.00 H ATOM 2337 HH11 ARG A 250 105.380 61.503 -6.966 1.00 0.00 H ATOM 2338 HH22 ARG A 250 102.740 59.426 -8.172 1.00 0.00 H ATOM 2339 HH21 ARG A 250 103.564 57.895 -7.699 1.00 0.00 H ATOM 2340 H ARG A 250 110.736 57.179 -5.324 1.00 0.00 H ATOM 2341 N SER A 251 111.257 61.094 -5.211 1.00 10.89 N ATOM 2342 CA SER A 251 112.438 61.758 -4.687 1.00 11.43 C ATOM 2343 C SER A 251 112.481 61.710 -3.161 1.00 11.92 C ATOM 2344 O SER A 251 111.449 61.571 -2.499 1.00 10.58 O ATOM 2345 CB SER A 251 112.470 63.208 -5.149 1.00 13.80 C ATOM 2346 OG SER A 251 111.449 63.954 -4.507 1.00 12.38 O ATOM 2347 HG SER A 251 111.483 64.893 -4.818 1.00 0.00 H ATOM 2348 H SER A 251 110.461 61.648 -5.586 1.00 0.00 H ATOM 2349 N PRO A 252 113.677 61.815 -2.575 1.00 10.56 N ATOM 2350 CA PRO A 252 113.767 61.938 -1.112 1.00 9.39 C ATOM 2351 C PRO A 252 112.881 63.039 -0.540 1.00 9.60 C ATOM 2352 O PRO A 252 112.232 62.825 0.492 1.00 10.17 O ATOM 2353 CB PRO A 252 115.258 62.227 -0.887 1.00 11.55 C ATOM 2354 CG PRO A 252 115.924 61.516 -2.034 1.00 13.54 C ATOM 2355 CD PRO A 252 115.002 61.694 -3.210 1.00 10.88 C ATOM 2356 N ALA A 253 112.814 64.204 -1.190 1.00 9.18 N ATOM 2357 CA ALA A 253 111.959 65.282 -0.695 1.00 9.79 C ATOM 2358 C ALA A 253 110.505 64.846 -0.639 1.00 9.57 C ATOM 2359 O ALA A 253 109.799 65.148 0.328 1.00 10.30 O ATOM 2360 CB ALA A 253 112.100 66.525 -1.584 1.00 10.61 C ATOM 2361 H ALA A 253 113.374 64.345 -2.055 1.00 0.00 H ATOM 2362 N LEU A 254 110.040 64.138 -1.670 1.00 10.45 N ATOM 2363 CA LEU A 254 108.646 63.708 -1.698 1.00 9.87 C ATOM 2364 C LEU A 254 108.366 62.648 -0.639 1.00 8.97 C ATOM 2365 O LEU A 254 107.288 62.655 -0.037 1.00 10.30 O ATOM 2366 CB LEU A 254 108.260 63.203 -3.088 1.00 10.18 C ATOM 2367 CG LEU A 254 107.690 64.285 -4.017 1.00 10.82 C ATOM 2368 CD1 LEU A 254 107.529 63.681 -5.406 1.00 18.86 C ATOM 2369 CD2 LEU A 254 106.339 64.808 -3.530 1.00 10.48 C ATOM 2370 H LEU A 254 110.674 63.892 -2.457 1.00 0.00 H ATOM 2371 N ILE A 255 109.322 61.756 -0.357 1.00 9.07 N ATOM 2372 CA ILE A 255 109.134 60.818 0.754 1.00 9.65 C ATOM 2373 C ILE A 255 109.015 61.571 2.077 1.00 10.14 C ATOM 2374 O ILE A 255 108.142 61.275 2.907 1.00 9.41 O ATOM 2375 CB ILE A 255 110.282 59.796 0.815 1.00 8.93 C ATOM 2376 CG1 ILE A 255 110.407 59.036 -0.506 1.00 10.76 C ATOM 2377 CG2 ILE A 255 110.081 58.852 2.008 1.00 10.30 C ATOM 2378 CD1 ILE A 255 109.166 58.248 -0.903 1.00 11.52 C ATOM 2379 H ILE A 255 110.194 61.728 -0.923 1.00 0.00 H ATOM 2380 N ALA A 256 109.908 62.539 2.303 1.00 10.23 N ATOM 2381 CA ALA A 256 109.901 63.296 3.551 1.00 9.03 C ATOM 2382 C ALA A 256 108.589 64.046 3.741 1.00 8.91 C ATOM 2383 O ALA A 256 108.072 64.124 4.869 1.00 9.80 O ATOM 2384 CB ALA A 256 111.089 64.258 3.567 1.00 10.73 C ATOM 2385 H ALA A 256 110.620 62.757 1.577 1.00 0.00 H ATOM 2386 N LEU A 257 108.029 64.598 2.652 1.00 9.07 N ATOM 2387 CA LEU A 257 106.757 65.299 2.761 1.00 9.97 C ATOM 2388 C LEU A 257 105.618 64.317 2.976 1.00 9.64 C ATOM 2389 O LEU A 257 104.724 64.570 3.791 1.00 10.08 O ATOM 2390 CB LEU A 257 106.492 66.154 1.517 1.00 9.91 C ATOM 2391 CG LEU A 257 107.389 67.368 1.287 1.00 11.16 C ATOM 2392 CD1 LEU A 257 107.015 68.017 -0.029 1.00 10.50 C ATOM 2393 CD2 LEU A 257 107.250 68.367 2.428 1.00 11.88 C ATOM 2394 H LEU A 257 108.504 64.525 1.730 1.00 0.00 H ATOM 2395 N ARG A 258 105.637 63.194 2.254 1.00 9.60 N ATOM 2396 CA ARG A 258 104.559 62.218 2.375 1.00 9.91 C ATOM 2397 C ARG A 258 104.505 61.628 3.778 1.00 8.92 C ATOM 2398 O ARG A 258 103.419 61.354 4.301 1.00 10.53 O ATOM 2399 CB ARG A 258 104.729 61.110 1.337 1.00 10.22 C ATOM 2400 CG ARG A 258 103.594 60.084 1.340 1.00 10.38 C ATOM 2401 CD ARG A 258 102.300 60.672 0.848 1.00 11.69 C ATOM 2402 NE ARG A 258 101.165 59.851 1.260 1.00 11.62 N ATOM 2403 CZ ARG A 258 99.915 60.084 0.881 1.00 13.88 C ATOM 2404 NH1 ARG A 258 99.645 61.093 0.073 1.00 14.73 N ATOM 2405 NH2 ARG A 258 98.930 59.297 1.314 1.00 18.33 N ATOM 2406 HE ARG A 258 101.346 59.039 1.885 1.00 0.00 H ATOM 2407 HH12 ARG A 258 98.665 61.274 -0.223 1.00 0.00 H ATOM 2408 HH11 ARG A 258 100.413 61.706 -0.267 1.00 0.00 H ATOM 2409 HH22 ARG A 258 97.950 59.479 1.017 1.00 0.00 H ATOM 2410 HH21 ARG A 258 99.141 58.501 1.949 1.00 0.00 H ATOM 2411 H ARG A 258 106.426 63.014 1.601 1.00 0.00 H ATOM 2412 N TYR A 259 105.670 61.389 4.383 1.00 9.33 N ATOM 2413 CA TYR A 259 105.731 60.934 5.770 1.00 9.17 C ATOM 2414 C TYR A 259 104.884 61.820 6.671 1.00 9.73 C ATOM 2415 O TYR A 259 104.096 61.330 7.486 1.00 11.11 O ATOM 2416 CB TYR A 259 107.192 60.934 6.243 1.00 10.66 C ATOM 2417 CG TYR A 259 107.383 60.568 7.709 1.00 8.98 C ATOM 2418 CD1 TYR A 259 107.268 59.250 8.140 1.00 11.31 C ATOM 2419 CD2 TYR A 259 107.690 61.543 8.649 1.00 11.53 C ATOM 2420 CE1 TYR A 259 107.444 58.923 9.483 1.00 11.29 C ATOM 2421 CE2 TYR A 259 107.880 61.224 9.977 1.00 12.55 C ATOM 2422 CZ TYR A 259 107.756 59.918 10.388 1.00 12.68 C ATOM 2423 OH TYR A 259 107.936 59.612 11.728 1.00 13.50 O ATOM 2424 HH TYR A 259 107.815 58.639 11.862 1.00 0.00 H ATOM 2425 H TYR A 259 106.555 61.530 3.855 1.00 0.00 H ATOM 2426 N LEU A 260 105.024 63.134 6.520 1.00 8.91 N ATOM 2427 CA LEU A 260 104.275 64.065 7.353 1.00 9.41 C ATOM 2428 C LEU A 260 102.785 64.025 7.018 1.00 11.47 C ATOM 2429 O LEU A 260 101.941 63.959 7.922 1.00 10.80 O ATOM 2430 CB LEU A 260 104.849 65.471 7.176 1.00 10.37 C ATOM 2431 CG LEU A 260 106.323 65.630 7.577 1.00 7.49 C ATOM 2432 CD1 LEU A 260 106.821 67.028 7.226 1.00 10.16 C ATOM 2433 CD2 LEU A 260 106.528 65.353 9.066 1.00 11.33 C ATOM 2434 H LEU A 260 105.676 63.501 5.798 1.00 0.00 H ATOM 2435 N ILE A 261 102.448 64.054 5.723 1.00 11.83 N ATOM 2436 CA ILE A 261 101.050 64.019 5.281 1.00 11.42 C ATOM 2437 C ILE A 261 100.331 62.803 5.848 1.00 12.92 C ATOM 2438 O ILE A 261 99.205 62.906 6.347 1.00 14.48 O ATOM 2439 CB ILE A 261 100.980 64.042 3.744 1.00 12.09 C ATOM 2440 CG1 ILE A 261 101.455 65.391 3.201 1.00 17.96 C ATOM 2441 CG2 ILE A 261 99.552 63.724 3.265 1.00 15.41 C ATOM 2442 CD1 ILE A 261 100.366 66.432 3.132 1.00 20.08 C ATOM 2443 H ILE A 261 103.201 64.103 5.008 1.00 0.00 H ATOM 2444 N GLN A 262 100.966 61.629 5.779 1.00 12.27 N ATOM 2445 CA GLN A 262 100.310 60.407 6.242 1.00 13.97 C ATOM 2446 C GLN A 262 100.106 60.365 7.751 1.00 15.80 C ATOM 2447 O GLN A 262 99.269 59.588 8.226 1.00 20.88 O ATOM 2448 CB GLN A 262 101.095 59.178 5.776 1.00 17.54 C ATOM 2449 CG GLN A 262 100.676 58.805 4.393 1.00 18.27 C ATOM 2450 CD GLN A 262 101.297 57.528 3.858 1.00 13.47 C ATOM 2451 OE1 GLN A 262 101.697 57.508 2.720 1.00 14.23 O ATOM 2452 NE2 GLN A 262 101.310 56.455 4.644 1.00 14.34 N ATOM 2453 HE22 GLN A 262 100.954 56.520 5.619 1.00 0.00 H ATOM 2454 HE21 GLN A 262 101.676 55.551 4.283 1.00 0.00 H ATOM 2455 H GLN A 262 101.931 61.584 5.394 1.00 0.00 H ATOM 2456 N ARG A 263 100.834 61.175 8.517 1.00 12.54 N ATOM 2457 CA ARG A 263 100.647 61.277 9.958 1.00 14.59 C ATOM 2458 C ARG A 263 99.661 62.368 10.343 1.00 14.87 C ATOM 2459 O ARG A 263 99.517 62.654 11.537 1.00 20.12 O ATOM 2460 CB ARG A 263 101.991 61.525 10.647 1.00 14.96 C ATOM 2461 CG ARG A 263 102.968 60.395 10.434 1.00 14.14 C ATOM 2462 CD ARG A 263 104.403 60.820 10.701 1.00 16.49 C ATOM 2463 NE ARG A 263 104.752 60.693 12.117 1.00 19.52 N ATOM 2464 CZ ARG A 263 105.336 61.642 12.847 1.00 16.56 C ATOM 2465 NH1 ARG A 263 105.666 62.805 12.314 1.00 15.72 N ATOM 2466 NH2 ARG A 263 105.611 61.405 14.121 1.00 16.61 N ATOM 2467 HE ARG A 263 104.527 59.794 12.589 1.00 0.00 H ATOM 2468 HH12 ARG A 263 106.121 63.535 12.899 1.00 0.00 H ATOM 2469 HH11 ARG A 263 105.470 62.991 11.310 1.00 0.00 H ATOM 2470 HH22 ARG A 263 106.067 62.139 14.700 1.00 0.00 H ATOM 2471 HH21 ARG A 263 105.371 60.485 14.542 1.00 0.00 H ATOM 2472 H ARG A 263 101.567 61.760 8.067 1.00 0.00 H ATOM 2473 N GLY A 264 98.992 62.976 9.369 1.00 13.54 N ATOM 2474 CA GLY A 264 98.004 64.005 9.629 1.00 15.12 C ATOM 2475 C GLY A 264 98.581 65.386 9.805 1.00 15.72 C ATOM 2476 O GLY A 264 97.863 66.304 10.225 1.00 15.07 O ATOM 2477 H GLY A 264 99.184 62.704 8.384 1.00 0.00 H ATOM 2478 N ILE A 265 99.835 65.558 9.498 1.00 12.82 N ATOM 2479 CA ILE A 265 100.525 66.831 9.618 1.00 11.11 C ATOM 2480 C ILE A 265 100.321 67.601 8.323 1.00 10.01 C ATOM 2481 O ILE A 265 100.299 67.005 7.236 1.00 12.55 O ATOM 2482 CB ILE A 265 102.016 66.586 9.926 1.00 8.40 C ATOM 2483 CG1 ILE A 265 102.144 65.912 11.298 1.00 11.75 C ATOM 2484 CG2 ILE A 265 102.817 67.875 9.859 1.00 12.15 C ATOM 2485 CD1 ILE A 265 103.545 65.432 11.618 1.00 12.97 C ATOM 2486 H ILE A 265 100.372 64.739 9.148 1.00 0.00 H ATOM 2487 N VAL A 266 100.146 68.918 8.430 1.00 10.13 N ATOM 2488 CA VAL A 266 100.049 69.795 7.267 1.00 11.79 C ATOM 2489 C VAL A 266 101.429 70.402 7.049 1.00 10.72 C ATOM 2490 O VAL A 266 101.825 71.309 7.799 1.00 12.12 O ATOM 2491 CB VAL A 266 98.978 70.877 7.461 1.00 10.61 C ATOM 2492 CG1 VAL A 266 99.030 71.879 6.313 1.00 12.18 C ATOM 2493 CG2 VAL A 266 97.608 70.229 7.550 1.00 12.44 C ATOM 2494 H VAL A 266 100.076 69.337 9.379 1.00 0.00 H ATOM 2495 N PRO A 267 102.199 69.940 6.068 1.00 8.83 N ATOM 2496 CA PRO A 267 103.526 70.518 5.853 1.00 10.99 C ATOM 2497 C PRO A 267 103.474 71.773 5.012 1.00 