Browse entries in the PDBbind-CN Database
HEADER 4RRQ_COMPLEX COMPND 4RRQ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 141 MET ARG VAL LEU LEU ILE HIS SER ASP TYR ILE GLU TYR SEQRES 2 A 141 GLU VAL LYS ASP LYS ALA LEU LYS ASN PRO GLU PRO ILE SEQRES 3 A 141 SER GLU ASP MET LYS ARG GLY ARG MET GLU GLU VAL LEU SEQRES 4 A 141 VAL ALA PHE ILE SER VAL GLU LYS VAL ASP GLU LYS ASN SEQRES 5 A 141 PRO GLU GLU VAL SER LEU LYS ALA ILE GLU GLU ILE SER SEQRES 6 A 141 LYS VAL ALA GLU GLN VAL LYS ALA GLU ASN VAL PHE VAL SEQRES 7 A 141 TYR PRO PHE ALA HIS LEU SER SER GLU LEU ALA LYS PRO SEQRES 8 A 141 SER VAL ALA MET ASP ILE LEU ASN ARG VAL TYR GLN GLY SEQRES 9 A 141 LEU LYS GLU ARG GLY PHE ASN VAL GLY LYS ALA PRO PHE SEQRES 10 A 141 GLY TYR TYR MET ALA PHE LYS ILE SER CYS LYS GLY HIS SEQRES 11 A 141 PRO LEU ALA GLU LEU SER ARG THR ILE VAL PRO SEQRES 1 B 147 MET ARG VAL LEU LEU ILE HIS SER ASP TYR ILE GLU TYR SEQRES 2 B 147 GLU VAL LYS ASP LYS ALA LEU LYS ASN PRO GLU PRO ILE SEQRES 3 B 147 SER GLU ASP MET LYS ARG GLY ARG MET GLU GLU VAL LEU SEQRES 4 B 147 VAL ALA PHE ILE SER VAL GLU LYS VAL ASP GLU LYS ASN SEQRES 5 B 147 PRO GLU GLU VAL SER LEU LYS ALA ILE GLU GLU ILE SER SEQRES 6 B 147 LYS VAL ALA GLU GLN VAL LYS ALA GLU ASN VAL PHE VAL SEQRES 7 B 147 TYR PRO PHE ALA HIS LEU SER SER GLU LEU ALA LYS PRO SEQRES 8 B 147 SER VAL ALA MET ASP ILE LEU ASN ARG VAL TYR GLN GLY SEQRES 9 B 147 LEU LYS GLU ARG GLY PHE ASN VAL GLY LYS ALA PRO PHE SEQRES 10 B 147 GLY TYR TYR MET ALA PHE LYS ILE SER CYS LYS GLY HIS SEQRES 11 B 147 PRO LEU ALA GLU LEU SER ARG THR ILE VAL PRO GLU GLU SEQRES 12 B 147 ALA ARG VAL GLU HET A A 3S 45 ATOM 1 N MET A 1 23.971 -8.124 -1.944 1.00 17.64 N ATOM 2 CA MET A 1 22.896 -7.094 -1.975 1.00 16.24 C ATOM 3 C MET A 1 22.134 -7.043 -0.660 1.00 16.46 C ATOM 4 O MET A 1 21.777 -8.080 -0.097 1.00 17.25 O ATOM 5 CB MET A 1 21.903 -7.396 -3.100 1.00 17.14 C ATOM 6 CG MET A 1 20.768 -6.379 -3.210 1.00 17.04 C ATOM 7 SD MET A 1 19.517 -6.841 -4.430 1.00 18.40 S ATOM 8 CE MET A 1 20.468 -6.718 -5.944 1.00 21.26 C ATOM 9 HN3 MET A 1 23.549 -9.059 -1.771 1.00 0.00 H ATOM 10 HN2 MET A 1 24.643 -7.899 -1.182 1.00 0.00 H ATOM 11 HN1 MET A 1 24.469 -8.131 -2.857 1.00 0.00 H ATOM 12 N ARG A 2 21.885 -5.829 -0.179 1.00 16.11 N ATOM 13 CA ARG A 2 21.130 -5.623 1.051 1.00 15.09 C ATOM 14 C ARG A 2 19.818 -4.968 0.634 1.00 15.47 C ATOM 15 O ARG A 2 19.820 -3.942 -0.046 1.00 14.33 O ATOM 16 CB ARG A 2 21.893 -4.713 2.000 1.00 17.51 C ATOM 17 H ARG A 2 22.240 -5.000 -0.697 1.00 0.00 H ATOM 18 N VAL A 3 18.703 -5.566 1.039 1.00 14.42 N ATOM 19 CA VAL A 3 17.389 -5.050 0.682 1.00 14.18 C ATOM 20 C VAL A 3 16.544 -4.799 1.920 1.00 15.94 C ATOM 21 O VAL A 3 16.397 -5.681 2.762 1.00 16.47 O ATOM 22 CB VAL A 3 16.619 -6.051 -0.228 1.00 14.04 C ATOM 23 CG1 VAL A 3 15.279 -5.452 -0.653 1.00 13.65 C ATOM 24 CG2 VAL A 3 17.446 -6.396 -1.447 1.00 14.83 C ATOM 25 H VAL A 3 18.770 -6.423 1.625 1.00 0.00 H ATOM 26 N LEU A 4 16.008 -3.586 2.028 1.00 14.20 N ATOM 27 CA LEU A 4 15.133 -3.213 3.135 1.00 13.44 C ATOM 28 C LEU A 4 13.779 -2.980 2.482 1.00 12.88 C ATOM 29 O LEU A 4 13.642 -2.109 1.631 1.00 11.48 O ATOM 30 CB LEU A 4 15.620 -1.934 3.819 1.00 14.32 C ATOM 31 CG LEU A 4 14.755 -1.410 4.973 1.00 13.45 C ATOM 32 CD1 LEU A 4 14.608 -2.480 6.050 1.00 16.41 C ATOM 33 CD2 LEU A 4 15.392 -0.157 5.553 1.00 13.88 C ATOM 34 H LEU A 4 16.220 -2.878 1.297 1.00 0.00 H ATOM 35 N LEU A 5 12.792 -3.775 2.878 1.00 11.50 N ATOM 36 CA LEU A 5 11.451 -3.699 2.310 1.00 10.91 C ATOM 37 C LEU A 5 10.447 -3.054 3.248 1.00 12.34 C ATOM 38 O LEU A 5 10.173 -3.577 4.325 1.00 12.98 O ATOM 39 CB LEU A 5 10.973 -5.109 1.951 1.00 11.87 C ATOM 40 CG LEU A 5 11.781 -5.821 0.862 1.00 13.74 C ATOM 41 CD1 LEU A 5 11.481 -7.315 0.882 1.00 13.63 C