Browse entries in the PDBbind-CN Database
HEADER 4RRG_COMPLEX COMPND 4RRG_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 138 MET LYS MET LEU LEU ILE HIS SER ASP TYR LEU GLU PHE SEQRES 2 A 138 GLU ALA LYS GLU LYS THR LYS ILE ALA GLU GLU THR GLU SEQRES 3 A 138 ASN LEU LYS GLY LYS LEU ASP GLU CYS LEU ALA CYS PHE SEQRES 4 A 138 ILE ALA VAL GLU ARG GLU ASP GLU ASN ASN PRO GLU GLY SEQRES 5 A 138 THR ALA ILE GLY ALA VAL GLU GLU ILE GLU LYS VAL ALA SEQRES 6 A 138 ASN GLN LEU LYS VAL ASN ASN ILE VAL VAL TYR PRO TYR SEQRES 7 A 138 ALA HIS LEU SER SER ASP LEU SER SER PRO GLU THR ALA SEQRES 8 A 138 VAL LYS VAL LEU LYS ASP ILE GLU SER ILE LEU LYS GLU SEQRES 9 A 138 ARG GLY TYR ASN VAL LEU ARG ALA PRO PHE GLY TRP TYR SEQRES 10 A 138 LYS ALA PHE LYS ILE SER CYS LYS GLY HIS PRO LEU SER SEQRES 11 A 138 GLU LEU SER ARG LYS ILE VAL ALA SEQRES 1 B 138 MET LYS MET LEU LEU ILE HIS SER ASP TYR LEU GLU PHE SEQRES 2 B 138 GLU ALA LYS GLU LYS THR LYS ILE ALA GLU GLU THR GLU SEQRES 3 B 138 ASN LEU LYS GLY LYS LEU ASP GLU CYS LEU ALA CYS PHE SEQRES 4 B 138 ILE ALA VAL GLU ARG GLU ASP GLU ASN ASN PRO GLU GLY SEQRES 5 B 138 THR ALA ILE GLY ALA VAL GLU GLU ILE GLU LYS VAL ALA SEQRES 6 B 138 ASN GLN LEU LYS VAL ASN ASN ILE VAL VAL TYR PRO TYR SEQRES 7 B 138 ALA HIS LEU SER SER ASP LEU SER SER PRO GLU THR ALA SEQRES 8 B 138 VAL LYS VAL LEU LYS ASP ILE GLU SER ILE LEU LYS GLU SEQRES 9 B 138 ARG GLY TYR ASN VAL LEU ARG ALA PRO PHE GLY TRP TYR SEQRES 10 B 138 LYS ALA PHE LYS ILE SER CYS LYS GLY HIS PRO LEU SER SEQRES 11 B 138 GLU LEU SER ARG LYS ILE VAL ALA HET A A 3T 48 ATOM 1 N MET A 5 -2.987 -4.820 51.560 1.00 27.41 N ATOM 2 CA MET A 5 -2.094 -3.773 50.955 1.00 27.28 C ATOM 3 C MET A 5 -1.086 -4.372 49.970 1.00 27.02 C ATOM 4 O MET A 5 -0.564 -5.456 50.200 1.00 27.01 O ATOM 5 CB MET A 5 -1.337 -3.031 52.058 1.00 27.20 C ATOM 6 CG MET A 5 -0.258 -2.076 51.540 1.00 27.88 C ATOM 7 SD MET A 5 0.598 -1.208 52.850 1.00 28.96 S ATOM 8 CE MET A 5 -0.570 0.075 53.245 1.00 28.08 C ATOM 9 HN3 MET A 5 -2.407 -5.515 52.073 1.00 0.00 H ATOM 10 HN2 MET A 5 -3.518 -5.300 50.805 1.00 0.00 H ATOM 11 HN1 MET A 5 -3.652 -4.368 52.219 1.00 0.00 H ATOM 12 N LYS A 6 -0.810 -3.651 48.884 1.00 26.82 N ATOM 13 CA LYS A 6 0.272 -4.025 47.977 1.00 26.83 C ATOM 14 C LYS A 6 1.307 -2.915 47.951 1.00 26.31 C ATOM 15 O LYS A 6 0.969 -1.727 47.858 1.00 25.92 O ATOM 16 CB LYS A 6 -0.253 -4.330 46.557 1.00 26.88 C ATOM 17 CG LYS A 6 0.815 -4.778 45.544 1.00 29.76 C ATOM 18 CD LYS A 6 1.165 -6.267 45.671 1.00 32.03 C ATOM 19 CE LYS A 6 2.527 -6.576 45.077 1.00 34.56 C ATOM 20 NZ LYS A 6 2.468 -6.962 43.626 1.00 35.35 N ATOM 21 HZ1 LYS A 6 1.878 -7.812 43.518 1.00 0.00 H ATOM 22 HZ2 LYS A 6 2.056 -6.181 43.077 1.00 0.00 H ATOM 23 HZ3 LYS A 6 3.429 -7.160 43.282 1.00 0.00 H ATOM 24 H LYS A 6 -1.377 -2.804 48.678 1.00 0.00 H ATOM 25 N MET A 7 2.572 -3.309 48.007 1.00 26.19 N ATOM 26 CA MET A 7 3.665 -2.350 48.070 1.00 25.96 C ATOM 27 C MET A 7 4.808 -2.766 47.153 1.00 25.63 C ATOM 28 O MET A 7 5.134 -3.942 47.062 1.00 25.45 O ATOM 29 CB MET A 7 4.162 -2.232 49.509 1.00 26.62 C ATOM 30 CG MET A 7 5.154 -1.116 49.763 1.00 28.17 C ATOM 31 SD MET A 7 5.816 -1.114 51.461 1.00 33.34 S ATOM 32 CE MET A 7 6.090 -2.860 51.730 1.00 32.97 C ATOM 33 H MET A 7 2.788 -4.326 48.006 1.00 0.00 H ATOM 34 N LEU A 8 5.389 -1.792 46.464 1.00 25.17 N ATOM 35 CA LEU A 8 6.607 -2.014 45.708 1.00 25.57 C ATOM 36 C LEU A 8 7.722 -1.190 46.330 1.00 25.50 C ATOM 37 O LEU A 8 7.614 0.031 46.425 1.00 25.87 O ATOM 38 CB LEU A 8 6.401 -1.629 44.237 1.00 25.58 C ATOM 39 CG LEU A 8 7.604 -1.720 43.299 1.00 25.33 C ATOM 40 CD1 LEU A 8 8.201 -3.139 43.279 1.00 26.96 C ATOM 41 CD2 LEU A 8 7.210 -1.277 41.893 1.00 26.72 C ATOM 42 H LEU A 8 4.960 -0.845 46.466 1.00 0.00 H ATOM 43 N LEU A 9 8.789 -1.857 46.760 1.00 25.63 N ATOM 44 CA LEU A 9 9.909 -1.171 47.405 1.00 25.94 C ATOM 45 C LEU A 9 11.070 -1.087 46.433 1.00 26.03 C ATOM 46 O LEU A 9 11.583 -2.115 45.985 1.00 26.04 O ATOM 47 CB LEU A 9 10.348 -1.887 48.693 1.00 26.48 C ATOM 48 CG LEU A 9 9.280 -2.161 49.754 1.00 28.25 C ATOM 49 CD1 LEU A 9 9.915 -2.396 51.102 1.00 30.09 C ATOM 50 CD2 LEU A 9 8.432 -0.954 49.856 1.00 30.58 C ATOM 51 H LEU A 9 8.828 -2.889 46.635 1.00 0.00 H ATOM 52 N ILE A 10 11.464 0.137 46.095 1.00 25.84 N ATOM 53 CA ILE A 10 12.552 0.342 45.147 1.00 25.77 C ATOM 54 C ILE A 10 13.728 1.029 45.823 1.00 26.16 C ATOM 55 O ILE A 10 13.638 2.190 46.246 1.00 25.83 O ATOM 56 CB ILE A 10 12.100 1.077 43.858 1.00 25.96 C ATOM 57 CG1 ILE A 10 10.902 0.336 43.218 1.00 26.47 C ATOM 58 CG2 ILE A 10 13.262 1.163 42.859 1.00 25.01 C ATOM 59 CD1 ILE A 10 10.308 0.977 41.948 1.00 27.37 C ATOM 60 H ILE A 10 10.988 0.962 46.514 1.00 0.00 H ATOM 61 N HIS A 11 14.835 0.300 45.929 1.00 26.64 N ATOM 62 CA HIS A 11 16.050 0.895 46.501 1.00 27.30 C ATOM 63 C HIS A 11 16.684 1.800 45.453 1.00 27.25 C ATOM 64 O HIS A 11 17.162 1.339 44.410 1.00 27.15 O ATOM 65 CB HIS A 11 17.008 -0.169 47.046 1.00 27.56 C ATOM 66 CG HIS A 11 18.126 0.393 47.870 1.00 29.31 C ATOM 67 ND1 HIS A 11 19.357 -0.221 47.973 1.00 31.18 N ATOM 68 CD2 HIS A 11 18.213 1.532 48.599 1.00 30.89 C ATOM 69 CE1 HIS A 11 20.141 0.498 48.758 1.00 31.92 C ATOM 70 NE2 HIS A 11 19.475 1.573 49.141 1.00 31.14 N ATOM 71 H HIS A 11 14.841 -0.689 45.608 1.00 0.00 H ATOM 72 N SER A 12 16.661 3.098 45.738 1.00 27.12 N ATOM 73 CA SER A 12 16.870 4.114 44.716 1.00 27.90 C ATOM 74 C SER A 12 18.026 5.063 45.021 1.00 28.22 C ATOM 75 O SER A 12 18.244 5.421 46.184 1.00 27.57 O ATOM 76 CB SER A 12 15.588 4.936 44.567 1.00 28.05 C ATOM 77 OG SER A 12 14.482 4.090 44.298 1.00 29.53 O ATOM 78 HG SER A 12 14.369 3.450 45.045 1.00 0.00 H ATOM 79 H SER A 12 16.489 3.397 46.719 1.00 0.00 H ATOM 80 N ASP A 13 18.744 5.474 43.970 1.00 28.52 N ATOM 81 CA ASP A 13 19.765 6.536 44.069 1.00 29.79 C ATOM 82 C ASP A 13 19.142 7.855 44.506 1.00 29.98 C ATOM 83 O ASP A 13 19.744 8.620 45.266 1.00 30.32 O ATOM 84 CB ASP A 13 20.471 6.736 42.719 1.00 29.81 C ATOM 85 CG ASP A 13 21.213 5.505 42.272 1.00 30.42 C ATOM 86 OD1 ASP A 13 22.004 4.972 43.076 1.00 31.00 O ATOM 87 OD2 ASP A 13 21.002 5.063 41.124 1.00 32.65 O ATOM 88 H ASP A 13 18.576 5.028 43.046 1.00 0.00 H ATOM 89 N TYR A 14 17.921 8.096 44.021 1.00 30.04 N ATOM 90 CA TYR A 14 17.157 9.304 44.297 1.00 30.42 C ATOM 91 C TYR A 14 15.696 9.102 43.896 1.00 30.29 C ATOM 92 O TYR A 14 15.380 8.223 43.093 1.00 30.20 O ATOM 93 CB TYR A 14 17.722 10.499 43.516 1.00 30.21 C ATOM 94 CG TYR A 14 17.761 10.294 42.018 1.00 31.45 C ATOM 95 CD1 TYR A 14 16.608 10.452 41.236 1.00 32.11 C ATOM 96 CD2 TYR A 14 18.954 9.961 41.372 1.00 31.96 C ATOM 97 CE1 TYR A 14 16.638 10.256 39.853 1.00 32.80 C ATOM 98 CE2 TYR A 14 19.000 9.780 39.986 1.00 33.30 C ATOM 99 CZ TYR A 14 17.840 9.925 39.238 1.00 33.00 C ATOM 100 OH TYR A 14 17.880 9.733 37.884 1.00 33.66 O ATOM 101 HH TYR A 14 16.976 9.874 37.505 1.00 0.00 H ATOM 102 H TYR A 14 17.489 7.376 43.408 1.00 0.00 H ATOM 103 N LEU A 15 14.827 9.930 44.462 1.00 30.46 N ATOM 104 CA LEU A 15 13.455 10.070 43.995 1.00 30.69 C ATOM 105 C LEU A 15 13.079 11.538 44.103 1.00 30.78 C ATOM 106 O LEU A 15 13.244 12.161 45.163 1.00 31.18 O ATOM 107 CB LEU A 15 12.484 9.195 44.794 1.00 30.62 C ATOM 108 CG LEU A 15 11.017 9.191 44.325 1.00 31.07 C ATOM 109 CD1 LEU A 15 10.399 7.844 44.536 1.00 33.09 C ATOM 110 CD2 LEU A 15 10.178 10.277 45.012 1.00 31.41 C ATOM 111 H LEU A 15 15.139 10.502 45.272 1.00 0.00 H ATOM 112 N GLU A 16 12.599 12.091 42.999 1.00 30.36 N ATOM 113 CA GLU A 16 12.028 13.433 43.015 1.00 30.55 C ATOM 114 C GLU A 16 10.644 13.392 42.413 1.00 29.46 C ATOM 115 O GLU A 16 10.371 12.576 41.544 1.00 28.86 O ATOM 116 CB GLU A 16 12.920 14.445 42.274 1.00 31.17 C ATOM 117 CG GLU A 16 13.324 14.045 40.873 1.00 34.62 C ATOM 118 CD GLU A 16 14.536 14.818 40.355 1.00 38.62 C ATOM 119 OE1 GLU A 16 14.569 16.066 40.483 1.00 39.52 O ATOM 120 OE2 GLU A 16 15.453 14.167 39.807 1.00 42.33 O ATOM 121 H GLU A 16 12.630 11.559 42.106 1.00 0.00 H ATOM 122 N PHE A 17 9.763 14.248 42.906 1.00 28.87 N ATOM 123 CA PHE A 17 8.423 14.359 42.354 1.00 28.96 C ATOM 124 C PHE A 17 8.005 15.823 42.279 1.00 29.40 C ATOM 125 O PHE A 17 8.564 16.684 42.985 1.00 29.06 O ATOM 126 CB PHE A 17 7.412 13.538 43.167 1.00 28.85 C ATOM 127 CG PHE A 17 7.276 13.981 44.596 1.00 28.69 C ATOM 128 CD1 PHE A 17 6.503 15.096 44.923 1.00 29.17 C ATOM 129 CD2 PHE A 17 7.928 13.289 45.616 1.00 29.46 C ATOM 130 CE1 PHE A 17 6.379 15.516 46.237 1.00 29.02 C ATOM 131 CE2 PHE A 17 7.806 13.699 46.941 1.00 28.88 C ATOM 132 CZ PHE A 17 7.035 14.810 47.252 1.00 29.74 C ATOM 133 H PHE A 17 10.036 14.854 43.706 1.00 0.00 H ATOM 134 N GLU A 18 7.032 16.091 41.414 1.00 29.76 N ATOM 135 CA GLU A 18 6.466 17.417 41.243 1.00 30.42 C ATOM 136 C GLU A 18 4.987 17.277 40.942 1.00 30.11 C ATOM 137 O GLU A 18 4.614 16.809 39.873 1.00 29.86 O ATOM 138 CB GLU A 18 7.168 18.173 40.101 1.00 30.86 C ATOM 139 CG GLU A 18 6.541 19.544 39.789 1.00 34.01 C ATOM 140 CD GLU A 18 7.322 20.382 38.772 1.00 37.80 C ATOM 141 OE1 GLU A 18 8.030 19.827 37.903 1.00 39.78 O ATOM 142 OE2 GLU A 18 7.206 21.623 38.837 1.00 41.03 O ATOM 143 H GLU A 18 6.658 15.314 40.832 1.00 0.00 H ATOM 144 N ALA A 19 4.140 17.675 41.888 1.00 30.21 N ATOM 145 CA ALA A 19 2.701 17.686 41.637 1.00 30.89 C ATOM 146 C ALA A 19 2.434 18.650 40.491 1.00 31.74 C ATOM 147 O ALA A 19 3.052 19.715 40.413 1.00 31.54 O ATOM 148 CB ALA A 19 1.936 18.094 42.875 1.00 30.93 C ATOM 149 H ALA A 19 4.505 17.980 42.813 1.00 0.00 H ATOM 150 N LYS A 20 1.542 18.255 39.588 1.00 32.90 N ATOM 151 CA LYS A 20 1.250 19.041 38.397 1.00 33.90 C ATOM 152 C LYS A 20 -0.222 19.404 38.288 1.00 34.66 C ATOM 153 O LYS A 20 -0.565 20.504 37.844 1.00 35.08 O ATOM 154 CB LYS A 20 1.723 18.307 37.137 1.00 34.35 C ATOM 155 CG LYS A 20 3.221 18.410 36.925 1.00 35.73 C ATOM 156 CD LYS A 20 3.636 17.949 35.536 1.00 39.67 C ATOM 157 CE LYS A 20 5.125 18.200 35.297 1.00 41.11 C ATOM 158 NZ LYS A 20 5.474 19.650 35.170 1.00 42.80 N ATOM 159 HZ1 LYS A 20 4.956 20.061 34.367 1.00 0.00 H ATOM 160 HZ2 LYS A 20 5.211 20.147 36.045 1.00 0.00 H ATOM 161 HZ3 LYS A 20 6.497 19.746 35.010 1.00 0.00 H ATOM 162 H LYS A 20 1.037 17.358 39.736 1.00 0.00 H ATOM 163 N GLU A 21 -1.094 18.491 38.704 1.00 35.01 N ATOM 164 CA GLU A 21 -2.535 18.688 38.550 1.00 35.45 C ATOM 165 C GLU A 21 -3.319 17.927 39.608 1.00 35.70 C ATOM 166 O GLU A 21 -2.942 16.818 39.985 1.00 35.32 O ATOM 167 CB GLU A 21 -2.970 18.238 37.153 1.00 35.80 C ATOM 168 CG GLU A 21 -4.339 18.732 36.705 1.00 36.83 C ATOM 169 CD GLU A 21 -4.557 18.559 35.212 1.00 37.79 C ATOM 170 OE1 GLU A 21 -3.587 18.705 34.440 1.00 38.79 O ATOM 171 OE2 GLU A 21 -5.701 18.281 34.808 1.00 38.32 O ATOM 172 H GLU A 21 -0.744 17.618 39.148 1.00 0.00 H ATOM 173 N LYS A 22 -4.409 18.533 40.081 1.00 35.85 N ATOM 174 CA LYS A 22 -5.289 17.901 41.059 1.00 36.39 C ATOM 175 C LYS A 22 -6.262 16.939 40.401 1.00 36.37 C ATOM 176 O LYS A 22 -6.777 17.222 39.322 1.00 36.25 O ATOM 177 CB LYS A 22 -6.097 18.957 41.829 1.00 36.54 C ATOM 178 CG LYS A 22 -5.327 19.651 42.921 1.00 36.89 C ATOM 179 CD LYS A 22 -6.225 20.427 43.885 1.00 39.14 C ATOM 180 CE LYS A 22 -6.305 21.892 43.501 1.00 40.52 C ATOM 181 NZ LYS A 22 -6.710 22.749 44.653 1.00 40.36 N ATOM 182 HZ1 LYS A 22 -7.646 22.450 44.994 1.00 0.00 H ATOM 183 HZ2 LYS A 22 -6.013 22.650 45.419 1.00 0.00 H ATOM 184 HZ3 LYS A 22 -6.752 23.742 44.347 1.00 0.00 H ATOM 185 H LYS A 22 -4.640 19.489 39.741 1.00 0.00 H ATOM 186 N THR A 23 -6.507 15.807 41.062 1.00 36.46 N ATOM 187 CA THR A 23 -7.675 14.973 40.775 1.00 36.30 C ATOM 188 C THR A 23 -8.820 15.470 41.654 1.00 36.94 C ATOM 189 O THR A 23 -8.643 16.406 42.430 1.00 36.68 O ATOM 190 CB THR A 23 -7.442 13.478 41.105 1.00 36.39 C ATOM 191 OG1 THR A 23 -7.428 13.296 42.529 1.00 35.05 O ATOM 192 CG2 THR A 23 -6.144 12.965 40.494 1.00 35.35 C ATOM 193 HG1 THR A 23 -6.699 13.838 42.923 1.00 0.00 H ATOM 194 H THR A 23 -5.846 15.507 41.807 1.00 0.00 H ATOM 195 N LYS A 24 -9.983 14.833 41.545 1.00 37.59 N ATOM 196 CA LYS A 24 -11.130 15.170 42.383 1.00 38.40 C ATOM 197 C LYS A 24 -10.890 14.858 43.869 1.00 38.51 C ATOM 198 O LYS A 24 -11.450 15.519 44.758 1.00 38.34 O ATOM 199 CB LYS A 24 -12.382 14.450 41.865 1.00 38.89 C ATOM 200 CG LYS A 24 -12.865 14.984 40.523 1.00 40.30 C ATOM 201 CD LYS A 24 -13.835 14.026 39.837 1.00 42.55 C ATOM 202 CE LYS A 24 -14.536 14.705 38.664 1.00 44.55 C ATOM 203 NZ LYS A 24 -15.433 15.818 39.121 1.00 44.88 N ATOM 204 HZ1 LYS A 24 -16.159 15.436 39.760 1.00 0.00 H ATOM 205 HZ2 LYS A 24 -14.868 16.533 39.623 1.00 0.00 H ATOM 206 HZ3 LYS A 24 -15.891 16.254 38.295 1.00 0.00 H ATOM 207 H LYS A 24 -10.078 14.072 40.842 1.00 0.00 H ATOM 208 N ILE A 25 -10.043 13.865 44.134 1.00 38.51 N ATOM 209 CA ILE A 25 -9.749 13.444 45.513 1.00 38.67 C ATOM 210 C ILE A 25 -8.354 13.866 46.001 1.00 38.69 C ATOM 211 O ILE A 25 -7.755 13.195 46.844 1.00 38.39 O ATOM 212 CB ILE A 25 -9.944 11.911 45.701 1.00 38.56 C ATOM 213 CG1 ILE A 25 -9.107 11.134 44.675 1.00 38.72 C ATOM 214 CG2 ILE A 25 -11.436 11.541 45.609 1.00 38.22 C ATOM 215 CD1 ILE A 25 -8.889 9.681 45.008 1.00 37.82 C ATOM 216 H ILE A 25 -9.577 13.374 43.345 1.00 0.00 H ATOM 217 N ALA A 26 -7.855 14.986 45.480 1.00 38.99 N ATOM 218 CA ALA A 26 -6.563 15.534 45.898 1.00 39.78 C ATOM 219 C ALA A 26 -6.552 15.933 47.376 1.00 40.39 C ATOM 220 O ALA A 26 -7.525 16.506 47.878 1.00 40.48 O ATOM 221 CB ALA A 26 -6.191 16.722 45.035 1.00 39.58 C ATOM 222 H ALA A 26 -8.402 15.488 44.752 1.00 0.00 H ATOM 223 N GLU A 27 -5.450 15.624 48.057 1.00 41.23 N ATOM 224 CA GLU A 27 -5.265 15.973 49.472 1.00 42.03 C ATOM 225 C GLU A 27 -4.536 17.303 49.573 1.00 42.54 C ATOM 226 O GLU A 27 -3.693 17.626 48.727 1.00 42.26 O ATOM 227 CB GLU A 27 -4.468 14.888 50.239 1.00 42.15 C ATOM 228 CG GLU A 27 -2.921 15.054 50.182 1.00 43.01 C ATOM 229 CD GLU A 27 -2.126 14.155 51.145 1.00 43.66 C ATOM 230 OE1 GLU A 27 -2.627 13.809 52.239 1.00 44.90 O ATOM 231 OE2 GLU A 27 -0.971 13.808 50.808 1.00 42.18 O ATOM 232 H GLU A 27 -4.688 15.114 47.566 1.00 0.00 H ATOM 233 N GLU A 28 -4.883 18.071 50.604 1.00 43.12 N ATOM 234 CA GLU A 28 -4.074 19.200 51.038 1.00 44.21 C ATOM 235 C GLU A 28 -2.701 18.661 51.382 1.00 44.13 C ATOM 236 O GLU A 28 -2.576 17.686 52.121 1.00 44.33 O ATOM 237 CB GLU A 28 -4.683 19.852 52.281 1.00 44.47 C ATOM 238 CG GLU A 28 -6.114 20.319 52.100 1.00 46.90 C ATOM 239 CD GLU A 28 -6.202 21.570 51.257 1.00 49.43 C ATOM 240 OE1 GLU A 28 -5.783 21.525 50.079 1.00 50.98 O ATOM 241 OE2 GLU A 28 -6.687 22.597 51.780 1.00 50.70 O ATOM 242 H GLU A 28 -5.762 17.857 51.117 1.00 0.00 H ATOM 243 N THR A 29 -1.669 19.278 50.829 1.00 44.18 N ATOM 244 CA THR A 29 -0.320 18.814 51.085 1.00 44.17 C ATOM 245 C THR A 29 0.605 19.995 51.315 1.00 44.08 C ATOM 246 O THR A 29 0.424 21.054 50.724 1.00 44.19 O ATOM 247 CB THR A 29 0.189 17.889 49.945 1.00 44.15 C ATOM 248 OG1 THR A 29 1.505 17.417 50.256 1.00 44.02 O ATOM 249 CG2 THR A 29 0.194 18.612 48.600 1.00 44.07 C ATOM 250 HG1 THR A 29 1.480 16.908 51.105 1.00 0.00 H ATOM 251 H THR A 29 -1.826 20.098 50.209 1.00 0.00 H ATOM 252 N GLU A 30 1.588 19.809 52.187 1.00 44.31 N ATOM 253 CA GLU A 30 2.523 20.883 52.511 1.00 44.70 C ATOM 254 C GLU A 30 3.837 20.774 51.733 1.00 44.36 C ATOM 255 O GLU A 30 4.804 21.468 52.044 1.00 44.59 O ATOM 256 CB GLU A 30 2.754 20.979 54.028 1.00 44.99 C ATOM 257 CG GLU A 30 1.605 21.680 54.757 1.00 46.62 C ATOM 258 CD GLU A 30 1.925 22.097 56.188 1.00 48.94 C ATOM 259 OE1 GLU A 30 3.119 22.082 56.574 1.00 50.09 O ATOM 260 OE2 GLU A 30 0.967 22.451 56.921 1.00 48.46 O ATOM 261 H GLU A 30 1.694 18.883 52.647 1.00 0.00 H ATOM 262 N ASN A 31 3.851 19.899 50.725 1.00 43.78 N ATOM 263 CA ASN A 31 4.952 19.787 49.770 1.00 43.25 C ATOM 264 C ASN A 31 4.464 19.260 48.419 1.00 42.34 C ATOM 265 O ASN A 31 4.235 18.058 48.250 1.00 42.07 O ATOM 266 CB ASN A 31 6.073 18.895 50.314 1.00 43.66 C ATOM 267 CG ASN A 31 6.944 19.608 51.335 1.00 45.31 C ATOM 268 OD1 ASN A 31 7.750 20.477 50.986 1.00 46.43 O ATOM 269 ND2 ASN A 31 6.782 19.247 52.610 1.00 45.82 N ATOM 270 HD22 ASN A 31 6.091 18.510 52.858 1.00 0.00 H ATOM 271 HD21 ASN A 31 7.347 19.703 53.355 1.00 0.00 H ATOM 272 H ASN A 31 3.035 19.263 50.613 1.00 0.00 H ATOM 273 N LEU A 32 4.298 20.173 47.467 1.00 41.45 N ATOM 274 CA LEU A 32 3.944 19.810 46.095 1.00 40.67 C ATOM 275 C LEU A 32 5.162 19.298 45.337 1.00 40.02 C ATOM 276 O LEU A 32 5.029 18.657 44.298 1.00 39.61 O ATOM 277 CB LEU A 32 3.378 21.013 45.361 1.00 40.81 C ATOM 278 CG LEU A 32 2.166 21.693 45.986 1.00 41.27 C ATOM 279 CD1 LEU A 32 2.013 23.082 45.395 1.00 41.04 C ATOM 280 CD2 LEU A 32 0.918 20.847 45.781 1.00 40.96 C ATOM 281 H LEU A 32 4.424 21.177 47.705 1.00 0.00 H ATOM 282 N LYS A 33 6.343 19.596 45.868 1.00 39.65 N ATOM 283 CA LYS A 33 7.602 19.119 45.303 1.00 39.39 C ATOM 284 C LYS A 33 8.432 18.423 46.366 1.00 39.01 C ATOM 285 O LYS A 33 8.320 18.726 47.561 1.00 38.57 O ATOM 286 CB LYS A 33 8.402 20.282 44.731 1.00 39.39 C ATOM 287 CG LYS A 33 7.874 20.832 43.431 1.00 40.38 C ATOM 288 CD LYS A 33 8.721 22.016 42.954 1.00 42.08 C ATOM 289 CE LYS A 33 10.179 21.625 42.725 1.00 42.92 C ATOM 290 NZ LYS A 33 10.371 20.814 41.485 1.00 44.20 N ATOM 291 HZ1 LYS A 33 9.813 19.939 41.555 1.00 0.00 H ATOM 292 HZ2 LYS A 33 10.055 21.363 40.661 1.00 0.00 H ATOM 293 HZ3 LYS A 33 11.378 20.577 41.380 1.00 0.00 H ATOM 294 H LYS A 33 6.372 20.192 46.719 1.00 0.00 H ATOM 295 N GLY A 34 9.276 17.494 45.932 1.00 38.47 N ATOM 296 CA GLY A 34 10.153 16.796 46.859 1.00 38.59 C ATOM 297 C GLY A 34 11.265 16.029 46.178 1.00 38.75 C ATOM 298 O GLY A 34 11.100 15.526 45.071 1.00 38.26 O ATOM 299 H GLY A 34 9.310 17.263 44.919 1.00 0.00 H ATOM 300 N LYS A 35 12.402 15.959 46.860 1.00 39.21 N ATOM 301 CA LYS A 35 13.539 15.157 46.436 1.00 39.58 C ATOM 302 C LYS A 35 14.150 14.460 47.648 1.00 39.74 C ATOM 303 O LYS A 35 14.270 15.053 48.731 1.00 39.40 O ATOM 304 CB LYS A 35 14.583 16.008 45.691 1.00 39.90 C ATOM 305 CG LYS A 35 15.091 17.257 46.434 1.00 41.98 C ATOM 306 CD LYS A 35 15.664 18.296 45.461 1.00 43.73 C ATOM 307 CE LYS A 35 16.004 19.625 46.156 1.00 44.83 C ATOM 308 NZ LYS A 35 17.425 19.723 46.602 1.00 44.31 N ATOM 309 HZ1 LYS A 35 17.629 18.959 47.278 1.00 0.00 H ATOM 310 HZ2 LYS A 35 18.053 19.635 45.778 1.00 0.00 H ATOM 311 HZ3 LYS A 35 17.580 20.643 47.061 1.00 0.00 H ATOM 312 H LYS A 35 12.484 16.505 47.741 1.00 0.00 H ATOM 313 N LEU A 36 14.503 13.190 47.468 1.00 39.76 N ATOM 314 CA LEU A 36 15.223 12.433 48.484 1.00 40.32 C ATOM 315 C LEU A 36 16.265 11.542 47.819 1.00 40.68 C ATOM 316 O LEU A 36 15.934 10.725 46.950 1.00 40.76 O ATOM 317 CB LEU A 36 14.257 11.605 49.345 1.00 40.18 C ATOM 318 CG LEU A 36 14.713 11.178 50.741 1.00 40.29 C ATOM 319 CD1 LEU A 36 15.013 12.389 51.639 1.00 40.66 C ATOM 320 CD2 LEU A 36 13.674 10.282 51.396 1.00 40.32 C ATOM 321 H LEU A 36 14.257 12.722 46.572 1.00 0.00 H ATOM 322 N ASP A 37 17.523 11.726 48.219 1.00 40.96 N ATOM 323 CA ASP A 37 18.635 10.915 47.724 1.00 41.10 C ATOM 324 C ASP A 37 18.673 9.575 48.435 1.00 40.67 C ATOM 325 O ASP A 37 18.211 9.470 49.580 1.00 41.09 O ATOM 326 CB ASP A 37 19.965 11.633 47.956 1.00 41.46 C ATOM 327 CG ASP A 37 20.211 12.736 46.956 1.00 43.64 C ATOM 328 OD1 ASP A 37 20.121 12.473 45.729 1.00 46.63 O ATOM 329 OD2 ASP A 37 20.498 13.870 47.397 1.00 45.47 O ATOM 330 H ASP A 37 17.722 12.476 48.911 1.00 0.00 H ATOM 331 N GLU A 38 19.238 8.571 47.757 1.00 39.50 N ATOM 332 CA GLU A 38 19.491 7.240 48.321 1.00 38.41 C ATOM 333 C GLU A 38 18.426 6.804 49.335 1.00 37.32 C ATOM 334 O GLU A 38 18.574 7.009 50.540 1.00 36.77 O ATOM 335 CB GLU A 38 20.907 7.170 48.915 1.00 39.32 C ATOM 336 CG GLU A 38 21.974 6.568 47.976 1.00 40.95 C ATOM 337 CD GLU A 38 22.351 7.441 46.772 1.00 44.15 C ATOM 338 OE1 GLU A 38 22.142 8.676 46.792 1.00 45.23 O ATOM 339 OE2 GLU A 38 22.884 6.875 45.792 1.00 45.46 O ATOM 340 H GLU A 38 19.515 8.744 46.770 1.00 0.00 H ATOM 341 N CYS A 39 17.353 6.203 48.827 