10.81 C ATOM 2498 O PRO A 267 102.627 71.933 4.127 1.00 11.66 O ATOM 2499 CB PRO A 267 104.294 69.414 5.113 1.00 14.91 C ATOM 2500 CG PRO A 267 103.269 68.377 4.713 1.00 14.66 C ATOM 2501 CD PRO A 267 101.911 68.853 5.121 1.00 11.00 C ATOM 2502 N LEU A 268 104.408 72.663 5.296 1.00 10.00 N ATOM 2503 CA LEU A 268 104.686 73.816 4.451 1.00 10.03 C ATOM 2504 C LEU A 268 105.877 73.448 3.582 1.00 14.64 C ATOM 2505 O LEU A 268 106.986 73.247 4.088 1.00 23.48 O ATOM 2506 CB LEU A 268 104.976 75.056 5.290 1.00 11.13 C ATOM 2507 CG LEU A 268 103.874 75.390 6.292 1.00 10.86 C ATOM 2508 CD1 LEU A 268 104.266 76.606 7.129 1.00 12.60 C ATOM 2509 CD2 LEU A 268 102.548 75.615 5.581 1.00 11.76 C ATOM 2510 H LEU A 268 104.970 72.535 6.162 1.00 0.00 H ATOM 2511 N ALA A 269 105.643 73.292 2.293 1.00 11.03 N ATOM 2512 CA ALA A 269 106.718 72.990 1.360 1.00 13.44 C ATOM 2513 C ALA A 269 107.158 74.286 0.708 1.00 13.53 C ATOM 2514 O ALA A 269 106.320 75.083 0.276 1.00 14.19 O ATOM 2515 CB ALA A 269 106.261 71.985 0.302 1.00 17.51 C ATOM 2516 H ALA A 269 104.671 73.387 1.937 1.00 0.00 H ATOM 2517 N GLN A 270 108.462 74.519 0.643 1.00 13.16 N ATOM 2518 CA GLN A 270 108.865 75.693 -0.115 1.00 15.32 C ATOM 2519 C GLN A 270 110.142 75.456 -0.900 1.00 13.02 C ATOM 2520 O GLN A 270 111.039 74.711 -0.490 1.00 12.99 O ATOM 2521 CB GLN A 270 109.004 76.946 0.765 1.00 18.68 C ATOM 2522 CG GLN A 270 110.132 76.979 1.767 1.00 18.56 C ATOM 2523 CD GLN A 270 110.168 78.333 2.477 1.00 13.78 C ATOM 2524 OE1 GLN A 270 109.613 78.492 3.569 1.00 17.00 O ATOM 2525 NE2 GLN A 270 110.771 79.323 1.826 1.00 17.44 N ATOM 2526 HE22 GLN A 270 111.225 79.141 0.908 1.00 0.00 H ATOM 2527 HE21 GLN A 270 110.788 80.279 2.234 1.00 0.00 H ATOM 2528 H GLN A 270 109.156 73.898 1.107 1.00 0.00 H ATOM 2529 N SER A 271 110.172 76.085 -2.063 1.00 14.33 N ATOM 2530 CA SER A 271 111.353 76.182 -2.887 1.00 12.26 C ATOM 2531 C SER A 271 111.223 77.473 -3.668 1.00 16.01 C ATOM 2532 O SER A 271 110.118 77.985 -3.870 1.00 16.40 O ATOM 2533 CB SER A 271 111.492 74.984 -3.836 1.00 13.14 C ATOM 2534 OG SER A 271 112.664 75.116 -4.620 1.00 13.22 O ATOM 2535 HG SER A 271 112.743 74.338 -5.227 1.00 0.00 H ATOM 2536 H SER A 271 109.297 76.534 -2.402 1.00 0.00 H ATOM 2537 N PHE A 272 112.360 78.007 -4.087 1.00 13.11 N ATOM 2538 CA PHE A 272 112.355 79.094 -5.050 1.00 14.54 C ATOM 2539 C PHE A 272 112.535 78.582 -6.469 1.00 17.90 C ATOM 2540 O PHE A 272 112.563 79.383 -7.410 1.00 19.83 O ATOM 2541 CB PHE A 272 113.434 80.125 -4.685 1.00 16.45 C ATOM 2542 CG PHE A 272 113.237 80.745 -3.315 1.00 16.24 C ATOM 2543 CD1 PHE A 272 112.220 81.667 -3.098 1.00 19.42 C ATOM 2544 CD2 PHE A 272 114.047 80.390 -2.245 1.00 17.50 C ATOM 2545 CE1 PHE A 272 112.014 82.223 -1.842 1.00 20.44 C ATOM 2546 CE2 PHE A 272 113.843 80.948 -0.978 1.00 20.55 C ATOM 2547 CZ PHE A 272 112.822 81.862 -0.783 1.00 18.21 C ATOM 2548 H PHE A 272 113.264 77.645 -3.723 1.00 0.00 H ATOM 2549 N LYS A 273 112.629 77.263 -6.642 1.00 14.74 N ATOM 2550 CA LYS A 273 112.790 76.639 -7.953 1.00 13.89 C ATOM 2551 C LYS A 273 111.454 76.067 -8.416 1.00 14.56 C ATOM 2552 O LYS A 273 110.866 75.215 -7.738 1.00 14.22 O ATOM 2553 CB LYS A 273 113.855 75.540 -7.910 1.00 13.81 C ATOM 2554 CG LYS A 273 115.235 76.009 -7.433 1.00 17.88 C ATOM 2555 CD LYS A 273 116.254 74.873 -7.430 1.00 22.97 C ATOM 2556 CE LYS A 273 117.646 75.385 -7.076 1.00 25.87 C ATOM 2557 NZ LYS A 273 117.731 75.808 -5.652 1.00 31.31 N ATOM 2558 HZ1 LYS A 273 117.047 76.571 -5.477 1.00 0.00 H ATOM 2559 HZ2 LYS A 273 117.513 74.998 -5.037 1.00 0.00 H ATOM 2560 HZ3 LYS A 273 118.692 76.150 -5.450 1.00 0.00 H ATOM 2561 H LYS A 273 112.586 76.649 -5.803 1.00 0.00 H ATOM 2562 N GLU A 274 111.007 76.498 -9.598 1.00 13.04 N ATOM 2563 CA GLU A 274 109.691 76.118 -10.098 1.00 10.24 C ATOM 2564 C GLU A 274 109.531 74.606 -10.204 1.00 11.74 C ATOM 2565 O GLU A 274 108.440 74.076 -9.951 1.00 12.43 O ATOM 2566 CB GLU A 274 109.453 76.778 -11.463 1.00 14.21 C ATOM 2567 CG GLU A 274 108.070 76.560 -12.056 1.00 14.10 C ATOM 2568 CD GLU A 274 107.992 75.368 -12.985 1.00 13.12 C ATOM 2569 OE1 GLU A 274 109.012 74.667 -13.180 1.00 16.36 O ATOM 2570 OE2 GLU A 274 106.887 75.119 -13.520 1.00 15.67 O ATOM 2571 H GLU A 274 111.611 77.118 -10.175 1.00 0.00 H ATOM 2572 N ASN A 275 110.587 73.896 -10.615 1.00 11.93 N ATOM 2573 CA ASN A 275 110.447 72.454 -10.776 1.00 11.04 C ATOM 2574 C ASN A 275 110.203 71.778 -9.439 1.00 11.46 C ATOM 2575 O ASN A 275 109.406 70.832 -9.357 1.00 12.03 O ATOM 2576 CB ASN A 275 111.677 71.857 -11.472 1.00 10.82 C ATOM 2577 CG ASN A 275 112.965 72.153 -10.741 1.00 13.24 C ATOM 2578 OD1 ASN A 275 113.272 73.311 -10.457 1.00 14.37 O ATOM 2579 ND2 ASN A 275 113.727 71.109 -10.423 1.00 14.06 N ATOM 2580 HD22 ASN A 275 113.427 70.148 -10.684 1.00 0.00 H ATOM 2581 HD21 ASN A 275 114.622 71.254 -9.914 1.00 0.00 H ATOM 2582 H ASN A 275 111.493 74.365 -10.816 1.00 0.00 H ATOM 2583 N GLU A 276 110.848 72.271 -8.379 1.00 10.43 N ATOM 2584 CA GLU A 276 110.652 71.676 -7.057 1.00 11.51 C ATOM 2585 C GLU A 276 109.266 71.994 -6.503 1.00 11.08 C ATOM 2586 O GLU A 276 108.633 71.122 -5.897 1.00 11.27 O ATOM 2587 CB GLU A 276 111.761 72.134 -6.109 1.00 11.63 C ATOM 2588 CG GLU A 276 113.120 71.579 -6.525 1.00 13.46 C ATOM 2589 CD GLU A 276 114.284 72.095 -5.706 1.00 16.72 C ATOM 2590 OE1 GLU A 276 114.093 72.976 -4.838 1.00 14.57 O ATOM 2591 OE2 GLU A 276 115.406 71.607 -5.946 1.00 20.30 O ATOM 2592 H GLU A 276 111.491 73.080 -8.493 1.00 0.00 H ATOM 2593 N MET A 277 108.767 73.223 -6.717 1.00 11.05 N ATOM 2594 CA MET A 277 107.381 73.547 -6.365 1.00 10.97 C ATOM 2595 C MET A 277 106.402 72.553 -6.964 1.00 12.58 C ATOM 2596 O MET A 277 105.475 72.080 -6.295 1.00 11.57 O ATOM 2597 CB MET A 277 107.000 74.945 -6.860 1.00 15.36 C ATOM 2598 CG MET A 277 107.887 76.056 -6.467 1.00 15.60 C ATOM 2599 SD MET A 277 107.127 77.542 -7.149 1.00 17.07 S ATOM 2600 CE MET A 277 108.534 78.615 -7.002 1.00 20.66 C ATOM 2601 H MET A 277 109.373 73.956 -7.139 1.00 0.00 H ATOM 2602 N ARG A 278 106.556 72.266 -8.254 1.00 11.01 N ATOM 2603 CA ARG A 278 105.616 71.367 -8.901 1.00 11.01 C ATOM 2604 C ARG A 278 105.815 69.937 -8.426 1.00 10.81 C ATOM 2605 O ARG A 278 104.843 69.198 -8.253 1.00 11.75 O ATOM 2606 CB ARG A 278 105.760 71.465 -10.419 1.00 11.49 C ATOM 2607 CG ARG A 278 105.407 72.837 -10.966 1.00 12.60 C ATOM 2608 CD ARG A 278 105.056 72.747 -12.454 1.00 12.09 C ATOM 2609 NE ARG A 278 103.883 71.907 -12.663 1.00 12.53 N ATOM 2610 CZ ARG A 278 103.564 71.317 -13.815 1.00 12.78 C ATOM 2611 NH1 ARG A 278 104.337 71.474 -14.895 1.00 12.34 N ATOM 2612 NH2 ARG A 278 102.477 70.567 -13.889 1.00 14.92 N ATOM 2613 HE ARG A 278 103.248 71.757 -11.853 1.00 0.00 H ATOM 2614 HH12 ARG A 278 104.081 71.010 -15.790 1.00 0.00 H ATOM 2615 HH11 ARG A 278 105.194 72.060 -14.840 1.00 0.00 H ATOM 2616 HH22 ARG A 278 102.224 70.105 -14.786 1.00 0.00 H ATOM 2617 HH21 ARG A 278 101.875 70.440 -13.051 1.00 0.00 H ATOM 2618 H ARG A 278 107.342 72.681 -8.794 1.00 0.00 H ATOM 2619 N GLU A 279 107.068 69.523 -8.207 1.00 9.68 N ATOM 2620 CA GLU A 279 107.293 68.183 -7.685 1.00 10.49 C ATOM 2621 C GLU A 279 106.608 67.998 -6.341 1.00 10.61 C ATOM 2622 O GLU A 279 105.986 66.957 -6.093 1.00 9.33 O ATOM 2623 CB GLU A 279 108.787 67.885 -7.565 1.00 12.13 C ATOM 2624 CG GLU A 279 108.977 66.410 -7.221 1.00 13.43 C ATOM 2625 CD GLU A 279 110.379 65.982 -6.820 1.00 19.58 C ATOM 2626 OE1 GLU A 279 111.190 66.792 -6.326 1.00 18.60 O ATOM 2627 OE2 GLU A 279 110.657 64.771 -6.965 1.00 25.81 O ATOM 2628 H GLU A 279 107.872 70.151 -8.407 1.00 0.00 H ATOM 2629 N ASN A 280 106.678 69.012 -5.474 1.00 10.14 N ATOM 2630 CA ASN A 280 106.137 68.854 -4.127 1.00 9.02 C ATOM 2631 C ASN A 280 104.630 68.660 -4.155 1.00 10.63 C ATOM 2632 O ASN A 280 104.085 67.960 -3.294 1.00 10.70 O ATOM 2633 CB ASN A 280 106.532 70.047 -3.258 1.00 10.04 C ATOM 2634 CG ASN A 280 108.022 70.109 -3.016 1.00 10.45 C ATOM 2635 OD1 ASN A 280 108.726 69.117 -3.209 1.00 10.60 O ATOM 2636 ND2 ASN A 280 108.515 71.267 -2.576 1.00 10.69 N ATOM 2637 HD22 ASN A 280 107.882 72.079 -2.427 1.00 0.00 H ATOM 2638 HD21 ASN A 280 109.533 71.359 -2.381 1.00 0.00 H ATOM 2639 H ASN A 280 107.117 69.911 -5.758 1.00 0.00 H ATOM 2640 N LEU A 281 103.949 69.206 -5.161 1.00 10.35 N ATOM 2641 CA LEU A 281 102.507 69.019 -5.281 1.00 11.37 C ATOM 2642 C LEU A 281 102.126 67.591 -5.632 1.00 12.58 C ATOM 2643 O LEU A 281 100.943 67.248 -5.525 1.00 14.43 O ATOM 2644 CB LEU A 281 101.925 69.956 -6.341 1.00 12.77 C ATOM 2645 CG LEU A 281 101.750 71.410 -5.921 1.00 13.27 C ATOM 2646 CD1 LEU A 281 101.420 72.267 -7.130 1.00 13.41 C ATOM 2647 CD2 LEU A 281 100.635 71.538 -4.898 1.00 12.42 C ATOM 2648 H LEU A 281 104.453 69.774 -5.872 1.00 0.00 H ATOM 2649 N GLN A 282 103.078 66.761 -6.062 1.00 11.02 N ATOM 2650 CA GLN A 282 102.778 65.373 -6.394 1.00 12.79 C ATOM 2651 C GLN A 282 102.676 64.485 -5.162 1.00 11.03 C ATOM 2652 O GLN A 282 102.505 63.269 -5.309 1.00 12.78 O ATOM 2653 CB GLN A 282 103.843 64.818 -7.344 1.00 13.03 C ATOM 2654 CG GLN A 282 103.997 65.636 -8.616 1.00 14.80 C ATOM 2655 CD GLN A 282 105.017 65.053 -9.583 1.00 18.93 C ATOM 2656 OE1 GLN