ATOM 42 CD2 LEU A 5 11.445 -5.220 -0.492 1.00 13.78 C ATOM 43 H LEU A 5 12.982 -4.478 3.621 1.00 0.00 H ATOM 44 N ILE A 6 9.886 -1.922 2.827 1.00 9.28 N ATOM 45 CA ILE A 6 8.900 -1.220 3.638 1.00 9.96 C ATOM 46 C ILE A 6 7.570 -1.088 2.891 1.00 9.65 C ATOM 47 O ILE A 6 7.491 -0.451 1.838 1.00 10.39 O ATOM 48 CB ILE A 6 9.415 0.184 4.045 1.00 11.01 C ATOM 49 CG1 ILE A 6 10.719 0.047 4.840 1.00 14.61 C ATOM 50 CG2 ILE A 6 8.371 0.905 4.893 1.00 11.75 C ATOM 51 CD1 ILE A 6 11.272 1.369 5.366 1.00 16.27 C ATOM 52 H ILE A 6 10.157 -1.532 1.902 1.00 0.00 H ATOM 53 N HIS A 7 6.528 -1.712 3.432 1.00 10.08 N ATOM 54 CA HIS A 7 5.210 -1.653 2.824 1.00 10.68 C ATOM 55 C HIS A 7 4.631 -0.318 3.282 1.00 12.65 C ATOM 56 O HIS A 7 4.370 -0.109 4.471 1.00 12.51 O ATOM 57 CB HIS A 7 4.373 -2.844 3.296 1.00 12.47 C ATOM 58 CG HIS A 7 3.098 -3.021 2.539 1.00 12.14 C ATOM 59 ND1 HIS A 7 2.880 -2.446 1.306 1.00 14.53 N ATOM 60 CD2 HIS A 7 1.976 -3.717 2.834 1.00 12.60 C ATOM 61 CE1 HIS A 7 1.677 -2.778 0.875 1.00 10.48 C ATOM 62 NE2 HIS A 7 1.107 -3.548 1.783 1.00 14.91 N ATOM 63 H HIS A 7 6.659 -2.254 4.310 1.00 0.00 H ATOM 64 N SER A 8 4.439 0.585 2.326 1.00 11.23 N ATOM 65 CA SER A 8 3.990 1.934 2.634 1.00 12.21 C ATOM 66 C SER A 8 2.708 2.421 1.970 1.00 10.74 C ATOM 67 O SER A 8 2.297 1.930 0.920 1.00 10.99 O ATOM 68 CB SER A 8 5.112 2.910 2.279 1.00 13.98 C ATOM 69 OG SER A 8 6.385 2.347 2.567 1.00 15.70 O ATOM 70 HG SER A 8 6.505 1.518 2.039 1.00 0.00 H ATOM 71 H SER A 8 4.614 0.321 1.335 1.00 0.00 H ATOM 72 N ASP A 9 2.089 3.417 2.591 1.00 11.13 N ATOM 73 CA ASP A 9 0.872 3.999 2.040 1.00 11.32 C ATOM 74 C ASP A 9 1.279 4.805 0.812 1.00 11.69 C ATOM 75 O ASP A 9 0.497 4.980 -0.122 1.00 12.32 O ATOM 76 CB ASP A 9 0.209 4.911 3.074 1.00 11.88 C ATOM 77 CG ASP A 9 -0.127 4.179 4.357 1.00 16.04 C ATOM 78 OD1 ASP A 9 -0.966 3.253 4.311 1.00 15.82 O ATOM 79 OD2 ASP A 9 0.453 4.524 5.411 1.00 18.63 O ATOM 80 H ASP A 9 2.477 3.787 3.482 1.00 0.00 H ATOM 81 N TYR A 10 2.515 5.292 0.825 1.00 11.73 N ATOM 82 CA TYR A 10 3.042 6.072 -0.290 1.00 11.60 C ATOM 83 C TYR A 10 4.540 6.293 -0.162 1.00 11.82 C ATOM 84 O TYR A 10 5.124 6.112 0.906 1.00 11.20 O ATOM 85 CB TYR A 10 2.360 7.446 -0.352 1.00 11.73 C ATOM 86 CG TYR A 10 2.593 8.300 0.885 1.00 13.13 C ATOM 87 CD1 TYR A 10 3.828 8.914 1.124 1.00 13.68 C ATOM 88 CD2 TYR A 10 1.595 8.448 1.841 1.00 14.38 C ATOM 89 CE1 TYR A 10 4.060 9.649 2.294 1.00 15.31 C ATOM 90 CE2 TYR A 10 1.812 9.176 3.008 1.00 17.25 C ATOM 91 CZ TYR A 10 3.044 9.770 3.232 1.00 16.62 C ATOM 92 OH TYR A 10 3.262 10.453 4.409 1.00 19.36 O ATOM 93 HH TYR A 10 4.184 10.815 4.414 1.00 0.00 H ATOM 94 H TYR A 10 3.122 5.113 1.650 1.00 0.00 H ATOM 95 N ILE A 11 5.150 6.678 -1.275 1.00 12.62 N ATOM 96 CA ILE A 11 6.559 7.021 -1.311 1.00 11.64 C ATOM 97 C ILE A 11 6.624 8.212 -2.259 1.00 12.06 C ATOM 98 O ILE A 11 5.979 8.218 -3.307 1.00 12.35 O ATOM 99 CB ILE A 11 7.459 5.869 -1.849 1.00 13.83 C ATOM 100 CG1 ILE A 11 8.922 6.316 -1.851 1.00 14.12 C ATOM 101 CG2 ILE A 11 7.053 5.478 -3.259 1.00 11.54 C ATOM 102 CD1 ILE A 11 9.456 6.674 -0.482 1.00 16.11 C ATOM 103 H ILE A 11 4.598 6.736 -2.154 1.00 0.00 H ATOM 104 N GLU A 12 7.354 9.241 -1.854 1.00 11.06 N ATOM 105 CA GLU A 12 7.530 10.436 -2.672 1.00 12.79 C ATOM 106 C GLU A 12 9.020 10.726 -2.665 1.00 12.12 C ATOM 107 O GLU A 12 9.700 10.440 -1.683 1.00 12.17 O ATOM 108 CB GLU A 12 6.802 11.633 -2.059 1.00 15.53 C ATOM 109 CG GLU A 12 5.330 11.753 -2.372 1.00 20.82 C ATOM 110 CD GLU A 12 4.744 13.037 -1.808 1.00 22.40 C ATOM 111 OE1 GLU A 12 5.497 14.034 -1.701 1.00 21.10 O ATOM 112 OE2 GLU A 12 3.536 13.053 -1.483 1.00 23.57 O ATOM 113 H GLU A 12 7.816 9.195 -0.923 1.00 0.00 H ATOM 114 N TYR A 13 9.544 11.279 -3.752 1.00 10.94 N ATOM 115 CA TYR A 13 