1.00 35.73 N ATOM 342 CA CYS A 39 16.167 5.945 49.631 1.00 34.03 C ATOM 343 C CYS A 39 15.477 4.636 49.259 1.00 33.41 C ATOM 344 O CYS A 39 15.814 3.994 48.264 1.00 32.63 O ATOM 345 CB CYS A 39 15.179 7.107 49.486 1.00 34.46 C ATOM 346 SG CYS A 39 14.592 7.419 47.791 1.00 32.92 S ATOM 347 H CYS A 39 17.362 5.910 47.829 1.00 0.00 H ATOM 348 N LEU A 40 14.524 4.236 50.092 1.00 31.97 N ATOM 349 CA LEU A 40 13.644 3.143 49.754 1.00 30.93 C ATOM 350 C LEU A 40 12.340 3.792 49.318 1.00 29.80 C ATOM 351 O LEU A 40 11.593 4.323 50.135 1.00 29.58 O ATOM 352 CB LEU A 40 13.438 2.216 50.954 1.00 30.81 C ATOM 353 CG LEU A 40 12.836 0.842 50.669 1.00 31.39 C ATOM 354 CD1 LEU A 40 13.778 -0.006 49.812 1.00 30.86 C ATOM 355 CD2 LEU A 40 12.514 0.124 51.976 1.00 30.58 C ATOM 356 H LEU A 40 14.409 4.719 51.006 1.00 0.00 H ATOM 357 N ALA A 41 12.091 3.781 48.013 1.00 28.71 N ATOM 358 CA ALA A 41 10.870 4.353 47.474 1.00 26.89 C ATOM 359 C ALA A 41 9.802 3.272 47.597 1.00 25.94 C ATOM 360 O ALA A 41 9.894 2.217 46.969 1.00 25.67 O ATOM 361 CB ALA A 41 11.067 4.768 46.039 1.00 27.03 C ATOM 362 H ALA A 41 12.784 3.355 47.365 1.00 0.00 H ATOM 363 N CYS A 42 8.822 3.540 48.450 1.00 24.70 N ATOM 364 CA CYS A 42 7.751 2.610 48.740 1.00 23.96 C ATOM 365 C CYS A 42 6.482 3.075 48.044 1.00 22.84 C ATOM 366 O CYS A 42 5.835 4.028 48.472 1.00 22.75 O ATOM 367 CB CYS A 42 7.552 2.496 50.260 1.00 24.15 C ATOM 368 SG CYS A 42 9.081 1.954 51.087 1.00 27.12 S ATOM 369 H CYS A 42 8.823 4.461 48.933 1.00 0.00 H ATOM 370 N PHE A 43 6.155 2.397 46.955 1.00 22.68 N ATOM 371 CA PHE A 43 4.947 2.689 46.196 1.00 21.74 C ATOM 372 C PHE A 43 3.839 1.841 46.784 1.00 21.47 C ATOM 373 O PHE A 43 3.948 0.617 46.821 1.00 21.49 O ATOM 374 CB PHE A 43 5.173 2.384 44.718 1.00 22.35 C ATOM 375 CG PHE A 43 6.210 3.272 44.072 1.00 21.05 C ATOM 376 CD1 PHE A 43 5.835 4.444 43.438 1.00 22.01 C ATOM 377 CD2 PHE A 43 7.558 2.920 44.094 1.00 21.92 C ATOM 378 CE1 PHE A 43 6.785 5.277 42.836 1.00 23.20 C ATOM 379 CE2 PHE A 43 8.517 3.740 43.513 1.00 21.04 C ATOM 380 CZ PHE A 43 8.139 4.914 42.874 1.00 22.64 C ATOM 381 H PHE A 43 6.781 1.632 46.631 1.00 0.00 H ATOM 382 N ILE A 44 2.777 2.495 47.253 1.00 20.88 N ATOM 383 CA ILE A 44 1.763 1.820 48.061 1.00 20.74 C ATOM 384 C ILE A 44 0.325 1.975 47.532 1.00 21.01 C ATOM 385 O ILE A 44 -0.125 3.078 47.251 1.00 20.41 O ATOM 386 CB ILE A 44 1.836 2.301 49.535 1.00 20.97 C ATOM 387 CG1 ILE A 44 3.221 1.989 50.135 1.00 21.27 C ATOM 388 CG2 ILE A 44 0.744 1.638 50.371 1.00 19.89 C ATOM 389 CD1 ILE A 44 3.509 2.702 51.459 1.00 24.76 C ATOM 390 H ILE A 44 2.667 3.507 47.040 1.00 0.00 H ATOM 391 N ALA A 45 -0.364 0.848 47.397 1.00 21.09 N ATOM 392 CA ALA A 45 -1.805 0.822 47.142 1.00 22.29 C ATOM 393 C ALA A 45 -2.481 0.275 48.385 1.00 22.72 C ATOM 394 O ALA A 45 -2.249 -0.878 48.762 1.00 22.42 O ATOM 395 CB ALA A 45 -2.134 -0.052 45.930 1.00 21.39 C ATOM 396 H ALA A 45 0.143 -0.057 47.476 1.00 0.00 H ATOM 397 N VAL A 46 -3.286 1.116 49.025 1.00 24.06 N ATOM 398 CA VAL A 46 -4.088 0.710 50.178 1.00 25.35 C ATOM 399 C VAL A 46 -5.346 0.040 49.625 1.00 26.17 C ATOM 400 O VAL A 46 -6.043 0.613 48.789 1.00 25.75 O ATOM 401 CB VAL A 46 -4.451 1.910 51.065 1.00 25.50 C ATOM 402 CG1 VAL A 46 -5.134 1.446 52.356 1.00 25.55 C ATOM 403 CG2 VAL A 46 -3.200 2.729 51.384 1.00 26.24 C ATOM 404 H VAL A 46 -3.348 2.100 48.693 1.00 0.00 H ATOM 405 N GLU A 47 -5.607 -1.177 50.088 1.00 27.62 N ATOM 406 CA GLU A 47 -6.584 -2.063 49.452 1.00 28.76 C ATOM 407 C GLU A 47 -7.873 -2.175 50.252 1.00 29.56 C ATOM 408 O GLU A 47 -7.904 -1.827 51.425 1.00 29.55 O ATOM 409 CB GLU A 47 -5.968 -3.446 49.246 1.00 28.72 C ATOM 410 CG GLU A 47 -4.837 -3.458 48.228 1.00 29.36 C ATOM 411 CD GLU A 47 -4.333 -4.850 47.912 1.00 29.98 C ATOM 412 OE1 GLU A 47 -3.762 -5.493 48.807 1.00 30.85 O ATOM 413 OE2 GLU A 47 -4.494 -5.301 46.760 1.00 32.32 O ATOM 414 H GLU A 47 -5.100 -1.512 50.932 1.00 0.00 H ATOM 415 N ARG A 48 -8.935 -2.667 49.613 1.00 31.30 N ATOM 416 CA ARG A 48 -10.244 -2.785 50.270 1.00 32.82 C ATOM 417 C ARG A 48 -10.140 -3.624 51.543 1.00 33.86 C ATOM 418 O ARG A 48 -10.696 -3.248 52.575 1.00 34.08 O ATOM 419 CB ARG A 48 -11.290 -3.369 49.313 1.00 32.58 C ATOM 420 CG ARG A 48 -12.714 -3.409 49.869 1.00 33.47 C ATOM 421 CD ARG A 48 -13.760 -3.679 48.783 1.00 33.19 C ATOM 422 NE ARG A 48 -13.471 -4.858 47.963 1.00 33.74 N ATOM 423 CZ ARG A 48 -13.855 -6.100 48.255 1.00 35.20 C ATOM 424 NH1 ARG A 48 -14.544 -6.347 49.363 1.00 35.87 N ATOM 425 NH2 ARG A 48 -13.546 -7.105 47.438 1.00 35.27 N ATOM 426 HE ARG A 48 -12.926 -4.715 47.089 1.00 0.00 H ATOM 427 HH12 ARG A 48 -14.841 -7.319 49.585 1.00 0.00 H ATOM 428 HH11 ARG A 48 -14.787 -5.569 50.009 1.00 0.00 H ATOM 429 HH22 ARG A 48 -13.847 -8.074 47.668 1.00 0.00 H ATOM 430 HH21 ARG A 48 -13.004 -6.921 46.570 1.00 0.00 H ATOM 431 H ARG A 48 -8.834 -2.975 48.625 1.00 0.00 H ATOM 432 N GLU A 49 -9.405 -4.735 51.473 1.00 35.55 N ATOM 433 CA GLU A 49 -9.166 -5.590 52.642 1.00 37.16 C ATOM 434 C GLU A 49 -8.504 -4.850 53.812 1.00 37.69 C ATOM 435 O GLU A 49 -8.687 -5.228 54.975 1.00 38.05 O ATOM 436 CB GLU A 49 -8.371 -6.845 52.254 1.00 37.54 C ATOM 437 CG GLU A 49 -9.252 -7.972 51.709 1.00 40.22 C ATOM 438 CD GLU A 49 -8.476 -9.136 51.090 1.00 43.94 C ATOM 439 OE1 GLU A 49 -7.224 -9.166 51.180 1.00 46.74 O ATOM 440 OE2 GLU A 49 -9.130 -10.031 50.503 1.00 45.77 O ATOM 441 H GLU A 49 -8.987 -5.004 50.559 1.00 0.00 H ATOM 442 N ASP A 50 -7.778 -3.774 53.502 1.00 38.26 N ATOM 443 CA ASP A 50 -7.112 -2.940 54.507 1.00 38.41 C ATOM 444 C ASP A 50 -8.089 -2.131 55.358 1.00 39.11 C ATOM 445 O ASP A 50 -7.740 -1.676 56.453 1.00 38.81 O ATOM 446 CB ASP A 50 -6.158 -1.954 53.837 1.00 38.12 C ATOM 447 CG ASP A 50 -4.966 -2.623 53.190 1.00 38.35 C ATOM 448 OD1 ASP A 50 -4.716 -3.827 53.438 1.00 37.01 O ATOM 449 OD2 ASP A 50 -4.262 -1.913 52.439 1.00 36.93 O ATOM 450 H ASP A 50 -7.680 -3.515 52.500 1.00 0.00 H ATOM 451 N GLU A 51 -9.301 -1.930 54.847 1.00 39.76 N ATOM 452 CA GLU A 51 -10.308 -1.159 55.577 1.00 40.73 C ATOM 453 C GLU A 51 -10.806 -1.890 56.835 1.00 40.88 C ATOM 454 O GLU A 51 -11.319 -1.256 57.762 1.00 40.91 O ATOM 455 CB GLU A 51 -11.487 -0.814 54.678 1.00 40.79 C ATOM 456 CG GLU A 51 -11.748 0.676 54.579 1.00 42.19 C ATOM 457 CD GLU A 51 -11.616 1.185 53.161 1.00 43.64 C ATOM 458 OE1 GLU A 51 -11.554 0.355 52.227 1.00 45.95 O ATOM 459 OE2 GLU A 51 -11.598 2.412 52.975 1.00 44.08 O ATOM 460 H GLU A 51 -9.536 -2.327 53.915 1.00 0.00 H ATOM 461 N ASN A 52 -10.654 -3.216 56.851 1.00 41.38 N ATOM 462 CA ASN A 52 -10.945 -4.040 58.030 1.00 41.64 C ATOM 463 C ASN A 52 -10.204 -3.531 59.266 1.00 41.19 C ATOM 464 O ASN A 52 -10.744 -3.565 60.376 1.00 41.39 O ATOM 465 CB ASN A 52 -10.584 -5.515 57.784 1.00 42.21 C ATOM 466 CG ASN A 52 -11.349 -6.135 56.618 1.00 44.23 C ATOM 467 OD1 ASN A 52 -11.541 -5.504 55.573 1.00 47.67 O ATOM 468 ND2 ASN A 52 -11.785 -7.381 56.792 1.00 45.46 N ATOM 469 HD22 ASN A 52 -11.601 -7.876 57.688 1.00 0.00 H ATOM 470 HD21 ASN A 52 -12.309 -7.859 56.032 1.00 0.00 H ATOM 471 H ASN A 52 -10.314 -3.687 55.988 1.00 0.00 H ATOM 472 N ASN A 53 -8.974 -3.048 59.062 1.00 40.16 N ATOM 473 CA ASN A 53 -8.145 -2.528 60.149 1.00 39.12 C ATOM 474 C ASN A 53 -7.052 -1.565 59.638 1.00 38.52 C ATOM 475 O ASN A 53 -5.902 -1.974 59.452 1.00 38.40 O ATOM 476 CB ASN A 53 -7.537 -3.700 60.933 1.00 39.15 C ATOM 477 CG ASN A 53 -6.713 -3.254 62.131 1.00 38.19 C ATOM 478 OD1 ASN A 53 -6.671 -2.071 62.482 1.00 37.10 O ATOM 479 ND2 ASN A 53 -6.038 -4.210 62.757 1.00 39.36 N ATOM 480 HD22 ASN A 53 -6.103 -5.194 62.427 1.00 0.00 H ATOM 481 HD21 ASN A 53 -5.444 -3.975 63.578 1.00 0.00 H ATOM 482 H ASN A 53 -8.593 -3.042 58.094 1.00 0.00 H ATOM 483 N PRO A 54 -7.414 -0.285 59.403 1.00 37.90 N ATOM 484 CA PRO A 54 -6.446 0.671 58.842 1.00 37.19 C ATOM 485 C PRO A 54 -5.231 0.896 59.742 1.00 36.63 C ATOM 486 O PRO A 54 -4.109 1.019 59.241 1.00 35.83 O ATOM 487 CB PRO A 54 -7.255 1.965 58.689 1.00 37.25 C ATOM 488 CG PRO A 54 -8.529 1.751 59.452 1.00 37.63 C ATOM 489 CD PRO A 54 -8.773 0.284 59.480 1.00 37.86 C ATOM 490 N GLU A 55 -5.458 0.935 61.055 1.00 35.72 N ATOM 491 CA GLU A 55 -4.376 1.124 62.014 1.00 35.24 C ATOM 492 C GLU A 55 -3.415 -0.063 62.010 1.00 34.15 C ATOM 493 O GLU A 55 -2.204 0.125 62.048 1.00 33.95 O ATOM 494 CB GLU A 55 -4.936 1.357 63.421 1.00 35.70 C ATOM 495 CG GLU A 55 -5.873 2.561 63.526 1.00 38.16 C ATOM 496 CD GLU A 55 -5.149 3.869 63.795 1.00 40.96 C ATOM 497 OE1 GLU A 55 -3.925 3.946 63.544 1.00 43.33 O ATOM 498 OE2 GLU A 55 -5.809 4.831 64.257 1.00 40.91 O ATOM 499 H GLU A 55 -6.432 0.828 61.404 1.00 0.00 H ATOM 500 N GLY A 56 -3.963 -1.279 61.962 1.00 32.90 N ATOM 501 CA GLY A 56 -3.150 -2.495 61.893 1.00 31.30 C ATOM 502 C GLY A 56 -2.373 -2.593 60.590 1.00 30.68 C ATOM 503 O GLY A 56 -1.244 -3.106 60.561 1.00 30.35 O ATOM 504 H GLY A 56 -4.999 -1.366 61.974 1.00 0.00 H ATOM 505 N THR A 57 -2.987 -2.093 59.519 1.00 29.51 N ATOM 506 CA THR A 57 -2.388 -2.080 58.181 1.00 29.15 C ATOM 507 C THR A 57 -1.149 -1.194 58.144 1.00 28.88 C ATOM 508 O THR A 57 -0.127 -1.588 57.583 1.00 28.78 O ATOM 509 CB THR A 57 -3.418 -1.658 57.122 1.00 29.02 C ATOM 510 OG1 THR A 57 -4.509 -2.583 57.148 1.00 29.71 O ATOM 511 CG2 THR A 57 -2.807 -1.636 55.702 1.00 28.92 C ATOM 512 HG1 THR A 57 -4.926 -2.574 58.046 1.00 0.00 H ATOM 513 H THR A 57 -3.939 -1.692 59.638 1.00 0.00 H ATOM 514 N ALA A 58 -1.240 -0.022 58.771 1.00 29.07 N ATOM 515 CA ALA A 58 -0.125 0.930 58.842 1.00 28.96 C ATOM 516 C ALA A 58 1.044 0.367 59.640 1.00 29.34 C ATOM 517 O ALA A 58 2.199 0.582 59.280 1.00 28.77 O ATOM 518 CB ALA A 58 -0.581 2.237 59.435 1.00 29.32 C ATOM 519 H ALA A 58 -2.139 0.229 59.230 1.00 0.00 H ATOM 520 N ILE A 59 0.730 -0.346 60.724 1.00 29.12 N ATOM 521 CA ILE A 59 1.727 -1.076 61.506 1.00 29.11 C ATOM 522 C ILE A 59 2.357 -2.213 60.701 1.00 28.32 C ATOM 523 O ILE A 59 3.582 -2.356 60.664 1.00 28.11 O ATOM 524 CB ILE A 59 1.115 -1.672 62.801 1.00 29.31 C ATOM 525 CG1 ILE A 59 0.460 -0.585 63.664 1.00 30.07 C ATOM 526 CG2 ILE A 59 2.190 -2.416 63.609 1.00 30.27 C ATOM 527 CD1 ILE A 59 1.442 0.384 64.310 1.00 32.78 C ATOM 528 H ILE A 59 -0.265 -0.384 61.025 1.00 0.00 H ATOM 529 N GLY A 60 1.510 -3.032 60.085 1.00 28.08 N ATOM 530 CA GLY A 60 1.963 -4.102 59.201 1.00 28.09 C ATOM 531 C GLY A 60 2.855 -3.571 58.093 1.00 27.74 C ATOM 532 O GLY A 60 3.849 -4.198 57.740 1.00 27.88 O ATOM 533 H GLY A 60 0.489 -2.906 60.238 1.00 0.00 H ATOM 534 N ALA A 61 2.499 -2.413 57.540 1.00 27.51 N ATOM 535 CA ALA A 61 3.306 -1.758 56.494 1.00 27.03 C ATOM 536 C ALA A 61 4.695 -1.322 56.975 1.00 27.32 C ATOM 537 O ALA A 61 5.718 -1.601 56.325 1.00 25.97 O ATOM 538 CB ALA A 61 2.551 -0.560 55.934 1.00 27.27 C ATOM 539 H ALA A 61 1.621 -1.955 57.857 1.00 0.00 H ATOM 540 N VAL A 62 4.722 -0.604 58.100 1.00 27.55 N ATOM 541 CA VAL A 62 5.982 -0.154 58.701 1.00 28.21 C ATOM 542 C VAL A 62 6.861 -1.356 59.061 1.00 28.71 C ATOM 543 O VAL A 62 8.058 -1.350 58.805 1.00 28.46 O ATOM 544 CB VAL A 62 5.740 0.736 59.950 1.00 28.10 C ATOM 545 CG1 VAL A 62 7.062 1.131 60.593 1.00 28.01 C ATOM 546 CG2 VAL A 62 4.963 1.983 59.561 1.00 28.03 C ATOM 547 H VAL A 62 3.824 -0.357 58.563 1.00 0.00 H ATOM 548 N GLU A 63 6.246 -2.389 59.632 1.00 29.84 N ATOM 549 CA GLU A 63 6.955 -3.620 59.986 1.00 31.35 C ATOM 550 C GLU A 63 7.706 -4.193 58.766 1.00 31.54 C ATOM 551 O GLU A 63 8.898 -4.494 58.848 1.00 31.06 O ATOM 552 CB GLU A 63 5.954 -4.619 60.563 1.00 31.85 C ATOM 553 CG GLU A 63 6.514 -5.841 61.259 1.00 35.30 C ATOM 554 CD GLU A 63 5.394 -6.750 61.760 1.00 39.67 C ATOM 555 OE1 GLU A 63 4.795 -6.436 62.815 1.00 41.57 O ATOM 556 OE2 GLU A 63 5.100 -7.769 61.087 1.00 41.78 O ATOM 557 H GLU A 63 5.228 -2.319 59.833 1.00 0.00 H ATOM 558 N GLU A 64 7.018 -4.295 57.629 1.00 31.58 N ATOM 559 CA GLU A 64 7.628 -4.814 56.402 1.00 32.12 C ATOM 560 C GLU A 64 8.680 -3.886 55.791 1.00 31.48 C ATOM 561 O GLU A 64 9.712 -4.359 55.313 1.00 31.66 O ATOM 562 CB GLU A 64 6.556 -5.135 55.358 1.00 32.75 C ATOM 563 CG GLU A 64 7.116 -5.743 54.072 1.00 35.84 C ATOM 564 CD GLU A 64 7.605 -7.154 54.271 1.00 39.67 C ATOM 565 OE1 GLU A 64 6.756 -8.038 54.524 1.00 41.63 O ATOM 566 OE2 GLU A 64 8.835 -7.376 54.168 1.00 41.69 O ATOM 567 H GLU A 64 6.021 -3.998 57.612 1.00 0.00 H ATOM 568 N ILE A 65 8.404 -2.580 55.781 1.00 31.02 N ATOM 569 CA ILE A 65 9.367 -1.574 55.316 1.00 30.62 C ATOM 570 C ILE A 65 10.654 -1.657 56.143 1.00 31.32 C ATOM 571 O ILE A 65 11.756 -1.644 55.590 1.00 31.10 O ATOM 572 CB ILE A 65 8.778 -0.127 55.369 1.00 30.55 C ATOM 573 CG1 ILE A 65 7.679 0.057 54.308 1.00 29.56 C ATOM 574 CG2 ILE A 65 9.886 0.947 55.211 1.00 29.84 C ATOM 575 CD1 ILE A 65 6.868 1.342 54.447 1.00 27.66 C ATOM 576 H ILE A 65 7.472 -2.263 56.115 1.00 0.00 H ATOM 577 N GLU A 66 10.503 -1.743 57.466 1.00 31.66 N ATOM 578 CA GLU A 66 11.649 -1.921 58.354 1.00 31.99 C ATOM 579 C GLU A 66 12.424 -3.185 58.003 1.00 32.39 C ATOM 580 O GLU A 66 13.649 -3.152 57.914 1.00 32.38 O ATOM 581 CB GLU A 66 11.212 -1.966 59.816 1.00 31.83 C ATOM 582 CG GLU A 66 10.796 -0.628 60.397 1.00 30.88 C ATOM 583 CD GLU A 66 11.159 -0.502 61.876 1.00 29.98 C ATOM 584 OE1 GLU A 66 10.287 -0.755 62.724 1.00 31.59 O ATOM 585 OE2 GLU A 66 12.307 -0.154 62.186 1.00 29.08 O ATOM 586 H GLU A 66 9.548 -1.682 57.874 1.00 0.00 H ATOM 587 N LYS A 67 11.704 -4.286 57.786 1.00 33.07 N ATOM 588 CA LYS A 67 12.319 -5.574 57.464 1.00 33.86 C ATOM 589 C LYS A 67 13.267 -5.425 56.273 1.00 33.91 C ATOM 590 O LYS A 67 14.445 -5.794 56.356 1.00 33.77 O ATOM 591 CB LYS A 67 11.246 -6.646 57.215 1.00 34.24 C ATOM 592 CG LYS A 67 11.765 -8.082 57.199 1.00 36.00 C ATOM 593 CD LYS A 67 10.680 -9.053 56.748 1.00 39.50 C ATOM 594 CE LYS A 67 11.243 -10.454 56.481 1.00 41.42 C ATOM 595 NZ LYS A 67 11.365 -11.268 57.728 1.00 42.53 N ATOM 596 HZ1 LYS A 67 12.003 -10.787 58.393 1.00 0.00 H ATOM 597 HZ2 LYS A 67 10.427 -11.377 58.163 1.00 0.00 H ATOM 598 HZ3 LYS A 67 11.750 -12.205 57.493 1.00 0.00 H ATOM 599 H LYS A 67 10.668 -4.227 57.848 1.00 0.00 H ATOM 600 N VAL A 68 12.764 -4.828 55.195 1.00 34.18 N ATOM 601 CA VAL A 68 13.567 -4.554 53.997 1.00 34.07 C ATOM 602 C VAL A 68 14.605 -3.451 54.215 1.00 34.59 C ATOM 603 O VAL A 68 15.759 -3.584 53.788 1.00 34.89 O ATOM 604 CB VAL A 68 12.675 -4.197 52.777 1.00 33.77 C ATOM 605 CG1 VAL A 68 13.519 -3.747 51.591 1.00 33.06 C ATOM 606 CG2 VAL A 68 11.787 -5.377 52.397 1.00 32.90 C ATOM 607 H VAL A 68 11.763 -4.545 55.202 1.00 0.00 H ATOM 608 N ALA A 69 14.208 -2.366 54.874 1.00 35.04 N ATOM 609 CA ALA A 69 15.112 -1.232 55.057 1.00 35.67 C ATOM 610 C ALA A 69 16.282 -1.560 55.992 1.00 36.49 C ATOM 611 O ALA A 69 17.378 -1.020 55.821 1.00 36.38 O ATOM 612 CB ALA A 69 14.363 -0.005 55.536 1.00 35.74 C ATOM 613 H ALA A 69 13.244 -2.324 55.263 1.00 0.00 H ATOM 614 N ASN A 70 16.042 -2.434 56.971 1.00 37.11 N ATOM 615 CA ASN A 70 17.111 -2.939 57.838 1.00 38.28 C ATOM 616 C ASN A 70 18.044 -3.886 57.086 1.00 39.01 C ATOM 617 O ASN A 70 19.241 -3.897 57.342 1.00 39.39 O ATOM 618 CB ASN A 70 16.550 -3.643 59.079 1.00 37.82 C ATOM 619 CG ASN A 70 15.916 -2.683 60.081 1.00 37.51 C ATOM 620 OD1 ASN A 70 15.261 -3.121 61.028 1.00 36.55 O ATOM 621 ND2 ASN A 70 16.112 -1.379 59.886 1.00 37.37 N ATOM 622 HD22 ASN A 70 16.672 -1.053 59.073 1.00 0.00 H ATOM 623 HD21 ASN A 70 15.705 -0.687 60.547 1.00 0.00 H ATOM 624 H ASN A 70 15.069 -2.767 57.124 1.00 0.00 H ATOM 625 N GLN A 71 17.489 -4.673 56.161 1.00 40.43 N ATOM 626 CA GLN A 71 18.282 -5.569 55.306 1.00 41.36 C ATOM 627 C GLN A 71 19.144 -4.801 54.289 1.00 41.65 C ATOM 628 O GLN A 71 20.145 -5.325 53.791 1.00 42.11 O ATOM 629 CB GLN A 71 17.389 -6.608 54.603 1.00 41.70 C ATOM 630 CG GLN A 71 18.144 -7.500 53.604 1.00 43.41 C ATOM 631 CD GLN A 71 17.419 -8.789 53.245 1.00 46.21 C ATOM 632 OE1 GLN A 71 16.192 -8.821 53.100 1.00 47.62 O ATOM 633 NE2 GLN A 71 18.186 -9.864 53.085 1.00 47.03 N ATOM 634 HE22 GLN A 71 19.215 -9.793 53.217 1.00 0.00 H ATOM 635 HE21 GLN A 71 17.757 -10.776 52.828 1.00 0.00 H ATOM 636 H GLN A 71 16.456 -4.651 56.041 1.00 0.00 H ATOM 637 N LEU A 72 18.751 -3.567 53.986 1.00 41.71 N ATOM 638 CA LEU A 72 19.518 -2.698 53.091 1.00 41.74 C ATOM 639 C LEU A 72 20.227 -1.608 53.897 1.00 41.62 C ATOM 640 O LEU A 72 21.035 -0.841 53.361 1.00 41.57 O ATOM 641 CB LEU A 72 18.592 -2.066 52.046 1.00 41.75 C ATOM 642 CG LEU A 72 18.014 -2.799 50.821 1.00 42.35 C ATOM 643 CD1 LEU A 72 17.758 -4.294 51.013 1.00 42.56 C ATOM 644 CD2 LEU A 72 16.731 -2.105 50.381 1.00 41.99 C ATOM 645 H LEU A 72 17.867 -3.206 54.399 1.00 0.00 H ATOM 646 N LYS A 73 19.920 -1.567 55.193 1.00 41.69 N ATOM 647 CA LYS A 73 20.426 -0.545 56.126 1.00 41.91 C ATOM 648 C LYS A 73 20.240 0.875 55.574 1.00 41.55 C ATOM 649 O LYS A 73 21.161 1.700 55.599 1.00 41.46 O ATOM 650 CB LYS A 73 21.884 -0.821 56.538 1.00 42.26 C ATOM 651 CG LYS A 73 22.099 -2.180 57.206 1.00 43.77 C ATOM 652 CD LYS A 73 22.400 -3.267 56.178 1.00 45.00 C ATOM 653 CE LYS A 73 22.143 -4.656 56.748 1.00 46.62 C ATOM 654 NZ LYS A 73 22.246 -5.700 55.697 1.00 47.28 N ATOM 655 HZ1 LYS A 73 21.543 -5.512 54.954 1.00 0.00 H ATOM 656 HZ2 LYS A 73 23.201 -5.683 55.285 1.00 0.00 H ATOM 657 HZ3 LYS A 73 22.066 -6.633 56.118 1.00 0.00 H ATOM 658 H LYS A 73 19.285 -2.300 55.568 1.00 0.00 H ATOM 659 N VAL A 74 19.030 1.133 55.070 1.00 40.86 N ATOM 660 CA VAL A 74 18.642 2.443 54.552 1.00 40.14 C ATOM 661 C VAL A 74 17.784 3.142 55.598 1.00 39.62 C ATOM 662 O VAL A 74 16.958 2.503 56.265 1.00 39.88 O ATOM 663 CB VAL A 74 17.853 2.312 53.227 1.00 40.46 C ATOM 664 CG1 VAL A 74 17.478 3.690 52.665 1.00 40.48 C ATOM 665 CG2 VAL A 74 18.658 1.531 52.208 1.00 40.67 C ATOM 666 H VAL A 74 18.330 0.364 55.045 1.00 0.00 H ATOM 667 N ASN A 75 17.985 4.448 55.748 1.00 38.60 N ATOM 668 CA ASN A 75 17.251 5.236 56.735 1.00 37.76 C ATOM 669 C ASN A 75 16.280 6.208 56.069 1.00 36.51 C ATOM 670 O ASN A 75 15.400 6.769 56.733 1.00 36.05 O ATOM 671 CB ASN A 75 18.230 5.996 57.644 1.00 38.36 C ATOM 672 CG ASN A 75 17.548 6.632 58.848 1.00 40.38 C ATOM 673 OD1 ASN A 75 16.854 5.953 59.615 1.00 43.91 O ATOM 674 ND2 ASN A 75 17.749 7.938 59.029 1.00 42.06 N ATOM 675 HD22 ASN A 75 18.340 8.471 58.359 1.00 0.00 H ATOM 676 HD21 ASN A 75 17.315 8.424 59.840 1.00 0.00 H ATOM 677 H ASN A 75 18.686 4.923 55.144 1.00 0.00 H ATOM 678 N ASN A 76 16.450 6.394 54.757 1.00 34.85 N ATOM 679 CA ASN A 76 15.631 7.314 53.973 1.00 33.45 C ATOM 680 C ASN A 76 14.482 6.572 53.297 1.00 32.37 C ATOM 681 O ASN A 76 14.698 5.577 52.603 1.00 32.20 O ATOM 682 CB ASN A 76 16.481 8.049 52.928 1.00 33.51 C ATOM 683 CG ASN A 76 17.607 8.873 53.554 1.00 34.09 C ATOM 684 OD1 ASN A 76 17.551 9.227 54.731 1.00 31.92 O ATOM 685 ND2 ASN A 76 18.630 9.192 52.755 1.00 34.80 N ATOM 686 HD22 ASN A 76 18.637 8.871 51.766 1.00 0.00 H ATOM 687 HD21 ASN A 76 19.419 9.761 53.123 1.00 0.00 H ATOM 688 H ASN A 76 17.199 5.860 54.272 1.00 0.00 H ATOM 689 N ILE A 77 13.265 7.053 53.518 1.00 31.12 N ATOM 690 CA ILE A 77 12.061 6.380 53.016 1.00 29.60 C ATOM 691 C ILE A 77 11.184 7.395 52.288 1.00 28.46 C ATOM 692 O ILE A 77 10.941 8.498 52.801 1.00 28.43 O ATOM 693 CB ILE A 77 11.226 5.729 54.188 1.00 29.64 C ATOM 694 CG1 ILE A 77 12.064 4.778 55.078 1.00 29.20 C ATOM 695 CG2 ILE A 77 9.954 5.027 53.664 1.00 29.61 C ATOM 696 CD1 ILE A 77 12.688 3.545 54.381 1.00 28.31 C ATOM 697 H ILE A 77 13.161 7.933 54.063 1.00 0.00 H ATOM 698 N VAL A 78 10.707 7.027 51.098 1.00 27.22 N ATOM 699 CA VAL A 78 9.637 7.769 50.441 1.00 25.15 C ATOM 700 C VAL A 78 8.347 6.947 50.450 1.00 24.47 C ATOM 701 O VAL A 78 8.350 5.783 50.062 1.00 23.45 O ATOM 702 CB VAL A 78 9.988 8.174 48.996 1.00 25.90 C ATOM 703 CG1 VAL A 78 8.826 8.936 48.366 1.00 24.74 C ATOM 704 CG2 VAL A 78 11.241 9.053 48.976 1.00 25.00 C ATOM 705 H VAL A 78 11.108 6.191 50.627 1.00 0.00 H ATOM 706 N VAL A 79 7.272 7.563 50.935 1.00 23.84 N ATOM 707 CA VAL A 79 5.937 6.963 50.973 1.00 23.56 C ATOM 708 C VAL A 79 5.183 7.549 