A 282 106.065 64.560 -9.176 1.00 26.26 O ATOM 2657 NE2 GLN A 282 104.710 65.117 -10.869 1.00 21.06 N ATOM 2658 HE22 GLN A 282 103.810 65.544 -11.168 1.00 0.00 H ATOM 2659 HE21 GLN A 282 105.369 64.740 -11.580 1.00 0.00 H ATOM 2660 H GLN A 282 104.052 67.110 -6.162 1.00 0.00 H ATOM 2661 N VAL A 283 102.768 65.065 -3.961 1.00 11.14 N ATOM 2662 CA VAL A 283 102.794 64.275 -2.740 1.00 10.98 C ATOM 2663 C VAL A 283 101.497 63.503 -2.519 1.00 11.84 C ATOM 2664 O VAL A 283 101.489 62.533 -1.756 1.00 13.06 O ATOM 2665 CB VAL A 283 103.130 65.196 -1.541 1.00 9.71 C ATOM 2666 CG1 VAL A 283 101.957 66.101 -1.210 1.00 11.20 C ATOM 2667 CG2 VAL A 283 103.565 64.374 -0.342 1.00 11.38 C ATOM 2668 H VAL A 283 102.822 66.102 -3.898 1.00 0.00 H ATOM 2669 N PHE A 284 100.405 63.879 -3.185 1.00 12.61 N ATOM 2670 CA PHE A 284 99.166 63.123 -3.033 1.00 13.96 C ATOM 2671 C PHE A 284 99.037 61.995 -4.046 1.00 13.72 C ATOM 2672 O PHE A 284 98.050 61.252 -4.000 1.00 17.95 O ATOM 2673 CB PHE A 284 97.954 64.060 -3.122 1.00 17.19 C ATOM 2674 CG PHE A 284 97.986 65.165 -2.110 1.00 15.25 C ATOM 2675 CD1 PHE A 284 97.680 64.916 -0.781 1.00 16.19 C ATOM 2676 CD2 PHE A 284 98.357 66.442 -2.483 1.00 13.77 C ATOM 2677 CE1 PHE A 284 97.728 65.941 0.166 1.00 16.20 C ATOM 2678 CE2 PHE A 284 98.408 67.469 -1.543 1.00 14.94 C ATOM 2679 CZ PHE A 284 98.095 67.215 -0.224 1.00 15.59 C ATOM 2680 H PHE A 284 100.436 64.709 -3.811 1.00 0.00 H ATOM 2681 N GLY A 285 100.024 61.822 -4.922 1.00 13.22 N ATOM 2682 CA GLY A 285 99.957 60.805 -5.948 1.00 14.32 C ATOM 2683 C GLY A 285 100.500 59.441 -5.588 1.00 13.52 C ATOM 2684 O GLY A 285 100.522 58.546 -6.439 1.00 14.77 O ATOM 2685 H GLY A 285 100.864 62.433 -4.867 1.00 0.00 H ATOM 2686 N PHE A 286 100.956 59.246 -4.353 1.00 12.05 N ATOM 2687 CA PHE A 286 101.466 57.959 -3.915 1.00 12.33 C ATOM 2688 C PHE A 286 101.258 57.877 -2.415 1.00 11.18 C ATOM 2689 O PHE A 286 100.965 58.876 -1.756 1.00 11.32 O ATOM 2690 CB PHE A 286 102.947 57.774 -4.289 1.00 11.61 C ATOM 2691 CG PHE A 286 103.905 58.591 -3.449 1.00 11.08 C ATOM 2692 CD1 PHE A 286 104.061 59.949 -3.669 1.00 13.83 C ATOM 2693 CD2 PHE A 286 104.657 57.990 -2.448 1.00 10.47 C ATOM 2694 CE1 PHE A 286 104.946 60.698 -2.902 1.00 13.30 C ATOM 2695 CE2 PHE A 286 105.547 58.736 -1.675 1.00 12.28 C ATOM 2696 CZ PHE A 286 105.685 60.095 -1.905 1.00 11.00 C ATOM 2697 H PHE A 286 100.947 60.040 -3.681 1.00 0.00 H ATOM 2698 N GLN A 287 101.398 56.675 -1.875 1.00 11.90 N ATOM 2699 CA GLN A 287 101.390 56.538 -0.430 1.00 12.68 C ATOM 2700 C GLN A 287 102.443 55.528 -0.012 1.00 12.88 C ATOM 2701 O GLN A 287 102.892 54.689 -0.799 1.00 15.32 O ATOM 2702 CB GLN A 287 100.009 56.151 0.106 1.00 17.59 C ATOM 2703 CG GLN A 287 99.581 54.731 -0.158 1.00 20.11 C ATOM 2704 CD GLN A 287 98.180 54.478 0.364 1.00 24.34 C ATOM 2705 OE1 GLN A 287 97.402 55.417 0.544 1.00 27.82 O ATOM 2706 NE2 GLN A 287 97.855 53.213 0.625 1.00 25.94 N ATOM 2707 HE22 GLN A 287 98.545 52.453 0.457 1.00 0.00 H ATOM 2708 HE21 GLN A 287 96.911 52.985 0.997 1.00 0.00 H ATOM 2709 H GLN A 287 101.513 55.838 -2.481 1.00 0.00 H ATOM 2710 N LEU A 288 102.845 55.649 1.243 1.00 12.35 N ATOM 2711 CA LEU A 288 103.872 54.813 1.837 1.00 11.51 C ATOM 2712 C LEU A 288 103.229 53.653 2.583 1.00 12.25 C ATOM 2713 O LEU A 288 102.250 53.835 3.318 1.00 14.64 O ATOM 2714 CB LEU A 288 104.749 55.633 2.790 1.00 12.22 C ATOM 2715 CG LEU A 288 105.575 56.732 2.113 1.00 10.37 C ATOM 2716 CD1 LEU A 288 106.051 57.766 3.112 1.00 12.77 C ATOM 2717 CD2 LEU A 288 106.755 56.119 1.370 1.00 15.07 C ATOM 2718 H LEU A 288 102.402 56.381 1.834 1.00 0.00 H ATOM 2719 N SER A 289 103.803 52.461 2.395 1.00 11.96 N ATOM 2720 CA SER A 289 103.354 51.263 3.092 1.00 11.96 C ATOM 2721 C SER A 289 103.571 51.403 4.597 1.00 12.19 C ATOM 2722 O SER A 289 104.393 52.205 5.042 1.00 13.04 O ATOM 2723 CB SER A 289 104.123 50.051 2.591 1.00 13.25 C ATOM 2724 OG SER A 289 105.483 50.158 2.968 1.00 13.16 O ATOM 2725 HG SER A 289 105.979 49.367 2.639 1.00 0.00 H ATOM 2726 H SER A 289 104.598 52.386 1.728 1.00 0.00 H ATOM 2727 N PRO A 290 102.844 50.627 5.409 1.00 13.32 N ATOM 2728 CA PRO A 290 103.125 50.656 6.851 1.00 13.46 C ATOM 2729 C PRO A 290 104.572 50.330 7.179 1.00 13.05 C ATOM 2730 O PRO A 290 105.155 50.946 8.080 1.00 12.47 O ATOM 2731 CB PRO A 290 102.147 49.611 7.413 1.00 14.63 C ATOM 2732 CG PRO A 290 101.007 49.633 6.457 1.00 15.45 C ATOM 2733 CD PRO A 290 101.627 49.857 5.096 1.00 16.16 C ATOM 2734 N GLU A 291 105.179 49.396 6.444 1.00 13.31 N ATOM 2735 CA GLU A 291 106.578 49.053 6.684 1.00 14.24 C ATOM 2736 C GLU A 291 107.489 50.245 6.421 1.00 12.04 C ATOM 2737 O GLU A 291 108.411 50.516 7.199 1.00 12.84 O ATOM 2738 CB GLU A 291 106.977 47.865 5.808 1.00 18.47 C ATOM 2739 CG GLU A 291 108.441 47.484 5.911 1.00 22.49 C ATOM 2740 CD GLU A 291 108.833 46.357 4.963 1.00 29.51 C ATOM 2741 OE1 GLU A 291 108.417 46.388 3.784 1.00 31.15 O ATOM 2742 OE2 GLU A 291 109.561 45.439 5.400 1.00 38.68 O ATOM 2743 H GLU A 291 104.651 48.908 5.693 1.00 0.00 H ATOM 2744 N ASP A 292 107.231 50.986 5.345 1.00 12.42 N ATOM 2745 CA ASP A 292 108.083 52.132 5.051 1.00 12.17 C ATOM 2746 C ASP A 292 107.867 53.252 6.061 1.00 11.03 C ATOM 2747 O ASP A 292 108.822 53.939 6.438 1.00 11.54 O ATOM 2748 CB ASP A 292 107.842 52.622 3.622 1.00 13.69 C ATOM 2749 CG ASP A 292 108.499 51.726 2.577 1.00 14.17 C ATOM 2750 OD1 ASP A 292 109.309 50.855 2.957 1.00 18.06 O ATOM 2751 OD2 ASP A 292 108.200 51.895 1.375 1.00 15.32 O ATOM 2752 H ASP A 292 106.432 50.750 4.722 1.00 0.00 H ATOM 2753 N MET A 293 106.627 53.437 6.534 1.00 12.02 N ATOM 2754 CA MET A 293 106.399 54.423 7.587 1.00 11.34 C ATOM 2755 C MET A 293 107.152 54.057 8.856 1.00 12.46 C ATOM 2756 O MET A 293 107.736 54.929 9.506 1.00 12.49 O ATOM 2757 CB MET A 293 104.907 54.562 7.874 1.00 11.07 C ATOM 2758 CG MET A 293 104.119 55.240 6.757 1.00 12.83 C ATOM 2759 SD MET A 293 104.572 56.982 6.514 1.00 12.33 S ATOM 2760 CE MET A 293 103.910 57.724 8.014 1.00 11.37 C ATOM 2761 H MET A 293 105.833 52.883 6.154 1.00 0.00 H ATOM 2762 N LYS A 294 107.148 52.770 9.229 1.00 12.46 N ATOM 2763 CA LYS A 294 107.911 52.347 10.402 1.00 12.53 C ATOM 2764 C LYS A 294 109.409 52.554 10.198 1.00 11.70 C ATOM 2765 O LYS A 294 110.117 52.979 11.119 1.00 14.39 O ATOM 2766 CB LYS A 294 107.619 50.880 10.726 1.00 13.76 C ATOM 2767 CG LYS A 294 106.249 50.630 11.333 1.00 15.85 C ATOM 2768 CD LYS A 294 106.172 51.133 12.759 1.00 17.73 C ATOM 2769 CE LYS A 294 104.793 50.849 13.363 1.00 20.48 C ATOM 2770 NZ LYS A 294 104.404 49.404 13.235 1.00 23.71 N ATOM 2771 HZ1 LYS A 294 104.377 49.141 12.229 1.00 0.00 H ATOM 2772 HZ2 LYS A 294 105.102 48.813 13.730 1.00 0.00 H ATOM 2773 HZ3 LYS A 294 103.465 49.260 13.657 1.00 0.00 H ATOM 2774 H LYS A 294 106.602 52.072 8.684 1.00 0.00 H ATOM 2775 N THR A 295 109.908 52.266 8.996 1.00 12.26 N ATOM 2776 CA THR A 295 111.311 52.534 8.698 1.00 12.02 C ATOM 2777 C THR A 295 111.638 54.015 8.869 1.00 11.97 C ATOM 2778 O THR A 295 112.661 54.369 9.468 1.00 12.89 O ATOM 2779 CB THR A 295 111.631 52.060 7.278 1.00 12.70 C ATOM 2780 OG1 THR A 295 111.580 50.624 7.242 1.00 15.75 O ATOM 2781 CG2 THR A 295 113.018 52.518 6.847 1.00 15.08 C ATOM 2782 HG1 THR A 295 112.245 50.255 7.876 1.00 0.00 H ATOM 2783 H THR A 295 109.295 51.848 8.267 1.00 0.00 H ATOM 2784 N LEU A 296 110.767 54.892 8.372 1.00 11.20 N ATOM 2785 CA LEU A 296 111.010 56.325 8.494 1.00 11.52 C ATOM 2786 C LEU A 296 110.875 56.823 9.938 1.00 12.29 C ATOM 2787 O LEU A 296 111.604 57.740 10.332 1.00 11.57 O ATOM 2788 CB LEU A 296 110.065 57.080 7.564 1.00 10.51 C ATOM 2789 CG LEU A 296 110.297 56.810 6.077 1.00 9.26 C ATOM 2790 CD1 LEU A 296 109.168 57.363 5.219 1.00 10.79 C ATOM 2791 CD2 LEU A 296 111.645 57.340 5.605 1.00 12.01 C ATOM 2792 H LEU A 296 109.908 54.553 7.894 1.00 0.00 H ATOM 2793 N ASP A 297 109.972 56.232 10.739 1.00 11.79 N ATOM 2794 CA ASP A 297 109.911 56.564 12.164 1.00 12.30 C ATOM 2795 C ASP A 297 111.264 56.386 12.834 1.00 13.02 C ATOM 2796 O ASP A 297 111.592 57.106 13.785 1.00 14.99 O ATOM 2797 CB ASP A 297 108.905 55.681 12.912 1.00 14.21 C ATOM 2798 CG ASP A 297 107.459 55.957 12.551 1.00 16.32 C ATOM 2799 OD1 ASP A 297 107.109 57.096 12.178 1.00 16.95 O ATOM 2800 OD2 ASP A 297 106.644 55.017 12.668 1.00 19.40 O ATOM 2801 H ASP A 297 109.311 55.533 10.344 1.00 0.00 H ATOM 2802 N GLY A 298 112.043 55.404 12.379 1.00 12.55 N ATOM 2803 CA GLY A 298 113.315 55.085 12.997 1.00 16.57 C ATOM 2804 C GLY A 298 114.416 56.084 12.731 1.00 15.43 C ATOM 2805 O GLY A 298 115.498 55.952 13.311 1.00 17.32 O ATOM 2806 H GLY A 298 111.729 54.851 11.556 1.00 0.00 H ATOM 2807 N LEU A 299 114.177 57.073 11.870 1.00 14.36 N ATOM 2808 CA LEU A 299 115.196 58.075 11.596 1.00 13.77 C ATOM 2809 C LEU A 299 115.225 59.198 12.620 1.00 12.56 C ATOM 2810 O LEU A 299 116.153 60.011 12.587 1.00 16.11 O ATOM 2811 CB LEU A 299 114.986 58.668 10.200 1.00 14.71 C ATOM 2812 CG LEU A 299 115.029 57.653 9.058 1.00 16.26 C ATOM 2813 CD1 LEU A 299 115.027 58.370 7.715 1.00 19.73 C ATOM 2814 CD2 LEU A 299 116.234 56.722 9.181 1.00 21.99 C ATOM 2815 H LEU A 299 113.256 57.129 11.391 1.00 0.00 H ATOM 2816 N ASN A 300 114.243 