10.961 11.602 -3.771 1.00 10.08 C ATOM 116 C TYR A 13 11.215 12.869 -4.561 1.00 10.98 C ATOM 117 O TYR A 13 10.387 13.288 -5.368 1.00 9.97 O ATOM 118 CB TYR A 13 11.783 10.450 -4.364 1.00 11.99 C ATOM 119 CG TYR A 13 11.515 10.177 -5.827 1.00 12.59 C ATOM 120 CD1 TYR A 13 12.205 10.862 -6.827 1.00 15.68 C ATOM 121 CD2 TYR A 13 10.547 9.250 -6.209 1.00 15.37 C ATOM 122 CE1 TYR A 13 11.933 10.628 -8.176 1.00 16.44 C ATOM 123 CE2 TYR A 13 10.267 9.014 -7.548 1.00 17.00 C ATOM 124 CZ TYR A 13 10.960 9.704 -8.523 1.00 18.82 C ATOM 125 OH TYR A 13 10.661 9.479 -9.846 1.00 20.92 O ATOM 126 HH TYR A 13 11.240 10.045 -10.415 1.00 0.00 H ATOM 127 H TYR A 13 8.948 11.479 -4.580 1.00 0.00 H ATOM 128 N GLU A 14 12.353 13.490 -4.275 1.00 10.89 N ATOM 129 CA GLU A 14 12.783 14.697 -4.966 1.00 10.72 C ATOM 130 C GLU A 14 14.293 14.615 -5.097 1.00 10.31 C ATOM 131 O GLU A 14 15.005 14.566 -4.097 1.00 10.41 O ATOM 132 CB GLU A 14 12.431 15.964 -4.183 1.00 14.92 C ATOM 133 CG GLU A 14 12.792 17.237 -4.962 1.00 17.66 C ATOM 134 CD GLU A 14 12.798 18.495 -4.113 1.00 22.64 C ATOM 135 OE1 GLU A 14 12.031 18.557 -3.134 1.00 25.34 O ATOM 136 OE2 GLU A 14 13.565 19.430 -4.438 1.00 24.07 O ATOM 137 H GLU A 14 12.961 13.099 -3.528 1.00 0.00 H ATOM 138 N VAL A 15 14.779 14.583 -6.330 1.00 10.05 N ATOM 139 CA VAL A 15 16.215 14.536 -6.575 1.00 9.84 C ATOM 140 C VAL A 15 16.825 15.877 -6.177 1.00 10.81 C ATOM 141 O VAL A 15 16.307 16.930 -6.549 1.00 11.66 O ATOM 142 CB VAL A 15 16.511 14.287 -8.069 1.00 11.49 C ATOM 143 CG1 VAL A 15 17.996 14.493 -8.357 1.00 12.24 C ATOM 144 CG2 VAL A 15 16.079 12.884 -8.453 1.00 11.63 C ATOM 145 H VAL A 15 14.123 14.592 -7.137 1.00 0.00 H ATOM 146 N LYS A 16 17.908 15.844 -5.409 1.00 11.48 N ATOM 147 CA LYS A 16 18.580 17.076 -5.014 1.00 12.17 C ATOM 148 C LYS A 16 20.000 17.088 -5.583 1.00 12.38 C ATOM 149 O LYS A 16 20.169 16.924 -6.786 1.00 13.84 O ATOM 150 CB LYS A 16 18.560 17.224 -3.490 1.00 14.26 C ATOM 151 CG LYS A 16 17.137 17.467 -2.973 1.00 16.52 C ATOM 152 CD LYS A 16 17.068 17.616 -1.462 1.00 18.68 C ATOM 153 CE LYS A 16 17.785 18.862 -0.981 1.00 20.65 C ATOM 154 NZ LYS A 16 17.136 20.105 -1.488 1.00 19.46 N ATOM 155 HZ1 LYS A 16 17.148 20.102 -2.528 1.00 0.00 H ATOM 156 HZ2 LYS A 16 16.153 20.143 -1.152 1.00 0.00 H ATOM 157 HZ3 LYS A 16 17.656 20.934 -1.137 1.00 0.00 H ATOM 158 H LYS A 16 18.281 14.929 -5.086 1.00 0.00 H ATOM 159 N ASP A 17 21.014 17.276 -4.747 1.00 12.07 N ATOM 160 CA ASP A 17 22.396 17.301 -5.230 1.00 13.42 C ATOM 161 C ASP A 17 22.853 15.953 -5.787 1.00 12.21 C ATOM 162 O ASP A 17 22.359 14.906 -5.377 1.00 11.03 O ATOM 163 CB ASP A 17 23.343 17.690 -4.092 1.00 16.50 C ATOM 164 CG ASP A 17 23.371 19.175 -3.831 1.00 17.04 C ATOM 165 OD1 ASP A 17 22.399 19.872 -4.191 1.00 17.61 O ATOM 166 OD2 ASP A 17 24.372 19.637 -3.248 1.00 19.63 O ATOM 167 H ASP A 17 20.824 17.408 -3.733 1.00 0.00 H ATOM 168 N LYS A 18 23.795 15.983 -6.725 1.00 12.11 N ATOM 169 CA LYS A 18 24.330 14.746 -7.279 1.00 11.28 C ATOM 170 C LYS A 18 25.227 14.148 -6.201 1.00 12.00 C ATOM 171 O LYS A 18 25.826 14.889 -5.415 1.00 11.99 O ATOM 172 CB LYS A 18 25.146 15.016 -8.550 1.00 12.07 C ATOM 173 CG LYS A 18 26.444 15.789 -8.334 1.00 11.61 C ATOM 174 CD LYS A 18 27.168 15.987 -9.662 1.00 12.07 C ATOM 175 CE LYS A 18 28.580 16.524 -9.462 1.00 12.65 C ATOM 176 NZ LYS A 18 29.311 16.615 -10.759 1.00 13.08 N ATOM 177 HZ1 LYS A 18 29.373 15.670 -11.188 1.00 0.00 H ATOM 178 HZ2 LYS A 18 28.800 17.255 -11.400 1.00 0.00 H ATOM 179 HZ3 LYS A 18 30.269 16.984 -10.591 1.00 0.00 H ATOM 180 H LYS A 18 24.153 16.898 -7.066 1.00 0.00 H ATOM 181 N ALA A 19 25.310 12.821 -6.152 1.00 10.67 N ATOM 182 CA ALA A 19 26.136 12.133 -5.154 1.00 12.60 C ATOM 183 C ALA A 19 27.302 11.412 -5.822 1.00 14.22 C ATOM 