49.766 1.00 23.08 C ATOM 709 O VAL A 79 4.814 8.718 49.752 1.00 22.83 O ATOM 710 CB VAL A 79 5.232 7.266 52.336 1.00 23.92 C ATOM 711 CG1 VAL A 79 3.760 6.858 52.318 1.00 23.01 C ATOM 712 CG2 VAL A 79 5.959 6.551 53.475 1.00 24.25 C ATOM 713 H VAL A 79 7.387 8.527 51.309 1.00 0.00 H ATOM 714 N TYR A 80 4.998 6.734 48.738 1.00 22.90 N ATOM 715 CA TYR A 80 4.508 7.237 47.460 1.00 23.25 C ATOM 716 C TYR A 80 3.200 6.540 47.111 1.00 23.32 C ATOM 717 O TYR A 80 3.206 5.355 46.793 1.00 23.42 O ATOM 718 CB TYR A 80 5.560 7.004 46.372 1.00 22.48 C ATOM 719 CG TYR A 80 5.387 7.872 45.135 1.00 22.82 C ATOM 720 CD1 TYR A 80 4.327 7.661 44.247 1.00 19.76 C ATOM 721 CD2 TYR A 80 6.302 8.880 44.838 1.00 23.09 C ATOM 722 CE1 TYR A 80 4.172 8.445 43.105 1.00 21.53 C ATOM 723 CE2 TYR A 80 6.154 9.683 43.692 1.00 23.09 C ATOM 724 CZ TYR A 80 5.091 9.454 42.832 1.00 22.40 C ATOM 725 OH TYR A 80 4.936 10.243 41.709 1.00 23.59 O ATOM 726 HH TYR A 80 4.134 9.948 41.208 1.00 0.00 H ATOM 727 H TYR A 80 5.205 5.720 48.844 1.00 0.00 H ATOM 728 N PRO A 81 2.070 7.267 47.195 1.00 23.76 N ATOM 729 CA PRO A 81 0.804 6.630 46.893 1.00 23.85 C ATOM 730 C PRO A 81 0.836 6.123 45.462 1.00 23.82 C ATOM 731 O PRO A 81 1.296 6.841 44.561 1.00 23.39 O ATOM 732 CB PRO A 81 -0.207 7.765 47.042 1.00 23.70 C ATOM 733 CG PRO A 81 0.472 8.777 47.897 1.00 24.09 C ATOM 734 CD PRO A 81 1.905 8.678 47.582 1.00 23.90 C ATOM 735 N TYR A 82 0.384 4.889 45.254 1.00 23.92 N ATOM 736 CA TYR A 82 0.383 4.323 43.904 1.00 24.12 C ATOM 737 C TYR A 82 -0.749 3.333 43.703 1.00 24.04 C ATOM 738 O TYR A 82 -0.563 2.131 43.848 1.00 23.67 O ATOM 739 CB TYR A 82 1.747 3.726 43.537 1.00 24.30 C ATOM 740 CG TYR A 82 2.111 4.012 42.110 1.00 26.52 C ATOM 741 CD1 TYR A 82 2.498 5.291 41.723 1.00 27.14 C ATOM 742 CD2 TYR A 82 2.046 3.020 41.137 1.00 29.06 C ATOM 743 CE1 TYR A 82 2.815 5.576 40.413 1.00 28.89 C ATOM 744 CE2 TYR A 82 2.364 3.301 39.804 1.00 29.41 C ATOM 745 CZ TYR A 82 2.749 4.582 39.456 1.00 30.37 C ATOM 746 OH TYR A 82 3.073 4.886 38.150 1.00 31.72 O ATOM 747 HH TYR A 82 3.323 5.842 38.087 1.00 0.00 H ATOM 748 H TYR A 82 0.030 4.325 46.053 1.00 0.00 H ATOM 749 N ALA A 83 -1.918 3.870 43.358 1.00 24.02 N ATOM 750 CA ALA A 83 -3.150 3.092 43.237 1.00 25.06 C ATOM 751 C ALA A 83 -3.077 1.945 42.231 1.00 25.51 C ATOM 752 O ALA A 83 -3.681 0.885 42.448 1.00 25.48 O ATOM 753 CB ALA A 83 -4.341 4.012 42.936 1.00 24.81 C ATOM 754 H ALA A 83 -1.956 4.891 43.166 1.00 0.00 H ATOM 755 N HIS A 84 -2.303 2.145 41.162 1.00 26.06 N ATOM 756 CA HIS A 84 -2.154 1.153 40.094 1.00 26.97 C ATOM 757 C HIS A 84 -1.611 -0.215 40.509 1.00 27.27 C ATOM 758 O HIS A 84 -1.686 -1.167 39.727 1.00 27.56 O ATOM 759 CB HIS A 84 -1.308 1.727 38.953 1.00 27.38 C ATOM 760 CG HIS A 84 -1.988 2.823 38.205 1.00 28.47 C ATOM 761 ND1 HIS A 84 -1.303 3.855 37.604 1.00 32.08 N ATOM 762 CD2 HIS A 84 -3.302 3.067 37.987 1.00 30.84 C ATOM 763 CE1 HIS A 84 -2.164 4.670 37.022 1.00 30.33 C ATOM 764 NE2 HIS A 84 -3.382 4.214 37.239 1.00 31.22 N ATOM 765 H HIS A 84 -1.784 3.043 41.084 1.00 0.00 H ATOM 766 N LEU A 85 -1.085 -0.333 41.729 1.00 27.61 N ATOM 767 CA LEU A 85 -0.590 -1.630 42.201 1.00 28.06 C ATOM 768 C LEU A 85 -1.698 -2.600 42.617 1.00 28.66 C ATOM 769 O LEU A 85 -1.437 -3.778 42.843 1.00 28.13 O ATOM 770 CB LEU A 85 0.430 -1.472 43.327 1.00 28.02 C ATOM 771 CG LEU A 85 1.707 -0.729 42.956 1.00 28.34 C ATOM 772 CD1 LEU A 85 2.510 -0.425 44.213 1.00 27.91 C ATOM 773 CD2 LEU A 85 2.554 -1.511 41.941 1.00 28.91 C ATOM 774 H LEU A 85 -1.026 0.500 42.349 1.00 0.00 H ATOM 775 N SER A 86 -2.930 -2.109 42.709 1.00 29.66 N ATOM 776 CA SER A 86 -4.064 -2.965 43.060 1.00 30.63 C ATOM 777 C SER A 86 -5.318 -2.612 42.267 1.00 31.03 C ATOM 778 O SER A 86 -5.514 -1.466 41.881 1.00 30.45 O ATOM 779 CB SER A 86 -4.336 -2.877 44.561 1.00 30.72 C ATOM 780 OG SER A 86 -5.445 -3.671 44.944 1.00 31.59 O ATOM 781 HG SER A 86 -5.588 -3.587 45.920 1.00 0.00 H ATOM 782 H SER A 86 -3.091 -1.098 42.528 1.00 0.00 H ATOM 783 N SER A 87 -6.157 -3.615 42.032 1.00 32.04 N ATOM 784 CA SER A 87 -7.437 -3.419 41.369 1.00 33.31 C ATOM 785 C SER A 87 -8.610 -3.376 42.347 1.00 33.20 C ATOM 786 O SER A 87 -9.756 -3.198 41.931 1.00 34.22 O ATOM 787 CB SER A 87 -7.668 -4.531 40.348 1.00 33.63 C ATOM 788 OG SER A 87 -6.649 -4.500 39.372 1.00 36.87 O ATOM 789 HG SER A 87 -6.803 -5.222 38.713 1.00 0.00 H ATOM 790 H SER A 87 -5.889 -4.574 42.333 1.00 0.00 H ATOM 791 N ASP A 88 -8.334 -3.570 43.633 1.00 32.93 N ATOM 792 CA ASP A 88 -9.380 -3.553 44.651 1.00 32.64 C ATOM 793 C ASP A 88 -8.959 -2.608 45.767 1.00 31.79 C ATOM 794 O ASP A 88 -8.433 -3.027 46.800 1.00 31.26 O ATOM 795 CB ASP A 88 -9.653 -4.965 45.181 1.00 33.32 C ATOM 796 CG ASP A 88 -10.929 -5.049 46.030 1.00 34.63 C ATOM 797 OD1 ASP A 88 -11.760 -4.118 46.006 1.00 34.19 O ATOM 798 OD2 ASP A 88 -11.100 -6.066 46.727 1.00 38.23 O ATOM 799 H ASP A 88 -7.349 -3.738 43.921 1.00 0.00 H ATOM 800 N LEU A 89 -9.201 -1.324 45.535 1.00 30.95 N ATOM 801 CA LEU A 89 -8.630 -0.268 46.360 1.00 30.64 C ATOM 802 C LEU A 89 -9.497 0.099 47.549 1.00 30.49 C ATOM 803 O LEU A 89 -10.712 -0.100 47.533 1.00 30.13 O ATOM 804 CB LEU A 89 -8.387 0.980 45.510 1.00 30.26 C ATOM 805 CG LEU A 89 -7.333 0.880 44.406 1.00 30.48 C ATOM 806 CD1 LEU A 89 -7.438 2.116 43.508 1.00 30.66 C ATOM 807 CD2 LEU A 89 -5.941 0.740 44.993 1.00 28.87 C ATOM 808 H LEU A 89 -9.818 -1.063 44.739 1.00 0.00 H ATOM 809 N SER A 90 -8.859 0.654 48.572 1.00 29.97 N ATOM 810 CA SER A 90 -9.572 1.225 49.703 1.00 30.06 C ATOM 811 C SER A 90 -10.207 2.557 49.316 1.00 29.78 C ATOM 812 O SER A 90 -9.968 3.085 48.224 1.00 29.99 O ATOM 813 CB SER A 90 -8.618 1.453 50.874 1.00 29.94 C ATOM 814 OG SER A 90 -7.975 2.716 50.773 1.00 29.79 O ATOM 815 HG SER A 90 -8.657 3.433 50.776 1.00 0.00 H ATOM 816 H SER A 90 -7.819 0.681 48.564 1.00 0.00 H ATOM 817 N SER A 91 -10.999 3.108 50.227 1.00 29.49 N ATOM 818 CA SER A 91 -11.464 4.481 50.098 1.00 29.60 C ATOM 819 C SER A 91 -10.288 5.452 50.205 1.00 29.30 C ATOM 820 O SER A 91 -9.326 5.191 50.935 1.00 28.59 O ATOM 821 CB SER A 91 -12.507 4.805 51.169 1.00 29.99 C ATOM 822 OG SER A 91 -11.955 4.679 52.466 1.00 30.27 O ATOM 823 HG SER A 91 -11.638 3.751 52.600 1.00 0.00 H ATOM 824 H SER A 91 -11.294 2.546 51.051 1.00 0.00 H ATOM 825 N PRO A 92 -10.349 6.560 49.452 1.00 29.39 N ATOM 826 CA PRO A 92 -9.388 7.658 49.531 1.00 29.34 C ATOM 827 C PRO A 92 -9.155 8.168 50.957 1.00 29.77 C ATOM 828 O PRO A 92 -8.003 8.402 51.344 1.00 29.01 O ATOM 829 CB PRO A 92 -10.037 8.739 48.675 1.00 29.32 C ATOM 830 CG PRO A 92 -10.769 7.978 47.636 1.00 29.81 C ATOM 831 CD PRO A 92 -11.207 6.678 48.257 1.00 29.40 C ATOM 832 N GLU A 93 -10.232 8.311 51.732 1.00 29.89 N ATOM 833 CA GLU A 93 -10.125 8.765 53.129 1.00 30.00 C ATOM 834 C GLU A 93 -9.283 7.805 53.971 1.00 29.88 C ATOM 835 O GLU A 93 -8.438 8.227 54.758 1.00 30.03 O ATOM 836 CB GLU A 93 -11.372 9.119 53.766 1.00 32.31 C ATOM 837 CG GLU A 93 -11.288 9.742 55.152 1.00 32.45 C ATOM 838 CD GLU A 93 -12.618 10.291 55.627 1.00 32.51 C ATOM 839 OE1 GLU A 93 -13.145 11.218 54.976 1.00 32.59 O ATOM 840 OE2 GLU A 93 -13.138 9.796 56.649 1.00 32.59 O ATOM 841 H GLU A 93 -11.171 8.096 51.339 1.00 0.00 H ATOM 842 N THR A 94 -9.515 6.512 53.792 1.00 29.96 N ATOM 843 CA THR A 94 -8.764 5.489 54.517 1.00 29.81 C ATOM 844 C THR A 94 -7.315 5.384 54.026 1.00 29.37 C ATOM 845 O THR A 94 -6.397 5.183 54.825 1.00 28.62 O ATOM 846 CB THR A 94 -9.463 4.130 54.414 1.00 30.28 C ATOM 847 OG1 THR A 94 -10.714 4.200 55.110 1.00 30.75 O ATOM 848 CG2 THR A 94 -8.618 3.019 55.017 1.00 30.34 C ATOM 849 HG1 THR A 94 -10.549 4.422 56.061 1.00 0.00 H ATOM 850 H THR A 94 -10.251 6.218 53.118 1.00 0.00 H ATOM 851 N ALA A 95 -7.126 5.512 52.714 1.00 28.61 N ATOM 852 CA ALA A 95 -5.797 5.468 52.114 1.00 28.55 C ATOM 853 C ALA A 95 -4.918 6.596 52.653 1.00 28.56 C ATOM 854 O ALA A 95 -3.787 6.353 53.069 1.00 28.70 O ATOM 855 CB ALA A 95 -5.898 5.537 50.592 1.00 28.26 C ATOM 856 H ALA A 95 -7.952 5.648 52.097 1.00 0.00 H ATOM 857 N VAL A 96 -5.458 7.816 52.662 1.00 28.58 N ATOM 858 CA VAL A 96 -4.775 8.986 53.223 1.00 28.96 C ATOM 859 C VAL A 96 -4.423 8.763 54.693 1.00 28.75 C ATOM 860 O VAL A 96 -3.315 9.086 55.117 1.00 27.81 O ATOM 861 CB VAL A 96 -5.620 10.282 53.104 1.00 29.33 C ATOM 862 CG1 VAL A 96 -4.906 11.456 53.761 1.00 30.44 C ATOM 863 CG2 VAL A 96 -5.909 10.613 51.655 1.00 30.18 C ATOM 864 H VAL A 96 -6.406 7.943 52.253 1.00 0.00 H ATOM 865 N LYS A 97 -5.367 8.218 55.463 1.00 28.64 N ATOM 866 CA LYS A 97 -5.113 7.926 56.871 1.00 29.10 C ATOM 867 C LYS A 97 -3.938 6.949 57.035 1.00 28.65 C ATOM 868 O LYS A 97 -3.031 7.206 57.811 1.00 28.95 O ATOM 869 CB LYS A 97 -6.375 7.413 57.584 1.00 29.35 C ATOM 870 CG LYS A 97 -6.102 6.818 58.968 1.00 31.29 C ATOM 871 CD LYS A 97 -7.317 6.822 59.882 1.00 34.23 C ATOM 872 CE LYS A 97 -6.998 6.102 61.200 1.00 35.05 C ATOM 873 NZ LYS A 97 -5.743 6.604 61.860 1.00 34.65 N ATOM 874 HZ1 LYS A 97 -4.936 6.462 61.220 1.00 0.00 H ATOM 875 HZ2 LYS A 97 -5.845 7.617 62.071 1.00 0.00 H ATOM 876 HZ3 LYS A 97 -5.583 6.079 62.743 1.00 0.00 H ATOM 877 H LYS A 97 -6.298 7.998 55.054 1.00 0.00 H ATOM 878 N VAL A 98 -3.956 5.848 56.290 1.00 28.29 N ATOM 879 CA VAL A 98 -2.920 4.818 56.395 1.00 27.52 C ATOM 880 C VAL A 98 -1.551 5.360 55.995 1.00 27.67 C ATOM 881 O VAL A 98 -0.553 5.125 56.687 1.00 27.21 O ATOM 882 CB VAL A 98 -3.278 3.566 55.562 1.00 27.74 C ATOM 883 CG1 VAL A 98 -2.080 2.614 55.441 1.00 26.81 C ATOM 884 CG2 VAL A 98 -4.484 2.842 56.177 1.00 28.04 C ATOM 885 H VAL A 98 -4.731 5.714 55.610 1.00 0.00 H ATOM 886 N LEU A 99 -1.509 6.097 54.891 1.00 27.73 N ATOM 887 CA LEU A 99 -0.256 6.648 54.385 1.00 28.29 C ATOM 888 C LEU A 99 0.317 7.673 55.356 1.00 29.00 C ATOM 889 O LEU A 99 1.528 7.720 55.568 1.00 28.71 O ATOM 890 CB LEU A 99 -0.462 7.255 52.988 1.00 28.44 C ATOM 891 CG LEU A 99 -0.770 6.234 51.887 1.00 28.20 C ATOM 892 CD1 LEU A 99 -1.484 6.879 50.707 1.00 30.24 C ATOM 893 CD2 LEU A 99 0.501 5.525 51.427 1.00 28.20 C ATOM 894 H LEU A 99 -2.391 6.286 54.374 1.00 0.00 H ATOM 895 N LYS A 100 -0.558 8.480 55.952 1.00 29.65 N ATOM 896 CA LYS A 100 -0.140 9.450 56.953 1.00 31.00 C ATOM 897 C LYS A 100 0.364 8.785 58.239 1.00 31.13 C ATOM 898 O LYS A 100 1.365 9.226 58.798 1.00 31.36 O ATOM 899 CB LYS A 100 -1.248 10.447 57.267 1.00 31.39 C ATOM 900 CG LYS A 100 -1.465 11.480 56.167 1.00 33.48 C ATOM 901 CD LYS A 100 -1.991 12.799 56.723 1.00 36.89 C ATOM 902 CE LYS A 100 -3.367 12.648 57.349 1.00 38.07 C ATOM 903 NZ LYS A 100 -3.711 13.811 58.222 1.00 39.25 N ATOM 904 HZ1 LYS A 100 -3.011 13.888 58.987 1.00 0.00 H ATOM 905 HZ2 LYS A 100 -3.704 14.683 57.655 1.00 0.00 H ATOM 906 HZ3 LYS A 100 -4.657 13.669 58.630 1.00 0.00 H ATOM 907 H LYS A 100 -1.564 8.416 55.696 1.00 0.00 H ATOM 908 N ASP A 101 -0.322 7.727 58.682 1.00 31.60 N ATOM 909 CA ASP A 101 0.110 6.934 59.852 1.00 31.59 C ATOM 910 C ASP A 101 1.452 6.249 59.615 1.00 31.45 C ATOM 911 O ASP A 101 2.305 6.222 60.505 1.00 31.65 O ATOM 912 CB ASP A 101 -0.939 5.884 60.231 1.00 31.89 C ATOM 913 CG ASP A 101 -2.080 6.454 61.059 1.00 33.43 C ATOM 914 OD1 ASP A 101 -1.928 7.539 61.658 1.00 35.41 O ATOM 915 OD2 ASP A 101 -3.140 5.804 61.119 1.00 35.77 O ATOM 916 H ASP A 101 -1.193 7.451 58.185 1.00 0.00 H ATOM 917 N ILE A 102 1.637 5.689 58.420 1.00 30.98 N ATOM 918 CA ILE A 102 2.921 5.094 58.041 1.00 30.70 C ATOM 919 C ILE A 102 4.053 6.110 58.162 1.00 31.04 C ATOM 920 O ILE A 102 5.105 5.808 58.738 1.00 30.28 O ATOM 921 CB ILE A 102 2.896 4.506 56.606 1.00 30.43 C ATOM 922 CG1 ILE A 102 2.043 3.230 56.563 1.00 29.65 C ATOM 923 CG2 ILE A 102 4.314 4.217 56.125 1.00 29.81 C ATOM 924 CD1 ILE A 102 1.711 2.769 55.151 1.00 28.87 C ATOM 925 H ILE A 102 0.851 5.674 57.740 1.00 0.00 H ATOM 926 N GLU A 103 3.830 7.310 57.623 1.00 31.31 N ATOM 927 CA GLU A 103 4.814 8.386 57.713 1.00 32.24 C ATOM 928 C GLU A 103 5.089 8.733 59.180 1.00 32.02 C ATOM 929 O GLU A 103 6.239 8.912 59.560 1.00 31.92 O ATOM 930 CB GLU A 103 4.365 9.630 56.926 1.00 32.23 C ATOM 931 CG GLU A 103 5.297 10.846 57.104 1.00 34.75 C ATOM 932 CD GLU A 103 4.710 12.176 56.599 1.00 37.01 C ATOM 933 OE1 GLU A 103 5.410 13.209 56.669 1.00 39.85 O ATOM 934 OE2 GLU A 103 3.560 12.203 56.133 1.00 36.50 O ATOM 935 H GLU A 103 2.933 7.484 57.126 1.00 0.00 H ATOM 936 N SER A 104 4.034 8.807 59.991 1.00 32.27 N ATOM 937 CA SER A 104 4.147 9.144 61.423 1.00 32.22 C ATOM 938 C SER A 104 4.960 8.111 62.209 1.00 32.13 C ATOM 939 O SER A 104 5.903 8.470 62.919 1.00 32.08 O ATOM 940 CB SER A 104 2.764 9.292 62.066 1.00 32.45 C ATOM 941 OG SER A 104 2.067 10.408 61.545 1.00 33.41 O ATOM 942 HG SER A 104 1.949 10.295 60.569 1.00 0.00 H ATOM 943 H SER A 104 3.090 8.619 59.597 1.00 0.00 H ATOM 944 N ILE A 105 4.581 6.841 62.077 1.00 31.72 N ATOM 945 CA ILE A 105 5.284 5.726 62.718 1.00 31.57 C ATOM 946 C ILE A 105 6.763 5.654 62.301 1.00 31.83 C ATOM 947 O ILE A 105 7.646 5.527 63.153 1.00 31.83 O ATOM 948 CB ILE A 105 4.566 4.376 62.470 1.00 31.17 C ATOM 949 CG1 ILE A 105 3.125 4.429 63.004 1.00 31.00 C ATOM 950 CG2 ILE A 105 5.342 3.231 63.123 1.00 31.85 C ATOM 951 CD1 ILE A 105 2.218 3.316 62.492 1.00 30.93 C ATOM 952 H ILE A 105 3.747 6.631 61.492 1.00 0.00 H ATOM 953 N LEU A 106 7.035 5.756 61.004 1.00 32.06 N ATOM 954 CA LEU A 106 8.424 5.729 60.520 1.00 32.64 C ATOM 955 C LEU A 106 9.236 6.873 61.112 1.00 33.30 C ATOM 956 O LEU A 106 10.333 6.652 61.630 1.00 33.42 O ATOM 957 CB LEU A 106 8.492 5.769 58.992 1.00 32.45 C ATOM 958 CG LEU A 106 7.971 4.558 58.217 1.00 32.69 C ATOM 959 CD1 LEU A 106 7.846 4.935 56.770 1.00 32.96 C ATOM 960 CD2 LEU A 106 8.869 3.334 58.380 1.00 33.48 C ATOM 961 H LEU A 106 6.256 5.856 60.322 1.00 0.00 H ATOM 962 N LYS A 107 8.694 8.087 61.054 1.00 33.98 N ATOM 963 CA LYS A 107 9.357 9.236 61.662 1.00 35.28 C ATOM 964 C LYS A 107 9.650 8.971 63.147 1.00 35.64 C ATOM 965 O LYS A 107 10.770 9.190 63.618 1.00 35.93 O ATOM 966 CB LYS A 107 8.537 10.516 61.457 1.00 35.38 C ATOM 967 CG LYS A 107 8.670 11.124 60.057 1.00 36.30 C ATOM 968 CD LYS A 107 8.028 12.497 59.991 1.00 37.64 C ATOM 969 CE LYS A 107 7.856 13.005 58.565 1.00 39.79 C ATOM 970 NZ LYS A 107 9.130 13.359 57.870 1.00 40.77 N ATOM 971 HZ1 LYS A 107 9.616 14.110 58.401 1.00 0.00 H ATOM 972 HZ2 LYS A 107 9.741 12.519 57.819 1.00 0.00 H ATOM 973 HZ3 LYS A 107 8.918 13.694 56.909 1.00 0.00 H ATOM 974 H LYS A 107 7.784 8.219 60.568 1.00 0.00 H ATOM 975 N GLU A 108 8.648 8.460 63.859 1.00 35.99 N ATOM 976 CA GLU A 108 8.790 8.066 65.261 1.00 36.61 C ATOM 977 C GLU A 108 9.903 7.038 65.474 1.00 36.92 C ATOM 978 O GLU A 108 10.562 7.039 66.519 1.00 37.34 O ATOM 979 CB GLU A 108 7.519 7.671 65.868 1.00 38.36 C ATOM 980 CG GLU A 108 6.532 8.810 66.057 1.00 38.48 C ATOM 981 CD GLU A 108 7.063 9.882 66.989 1.00 38.54 C ATOM 982 OE1 GLU A 108 7.339 9.568 68.166 1.00 38.60 O ATOM 983 OE2 GLU A 108 7.208 11.040 66.544 1.00 38.60 O ATOM 984 H GLU A 108 7.724 8.335 63.399 1.00 0.00 H ATOM 985 N ARG A 109 10.107 6.170 64.482 1.00 36.96 N ATOM 986 CA ARG A 109 11.123 5.110 64.544 1.00 36.78 C ATOM 987 C ARG A 109 12.483 5.550 63.998 1.00 36.67 C ATOM 988 O ARG A 109 13.335 4.717 63.681 1.00 36.64 O ATOM 989 CB ARG A 109 10.628 3.826 63.863 1.00 36.39 C ATOM 990 CG ARG A 109 9.504 3.177 64.634 1.00 36.99 C ATOM 991 CD ARG A 109 9.008 1.890 64.032 1.00 36.87 C ATOM 992 NE ARG A 109 7.820 1.440 64.753 1.00 38.97 N ATOM 993 CZ ARG A 109 7.249 0.247 64.623 1.00 39.51 C ATOM 994 NH1 ARG A 109 7.748 -0.659 63.796 1.00 40.37 N ATOM 995 NH2 ARG A 109 6.166 -0.042 65.332 1.00 41.18 N ATOM 996 HE ARG A 109 7.386 2.107 65.422 1.00 0.00 H ATOM 997 HH12 ARG A 109 7.290 -1.588 63.705 1.00 0.00 H ATOM 998 HH11 ARG A 109 8.598 -0.441 63.237 1.00 0.00 H ATOM 999 HH22 ARG A 109 5.714 -0.974 65.235 1.00 0.00 H ATOM 1000 HH21 ARG A 109 5.768 0.663 65.985 1.00 0.00 H ATOM 1001 H ARG A 109 9.521 6.247 63.626 1.00 0.00 H ATOM 1002 N GLY A 110 12.670 6.865 63.907 1.00 36.74 N ATOM 1003 CA GLY A 110 13.955 7.459 63.562 1.00 36.79 C ATOM 1004 C GLY A 110 14.337 7.342 62.100 1.00 36.78 C ATOM 1005 O GLY A 110 15.521 7.392 61.767 1.00 36.70 O ATOM 1006 H GLY A 110 11.864 7.496 64.090 1.00 0.00 H ATOM 1007 N TYR A 111 13.339 7.174 61.226 1.00 36.40 N ATOM 1008 CA TYR A 111 13.582 7.152 59.779 1.00 35.75 C ATOM 1009 C TYR A 111 13.367 8.530 59.181 1.00 35.47 C ATOM 1010 O TYR A 111 12.535 9.307 59.659 1.00 35.70 O ATOM 1011 CB TYR A 111 12.675 6.140 59.064 1.00 35.55 C ATOM 1012 CG TYR A 111 12.989 4.699 59.367 1.00 34.72 C ATOM 1013 CD1 TYR A 111 13.919 3.987 58.607 1.00 33.61 C ATOM 1014 CD2 TYR A 111 12.349 4.041 60.412 1.00 33.83 C ATOM 1015 CE1 TYR A 111 14.213 2.652 58.894 1.00 33.54 C ATOM 1016 CE2 TYR A 111 12.623 2.710 60.697 1.00 34.79 C ATOM 1017 CZ TYR A 111 13.560 2.022 59.937 1.00 33.77 C ATOM 1018 OH TYR A 111 13.829 0.701 60.235 1.00 35.33 O ATOM 1019 HH TYR A 111 12.999 0.168 60.146 1.00 0.00 H ATOM 1020 H TYR A 111 12.368 7.056 61.580 1.00 0.00 H ATOM 1021 N ASN A 112 14.138 8.832 58.139 1.00 34.99 N ATOM 1022 CA ASN A 112 13.962 10.055 57.373 1.00 34.45 C ATOM 1023 C ASN A 112 12.891 9.813 56.301 1.00 34.00 C ATOM 1024 O ASN A 112 13.085 8.999 55.402 1.00 33.77 O ATOM 1025 CB ASN A 112 15.284 10.455 56.722 1.00 34.84 C ATOM 1026 CG ASN A 112 15.224 11.814 56.067 1.00 35.27 C ATOM 1027 OD1 ASN A 112 15.936 12.077 55.098 1.00 37.27 O ATOM 1028 ND2 ASN A 112 14.371 12.687 56.589 1.00 36.84 N ATOM 1029 HD22 ASN A 112 13.790 12.419 57.409 1.00 0.00 H ATOM 1030 HD21 ASN A 112 14.284 13.638 56.178 1.00 0.00 H ATOM 1031 H ASN A 112 14.892 8.171 57.863 1.00 0.00 H ATOM 1032 N VAL A 113 11.765 10.516 56.406 1.00 33.55 N ATOM 1033 CA VAL A 113 10.593 10.206 55.575 1.00 33.02 C ATOM 1034 C VAL A 113 10.114 11.390 54.733 1.00 32.58 C ATOM 1035 O VAL A 113 10.057 12.528 55.202 1.00 32.88 O ATOM 1036 CB VAL A 113 9.395 9.661 56.430 1.00 32.99 C ATOM 1037 CG1 VAL A 113 8.310 9.076 55.526 1.00 33.09 C ATOM 1038 CG2 VAL A 113 9.859 8.616 57.442 1.00 33.40 C ATOM 1039 H VAL A 113 11.714 11.299 57.089 1.00 0.00 H ATOM 1040 N LEU A 114 9.760 11.095 53.484 1.00 31.89 N ATOM 1041 CA LEU A 114 9.140 12.045 52.575 1.00 31.21 C ATOM 1042 C LEU A 114 7.874 11.402 52.001 1.00 31.05 C ATOM 1043 O LEU A 114 7.937 10.295 51.465 1.00 30.62 O ATOM 1044 CB LEU A 114 10.113 12.379 51.437 1.00 30.99 C ATOM 1045 CG LEU A 114 9.607 13.306 50.338 1.00 31.83 C ATOM 1046 CD1 LEU A 114 9.178 14.653 50.923 1.00 33.03 C ATOM 1047 CD2 LEU A 114 10.678 13.475 49.261 1.00 32.64 C ATOM 1048 H LEU A 114 9.937 10.130 53.139 1.00 0.00 H ATOM 1049 N ARG A 115 6.734 12.080 52.120 1.00 30.80 N ATOM 1050 CA ARG A 115 5.485 11.542 51.582 1.00 30.61 C ATOM 1051 C ARG A 115 5.011 12.370 50.391 1.00 30.09 C ATOM 1052 O ARG A 115 4.855 13.585 50.500 1.00 30.13 O ATOM 1053 CB ARG A 115 4.397 11.455 52.660 1.00 30.99 C ATOM 1054 CG ARG A 115 3.104 10.796 52.161 1.00 32.28 C ATOM 1055 CD ARG A 115 2.133 10.426 53.273 1.00 35.17 C ATOM 1056 NE ARG A 115 2.000 11.454 54.305 1.00 37.89 N ATOM 1057 CZ ARG A 115 1.179 12.501 54.252 1.00 40.39 C ATOM 1058 NH1 ARG A 115 0.389 12.699 53.203 1.00 41.56 N ATOM 1059 NH2 ARG A 115 1.152 13.359 55.269 1.00 41.90 N ATOM 1060 HE ARG A 115 2.597 11.359 55.151 1.00 0.00 H ATOM 1061 HH12 ARG A 115 -0.246 13.522 53.178 1.00 0.00 H ATOM 1062 HH11 ARG A 115 0.405 12.031 52.406 1.00 0.00 H ATOM 1063 HH22 ARG A 115 0.515 14.181 55.239 1.00 0.00 H ATOM 1064 HH21 ARG A 115 1.768 13.208 56.093 1.00 0.00 H ATOM 1065 H ARG A 115 6.732 13.002 52.601 1.00 0.00 H ATOM 1066 N ALA A 116 4.809 11.702 49.255 1.00 29.34 N ATOM 1067 CA ALA A 116 4.299 12.339 48.038 1.00 28.39 C ATOM 1068 C ALA A 116 2.798 12.645 48.165 1.00 28.01 C ATOM 1069 O ALA A 116 2.085 11.921 48.867 1.00 27.41 O ATOM 1070 CB ALA A 116 4.557 11.442 46.843 1.00 28.79 C ATOM 1071 H ALA A 116 5.023 10.684 49.232 1.00 0.00 H ATOM 1072 N PRO A 117 2.320 13.716 47.492 1.00 27.41 N ATOM 1073 CA PRO A 117 0.918 14.133 47.601 1.00 27.64 C ATOM 1074 C PRO A 117 -0.094 13.090 47.119 1.00 27.54 C ATOM 1075 O PRO A 117 0.039 12.533 46.036 1.00 27.27 O ATOM 1076 CB PRO A 117 0.847 15.406 46.733 1.00 27.90 C ATOM 1077 CG PRO A 117 2.143 15.489 46.005 1.00 27.85 C ATOM 1078 CD PRO A 117 3.138 14.752 46.832 1.00 27.16 C ATOM 1079 N PHE A 118 -1.093 12.828 47.948 1.00 27.73 N ATOM 1080 CA PHE A 118 -2.174 11.927 47.589 1.00 27.93 C ATOM 1081 C PHE A 118 -3.157 12.611 46.635 1.00 27.45 C ATOM 1082 O PHE A 118 -3.590 13.740 46.879 1.00 27.43 O ATOM 1083 CB PHE A 118 -2.891 11.499 48.863 1.00 28.46 C ATOM 1084 CG PHE A 118 -3.975 10.496 48.653 1.00 29.86 C ATOM 1085 CD1 PHE A 118 -3.732 9.149 48.882 1.00 30.35 C ATOM 1086 CD2 PHE A 118 -5.252 10.898 48.262 1.00 29.96 C ATOM 1087 CE1 PHE A 118 -4.739 8.214 48.716 1.00 30.76 C ATOM 1088 CE2 PHE A 118 -6.264 9.970 48.093 1.00 30.89 C ATOM 1089 CZ PHE A 118 -6.010 8.624 48.324 1.00 31.02 C ATOM 1090 H PHE A 118 -1.104 13.281 48.884 1.00 0.00 H ATOM 1091 N GLY A 119 -3.519 11.908 45.563 1.00 27.19 N ATOM 1092 CA GLY A 119 -4.561 12.359 44.638 1.00 26.82 C ATOM 1093 C GLY A 119 -4.169 13.508 43.731 1.00 26.91 C ATOM 1094 O GLY A 119 -5.033 14.243 43.248 1.00 26.76 O ATOM 1095 H GLY A 119 -3.043 11.003 45.375 1.00 0.00 H ATOM 1096 N TRP A 120 -2.865 13.690 43.527 1.00 26.51 N ATOM 1097 CA TRP A 120 -2.360 14.642 42.542 1.00 25.96 C ATOM 1098 C TRP A 120 -1.648 13.870 41.443 1.00 25.59 C ATOM 1099 O TRP A 120 -0.977 12.878 41.727 1.00 24.63 O ATOM 1100 CB TRP A 120 -1.338 15.582 43.172 1.00 26.42 C ATOM 1101 CG TRP A 120 -1.865 16.575 44.177 1.00 27.51 C ATOM 1102 CD1 TRP A 120 -2.285 16.316 45.449 1.00 29.15 C ATOM 1103 CD2 TRP A 120 -1.977 17.990 43.995 1.00 29.31 C ATOM 1104 NE1 TRP A 120 -2.656 17.488 46.073 1.00 30.07 N ATOM 1105 CE2 TRP A 120 -2.482 18.529 45.201 1.00 29.88 C ATOM 1106 CE3 TRP A 120 -1.709 18.857 42.924 1.00 29.43 C ATOM 1107 CZ2 TRP A 120 -2.726 19.897 45.369 1.00 31.64 C ATOM 1108 CZ3 TRP A 120 -1.950 20.219 43.093 1.00 30.87 C ATOM 1109 CH2 TRP A 120 -2.451 20.725 44.307 1.00 30.82 C ATOM 1110 HE1 TRP A 120 -3.010 17.568 47.047 1.00 0.00 H ATOM 1111 H TRP A 120 -2.186 13.137 44.087 1.00 0.00 H ATOM 1112 N TYR A 121 -1.788 14.321 40.195 1.00 24.84 N ATOM 1113 CA TYR A 121 -0.954 13.799 39.111 1.00 24.90 C ATOM 1114 C TYR A 121 0.432 14.384 39.291 1.00 24.53 C ATOM 1115 O TYR A 121 0.585 15.599 39.473 1.00 24.62 O ATOM 1116 CB TYR A 121 -1.497 14.188 37.737 1.00 24.82 C ATOM 1117 CG TYR A 121 -2.857 13.626 37.436 1.00 26.87 C ATOM 1118 CD1 TYR A 121 -3.032 12.262 37.203 1.00 27.76 C ATOM 1119 CD2 TYR A 121 -3.971 14.454 37.378 1.00 28.74 C ATOM 1120 CE1 TYR A 121 -4.283 11.737 36.935 1.00 29.64 C ATOM 1121 CE2 TYR A 121 -5.235 13.934 37.099 1.00 29.75 C ATOM 1122 CZ TYR A 121 -5.378 12.578 36.877 1.00 30.58 C ATOM 1123 OH TYR A 121 -6.619 12.047 36.605 1.00 32.51 O ATOM 1124 HH TYR A 121 -6.537 11.069 36.474 1.00 0.00 H ATOM 1125 H TYR A 121 -2.498 15.052 39.990 1.00 0.00 H ATOM 1126 N LYS A 122 1.441 13.526 39.245 1.00 24.84 N ATOM 1127 CA LYS A 122 2.784 13.920 39.631 1.00 24.53 C ATOM 1128 C LYS A 122 3.773 13.466 38.589 1.00 25.19 C ATOM 1129 O LYS A 122 3.778 12.299 38.205 1.00 24.92 O ATOM 1130 CB LYS A 122 3.178 13.262 40.960 1.00 24.88 C ATOM 1131 CG LYS A 122 2.507 13.808 42.219 1.00 23.58 C ATOM 1132 CD LYS A 122 2.890 12.965 43.448 1.00 24.45 C ATOM 1133 CE LYS A 122 2.271 11.542 43.426 1.00 22.52 C ATOM 1134 NZ LYS A 122 0.771 11.550 43.439 1.00 24.10 N ATOM 1135 HZ1 LYS A 122 0.436 12.026 44.301 1.00 0.00 H ATOM 1136 HZ2 LYS A 122 0.421 12.059 42.602 1.00 0.00 H ATOM 1137 HZ3 LYS A 122 0.420 10.571 43.423 1.00 0.00 H ATOM 1138 H LYS A 122 1.267 12.551 38.926 1.00 0.00 H ATOM 1139 N ALA A 123 4.636 14.374 38.153 1.00 24.95 N ATOM 1140 CA ALA A 123 5.835 13.953 37.433 1.00 24.85 C ATOM 1141 C ALA A 123 6.785 13.403 38.480 1.00 25.10 C ATOM 1142 O ALA A 123 6.774 13.859 39.632 1.00 25.17 O ATOM 1143 CB ALA A 123 6.473 15.128 36.705 1.00 24.44 C ATOM 1144 H ALA A 123 4.459 15.385 38.324 1.00 0.00 H ATOM 1145 N PHE A 124 7.589 12.409 38.109 1.00 24.90 N ATOM 1146 CA PHE A 124 8.599 11.901 39.023 1.00 24.75 C ATOM 1147 C PHE A 124 9.797 11.334 38.292 1.00 25.32 C ATOM 1148 O PHE A 124 9.715 10.985 37.119 1.00 24.70 O ATOM 1149 CB PHE A 124 8.019 10.880 40.026 1.00 24.88 C ATOM 1150 CG PHE A 124 7.695 9.532 39.429 1.00 24.55 C ATOM 1151 CD1 PHE A 124 6.425 9.273 38.920 1.00 23.06 C ATOM 1152 CD2 PHE A 124 8.652 8.512 39.414 1.00 24.41 C ATOM 1153 CE1 PHE A 124 6.110 8.018 38.382 1.00 23.12 C ATOM 1154 CE2 PHE A 124 8.352 7.249 38.875 1.00 24.23 C ATOM 1155 CZ PHE A 124 7.073 7.007 38.355 1.00 23.46 C ATOM 1156 H PHE A 124 7.494 11.994 37.160 1.00 0.00 H ATOM 1157 N LYS A 125 10.913 11.269 39.009 1.00 25.90 N ATOM 1158 CA LYS A 125 12.153 10.718 38.483 1.00 26.53 C ATOM 1159 C LYS A 125 12.685 9.774 39.533 1.00 26.45 C ATOM 1160 O LYS A 125 12.765 10.134 40.716 1.00 26.23 O ATOM 1161 CB LYS A 125 13.177 11.825 38.213 1.00 26.88 C ATOM 1162 CG LYS A 125 12.694 12.916 37.249 1.00 28.89 C ATOM 1163 CD LYS A 125 13.796 13.941 36.949 1.00 32.16 C ATOM 1164 CE LYS A 125 13.252 15.132 36.164 1.00 34.05 C ATOM 1165 NZ LYS A 125 12.375 15.998 37.016 1.00 36.19 N ATOM 1166 HZ1 LYS A 125 11.571 15.438 37.365 1.00 0.00 H ATOM 1167 HZ2 LYS A 125 12.924 16.358 37.823 1.00 0.00 H ATOM 1168 HZ3 LYS A 125 12.024 16.797 36.450 1.00 0.00 H ATOM 1169 H LYS A 125 10.900 11.626 39.986 1.00 0.00 H ATOM 1170 N ILE A 126 13.022 8.563 39.103 1.00 26.15 N ATOM 1171 CA ILE A 126 13.582 7.551 39.993 1.00 26.48 C ATOM 1172 C ILE A 126 14.747 6.817 39.309 1.00 26.67 C ATOM 1173 O ILE A 126 14.753 6.642 38.100 1.00 25.92 O ATOM 1174 CB ILE A 126 12.479 6.568 40.503 1.00 26.69 C ATOM 1175 CG1 ILE A 126 12.972 5.759 41.707 1.00 27.45 C ATOM 1176 CG2 ILE A 126 11.917 5.697 39.372 1.00 26.15 C ATOM 1177 CD1 ILE A 126 11.904 4.897 42.353 1.00 30.26 C ATOM 1178 H ILE A 126 12.882 8.329 38.099 1.00 0.00 H ATOM 1179 N SER A 127 15.738 6.420 40.103 1.00 27.07 N ATOM 1180 CA SER A 127 16.849 5.618 39.617 1.00 27.29 C ATOM 1181 C SER A 127 17.027 4.409 40.540 1.00 27.92 C ATOM 1182 O SER A 127 17.422 4.556 41.695 1.00 27.82 O ATOM 1183 CB SER A 127 18.117 6.480 39.541 1.00 27.67 C ATOM 1184 OG SER A 127 19.275 5.703 39.292 1.00 26.90 O ATOM 1185 HG SER A 127 19.392 5.044 40.022 1.00 0.00 H ATOM 1186 H SER A 127 15.717 6.693 41.106 1.00 0.00 H ATOM 1187 N CYS A 128 16.695 3.222 40.031 1.00 27.88 N ATOM 1188 CA CYS A 128 16.834 1.976 40.783 1.00 28.33 C ATOM 1189 C CYS A 128 18.274 1.486 40.749 1.00 27.91 C ATOM 1190 O CYS A 128 18.906 1.465 39.688 1.00 27.71 O ATOM 1191 CB CYS A 128 15.916 0.901 40.203 1.00 28.09 C ATOM 1192 SG CYS A 128 16.058 -0.695 40.999 1.00 30.77 S ATOM 1193 H CYS A 128 16.323 3.181 39.061 1.00 0.00 H ATOM 1194 N LYS A 129 18.780 1.082 41.911 1.00 28.06 N ATOM 1195 CA LYS A 129 20.179 0.666 42.039 1.00 28.53 C ATOM 1196 C LYS A 129 20.485 -0.625 41.283 1.00 28.44 C ATOM 1197 O LYS A 129 21.576 -0.774 40.742 1.00 28.62 O ATOM 1198 CB LYS A 129 20.595 0.574 43.511 1.00 28.74 C ATOM 1199 CG LYS A 129 20.644 1.943 44.197 1.00 30.21 C ATOM 1200 CD LYS A 129 21.372 1.898 45.527 1.00 33.55 C ATOM 1201 CE LYS A 129 21.513 3.301 46.106 1.00 34.88 C ATOM 1202 NZ LYS A 129 22.530 3.378 47.205 1.00 38.47 N ATOM 1203 HZ1 LYS A 129 22.251 2.741 47.979 1.00 0.00 H ATOM 1204 HZ2 LYS A 129 23.459 3.091 46.836 1.00 0.00 H ATOM 1205 HZ3 LYS A 129 22.582 4.354 47.559 1.00 0.00 H ATOM 1206 H LYS A 129 18.167 1.061 42.751 1.00 0.00 H ATOM 1207 N GLY A 130 19.523 -1.543 41.233 1.00 28.36 N ATOM 1208 CA GLY A 130 19.638 -2.717 40.381 1.00 29.05 C ATOM 1209 C GLY A 130 20.290 -3.947 40.981 1.00 29.78 C ATOM 1210 O GLY A 130 20.493 -4.931 40.279 1.00 29.89 O ATOM 1211 H GLY A 130 18.670 -1.419 41.815 1.00 0.00 H ATOM 1212 N HIS A 131 20.622 -3.905 42.270 1.00 30.34 N ATOM 1213 CA HIS A 131 21.119 -5.104 42.955 1.00 30.70 C ATOM 1214 C HIS A 131 19.963 -6.097 43.205 1.00 31.24 C ATOM 1215 O HIS A 131 18.800 -5.726 43.047 1.00 31.33 O ATOM 1216 CB HIS A 131 21.895 -4.739 44.232 1.00 30.86 C ATOM 1217 CG HIS A 131 21.089 -4.001 45.260 1.00 30.28 C ATOM 1218 ND1 HIS A 131 20.134 -4.618 46.038 1.00 29.30 N ATOM 1219 CD2 HIS A 131 21.137 -2.712 45.674 1.00 30.01 C ATOM 1220 CE1 HIS A 131 19.605 -3.734 46.866 1.00 29.04 C ATOM 1221 NE2 HIS A 131 20.195 -2.570 46.666 1.00 29.43 N ATOM 1222 H HIS A 131 20.528 -3.013 42.797 1.00 0.00 H ATOM 1223 N PRO A 132 20.273 -7.367 43.548 1.00 31.88 N ATOM 1224 CA PRO A 132 19.211 -8.384 43.697 1.00 32.10 C ATOM 1225 C PRO A 132 18.072 -8.056 44.676 1.00 32.47 C ATOM 1226 O PRO A 132 16.973 -8.590 44.529 1.00 33.03 O ATOM 1227 CB PRO A 132 19.982 -9.623 44.158 1.00 32.07 C ATOM 1228 CG PRO A 132 21.306 -9.477 43.518 1.00 32.25 C ATOM 1229 CD PRO A 132 21.612 -7.991 43.535 1.00 31.73 C ATOM 1230 N LEU A 133 18.319 -7.191 45.655 1.00 32.34 N ATOM 1231 CA LEU A 133 17.254 -6.773 46.577 1.00 32.59 C ATOM 1232 C LEU A 133 16.741 -5.344 46.343 1.00 32.14 C ATOM 1233 O LEU A 133 16.129 -4.755 47.238 1.00 32.15 O ATOM 1234 CB LEU A 133 17.711 -6.939 48.034 1.00 32.57 C ATOM 1235 CG LEU A 133 18.362 -8.268 48.437 1.00 33.56 C ATOM 1236 CD1 LEU A 133 18.719 -8.236 49.924 1.00 35.39 C ATOM 1237 CD2 LEU A 133 17.490 -9.481 48.106 1.00 34.73 C ATOM 1238 H LEU A 133 19.278 -6.805 45.770 1.00 0.00 H ATOM 1239 N SER A 134 16.984 -4.795 45.149 1.00 31.62 N ATOM 1240 CA SER A 134 16.671 -3.380 44.865 1.00 31.41 C ATOM 1241 C SER A 134 15.226 -3.123 44.423 1.00 31.25 C ATOM 1242 O SER A 134 14.774 -1.973 44.431 1.00 31.06 O ATOM 1243 CB SER A 134 17.636 -2.796 43.827 1.00 31.17 C ATOM 1244 OG SER A 134 17.531 -3.504 42.603 1.00 30.72 O ATOM 1245 HG SER A 134 17.756 -4.456 42.754 1.00 0.00 H ATOM 1246 H SER A 134 17.405 -5.380 44.399 1.00 0.00 H ATOM 1247 N GLU A 135 14.521 -4.174 44.006 1.00 31.07 N ATOM 1248 CA GLU A 135 13.078 -4.067 43.737 1.00 31.42 C ATOM 1249 C GLU A 135 12.339 -5.254 44.337 1.00 30.98 C ATOM 1250 O GLU A 135 12.504 -6.395 43.884 1.00 30.24 O ATOM 1251 CB GLU A 135 12.760 -3.999 42.240 1.00 32.28 C ATOM 1252 CG GLU A 135 13.664 -3.149 41.391 1.00 34.10 C ATOM 1253 CD GLU A 135 13.530 -3.495 39.921 1.00 37.09 C ATOM 1254 OE1 GLU A 135 12.610 -2.971 39.267 1.00 38.29 O ATOM 1255 OE2 GLU A 135 14.344 -4.303 39.423 1.00 39.01 O ATOM 1256 H GLU A 135 14.999 -5.087 43.868 1.00 0.00 H ATOM 1257 N LEU A 136 11.523 -4.975 45.350 1.00 30.67 N ATOM 1258 CA LEU A 136 10.774 -6.014 46.047 1.00 30.90 C ATOM 1259 C LEU A 136 9.295 -5.661 46.124 1.00 30.98 C ATOM 1260 O LEU A 136 8.938 -4.509 46.357 1.00 31.05 O ATOM 1261 CB LEU A 136 11.329 -6.229 47.459 1.00 30.90 C ATOM 1262 CG LEU A 136 12.820 -6.561 47.623 1.00 31.05 C ATOM 1263 CD1 LEU A 136 13.238 -6.434 49.075 1.00 31.96 C ATOM 1264 CD2 LEU A 136 13.152 -7.949 47.089 1.00 30.69 C ATOM 1265 H LEU A 136 11.416 -3.986 45.654 1.00 0.00 H ATOM 1266 N SER A 137 8.444 -6.655 45.908 1.00 31.03 N ATOM 1267 CA SER A 137 7.008 -6.480 46.087 1.00 31.45 C ATOM 1268 C SER A 137 6.533 -7.241 47.309 1.00 31.07 C ATOM 1269 O SER A 137 6.998 -8.353 47.606 1.00 31.02 O ATOM 1270 CB SER A 137 6.205 -6.884 44.842 1.00 31.24 C ATOM 1271 OG SER A 137 6.638 -8.122 44.326 1.00 34.14 O ATOM 1272 HG SER A 137 7.594 -8.058 44.075 1.00 0.00 H ATOM 1273 H SER A 137 8.809 -7.580 45.604 1.00 0.00 H ATOM 1274 N ARG A 138 5.620 -6.612 48.032 1.00 30.97 N ATOM 1275 CA ARG A 138 5.112 -7.178 49.265 1.00 30.87 C ATOM 1276 C ARG A 138 3.615 -7.008 49.335 1.00 31.12 C ATOM 1277 O ARG A 138 3.088 -5.925 49.073 1.00 30.46 O ATOM 1278 CB ARG A 138 5.767 -6.517 50.477 1.00 31.10 C ATOM 1279 CG ARG A 138 7.262 -6.783 50.604 1.00 31.03 C ATOM 1280 CD ARG A 138 7.529 -8.176 51.142 1.00 32.71 C ATOM 1281 NE ARG A 138 8.946 -8.336 51.460 1.00 34.54 N ATOM 1282 CZ ARG A 138 9.825 -8.900 50.644 1.00 33.82 C ATOM 1283 NH1 ARG A 138 9.429 -9.370 49.469 1.00 35.46 N ATOM 1284 NH2 ARG A 138 11.095 -8.995 51.000 1.00 34.13 N ATOM 1285 HE ARG A 138 9.284 -7.987 52.380 1.00 0.00 H ATOM 1286 HH12 ARG A 138 10.117 -9.813 48.827 1.00 0.00 H ATOM 1287 HH11 ARG A 138 8.430 -9.296 49.189 1.00 0.00 H ATOM 1288 HH22 ARG A 138 11.783 -9.438 50.358 1.00 0.00 H ATOM 1289 HH21 ARG A 138 11.406 -8.627 51.922 1.00 0.00 H ATOM 1290 H ARG A 138 5.260 -5.692 47.708 1.00 0.00 H ATOM 1291 N LYS A 139 2.942 -8.107 49.665 1.00 31.44 N ATOM 1292 CA LYS A 139 1.552 -8.066 50.053 1.00 31.80 C ATOM 1293 C LYS A 139 1.518 -7.940 51.571 1.00 32.03 C ATOM 1294 O LYS A 139 2.214 -8.673 52.281 1.00 32.44 O ATOM 1295 CB LYS A 139 0.830 -9.330 49.601 1.00 31.87 C ATOM 1296 CG LYS A 139 -0.658 -9.324 49.902 1.00 32.60 C ATOM 1297 CD LYS A 139 -1.447 -8.638 48.797 1.00 34.81 C ATOM 1298 CE LYS A 139 -2.906 -8.526 49.192 1.00 35.90 C ATOM 1299 NZ LYS A 139 -3.815 -8.158 48.074 1.00 36.21 N ATOM 1300 HZ1 LYS A 139 -3.532 -7.235 47.688 1.00 0.00 H ATOM 1301 HZ2 LYS A 139 -3.755 -8.880 47.328 1.00 0.00 H ATOM 1302 HZ3 LYS A 139 -4.792 -8.102 48.427 1.00 0.00 H ATOM 1303 H LYS A 139 3.432 -9.024 49.643 1.00 0.00 H ATOM 1304 N ILE A 140 0.710 -7.013 52.069 1.00 32.16 N ATOM 1305 CA ILE A 140 0.721 -6.666 53.483 1.00 32.61 C ATOM 1306 C ILE A 140 -0.661 -6.853 54.116 1.00 32.89 C ATOM 1307 O ILE A 140 -1.664 -6.388 53.568 1.00 32.85 O ATOM 1308 CB ILE A 140 1.195 -5.195 53.686 1.00 32.40 C ATOM 1309 CG1 ILE A 140 2.541 -4.935 52.989 1.00 33.48 C ATOM 1310 CG2 ILE A 140 1.255 -4.827 55.166 1.00 32.30 C ATOM 1311 CD1 ILE A 140 3.694 -5.746 53.530 1.00 34.15 C ATOM 1312 H ILE A 140 0.051 -6.521 51.432 1.00 0.00 H ATOM 1313 N VAL A 141 -0.698 -7.543 55.257 1.00 33.56 N ATOM 1314 CA VAL A 141 -1.921 -7.690 56.068 1.00 34.94 C ATOM 1315 C VAL A 141 -1.750 -6.948 57.394 1.00 35.05 C ATOM 1316 O VAL A 141 -0.624 -6.796 57.888 1.00 35.17 O ATOM 1317 CB VAL A 141 -2.287 -9.188 56.330 1.00 35.19 C ATOM 1318 CG1 VAL A 141 -3.712 -9.334 56.866 1.00 36.10 C ATOM 1319 CG2 VAL A 141 -2.192 -9.981 55.064 1.00 35.96 C ATOM 1320 H VAL A 141 0.176 -7.998 55.590 1.00 0.00 H ATOM 1321 N ALA A 142 -2.867 -6.465 57.939 1.00 35.34 N ATOM 1322 CA ALA A 142 -2.902 -5.770 59.228 1.00 35.93 C ATOM 1323 C ALA A 142 -2.261 -6.608 60.331 1.00 36.47 C ATOM 1324 O ALA A 142 -2.499 -7.815 60.397 1.00 36.72 O ATOM 1325 CB ALA A 142 -4.332 -5.431 59.596 1.00 35.76 C ATOM 1326 H ALA A 142 -3.761 -6.588 57.422 1.00 0.00 H TER 1327 ALA A 142 ATOM 1328 N MET B 5 -2.817 -10.828 31.959 1.00 24.67 N ATOM 1329 CA MET B 5 -1.650 -9.890 31.932 1.00 24.66 C ATOM 1330 C MET B 5 -1.975 -8.576 32.636 1.00 24.24 C ATOM 1331 O MET B 5 -3.097 -8.066 32.520 1.00 24.59 O ATOM 1332 CB MET B 5 -1.228 -9.611 30.481 1.00 24.03 C ATOM 1333 CG MET B 5 -0.145 -8.566 30.352 1.00 25.42 C ATOM 1334 SD MET B 5 0.370 -8.346 28.654 1.00 27.19 S ATOM 1335 CE MET B 5 1.423 -9.771 28.455 1.00 27.25 C ATOM 1336 HN3 MET B 5 -3.626 -10.387 31.478 1.00 0.00 H ATOM 1337 HN2 MET B 5 -3.070 -11.036 32.946 1.00 0.00 H ATOM 1338 HN1 MET B 5 -2.562 -11.711 31.472 1.00 0.00 H ATOM 1339 N LYS B 6 -0.994 -8.033 33.357 1.00 24.18 N ATOM 1340 CA LYS B 6 -1.100 -6.671 33.916 1.00 24.33 C ATOM 1341 C LYS B 6 -0.008 -5.797 33.334 1.00 23.33 C ATOM 1342 O LYS B 6 1.154 -6.193 33.304 1.00 22.80 O ATOM 1343 CB LYS B 6 -0.984 -6.682 35.443 1.00 25.15 C ATOM 1344 CG LYS B 6 -2.061 -7.492 36.161 1.00 28.26 C ATOM 1345 CD LYS B 6 -3.223 -6.625 36.666 1.00 34.04 C ATOM 1346 CE LYS B 6 -4.028 -5.967 35.546 1.00 35.57 C ATOM 1347 NZ LYS B 6 -5.390 -5.524 35.999 1.00 38.68 N ATOM 1348 HZ1 LYS B 6 -5.926 -6.348 36.338 1.00 0.00 H ATOM 1349 HZ2 LYS B 6 -5.290 -4.833 36.770 1.00 0.00 H ATOM 1350 HZ3 LYS B 6 -5.893 -5.085 35.202 1.00 0.00 H ATOM 1351 H LYS B 6 -0.130 -8.585 33.531 1.00 0.00 H ATOM 1352 N MET B 7 -0.377 -4.613 32.861 1.00 23.05 N ATOM 1353 CA MET B 7 0.611 -3.673 32.318 1.00 23.00 C ATOM 1354 C MET B 7 0.460 -2.318 32.988 1.00 22.21 C ATOM 1355 O MET B 7 -0.652 -1.890 33.280 1.00 22.29 O ATOM 1356 CB MET B 7 0.413 -3.469 30.811 1.00 23.67 C ATOM 1357 CG MET B 7 0.491 -4.714 29.946 1.00 26.92 C ATOM 1358 SD MET B 7 0.297 -4.318 28.187 1.00 36.24 S ATOM 1359 CE MET B 7 1.101 -2.717 28.119 1.00 28.41 C ATOM 1360 H MET B 7 -1.382 -4.347 32.875 1.00 0.00 H ATOM 1361 N LEU B 8 1.579 -1.658 33.226 1.00 21.52 N ATOM 1362 CA LEU B 8 1.567 -0.255 33.602 1.00 21.38 C ATOM 1363 C LEU B 8 2.287 0.513 32.502 1.00 20.44 C ATOM 1364 O LEU B 8 3.441 0.209 32.181 1.00 20.36 O ATOM 1365 CB LEU B 8 2.233 -0.042 34.966 1.00 21.29 C ATOM 1366 CG LEU B 8 2.559 1.396 35.408 1.00 23.06 C ATOM 1367 CD1 LEU B 8 1.320 2.253 35.563 1.00 25.89 C ATOM 1368 CD2 LEU B 8 3.331 1.354 36.713 1.00 25.89 C ATOM 1369 H LEU B 8 2.489 -2.154 33.142 1.00 0.00 H ATOM 1370 N LEU B 9 1.615 1.508 31.938 1.00 19.99 N ATOM 1371 CA LEU B 9 2.171 2.268 30.809 1.00 20.23 C ATOM 1372 C LEU B 9 2.516 3.676 31.239 1.00 20.45 C ATOM 1373 O LEU B 9 1.627 4.442 31.614 1.00 20.99 O ATOM 1374 CB LEU B 9 1.188 2.324 29.642 1.00 20.05 C ATOM 1375 CG LEU B 9 0.684 1.024 28.999 1.00 21.03 C ATOM 1376 CD1 LEU B 9 -0.660 0.646 29.572 1.00 21.87 C ATOM 1377 CD2 LEU B 9 0.568 1.183 27.487 1.00 22.46 C ATOM 1378 H LEU B 9 0.673 1.756 32.303 1.00 0.00 H ATOM 1379 N ILE B 10 3.803 4.015 31.187 1.00 21.15 N ATOM 1380 CA ILE B 10 4.274 5.313 31.690 1.00 21.60 C ATOM 1381 C ILE B 10 4.850 6.165 30.552 1.00 21.98 C ATOM 1382 O ILE B 10 5.822 5.787 29.899 1.00 22.58 O ATOM 1383 CB ILE B 10 5.270 5.177 32.878 1.00 21.35 C ATOM 1384 CG1 ILE B 10 4.643 4.346 34.015 1.00 22.59 C ATOM 1385 CG2 ILE B 10 5.660 6.544 33.405 1.00 20.67 C ATOM 1386 CD1 ILE B 10 5.601 3.991 35.117 1.00 24.39 C ATOM 1387 H ILE B 10 4.489 3.347 30.782 1.00 0.00 H ATOM 1388 N HIS B 11 4.220 7.307 30.314 1.00 22.22 N ATOM 1389 CA HIS B 11 4.697 8.253 29.311 1.00 22.39 C ATOM 1390 C HIS B 11 5.882 8.974 29.920 1.00 22.76 C ATOM 1391 O HIS B 11 5.741 9.704 30.909 1.00 23.54 O ATOM 1392 CB HIS B 11 3.574 9.226 28.921 1.00 22.58 C ATOM 1393 CG HIS B 11 3.890 10.084 27.733 1.00 23.24 C ATOM 1394 ND1 HIS B 11 3.223 11.261 27.473 1.00 23.47 N ATOM 1395 CD2 HIS B 11 4.810 9.947 26.747 1.00 24.07 C ATOM 1396 CE1 HIS B 11 3.699 11.798 26.363 1.00 24.91 C ATOM 1397 NE2 HIS B 11 4.669 11.027 25.909 1.00 24.28 N ATOM 1398 H HIS B 11 3.363 7.535 30.857 1.00 0.00 H ATOM 1399 N SER B 12 7.057 8.734 29.353 1.00 22.44 N ATOM 1400 CA SER B 12 8.306 9.120 29.988 1.00 23.37 C ATOM 1401 C SER B 12 9.148 10.059 29.134 1.00 23.70 C ATOM 1402 O SER B 12 9.141 9.960 27.913 1.00 23.53 O ATOM 1403 CB SER B 12 9.129 7.867 30.312 1.00 23.32 C ATOM 1404 OG SER B 12 8.356 6.929 31.029 1.00 24.19 O ATOM 1405 HG SER B 12 7.572 6.664 30.485 1.00 0.00 H ATOM 1406 H SER B 12 7.085 8.257 28.429 1.00 0.00 H ATOM 1407 N ASP B 13 9.871 10.965 29.789 1.00 24.51 N ATOM 1408 CA ASP B 13 10.907 11.751 29.111 1.00 25.33 C ATOM 1409 C ASP B 13 12.020 10.810 28.654 1.00 25.57 C ATOM 1410 O ASP B 13 12.556 10.974 27.563 1.00 25.44 O ATOM 1411 CB ASP B 13 11.471 12.829 30.036 1.00 25.64 C ATOM 1412 CG ASP B 13 10.396 13.741 30.580 1.00 26.85 C ATOM 1413 OD1 ASP B 13 9.759 14.446 29.774 1.00 27.53 O ATOM 1414 OD2 ASP B 13 10.185 13.737 31.814 1.00 28.19 O ATOM 1415 H ASP B 13 9.697 11.119 30.803 1.00 0.00 H ATOM 1416 N TYR B 14 12.353 9.824 29.495 1.00 26.01 N ATOM 1417 CA TYR B 14 13.307 8.758 29.132 1.00 26.50 C ATOM 1418 C TYR B 14 13.085 7.502 29.958 1.00 26.71 C ATOM 1419 O TYR B 14 12.500 7.546 31.046 1.00 26.83 O ATOM 1420 CB TYR B 14 14.777 9.203 29.305 1.00 26.73 C ATOM 1421 CG TYR B 14 15.073 9.745 30.676 1.00 26.67 C ATOM 1422 CD1 TYR B 14 15.355 8.889 31.742 1.00 27.94 C ATOM 1423 CD2 TYR B 14 15.029 11.116 30.922 1.00 28.30 C ATOM 1424 CE1 TYR B 14 15.588 9.386 33.018 1.00 28.50 C ATOM 1425 CE2 TYR B 14 15.276 11.625 32.188 1.00 28.26 C ATOM 1426 CZ TYR B 14 15.549 10.754 33.229 1.00 29.09 C ATOM 1427 OH TYR B 14 15.791 11.251 34.486 1.00 28.97 O ATOM 1428 HH TYR B 14 15.967 10.501 35.108 1.00 0.00 H ATOM 1429 H TYR B 14 11.923 9.808 30.442 1.00 0.00 H ATOM 1430 N LEU B 15 13.569 6.386 29.425 1.00 26.47 N ATOM 1431 CA LEU B 15 13.815 5.197 30.211 1.00 26.85 C ATOM 1432 C