59.262 13.518 1.00 13.87 N ATOM 2817 CA ASN A 300 114.135 60.397 14.419 1.00 14.24 C ATOM 2818 C ASN A 300 115.406 60.576 15.238 1.00 16.16 C ATOM 2819 O ASN A 300 115.950 59.612 15.791 1.00 17.39 O ATOM 2820 CB ASN A 300 112.936 60.222 15.340 1.00 13.95 C ATOM 2821 CG ASN A 300 112.702 61.428 16.193 1.00 14.06 C ATOM 2822 OD1 ASN A 300 112.767 62.556 15.702 1.00 16.39 O ATOM 2823 ND2 ASN A 300 112.476 61.214 17.484 1.00 18.82 N ATOM 2824 HD22 ASN A 300 112.430 60.241 17.850 1.00 0.00 H ATOM 2825 HD21 ASN A 300 112.345 62.019 18.129 1.00 0.00 H ATOM 2826 H ASN A 300 113.547 58.492 13.575 1.00 0.00 H ATOM 2827 N LYS A 301 115.872 61.820 15.314 1.00 14.97 N ATOM 2828 CA LYS A 301 117.021 62.198 16.128 1.00 18.48 C ATOM 2829 C LYS A 301 116.654 63.193 17.220 1.00 20.81 C ATOM 2830 O LYS A 301 117.519 63.544 18.036 1.00 22.07 O ATOM 2831 CB LYS A 301 118.128 62.823 15.261 1.00 18.39 C ATOM 2832 CG LYS A 301 118.697 61.965 14.133 1.00 19.93 C ATOM 2833 CD LYS A 301 119.712 62.774 13.318 1.00 22.38 C ATOM 2834 CE LYS A 301 120.358 61.954 12.212 1.00 23.35 C ATOM 2835 NZ LYS A 301 121.168 60.806 12.726 1.00 29.40 N ATOM 2836 HZ1 LYS A 301 121.929 61.166 13.336 1.00 0.00 H ATOM 2837 HZ2 LYS A 301 120.555 60.169 13.274 1.00 0.00 H ATOM 2838 HZ3 LYS A 301 121.581 60.288 11.924 1.00 0.00 H ATOM 2839 H LYS A 301 115.392 62.561 14.764 1.00 0.00 H ATOM 2840 N ASN A 302 115.406 63.661 17.257 1.00 15.21 N ATOM 2841 CA ASN A 302 115.020 64.829 18.042 1.00 16.66 C ATOM 2842 C ASN A 302 116.027 65.964 17.848 1.00 19.01 C ATOM 2843 O ASN A 302 116.484 66.605 18.797 1.00 23.41 O ATOM 2844 CB ASN A 302 114.837 64.455 19.514 1.00 22.26 C ATOM 2845 CG ASN A 302 113.625 63.566 19.728 1.00 23.26 C ATOM 2846 OD1 ASN A 302 112.598 63.731 19.064 1.00 22.14 O ATOM 2847 ND2 ASN A 302 113.743 62.604 20.636 1.00 29.74 N ATOM 2848 HD22 ASN A 302 114.628 62.502 21.173 1.00 0.00 H ATOM 2849 HD21 ASN A 302 112.951 61.953 20.810 1.00 0.00 H ATOM 2850 H ASN A 302 114.675 63.172 16.702 1.00 0.00 H ATOM 2851 N PHE A 303 116.370 66.212 16.583 1.00 15.88 N ATOM 2852 CA PHE A 303 117.343 67.229 16.211 1.00 15.43 C ATOM 2853 C PHE A 303 116.619 68.465 15.701 1.00 14.34 C ATOM 2854 O PHE A 303 115.920 68.410 14.682 1.00 13.90 O ATOM 2855 CB PHE A 303 118.318 66.727 15.146 1.00 17.71 C ATOM 2856 CG PHE A 303 119.417 67.706 14.850 1.00 18.57 C ATOM 2857 CD1 PHE A 303 119.242 68.708 13.910 1.00 15.56 C ATOM 2858 CD2 PHE A 303 120.617 67.647 15.539 1.00 25.90 C ATOM 2859 CE1 PHE A 303 120.236 69.625 13.655 1.00 20.18 C ATOM 2860 CE2 PHE A 303 121.623 68.556 15.280 1.00 28.08 C ATOM 2861 CZ PHE A 303 121.432 69.546 14.337 1.00 27.00 C ATOM 2862 H PHE A 303 115.922 65.654 15.828 1.00 0.00 H ATOM 2863 N ARG A 304 116.850 69.584 16.369 1.00 14.34 N ATOM 2864 CA ARG A 304 116.188 70.845 16.086 1.00 12.20 C ATOM 2865 C ARG A 304 117.132 71.730 15.269 1.00 13.51 C ATOM 2866 O ARG A 304 118.141 72.219 15.788 1.00 16.01 O ATOM 2867 CB ARG A 304 115.811 71.502 17.415 1.00 16.80 C ATOM 2868 CG ARG A 304 114.606 72.362 17.394 1.00 18.71 C ATOM 2869 CD ARG A 304 114.295 72.861 18.807 1.00 13.21 C ATOM 2870 NE ARG A 304 113.554 71.906 19.633 1.00 13.40 N ATOM 2871 CZ ARG A 304 112.252 71.660 19.498 1.00 11.19 C ATOM 2872 NH1 ARG A 304 111.567 72.264 18.534 1.00 10.53 N ATOM 2873 NH2 ARG A 304 111.643 70.806 20.302 1.00 14.79 N ATOM 2874 HE ARG A 304 114.075 71.389 20.369 1.00 0.00 H ATOM 2875 HH12 ARG A 304 110.550 72.077 18.423 1.00 0.00 H ATOM 2876 HH11 ARG A 304 112.047 72.924 17.890 1.00 0.00 H ATOM 2877 HH22 ARG A 304 110.626 70.620 20.189 1.00 0.00 H ATOM 2878 HH21 ARG A 304 112.181 70.320 21.048 1.00 0.00 H ATOM 2879 H ARG A 304 117.546 69.559 17.141 1.00 0.00 H ATOM 2880 N TYR A 305 116.806 71.947 13.998 1.00 13.32 N ATOM 2881 CA TYR A 305 117.594 72.855 13.174 1.00 12.64 C ATOM 2882 C TYR A 305 117.335 74.312 13.512 1.00 13.19 C ATOM 2883 O TYR A 305 118.181 75.164 13.218 1.00 17.30 O ATOM 2884 CB TYR A 305 117.299 72.644 11.683 1.00 13.70 C ATOM 2885 CG TYR A 305 117.800 71.341 11.105 1.00 14.94 C ATOM 2886 CD1 TYR A 305 119.094 71.224 10.613 1.00 14.00 C ATOM 2887 CD2 TYR A 305 116.971 70.238 11.037 1.00 15.00 C ATOM 2888 CE1 TYR A 305 119.545 70.025 10.079 1.00 16.47 C ATOM 2889 CE2 TYR A 305 117.405 69.044 10.505 1.00 15.01 C ATOM 2890 CZ TYR A 305 118.690 68.941 10.028 1.00 15.71 C ATOM 2891 OH TYR A 305 119.104 67.735 9.500 1.00 18.14 O ATOM 2892 HH TYR A 305 120.044 67.813 9.200 1.00 0.00 H ATOM 2893 H TYR A 305 115.981 71.464 13.588 1.00 0.00 H ATOM 2894 N LEU A 306 116.179 74.622 14.097 1.00 12.16 N ATOM 2895 CA LEU A 306 115.731 76.001 14.292 1.00 12.41 C ATOM 2896 C LEU A 306 115.342 76.218 15.751 1.00 12.36 C ATOM 2897 O LEU A 306 114.156 76.326 16.087 1.00 12.88 O ATOM 2898 CB LEU A 306 114.571 76.318 13.346 1.00 11.97 C ATOM 2899 CG LEU A 306 114.951 76.182 11.865 1.00 14.75 C ATOM 2900 CD1 LEU A 306 113.741 76.297 10.940 1.00 14.93 C ATOM 2901 CD2 LEU A 306 116.007 77.227 11.503 1.00 18.10 C ATOM 2902 H LEU A 306 115.568 73.849 14.430 1.00 0.00 H ATOM 2903 N PRO A 307 116.329 76.297 16.650 1.00 12.32 N ATOM 2904 CA PRO A 307 116.033 76.371 18.086 1.00 12.29 C ATOM 2905 C PRO A 307 115.685 77.755 18.614 1.00 13.80 C ATOM 2906 O PRO A 307 115.457 77.883 19.821 1.00 13.61 O ATOM 2907 CB PRO A 307 117.341 75.871 18.718 1.00 12.96 C ATOM 2908 CG PRO A 307 118.385 76.327 17.761 1.00 15.12 C ATOM 2909 CD PRO A 307 117.774 76.154 16.390 1.00 16.17 C ATOM 2910 N ALA A 308 115.644 78.792 17.775 1.00 12.27 N ATOM 2911 CA ALA A 308 115.243 80.137 18.210 1.00 11.84 C ATOM 2912 C ALA A 308 116.047 80.600 19.423 1.00 13.66 C ATOM 2913 O ALA A 308 115.491 81.008 20.445 1.00 12.17 O ATOM 2914 CB ALA A 308 113.741 80.194 18.508 1.00 13.60 C ATOM 2915 H ALA A 308 115.905 78.643 16.779 1.00 0.00 H ATOM 2916 N GLU A 309 117.378 80.545 19.293 1.00 15.47 N ATOM 2917 CA GLU A 309 118.263 80.836 20.418 1.00 15.84 C ATOM 2918 C GLU A 309 118.090 82.261 20.926 1.00 13.96 C ATOM 2919 O GLU A 309 118.334 82.529 22.112 1.00 13.98 O ATOM 2920 CB GLU A 309 119.718 80.590 20.009 1.00 22.72 C ATOM 2921 CG GLU A 309 120.670 80.386 21.187 1.00 29.13 C ATOM 2922 CD GLU A 309 120.338 79.138 21.991 1.00 35.64 C ATOM 2923 OE1 GLU A 309 120.812 79.033 23.146 1.00 42.02 O ATOM 2924 OE2 GLU A 309 119.606 78.263 21.469 1.00 36.44 O ATOM 2925 H GLU A 309 117.790 80.290 18.373 1.00 0.00 H ATOM 2926 N PHE A 310 117.638 83.178 20.068 1.00 11.99 N ATOM 2927 CA PHE A 310 117.402 84.545 20.510 1.00 12.28 C ATOM 2928 C PHE A 310 116.330 84.637 21.592 1.00 14.26 C ATOM 2929 O PHE A 310 116.230 85.678 22.247 1.00 14.85 O ATOM 2930 CB PHE A 310 117.037 85.443 19.314 1.00 14.66 C ATOM 2931 CG PHE A 310 115.753 85.065 18.624 1.00 14.36 C ATOM 2932 CD1 PHE A 310 115.723 84.026 17.707 1.00 16.43 C ATOM 2933 CD2 PHE A 310 114.584 85.760 18.865 1.00 16.34 C ATOM 2934 CE1 PHE A 310 114.541 83.676 17.066 1.00 19.26 C ATOM 2935 CE2 PHE A 310 113.403 85.414 18.211 1.00 18.20 C ATOM 2936 CZ PHE A 310 113.388 84.372 17.323 1.00 18.26 C ATOM 2937 H PHE A 310 117.453 82.915 19.079 1.00 0.00 H ATOM 2938 N LEU A 311 115.555 83.580 21.830 1.00 10.38 N ATOM 2939 CA LEU A 311 114.542 83.590 22.879 1.00 11.97 C ATOM 2940 C LEU A 311 114.936 82.808 24.126 1.00 11.49 C ATOM 2941 O LEU A 311 114.119 82.700 25.048 1.00 11.14 O ATOM 2942 CB LEU A 311 113.230 83.013 22.351 1.00 11.57 C ATOM 2943 CG LEU A 311 112.615 83.720 21.148 1.00 11.77 C ATOM 2944 CD1 LEU A 311 111.384 82.930 20.703 1.00 13.15 C ATOM 2945 CD2 LEU A 311 112.245 85.164 21.479 1.00 12.80 C ATOM 2946 H LEU A 311 115.676 82.724 21.252 1.00 0.00 H ATOM 2947 N VAL A 312 116.161 82.272 24.191 1.00 10.87 N ATOM 2948 CA VAL A 312 116.479 81.262 25.198 1.00 11.95 C ATOM 2949 C VAL A 312 116.468 81.820 26.620 1.00 12.33 C ATOM 2950 O VAL A 312 116.241 81.056 27.565 1.00 13.13 O ATOM 2951 CB VAL A 312 117.834 80.597 24.859 1.00 14.01 C ATOM 2952 CG1 VAL A 312 118.993 81.553 25.117 1.00 16.19 C ATOM 2953 CG2 VAL A 312 118.021 79.314 25.638 1.00 16.29 C ATOM 2954 H VAL A 312 116.893 82.577 23.518 1.00 0.00 H ATOM 2955 N ASP A 313 116.668 83.126 26.810 1.00 12.00 N ATOM 2956 CA ASP A 313 116.720 83.663 28.170 1.00 13.07 C ATOM 2957 C ASP A 313 115.356 83.772 28.827 1.00 13.23 C ATOM 2958 O ASP A 313 115.289 83.996 30.039 1.00 16.22 O ATOM 2959 CB ASP A 313 117.361 85.052 28.186 1.00 15.50 C ATOM 2960 CG ASP A 313 118.824 85.031 27.802 1.00 19.44 C ATOM 2961 OD1 ASP A 313 119.457 83.960 27.915 1.00 22.33 O ATOM 2962 OD2 ASP A 313 119.335 86.096 27.391 1.00 22.01 O ATOM 2963 H ASP A 313 116.786 83.760 25.994 1.00 0.00 H ATOM 2964 N HIS A 314 114.291 83.661 28.076 1.00 10.47 N ATOM 2965 CA HIS A 314 112.965 83.897 28.633 1.00 10.01 C ATOM 2966 C HIS A 314 112.413 82.631 29.291 1.00 10.95 C ATOM 2967 O HIS A 314 112.626 81.528 28.788 1.00 10.62 O ATOM 2968 CB HIS A 314 112.024 84.353 27.525 1.00 11.95 C ATOM 2969 CG HIS A 314 110.736 84.923 28.021 1.00 10.56 C ATOM 2970 ND1 HIS A 314 109.652 84.140 28.353 1.00 10.72 N ATOM 2971 CD2 HIS A 314 110.362 86.204 28.252 1.00 11.59 C ATOM 2972 CE1 HIS A 314 108.663 84.913 28.765 1.00 12.52 C ATOM 2973 NE2 HIS A 314 109.070 86.170 28.718 1.00 12.74 N ATOM 2974 H HIS A 314 114.391 83.402 