184 O ALA A 19 28.112 10.762 -5.156 1.00 16.87 O ATOM 185 CB ALA A 19 25.290 11.137 -4.364 1.00 14.22 C ATOM 186 H ALA A 19 24.774 12.255 -6.841 1.00 0.00 H ATOM 187 N LEU A 20 27.358 11.523 -7.144 1.00 12.82 N ATOM 188 CA LEU A 20 28.419 10.934 -7.952 1.00 12.64 C ATOM 189 C LEU A 20 28.873 12.036 -8.896 1.00 12.57 C ATOM 190 O LEU A 20 28.119 12.969 -9.163 1.00 12.06 O ATOM 191 CB LEU A 20 27.892 9.757 -8.783 1.00 13.94 C ATOM 192 CG LEU A 20 27.410 8.504 -8.053 1.00 14.45 C ATOM 193 CD1 LEU A 20 26.935 7.480 -9.065 1.00 13.97 C ATOM 194 CD2 LEU A 20 28.540 7.922 -7.221 1.00 15.42 C ATOM 195 H LEU A 20 26.608 12.057 -7.627 1.00 0.00 H ATOM 196 N LYS A 21 30.095 11.929 -9.406 1.00 12.89 N ATOM 197 CA LYS A 21 30.613 12.928 -10.332 1.00 14.04 C ATOM 198 C LYS A 21 29.747 12.989 -11.589 1.00 14.22 C ATOM 199 O LYS A 21 29.447 14.071 -12.102 1.00 11.69 O ATOM 200 CB LYS A 21 32.055 12.596 -10.732 1.00 15.47 C ATOM 201 CG LYS A 21 33.077 12.694 -9.605 1.00 18.11 C ATOM 202 CD LYS A 21 34.494 12.667 -10.172 1.00 21.80 C ATOM 203 CE LYS A 21 35.552 12.835 -9.088 1.00 23.42 C ATOM 204 NZ LYS A 21 35.649 11.648 -8.183 1.00 28.03 N ATOM 205 HZ1 LYS A 21 34.734 11.496 -7.713 1.00 0.00 H ATOM 206 HZ2 LYS A 21 35.897 10.807 -8.742 1.00 0.00 H ATOM 207 HZ3 LYS A 21 36.383 11.819 -7.467 1.00 0.00 H ATOM 208 H LYS A 21 30.691 11.120 -9.140 1.00 0.00 H ATOM 209 N ASN A 22 29.350 11.818 -12.080 1.00 14.17 N ATOM 210 CA ASN A 22 28.529 11.731 -13.282 1.00 15.83 C ATOM 211 C ASN A 22 27.341 10.798 -13.066 1.00 15.47 C ATOM 212 O ASN A 22 27.391 9.623 -13.420 1.00 14.62 O ATOM 213 CB ASN A 22 29.386 11.237 -14.449 1.00 20.80 C ATOM 214 CG ASN A 22 30.542 12.173 -14.753 1.00 24.11 C ATOM 215 OD1 ASN A 22 30.339 13.306 -15.187 1.00 28.83 O ATOM 216 ND2 ASN A 22 31.760 11.706 -14.514 1.00 28.03 N ATOM 217 HD22 ASN A 22 31.884 10.741 -14.147 1.00 0.00 H ATOM 218 HD21 ASN A 22 32.591 12.305 -14.694 1.00 0.00 H ATOM 219 H ASN A 22 29.632 10.943 -11.594 1.00 0.00 H ATOM 220 N PRO A 23 26.254 11.323 -12.482 1.00 13.88 N ATOM 221 CA PRO A 23 25.041 10.548 -12.209 1.00 13.59 C ATOM 222 C PRO A 23 24.201 10.321 -13.465 1.00 12.56 C ATOM 223 O PRO A 23 24.553 10.784 -14.548 1.00 12.51 O ATOM 224 CB PRO A 23 24.318 11.409 -11.180 1.00 11.17 C ATOM 225 CG PRO A 23 24.627 12.803 -11.668 1.00 12.77 C ATOM 226 CD PRO A 23 26.103 12.722 -12.030 1.00 13.51 C ATOM 227 N GLU A 24 23.094 9.600 -13.310 1.00 12.55 N ATOM 228 CA GLU A 24 22.185 9.328 -14.419 1.00 12.61 C ATOM 229 C GLU A 24 21.516 10.622 -14.888 1.00 13.52 C ATOM 230 O GLU A 24 20.770 11.255 -14.135 1.00 13.78 O ATOM 231 CB GLU A 24 21.106 8.325 -13.982 1.00 13.58 C ATOM 232 CG GLU A 24 19.944 8.178 -14.970 1.00 12.98 C ATOM 233 CD GLU A 24 18.852 7.239 -14.479 1.00 15.32 C ATOM 234 OE1 GLU A 24 18.784 6.969 -13.261 1.00 14.32 O ATOM 235 OE2 GLU A 24 18.046 6.777 -15.315 1.00 17.38 O ATOM 236 H GLU A 24 22.869 9.218 -12.369 1.00 0.00 H ATOM 237 N PRO A 25 21.780 11.040 -16.136 1.00 14.09 N ATOM 238 CA PRO A 25 21.163 12.272 -16.640 1.00 15.98 C ATOM 239 C PRO A 25 19.647 12.101 -16.684 1.00 15.57 C ATOM 240 O PRO A 25 19.147 11.063 -17.123 1.00 14.76 O ATOM 241 CB PRO A 25 21.772 12.420 -18.034 1.00 17.23 C ATOM 242 CG PRO A 25 23.113 11.765 -17.887 1.00 16.66 C ATOM 243 CD PRO A 25 22.789 10.533 -17.082 1.00 15.68 C ATOM 244 N ILE A 26 18.920 13.115 -16.227 1.00 15.66 N ATOM 245 CA ILE A 26 17.466 13.047 -16.210 1.00 15.43 C ATOM 246 C ILE A 26 16.812 14.362 -16.623 1.00 16.07 C ATOM 247 O ILE A 26 17.452 15.414 -16.638 1.00 15.05 O ATOM 248 CB ILE A 26 16.951 12.679 -14.801 1.00 14.33 C ATOM 249 CG1 ILE A 26 17.458 13.703 -13.784 1.00 14.27 C ATOM 250 CG2 ILE A 26 17.415 11.279 -14.419 1.00 14.52 C ATOM 251 CD1 ILE A 26 17.076 13.394 -12.346 1.00 16.97 C ATOM 252 