LEU B 15 15.213 4.703 29.843 1.00 26.81 C ATOM 1433 O LEU B 15 15.523 4.566 28.661 1.00 26.91 O ATOM 1434 CB LEU B 15 12.764 4.126 29.913 1.00 26.71 C ATOM 1435 CG LEU B 15 12.765 2.781 30.666 1.00 28.19 C ATOM 1436 CD1 LEU B 15 13.849 1.798 30.147 1.00 27.01 C ATOM 1437 CD2 LEU B 15 12.878 2.962 32.179 1.00 29.59 C ATOM 1438 H LEU B 15 13.779 6.366 28.407 1.00 0.00 H ATOM 1439 N GLU B 16 16.047 4.468 30.851 1.00 27.02 N ATOM 1440 CA GLU B 16 17.373 3.887 30.650 1.00 28.08 C ATOM 1441 C GLU B 16 17.501 2.689 31.564 1.00 27.98 C ATOM 1442 O GLU B 16 16.927 2.676 32.653 1.00 27.64 O ATOM 1443 CB GLU B 16 18.485 4.894 30.982 1.00 28.54 C ATOM 1444 CG GLU B 16 18.292 6.272 30.362 1.00 31.54 C ATOM 1445 CD GLU B 16 19.418 7.260 30.687 1.00 35.66 C ATOM 1446 OE1 GLU B 16 20.012 7.177 31.783 1.00 36.38 O ATOM 1447 OE2 GLU B 16 19.692 8.134 29.834 1.00 38.44 O ATOM 1448 H GLU B 16 15.745 4.706 31.817 1.00 0.00 H ATOM 1449 N PHE B 17 18.253 1.683 31.133 1.00 28.07 N ATOM 1450 CA PHE B 17 18.513 0.529 31.992 1.00 28.52 C ATOM 1451 C PHE B 17 19.940 -0.013 31.845 1.00 29.01 C ATOM 1452 O PHE B 17 20.611 0.221 30.828 1.00 28.42 O ATOM 1453 CB PHE B 17 17.492 -0.580 31.734 1.00 28.58 C ATOM 1454 CG PHE B 17 17.577 -1.177 30.354 1.00 29.78 C ATOM 1455 CD1 PHE B 17 18.602 -2.051 30.024 1.00 31.01 C ATOM 1456 CD2 PHE B 17 16.616 -0.872 29.390 1.00 31.93 C ATOM 1457 CE1 PHE B 17 18.689 -2.596 28.748 1.00 31.55 C ATOM 1458 CE2 PHE B 17 16.686 -1.429 28.115 1.00 30.50 C ATOM 1459 CZ PHE B 17 17.723 -2.290 27.798 1.00 31.82 C ATOM 1460 H PHE B 17 18.660 1.716 30.177 1.00 0.00 H ATOM 1461 N GLU B 18 20.382 -0.751 32.859 1.00 29.51 N ATOM 1462 CA GLU B 18 21.685 -1.417 32.820 1.00 31.00 C ATOM 1463 C GLU B 18 21.567 -2.751 33.546 1.00 31.20 C ATOM 1464 O GLU B 18 21.381 -2.781 34.758 1.00 31.21 O ATOM 1465 CB GLU B 18 22.763 -0.527 33.462 1.00 31.26 C ATOM 1466 CG GLU B 18 24.191 -1.071 33.389 1.00 33.90 C ATOM 1467 CD GLU B 18 25.170 -0.297 34.280 1.00 36.89 C ATOM 1468 OE1 GLU B 18 25.047 0.947 34.414 1.00 35.99 O ATOM 1469 OE2 GLU B 18 26.074 -0.944 34.847 1.00 38.24 O ATOM 1470 H GLU B 18 19.785 -0.858 33.704 1.00 0.00 H ATOM 1471 N ALA B 19 21.658 -3.846 32.793 1.00 31.90 N ATOM 1472 CA ALA B 19 21.640 -5.181 33.379 1.00 32.83 C ATOM 1473 C ALA B 19 22.907 -5.360 34.208 1.00 33.87 C ATOM 1474 O ALA B 19 24.014 -5.046 33.748 1.00 33.93 O ATOM 1475 CB ALA B 19 21.535 -6.237 32.309 1.00 32.19 C ATOM 1476 H ALA B 19 21.744 -3.746 31.761 1.00 0.00 H ATOM 1477 N LYS B 20 22.735 -5.836 35.437 1.00 34.77 N ATOM 1478 CA LYS B 20 23.842 -5.918 36.381 1.00 36.13 C ATOM 1479 C LYS B 20 24.225 -7.349 36.729 1.00 37.17 C ATOM 1480 O LYS B 20 25.398 -7.718 36.637 1.00 37.95 O ATOM 1481 CB LYS B 20 23.530 -5.118 37.652 1.00 35.85 C ATOM 1482 CG LYS B 20 23.580 -3.614 37.454 1.00 35.72 C ATOM 1483 CD LYS B 20 23.187 -2.879 38.728 1.00 36.68 C ATOM 1484 CE LYS B 20 24.252 -2.987 39.804 1.00 36.80 C ATOM 1485 NZ LYS B 20 25.416 -2.129 39.495 1.00 38.20 N ATOM 1486 HZ1 LYS B 20 25.830 -2.423 38.587 1.00 0.00 H ATOM 1487 HZ2 LYS B 20 25.108 -1.138 39.432 1.00 0.00 H ATOM 1488 HZ3 LYS B 20 26.126 -2.225 40.249 1.00 0.00 H ATOM 1489 H LYS B 20 21.790 -6.157 35.731 1.00 0.00 H ATOM 1490 N GLU B 21 23.244 -8.141 37.145 1.00 38.29 N ATOM 1491 CA GLU B 21 23.482 -9.527 37.529 1.00 39.18 C ATOM 1492 C GLU B 21 22.433 -10.436 36.928 1.00 39.44 C ATOM 1493 O GLU B 21 21.271 -10.044 36.771 1.00 39.39 O ATOM 1494 CB GLU B 21 23.467 -9.692 39.049 1.00 39.47 C ATOM 1495 CG GLU B 21 24.668 -9.108 39.773 1.00 41.05 C ATOM 1496 CD GLU B 21 24.585 -9.320 41.273 1.00 43.26 C ATOM 1497 OE1 GLU B 21 24.490 -8.312 42.004 1.00 44.54 O ATOM 1498 OE2 GLU B 21 24.603 -10.492 41.716 1.00 43.67 O ATOM 1499 H GLU B 21 22.277 -7.761 37.198 1.00 0.00 H ATOM 1500 N LYS B 22 22.859 -11.653 36.610 1.00 39.85 N ATOM 1501 CA LYS B 22 21.981 -12.690 36.094 1.00 40.49 C ATOM 1502 C LYS B 22 21.183 -13.339 37.213 1.00 40.84 C ATOM 1503 O LYS B 22 21.655 -13.428 38.353 1.00 40.41 O ATOM 1504 CB LYS B 22 22.807 -13.773 35.395 1.00 40.51 C ATOM 1505 CG LYS B 22 23.622 -13.289 34.208 1.00 41.09 C ATOM 1506 CD LYS B 22 24.535 -14.380 33.622 1.00 42.93 C ATOM 1507 CE LYS B 22 23.818 -15.245 32.598 1.00 44.39 C ATOM 1508 NZ LYS B 22 22.945 -16.280 33.232 1.00 45.64 N ATOM 1509 HZ1 LYS B 22 23.526 -16.904 33.828 1.00 0.00 H ATOM 1510 HZ2 LYS B 22 22.224 -15.812 33.817 1.00 0.00 H ATOM 1511 HZ3 LYS B 22 22.480 -16.841 32.490 1.00 0.00 H ATOM 1512 H LYS B 22 23.867 -11.874 36.736 1.00 0.00 H ATOM 1513 N THR B 23 19.962 -13.758 36.885 1.00 41.48 N ATOM 1514 CA THR B 23 19.249 -14.773 37.660 1.00 41.85 C ATOM 1515 C THR B 23 19.422 -16.113 36.940 1.00 42.23 C ATOM 1516 O THR B 23 20.032 -16.179 35.867 1.00 41.75 O ATOM 1517 CB THR B 23 17.728 -14.484 37.790 1.00 41.96 C ATOM 1518 OG1 THR B 23 17.119 -14.524 36.492 1.00 41.74 O ATOM 1519 CG2 THR B 23 17.458 -13.133 38.443 1.00 41.93 C ATOM 1520 HG1 THR B 23 17.536 -13.839 35.912 1.00 0.00 H ATOM 1521 H THR B 23 19.499 -13.349 36.048 1.00 0.00 H ATOM 1522 N LYS B 24 18.872 -17.166 37.546 1.00 43.12 N ATOM 1523 CA LYS B 24 18.771 -18.512 36.974 1.00 44.05 C ATOM 1524 C LYS B 24 18.214 -18.535 35.543 1.00 44.34 C ATOM 1525 O LYS B 24 18.614 -19.365 34.716 1.00 44.54 O ATOM 1526 CB LYS B 24 17.853 -19.349 37.874 1.00 44.31 C ATOM 1527 CG LYS B 24 17.555 -20.758 37.377 1.00 45.49 C ATOM 1528 CD LYS B 24 16.076 -21.097 37.489 1.00 47.55 C ATOM 1529 CE LYS B 24 15.614 -21.208 38.938 1.00 48.87 C ATOM 1530 NZ LYS B 24 14.168 -21.559 39.033 1.00 49.95 N ATOM 1531 HZ1 LYS B 24 13.602 -20.823 38.565 1.00 0.00 H ATOM 1532 HZ2 LYS B 24 14.003 -22.474 38.566 1.00 0.00 H ATOM 1533 HZ3 LYS B 24 13.894 -21.625 40.034 1.00 0.00 H ATOM 1534 H LYS B 24 18.484 -17.021 38.500 1.00 0.00 H ATOM 1535 N ILE B 25 17.289 -17.618 35.269 1.00 44.51 N ATOM 1536 CA ILE B 25 16.523 -17.596 34.018 1.00 44.72 C ATOM 1537 C ILE B 25 16.871 -16.396 33.124 1.00 44.63 C ATOM 1538 O ILE B 25 16.075 -15.989 32.277 1.00 44.33 O ATOM 1539 CB ILE B 25 15.007 -17.598 34.312 1.00 44.80 C ATOM 1540 CG1 ILE B 25 14.696 -16.618 35.454 1.00 45.51 C ATOM 1541 CG2 ILE B 25 14.537 -19.010 34.655 1.00 45.37 C ATOM 1542 CD1 ILE B 25 13.269 -16.112 35.503 1.00 46.14 C ATOM 1543 H ILE B 25 17.100 -16.880 35.977 1.00 0.00 H ATOM 1544 N ALA B 26 18.065 -15.838 33.323 1.00 44.40 N ATOM 1545 CA ALA B 26 18.548 -14.720 32.525 1.00 44.39 C ATOM 1546 C ALA B 26 18.610 -15.114 31.054 1.00 44.45 C ATOM 1547 O ALA B 26 19.205 -16.135 30.703 1.00 44.52 O ATOM 1548 CB ALA B 26 19.921 -14.268 33.018 1.00 44.28 C ATOM 1549 H ALA B 26 18.674 -16.215 34.077 1.00 0.00 H ATOM 1550 N GLU B 27 17.974 -14.322 30.195 1.00 44.25 N ATOM 1551 CA GLU B 27 18.044 -14.589 28.765 1.00 44.10 C ATOM 1552 C GLU B 27 19.455 -14.280 28.270 1.00 44.09 C ATOM 1553 O GLU B 27 20.142 -13.416 28.830 1.00 43.92 O ATOM 1554 CB GLU B 27 16.989 -13.793 27.983 1.00 44.10 C ATOM 1555 CG GLU B 27 17.340 -12.338 27.743 1.00 43.55 C ATOM 1556 CD GLU B 27 16.364 -11.639 26.814 1.00 43.91 C ATOM 1557 OE1 GLU B 27 15.672 -10.725 27.294 1.00 43.02 O ATOM 1558 OE2 GLU B 27 16.292 -11.992 25.617 1.00 43.74 O ATOM 1559 H GLU B 27 17.426 -13.511 30.545 1.00 0.00 H ATOM 1560 N GLU B 28 19.879 -15.004 27.238 1.00 44.19 N ATOM 1561 CA GLU B 28 21.160 -14.763 26.589 1.00 44.87 C ATOM 1562 C GLU B 28 20.988 -13.649 25.573 1.00 45.15 C ATOM 1563 O GLU B 28 20.201 -13.773 24.630 1.00 45.63 O ATOM 1564 CB GLU B 28 21.374 -16.044 25.649 1.00 45.60 C ATOM 1565 CG GLU B 28 20.304 -16.553 24.696 1.00 45.51 C ATOM 1566 CD GLU B 28 20.705 -17.845 24.009 1.00 45.42 C ATOM 1567 OE1 GLU B 28 20.997 -18.831 24.719 1.00 45.40 O ATOM 1568 OE2 GLU B 28 20.725 -17.877 22.760 1.00 45.40 O ATOM 1569 H GLU B 28 19.273 -15.771 26.881 1.00 0.00 H ATOM 1570 N THR B 29 21.713 -12.554 25.782 1.00 45.38 N ATOM 1571 CA THR B 29 21.601 -11.378 24.924 1.00 45.56 C ATOM 1572 C THR B 29 22.843 -10.487 24.970 1.00 45.62 C ATOM 1573 O THR B 29 23.680 -10.600 25.871 1.00 46.05 O ATOM 1574 CB THR B 29 20.341 -10.538 25.260 1.00 45.65 C ATOM 1575 OG1 THR B 29 20.177 -9.506 24.278 1.00 45.88 O ATOM 1576 CG2 THR B 29 20.445 -9.909 26.659 1.00 45.74 C ATOM 1577 HG1 THR B 29 19.372 -8.971 24.494 1.00 0.00 H ATOM 1578 H THR B 29 22.379 -12.535 26.580 1.00 0.00 H ATOM 1579 N GLU B 30 22.941 -9.603 23.983 1.00 45.58 N ATOM 1580 CA GLU B 30 23.969 -8.572 23.942 1.00 45.57 C ATOM 1581 C GLU B 30 23.441 -7.230 24.488 1.00 44.77 C ATOM 1582 O GLU B 30 24.184 -6.477 25.109 1.00 44.88 O ATOM 1583 CB GLU B 30 24.540 -8.437 22.514 1.00 45.92 C ATOM 1584 CG GLU B 30 23.650 -7.736 21.455 1.00 47.72 C ATOM 1585 CD GLU B 30 22.184 -8.182 21.462 1.00 49.94 C ATOM 1586 OE1 GLU B 30 21.905 -9.395 21.286 1.00 50.29 O ATOM 1587 OE2 GLU B 30 21.311 -7.302 21.645 1.00 50.39 O ATOM 1588 H GLU B 30 22.253 -9.649 23.205 1.00 0.00 H ATOM 1589 N ASN B 31 22.156 -6.957 24.262 1.00 44.17 N ATOM 1590 CA ASN B 31 21.516 -5.712 24.690 1.00 42.98 C ATOM 1591 C ASN B 31 21.292 -5.674 26.200 1.00 42.12 C ATOM 1592 O ASN B 31 20.184 -5.944 26.679 1.00 42.32 O ATOM 1593 CB ASN B 31 20.403 -5.395 23.918 1.00 46.63 C ATOM 1594 CG ASN B 31 19.930 -3.960 24.049 1.00 46.63 C ATOM 1595 OD1 ASN B 31 19.698 -3.468 25.153 1.00 46.73 O ATOM 1596 ND2 ASN B 31 19.782 -3.282 22.917 1.00 46.73 N ATOM 1597 HD22 ASN B 31 19.990 -3.739 22.006 1.00 0.00 H ATOM 1598 HD21 ASN B 31 19.458 -2.294 22.941 1.00 0.00 H ATOM 1599 H ASN B 31 21.581 -7.662 23.758 1.00 0.00 H ATOM 1600 N LEU B 32 22.349 -5.345 26.937 1.00 40.94 N ATOM 1601 CA LEU B 32 22.305 -5.296 28.405 1.00 40.04 C ATOM 1602 C LEU B 32 22.256 -3.859 28.948 1.00 39.12 C ATOM 1603 O LEU B 32 22.092 -3.637 30.153 1.00 39.14 O ATOM 1604 CB LEU B 32 23.493 -6.066 28.999 1.00 40.23 C ATOM 1605 CG LEU B 32 23.581 -7.568 28.676 1.00 40.11 C ATOM 1606 CD1 LEU B 32 24.873 -8.158 29.199 1.00 40.53 C ATOM 1607 CD2 LEU B 32 22.378 -8.338 29.234 1.00 40.16 C ATOM 1608 H LEU B 32 23.241 -5.113 26.456 1.00 0.00 H ATOM 1609 N LYS B 33 22.400 -2.898 28.038 1.00 37.85 N ATOM 1610 CA LYS B 33 22.338 -1.475 28.349 1.00 36.65 C ATOM 1611 C LYS B 33 21.477 -0.814 27.270 1.00 35.30 C ATOM 1612 O LYS B 33 21.530 -1.199 26.099 1.00 34.57 O ATOM 1613 CB LYS B 33 23.753 -0.892 28.357 1.00 37.15 C ATOM 1614 CG LYS B 33 23.956 0.333 29.229 1.00 38.82 C ATOM 1615 CD LYS B 33 25.447 0.649 29.374 1.00 40.26 C ATOM 1616 CE LYS B 33 25.687 2.064 29.882 1.00 41.79 C ATOM 1617 NZ LYS B 33 25.038 2.345 31.205 1.00 42.10 N ATOM 1618 HZ1 LYS B 33 24.010 2.215 31.120 1.00 0.00 H ATOM 1619 HZ2 LYS B 33 25.413 1.690 31.920 1.00 0.00 H ATOM 1620 HZ3 LYS B 33 25.243 3.324 31.489 1.00 0.00 H ATOM 1621 H LYS B 33 22.566 -3.178 27.050 1.00 0.00 H ATOM 1622 N GLY B 34 20.658 0.155 27.659 1.00 33.82 N ATOM 1623 CA GLY B 34 19.754 0.771 26.696 1.00 31.82 C ATOM 1624 C GLY B 34 19.084 2.025 27.205 1.00 30.79 C ATOM 1625 O GLY B 34 19.026 2.262 28.415 1.00 29.91 O ATOM 1626 H GLY B 34 20.661 0.474 28.649 1.00 0.00 H ATOM 1627 N LYS B 35 18.597 2.829 26.262 1.00 30.06 N ATOM 1628 CA LYS B 35 17.800 4.015 26.563 1.00 30.18 C ATOM 1629 C LYS B 35 16.895 4.393 25.399 1.00 29.35 C ATOM 1630 O LYS B 35 17.268 4.256 24.224 1.00 28.76 O ATOM 1631 CB LYS B 35 18.673 5.212 26.945 1.00 30.34 C ATOM 1632 CG LYS B 35 19.729 5.592 25.921 1.00 33.72 C ATOM 1633 CD LYS B 35 20.406 6.904 26.304 1.00 36.96 C ATOM 1634 CE LYS B 35 21.725 7.084 25.556 1.00 39.66 C ATOM 1635 NZ LYS B 35 22.833 6.299 26.170 1.00 40.43 N ATOM 1636 HZ1 LYS B 35 22.973 6.610 27.152 1.00 0.00 H ATOM 1637 HZ2 LYS B 35 22.589 5.288 26.156 1.00 0.00 H ATOM 1638 HZ3 LYS B 35 23.707 6.453 25.628 1.00 0.00 H ATOM 1639 H LYS B 35 18.793 2.602 25.266 1.00 0.00 H ATOM 1640 N LEU B 36 15.699 4.852 25.749 1.00 28.46 N ATOM 1641 CA LEU B 36 14.764 5.444 24.805 1.00 28.10 C ATOM 1642 C LEU B 36 14.192 6.714 25.417 1.00 27.49 C ATOM 1643 O LEU B 36 13.841 6.743 26.598 1.00 26.77 O ATOM 1644 CB LEU B 36 13.621 4.485 24.453 1.00 27.95 C ATOM 1645 CG LEU B 36 13.631 3.668 23.157 1.00 29.67 C ATOM 1646 CD1 LEU B 36 12.247 3.058 22.913 1.00 28.99 C ATOM 1647 CD2 LEU B 36 14.060 4.480 21.936 1.00 30.01 C ATOM 1648 H LEU B 36 15.417 4.785 26.748 1.00 0.00 H ATOM 1649 N ASP B 37 14.108 7.761 24.606 1.00 26.99 N ATOM 1650 CA ASP B 37 13.538 9.030 25.034 1.00 27.01 C ATOM 1651 C ASP B 37 12.097 9.135 24.576 1.00 26.37 C ATOM 1652 O ASP B 37 11.698 8.450 23.634 1.00 26.70 O ATOM 1653 CB ASP B 37 14.324 10.201 24.431 1.00 27.34 C ATOM 1654 CG ASP B 37 15.767 10.235 24.884 1.00 29.75 C ATOM 1655 OD1 ASP B 37 16.018 10.390 26.103 1.00 31.52 O ATOM 1656 OD2 ASP B 37 16.651 10.115 24.011 1.00 31.44 O ATOM 1657 H ASP B 37 14.461 7.672 23.632 1.00 0.00 H ATOM 1658 N GLU B 38 11.337 10.017 25.232 1.00 25.34 N ATOM 1659 CA GLU B 38 9.984 10.361 24.808 1.00 24.87 C ATOM 1660 C GLU B 38 9.211 9.097 24.439 1.00 24.75 C ATOM 1661 O GLU B 38 8.779 8.915 23.301 1.00 24.35 O ATOM 1662 CB GLU B 38 10.029 11.366 23.639 1.00 25.21 C ATOM 1663 CG GLU B 38 10.787 12.655 23.965 1.00 25.59 C ATOM 1664 CD GLU B 38 10.207 13.408 25.153 1.00 28.49 C ATOM 1665 OE1 GLU B 38 10.985 14.021 25.918 1.00 30.21 O ATOM 1666 OE2 GLU B 38 8.975 13.392 25.322 1.00 29.87 O ATOM 1667 H GLU B 38 11.726 10.477 26.080 1.00 0.00 H ATOM 1668 N CYS B 39 9.057 8.220 25.426 1.00 23.69 N ATOM 1669 CA CYS B 39 8.598 6.875 25.162 1.00 23.53 C ATOM 1670 C CYS B 39 7.453 6.499 26.081 1.00 23.14 C ATOM 1671 O CYS B 39 7.221 7.154 27.107 1.00 22.50 O ATOM 1672 CB CYS B 39 9.759 5.886 25.360 1.00 23.41 C ATOM 1673 SG CYS B 39 10.359 5.761 27.059 1.00 25.79 S ATOM 1674 H CYS B 39 9.270 8.506 26.403 1.00 0.00 H ATOM 1675 N LEU B 40 6.750 5.440 25.690 1.00 22.28 N ATOM 1676 CA LEU B 40 5.774 4.797 26.536 1.00 22.43 C ATOM 1677 C LEU B 40 6.492 3.590 27.125 1.00 22.47 C ATOM 1678 O LEU B 40 6.787 2.625 26.405 1.00 22.86 O ATOM 1679 CB LEU B 40 4.554 4.379 25.704 1.00 21.83 C ATOM 1680 CG LEU B 40 3.273 3.993 26.435 1.00 21.95 C ATOM 1681 CD1 LEU B 40 2.770 5.140 27.299 1.00 22.23 C ATOM 1682 CD2 LEU B 40 2.212 3.602 25.424 1.00 22.13 C ATOM 1683 H LEU B 40 6.910 5.060 24.735 1.00 0.00 H ATOM 1684 N ALA B 41 6.823 3.683 28.413 1.00 21.63 N ATOM 1685 CA ALA B 41 7.496 2.608 29.124 1.00 21.51 C ATOM 1686 C ALA B 41 6.452 1.622 29.637 1.00 21.54 C ATOM 1687 O ALA B 41 5.628 1.957 30.506 1.00 21.56 O ATOM 1688 CB ALA B 41 8.328 3.163 30.260 1.00 21.20 C ATOM 1689 H ALA B 41 6.591 4.556 28.928 1.00 0.00 H ATOM 1690 N CYS B 42 6.488 0.412 29.086 1.00 20.86 N ATOM 1691 CA CYS B 42 5.423 -0.563 29.311 1.00 21.01 C ATOM 1692 C CYS B 42 5.931 -1.669 30.222 1.00 20.81 C ATOM 1693 O CYS B 42 6.583 -2.620 29.781 1.00 20.52 O ATOM 1694 CB CYS B 42 4.898 -1.125 27.992 1.00 21.47 C ATOM 1695 SG CYS B 42 4.217 0.171 26.878 1.00 23.34 S ATOM 1696 H CYS B 42 7.293 0.154 28.481 1.00 0.00 H ATOM 1697 N PHE B 43 5.630 -1.515 31.502 1.00 19.89 N ATOM 1698 CA PHE B 43 5.998 -2.513 32.508 1.00 20.40 C ATOM 1699 C PHE B 43 4.984 -3.640 32.499 1.00 20.38 C ATOM 1700 O PHE B 43 3.801 -3.409 32.703 1.00 20.29 O ATOM 1701 CB PHE B 43 6.115 -1.826 33.868 1.00 20.31 C ATOM 1702 CG PHE B 43 7.179 -0.771 33.902 1.00 20.67 C ATOM 1703 CD1 PHE B 43 8.471 -1.081 34.335 1.00 21.58 C ATOM 1704 CD2 PHE B 43 6.901 0.528 33.480 1.00 20.83 C ATOM 1705 CE1 PHE B 43 9.467 -0.107 34.349 1.00 23.68 C ATOM 1706 CE2 PHE B 43 7.877 1.501 33.475 1.00 20.20 C ATOM 1707 CZ PHE B 43 9.163 1.200 33.926 1.00 23.24 C ATOM 1708 H PHE B 43 5.118 -0.661 31.801 1.00 0.00 H ATOM 1709 N ILE B 44 5.440 -4.861 32.215 1.00 20.70 N ATOM 1710 CA ILE B 44 4.513 -5.948 31.930 1.00 20.65 C ATOM 1711 C ILE B 44 4.725 -7.184 32.815 1.00 20.79 C ATOM 1712 O ILE B 44 5.842 -7.698 32.916 1.00 21.01 O ATOM 1713 CB ILE B 44 4.568 -6.348 30.429 1.00 21.16 C ATOM 1714 CG1 ILE B 44 4.253 -5.144 29.530 1.00 19.97 C ATOM 1715 CG2 ILE B 44 3.580 -7.484 30.136 1.00 19.16 C ATOM 1716 CD1 ILE B 44 4.633 -5.359 28.063 1.00 22.88 C ATOM 1717 H ILE B 44 6.465 -5.038 32.197 1.00 0.00 H ATOM 1718 N ALA B 45 3.651 -7.623 33.472 1.00 20.84 N ATOM 1719 CA ALA B 45 3.637 -8.890 34.201 1.00 21.87 C ATOM 1720 C ALA B 45 2.770 -9.887 33.429 1.00 21.94 C ATOM 1721 O ALA B 45 1.568 -9.662 33.244 1.00 22.07 O ATOM 1722 CB ALA B 45 3.092 -8.695 35.611 1.00 21.70 C ATOM 1723 H ALA B 45 2.789 -7.041 33.466 1.00 0.00 H ATOM 1724 N VAL B 46 3.382 -10.969 32.961 1.00 22.19 N ATOM 1725 CA VAL B 46 2.653 -12.010 32.236 1.00 22.49 C ATOM 1726 C VAL B 46 2.070 -12.945 33.293 1.00 22.99 C ATOM 1727 O VAL B 46 2.779 -13.370 34.198 1.00 22.94 O ATOM 1728 CB VAL B 46 3.563 -12.768 31.239 1.00 22.86 C ATOM 1729 CG1 VAL B 46 2.766 -13.782 30.439 1.00 21.95 C ATOM 1730 CG2 VAL B 46 4.237 -11.792 30.274 1.00 22.60 C ATOM 1731 H VAL B 46 4.405 -11.079 33.114 1.00 0.00 H ATOM 1732 N GLU B 47 0.776 -13.236 33.195 1.00 23.49 N ATOM 1733 CA GLU B 47 0.084 -13.939 34.278 1.00 24.79 C ATOM 1734 C GLU B 47 -0.295 -15.374 33.955 1.00 25.54 C ATOM 1735 O GLU B 47 -0.250 -15.799 32.808 1.00 25.55 O ATOM 1736 CB GLU B 47 -1.157 -13.166 34.707 1.00 24.07 C ATOM 1737 CG GLU B 47 -0.855 -11.762 35.184 1.00 26.15 C ATOM 1738 CD GLU B 47 -2.095 -11.036 35.614 1.00 27.29 C ATOM 1739 OE1 GLU B 47 -2.955 -10.769 34.750 1.00 27.85 O ATOM 1740 OE2 GLU B 47 -2.203 -10.734 36.817 1.00 29.48 O ATOM 1741 H GLU B 47 0.250 -12.962 32.341 1.00 0.00 H ATOM 1742 N ARG B 48 -0.671 -16.115 34.993 1.00 26.94 N ATOM 1743 CA ARG B 48 -0.981 -17.536 34.856 1.00 28.51 C ATOM 1744 C ARG B 48 -2.047 -17.781 33.790 1.00 28.98 C ATOM 1745 O ARG B 48 -1.892 -18.682 32.971 1.00 29.15 O ATOM 1746 CB ARG B 48 -1.395 -18.111 36.216 1.00 28.42 C ATOM 1747 CG ARG B 48 -1.935 -19.537 36.177 1.00 30.91 C ATOM 1748 CD ARG B 48 -2.521 -19.932 37.536 1.00 34.51 C ATOM 1749 NE ARG B 48 -3.456 -18.929 38.049 1.00 36.90 N ATOM 1750 CZ ARG B 48 -4.740 -18.823 37.705 1.00 38.85 C ATOM 1751 NH1 ARG B 48 -5.290 -19.663 36.829 1.00 38.76 N ATOM 1752 NH2 ARG B 48 -5.483 -17.866 38.244 1.00 38.92 N ATOM 1753 HE ARG B 48 -3.089 -18.243 38.739 1.00 0.00 H ATOM 1754 HH12 ARG B 48 -6.293 -19.564 36.573 1.00 0.00 H ATOM 1755 HH11 ARG B 48 -4.716 -20.417 36.401 1.00 0.00 H ATOM 1756 HH22 ARG B 48 -6.485 -17.776 37.982 1.00 0.00 H ATOM 1757 HH21 ARG B 48 -5.063 -17.206 38.929 1.00 0.00 H ATOM 1758 H ARG B 48 -0.747 -15.670 35.930 1.00 0.00 H ATOM 1759 N GLU B 49 -3.100 -16.958 33.786 1.00 30.04 N ATOM 1760 CA GLU B 49 -4.188 -17.031 32.796 1.00 31.10 C ATOM 1761 C GLU B 49 -3.692 -16.893 31.365 1.00 30.62 C ATOM 1762 O GLU B 49 -4.297 -17.438 30.446 1.00 30.37 O ATOM 1763 CB GLU B 49 -5.214 -15.919 33.026 1.00 31.75 C ATOM 1764 CG GLU B 49 -6.188 -16.144 34.158 1.00 35.78 C ATOM 1765 CD GLU B 49 -6.931 -14.864 34.543 1.00 40.70 C ATOM 1766 OE1 GLU B 49 -6.287 -13.781 34.606 1.00 42.00 O ATOM 1767 OE2 GLU B 49 -8.161 -14.942 34.778 1.00 42.70 O ATOM 1768 H GLU B 49 -3.154 -16.226 34.522 1.00 0.00 H ATOM 1769 N ASP B 50 -2.584 -16.167 31.187 1.00 29.99 N ATOM 1770 CA ASP B 50 -2.020 -15.932 29.857 1.00 29.65 C ATOM 1771 C ASP B 50 -1.399 -17.192 29.225 1.00 29.83 C ATOM 1772 O ASP B 50 -1.187 -17.245 28.011 1.00 29.58 O ATOM 1773 CB ASP B 50 -0.983 -14.803 29.898 1.00 29.00 C ATOM 1774 CG ASP B 50 -1.521 -13.521 30.528 1.00 28.23 C ATOM 1775 OD1 ASP B 50 -2.746 -13.278 30.482 1.00 26.54 O ATOM 1776 OD2 ASP B 50 -0.697 -12.744 31.062 1.00 26.31 O ATOM 1777 H ASP B 50 -2.109 -15.758 32.017 1.00 0.00 H ATOM 1778 N GLU B 51 -1.105 -18.195 30.049 1.00 30.53 N ATOM 1779 CA GLU B 51 -0.556 -19.473 29.555 1.00 31.56 C ATOM 1780 C GLU B 51 -1.497 -20.202 28.606 1.00 31.82 C ATOM 1781 O GLU B 51 -1.041 -20.931 27.717 1.00 31.97 O ATOM 1782 CB GLU B 51 -0.179 -20.390 30.716 1.00 31.78 C ATOM 1783 CG GLU B 51 0.878 -19.789 31.628 1.00 33.64 C ATOM 1784 CD GLU B 51 1.501 -20.791 32.566 1.00 36.37 C ATOM 1785 OE1 GLU B 51 0.862 -21.831 32.853 1.00 37.45 O ATOM 1786 OE2 GLU B 51 2.638 -20.532 33.016 1.00 36.55 O ATOM 1787 H GLU B 51 -1.267 -18.075 31.069 1.00 0.00 H ATOM 1788 N ASN B 52 -2.800 -19.999 28.795 1.00 31.89 N ATOM 1789 CA ASN B 52 -3.822 -20.605 27.942 1.00 32.93 C ATOM 1790 C ASN B 52 -3.746 -20.147 26.482 1.00 32.43 C ATOM 1791 O ASN B 52 -4.115 -20.899 25.577 1.00 33.11 O ATOM 1792 CB ASN B 52 -5.231 -20.352 28.506 1.00 33.55 C ATOM 1793 CG ASN B 52 -5.371 -20.767 29.963 1.00 36.18 C ATOM 1794 OD1 ASN B 52 -5.878 -20.001 30.797 1.00 38.97 O ATOM 1795 ND2 ASN B 52 -4.918 -21.979 30.286 1.00 39.52 N ATOM 1796 HD22 ASN B 52 -4.500 -22.590 29.555 1.00 0.00 H ATOM 1797 HD21 ASN B 52 -4.983 -22.314 31.269 1.00 0.00 H ATOM 1798 H ASN B 52 -3.102 -19.386 29.579 1.00 0.00 H ATOM 1799 N ASN B 53 -3.261 -18.924 26.254 1.00 31.68 N ATOM 1800 CA ASN B 53 -3.142 -18.377 24.899 1.00 31.08 C ATOM 1801 C ASN B 53 -2.077 -17.280 24.812 1.00 30.71 C ATOM 1802 O ASN B 53 -2.406 -16.093 24.738 1.00 30.11 O ATOM 1803 CB ASN B 53 -4.503 -17.866 24.398 1.00 31.50 C ATOM 1804 CG ASN B 53 -4.476 -17.420 22.937 1.00 31.88 C ATOM 1805 OD1 ASN B 53 -3.462 -17.530 22.237 1.00 32.47 O ATOM 1806 ND2 ASN B 53 -5.605 -16.906 22.475 1.00 32.12 N ATOM 1807 HD22 ASN B 53 -6.435 -16.831 23.097 1.00 0.00 H ATOM 1808 HD21 ASN B 53 -5.662 -16.577 21.490 1.00 0.00 H ATOM 1809 H ASN B 53 -2.959 -18.342 27.061 1.00 0.00 H ATOM 1810 N PRO B 54 -0.796 -17.689 24.792 1.00 30.50 N ATOM 1811 CA PRO B 54 0.343 -16.764 24.835 1.00 30.21 C ATOM 1812 C PRO B 54 0.359 -15.779 23.661 1.00 30.01 C ATOM 1813 O PRO B 54 0.474 -14.577 23.877 1.00 28.84 O ATOM 1814 CB PRO B 54 1.554 -17.703 24.800 1.00 30.38 C ATOM 1815 CG PRO B 54 1.039 -18.998 25.346 1.00 30.27 C ATOM 1816 CD PRO B 54 -0.349 -19.095 24.792 1.00 30.04 C ATOM 1817 N GLU B 55 0.213 -16.288 22.438 1.00 29.95 N ATOM 1818 CA GLU B 55 0.148 -15.443 21.237 1.00 30.32 C ATOM 1819 C GLU B 55 -1.036 -14.451 21.280 1.00 29.56 C ATOM 1820 O GLU B 55 -0.883 -13.271 20.933 1.00 29.42 O ATOM 1821 CB GLU B 55 0.062 -16.315 19.971 1.00 30.75 C ATOM 1822 CG GLU B 55 1.098 -17.451 19.892 1.00 33.45 C ATOM 1823 CD GLU B 55 0.755 -18.696 20.747 1.00 36.80 C ATOM 1824 OE1 GLU B 55 -0.446 -19.049 20.890 1.00 39.03 O ATOM 1825 OE2 GLU B 55 1.700 -19.335 21.265 1.00 36.64 O ATOM 1826 H GLU B 55 0.143 -17.320 22.329 1.00 0.00 H ATOM 1827 N GLY B 56 -2.204 -14.930 21.715 1.00 28.23 N ATOM 1828 CA GLY B 56 -3.397 -14.088 21.831 1.00 27.07 C ATOM 1829 C GLY B 56 -3.242 -12.981 22.865 1.00 26.29 C ATOM 1830 O GLY B 56 -3.699 -11.848 22.664 1.00 26.05 O ATOM 1831 H GLY B 56 -2.269 -15.934 21.980 1.00 0.00 H ATOM 1832 N THR B 57 -2.577 -13.317 23.964 1.00 25.93 N ATOM 1833 CA THR B 57 -2.245 -12.366 25.021 1.00 25.03 C ATOM 1834 C THR B 57 -1.328 -11.283 24.457 1.00 25.00 C ATOM 1835 O THR B 57 -1.527 -10.095 24.724 1.00 23.86 O ATOM 1836 CB THR B 57 -1.554 -13.079 26.207 1.00 25.74 C ATOM 1837 OG1 THR B 57 -2.435 -14.070 26.762 1.00 24.91 O ATOM 1838 CG2 THR B 57 -1.161 -12.078 27.302 1.00 25.07 C ATOM 1839 HG1 THR B 57 -2.660 -14.737 26.066 1.00 0.00 H ATOM 1840 H THR B 57 -2.278 -14.307 24.078 1.00 0.00 H ATOM 1841 N ALA B 58 -0.336 -11.703 23.667 1.00 24.20 N ATOM 1842 CA ALA B 58 0.600 -10.767 23.053 1.00 24.37 C ATOM 1843 C ALA B 58 -0.131 -9.809 22.127 1.00 24.32 C ATOM 1844 O ALA B 58 0.137 -8.603 22.150 1.00 24.07 O ATOM 1845 CB ALA B 58 1.722 -11.510 22.303 1.00 24.31 C ATOM 1846 H ALA B 58 -0.228 -12.721 23.485 1.00 0.00 H ATOM 1847 N ILE B 59 -1.065 -10.343 21.333 1.00 24.11 N ATOM 1848 CA ILE B 59 -1.829 -9.522 20.392 1.00 24.14 C ATOM 1849 C ILE B 59 -2.714 -8.523 21.150 1.00 23.39 C ATOM 1850 O ILE B 59 -2.757 -7.330 20.803 1.00 22.21 O ATOM 1851 CB ILE B 59 -2.652 -10.388 19.383 1.00 24.53 C ATOM 1852 CG1 ILE B 59 -1.725 -11.245 18.500 1.00 25.98 C ATOM 1853 CG2 ILE B 59 -3.561 -9.524 18.521 1.00 25.26 C ATOM 1854 CD1 ILE B 59 -0.859 -10.466 17.545 1.00 29.17 C ATOM 1855 H ILE B 59 -1.253 -11.365 21.385 1.00 0.00 H ATOM 1856 N GLY B 60 -3.390 -9.006 22.193 1.00 22.61 N ATOM 1857 CA GLY B 60 -4.183 -8.141 23.067 1.00 22.40 C ATOM 1858 C GLY B 60 -3.381 -7.024 23.722 1.00 21.76 C ATOM 1859 O GLY B 60 -3.861 -5.896 23.844 1.00 21.25 O ATOM 1860 H GLY B 60 -3.353 -10.026 22.391 1.00 0.00 H ATOM 1861 N ALA B 61 -2.161 -7.340 24.156 1.00 21.13 N ATOM 1862 CA ALA B 61 -1.300 -6.366 24.806 1.00 20.89 C ATOM 1863 C ALA B 61 -0.879 -5.295 23.807 1.00 21.08 C ATOM 1864 O ALA B 61 -0.923 -4.099 24.122 1.00 20.58 O ATOM 1865 CB ALA B 61 -0.076 -7.042 25.427 1.00 20.72 C ATOM 1866 H ALA B 61 -1.815 -8.312 24.026 1.00 0.00 H ATOM 1867 N VAL B 62 -0.490 -5.729 22.603 1.00 21.24 N ATOM 1868 CA VAL B 62 -0.102 -4.797 21.524 1.00 21.25 C ATOM 1869 C VAL B 62 -1.256 -3.868 21.178 1.00 21.74 C ATOM 1870 O VAL B 62 -1.048 -2.666 20.996 1.00 21.67 O ATOM 1871 CB VAL B 62 0.405 -5.545 20.257 1.00 21.15 C ATOM 1872 CG1 VAL B 62 0.642 -4.575 19.087 1.00 21.30 C ATOM 1873 CG2 VAL B 62 1.689 -6.301 20.571 1.00 19.60 C ATOM 1874 H VAL B 62 -0.460 -6.753 22.421 1.00 0.00 H ATOM 1875 N GLU B 63 -2.470 -4.411 21.121 1.00 22.21 N ATOM 1876 CA GLU B 63 -3.642 -3.590 20.818 1.00 23.31 C ATOM 1877 C GLU B 63 -3.837 -2.474 21.842 1.00 22.57 C ATOM 1878 O GLU B 63 -4.104 -1.330 21.474 1.00 22.76 O ATOM 1879 CB GLU B 63 -4.894 -4.449 20.671 1.00 23.51 C ATOM 1880 CG GLU B 63 -4.900 -5.252 19.356 1.00 27.37 C ATOM 1881 CD GLU B 63 -6.270 -5.839 18.985 1.00 31.49 C ATOM 1882 OE1 GLU B 63 -7.259 -5.593 19.717 1.00 35.40 O ATOM 1883 OE2 GLU B 63 -6.350 -6.553 17.957 1.00 33.28 O ATOM 1884 H GLU B 63 -2.586 -5.430 21.294 1.00 0.00 H ATOM 1885 N GLU B 64 -3.654 -2.790 23.119 1.00 22.45 N ATOM 1886 CA GLU B 64 -3.781 -1.767 24.164 1.00 22.54 C ATOM 1887 C GLU B 64 -2.646 -0.751 24.152 1.00 21.65 C ATOM 1888 O GLU B 64 -2.896 0.453 24.349 1.00 21.03 O ATOM 1889 CB GLU B 64 -3.920 -2.404 25.544 1.00 23.37 C ATOM 1890 CG GLU B 64 -4.209 -1.413 26.659 1.00 27.09 C ATOM 1891 CD GLU B 64 -5.456 -0.575 26.415 1.00 32.30 C ATOM 1892 OE1 GLU B 64 -6.525 -1.158 26.090 1.00 32.78 O ATOM 1893 OE2 GLU B 64 -5.364 0.672 26.552 1.00 34.17 O ATOM 1894 H GLU B 64 -3.419 -3.769 23.380 1.00 0.00 H ATOM 1895 N ILE B 65 -1.412 -1.216 23.934 1.00 20.43 N ATOM 1896 CA ILE B 65 -0.269 -0.309 23.802 1.00 21.00 C ATOM 1897 C ILE B 65 -0.500 0.682 22.651 1.00 21.31 C ATOM 1898 O ILE B 65 -0.261 1.888 22.810 1.00 20.52 O ATOM 1899 CB ILE B 65 1.086 -1.069 23.625 1.00 20.92 C ATOM 1900 CG1 ILE B 65 1.448 -1.798 24.931 1.00 21.37 C ATOM 1901 CG2 ILE B 65 2.206 -0.114 23.207 1.00 22.04 C ATOM 1902 CD1 ILE B 65 2.640 -2.768 24.839 1.00 20.59 C ATOM 1903 H ILE B 65 -1.260 -2.242 23.857 1.00 0.00 H ATOM 1904 N GLU B 66 -0.941 0.161 21.503 1.00 21.28 N ATOM 1905 CA GLU B 66 -1.232 0.992 20.337 1.00 22.18 C ATOM 1906 C GLU B 66 -2.295 2.056 20.636 1.00 22.06 C ATOM 1907 O GLU B 66 -2.155 3.197 20.198 1.00 21.79 O ATOM 1908 CB GLU B 66 -1.686 0.151 19.149 1.00 21.93 C ATOM 1909 CG GLU B 66 -0.621 -0.725 18.520 1.00 23.65 C ATOM 1910 CD GLU B 66 -0.936 -1.008 17.061 1.00 26.99 C ATOM 1911 OE1 GLU B 66 -1.459 -2.102 16.768 1.00 28.16 O ATOM 1912 OE2 GLU B 66 -0.687 -0.115 16.219 1.00 28.56 O ATOM 1913 H GLU B 66 -1.082 -0.867 21.437 1.00 0.00 H ATOM 1914 N LYS B 67 -3.356 1.676 21.351 1.00 22.21 N ATOM 1915 CA LYS B 67 -4.419 2.622 21.719 1.00 23.36 C ATOM 1916 C LYS B 67 -3.851 3.809 22.486 1.00 23.05 C ATOM 1917 O LYS B 67 -4.211 4.963 22.220 1.00 23.36 O ATOM 1918 CB LYS B 67 -5.496 1.956 22.584 1.00 23.26 C ATOM 1919 CG LYS B 67 -6.418 0.998 21.876 1.00 27.75 C ATOM 1920 CD LYS B 67 -7.494 0.475 22.842 1.00 31.09 C ATOM 1921 CE LYS B 67 -8.295 -0.655 22.223 1.00 33.84 C ATOM 1922 NZ LYS B 67 -9.358 -1.103 23.163 1.00 36.44 N ATOM 1923 HZ1 LYS B 67 -8.920 -1.437 24.045 1.00 0.00 H ATOM 1924 HZ2 LYS B 67 -9.994 -0.307 23.370 1.00 0.00 H ATOM 1925 HZ3 LYS B 67 -9.900 -1.877 22.728 1.00 0.00 H ATOM 1926 H LYS B 67 -3.433 0.685 21.656 1.00 0.00 H ATOM 1927 N VAL B 68 -2.948 3.527 23.423 1.00 22.77 N ATOM 1928 CA VAL B 68 -2.358 4.576 24.250 1.00 22.68 C ATOM 1929 C VAL B 68 -1.298 5.375 23.484 1.00 22.71 C ATOM 1930 O VAL B 68 -1.300 6.611 23.528 1.00 22.53 O ATOM 1931 CB VAL B 68 -1.807 4.008 25.587 1.00 22.62 C ATOM 1932 CG1 VAL B 68 -1.060 5.078 26.385 1.00 20.79 C ATOM 1933 CG2 VAL B 68 -2.960 3.433 26.420 1.00 23.01 C ATOM 1934 H VAL B 68 -2.657 2.539 23.569 1.00 0.00 H ATOM 1935 N ALA B 69 -0.414 4.666 22.777 1.00 22.46 N ATOM 1936 CA ALA B 69 0.604 5.297 21.946 1.00 23.21 C ATOM 1937 C ALA B 69 -0.007 6.213 20.885 1.00 23.35 C ATOM 1938 O ALA B 69 0.547 7.269 20.590 1.00 23.93 O ATOM 1939 CB ALA B 69 1.491 4.244 21.280 1.00 23.28 C ATOM 1940 H ALA B 69 -0.453 3.628 22.821 1.00 0.00 H ATOM 1941 N ASN B 70 -1.137 5.795 20.322 1.00 23.46 N ATOM 1942 CA ASN B 70 -1.833 6.577 19.306 1.00 24.12 C ATOM 1943 C ASN B 70 -2.516 7.799 19.912 1.00 24.86 C ATOM 1944 O ASN B 70 -2.521 8.859 19.296 1.00 25.51 O ATOM 1945 CB ASN B 70 -2.838 5.721 18.533 1.00 23.25 C ATOM 1946 CG ASN B 70 -2.170 4.758 17.541 1.00 23.26 C ATOM 1947 OD1 ASN B 70 -2.778 3.789 17.119 1.00 22.99 O ATOM 1948 ND2 ASN B 70 -0.926 5.037 17.167 1.00 25.97 N ATOM 1949 HD22 ASN B 70 -0.443 5.874 17.551 1.00 0.00 H ATOM 1950 HD21 ASN B 70 -0.435 4.418 16.490 1.00 0.00 H ATOM 1951 H ASN B 70 -1.537 4.881 20.615 1.00 0.00 H ATOM 1952 N GLN B 71 -3.068 7.644 21.116 1.00 25.59 N ATOM 1953 CA GLN B 71 -3.709 8.744 21.849 1.00 26.79 C ATOM 1954 C GLN B 71 -2.701 9.827 22.230 1.00 26.36 C ATOM 1955 O GLN B 71 -3.027 11.019 22.229 1.00 26.46 O ATOM 1956 CB GLN B 71 -4.433 8.209 23.097 1.00 27.04 C ATOM 1957 CG GLN B 71 -5.229 9.273 23.887 1.00 30.04 C ATOM 1958 CD GLN B 71 -5.917 8.713 25.119 1.00 33.30 C ATOM 1959 OE1 GLN B 71 -5.561 7.643 25.611 1.00 35.74 O ATOM 1960 NE2 GLN B 71 -6.907 9.440 25.629 1.00 34.66 N ATOM 1961 HE22 GLN B 71 -7.176 10.339 25.181 1.00 0.00 H ATOM 1962 HE21 GLN B 71 -7.412 9.109 26.476 1.00 0.00 H ATOM 1963 H GLN B 71 -3.044 6.702 21.556 1.00 0.00 H ATOM 1964 N LEU B 72 -1.474 9.414 22.540 1.00 26.37 N ATOM 1965 CA LEU B 72 -0.429 10.344 22.959 1.00 26.61 C ATOM 1966 C LEU B 72 0.553 10.675 21.842 1.00 27.00 C ATOM 1967 O LEU B 72 1.484 11.466 22.040 1.00 27.49 O ATOM 1968 CB LEU B 72 0.323 9.794 24.176 1.00 26.23 C ATOM 1969 CG LEU B 72 -0.524 9.592 25.435 1.00 26.25 C ATOM 1970 CD1 LEU B 72 0.275 8.846 26.480 1.00 26.36 C ATOM 1971 CD2 LEU B 72 -1.034 10.943 25.980 1.00 25.44 C ATOM 1972 H LEU B 72 -1.253 8.399 22.482 1.00 0.00 H ATOM 1973 N LYS B 73 0.335 10.076 20.676 1.00 27.28 N ATOM 1974 CA LYS B 73 1.222 10.232 19.522 1.00 27.86 C ATOM 1975 C LYS B 73 2.666 9.933 19.879 1.00 27.69 C ATOM 1976 O LYS B 73 3.561 10.749 19.658 1.00 27.73 O ATOM 1977 CB LYS B 73 1.091 11.636 18.911 1.00 28.88 C ATOM 1978 CG LYS B 73 1.067 11.612 17.407 1.00 30.46 C ATOM 1979 CD LYS B 73 -0.147 10.850 16.877 1.00 35.72 C ATOM 1980 CE LYS B 73 -1.451 11.576 17.194 1.00 38.13 C ATOM 1981 NZ LYS B 73 -2.623 10.898 16.581 1.00 39.86 N ATOM 1982 HZ1 LYS B 73 -2.506 10.872 15.548 1.00 0.00 H ATOM 1983 HZ2 LYS B 73 -2.691 9.927 16.948 1.00 0.00 H ATOM 1984 HZ3 LYS B 73 -3.489 11.422 16.820 1.00 0.00 H ATOM 1985 H LYS B 73 -0.504 9.469 20.579 1.00 0.00 H ATOM 1986 N VAL B 74 2.873 8.763 20.474 1.00 26.95 N ATOM 1987 CA VAL B 74 4.189 8.323 20.871 1.00 26.64 C ATOM 1988 C VAL B 74 4.575 7.154 19.968 1.00 26.27 C ATOM 1989 O VAL B 74 3.733 6.319 19.646 1.00 25.56 O ATOM 1990 CB VAL B 74 4.209 7.914 22.355 1.00 27.14 C ATOM 1991 CG1 VAL B 74 5.554 7.301 22.733 1.00 27.44 C ATOM 1992 CG2 VAL B 74 3.907 9.127 23.245 1.00 27.00 C ATOM 1993 H VAL B 74 2.059 8.143 20.660 1.00 0.00 H ATOM 1994 N ASN B 75 5.829 7.122 19.525 1.00 25.79 N ATOM 1995 CA ASN B 75 6.279 6.036 18.662 1.00 26.33 C ATOM 1996 C ASN B 75 7.329 5.127 19.279 1.00 26.04 C ATOM 1997 O ASN B 75 7.524 3.997 18.813 1.00 25.92 O ATOM 1998 CB ASN B 75 6.774 6.553 17.306 1.00 27.11 C ATOM 1999 CG ASN B 75 6.966 5.430 16.308 1.00 28.99 C ATOM 2000 OD1 ASN B 75 6.025 4.698 15.997 1.00 31.14 O ATOM 2001 ND2 ASN B 75 8.192 5.261 15.832 1.00 31.47 N ATOM 2002 HD22 ASN B 75 8.956 5.904 16.123 1.00 0.00 H ATOM 2003 HD21 ASN B 75 8.390 4.485 15.168 1.00 0.00 H ATOM 2004 H ASN B 75 6.492 7.876 19.796 1.00 0.00 H ATOM 2005 N ASN B 76 8.012 5.647 20.299 1.00 24.79 N ATOM 2006 CA ASN B 76 9.028 4.928 21.052 1.00 24.33 C ATOM 2007 C ASN B 76 8.366 4.124 22.155 1.00 23.74 C ATOM 2008 O ASN B 76 7.645 4.689 22.979 1.00 23.76 O ATOM 2009 CB ASN B 76 10.032 5.926 21.657 1.00 23.93 C ATOM 2010 CG ASN B 76 10.786 6.704 20.585 1.00 25.05 C ATOM 2011 OD1 ASN B 76 10.783 6.310 19.425 1.00 24.93 O ATOM 2012 ND2 ASN B 76 11.451 7.797 20.973 1.00 25.77 N ATOM 2013 HD22 ASN B 76 11.426 8.095 21.969 1.00 0.00 H ATOM 2014 HD21 ASN B 76 11.994 8.349 20.279 1.00 0.00 H ATOM 2015 H ASN B 76 7.805 6.629 20.574 1.00 0.00 H ATOM 2016 N ILE B 77 8.601 2.814 22.156 1.00 22.69 N ATOM 2017 CA ILE B 77 8.030 1.925 23.161 1.00 22.49 C ATOM 2018 C ILE B 77 9.133 1.133 23.868 1.00 22.20 C ATOM 2019 O ILE B 77 10.054 0.611 23.222 1.00 21.53 O ATOM 2020 CB ILE B 77 7.021 0.915 22.528 1.00 21.96 C ATOM 2021 CG1 ILE B 77 5.957 1.630 21.672 1.00 22.64 C ATOM 2022 CG2 ILE B 77 6.384 0.016 23.611 1.00 22.44 C ATOM 2023 CD1 ILE B 77 5.075 2.659 22.429 1.00 23.38 C ATOM 2024 H ILE B 77 9.211 2.412 21.416 1.00 0.00 H ATOM 2025 N VAL B 78 9.035 1.043 25.191 1.00 22.04 N ATOM 2026 CA VAL B 78 9.913 0.168 25.961 1.00 22.20 C ATOM 2027 C VAL B 78 9.084 -0.992 26.510 1.00 22.21 C ATOM 2028 O VAL B 78 8.101 -0.776 27.219 1.00 22.21 O ATOM 2029 CB VAL B 78 10.589 0.900 27.141 1.00 22.39 C ATOM 2030 CG1 VAL B 78 11.503 -0.054 27.920 1.00 21.93 C ATOM 2031 CG2 VAL B 78 11.369 2.121 26.663 1.00 23.37 C ATOM 2032 H VAL B 78 8.317 1.608 25.688 1.00 0.00 H ATOM 2033 N VAL B 79 9.475 -2.213 26.154 1.00 21.93 N ATOM 2034 CA VAL B 79 8.883 -3.411 26.722 1.00 21.87 C ATOM 2035 C VAL B 79 9.744 -3.795 27.934 1.00 21.88 C ATOM 2036 O VAL B 79 10.880 -4.232 27.780 1.00 21.22 O ATOM 2037 CB VAL B 79 8.807 -4.553 25.672 1.00 21.43 C ATOM 2038 CG1 VAL B 79 8.220 -5.825 26.275 1.00 22.38 C ATOM 2039 CG2 VAL B 79 7.966 -4.120 24.488 1.00 23.15 C ATOM 2040 H VAL B 79 10.230 -2.313 25.445 1.00 0.00 H ATOM 2041 N TYR B 80 9.211 -3.601 29.142 1.00 22.25 N ATOM 2042 CA TYR B 80 9.987 -3.832 30.362 1.00 22.52 C ATOM 2043 C TYR B 80 9.336 -4.950 31.179 1.00 22.96 C ATOM 2044 O TYR B 80 8.239 -4.762 31.686 1.00 22.17 O ATOM 2045 CB TYR B 80 10.080 -2.539 31.190 1.00 22.91 C ATOM 2046 CG TYR B 80 11.284 -2.475 32.108 1.00 22.24 C ATOM 2047 CD1 TYR B 80 11.329 -3.216 33.286 1.00 21.63 C ATOM 2048 CD2 TYR B 80 12.382 -1.674 31.789 1.00 22.89 C ATOM 2049 CE1 TYR B 80 12.438 -3.169 34.127 1.00 22.43 C ATOM 2050 CE2 TYR B 80 13.494 -1.612 32.613 1.00 23.85 C ATOM 2051 CZ TYR B 80 13.518 -2.364 33.787 1.00 24.03 C ATOM 2052 OH TYR B 80 14.619 -2.287 34.604 1.00 25.04 O ATOM 2053 HH TYR B 80 14.486 -2.873 35.391 1.00 0.00 H ATOM 2054 H TYR B 80 8.225 -3.279 29.218 1.00 0.00 H ATOM 2055 N PRO B 81 9.993 -6.129 31.276 1.00 23.33 N ATOM 2056 CA PRO B 81 9.429 -7.219 32.077 1.00 23.71 C ATOM 2057 C PRO B 81 9.344 -6.767 33.537 1.00 23.99 C ATOM 2058 O PRO B 81 10.348 -6.290 34.096 1.00 23.67 O ATOM 2059 CB PRO B 81 10.461 -8.352 31.926 1.00 24.04 C ATOM 2060 CG PRO B 81 11.287 -7.986 30.720 1.00 23.82 C ATOM 2061 CD PRO B 81 11.320 -6.481 30.731 1.00 23.66 C ATOM 2062 N TYR B 82 8.160 -6.882 34.138 1.00 24.08 N ATOM 2063 CA TYR B 82 7.958 -6.397 35.508 1.00 25.00 C ATOM 2064 C TYR B 82 7.005 -7.287 36.297 1.00 25.55 C ATOM 2065 O TYR B 82 5.815 -6.973 36.471 1.00 25.16 O ATOM 2066 CB TYR B 82 7.469 -4.942 35.505 1.00 24.89 C ATOM 2067 CG TYR B 82 8.068 -4.127 36.628 1.00 27.35 C ATOM 2068 CD1 TYR B 82 9.449 -3.936 36.715 1.00 28.96 C ATOM 2069 CD2 TYR B 82 7.261 -3.556 37.603 1.00 29.78 C ATOM 2070 CE1 TYR B 82 10.018 -3.195 37.750 1.00 31.54 C ATOM 2071 CE2 TYR B 82 7.818 -2.809 38.643 1.00 32.50 C ATOM 2072 CZ TYR B 82 9.194 -2.638 38.712 1.00 33.76 C ATOM 2073 OH TYR B 82 9.742 -1.904 39.744 1.00 36.81 O ATOM 2074 HH TYR B 82 10.727 -1.881 39.644 1.00 0.00 H ATOM 2075 H TYR B 82 7.367 -7.322 33.628 1.00 0.00 H ATOM 2076 N ALA B 83 7.548 -8.395 36.788 1.00 26.46 N ATOM 2077 CA ALA B 83 6.763 -9.401 37.516 1.00 27.55 C ATOM 2078 C ALA B 83 5.997 -8.812 38.705 1.00 28.17 C ATOM 2079 O ALA B 83 4.944 -9.322 39.069 1.00 28.17 O ATOM 2080 CB ALA B 83 7.659 -10.536 37.966 1.00 27.16 C ATOM 2081 H ALA B 83 8.566 -8.556 36.652 1.00 0.00 H ATOM 2082 N HIS B 84 6.529 -7.730 39.282 1.00 29.45 N ATOM 2083 CA HIS B 84 5.972 -7.087 40.486 1.00 30.41 C ATOM 2084 C HIS B 84 4.523 -6.657 40.381 1.00 30.60 C ATOM 2085 O HIS B 84 3.823 -6.576 41.389 1.00 30.70 O ATOM 2086 CB HIS B 84 6.804 -5.865 40.873 1.00 30.96 C ATOM 2087 CG HIS B 84 8.210 -6.194 41.242 1.00 33.32 C ATOM 2088 ND1 HIS B 84 8.525 -6.974 42.331 1.00 36.30 N ATOM 2089 CD2 HIS B 84 9.389 -5.847 40.671 1.00 35.89 C ATOM 2090 CE1 HIS B 84 9.837 -7.096 42.419 1.00 36.85 C ATOM 2091 NE2 HIS B 84 10.385 -6.420 41.424 1.00 38.42 N ATOM 2092 H HIS B 84 7.385 -7.318 38.857 1.00 0.00 H ATOM 2093 N LEU B 85 4.066 -6.380 39.163 1.00 30.19 N ATOM 2094 CA LEU B 85 2.714 -5.894 38.963 1.00 30.37 C ATOM 2095 C LEU B 85 1.644 -6.934 39.262 1.00 30.81 C ATOM 2096 O LEU B 85 0.489 -6.580 39.467 1.00 30.74 O ATOM 2097 CB LEU B 85 2.540 -5.350 37.540 1.00 30.38 C ATOM 2098 CG LEU B 85 3.405 -4.134 37.199 1.00 29.24 C ATOM 2099 CD1 LEU B 85 3.220 -3.769 35.740 1.00 31.38 C ATOM 2100 CD2 LEU B 85 3.076 -2.946 38.086 1.00 29.67 C ATOM 2101 H LEU B 85 4.688 -6.514 38.341 1.00 0.00 H ATOM 2102 N SER B 86 2.022 -8.210 39.280 1.00 31.39 N ATOM 2103 CA SER B 86 1.036 -9.270 39.454 1.00 32.21 C ATOM 2104 C SER B 86 1.440 -10.305 40.481 1.00 32.37 C ATOM 2105 O SER B 86 2.598 -10.709 40.545 1.00 32.73 O ATOM 2106 CB SER B 86 0.753 -9.970 38.124 1.00 32.24 C ATOM 2107 OG SER B 86 -0.193 -11.016 38.300 1.00 33.00 O ATOM 2108 HG SER B 86 -0.363 -11.456 37.429 1.00 0.00 H ATOM 2109 H SER B 86 3.027 -8.453 39.169 1.00 0.00 H ATOM 2110 N SER B 87 0.457 -10.753 41.254 1.00 33.01 N ATOM 2111 CA SER B 87 0.665 -11.794 42.261 1.00 33.40 C ATOM 2112 C SER B 87 0.340 -13.187 41.716 1.00 33.14 C ATOM 2113 O SER B 87 0.417 -14.173 42.460 1.00 34.01 O ATOM 2114 CB SER B 87 -0.192 -11.522 43.508 1.00 33.60 C ATOM 2115 OG SER B 87 -0.187 -10.150 43.874 1.00 34.66 O ATOM 2116 HG SER B 87 -0.749 -10.022 44.679 1.00 0.00 H ATOM 2117 H SER B 87 -0.495 -10.349 41.139 1.00 0.00 H ATOM 2118 N ASP B 88 -0.020 -13.275 40.434 1.00 31.95 N ATOM 2119 CA ASP B 88 -0.416 -14.554 39.826 1.00 31.44 C ATOM 2120 C ASP B 88 0.291 -14.769 38.483 1.00 30.50 C ATOM 2121 O ASP B 88 -0.325 -14.683 37.425 1.00 29.49 O ATOM 2122 CB ASP B 88 -1.939 -14.606 39.659 1.00 31.90 C ATOM 2123 CG ASP B 88 -2.455 -16.002 39.324 1.00 33.50 C ATOM 2124 OD1 ASP B 88 -1.742 -17.003 39.551 1.00 35.86 O ATOM 2125 OD2 ASP B 88 -3.587 -16.093 38.816 1.00 35.63 O ATOM 2126 H ASP B 88 -0.020 -12.415 39.849 1.00 0.00 H ATOM 2127 N LEU B 89 1.582 -15.076 38.558 1.00 29.57 N ATOM 2128 CA LEU B 89 2.480 -15.059 37.401 1.00 29.09 C ATOM 2129 C LEU B 89 2.450 -16.338 36.562 1.00 28.78 C ATOM 2130 O LEU B 89 2.190 -17.434 37.075 1.00 28.68 O ATOM 2131 CB LEU B 89 3.919 -14.814 37.882 1.00 29.03 C ATOM 2132 CG LEU B 89 4.278 -13.508 38.600 1.00 28.99 C ATOM 2133 CD1 LEU B 89 5.685 -13.590 39.167 1.00 29.71 C ATOM 2134 CD2 LEU B 89 4.141 -12.317 37.658 1.00 29.10 C ATOM 2135 H LEU B 89 1.974 -15.341 39.484 1.00 0.00 H ATOM 2136 N SER B 90 2.741 -16.191 35.271 1.00 27.86 N ATOM 2137 CA SER B 90 2.968 -17.332 34.384 1.00 27.10 C ATOM 2138 C SER B 90 4.364 -17.866 34.632 1.00 26.92 C ATOM 2139 O SER B 90 5.149 -17.249 35.353 1.00 26.89 O ATOM 2140 CB SER B 90 2.888 -16.885 32.920 1.00 27.01 C ATOM 2141 OG SER B 90 4.017 -16.077 32.593 1.00 25.78 O ATOM 2142 HG SER B 90 4.846 -16.600 32.729 1.00 0.00 H ATOM 2143 H SER B 90 2.809 -15.230 34.879 1.00 0.00 H ATOM 2144 N SER B 91 4.691 -18.990 33.997 1.00 26.79 N ATOM 2145 CA SER B 91 6.051 -19.498 34.012 1.00 26.66 C ATOM 2146 C SER B 91 7.014 -18.506 33.365 1.00 26.98 C ATOM 2147 O SER B 91 6.589 -17.693 32.526 1.00 25.89 O ATOM 2148 CB SER B 91 6.120 -20.823 33.269 1.00 27.11 C ATOM 2149 