27.074 1.00 0.00 H ATOM 2975 N PRO A 315 111.693 82.750 30.411 1.00 10.64 N ATOM 2976 CA PRO A 315 111.132 81.551 31.060 1.00 10.73 C ATOM 2977 C PRO A 315 110.192 80.741 30.179 1.00 11.83 C ATOM 2978 O PRO A 315 110.029 79.536 30.414 1.00 11.58 O ATOM 2979 CB PRO A 315 110.389 82.125 32.277 1.00 11.42 C ATOM 2980 CG PRO A 315 111.117 83.378 32.584 1.00 13.60 C ATOM 2981 CD PRO A 315 111.504 83.957 31.239 1.00 11.19 C ATOM 2982 N GLU A 316 109.554 81.351 29.184 1.00 9.29 N ATOM 2983 CA GLU A 316 108.677 80.612 28.289 1.00 9.73 C ATOM 2984 C GLU A 316 109.378 80.127 27.016 1.00 9.58 C ATOM 2985 O GLU A 316 108.700 79.685 26.084 1.00 9.40 O ATOM 2986 CB GLU A 316 107.454 81.462 27.938 1.00 11.05 C ATOM 2987 CG GLU A 316 106.532 81.771 29.141 1.00 11.47 C ATOM 2988 CD GLU A 316 105.741 80.559 29.647 1.00 11.49 C ATOM 2989 OE1 GLU A 316 105.872 79.440 29.104 1.00 11.25 O ATOM 2990 OE2 GLU A 316 104.962 80.729 30.613 1.00 14.72 O ATOM 2991 H GLU A 316 109.684 82.373 29.044 1.00 0.00 H ATOM 2992 N TYR A 317 110.704 80.164 26.960 1.00 8.97 N ATOM 2993 CA TYR A 317 111.409 79.520 25.863 1.00 9.29 C ATOM 2994 C TYR A 317 110.896 78.089 25.727 1.00 9.72 C ATOM 2995 O TYR A 317 110.934 77.332 26.706 1.00 9.99 O ATOM 2996 CB TYR A 317 112.918 79.532 26.118 1.00 11.57 C ATOM 2997 CG TYR A 317 113.713 78.807 25.056 1.00 9.91 C ATOM 2998 CD1 TYR A 317 113.824 79.330 23.785 1.00 10.26 C ATOM 2999 CD2 TYR A 317 114.330 77.591 25.330 1.00 11.30 C ATOM 3000 CE1 TYR A 317 114.543 78.681 22.807 1.00 10.44 C ATOM 3001 CE2 TYR A 317 115.055 76.923 24.354 1.00 11.13 C ATOM 3002 CZ TYR A 317 115.153 77.476 23.096 1.00 11.65 C ATOM 3003 OH TYR A 317 115.865 76.836 22.107 1.00 13.08 O ATOM 3004 HH TYR A 317 115.829 77.373 21.276 1.00 0.00 H ATOM 3005 H TYR A 317 111.240 80.655 27.703 1.00 0.00 H ATOM 3006 N PRO A 318 110.365 77.699 24.562 1.00 8.37 N ATOM 3007 CA PRO A 318 109.539 76.481 24.506 1.00 8.79 C ATOM 3008 C PRO A 318 110.292 75.164 24.392 1.00 10.41 C ATOM 3009 O PRO A 318 109.648 74.115 24.517 1.00 10.22 O ATOM 3010 CB PRO A 318 108.683 76.706 23.251 1.00 8.23 C ATOM 3011 CG PRO A 318 109.531 77.616 22.367 1.00 9.12 C ATOM 3012 CD PRO A 318 110.180 78.551 23.371 1.00 8.58 C ATOM 3013 N PHE A 319 111.609 75.168 24.170 1.00 9.31 N ATOM 3014 CA PHE A 319 112.291 73.950 23.744 1.00 10.24 C ATOM 3015 C PHE A 319 113.156 73.311 24.830 1.00 13.10 C ATOM 3016 O PHE A 319 113.911 72.379 24.528 1.00 14.68 O ATOM 3017 CB PHE A 319 113.122 74.238 22.486 1.00 10.37 C ATOM 3018 CG PHE A 319 112.321 74.824 21.343 1.00 10.38 C ATOM 3019 CD1 PHE A 319 111.013 74.417 21.090 1.00 9.93 C ATOM 3020 CD2 PHE A 319 112.887 75.789 20.531 1.00 10.41 C ATOM 3021 CE1 PHE A 319 110.285 74.984 20.036 1.00 9.83 C ATOM 3022 CE2 PHE A 319 112.177 76.363 19.477 1.00 10.77 C ATOM 3023 CZ PHE A 319 110.874 75.948 19.230 1.00 10.18 C ATOM 3024 H PHE A 319 112.152 76.045 24.302 1.00 0.00 H ATOM 3025 N VAL A 320 113.035 73.743 26.088 1.00 11.18 N ATOM 3026 CA VAL A 320 113.703 73.036 27.183 1.00 12.49 C ATOM 3027 C VAL A 320 112.984 71.734 27.494 1.00 12.58 C ATOM 3028 O VAL A 320 113.611 70.694 27.722 1.00 14.88 O ATOM 3029 CB VAL A 320 113.773 73.929 28.433 1.00 13.49 C ATOM 3030 CG1 VAL A 320 114.345 73.143 29.613 1.00 14.58 C ATOM 3031 CG2 VAL A 320 114.599 75.153 28.162 1.00 16.88 C ATOM 3032 H VAL A 320 112.463 74.587 26.291 1.00 0.00 H ATOM 3033 N GLU A 321 111.659 71.773 27.526 1.00 11.50 N ATOM 3034 CA GLU A 321 110.877 70.630 27.960 1.00 12.07 C ATOM 3035 C GLU A 321 110.862 69.547 26.885 1.00 12.53 C ATOM 3036 O GLU A 321 111.107 69.801 25.698 1.00 13.97 O ATOM 3037 CB GLU A 321 109.465 71.089 28.313 1.00 12.48 C ATOM 3038 CG GLU A 321 109.451 71.975 29.561 1.00 14.13 C ATOM 3039 CD GLU A 321 108.288 72.938 29.606 1.00 13.57 C ATOM 3040 OE1 GLU A 321 108.482 74.132 29.272 1.00 15.12 O ATOM 3041 OE2 GLU A 321 107.188 72.495 29.991 1.00 17.00 O ATOM 3042 H GLU A 321 111.169 72.642 27.233 1.00 0.00 H ATOM 3043 N GLU A 322 110.579 68.313 27.321 1.00 13.95 N ATOM 3044 CA GLU A 322 110.651 67.186 26.396 1.00 16.07 C ATOM 3045 C GLU A 322 109.723 67.385 25.210 1.00 16.03 C ATOM 3046 O GLU A 322 110.108 67.126 24.065 1.00 18.38 O ATOM 3047 CB GLU A 322 110.325 65.878 27.107 1.00 19.35 C ATOM 3048 CG GLU A 322 110.596 64.678 26.196 1.00 24.25 C ATOM 3049 CD GLU A 322 110.183 63.356 26.800 1.00 31.36 C ATOM 3050 OE1 GLU A 322 109.582 63.355 27.894 1.00 36.39 O ATOM 3051 OE2 GLU A 322 110.464 62.312 26.171 1.00 39.28 O ATOM 3052 H GLU A 322 110.309 68.158 28.313 1.00 0.00 H ATOM 3053 N TYR A 323 108.499 67.837 25.461 1.00 13.75 N ATOM 3054 CA TYR A 323 107.608 68.245 24.384 1.00 12.94 C ATOM 3055 C TYR A 323 106.617 69.266 24.921 1.00 14.34 C ATOM 3056 O TYR A 323 105.856 69.881 24.170 1.00 10.98 O ATOM 3057 CB TYR A 323 106.875 67.040 23.772 1.00 14.24 C ATOM 3058 CG TYR A 323 105.805 66.440 24.651 1.00 15.08 C ATOM 3059 CD1 TYR A 323 106.143 65.673 25.758 1.00 16.48 C ATOM 3060 CD2 TYR A 323 104.459 66.618 24.367 1.00 13.69 C ATOM 3061 CE1 TYR A 323 105.172 65.113 26.564 1.00 21.74 C ATOM 3062 CE2 TYR A 323 103.479 66.063 25.169 1.00 16.40 C ATOM 3063 CZ TYR A 323 103.841 65.313 26.267 1.00 23.45 C ATOM 3064 OH TYR A 323 102.868 64.755 27.066 1.00 31.74 O ATOM 3065 OXT TYR A 323 106.576 69.491 26.135 1.00 14.66 O ATOM 3066 HH TYR A 323 102.312 64.139 26.526 1.00 0.00 H ATOM 3067 H TYR A 323 108.171 67.901 26.446 1.00 0.00 H TER 3068 TYR A 323 HETATM 3069 O HOH 1 117.117 48.890 -1.445 1.00 35.08 O HETATM 3070 O HOH 2 124.411 96.077 28.485 1.00 29.18 O HETATM 3071 O HOH 3 89.710 79.996 -7.279 1.00 31.69 O HETATM 3072 O HOH 4 111.607 63.824 -8.995 1.00 24.24 O HETATM 3073 O HOH 5 103.980 59.660 21.679 1.00 23.56 O HETATM 3074 O HOH 6 108.848 74.061 5.493 1.00 17.40 O HETATM 3075 O HOH 7 89.173 95.011 23.292 1.00 29.63 O HETATM 3076 O HOH 8 99.321 58.545 -8.644 1.00 26.39 O HETATM 3077 O HOH 9 85.974 88.362 21.409 1.00 30.37 O HETATM 3078 O HOH 10 100.464 64.459 26.324 1.00 29.46 O HETATM 3079 O HOH 11 104.924 82.639 32.304 1.00 25.05 O HETATM 3080 O HOH 12 105.498 98.275 25.238 1.00 35.16 O HETATM 3081 O HOH 13 105.324 55.723 -5.717 1.00 27.05 O HETATM 3082 O HOH 14 106.088 47.714 14.171 1.00 29.40 O HETATM 3083 O HOH 15 86.296 85.265 0.902 1.00 31.80 O HETATM 3084 O HOH 16 91.320 96.324 1.254 1.00 28.26 O HETATM 3085 O HOH 17 111.908 50.620 -7.218 1.00 30.12 O HETATM 3086 O HOH 18 89.174 84.157 26.429 1.00 20.89 O HETATM 3087 O HOH 19 108.436 76.783 5.104 1.00 24.35 O HETATM 3088 O HOH 20 119.246 92.532 16.449 1.00 29.52 O HETATM 3089 O HOH 21 119.159 63.194 -1.758 1.00 26.38 O HETATM 3090 O HOH 22 107.079 73.020 -15.031 1.00 12.04 O HETATM 3091 O HOH 23 127.825 100.669 20.496 1.00 39.82 O HETATM 3092 O HOH 24 113.508 49.317 8.395 1.00 28.25 O HETATM 3093 O HOH 25 98.190 58.989 16.898 1.00 30.75 O HETATM 3094 O HOH 26 89.491 82.208 2.102 1.00 20.34 O HETATM 3095 O HOH 27 119.776 75.611 4.805 1.00 36.15 O HETATM 3096 O HOH 28 84.830 83.313 13.221 1.00 33.23 O HETATM 3097 O HOH 29 84.739 77.948 20.551 1.00 33.14 O HETATM 3098 O HOH 30 98.127 71.511 -9.548 1.00 30.14 O HETATM 3099 O HOH 31 84.838 82.304 10.765 1.00 31.34 O HETATM 3100 O HOH 32 90.192 85.896 -9.909 1.00 31.23 O HETATM 3101 O HOH 33 100.788 93.539 -1.183 1.00 20.91 O HETATM 3102 O HOH 34 90.198 72.750 30.907 1.00 29.73 O HETATM 3103 O HOH 35 85.917 77.527 25.620 1.00 35.26 O HETATM 3104 O HOH 36 117.425 79.266 -0.570 1.00 25.64 O HETATM 3105 O HOH 37 107.477 97.600 12.362 1.00 34.19 O HETATM 3106 O HOH 38 117.312 78.084 3.276 1.00 34.43 O HETATM 3107 O HOH 39 116.031 74.656 -3.888 1.00 18.18 O HETATM 3108 O HOH 40 100.223 52.931 4.732 1.00 29.10 O HETATM 3109 O HOH 41 97.714 69.918 31.970 1.00 22.83 O HETATM 3110 O HOH 42 104.600 57.900 12.296 1.00 25.13 O HETATM 3111 O HOH 43 100.475 89.759 30.746 1.00 18.54 O HETATM 3112 O HOH 44 106.808 97.288 9.205 1.00 35.53 O HETATM 3113 O HOH 45 117.767 72.154 -4.883 1.00 31.56 O HETATM 3114 O HOH 46 111.163 49.971 4.626 1.00 22.31 O HETATM 3115 O HOH 47 114.900 77.047 -3.070 1.00 15.80 O HETATM 3116 O HOH 48 86.186 85.422 11.677 1.00 21.25 O HETATM 3117 O HOH 49 110.988 81.194 -8.533 1.00 23.36 O HETATM 3118 O HOH 50 89.912 94.222 19.781 1.00 25.56 O HETATM 3119 O HOH 51 97.544 89.933 -13.095 1.00 34.03 O HETATM 3120 O HOH 52 108.716 80.836 11.243 1.00 24.66 O HETATM 3121 O HOH 53 106.636 48.191 1.613 1.00 23.30 O HETATM 3122 O HOH 54 113.806 66.352 -5.463 1.00 17.82 O HETATM 3123 O HOH 55 88.840 87.147 24.365 1.00 24.76 O HETATM 3124 O HOH 56 122.983 89.204 19.413 1.00 32.09 O HETATM 3125 O HOH 57 105.786 52.143 0.274 1.00 15.51 O HETATM 3126 O HOH 58 119.761 57.770 9.538 1.00 27.30 O HETATM 3127 O HOH 59 108.996 95.031 15.623 1.00 18.44 O HETATM 3128 O HOH 60 116.883 58.272 -3.803 1.00 25.76 O HETATM 3129 O HOH 61 87.538 71.186 19.739 1.00 25.24 O HETATM 3130 O HOH 62 96.590 76.943 -10.604 1.00 22.53 O HETATM 3131 O HOH 63 99.322 60.484 13.291 1.00 30.46 O HETATM 3132 O HOH 64 95.670 78.946 31.816 1.00 16.16 O HETATM 3133 O HOH 65 112.399 90.256 10.844 1.00 29.24 O HETATM 3134 O HOH 66 98.271 67.162 5.497 1.00 16.08 O HETATM 3135 O HOH 67 99.473 65.025 -5.782 1.00 20.62 O HETATM 3136 O HOH 68 89.117 77.413 17.214 