H ILE A 26 19.397 13.970 -15.876 1.00 0.00 H ATOM 253 N SER A 27 15.531 14.287 -16.964 1.00 16.44 N ATOM 254 CA SER A 27 14.776 15.470 -17.350 1.00 17.37 C ATOM 255 C SER A 27 14.122 16.051 -16.100 1.00 17.82 C ATOM 256 O SER A 27 14.082 15.405 -15.056 1.00 15.90 O ATOM 257 CB SER A 27 13.716 15.099 -18.385 1.00 18.50 C ATOM 258 OG SER A 27 12.933 14.012 -17.930 1.00 19.76 O ATOM 259 HG SER A 27 12.482 14.262 -17.085 1.00 0.00 H ATOM 260 H SER A 27 15.056 13.362 -16.955 1.00 0.00 H ATOM 261 N GLU A 28 13.606 17.269 -16.209 1.00 18.81 N ATOM 262 CA GLU A 28 12.971 17.938 -15.078 1.00 18.97 C ATOM 263 C GLU A 28 11.864 17.103 -14.441 1.00 18.08 C ATOM 264 O GLU A 28 11.797 16.985 -13.220 1.00 19.24 O ATOM 265 CB GLU A 28 12.415 19.296 -15.527 1.00 21.46 C ATOM 266 CG GLU A 28 11.799 20.135 -14.418 1.00 23.97 C ATOM 267 CD GLU A 28 12.778 20.438 -13.301 1.00 26.72 C ATOM 268 OE1 GLU A 28 13.945 20.769 -13.606 1.00 26.67 O ATOM 269 OE2 GLU A 28 12.378 20.356 -12.119 1.00 28.03 O ATOM 270 H GLU A 28 13.655 17.760 -17.125 1.00 0.00 H ATOM 271 N ASP A 29 11.005 16.514 -15.265 1.00 17.70 N ATOM 272 CA ASP A 29 9.900 15.705 -14.765 1.00 18.12 C ATOM 273 C ASP A 29 10.346 14.485 -13.957 1.00 17.63 C ATOM 274 O ASP A 29 9.599 13.991 -13.113 1.00 19.34 O ATOM 275 CB ASP A 29 9.018 15.249 -15.930 1.00 22.16 C ATOM 276 CG ASP A 29 9.820 14.626 -17.054 1.00 23.86 C ATOM 277 OD1 ASP A 29 10.602 15.358 -17.697 1.00 27.55 O ATOM 278 OD2 ASP A 29 9.675 13.409 -17.290 1.00 26.35 O ATOM 279 H ASP A 29 11.123 16.633 -16.291 1.00 0.00 H ATOM 280 N MET A 30 11.562 14.008 -14.204 1.00 13.63 N ATOM 281 CA MET A 30 12.077 12.838 -13.502 1.00 12.60 C ATOM 282 C MET A 30 12.665 13.137 -12.129 1.00 12.31 C ATOM 283 O MET A 30 13.005 12.220 -11.379 1.00 12.76 O ATOM 284 CB MET A 30 13.127 12.142 -14.369 1.00 12.03 C ATOM 285 CG MET A 30 12.553 11.541 -15.637 1.00 14.58 C ATOM 286 SD MET A 30 13.849 10.903 -16.698 1.00 15.78 S ATOM 287 CE MET A 30 14.290 9.411 -15.853 1.00 16.97 C ATOM 288 H MET A 30 12.159 14.479 -14.913 1.00 0.00 H ATOM 289 N LYS A 31 12.780 14.418 -11.799 1.00 11.76 N ATOM 290 CA LYS A 31 13.335 14.814 -10.513 1.00 12.18 C ATOM 291 C LYS A 31 12.393 14.537 -9.345 1.00 10.93 C ATOM 292 O LYS A 31 12.827 14.488 -8.198 1.00 10.52 O ATOM 293 CB LYS A 31 13.692 16.300 -10.535 1.00 12.06 C ATOM 294 CG LYS A 31 14.831 16.654 -11.471 1.00 14.62 C ATOM 295 CD LYS A 31 15.110 18.150 -11.436 1.00 19.03 C ATOM 296 CE LYS A 31 16.213 18.527 -12.408 1.00 22.25 C ATOM 297 NZ LYS A 31 16.546 19.982 -12.328 1.00 26.60 N ATOM 298 HZ1 LYS A 31 15.701 20.543 -12.557 1.00 0.00 H ATOM 299 HZ2 LYS A 31 16.865 20.211 -11.365 1.00 0.00 H ATOM 300 HZ3 LYS A 31 17.303 20.201 -13.006 1.00 0.00 H ATOM 301 H LYS A 31 12.469 15.149 -12.470 1.00 0.00 H ATOM 302 N ARG A 32 11.107 14.358 -9.637 1.00 12.62 N ATOM 303 CA ARG A 32 10.112 14.102 -8.597 1.00 12.53 C ATOM 304 C ARG A 32 9.160 12.981 -8.982 1.00 12.32 C ATOM 305 O ARG A 32 8.840 12.796 -10.152 1.00 11.09 O ATOM 306 CB ARG A 32 9.291 15.367 -8.329 1.00 12.57 C ATOM 307 CG ARG A 32 10.113 16.572 -7.937 1.00 16.13 C ATOM 308 CD ARG A 32 9.238 17.809 -7.799 1.00 18.17 C ATOM 309 NE ARG A 32 10.018 18.977 -7.400 1.00 22.41 N ATOM 310 CZ ARG A 32 10.890 19.606 -8.183 1.00 25.01 C ATOM 311 NH1 ARG A 32 11.103 19.190 -9.424 1.00 24.50 N ATOM 312 NH2 ARG A 32 11.557 20.654 -7.717 1.00 28.45 N ATOM 313 HE ARG A 32 9.882 19.343 -6.436 1.00 0.00 H ATOM 314 HH12 ARG A 32 11.787 19.688 -10.029 1.00 0.00 H ATOM 315 HH11 ARG A 32 10.586 18.366 -9.792 1.00 0.00 H ATOM 316 HH22 ARG A 32 12.240 21.149 -8.326 1.00 0.00 H ATOM 317 HH21 ARG A 32 11.397 20.981 -6.743 1.00 0.00 H ATOM 318 H ARG A 32 10.802 14.401 -10.630 1.00 0.00 H ATOM 319 N GLY A 33 8.695 12.242 -7.984 1.00 13.84 N ATOM 320 