OG SER B 91 5.869 -20.632 31.900 1.00 27.68 O ATOM 2150 HG SER B 91 4.966 -20.243 31.782 1.00 0.00 H ATOM 2151 H SER B 91 3.957 -19.515 33.480 1.00 0.00 H ATOM 2152 N PRO B 92 8.313 -18.568 33.739 1.00 26.68 N ATOM 2153 CA PRO B 92 9.280 -17.654 33.132 1.00 27.13 C ATOM 2154 C PRO B 92 9.337 -17.831 31.621 1.00 26.71 C ATOM 2155 O PRO B 92 9.358 -16.845 30.894 1.00 26.89 O ATOM 2156 CB PRO B 92 10.613 -18.076 33.756 1.00 26.73 C ATOM 2157 CG PRO B 92 10.243 -18.752 35.023 1.00 27.77 C ATOM 2158 CD PRO B 92 8.919 -19.389 34.803 1.00 27.17 C ATOM 2159 N GLU B 93 9.349 -19.083 31.162 1.00 26.61 N ATOM 2160 CA GLU B 93 9.470 -19.363 29.736 1.00 26.49 C ATOM 2161 C GLU B 93 8.295 -18.747 28.968 1.00 25.97 C ATOM 2162 O GLU B 93 8.497 -18.162 27.900 1.00 25.80 O ATOM 2163 CB GLU B 93 9.647 -20.868 29.453 1.00 26.66 C ATOM 2164 CG GLU B 93 8.528 -21.807 29.973 1.00 28.69 C ATOM 2165 CD GLU B 93 8.668 -22.216 31.453 1.00 29.56 C ATOM 2166 OE1 GLU B 93 9.398 -21.559 32.228 1.00 27.27 O ATOM 2167 OE2 GLU B 93 8.001 -23.196 31.849 1.00 31.72 O ATOM 2168 H GLU B 93 9.271 -19.874 31.833 1.00 0.00 H ATOM 2169 N THR B 94 7.087 -18.852 29.528 1.00 25.06 N ATOM 2170 CA THR B 94 5.908 -18.225 28.925 1.00 24.42 C ATOM 2171 C THR B 94 6.094 -16.710 28.859 1.00 23.89 C ATOM 2172 O THR B 94 5.876 -16.090 27.815 1.00 23.36 O ATOM 2173 CB THR B 94 4.613 -18.556 29.700 1.00 24.74 C ATOM 2174 OG1 THR B 94 4.386 -19.965 29.645 1.00 25.40 O ATOM 2175 CG2 THR B 94 3.397 -17.836 29.085 1.00 23.48 C ATOM 2176 HG1 THR B 94 4.292 -20.246 28.700 1.00 0.00 H ATOM 2177 H THR B 94 6.981 -19.391 30.411 1.00 0.00 H ATOM 2178 N ALA B 95 6.506 -16.129 29.980 1.00 23.29 N ATOM 2179 CA ALA B 95 6.677 -14.681 30.070 1.00 23.00 C ATOM 2180 C ALA B 95 7.602 -14.122 28.971 1.00 22.85 C ATOM 2181 O ALA B 95 7.176 -13.237 28.241 1.00 21.60 O ATOM 2182 CB ALA B 95 7.141 -14.280 31.463 1.00 22.95 C ATOM 2183 H ALA B 95 6.711 -16.718 30.812 1.00 0.00 H ATOM 2184 N VAL B 96 8.820 -14.669 28.822 1.00 23.11 N ATOM 2185 CA VAL B 96 9.773 -14.206 27.775 1.00 23.92 C ATOM 2186 C VAL B 96 9.204 -14.317 26.364 1.00 23.16 C ATOM 2187 O VAL B 96 9.389 -13.420 25.548 1.00 23.02 O ATOM 2188 CB VAL B 96 11.159 -14.978 27.729 1.00 24.07 C ATOM 2189 CG1 VAL B 96 12.283 -14.035 27.256 1.00 24.65 C ATOM 2190 CG2 VAL B 96 11.512 -15.579 29.018 1.00 26.85 C ATOM 2191 H VAL B 96 9.107 -15.440 29.458 1.00 0.00 H ATOM 2192 N LYS B 97 8.535 -15.432 26.081 1.00 23.08 N ATOM 2193 CA LYS B 97 7.881 -15.644 24.795 1.00 22.28 C ATOM 2194 C LYS B 97 6.907 -14.510 24.496 1.00 22.03 C ATOM 2195 O LYS B 97 6.935 -13.902 23.406 1.00 21.15 O ATOM 2196 CB LYS B 97 7.147 -16.991 24.796 1.00 22.60 C ATOM 2197 CG LYS B 97 6.524 -17.392 23.463 1.00 24.37 C ATOM 2198 CD LYS B 97 5.049 -16.984 23.351 1.00 25.52 C ATOM 2199 CE LYS B 97 4.371 -17.591 22.114 1.00 27.71 C ATOM 2200 NZ LYS B 97 4.957 -17.160 20.797 1.00 27.73 N ATOM 2201 HZ1 LYS B 97 4.879 -16.127 20.706 1.00 0.00 H ATOM 2202 HZ2 LYS B 97 5.958 -17.438 20.757 1.00 0.00 H ATOM 2203 HZ3 LYS B 97 4.438 -17.618 20.021 1.00 0.00 H ATOM 2204 H LYS B 97 8.477 -16.179 26.803 1.00 0.00 H ATOM 2205 N VAL B 98 6.044 -14.225 25.467 1.00 21.54 N ATOM 2206 CA VAL B 98 5.000 -13.214 25.276 1.00 20.72 C ATOM 2207 C VAL B 98 5.634 -11.831 25.144 1.00 20.36 C ATOM 2208 O VAL B 98 5.237 -11.033 24.293 1.00 19.30 O ATOM 2209 CB VAL B 98 3.933 -13.280 26.409 1.00 21.09 C ATOM 2210 CG1 VAL B 98 2.949 -12.104 26.305 1.00 21.27 C ATOM 2211 CG2 VAL B 98 3.173 -14.621 26.333 1.00 20.09 C ATOM 2212 H VAL B 98 6.111 -14.727 26.375 1.00 0.00 H ATOM 2213 N LEU B 99 6.646 -11.563 25.964 1.00 20.51 N ATOM 2214 CA LEU B 99 7.340 -10.280 25.877 1.00 20.83 C ATOM 2215 C LEU B 99 8.055 -10.105 24.549 1.00 20.87 C ATOM 2216 O LEU B 99 8.024 -9.020 23.966 1.00 20.00 O ATOM 2217 CB LEU B 99 8.298 -10.106 27.038 1.00 20.99 C ATOM 2218 CG LEU B 99 7.593 -10.071 28.400 1.00 21.72 C ATOM 2219 CD1 LEU B 99 8.619 -10.295 29.485 1.00 22.09 C ATOM 2220 CD2 LEU B 99 6.842 -8.748 28.614 1.00 22.73 C ATOM 2221 H LEU B 99 6.944 -12.268 26.668 1.00 0.00 H ATOM 2222 N LYS B 100 8.681 -11.181 24.071 1.00 21.41 N ATOM 2223 CA LYS B 100 9.369 -11.161 22.776 1.00 22.11 C ATOM 2224 C LYS B 100 8.395 -10.960 21.633 1.00 22.25 C ATOM 2225 O LYS B 100 8.697 -10.228 20.682 1.00 22.15 O ATOM 2226 CB LYS B 100 10.212 -12.423 22.572 1.00 22.38 C ATOM 2227 CG LYS B 100 11.579 -12.346 23.250 1.00 23.15 C ATOM 2228 CD LYS B 100 12.375 -13.612 22.999 1.00 27.80 C ATOM 2229 CE LYS B 100 13.769 -13.538 23.605 1.00 30.15 C ATOM 2230 NZ LYS B 100 14.448 -14.873 23.479 1.00 32.32 N ATOM 2231 HZ1 LYS B 100 13.891 -15.593 23.982 1.00 0.00 H ATOM 2232 HZ2 LYS B 100 14.522 -15.130 22.474 1.00 0.00 H ATOM 2233 HZ3 LYS B 100 15.400 -14.817 23.894 1.00 0.00 H ATOM 2234 H LYS B 100 8.681 -12.057 24.631 1.00 0.00 H ATOM 2235 N ASP B 101 7.223 -11.596 21.739 1.00 21.98 N ATOM 2236 CA ASP B 101 6.135 -11.395 20.778 1.00 22.59 C ATOM 2237 C ASP B 101 5.588 -9.969 20.733 1.00 21.99 C ATOM 2238 O ASP B 101 5.410 -9.405 19.655 1.00 21.81 O ATOM 2239 CB ASP B 101 5.011 -12.395 21.015 1.00 22.91 C ATOM 2240 CG ASP B 101 5.342 -13.766 20.460 1.00 26.82 C ATOM 2241 OD1 ASP B 101 6.338 -13.886 19.712 1.00 30.81 O ATOM 2242 OD2 ASP B 101 4.622 -14.725 20.770 1.00 29.22 O ATOM 2243 H ASP B 101 7.079 -12.255 22.530 1.00 0.00 H ATOM 2244 N ILE B 102 5.325 -9.388 21.898 1.00 21.33 N ATOM 2245 CA ILE B 102 4.913 -7.986 21.957 1.00 20.66 C ATOM 2246 C ILE B 102 5.906 -7.084 21.220 1.00 20.64 C ATOM 2247 O ILE B 102 5.504 -6.230 20.420 1.00 20.78 O ATOM 2248 CB ILE B 102 4.759 -7.509 23.409 1.00 20.64 C ATOM 2249 CG1 ILE B 102 3.576 -8.222 24.074 1.00 19.96 C ATOM 2250 CG2 ILE B 102 4.589 -5.983 23.464 1.00 20.26 C ATOM 2251 CD1 ILE B 102 3.529 -8.035 25.593 1.00 19.08 C ATOM 2252 H ILE B 102 5.413 -9.936 22.778 1.00 0.00 H ATOM 2253 N GLU B 103 7.194 -7.282 21.488 1.00 21.18 N ATOM 2254 CA GLU B 103 8.253 -6.516 20.832 1.00 21.87 C ATOM 2255 C GLU B 103 8.250 -6.710 19.311 1.00 22.15 C ATOM 2256 O GLU B 103 8.311 -5.727 18.562 1.00 22.29 O ATOM 2257 CB GLU B 103 9.628 -6.873 21.411 1.00 22.25 C ATOM 2258 CG GLU B 103 10.785 -6.325 20.591 1.00 25.05 C ATOM 2259 CD GLU B 103 12.135 -6.901 20.982 1.00 28.00 C ATOM 2260 OE1 GLU B 103 12.196 -8.043 21.498 1.00 30.21 O ATOM 2261 OE2 GLU B 103 13.140 -6.208 20.736 1.00 30.27 O ATOM 2262 H GLU B 103 7.456 -8.006 22.187 1.00 0.00 H ATOM 2263 N SER B 104 8.181 -7.961 18.851 1.00 22.29 N ATOM 2264 CA SER B 104 8.232 -8.227 17.394 1.00 22.50 C ATOM 2265 C SER B 104 6.996 -7.706 16.645 1.00 21.84 C ATOM 2266 O SER B 104 7.118 -7.163 15.539 1.00 20.71 O ATOM 2267 CB SER B 104 8.510 -9.712 17.073 1.00 23.16 C ATOM 2268 OG SER B 104 7.607 -10.579 17.724 1.00 28.40 O ATOM 2269 HG SER B 104 7.682 -10.457 18.704 1.00 0.00 H ATOM 2270 H SER B 104 8.091 -8.753 19.519 1.00 0.00 H ATOM 2271 N ILE B 105 5.819 -7.851 17.254 1.00 20.57 N ATOM 2272 CA ILE B 105 4.590 -7.337 16.652 1.00 20.91 C ATOM 2273 C ILE B 105 4.571 -5.799 16.617 1.00 20.81 C ATOM 2274 O ILE B 105 4.192 -5.210 15.593 1.00 20.83 O ATOM 2275 CB ILE B 105 3.318 -7.890 17.335 1.00 20.77 C ATOM 2276 CG1 ILE B 105 3.243 -9.404 17.172 1.00 21.02 C ATOM 2277 CG2 ILE B 105 2.071 -7.270 16.726 1.00 21.77 C ATOM 2278 CD1 ILE B 105 2.437 -10.080 18.259 1.00 22.00 C ATOM 2279 H ILE B 105 5.774 -8.338 18.172 1.00 0.00 H ATOM 2280 N LEU B 106 4.979 -5.149 17.708 1.00 20.62 N ATOM 2281 CA LEU B 106 5.073 -3.670 17.694 1.00 21.39 C ATOM 2282 C LEU B 106 6.011 -3.189 16.586 1.00 21.85 C ATOM 2283 O LEU B 106 5.714 -2.228 15.878 1.00 22.06 O ATOM 2284 CB LEU B 106 5.530 -3.121 19.043 1.00 21.84 C ATOM 2285 CG LEU B 106 4.485 -3.084 20.158 1.00 21.21 C ATOM 2286 CD1 LEU B 106 5.179 -2.833 21.467 1.00 22.76 C ATOM 2287 CD2 LEU B 106 3.465 -2.002 19.870 1.00 24.74 C ATOM 2288 H LEU B 106 5.231 -5.679 18.567 1.00 0.00 H ATOM 2289 N LYS B 107 7.142 -3.870 16.437 1.00 22.54 N ATOM 2290 CA LYS B 107 8.090 -3.555 15.372 1.00 23.25 C ATOM 2291 C LYS B 107 7.467 -3.674 13.979 1.00 23.99 C ATOM 2292 O LYS B 107 7.672 -2.800 13.136 1.00 23.36 O ATOM 2293 CB LYS B 107 9.343 -4.431 15.480 1.00 23.01 C ATOM 2294 CG LYS B 107 10.364 -3.927 16.509 1.00 24.52 C ATOM 2295 CD LYS B 107 11.519 -4.935 16.684 1.00 27.31 C ATOM 2296 CE LYS B 107 12.606 -4.360 17.568 1.00 29.45 C ATOM 2297 NZ LYS B 107 13.626 -5.390 17.968 1.00 31.98 N ATOM 2298 HZ1 LYS B 107 13.157 -6.155 18.493 1.00 0.00 H ATOM 2299 HZ2 LYS B 107 14.077 -5.779 17.115 1.00 0.00 H ATOM 2300 HZ3 LYS B 107 14.347 -4.946 18.572 1.00 0.00 H ATOM 2301 H LYS B 107 7.357 -4.646 17.095 1.00 0.00 H ATOM 2302 N GLU B 108 6.713 -4.748 13.736 1.00 24.78 N ATOM 2303 CA GLU B 108 6.097 -4.939 12.428 1.00 26.24 C ATOM 2304 C GLU B 108 4.969 -3.923 12.173 1.00 25.82 C ATOM 2305 O GLU B 108 4.571 -3.692 11.028 1.00 25.52 O ATOM 2306 CB GLU B 108 5.641 -6.394 12.208 1.00 27.49 C ATOM 2307 CG GLU B 108 4.486 -6.877 13.053 1.00 31.42 C ATOM 2308 CD GLU B 108 4.283 -8.386 12.950 1.00 35.92 C ATOM 2309 OE1 GLU B 108 5.270 -9.117 12.685 1.00 39.19 O ATOM 2310 OE2 GLU B 108 3.139 -8.844 13.133 1.00 36.34 O ATOM 2311 H GLU B 108 6.564 -5.454 14.485 1.00 0.00 H ATOM 2312 N ARG B 109 4.487 -3.310 13.246 1.00 24.99 N ATOM 2313 CA ARG B 109 3.471 -2.263 13.146 1.00 25.16 C ATOM 2314 C ARG B 109 4.050 -0.857 13.225 1.00 24.57 C ATOM 2315 O ARG B 109 3.309 0.111 13.403 1.00 25.10 O ATOM 2316 CB ARG B 109 2.374 -2.472 14.195 1.00 24.67 C ATOM 2317 CG ARG B 109 1.589 -3.748 13.966 1.00 25.77 C ATOM 2318 CD ARG B 109 0.539 -3.956 15.047 1.00 27.28 C ATOM 2319 NE ARG B 109 -0.087 -5.267 14.921 1.00 27.05 N ATOM 2320 CZ ARG B 109 -1.222 -5.635 15.517 1.00 28.82 C ATOM 2321 NH1 ARG B 109 -1.899 -4.787 16.283 1.00 28.17 N ATOM 2322 NH2 ARG B 109 -1.696 -6.862 15.329 1.00 27.06 N ATOM 2323 HE ARG B 109 0.389 -5.970 14.320 1.00 0.00 H ATOM 2324 HH12 ARG B 109 -2.782 -5.091 16.740 1.00 0.00 H ATOM 2325 HH11 ARG B 109 -1.546 -3.819 16.426 1.00 0.00 H ATOM 2326 HH22 ARG B 109 -2.581 -7.154 15.791 1.00 0.00 H ATOM 2327 HH21 ARG B 109 -1.182 -7.530 14.720 1.00 0.00 H ATOM 2328 H ARG B 109 4.842 -3.582 14.185 1.00 0.00 H ATOM 2329 N GLY B 110 5.371 -0.743 13.102 1.00 24.35 N ATOM 2330 CA GLY B 110 6.012 0.556 12.887 1.00 23.98 C ATOM 2331 C GLY B 110 6.502 1.323 14.098 1.00 23.85 C ATOM 2332 O GLY B 110 6.893 2.490 13.969 1.00 23.76 O ATOM 2333 H GLY B 110 5.962 -1.597 13.160 1.00 0.00 H ATOM 2334 N TYR B 111 6.479 0.683 15.267 1.00 23.25 N ATOM 2335 CA TYR B 111 6.966 1.297 16.509 1.00 23.42 C ATOM 2336 C TYR B 111 8.464 1.105 16.693 1.00 23.31 C ATOM 2337 O TYR B 111 9.018 0.088 16.268 1.00 22.81 O ATOM 2338 CB TYR B 111 6.186 0.770 17.720 1.00 23.37 C ATOM 2339 CG TYR B 111 4.727 1.132 17.623 1.00 24.42 C ATOM 2340 CD1 TYR B 111 4.247 2.325 18.165 1.00 25.25 C ATOM 2341 CD2 TYR B 111 3.829 0.304 16.943 1.00 24.10 C ATOM 2342 CE1 TYR B 111 2.893 2.676 18.038 1.00 25.91 C ATOM 2343 CE2 TYR B 111 2.485 0.641 16.828 1.00 24.96 C ATOM 2344 CZ TYR B 111 2.029 1.828 17.380 1.00 25.92 C ATOM 2345 OH TYR B 111 0.713 2.166 17.249 1.00 28.53 O ATOM 2346 HH TYR B 111 0.151 1.468 17.669 1.00 0.00 H ATOM 2347 H TYR B 111 6.103 -0.286 15.301 1.00 0.00 H ATOM 2348 N ASN B 112 9.118 2.111 17.279 1.00 23.27 N ATOM 2349 CA ASN B 112 10.507 1.970 17.713 1.00 23.66 C ATOM 2350 C ASN B 112 10.512 1.322 19.096 1.00 23.30 C ATOM 2351 O ASN B 112 10.088 1.938 20.067 1.00 23.29 O ATOM 2352 CB ASN B 112 11.204 3.333 17.760 1.00 23.57 C ATOM 2353 CG ASN B 112 12.708 3.222 17.991 1.00 26.07 C ATOM 2354 OD1 ASN B 112 13.331 4.160 18.474 1.00 30.12 O ATOM 2355 ND2 ASN B 112 13.295 2.080 17.640 1.00 30.17 N ATOM 2356 HD22 ASN B 112 12.729 1.308 17.233 1.00 0.00 H ATOM 2357 HD21 ASN B 112 14.319 1.960 17.773 1.00 0.00 H ATOM 2358 H ASN B 112 8.628 3.016 17.430 1.00 0.00 H ATOM 2359 N VAL B 113 10.988 0.084 19.177 1.00 22.99 N ATOM 2360 CA VAL B 113 10.889 -0.702 20.413 1.00 22.75 C ATOM 2361 C VAL B 113 12.260 -1.005 20.987 1.00 22.71 C ATOM 2362 O VAL B 113 13.191 -1.354 20.252 1.00 23.46 O ATOM 2363 CB VAL B 113 10.132 -2.050 20.193 1.00 22.33 C ATOM 2364 CG1 VAL B 113 9.820 -2.724 21.524 1.00 22.59 C ATOM 2365 CG2 VAL B 113 8.852 -1.829 19.417 1.00 23.01 C ATOM 2366 H VAL B 113 11.443 -0.339 18.343 1.00 0.00 H ATOM 2367 N LEU B 114 12.371 -0.857 22.301 1.00 22.53 N ATOM 2368 CA LEU B 114 13.512 -1.349 23.058 1.00 23.00 C ATOM 2369 C LEU B 114 12.968 -2.279 24.122 1.00 22.81 C ATOM 2370 O LEU B 114 12.066 -1.906 24.874 1.00 22.70 O ATOM 2371 CB LEU B 114 14.288 -0.188 23.698 1.00 22.83 C ATOM 2372 CG LEU B 114 15.398 -0.519 24.705 1.00 23.79 C ATOM 2373 CD1 LEU B 114 16.549 -1.341 24.084 1.00 27.09 C ATOM 2374 CD2 LEU B 114 15.927 0.763 25.318 1.00 25.12 C ATOM 2375 H LEU B 114 11.609 -0.368 22.812 1.00 0.00 H ATOM 2376 N ARG B 115 13.478 -3.505 24.151 1.00 23.10 N ATOM 2377 CA ARG B 115 13.074 -4.465 25.174 1.00 23.34 C ATOM 2378 C ARG B 115 14.199 -4.673 26.173 1.00 23.33 C ATOM 2379 O ARG B 115 15.335 -4.980 25.792 1.00 23.06 O ATOM 2380 CB ARG B 115 12.624 -5.807 24.565 1.00 23.34 C ATOM 2381 CG ARG B 115 12.072 -6.767 25.634 1.00 23.62 C ATOM 2382 CD ARG B 115 11.570 -8.082 25.060 1.00 24.45 C ATOM 2383 NE ARG B 115 12.600 -8.769 24.284 1.00 26.23 N ATOM 2384 CZ ARG B 115 13.537 -9.562 24.806 1.00 27.58 C ATOM 2385 NH1 ARG B 115 13.586 -9.792 26.117 1.00 26.62 N ATOM 2386 NH2 ARG B 115 14.423 -10.137 24.008 1.00 28.61 N ATOM 2387 HE ARG B 115 12.603 -8.630 23.253 1.00 0.00 H ATOM 2388 HH12 ARG B 115 14.323 -10.413 26.509 1.00 0.00 H ATOM 2389 HH11 ARG B 115 12.888 -9.351 26.749 1.00 0.00 H ATOM 2390 HH22 ARG B 115 15.157 -10.757 24.407 1.00 0.00 H ATOM 2391 HH21 ARG B 115 14.385 -9.969 22.982 1.00 0.00 H ATOM 2392 H ARG B 115 14.176 -3.786 23.433 1.00 0.00 H ATOM 2393 N ALA B 116 13.890 -4.456 27.447 1.00 23.06 N ATOM 2394 CA ALA B 116 14.864 -4.698 28.514 1.00 23.17 C ATOM 2395 C ALA B 116 15.023 -6.207 28.713 1.00 23.66 C ATOM 2396 O ALA B 116 14.036 -6.948 28.623 1.00 22.75 O ATOM 2397 CB ALA B 116 14.428 -4.021 29.805 1.00 22.61 C ATOM 2398 H ALA B 116 12.941 -4.108 27.691 1.00 0.00 H ATOM 2399 N PRO B 117 16.272 -6.663 28.954 1.00 24.79 N ATOM 2400 CA PRO B 117 16.580 -8.085 29.070 1.00 25.31 C ATOM 2401 C PRO B 117 15.799 -8.794 30.166 1.00 25.88 C ATOM 2402 O PRO B 117 15.652 -8.284 31.287 1.00 26.52 O ATOM 2403 CB PRO B 117 18.087 -8.114 29.393 1.00 25.42 C ATOM 2404 CG PRO B 117 18.525 -6.667 29.528 1.00 26.08 C ATOM 2405 CD PRO B 117 17.497 -5.842 28.853 1.00 24.89 C ATOM 2406 N PHE B 118 15.326 -9.986 29.831 1.00 25.92 N ATOM 2407 CA PHE B 118 14.535 -10.795 30.739 1.00 25.82 C ATOM 2408 C PHE B 118 15.432 -11.608 31.672 1.00 25.72 C ATOM 2409 O PHE B 118 16.385 -12.259 31.227 1.00 25.25 O ATOM 2410 CB PHE B 118 13.653 -11.723 29.906 1.00 25.70 C ATOM 2411 CG PHE B 118 12.725 -12.577 30.710 1.00 26.29 C ATOM 2412 CD1 PHE B 118 11.384 -12.229 30.831 1.00 27.33 C ATOM 2413 CD2 PHE B 118 13.180 -13.747 31.327 1.00 26.93 C ATOM 2414 CE1 PHE B 118 10.498 -13.027 31.552 1.00 28.02 C ATOM 2415 CE2 PHE B 118 12.307 -14.550 32.061 1.00 27.31 C ATOM 2416 CZ PHE B 118 10.961 -14.194 32.170 1.00 28.23 C ATOM 2417 H PHE B 118 15.530 -10.356 28.880 1.00 0.00 H ATOM 2418 N GLY B 119 15.110 -11.579 32.959 1.00 26.21 N ATOM 2419 CA GLY B 119 15.762 -12.451 33.943 1.00 27.37 C ATOM 2420 C GLY B 119 17.071 -11.895 34.475 1.00 27.58 C ATOM 2421 O GLY B 119 17.840 -12.605 35.117 1.00 27.75 O ATOM 2422 H GLY B 119 14.374 -10.919 33.280 1.00 0.00 H ATOM 2423 N TRP B 120 17.325 -10.621 34.199 1.00 27.94 N ATOM 2424 CA TRP B 120 18.480 -9.925 34.741 1.00 28.40 C ATOM 2425 C TRP B 120 18.000 -8.928 35.777 1.00 29.07 C ATOM 2426 O TRP B 120 16.952 -8.285 35.600 1.00 29.82 O ATOM 2427 CB TRP B 120 19.215 -9.158 33.643 1.00 28.53 C ATOM 2428 CG TRP B 120 19.969 -9.995 32.649 1.00 28.53 C ATOM 2429 CD1 TRP B 120 19.445 -10.722 31.616 1.00 28.98 C ATOM 2430 CD2 TRP B 120 21.393 -10.148 32.566 1.00 28.64 C ATOM 2431 NE1 TRP B 120 20.459 -11.329 30.899 1.00 28.15 N ATOM 2432 CE2 TRP B 120 21.661 -10.999 31.468 1.00 28.89 C ATOM 2433 CE3 TRP B 120 22.471 -9.657 33.322 1.00 29.49 C ATOM 2434 CZ2 TRP B 120 22.965 -11.366 31.105 1.00 30.14 C ATOM 2435 CZ3 TRP B 120 23.759 -10.029 32.966 1.00 30.52 C ATOM 2436 CH2 TRP B 120 23.996 -10.870 31.858 1.00 29.51 C ATOM 2437 HE1 TRP B 120 20.331 -11.936 30.065 1.00 0.00 H ATOM 2438 H TRP B 120 16.675 -10.104 33.573 1.00 0.00 H ATOM 2439 N TYR B 121 18.762 -8.794 36.856 1.00 29.18 N ATOM 2440 CA TYR B 121 18.614 -7.650 37.745 1.00 29.72 C ATOM 2441 C TYR B 121 19.149 -6.437 37.008 1.00 29.45 C ATOM 2442 O TYR B 121 20.279 -6.461 36.504 1.00 30.13 O ATOM 2443 CB TYR B 121 19.391 -7.854 39.039 1.00 29.78 C ATOM 2444 CG TYR B 121 18.878 -9.009 39.868 1.00 32.86 C ATOM 2445 CD1 TYR B 121 17.596 -8.984 40.417 1.00 33.85 C ATOM 2446 CD2 TYR B 121 19.675 -10.128 40.101 1.00 33.85 C ATOM 2447 CE1 TYR B 121 17.119 -10.054 41.176 1.00 36.56 C ATOM 2448 CE2 TYR B 121 19.208 -11.192 40.852 1.00 35.94 C ATOM 2449 CZ TYR B 121 17.933 -11.148 41.390 1.00 36.30 C ATOM 2450 OH TYR B 121 17.480 -12.213 42.141 1.00 38.72 O ATOM 2451 HH TYR B 121 16.558 -12.028 42.451 1.00 0.00 H ATOM 2452 H TYR B 121 19.477 -9.518 37.070 1.00 0.00 H ATOM 2453 N LYS B 122 18.337 -5.391 36.924 1.00 28.47 N ATOM 2454 CA LYS B 122 18.717 -4.207 36.172 1.00 27.86 C ATOM 2455 C LYS B 122 18.601 -2.954 37.007 1.00 27.45 C ATOM 2456 O LYS B 122 17.608 -2.757 37.716 1.00 27.44 O ATOM 2457 CB LYS B 122 17.823 -4.043 34.935 1.00 27.90 C ATOM 2458 CG LYS B 122 17.929 -5.143 33.898 1.00 27.77 C ATOM 2459 CD LYS B 122 16.822 -4.995 32.845 1.00 28.12 C ATOM 2460 CE LYS B 122 15.437 -5.329 33.430 1.00 28.14 C ATOM 2461 NZ LYS B 122 15.244 -6.779 33.682 1.00 29.68 N ATOM 2462 HZ1 LYS B 122 15.343 -7.301 32.788 1.00 0.00 H ATOM 2463 HZ2 LYS B 122 15.960 -7.110 34.359 1.00 0.00 H ATOM 2464 HZ3 LYS B 122 14.294 -6.938 34.075 1.00 0.00 H ATOM 2465 H LYS B 122 17.415 -5.419 37.404 1.00 0.00 H ATOM 2466 N ALA B 123 19.618 -2.102 36.922 1.00 26.68 N ATOM 2467 CA ALA B 123 19.468 -0.716 37.336 1.00 26.17 C ATOM 2468 C ALA B 123 18.640 -0.052 36.256 1.00 25.62 C ATOM 2469 O ALA B 123 18.709 -0.445 35.092 1.00 25.29 O ATOM 2470 CB ALA B 123 20.816 -0.038 37.449 1.00 25.65 C ATOM 2471 H ALA B 123 20.533 -2.431 36.554 1.00 0.00 H ATOM 2472 N PHE B 124 17.825 0.920 36.633 1.00 25.41 N ATOM 2473 CA PHE B 124 17.129 1.716 35.627 1.00 25.80 C ATOM 2474 C PHE B 124 16.869 3.130 36.103 1.00 25.66 C ATOM 2475 O PHE B 124 16.928 3.411 37.301 1.00 25.82 O ATOM 2476 CB PHE B 124 15.841 1.019 35.114 1.00 25.87 C ATOM 2477 CG PHE B 124 14.712 0.987 36.110 1.00 26.88 C ATOM 2478 CD1 PHE B 124 13.769 2.017 36.154 1.00 28.24 C ATOM 2479 CD2 PHE B 124 14.579 -0.082 36.990 1.00 26.43 C ATOM 2480 CE1 PHE B 124 12.709 1.980 37.076 1.00 28.35 C ATOM 2481 CE2 PHE B 124 13.533 -0.125 37.908 1.00 27.79 C ATOM 2482 CZ PHE B 124 12.598 0.908 37.955 1.00 28.88 C ATOM 2483 H PHE B 124 17.681 1.116 37.644 1.00 0.00 H ATOM 2484 N LYS B 125 16.612 4.016 35.146 1.00 25.72 N ATOM 2485 CA LYS B 125 16.243 5.393 35.429 1.00 26.22 C ATOM 2486 C LYS B 125 15.033 5.703 34.571 1.00 25.67 C ATOM 2487 O LYS B 125 14.974 5.303 33.412 1.00 25.48 O ATOM 2488 CB LYS B 125 17.366 6.370 35.068 1.00 26.27 C ATOM 2489 CG LYS B 125 18.670 6.182 35.826 1.00 28.67 C ATOM 2490 CD LYS B 125 19.630 7.338 35.550 1.00 31.91 C ATOM 2491 CE LYS B 125 20.887 7.244 36.412 1.00 35.10 C ATOM 2492 NZ LYS B 125 21.846 8.356 36.108 1.00 37.56 N ATOM 2493 HZ1 LYS B 125 22.127 8.306 35.108 1.00 0.00 H ATOM 2494 HZ2 LYS B 125 21.386 9.270 36.295 1.00 0.00 H ATOM 2495 HZ3 LYS B 125 22.688 8.261 36.711 1.00 0.00 H ATOM 2496 H LYS B 125 16.678 3.711 34.154 1.00 0.00 H ATOM 2497 N ILE B 126 14.068 6.405 35.151 1.00 25.17 N ATOM 2498 CA ILE B 126 12.873 6.818 34.419 1.00 24.96 C ATOM 2499 C ILE B 126 12.461 8.217 34.862 1.00 25.27 C ATOM 2500 O ILE B 126 12.739 8.629 35.996 1.00 25.82 O ATOM 2501 CB ILE B 126 11.703 5.789 34.593 1.00 24.32 C ATOM 2502 CG1 ILE B 126 10.611 