1.00 14.84 O HETATM 3137 O HOH 69 117.889 88.363 27.534 1.00 28.43 O HETATM 3138 O HOH 70 106.179 92.522 24.127 1.00 14.15 O HETATM 3139 O HOH 71 105.679 71.167 28.048 1.00 15.36 O HETATM 3140 O HOH 72 109.582 71.449 24.112 1.00 14.12 O HETATM 3141 O HOH 73 94.886 95.006 20.189 1.00 14.30 O HETATM 3142 O HOH 74 86.126 91.964 18.280 1.00 22.95 O HETATM 3143 O HOH 75 124.575 60.887 3.167 1.00 20.24 O HETATM 3144 O HOH 76 121.739 62.595 6.538 1.00 25.40 O HETATM 3145 O HOH 77 109.743 62.284 -7.511 1.00 25.92 O HETATM 3146 O HOH 78 98.283 82.065 32.283 1.00 17.39 O HETATM 3147 O HOH 79 111.929 78.065 15.745 1.00 14.28 O HETATM 3148 O HOH 80 102.626 69.120 -9.803 1.00 16.62 O HETATM 3149 O HOH 81 85.353 79.105 28.369 1.00 30.49 O HETATM 3150 O HOH 82 109.699 61.880 18.543 1.00 24.77 O HETATM 3151 O HOH 83 110.494 74.653 27.532 1.00 12.48 O HETATM 3152 O HOH 84 93.477 95.712 4.606 1.00 19.06 O HETATM 3153 O HOH 85 83.128 77.444 10.886 1.00 33.43 O HETATM 3154 O HOH 86 96.768 90.301 -1.955 1.00 18.55 O HETATM 3155 O HOH 87 114.527 58.227 -5.735 1.00 22.13 O HETATM 3156 O HOH 88 85.050 94.420 12.582 1.00 31.72 O HETATM 3157 O HOH 89 115.995 71.399 -8.948 1.00 28.09 O HETATM 3158 O HOH 90 108.956 69.533 20.388 1.00 13.21 O HETATM 3159 O HOH 91 90.334 79.433 8.452 1.00 14.11 O HETATM 3160 O HOH 92 108.593 93.830 1.625 1.00 29.80 O HETATM 3161 O HOH 93 110.453 65.051 18.023 1.00 20.68 O HETATM 3162 O HOH 94 101.328 90.474 12.089 1.00 13.75 O HETATM 3163 O HOH 95 118.025 81.004 6.608 1.00 34.58 O HETATM 3164 O HOH 96 119.385 81.531 29.152 1.00 26.24 O HETATM 3165 O HOH 97 106.434 99.838 15.858 1.00 32.21 O HETATM 3166 O HOH 98 124.453 94.963 20.570 1.00 35.15 O HETATM 3167 O HOH 99 119.824 98.412 23.404 1.00 34.79 O HETATM 3168 O HOH 100 86.192 79.221 31.763 1.00 29.25 O HETATM 3169 O HOH 101 89.367 76.812 29.460 1.00 16.59 O HETATM 3170 O HOH 102 112.299 74.169 16.434 1.00 11.41 O HETATM 3171 O HOH 103 119.290 72.200 18.279 1.00 29.67 O HETATM 3172 O HOH 104 92.072 72.270 14.402 1.00 11.33 O HETATM 3173 O HOH 105 104.769 84.699 27.382 1.00 14.24 O HETATM 3174 O HOH 106 121.233 86.767 29.258 1.00 38.44 O HETATM 3175 O HOH 107 96.997 58.840 6.872 1.00 32.83 O HETATM 3176 O HOH 108 110.042 72.425 1.767 1.00 16.85 O HETATM 3177 O HOH 109 110.452 52.149 13.723 1.00 27.16 O HETATM 3178 O HOH 110 86.824 73.851 18.920 1.00 24.85 O HETATM 3179 O HOH 111 96.168 100.195 20.325 1.00 15.90 O HETATM 3180 O HOH 112 87.419 91.668 6.999 1.00 28.32 O HETATM 3181 O HOH 113 85.942 86.928 -4.890 1.00 36.16 O HETATM 3182 O HOH 114 109.917 84.196 0.383 1.00 17.44 O HETATM 3183 O HOH 115 94.613 85.663 30.045 1.00 22.98 O HETATM 3184 O HOH 116 106.374 80.239 5.661 1.00 15.86 O HETATM 3185 O HOH 117 90.174 69.745 13.940 1.00 26.72 O HETATM 3186 O HOH 118 102.850 93.918 8.636 1.00 22.17 O HETATM 3187 O HOH 119 106.901 73.848 -2.639 1.00 14.28 O HETATM 3188 O HOH 120 85.056 84.849 27.426 1.00 36.77 O HETATM 3189 O HOH 121 118.142 91.557 28.070 1.00 31.87 O HETATM 3190 O HOH 122 97.486 99.308 12.206 1.00 21.13 O HETATM 3191 O HOH 123 89.826 94.516 6.947 1.00 19.74 O HETATM 3192 O HOH 124 104.229 54.290 11.495 1.00 23.17 O HETATM 3193 O HOH 125 118.670 58.893 12.195 1.00 23.20 O HETATM 3194 O HOH 126 89.099 77.823 4.417 1.00 24.46 O HETATM 3195 O HOH 127 84.655 79.452 13.386 1.00 26.36 O HETATM 3196 O HOH 128 107.016 94.084 6.017 1.00 27.61 O HETATM 3197 O HOH 129 99.671 78.015 7.613 1.00 10.88 O HETATM 3198 O HOH 130 96.033 70.443 -13.524 1.00 35.72 O HETATM 3199 O HOH 131 119.067 69.039 6.587 1.00 16.12 O HETATM 3200 O HOH 132 111.259 59.954 12.017 1.00 13.83 O HETATM 3201 O HOH 133 102.258 93.815 11.332 1.00 18.64 O HETATM 3202 O HOH 134 93.698 93.583 27.918 1.00 31.12 O HETATM 3203 O HOH 135 93.285 91.388 -7.956 1.00 31.75 O HETATM 3204 O HOH 136 99.823 74.018 31.456 1.00 12.96 O HETATM 3205 O HOH 137 96.315 63.702 25.485 1.00 15.36 O HETATM 3206 O HOH 138 114.963 52.965 10.221 1.00 22.29 O HETATM 3207 O HOH 139 109.982 89.257 -9.208 1.00 23.40 O HETATM 3208 O HOH 140 91.102 90.641 27.312 1.00 29.00 O HETATM 3209 O HOH 141 90.330 96.009 4.578 1.00 23.18 O HETATM 3210 O HOH 142 98.080 67.321 12.830 1.00 14.34 O HETATM 3211 O HOH 143 117.707 70.231 -2.040 1.00 23.82 O HETATM 3212 O HOH 144 107.602 70.997 22.278 1.00 11.73 O HETATM 3213 O HOH 145 93.079 70.697 28.500 1.00 23.80 O HETATM 3214 O HOH 146 109.461 74.318 16.505 1.00 8.43 O HETATM 3215 O HOH 147 105.725 45.749 3.291 1.00 31.30 O HETATM 3216 O HOH 148 102.131 51.985 -0.888 1.00 20.84 O HETATM 3217 O HOH 149 89.674 73.844 26.085 1.00 24.17 O HETATM 3218 O HOH 150 105.783 87.330 12.372 1.00 9.64 O HETATM 3219 O HOH 151 111.717 96.504 19.545 1.00 17.18 O HETATM 3220 O HOH 152 109.360 99.339 24.258 1.00 25.64 O HETATM 3221 O HOH 153 97.525 86.890 32.729 1.00 27.67 O HETATM 3222 O HOH 154 104.501 93.938 22.552 1.00 12.07 O HETATM 3223 O HOH 155 94.729 66.753 28.671 1.00 28.51 O HETATM 3224 O HOH 156 120.556 73.551 15.217 1.00 26.82 O HETATM 3225 O HOH 157 121.875 97.669 21.980 1.00 34.62 O HETATM 3226 O HOH 158 96.171 97.320 1.169 1.00 29.24 O HETATM 3227 O HOH 159 120.860 55.013 0.155 1.00 24.73 O HETATM 3228 O HOH 160 111.719 78.547 -0.748 1.00 21.12 O HETATM 3229 O HOH 161 95.090 65.961 10.614 1.00 25.49 O HETATM 3230 O HOH 162 106.348 79.538 12.353 1.00 14.79 O HETATM 3231 O HOH 163 125.419 65.174 3.079 1.00 29.55 O HETATM 3232 O HOH 164 112.424 68.608 -8.101 1.00 25.99 O HETATM 3233 O HOH 165 109.327 65.612 21.813 1.00 29.32 O HETATM 3234 O HOH 166 107.635 96.004 25.488 1.00 20.52 O HETATM 3235 O HOH 167 99.990 77.294 10.440 1.00 12.52 O HETATM 3236 O HOH 168 94.013 90.742 26.699 1.00 15.35 O HETATM 3237 O HOH 169 93.819 77.029 34.297 1.00 27.32 O HETATM 3238 O HOH 170 114.475 82.816 32.478 1.00 22.76 O HETATM 3239 O HOH 171 110.179 65.160 6.845 1.00 10.40 O HETATM 3240 O HOH 172 97.661 66.947 28.711 1.00 18.59 O HETATM 3241 O HOH 173 120.034 88.032 20.951 1.00 24.76 O HETATM 3242 O HOH 174 116.179 70.145 28.783 1.00 28.51 O HETATM 3243 O HOH 175 108.739 72.347 18.377 1.00 10.30 O HETATM 3244 O HOH 176 104.486 54.178 -3.587 1.00 21.08 O HETATM 3245 O HOH 177 117.029 85.359 24.949 1.00 16.31 O HETATM 3246 O HOH 178 100.192 92.704 -7.976 1.00 29.02 O HETATM 3247 O HOH 179 106.514 100.471 21.450 1.00 31.33 O HETATM 3248 O HOH 180 100.116 95.911 28.313 1.00 27.89 O HETATM 3249 O HOH 181 110.173 91.761 31.592 1.00 29.32 O HETATM 3250 O HOH 182 89.858 79.708 15.306 1.00 13.45 O HETATM 3251 O HOH 183 106.079 96.843 18.662 1.00 17.30 O HETATM 3252 O HOH 184 116.286 90.063 19.797 1.00 19.28 O HETATM 3253 O HOH 185 110.240 68.064 30.143 1.00 24.81 O HETATM 3254 O HOH 186 107.059 66.055 20.242 1.00 12.31 O HETATM 3255 O HOH 187 113.803 54.189 -8.201 1.00 28.26 O HETATM 3256 O HOH 188 119.501 86.606 24.585 1.00 21.71 O HETATM 3257 O HOH 189 122.240 78.804 1.780 1.00 40.42 O HETATM 3258 O HOH 190 113.044 99.819 17.612 1.00 29.14 O HETATM 3259 O HOH 191 111.449 60.991 21.227 1.00 37.28 O HETATM 3260 O HOH 192 90.481 63.061 22.145 1.00 30.52 O HETATM 3261 O HOH 193 100.934 97.359 17.001 1.00 16.03 O HETATM 3262 O HOH 194 104.173 83.941 -12.534 1.00 26.77 O HETATM 3263 O HOH 195 103.245 52.059 9.926 1.00 17.96 O HETATM 3264 O HOH 196 107.190 73.102 20.530 1.00 10.53 O HETATM 3265 O HOH 197 91.141 84.423 31.985 1.00 27.18 O HETATM 3266 O HOH 198 101.737 71.670 -10.752 1.00 17.31 O HETATM 3267 O HOH 199 93.518 88.815 30.847 1.00 25.53 O HETATM 3268 O HOH 200 117.972 68.458 4.050 1.00 19.38 O HETATM 3269 O HOH 201 103.306 91.331 14.050 1.00 13.15 O HETATM 3270 O HOH 202 89.153 79.941 6.033 1.00 19.96 O HETATM 3271 O HOH 203 87.903 94.302 17.982 1.00 34.03 O HETATM 3272 O HOH 204 97.686 78.386 -14.005 1.00 34.50 O HETATM 3273 O HOH 205 115.501 69.014 -7.224 1.00 26.86 O HETATM 3274 O HOH 206 115.251 70.892 21.748 1.00 29.95 O HETATM 3275 O HOH 207 101.987 92.132 30.511 1.00 27.67 O HETATM 3276 O HOH 208 102.860 77.213 32.693 1.00 13.63 O HETATM 3277 O HOH 209 102.581 86.922 24.996 1.00 12.07 O HETATM 3278 O HOH 210 94.152 96.907 7.141 1.00 19.03 O HETATM 3279 O HOH 211 91.127 65.537 25.300 1.00 27.14 O HETATM 3280 O HOH 212 85.962 86.412 -1.623 1.00 32.41 O HETATM 3281 O HOH 213 118.755 80.033 16.782 1.00 18.13 O HETATM 3282 O HOH 214 108.835 80.676 -1.112 1.00 17.78 O HETATM 3283 O HOH 215 93.492 98.757 15.993 1.00 29.65 O HETATM 3284 O HOH 216 115.433 91.490 28.631 1.00 25.99 O HETATM 3285 O HOH 217 106.121 86.633 29.162 1.00 13.87 O HETATM 3286 O HOH 218 112.158 78.940 -10.717 1.00 21.15 O HETATM 3287 O HOH 219 102.826 90.393 -9.494 1.00 35.29 O HETATM 3288 O HOH 220 117.253 99.300 16.840 1.00 36.20 O HETATM 3289 O HOH 221 107.432 53.552 15.084 1.00 28.09 O HETATM 3290 O HOH 222 101.441 63.075 24.125 1.00 18.62 O HETATM 3291 O HOH 223 114.798 65.151 -3.132 1.00 15.22 O HETATM 3292 O HOH 224 113.562 67.992 28.871 1.00 30.66 O HETATM 3293 O HOH 225 97.246 95.465 -6.401 1.00 41.51 O HETATM 3294 O HOH 226 109.449 57.807 16.252 1.00 25.26 O HETATM 3295 O HOH 227 97.216 64.981 5.722 1.00 25.95 O HETATM 3296 O HOH 228 86.998 69.473 17.346 1.00 27.44 O HETATM 3297 O HOH 229 100.812 98.323 6.702 1.00 25.09 O HETATM 3298 O HOH 230 87.141 76.233 20.394 1.00 22.71 O HETATM 