CA GLY A 33 7.773 11.155 -8.250 1.00 13.66 C ATOM 321 C GLY A 33 7.048 10.704 -7.000 1.00 12.65 C ATOM 322 O GLY A 33 7.470 11.002 -5.885 1.00 12.94 O ATOM 323 H GLY A 33 8.992 12.443 -7.008 1.00 0.00 H ATOM 324 N ARG A 34 5.948 9.983 -7.193 1.00 13.00 N ATOM 325 CA ARG A 34 5.149 9.475 -6.085 1.00 14.01 C ATOM 326 C ARG A 34 4.438 8.200 -6.512 1.00 14.46 C ATOM 327 O ARG A 34 4.019 8.069 -7.664 1.00 13.71 O ATOM 328 CB ARG A 34 4.102 10.512 -5.659 1.00 15.96 C ATOM 329 CG ARG A 34 3.170 10.055 -4.530 1.00 20.49 C ATOM 330 CD ARG A 34 2.052 11.064 -4.282 1.00 21.64 C ATOM 331 NE ARG A 34 0.991 10.527 -3.431 1.00 25.70 N ATOM 332 CZ ARG A 34 1.005 10.536 -2.101 1.00 25.78 C ATOM 333 NH1 ARG A 34 2.028 11.063 -1.447 1.00 27.42 N ATOM 334 NH2 ARG A 34 -0.009 10.011 -1.423 1.00 27.52 N ATOM 335 HE ARG A 34 0.164 10.107 -3.901 1.00 0.00 H ATOM 336 HH12 ARG A 34 2.034 11.067 -0.407 1.00 0.00 H ATOM 337 HH11 ARG A 34 2.826 11.473 -1.973 1.00 0.00 H ATOM 338 HH22 ARG A 34 0.002 10.018 -0.383 1.00 0.00 H ATOM 339 HH21 ARG A 34 -0.814 9.593 -1.932 1.00 0.00 H ATOM 340 H ARG A 34 5.648 9.775 -8.167 1.00 0.00 H ATOM 341 N MET A 35 4.324 7.258 -5.582 1.00 12.27 N ATOM 342 CA MET A 35 3.622 6.005 -5.835 1.00 12.62 C ATOM 343 C MET A 35 2.887 5.655 -4.547 1.00 13.42 C ATOM 344 O MET A 35 3.433 5.818 -3.457 1.00 13.50 O ATOM 345 CB MET A 35 4.601 4.889 -6.216 1.00 12.52 C ATOM 346 CG MET A 35 3.920 3.591 -6.617 1.00 14.32 C ATOM 347 SD MET A 35 5.073 2.341 -7.232 1.00 16.84 S ATOM 348 CE MET A 35 5.019 2.659 -8.975 1.00 17.80 C ATOM 349 H MET A 35 4.748 7.419 -4.646 1.00 0.00 H ATOM 350 N GLU A 36 1.649 5.186 -4.669 1.00 14.94 N ATOM 351 CA GLU A 36 0.856 4.845 -3.489 1.00 16.14 C ATOM 352 C GLU A 36 0.671 3.342 -3.305 1.00 15.58 C ATOM 353 O GLU A 36 0.900 2.575 -4.243 1.00 14.94 O ATOM 354 CB GLU A 36 -0.507 5.527 -3.584 1.00 19.81 C ATOM 355 CG GLU A 36 -0.413 7.037 -3.752 1.00 24.34 C ATOM 356 CD GLU A 36 -1.773 7.692 -3.860 1.00 29.77 C ATOM 357 OE1 GLU A 36 -2.599 7.217 -4.668 1.00 33.03 O ATOM 358 OE2 GLU A 36 -2.016 8.684 -3.141 1.00 33.41 O ATOM 359 H GLU A 36 1.239 5.060 -5.616 1.00 0.00 H ATOM 360 N GLU A 37 0.251 2.938 -2.098 1.00 13.38 N ATOM 361 CA GLU A 37 0.027 1.522 -1.756 1.00 14.81 C ATOM 362 C GLU A 37 1.160 0.740 -2.392 1.00 13.42 C ATOM 363 O GLU A 37 0.950 -0.103 -3.264 1.00 14.96 O ATOM 364 CB GLU A 37 -1.316 1.056 -2.314 1.00 14.28 C ATOM 365 CG GLU A 37 -2.488 1.883 -1.818 1.00 17.39 C ATOM 366 CD GLU A 37 -2.500 2.021 -0.308 1.00 20.50 C ATOM 367 OE1 GLU A 37 -2.300 1.003 0.385 1.00 20.62 O ATOM 368 OE2 GLU A 37 -2.712 3.147 0.184 1.00 24.01 O ATOM 369 H GLU A 37 0.075 3.658 -1.368 1.00 0.00 H ATOM 370 N VAL A 38 2.361 1.000 -1.901 1.00 12.56 N ATOM 371 CA VAL A 38 3.560 0.442 -2.495 1.00 12.06 C ATOM 372 C VAL A 38 4.553 -0.249 -1.572 1.00 11.23 C ATOM 373 O VAL A 38 4.742 0.149 -0.426 1.00 10.87 O ATOM 374 CB VAL A 38 4.292 1.595 -3.219 1.00 11.89 C ATOM 375 CG1 VAL A 38 4.630 2.681 -2.201 1.00 12.30 C ATOM 376 CG2 VAL A 38 5.539 1.102 -3.917 1.00 12.48 C ATOM 377 H VAL A 38 2.447 1.619 -1.070 1.00 0.00 H ATOM 378 N LEU A 39 5.190 -1.292 -2.100 1.00 10.73 N ATOM 379 CA LEU A 39 6.217 -2.008 -1.365 1.00 10.09 C ATOM 380 C LEU A 39 7.505 -1.340 -1.821 1.00 11.66 C ATOM 381 O LEU A 39 7.916 -1.490 -2.975 1.00 10.81 O ATOM 382 CB LEU A 39 6.241 -3.487 -1.756 1.00 11.83 C ATOM 383 CG LEU A 39 7.333 -4.327 -1.087 1.00 9.40 C ATOM 384 CD1 LEU A 39 7.112 -4.355 0.414 1.00 13.55 C ATOM 385 CD2 LEU A 39 7.300 -5.745 -1.651 1.00 10.93 C ATOM 386 H LEU A 39 4.946 -1.601 -3.062 1.00 0.00 H ATOM 387 N VAL A 40 8.124 -0.574 -0.932 1.00 10.07 N ATOM 388 CA VAL A 40 9.360 0.114 -1.280 1.00 10.61 C ATOM 389 C VAL A 40 10.561 -0.779 -1.020 1.00 10.06 C ATOM 390 O VAL A 40 10.753 -1.256 0.092 