5.996 33.536 1.00 24.59 C ATOM 2503 CG2 ILE B 126 11.124 5.834 36.006 1.00 25.05 C ATOM 2504 CD1 ILE B 126 9.512 4.924 33.554 1.00 22.93 C ATOM 2505 H ILE B 126 14.165 6.668 36.153 1.00 0.00 H ATOM 2506 N SER B 127 11.827 8.953 33.957 1.00 25.65 N ATOM 2507 CA SER B 127 11.229 10.244 34.292 1.00 25.88 C ATOM 2508 C SER B 127 9.823 10.265 33.717 1.00 25.78 C ATOM 2509 O SER B 127 9.661 10.275 32.509 1.00 25.86 O ATOM 2510 CB SER B 127 12.057 11.412 33.732 1.00 26.12 C ATOM 2511 OG SER B 127 11.472 12.661 34.091 1.00 26.43 O ATOM 2512 HG SER B 127 10.555 12.712 33.722 1.00 0.00 H ATOM 2513 H SER B 127 11.754 8.601 32.981 1.00 0.00 H ATOM 2514 N CYS B 128 8.821 10.241 34.598 1.00 25.73 N ATOM 2515 CA CYS B 128 7.412 10.232 34.210 1.00 25.53 C ATOM 2516 C CYS B 128 6.942 11.667 34.028 1.00 25.35 C ATOM 2517 O CYS B 128 7.201 12.520 34.886 1.00 25.21 O ATOM 2518 CB CYS B 128 6.562 9.579 35.304 1.00 25.70 C ATOM 2519 SG CYS B 128 4.761 9.763 35.062 1.00 26.68 S ATOM 2520 H CYS B 128 9.054 10.228 35.611 1.00 0.00 H ATOM 2521 N LYS B 129 6.249 11.918 32.924 1.00 25.13 N ATOM 2522 CA LYS B 129 5.779 13.268 32.567 1.00 25.83 C ATOM 2523 C LYS B 129 4.712 13.836 33.518 1.00 26.07 C ATOM 2524 O LYS B 129 4.591 15.056 33.680 1.00 27.06 O ATOM 2525 CB LYS B 129 5.284 13.287 31.121 1.00 25.66 C ATOM 2526 CG LYS B 129 6.407 13.085 30.121 1.00 24.74 C ATOM 2527 CD LYS B 129 5.880 13.026 28.721 1.00 26.06 C ATOM 2528 CE LYS B 129 7.012 12.878 27.713 1.00 25.23 C ATOM 2529 NZ LYS B 129 7.861 14.104 27.698 1.00 27.73 N ATOM 2530 HZ1 LYS B 129 7.278 14.924 27.435 1.00 0.00 H ATOM 2531 HZ2 LYS B 129 8.267 14.255 28.644 1.00 0.00 H ATOM 2532 HZ3 LYS B 129 8.627 13.985 27.005 1.00 0.00 H ATOM 2533 H LYS B 129 6.029 11.128 32.284 1.00 0.00 H ATOM 2534 N GLY B 130 3.941 12.973 34.163 1.00 26.04 N ATOM 2535 CA GLY B 130 3.027 13.471 35.200 1.00 25.76 C ATOM 2536 C GLY B 130 1.722 14.128 34.784 1.00 26.06 C ATOM 2537 O GLY B 130 0.955 14.555 35.651 1.00 26.32 O ATOM 2538 H GLY B 130 3.982 11.958 33.939 1.00 0.00 H ATOM 2539 N HIS B 131 1.449 14.204 33.479 1.00 25.48 N ATOM 2540 CA HIS B 131 0.119 14.627 32.993 1.00 24.91 C ATOM 2541 C HIS B 131 -0.946 13.547 33.285 1.00 24.72 C ATOM 2542 O HIS B 131 -0.595 12.434 33.669 1.00 25.16 O ATOM 2543 CB HIS B 131 0.146 15.046 31.510 1.00 24.85 C ATOM 2544 CG HIS B 131 0.526 13.946 30.563 1.00 23.25 C ATOM 2545 ND1 HIS B 131 -0.345 12.946 30.194 1.00 23.46 N ATOM 2546 CD2 HIS B 131 1.674 13.711 29.886 1.00 23.40 C ATOM 2547 CE1 HIS B 131 0.258 12.125 29.350 1.00 23.07 C ATOM 2548 NE2 HIS B 131 1.485 12.570 29.145 1.00 22.85 N ATOM 2549 H HIS B 131 2.189 13.960 32.790 1.00 0.00 H ATOM 2550 N PRO B 132 -2.246 13.879 33.152 1.00 24.21 N ATOM 2551 CA PRO B 132 -3.271 12.936 33.604 1.00 24.25 C ATOM 2552 C PRO B 132 -3.306 11.594 32.870 1.00 24.16 C ATOM 2553 O PRO B 132 -3.873 10.640 33.397 1.00 24.61 O ATOM 2554 CB PRO B 132 -4.577 13.709 33.396 1.00 24.18 C ATOM 2555 CG PRO B 132 -4.172 15.149 33.458 1.00 24.18 C ATOM 2556 CD PRO B 132 -2.831 15.184 32.787 1.00 24.44 C ATOM 2557 N LEU B 133 -2.700 11.510 31.686 1.00 23.83 N ATOM 2558 CA LEU B 133 -2.644 10.237 30.961 1.00 23.81 C ATOM 2559 C LEU B 133 -1.247 9.597 30.930 1.00 23.25 C ATOM 2560 O LEU B 133 -0.984 8.719 30.103 1.00 23.46 O ATOM 2561 CB LEU B 133 -3.137 10.418 29.527 1.00 24.12 C ATOM 2562 CG LEU B 133 -4.506 11.033 29.305 1.00 25.91 C ATOM 2563 CD1 LEU B 133 -4.714 11.268 27.819 1.00 27.77 C ATOM 2564 CD2 LEU B 133 -5.581 10.132 29.885 1.00 28.29 C ATOM 2565 H LEU B 133 -2.262 12.357 31.272 1.00 0.00 H ATOM 2566 N SER B 134 -0.373 10.012 31.842 1.00 22.98 N ATOM 2567 CA SER B 134 1.029 9.568 31.819 1.00 22.83 C ATOM 2568 C SER B 134 1.291 8.257 32.552 1.00 22.78 C ATOM 2569 O SER B 134 2.376 7.699 32.427 1.00 22.85 O ATOM 2570 CB SER B 134 1.948 10.662 32.379 1.00 22.62 C ATOM 2571 OG SER B 134 1.594 10.975 33.717 1.00 23.05 O ATOM 2572 HG SER B 134 0.658 11.297 33.743 1.00 0.00 H ATOM 2573 H SER B 134 -0.688 10.665 32.588 1.00 0.00 H ATOM 2574 N GLU B 135 0.322 7.799 33.346 1.00 23.20 N ATOM 2575 CA GLU B 135 0.448 6.556 34.120 1.00 23.70 C ATOM 2576 C GLU B 135 -0.881 5.820 34.079 1.00 23.68 C ATOM 2577 O GLU B 135 -1.851 6.191 34.752 1.00 23.14 O ATOM 2578 CB GLU B 135 0.856 6.823 35.575 1.00 24.45 C ATOM 2579 CG GLU B 135 2.082 7.690 35.747 1.00 27.10 C ATOM 2580 CD GLU B 135 2.216 8.232 37.157 1.00 30.41 C ATOM 2581 OE1 GLU B 135 2.845 7.563 37.992 1.00 30.73 O ATOM 2582 OE2 GLU B 135 1.686 9.333 37.432 1.00 34.17 O ATOM 2583 H GLU B 135 -0.560 8.345 33.421 1.00 0.00 H ATOM 2584 N LEU B 136 -0.927 4.789 33.246 1.00 23.43 N ATOM 2585 CA LEU B 136 -2.152 4.065 33.008 1.00 24.24 C ATOM 2586 C LEU B 136 -1.933 2.584 33.264 1.00 25.00 C ATOM 2587 O LEU B 136 -0.906 2.019 32.876 1.00 25.17 O ATOM 2588 CB LEU B 136 -2.617 4.292 31.573 1.00 23.99 C ATOM 2589 CG LEU B 136 -2.824 5.727 31.089 1.00 23.35 C ATOM 2590 CD1 LEU B 136 -2.999 5.727 29.558 1.00 23.18 C ATOM 2591 CD2 LEU B 136 -4.028 6.381 31.774 1.00 24.78 C ATOM 2592 H LEU B 136 -0.060 4.496 32.753 1.00 0.00 H ATOM 2593 N SER B 137 -2.880 1.954 33.940 1.00 26.18 N ATOM 2594 CA SER B 137 -2.784 0.509 34.108 1.00 27.47 C ATOM 2595 C SER B 137 -3.875 -0.193 33.314 1.00 28.04 C ATOM 2596 O SER B 137 -4.993 0.314 33.186 1.00 27.82 O ATOM 2597 CB SER B 137 -2.782 0.119 35.590 1.00 28.20 C ATOM 2598 OG SER B 137 -3.953 0.549 36.245 1.00 30.12 O ATOM 2599 HG SER B 137 -3.915 0.280 37.197 1.00 0.00 H ATOM 2600 H SER B 137 -3.680 2.481 34.345 1.00 0.00 H ATOM 2601 N ARG B 138 -3.525 -1.347 32.753 1.00 28.45 N ATOM 2602 CA ARG B 138 -4.443 -2.126 31.931 1.00 29.59 C ATOM 2603 C ARG B 138 -4.377 -3.613 32.270 1.00 30.06 C ATOM 2604 O ARG B 138 -3.301 -4.165 32.478 1.00 29.80 O ATOM 2605 CB ARG B 138 -4.141 -1.935 30.439 1.00 29.47 C ATOM 2606 CG ARG B 138 -4.271 -0.494 29.928 1.00 29.88 C ATOM 2607 CD ARG B 138 -5.720 -0.057 29.883 1.00 30.46 C ATOM 2608 NE ARG B 138 -5.868 1.274 29.295 1.00 32.00 N ATOM 2609 CZ ARG B 138 -6.004 2.396 29.993 1.00 30.64 C ATOM 2610 NH1 ARG B 138 -6.013 2.366 31.317 1.00 29.31 N ATOM 2611 NH2 ARG B 138 -6.139 3.552 29.359 1.00 30.29 N ATOM 2612 HE ARG B 138 -5.867 1.347 28.258 1.00 0.00 H ATOM 2613 HH12 ARG B 138 -6.120 3.249 31.856 1.00 0.00 H ATOM 2614 HH11 ARG B 138 -5.913 1.460 31.817 1.00 0.00 H ATOM 2615 HH22 ARG B 138 -6.246 4.433 29.901 1.00 0.00 H ATOM 2616 HH21 ARG B 138 -6.138 3.578 28.319 1.00 0.00 H ATOM 2617 H ARG B 138 -2.561 -1.707 32.906 1.00 0.00 H ATOM 2618 N LYS B 139 -5.549 -4.232 32.329 1.00 31.07 N ATOM 2619 CA LYS B 139 -5.692 -5.686 32.350 1.00 32.58 C ATOM 2620 C LYS B 139 -5.876 -6.157 30.914 1.00 33.26 C ATOM 2621 O LYS B 139 -6.686 -5.600 30.180 1.00 33.07 O ATOM 2622 CB LYS B 139 -6.919 -6.091 33.184 1.00 32.61 C ATOM 2623 CG LYS B 139 -7.145 -7.593 33.323 1.00 33.66 C ATOM 2624 CD LYS B 139 -6.400 -8.161 34.523 1.00 36.86 C ATOM 2625 CE LYS B 139 -6.115 -9.650 34.386 1.00 37.96 C ATOM 2626 NZ LYS B 139 -5.366 -10.150 35.579 1.00 38.50 N ATOM 2627 HZ1 LYS B 139 -4.464 -9.638 35.660 1.00 0.00 H ATOM 2628 HZ2 LYS B 139 -5.934 -9.991 36.435 1.00 0.00 H ATOM 2629 HZ3 LYS B 139 -5.180 -11.167 35.469 1.00 0.00 H ATOM 2630 H LYS B 139 -6.411 -3.652 32.362 1.00 0.00 H ATOM 2631 N ILE B 140 -5.115 -7.175 30.520 1.00 34.27 N ATOM 2632 CA ILE B 140 -5.251 -7.795 29.204 1.00 35.30 C ATOM 2633 C ILE B 140 -5.680 -9.255 29.379 1.00 36.08 C ATOM 2634 O ILE B 140 -5.089 -9.987 30.177 1.00 35.58 O ATOM 2635 CB ILE B 140 -3.913 -7.759 28.415 1.00 35.49 C ATOM 2636 CG1 ILE B 140 -3.287 -6.351 28.433 1.00 35.75 C ATOM 2637 CG2 ILE B 140 -4.100 -8.315 26.998 1.00 35.65 C ATOM 2638 CD1 ILE B 140 -4.138 -5.255 27.796 1.00 37.29 C ATOM 2639 H ILE B 140 -4.395 -7.544 31.174 1.00 0.00 H ATOM 2640 N VAL B 141 -6.688 -9.680 28.621 1.00 37.51 N ATOM 2641 CA VAL B 141 -7.300 -11.001 28.834 1.00 39.52 C ATOM 2642 C VAL B 141 -7.049 -12.022 27.705 1.00 40.74 C ATOM 2643 O VAL B 141 -6.671 -13.172 27.981 1.00 41.13 O ATOM 2644 CB VAL B 141 -8.816 -10.859 29.169 1.00 39.47 C ATOM 2645 CG1 VAL B 141 -9.521 -12.206 29.192 1.00 40.20 C ATOM 2646 CG2 VAL B 141 -8.984 -10.161 30.514 1.00 40.24 C ATOM 2647 H VAL B 141 -7.050 -9.066 27.863 1.00 0.00 H ATOM 2648 N ALA B 142 -7.246 -11.594 26.454 1.00 41.78 N ATOM 2649 CA ALA B 142 -7.177 -12.469 25.266 1.00 42.43 C ATOM 2650 C ALA B 142 -8.329 -13.478 25.198 1.00 42.87 C ATOM 2651 O ALA B 142 -8.454 -14.408 26.003 1.00 42.90 O ATOM 2652 CB ALA B 142 -5.832 -13.179 25.173 1.00 42.42 C ATOM 2653 H ALA B 142 -7.460 -10.587 26.309 1.00 0.00 H TER 2654 ALA B 142 HETATM 2655 O HOH 1 -0.060 9.091 43.416 1.00 27.06 O HETATM 2656 O HOH 2 2.979 9.586 39.871 1.00 23.52 O HETATM 2657 O HOH 3 -6.136 21.439 47.680 1.00 30.80 O HETATM 2658 O HOH 4 9.905 15.249 38.731 1.00 26.37 O HETATM 2659 O HOH 5 -8.997 5.258 65.319 1.00 33.40 O HETATM 2660 O HOH 6 15.566 9.514 36.633 1.00 33.70 O HETATM 2661 O HOH 7 1.203 15.143 51.652 1.00 50.34 O HETATM 2662 O HOH 8 12.699 10.187 62.370 1.00 35.07 O HETATM 2663 O HOH 9 16.497 2.589 62.880 1.00 39.85 O HETATM 2664 O HOH 10 10.025 -9.596 45.774 1.00 35.42 O HETATM 2665 O HOH 11 -13.107 8.400 51.094 1.00 33.79 O HETATM 2666 O HOH 12 20.226 3.674 37.793 1.00 38.01 O HETATM 2667 O HOH 13 -6.807 6.165 66.002 1.00 47.88 O HETATM 2668 O HOH 14 -4.159 18.203 31.844 1.00 34.13 O HETATM 2669 O HOH 15 -9.341 3.113 62.634 1.00 41.29 O HETATM 2670 O HOH 16 14.160 -2.595 47.481 1.00 31.59 O HETATM 2671 O HOH 17 3.510 -9.457 43.638 1.00 72.25 O HETATM 2672 O HOH 18 12.391 -9.210 53.609 1.00 53.89 O HETATM 2673 O HOH 19 -2.943 -7.721 45.813 1.00 46.54 O HETATM 2674 O HOH 20 -6.054 0.942 40.332 1.00 39.41 O HETATM 2675 O HOH 21 6.536 14.222 54.273 1.00 43.10 O HETATM 2676 O HOH 22 21.963 10.756 44.208 1.00 41.01 O HETATM 2677 O HOH 23 20.437 2.787 34.648 1.00 26.60 O HETATM 2678 O HOH 24 -4.926 7.813 65.751 1.00 37.20 O HETATM 2679 O HOH 25 12.236 12.249 61.346 1.00 38.96 O HETATM 2680 O HOH 26 24.892 3.017 45.157 1.00 45.36 O HETATM 2681 O HOH 27 -1.870 -6.582 63.562 1.00 46.84 O HETATM 2682 O HOH 28 -4.833 18.622 29.255 1.00 41.40 O HETATM 2683 O HOH 29 -10.415 -0.087 42.854 1.00 38.28 O HETATM 2684 O HOH 30 14.326 -9.983 51.968 1.00 52.05 O HETATM 2685 O HOH 31 2.174 25.995 56.421 1.00 54.34 O HETATM 2686 O HOH 32 15.485 -6.630 42.803 1.00 35.64 O HETATM 2687 O HOH 33 11.611 13.901 57.635 1.00 46.52 O HETATM 2688 O HOH 34 21.802 2.907 39.743 1.00 30.59 O HETATM 2689 O HOH 35 -9.069 21.614 52.650 1.00 50.63 O HETATM 2690 O HOH 36 5.627 -2.794 65.318 1.00 54.78 O HETATM 2691 O HOH 37 -14.887 10.406 52.309 1.00 41.44 O HETATM 2692 O HOH 38 -5.223 16.053 27.031 1.00 46.54 O HETATM 2693 O HOH 39 18.264 -7.268 58.497 1.00 41.92 O HETATM 2694 O HOH 40 -7.483 -5.439 57.357 1.00 50.68 O HETATM 2695 O HOH 41 24.180 3.476 39.890 1.00 43.68 O HETATM 2696 O HOH 42 15.089 -7.380 58.257 1.00 35.01 O HETATM 2697 O HOH 43 22.033 -4.935 52.140 1.00 40.96 O HETATM 2698 O HOH 44 22.383 0.486 51.259 1.00 37.65 O HETATM 2699 O HOH 45 5.887 25.465 38.188 1.00 45.33 O HETATM 2700 O HOH 46 -8.690 0.016 40.731 1.00 40.17 O HETATM 2701 O HOH 47 21.241 12.641 42.476 1.00 67.15 O HETATM 2702 O HOH 48 23.735 1.097 39.582 1.00 43.66 O HETATM 2703 O HOH 49 -9.902 9.957 40.448 1.00 49.20 O HETATM 2704 O HOH 50 20.532 7.749 56.361 1.00 43.25 O HETATM 2705 O HOH 51 7.251 -9.166 61.558 1.00 46.77 O HETATM 2706 O HOH 52 -10.179 5.181 57.664 1.00 52.35 O HETATM 2707 O HOH 53 -2.566 17.201 29.753 1.00 42.00 O HETATM 2708 O HOH 54 18.462 13.793 38.419 1.00 50.59 O HETATM 2709 O HOH 55 -5.387 3.695 34.452 1.00 24.78 O HETATM 2710 O HOH 56 12.835 -7.056 34.537 1.00 31.90 O HETATM 2711 O HOH 57 -8.048 -8.854 18.241 1.00 48.80 O HETATM 2712 O HOH 58 8.708 15.303 33.350 1.00 40.44 O HETATM 2713 O HOH 59 0.885 -7.337 13.211 1.00 33.17 O HETATM 2714 O HOH 60 -4.720 2.053 17.832 1.00 25.45 O HETATM 2715 O HOH 61 6.060 -16.098 17.636 1.00 38.63 O HETATM 2716 O HOH 62 14.740 -3.321 36.957 1.00 30.87 O HETATM 2717 O HOH 63 0.806 6.488 29.823 1.00 26.20 O HETATM 2718 O HOH 64 6.515 16.604 27.583 1.00 24.07 O HETATM 2719 O HOH 65 15.610 7.646 21.941 1.00 39.08 O HETATM 2720 O HOH 66 3.538 -21.025 23.443 1.00 35.18 O HETATM 2721 O HOH 67 28.515 -2.416 32.387 1.00 36.51 O HETATM 2722 O HOH 68 12.166 -0.912 16.592 1.00 32.34 O HETATM 2723 O HOH 69 -5.388 -0.559 19.119 1.00 30.27 O HETATM 2724 O HOH 70 -0.058 0.367 13.404 1.00 42.72 O HETATM 2725 O HOH 71 11.307 -10.191 19.944 1.00 35.02 O HETATM 2726 O HOH 72 7.949 8.936 20.656 1.00 34.38 O HETATM 2727 O HOH 73 6.155 -24.538 30.627 1.00 30.99 O HETATM 2728 O HOH 74 22.335 2.680 30.647 1.00 46.38 O HETATM 2729 O HOH 75 15.237 -3.424 19.286 1.00 46.16 O HETATM 2730 O HOH 76 17.543 -8.855 25.585 1.00 52.35 O HETATM 2731 O HOH 77 13.982 -10.133 21.220 1.00 41.53 O HETATM 2732 O HOH 78 15.010 -4.368 22.092 1.00 33.21 O HETATM 2733 O HOH 79 3.915 -20.867 27.358 1.00 40.22 O HETATM 2734 O HOH 80 -1.860 -1.551 13.865 1.00 39.37 O HETATM 2735 O HOH 81 -5.960 5.561 20.415 1.00 31.03 O HETATM 2736 O HOH 82 6.606 11.903 24.202 1.00 29.47 O HETATM 2737 O HOH 83 -4.273 -6.318 16.318 1.00 40.62 O HETATM 2738 O HOH 84 -7.081 -2.963 24.901 1.00 38.29 O HETATM 2739 O HOH 85 4.971 -19.827 25.113 1.00 54.96 O HETATM 2740 O HOH 86 -1.439 9.608 34.897 1.00 36.82 O HETATM 2741 O HOH 87 8.232 -15.092 21.273 1.00 36.54 O HETATM 2742 O HOH 88 -6.500 -5.723 24.245 1.00 40.72 O HETATM 2743 O HOH 89 9.898 14.032 35.585 1.00 32.39 O HETATM 2744 O HOH 90 3.680 -18.918 18.961 1.00 35.50 O HETATM 2745 O HOH 91 -5.362 12.438 17.108 1.00 52.29 O HETATM 2746 O HOH 92 -6.116 4.144 18.301 1.00 40.42 O HETATM 2747 O HOH 93 12.217 -8.583 17.700 1.00 30.61 O HETATM 2748 O HOH 94 15.159 -7.862 21.717 1.00 63.42 O HETATM 2749 O HOH 95 20.419 10.071 32.947 1.00 53.99 O HETATM 2750 O HOH 96 -0.594 -22.492 35.721 1.00 48.64 O HETATM 2751 O HOH 97 25.694 -12.626 37.066 1.00 34.69 O HETATM 2752 O HOH 98 7.691 -16.424 36.672 1.00 46.15 O HETATM 2753 O HOH 99 -7.989 -18.778 30.025 1.00 58.03 O HETATM 2754 O HOH 100 5.673 10.550 17.614 1.00 49.27 O HETATM 2755 O HOH 101 18.064 -16.924 26.415 1.00 42.00 O HETATM 2756 O HOH 102 -5.973 -11.806 37.644 1.00 57.99 O HETATM 2757 O HOH 103 24.056 8.269 37.420 1.00 54.31 O HETATM 2758 O HOH 104 -3.708 -15.214 35.886 1.00 38.99 O HETATM 2759 O HOH 105 22.439 -17.263 27.616 1.00 36.71 O HETATM 2760 O HOH 106 10.882 -12.802 18.292 1.00 40.87 O HETATM 2761 O HOH 107 13.676 -16.540 19.889 1.00 33.59 O HETATM 2762 O HOH 108 24.658 -5.689 41.707 1.00 41.29 O HETATM 2763 O HOH 109 8.057 -9.569 41.686 1.00 47.46 O HETATM 2764 O HOH 110 -3.531 0.889 15.630 1.00 43.86 O HETATM 2765 O HOH 111 -4.166 -2.687 17.152 1.00 40.10 O HETATM 2766 C A A 3 -1.972 7.612 41.479 1.00 0.23 C HETATM 2767 O A A 3 -1.780 6.341 41.931 1.00 -0.39 O HETATM 2768 N8 A A 3 -2.942 8.438 41.868 1.00 -0.27 N HETATM 2769 C3' A A 3 -3.978 8.058 42.839 1.00 0.10 C HETATM 2770 C2' A A 3 -3.397 8.018 44.243 1.00 0.14 C HETATM 2771 C1' A A 3 -4.624 8.334 45.094 1.00 0.20 C HETATM 2772 N9 A A 3 -5.296 7.127 45.667 1.00 -0.19 N HETATM 2773 C4 A A 3 -4.687 6.107 46.281 1.00 0.16 C HETATM 2774 N3 A A 3 -3.395 5.809 46.548 1.00 -0.27 N HETATM 2775 C2 A A 3 -3.061 4.684 47.189 1.00 0.05 C HETATM 2776 N1 A A 3 -4.000 3.828 47.590 1.00 -0.27 N HETATM 2777 C6 A A 3 -5.312 4.071 47.358 1.00 0.13 C HETATM 2778 C5 A A 3 -5.685 5.234 46.689 1.00 0.10 C HETATM 2779 N7 A A 3 -6.859 5.752 46.308 1.00 -0.30 N HETATM 2780 C8 A A 3 -6.618 6.910 45.694 1.00 0.11 C HETATM 2781 H7 A A 3 -7.375 7.574 45.280 1.00 0.13 H HETATM 2782 N6 A A 3 -6.253 3.214 47.761 1.00 -0.32 N HETATM 2783 H5 A A 3 -7.246 3.415 47.576 1.00 0.18 H HETATM 2784 H6 A A 3 -5.986 2.352 48.257 1.00 0.18 H HETATM 2785 H4 A A 3 -2.017 4.466 47.384 1.00 0.10 H HETATM 2786 O4' A A 3 -5.527 9.158 44.288 1.00 -0.34 O HETATM 2787 C4' A A 3 -5.052 9.158 42.920 1.00 0.11 C HETATM 2788 C5' A A 3 -6.248 8.878 41.987 1.00 0.07 C HETATM 2789 O5' A A 3 -6.795 7.582 42.268 1.00 -0.39 O HETATM 2790 H19 A A 3 -7.088 7.552 43.171 1.00 0.21 H HETATM 2791 H17 A A 3 -5.910 8.912 40.941 1.00 0.06 H HETATM 2792 H18 A A 3 -7.022 9.643 42.147 1.00 0.06 H HETATM 2793 H16 A A 3 -4.609 10.132 42.664 1.00 0.06 H HETATM 2794 H12 A A 3 -4.288 8.941 45.948 1.00 0.10 H HETATM 2795 O2' A A 3 -2.427 9.046 44.451 1.00 -0.38 O HETATM 2796 H14 A A 3 -1.656 8.863 43.927 1.00 0.21 H HETATM 2797 H13 A A 3 -2.966 7.033 44.476 1.00 0.07 H HETATM 2798 H15 A A 3 -4.418 7.089 42.561 1.00 0.06 H HETATM 2799 H8 A A 3 -2.966 9.360 41.481 1.00 0.19 H HETATM 2800 CA A A 3 -0.995 8.153 40.447 1.00 0.09 C HETATM 2801 N A A 3 0.364 7.771 40.843 1.00 0.24 N HETATM 2802 H1 A A 3 0.565 8.144 41.758 1.00 0.20 H HETATM 2803 H2 A A 3 1.024 8.141 40.177 1.00 0.20 H HETATM 2804 H3 A A 3 0.437 6.766 40.866 1.00 0.20 H HETATM 2805 CB A A 3 -1.313 7.593 39.059 1.00 0.11 C HETATM 2806 OG A A 3 -0.480 8.279 38.135 1.00 -0.38 O HETATM 2807 H11 A A 3 0.431 8.128 38.358 1.00 0.21 H HETATM 2808 CG2 A A 3 -2.785 7.768 38.652 1.00 -0.03 C HETATM 2809 H20 A A 3 -2.941 7.345 37.649 1.00 0.03 H HETATM 2810 H21 A A 3 -3.038 8.838 38.642 1.00 0.03 H HETATM 2811 H22 A A 3 -3.430 7.246 39.374 1.00 0.03 H HETATM 2812 H10 A A 3 -1.075 6.519 39.045 1.00 0.07 H HETATM 2813 H9 A A 3 -1.071 9.250 40.416 1.00 0.11 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1328 1329 1336 1337 1338 CONECT 1336 1328 CONECT 1337 1328 CONECT 1338 1328 CONECT 2766 2767 2768 2800 CONECT 2767 2766 CONECT 2768 2766 2769 2799 CONECT 2769 2768 2770 2787 2798 CONECT 2770 2769 2771 2795 2797 CONECT 2771 2770 2772 2786 2794 CONECT 2772 2771 2773 2780 CONECT 2773 2772 2774 2778 CONECT 2774 2773 2775 CONECT 2775 2774 2776 2785 CONECT 2776 2775 2777 CONECT 2777 2776 2778 2782 CONECT 2778 2773 2777 2779 CONECT 2779 2778 2780 CONECT 2780 2772 2779 2781 CONECT 2781 2780 CONECT 2782 2777 2783 2784 CONECT 2783 2782 CONECT 2784 2782 CONECT 2785 2775 CONECT 2786 2771 2787 CONECT 2787 2769 2786 2788 2793 CONECT 2788 2787 2789 2791 2792 CONECT 2789 2788 2790 CONECT 2790 2789 CONECT 2791 2788 CONECT 2792 2788 CONECT 2793 2787 CONECT 2794 2771 CONECT 2795 2770 2796 CONECT 2796 2795 CONECT 2797 2770 CONECT 2798 2769 CONECT 2799 2768 CONECT 2800 2766 2801 2805 2813 CONECT 2801 2800 2802 2803 2804 CONECT 2802 2801 CONECT 2803 2801 CONECT 2804 2801 CONECT 2805 2800 2806 2808 2812 CONECT 2806 2805 2807 CONECT 2807 2806 CONECT 2808 2805 2809 2810 2811 CONECT 2809 2808 CONECT 2810 2808 CONECT 2811 2808 CONECT 2812 2805 CONECT 2813 2800 MASTER 0 0 0 0 0 0 0 0 2811 2 56 22 END
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Structure:
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Related entries of code: 4rrg
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4rrf
RCSB PDB
PDBbind
141aa, >4RRF_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3pd3
RCSB PDB
PDBbind
A3T
4rra
RCSB PDB
PDBbind
A3T
4rrr
RCSB PDB
PDBbind
A3T
Entry Information
PDB ID
4rrg
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Editing domain of threonyl-tRNA synthetase from Methanococcus jannaschii, MjNTD
Ligand Name
A3T
EC.Number
E.C.6.1.1.3
Resolution
1.93(Å)
Affinity (Kd/Ki/IC50)
Kd=1538.5uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Nat Commun Vol. 6: pp. 7552-7552
Ligand Properties
Formula
C
1
4
H
2
2
N
7
O
5
Molecular Weight
368.368
Exact Mass
368.168
No. of atoms
48
No. of bonds
50
Polar Surface Area
196.28
LOGP Value
-3.03 (
Computed with XLOGP3
)
-2.89 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 3
Canonical SMILES
OC[C@H]1O[C@H]([C@@H]([C@@H]1NC(=O)[C@H]([C@H](O)C)[NH3+])O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C14H21N7O5/c1-5(23)7(15)13(25)20-8-6(2-22)26-14(10(8)24)21-4-19-9-11(16)17-3-18-12(9)21/h3-8,10,14,22-24H,2,15H2,1H3,(H,20,25)(H2,16,17,18)/p+1/t5-,6-,7+,8-,10-,14-/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):
Q58597
Entrez Gene ID
NCBI Entrez Gene ID:
1452092
ASD
Information of known allosteric effects of PDB entries
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