3299 O HOH 231 90.057 78.838 1.613 1.00 26.18 O HETATM 3300 O HOH 232 110.350 95.128 27.457 1.00 28.55 O HETATM 3301 O HOH 233 120.344 84.465 23.078 1.00 24.49 O HETATM 3302 O HOH 234 108.910 79.836 13.530 1.00 19.38 O HETATM 3303 O HOH 235 104.348 69.478 29.857 1.00 25.25 O HETATM 3304 O HOH 236 86.209 92.478 9.227 1.00 30.39 O HETATM 3305 O HOH 237 97.163 74.362 32.303 1.00 12.89 O HETATM 3306 O HOH 238 90.052 66.387 1.648 1.00 26.64 O HETATM 3307 O HOH 239 88.547 87.209 -5.596 1.00 26.71 O HETATM 3308 O HOH 240 103.431 83.579 29.468 1.00 15.51 O HETATM 3309 O HOH 241 106.694 93.443 3.250 1.00 26.73 O HETATM 3310 O HOH 242 100.821 59.837 23.789 1.00 19.56 O HETATM 3311 O HOH 243 112.074 47.216 1.787 1.00 38.83 O HETATM 3312 O HOH 244 93.763 65.586 3.256 1.00 30.94 O HETATM 3313 O HOH 245 109.766 48.470 8.886 1.00 19.45 O HETATM 3314 O HOH 246 89.905 93.388 26.195 1.00 29.74 O HETATM 3315 O HOH 247 106.181 91.549 6.322 1.00 19.70 O HETATM 3316 O HOH 248 86.398 92.559 24.720 1.00 35.03 O HETATM 3317 O HOH 249 91.189 69.901 27.094 1.00 27.43 O HETATM 3318 O HOH 250 115.413 80.144 -7.885 1.00 33.20 O HETATM 3319 O HOH 251 102.264 96.438 -2.168 1.00 32.46 O HETATM 3320 O HOH 252 113.648 94.722 12.203 1.00 30.08 O HETATM 3321 O HOH 253 106.468 58.637 14.863 1.00 22.18 O HETATM 3322 O HOH 254 85.036 87.583 5.207 1.00 38.45 O HETATM 3323 O HOH 255 108.371 63.244 20.345 1.00 22.86 O HETATM 3324 O HOH 256 98.030 57.129 3.183 1.00 24.50 O HETATM 3325 O HOH 257 107.923 83.388 -1.520 1.00 15.65 O HETATM 3326 O HOH 258 112.606 69.934 23.095 1.00 23.38 O HETATM 3327 O HOH 259 101.554 54.576 -4.023 1.00 16.07 O HETATM 3328 O HOH 260 118.568 69.470 18.839 1.00 25.77 O HETATM 3329 O HOH 261 96.719 61.398 -0.616 1.00 29.53 O HETATM 3330 O HOH 262 86.817 77.098 5.587 1.00 23.99 O HETATM 3331 O HOH 263 118.382 96.799 19.545 1.00 26.66 O HETATM 3332 O HOH 264 87.683 95.814 12.964 1.00 33.05 O HETATM 3333 O HOH 265 92.424 93.538 20.503 1.00 17.28 O HETATM 3334 O HOH 266 111.226 46.798 7.566 1.00 34.30 O HETATM 3335 O HOH 267 90.812 89.551 1.232 1.00 14.37 O HETATM 3336 O HOH 268 103.851 47.155 4.843 1.00 18.26 O HETATM 3337 O HOH 269 91.202 76.967 -7.058 1.00 28.21 O HETATM 3338 O HOH 270 111.024 101.772 18.183 1.00 33.02 O HETATM 3339 O HOH 271 115.814 81.408 11.068 1.00 34.46 O HETATM 3340 O HOH 272 89.414 96.864 10.859 1.00 31.44 O HETATM 3341 O HOH 273 119.671 54.802 -2.262 1.00 29.97 O HETATM 3342 O HOH 274 107.302 67.595 28.442 1.00 26.57 O HETATM 3343 O HOH 275 106.724 84.439 -11.394 1.00 25.45 O HETATM 3344 O HOH 276 102.087 61.785 -8.950 1.00 20.62 O HETATM 3345 O HOH 277 104.130 100.439 12.056 1.00 34.77 O HETATM 3346 O HOH 278 101.311 84.858 33.705 1.00 33.82 O HETATM 3347 O HOH 279 99.808 94.603 -6.203 1.00 26.60 O HETATM 3348 O HOH 280 97.646 92.342 30.069 1.00 28.30 O HETATM 3349 O HOH 281 116.269 79.401 14.794 1.00 11.79 O HETATM 3350 O HOH 282 102.138 49.841 11.130 1.00 29.50 O HETATM 3351 O HOH 283 123.771 91.087 29.052 1.00 34.74 O HETATM 3352 O HOH 284 94.690 78.350 -12.328 1.00 35.32 O HETATM 3353 O HOH 285 90.400 66.210 8.447 1.00 24.97 O HETATM 3354 O HOH 286 95.266 100.614 14.586 1.00 31.12 O HETATM 3355 O HOH 287 118.600 82.758 17.103 1.00 23.45 O HETATM 3356 O HOH 288 112.991 102.825 13.609 1.00 34.21 O HETATM 3357 O HOH 289 115.723 92.455 -8.471 1.00 26.97 O HETATM 3358 O HOH 290 100.487 55.668 7.606 1.00 18.06 O HETATM 3359 O HOH 291 90.668 65.059 -4.639 1.00 40.93 O HETATM 3360 O HOH 292 86.924 80.866 2.280 1.00 29.62 O HETATM 3361 O HOH 293 122.624 98.024 26.922 1.00 20.80 O HETATM 3362 O HOH 294 118.760 73.986 0.259 1.00 35.04 O HETATM 3363 O HOH 295 103.153 99.247 24.414 1.00 30.29 O HETATM 3364 O HOH 296 111.947 47.426 4.626 1.00 34.83 O HETATM 3365 O HOH 297 82.826 83.728 4.202 1.00 45.25 O HETATM 3366 O HOH 298 101.156 55.352 -6.612 1.00 25.61 O HETATM 3367 O HOH 299 100.608 67.395 -8.798 1.00 30.13 O HETATM 3368 O HOH 300 121.915 72.973 12.719 1.00 32.20 O HETATM 3369 O HOH 301 120.753 76.662 14.753 1.00 30.68 O HETATM 3370 O HOH 302 108.122 63.687 -11.687 1.00 30.91 O HETATM 3371 O HOH 303 119.130 94.276 29.071 1.00 35.22 O HETATM 3372 O HOH 304 87.817 89.711 0.993 1.00 28.09 O HETATM 3373 O HOH 305 86.641 80.834 5.196 1.00 27.60 O HETATM 3374 O HOH 306 82.797 75.946 15.739 1.00 37.72 O HETATM 3375 O HOH 307 111.770 68.181 -10.652 1.00 24.95 O HETATM 3376 O HOH 308 106.217 49.192 16.295 1.00 29.93 O HETATM 3377 O HOH 309 116.965 78.763 -3.793 1.00 30.25 O HETATM 3378 O HOH 310 83.749 92.592 17.124 1.00 31.31 O HETATM 3379 O HOH 311 100.226 92.849 29.067 1.00 27.45 O HETATM 3380 O HOH 312 123.801 86.370 22.551 1.00 36.22 O HETATM 3381 O HOH 313 97.412 99.670 9.370 1.00 25.05 O HETATM 3382 O HOH 314 110.688 67.218 19.998 1.00 23.83 O HETATM 3383 O HOH 315 108.461 44.826 8.839 1.00 35.59 O HETATM 3384 O HOH 316 113.189 67.605 21.273 1.00 33.13 O HETATM 3385 O HOH 317 88.950 75.324 31.735 1.00 33.10 O HETATM 3386 O HOH 318 107.676 88.386 -10.216 1.00 27.45 O HETATM 3387 O HOH 319 90.249 71.314 25.026 1.00 30.80 O HETATM 3388 O HOH 320 90.609 87.235 -16.119 1.00 34.60 O HETATM 3389 O HOH 321 95.569 94.865 28.576 1.00 33.93 O HETATM 3390 O HOH 322 111.405 49.302 10.880 1.00 29.47 O HETATM 3391 O HOH 323 94.877 99.504 7.919 1.00 23.65 O HETATM 3392 O HOH 324 118.496 88.801 18.450 1.00 22.91 O HETATM 3393 O HOH 325 98.502 67.291 31.288 1.00 27.86 O HETATM 3394 O HOH 326 120.126 90.174 29.257 1.00 33.24 O HETATM 3395 O HOH 327 117.283 53.659 10.757 1.00 30.11 O HETATM 3396 O HOH 328 98.936 81.463 34.743 1.00 29.85 O HETATM 3397 O HOH 329 88.435 72.571 28.577 1.00 36.01 O HETATM 3398 O HOH 330 120.823 84.164 18.101 1.00 32.84 O HETATM 3399 O HOH 331 100.137 63.878 -8.313 1.00 28.60 O HETATM 3400 O HOH 332 102.106 97.446 14.633 1.00 25.27 O HETATM 3401 O HOH 333 104.012 45.776 7.296 1.00 23.78 O HETATM 3402 O HOH 334 112.188 83.949 13.582 1.00 31.60 O HETATM 3403 O HOH 335 95.312 91.797 29.010 1.00 26.95 O HETATM 3404 O HOH 336 114.170 60.675 -7.796 1.00 30.21 O HETATM 3405 O HOH 337 101.799 89.203 32.999 1.00 28.53 O HETATM 3406 O HOH 338 96.987 72.788 34.550 1.00 29.44 O HETATM 3407 O HOH 339 101.240 99.096 4.021 1.00 31.08 O HETATM 3408 O HOH 340 86.297 85.033 31.754 1.00 28.00 O HETATM 3409 O HOH 341 86.221 75.945 22.875 1.00 32.88 O HETATM 3410 O HOH 342 104.708 85.513 31.403 1.00 21.38 O HETATM 3411 O HOH 343 84.162 83.251 31.805 1.00 35.00 O HETATM 3412 O HOH 344 118.487 70.871 2.959 1.00 31.33 O HETATM 3413 O HOH 345 103.120 86.784 33.169 1.00 25.36 O HETATM 3414 O HOH 346 96.291 70.429 34.089 1.00 31.06 O HETATM 3415 O HOH 347 113.436 98.404 20.239 1.00 27.57 O HETATM 3416 O HOH 348 99.904 100.568 8.197 1.00 34.41 O HETATM 3417 O HOH 349 122.964 64.935 -3.918 1.00 36.89 O HETATM 3418 O HOH 350 116.021 80.484 -12.169 1.00 32.04 O HETATM 3419 O HOH 351 94.136 96.605 2.035 1.00 28.59 O HETATM 3420 O HOH 352 91.342 92.028 -9.141 1.00 37.47 O HETATM 3421 O HOH 353 85.188 90.815 20.987 1.00 33.52 O HETATM 3422 O HOH 354 118.605 71.487 0.499 1.00 36.68 O HETATM 3423 O HOH 355 89.091 79.778 -10.013 1.00 34.26 O HETATM 3424 O HOH 356 120.957 85.629 20.563 1.00 28.31 O HETATM 3425 O HOH 357 84.243 77.970 16.821 1.00 31.99 O HETATM 3426 O HOH 358 104.375 50.302 -1.282 1.00 31.87 O HETATM 3427 O HOH 359 114.159 63.533 -8.873 1.00 27.68 O HETATM 3428 O HOH 360 91.963 63.076 25.621 1.00 32.23 O HETATM 3429 O HOH 361 104.891 99.612 19.557 1.00 27.54 O HETATM 3430 O HOH 362 120.178 90.197 16.760 1.00 35.64 O HETATM 3431 O HOH 363 86.591 77.498 18.053 1.00 24.33 O HETATM 3432 O HOH 364 120.562 67.443 19.357 1.00 38.16 O HETATM 3433 O HOH 365 113.860 56.534 -7.969 1.00 25.52 O HETATM 3434 O HOH 366 100.544 93.472 32.326 1.00 37.68 O HETATM 3435 O HOH 367 84.817 82.800 1.844 1.00 37.16 O HETATM 3436 O HOH 368 101.080 53.162 8.357 1.00 30.36 O HETATM 3437 O HOH 369 88.132 84.231 -11.321 1.00 36.58 O HETATM 3438 O HOH 370 97.893 64.384 27.693 1.00 24.60 O HETATM 3439 O HOH 371 99.987 79.201 35.554 1.00 26.11 O HETATM 3440 O HOH 372 102.936 91.247 34.180 1.00 31.59 O HETATM 3441 O HOH 373 94.120 83.918 31.817 1.00 23.15 O HETATM 3442 O HOH 374 104.167 59.056 24.359 1.00 28.75 O HETATM 3443 O HOH 375 122.761 81.425 26.170 1.00 36.82 O HETATM 3444 O HOH 376 111.199 65.604 -11.178 1.00 34.57 O HETATM 3445 O HOH 377 107.714 47.036 9.692 1.00 24.46 O HETATM 3446 O HOH 378 102.789 56.566 11.383 1.00 31.28 O HETATM 3447 O HOH 379 119.796 99.614 17.218 1.00 36.64 O HETATM 3448 O HOH 380 97.978 92.329 -12.285 1.00 37.98 O HETATM 3449 O HOH 381 114.280 51.398 12.272 1.00 33.22 O HETATM 3450 O HOH 382 97.435 70.821 -16.034 1.00 35.14 O HETATM 3451 O HOH 383 114.799 84.339 13.227 1.00 35.77 O HETATM 3452 O HOH 384 118.613 67.496 -2.701 1.00 36.29 O HETATM 3453 O HOH 385 117.509 65.460 -2.945 1.00 31.50 O HETATM 3454 O HOH 386 96.515 76.885 33.366 1.00 16.96 O HETATM 3455 O HOH 387 94.213 62.319 26.620 1.00 17.99 O HETATM 3456 O HOH 388 82.638 78.611 19.158 1.00 36.96 O HETATM 3457 O HOH 389 86.726 76.566 28.671 1.00 29.56 O HETATM 3458 O HOH 390 100.287 71.367 31.843 1.00 22.07 O HETATM 3459 O HOH 391 119.469 98.054 26.243 1.00 33.30 O HETATM 3460 O HOH 392 110.199 92.052 -8.728 1.00 