1.00 10.17 O ATOM 391 CB VAL A 40 9.532 1.418 -0.460 1.00 11.08 C ATOM 392 CG1 VAL A 40 10.766 2.176 -0.951 1.00 10.87 C ATOM 393 CG2 VAL A 40 8.286 2.293 -0.602 1.00 13.00 C ATOM 394 H VAL A 40 7.723 -0.464 0.021 1.00 0.00 H ATOM 395 N ALA A 41 11.355 -1.007 -2.060 1.00 11.06 N ATOM 396 CA ALA A 41 12.547 -1.825 -1.939 1.00 12.28 C ATOM 397 C ALA A 41 13.782 -0.933 -1.938 1.00 11.82 C ATOM 398 O ALA A 41 14.255 -0.495 -2.991 1.00 12.57 O ATOM 399 CB ALA A 41 12.621 -2.832 -3.092 1.00 12.28 C ATOM 400 H ALA A 41 11.117 -0.590 -2.982 1.00 0.00 H ATOM 401 N PHE A 42 14.281 -0.648 -0.743 1.00 10.73 N ATOM 402 CA PHE A 42 15.478 0.159 -0.576 1.00 11.24 C ATOM 403 C PHE A 42 16.606 -0.826 -0.833 1.00 12.43 C ATOM 404 O PHE A 42 16.730 -1.821 -0.125 1.00 12.75 O ATOM 405 CB PHE A 42 15.538 0.706 0.852 1.00 11.21 C ATOM 406 CG PHE A 42 14.527 1.782 1.132 1.00 11.34 C ATOM 407 CD1 PHE A 42 14.685 3.056 0.594 1.00 11.61 C ATOM 408 CD2 PHE A 42 13.416 1.524 1.930 1.00 14.15 C ATOM 409 CE1 PHE A 42 13.757 4.058 0.849 1.00 11.91 C ATOM 410 CE2 PHE A 42 12.475 2.523 2.192 1.00 13.79 C ATOM 411 CZ PHE A 42 12.648 3.795 1.651 1.00 12.10 C ATOM 412 H PHE A 42 13.800 -1.014 0.103 1.00 0.00 H ATOM 413 N ILE A 43 17.418 -0.560 -1.852 1.00 11.91 N ATOM 414 CA ILE A 43 18.481 -1.488 -2.215 1.00 12.07 C ATOM 415 C ILE A 43 19.888 -0.926 -2.277 1.00 14.13 C ATOM 416 O ILE A 43 20.115 0.182 -2.758 1.00 12.15 O ATOM 417 CB ILE A 43 18.179 -2.136 -3.590 1.00 12.53 C ATOM 418 CG1 ILE A 43 16.853 -2.891 -3.522 1.00 10.48 C ATOM 419 CG2 ILE A 43 19.319 -3.073 -4.005 1.00 12.13 C ATOM 420 CD1 ILE A 43 16.421 -3.490 -4.854 1.00 10.91 C ATOM 421 H ILE A 43 17.293 0.318 -2.395 1.00 0.00 H ATOM 422 N SER A 44 20.830 -1.719 -1.776 1.00 14.53 N ATOM 423 CA SER A 44 22.238 -1.374 -1.810 1.00 15.76 C ATOM 424 C SER A 44 22.914 -2.555 -2.494 1.00 14.61 C ATOM 425 O SER A 44 22.826 -3.685 -2.016 1.00 14.32 O ATOM 426 CB SER A 44 22.801 -1.202 -0.399 1.00 17.98 C ATOM 427 OG SER A 44 24.188 -0.910 -0.459 1.00 21.38 O ATOM 428 HG SER A 44 24.541 -0.801 0.459 1.00 0.00 H ATOM 429 H SER A 44 20.546 -2.621 -1.343 1.00 0.00 H ATOM 430 N VAL A 45 23.560 -2.299 -3.626 1.00 14.53 N ATOM 431 CA VAL A 45 24.246 -3.353 -4.357 1.00 15.03 C ATOM 432 C VAL A 45 25.662 -3.474 -3.802 1.00 17.63 C ATOM 433 O VAL A 45 26.384 -2.483 -3.702 1.00 18.07 O ATOM 434 CB VAL A 45 24.296 -3.037 -5.861 1.00 15.67 C ATOM 435 CG1 VAL A 45 24.859 -4.218 -6.623 1.00 15.24 C ATOM 436 CG2 VAL A 45 22.899 -2.700 -6.356 1.00 14.86 C ATOM 437 H VAL A 45 23.576 -1.327 -3.996 1.00 0.00 H ATOM 438 N GLU A 46 26.055 -4.694 -3.450 1.00 18.13 N ATOM 439 CA GLU A 46 27.369 -4.931 -2.863 1.00 19.95 C ATOM 440 C GLU A 46 28.462 -5.386 -3.824 1.00 19.98 C ATOM 441 O GLU A 46 28.188 -5.950 -4.883 1.00 20.20 O ATOM 442 CB GLU A 46 27.224 -5.927 -1.711 1.00 19.83 C ATOM 443 CG GLU A 46 26.308 -5.413 -0.610 1.00 20.78 C ATOM 444 CD GLU A 46 26.111 -6.412 0.510 1.00 24.02 C ATOM 445 OE1 GLU A 46 25.485 -7.464 0.265 1.00 21.51 O ATOM 446 OE2 GLU A 46 26.587 -6.139 1.634 1.00 25.94 O ATOM 447 H GLU A 46 25.411 -5.498 -3.596 1.00 0.00 H ATOM 448 N LYS A 47 29.709 -5.126 -3.436 1.00 21.07 N ATOM 449 CA LYS A 47 30.872 -5.481 -4.239 1.00 21.25 C ATOM 450 C LYS A 47 30.861 -6.940 -4.683 1.00 20.42 C ATOM 451 O LYS A 47 31.235 -7.253 -5.812 1.00 21.12 O ATOM 452 CB LYS A 47 32.155 -5.189 -3.453 1.00 22.39 C ATOM 453 CG LYS A 47 33.439 -5.624 -4.156 1.00 23.95 C ATOM 454 CD LYS A 47 33.659 -4.884 -5.471 1.00 24.02 C ATOM 455 CE LYS A 47 33.869 -3.391 -5.252 1.00 22.93 C ATOM 456 NZ LYS A 47 34.158 -2.671 -6.526 1.00 22.22 N ATOM 457 HZ1 LYS A 47 35.022 -3.060 -6.955 1.00 0.00 H ATOM 458 HZ2 LYS A 47 33.359 -2.793 -7.181 1.00 0.00 H ATOM 459 HZ3 LYS A 47 34.294 -1.659 -6.328 1.00 0.00 H ATOM 