35.21 O HETATM 3461 O HOH 393 85.931 89.723 2.631 1.00 36.98 O HETATM 3462 O HOH 394 115.898 98.320 20.395 1.00 31.61 O HETATM 3463 O HOH 395 94.291 63.802 29.025 1.00 22.54 O HETATM 3464 O HOH 396 94.858 64.442 7.370 1.00 31.43 O HETATM 3465 O HOH 397 88.080 87.161 -8.335 1.00 33.47 O HETATM 3466 O HOH 398 124.431 59.357 15.545 1.00 40.40 O HETATM 3467 O HOH 399 108.745 55.136 16.787 1.00 26.12 O HETATM 3468 O HOH 400 115.346 85.522 11.102 1.00 39.65 O HETATM 3469 O HOH 401 95.512 81.633 32.580 1.00 18.00 O HETATM 3470 O HOH 402 98.127 50.877 4.608 1.00 32.04 O HETATM 3471 O HOH 403 96.940 59.880 -9.090 1.00 33.47 O HETATM 3472 O HOH 404 95.685 86.854 34.752 1.00 29.44 O HETATM 3473 O HOH 405 89.488 89.480 -4.208 1.00 31.38 O HETATM 3474 O HOH 406 101.045 75.297 33.582 1.00 16.31 O HETATM 3475 O HOH 407 83.942 95.961 10.534 1.00 38.39 O HETATM 3476 O HOH 408 98.907 76.976 34.805 1.00 26.65 O HETATM 3477 O HOH 409 93.764 79.241 36.082 1.00 27.18 O HETATM 3478 O HOH 410 120.153 48.441 -3.085 1.00 33.41 O HETATM 3479 O HOH 411 115.585 65.001 -7.037 1.00 31.18 O HETATM 3480 O HOH 412 118.940 90.925 13.894 1.00 41.42 O HETATM 3481 O HOH 413 87.418 74.485 25.088 1.00 31.92 O HETATM 3482 O HOH 414 85.757 76.056 3.025 1.00 42.53 O HETATM 3483 O HOH 415 105.339 43.578 6.850 1.00 34.27 O HETATM 3484 O HOH 416 93.347 65.085 8.976 1.00 36.68 O HETATM 3485 O HOH 417 86.953 88.872 -1.781 1.00 39.08 O HETATM 3486 O HOH 418 117.201 80.775 -5.458 1.00 36.42 O HETATM 3487 O HOH 419 103.818 98.263 17.793 1.00 28.71 O HETATM 3488 O HOH 420 117.682 83.327 -5.161 1.00 36.68 O HETATM 3489 O HOH 421 100.860 47.758 10.025 1.00 27.32 O HETATM 3490 O HOH 422 95.712 89.222 35.153 1.00 26.37 O HETATM 3491 O HOH 423 119.603 55.132 10.176 1.00 29.17 O HETATM 3492 O HOH 424 118.714 79.705 -9.373 1.00 36.95 O HETATM 3493 O HOH 425 117.505 84.685 15.114 1.00 35.02 O HETATM 3494 O HOH 426 121.227 78.617 16.402 1.00 34.91 O HETATM 3495 O HOH 427 94.774 81.345 35.240 1.00 24.78 O HETATM 3496 O HOH 428 96.291 65.688 32.414 1.00 35.30 O HETATM 3497 O HOH 429 97.262 85.148 36.763 1.00 33.79 O HETATM 3498 O HOH 430 118.494 87.118 16.221 1.00 33.51 O HETATM 3499 O HOH 431 101.313 45.695 8.031 1.00 28.90 O HETATM 3500 O HOH 432 117.948 88.461 13.440 1.00 36.99 O HETATM 3501 P UNN A 433 114.751 76.983 0.780 1.00 0.26 P HETATM 3502 O1P UNN A 433 114.080 77.017 -0.553 1.00 -0.62 O HETATM 3503 O2P UNN A 433 115.873 77.949 1.085 1.00 -0.62 O HETATM 3504 O5' UNN A 433 113.589 77.132 1.890 1.00 -0.25 O HETATM 3505 C5' UNN A 433 113.859 77.758 3.138 1.00 0.11 C HETATM 3506 C4' UNN A 433 114.018 76.695 4.231 1.00 0.12 C HETATM 3507 O4' UNN A 433 114.426 77.355 5.444 1.00 -0.34 O HETATM 3508 C1' UNN A 433 113.572 76.948 6.507 1.00 0.20 C HETATM 3509 C2' UNN A 433 112.259 76.707 5.779 1.00 0.14 C HETATM 3510 C3' UNN A 433 112.746 75.938 4.566 1.00 0.15 C HETATM 3511 O3' UNN A 433 113.096 74.613 4.998 1.00 -0.25 O HETATM 3512 P1 UNN A 433 112.472 73.272 4.343 1.00 0.26 P HETATM 3513 O1P1 UNN A 433 112.966 72.141 5.194 1.00 -0.62 O HETATM 3514 O2P1 UNN A 433 111.000 73.493 4.112 1.00 -0.62 O HETATM 3515 O5'1 UNN A 433 113.135 73.178 2.879 1.00 -0.25 O HETATM 3516 C5'1 UNN A 433 114.553 73.076 2.836 1.00 0.11 C HETATM 3517 C4'1 UNN A 433 115.029 73.156 1.396 1.00 0.12 C HETATM 3518 O4'1 UNN A 433 114.519 72.072 0.625 1.00 -0.34 O HETATM 3519 C1'1 UNN A 433 114.741 72.426 -0.743 1.00 0.20 C HETATM 3520 C2'1 UNN A 433 114.718 73.943 -0.805 1.00 0.14 C HETATM 3521 C3'1 UNN A 433 114.537 74.372 0.643 1.00 0.15 C HETATM 3522 O3'1 UNN A 433 115.321 75.505 1.017 1.00 -0.25 O HETATM 3523 H15 UNN A 433 113.478 74.579 0.855 1.00 0.07 H HETATM 3524 O2'1 UNN A 433 115.994 74.387 -1.275 1.00 -0.38 O HETATM 3525 H17 UNN A 433 116.108 74.119 -2.179 1.00 0.21 H HETATM 3526 H16 UNN A 433 113.908 74.319 -1.447 1.00 0.07 H HETATM 3527 N91 UNN A 433 113.675 71.767 -1.517 1.00 -0.19 N HETATM 3528 C81 UNN A 433 112.365 72.077 -1.524 1.00 0.11 C HETATM 3529 N71 UNN A 433 111.677 71.237 -2.327 1.00 -0.30 N HETATM 3530 C51 UNN A 433 112.573 70.378 -2.850 1.00 0.10 C HETATM 3531 C61 UNN A 433 112.511 69.246 -3.783 1.00 0.13 C HETATM 3532 N61 UNN A 433 111.335 68.858 -4.319 1.00 -0.32 N HETATM 3533 H20 UNN A 433 111.304 68.062 -4.972 1.00 0.18 H HETATM 3534 H21 UNN A 433 110.468 69.358 -4.075 1.00 0.18 H HETATM 3535 N11 UNN A 433 113.671 68.614 -4.068 1.00 -0.27 N HETATM 3536 C21 UNN A 433 114.842 68.998 -3.520 1.00 0.05 C HETATM 3537 N31 UNN A 433 114.980 70.030 -2.665 1.00 -0.27 N HETATM 3538 C41 UNN A 433 113.885 70.730 -2.310 1.00 0.16 C HETATM 3539 H22 UNN A 433 115.732 68.439 -3.785 1.00 0.10 H HETATM 3540 H19 UNN A 433 111.920 72.895 -0.959 1.00 0.13 H HETATM 3541 H18 UNN A 433 115.720 72.063 -1.090 1.00 0.10 H HETATM 3542 H14 UNN A 433 116.129 73.141 1.397 1.00 0.07 H HETATM 3543 H12 UNN A 433 114.864 72.115 3.271 1.00 0.06 H HETATM 3544 H13 UNN A 433 114.996 73.900 3.414 1.00 0.06 H HETATM 3545 H4 UNN A 433 112.021 75.921 3.739 1.00 0.07 H HETATM 3546 O2' UNN A 433 111.292 75.943 6.520 1.00 -0.38 O HETATM 3547 H6 UNN A 433 111.003 76.445 7.273 1.00 0.21 H HETATM 3548 H5 UNN A 433 111.799 77.663 5.487 1.00 0.07 H HETATM 3549 N9 UNN A 433 113.636 78.016 7.542 1.00 -0.19 N HETATM 3550 C8 UNN A 433 114.787 78.559 8.001 1.00 0.11 C HETATM 3551 N7 UNN A 433 114.547 79.491 8.963 1.00 -0.30 N HETATM 3552 C5 UNN A 433 113.209 79.531 9.122 1.00 0.10 C HETATM 3553 C6 UNN A 433 112.281 80.291 9.983 1.00 0.13 C HETATM 3554 N6 UNN A 433 112.762 81.209 10.855 1.00 -0.32 N HETATM 3555 H9 UNN A 433 112.114 81.739 11.455 1.00 0.18 H HETATM 3556 H10 UNN A 433 113.776 81.378 10.918 1.00 0.18 H HETATM 3557 N1 UNN A 433 110.957 80.044 9.863 1.00 -0.27 N HETATM 3558 C2 UNN A 433 110.490 79.136 8.987 1.00 0.05 C HETATM 3559 N3 UNN A 433 111.277 78.408 8.171 1.00 -0.27 N HETATM 3560 C4 UNN A 433 112.620 78.552 8.205 1.00 0.16 C HETATM 3561 H11 UNN A 433 109.418 78.981 8.935 1.00 0.10 H HETATM 3562 H8 UNN A 433 115.779 78.285 7.646 1.00 0.13 H HETATM 3563 H7 UNN A 433 113.910 76.006 6.963 1.00 0.10 H HETATM 3564 H3 UNN A 433 114.787 75.977 3.911 1.00 0.07 H HETATM 3565 H1 UNN A 433 113.026 78.427 3.398 1.00 0.06 H HETATM 3566 H2 UNN A 433 114.788 78.342 3.060 1.00 0.06 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 2157 2158 2164 2165 2166 CONECT 2164 2157 CONECT 2165 2157 CONECT 2166 2157 CONECT 3501 3502 3503 3504 3522 CONECT 3502 3501 CONECT 3503 3501 CONECT 3504 3501 3505 CONECT 3505 3504 3506 3565 3566 CONECT 3506 3505 3507 3510 3564 CONECT 3507 3506 3508 CONECT 3508 3507 3509 3549 3563 CONECT 3509 3508 3510 3546 3548 CONECT 3510 3506 3509 3511 3545 CONECT 3511 3510 3512 CONECT 3512 3511 3513 3514 3515 CONECT 3513 3512 CONECT 3514 3512 CONECT 3515 3512 3516 CONECT 3516 3515 3517 3543 3544 CONECT 3517 3516 3518 3521 3542 CONECT 3518 3517 3519 CONECT 3519 3518 3520 3527 3541 CONECT 3520 3519 3521 3524 3526 CONECT 3521 3517 3520 3522 3523 CONECT 3522 3501 3521 CONECT 3523 3521 CONECT 3524 3520 3525 CONECT 3525 3524 CONECT 3526 3520 CONECT 3527 3519 3528 3538 CONECT 3528 3527 3529 3540 CONECT 3529 3528 3530 CONECT 3530 3529 3531 3538 CONECT 3531 3530 3532 3535 CONECT 3532 3531 3533 3534 CONECT 3533 3532 CONECT 3534 3532 CONECT 3535 3531 3536 CONECT 3536 3535 3537 3539 CONECT 3537 3536 3538 CONECT 3538 3527 3530 3537 CONECT 3539 3536 CONECT 3540 3528 CONECT 3541 3519 CONECT 3542 3517 CONECT 3543 3516 CONECT 3544 3516 CONECT 3545 3510 CONECT 3546 3509 3547 CONECT 3547 3546 CONECT 3548 3509 CONECT 3549 3508 3550 3560 CONECT 3550 3549 3551 3562 CONECT 3551 3550 3552 CONECT 3552 3551 3553 3560 CONECT 3553 3552 3554 3557 CONECT 3554 3553 3555 3556 CONECT 3555 3554 CONECT 3556 3554 CONECT 3557 3553 3558 CONECT 3558 3557 3559 3561 CONECT 3559 3558 3560 CONECT 3560 3549 3552 3559 CONECT 3561 3558 CONECT 3562 3550 CONECT 3563 3508 CONECT 3564 3506 CONECT 3565 3505 CONECT 3566 3505 MASTER 0 0 0 0 0 0 0 0 3564 2 74 26 END
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Entry Information
PDB ID
5uxf
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Dihydrodiol dehydrogenase
Ligand Name
2BA
EC.Number
E.C.-.-.-.-
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Kd=87nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Immunity Vol. 46: pp. 433-445
Ligand Properties
Formula
C
2
0
H
2
6
N
1
0
O
1
2
P
2
Molecular Weight
660.428
Exact Mass
660.121
No. of atoms
70
No. of bonds
76
Polar Surface Area
343.18
LOGP Value
-5.28 (
Computed with XLOGP3
)
-1.35 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 12
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 22
No. of Rings: 7
Canonical SMILES
O[C@@H]1[C@@H]2OP(O)(O)OC[C@H]3O[C@H]([C@@H]([C@@H]3OP(OC[C@H]2O[C@H]1n1cnc2c1ncnc2N)(O)O)O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C20H28N10O12P2/c21-15-9-17(25-3-23-15)29(5-27-9)19-11(31)13-7(39-19)1-37-43(33,34)42-14-8(2-38-44(35,36)41-13)40-20(12(14)32)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-36,43-44H,1-2H2,(H2,21,23,25)(H2,22,24,26)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q8VC28
Entrez Gene ID
NCBI Entrez Gene ID:
27384
ASD
Information of known allosteric effects of PDB entries
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