460 H LYS A 47 29.859 -4.651 -2.523 1.00 0.00 H ATOM 461 N VAL A 48 30.432 -7.830 -3.797 1.00 20.96 N ATOM 462 CA VAL A 48 30.389 -9.248 -4.124 1.00 22.60 C ATOM 463 C VAL A 48 29.391 -9.533 -5.242 1.00 22.17 C ATOM 464 O VAL A 48 29.530 -10.518 -5.967 1.00 22.70 O ATOM 465 CB VAL A 48 30.021 -10.103 -2.887 1.00 24.30 C ATOM 466 CG1 VAL A 48 28.603 -9.787 -2.428 1.00 24.34 C ATOM 467 CG2 VAL A 48 30.170 -11.581 -3.219 1.00 25.88 C ATOM 468 H VAL A 48 30.123 -7.510 -2.857 1.00 0.00 H ATOM 469 N ASP A 49 28.391 -8.666 -5.387 1.00 21.06 N ATOM 470 CA ASP A 49 27.382 -8.850 -6.425 1.00 19.70 C ATOM 471 C ASP A 49 27.983 -8.708 -7.819 1.00 19.48 C ATOM 472 O ASP A 49 27.461 -9.260 -8.787 1.00 18.91 O ATOM 473 CB ASP A 49 26.236 -7.845 -6.254 1.00 19.31 C ATOM 474 CG ASP A 49 25.527 -7.985 -4.918 1.00 20.53 C ATOM 475 OD1 ASP A 49 25.465 -9.115 -4.391 1.00 20.58 O ATOM 476 OD2 ASP A 49 25.015 -6.970 -4.397 1.00 20.91 O ATOM 477 H ASP A 49 28.328 -7.845 -4.751 1.00 0.00 H ATOM 478 N GLU A 50 29.082 -7.966 -7.916 1.00 21.02 N ATOM 479 CA GLU A 50 29.749 -7.750 -9.194 1.00 22.66 C ATOM 480 C GLU A 50 30.191 -9.049 -9.865 1.00 23.94 C ATOM 481 O GLU A 50 30.408 -9.084 -11.075 1.00 24.35 O ATOM 482 CB GLU A 50 30.959 -6.828 -9.004 1.00 23.25 C ATOM 483 CG GLU A 50 30.593 -5.367 -8.784 1.00 23.68 C ATOM 484 CD GLU A 50 31.807 -4.457 -8.731 1.00 24.72 C ATOM 485 OE1 GLU A 50 32.727 -4.643 -9.557 1.00 25.39 O ATOM 486 OE2 GLU A 50 31.835 -3.550 -7.873 1.00 24.18 O ATOM 487 H GLU A 50 29.476 -7.529 -7.058 1.00 0.00 H ATOM 488 N LYS A 51 30.312 -10.113 -9.078 1.00 25.86 N ATOM 489 CA LYS A 51 30.735 -11.409 -9.599 1.00 26.49 C ATOM 490 C LYS A 51 29.680 -12.049 -10.494 1.00 27.97 C ATOM 491 O LYS A 51 30.009 -12.683 -11.501 1.00 27.82 O ATOM 492 CB LYS A 51 31.075 -12.346 -8.445 1.00 28.48 C ATOM 493 H LYS A 51 30.100 -10.020 -8.064 1.00 0.00 H ATOM 494 N ASN A 52 28.412 -11.886 -10.132 1.00 27.15 N ATOM 495 CA ASN A 52 27.333 -12.471 -10.915 1.00 27.37 C ATOM 496 C ASN A 52 26.077 -11.605 -10.851 1.00 26.94 C ATOM 497 O ASN A 52 25.153 -11.888 -10.087 1.00 25.61 O ATOM 498 CB ASN A 52 27.019 -13.874 -10.395 1.00 28.72 C ATOM 499 CG ASN A 52 26.242 -14.702 -11.391 1.00 29.96 C ATOM 500 OD1 ASN A 52 25.320 -14.213 -12.042 1.00 30.23 O ATOM 501 ND2 ASN A 52 26.604 -15.974 -11.508 1.00 31.68 N ATOM 502 HD22 ASN A 52 27.390 -16.346 -10.937 1.00 0.00 H ATOM 503 HD21 ASN A 52 26.102 -16.599 -12.170 1.00 0.00 H ATOM 504 H ASN A 52 28.188 -11.334 -9.279 1.00 0.00 H ATOM 505 N PRO A 53 26.031 -10.533 -11.658 1.00 26.03 N ATOM 506 CA PRO A 53 24.884 -9.619 -11.693 1.00 26.60 C ATOM 507 C PRO A 53 23.555 -10.318 -11.981 1.00 25.78 C ATOM 508 O PRO A 53 22.548 -10.048 -11.327 1.00 27.14 O ATOM 509 CB PRO A 53 25.263 -8.636 -12.797 1.00 26.14 C ATOM 510 CG PRO A 53 26.760 -8.589 -12.704 1.00 26.60 C ATOM 511 CD PRO A 53 27.109 -10.053 -12.541 1.00 26.54 C ATOM 512 N GLU A 54 23.557 -11.213 -12.963 1.00 26.19 N ATOM 513 CA GLU A 54 22.348 -11.935 -13.340 1.00 26.38 C ATOM 514 C GLU A 54 21.784 -12.792 -12.212 1.00 25.82 C ATOM 515 O GLU A 54 20.573 -12.815 -11.994 1.00 23.68 O ATOM 516 CB GLU A 54 22.610 -12.812 -14.569 1.00 28.54 C ATOM 517 CG GLU A 54 23.052 -12.035 -15.803 1.00 31.27 C ATOM 518 CD GLU A 54 24.554 -11.789 -15.850 1.00 32.37 C ATOM 519 OE1 GLU A 54 25.199 -11.747 -14.781 1.00 33.28 O ATOM 520 OE2 GLU A 54 25.088 -11.622 -16.966 1.00 32.99 O ATOM 521 H GLU A 54 24.442 -11.403 -13.475 1.00 0.00 H ATOM 522 N GLU A 55 22.661 -13.494 -11.498 1.00 25.51 N ATOM 523 CA GLU A 55 22.238 -14.359 -10.400 1.00 25.34 C ATOM 524 C GLU A 55 21.614 -13.564 -9.260 1.00 23.63 C ATOM 525 O GLU A 55 20.517 -13.879 -8.801 1.00 22.88 O ATOM 526 CB GLU A 55 23.426 -15.155 -9.858 1.00 27.49 C ATOM 527 CG GLU A 55 23.044 -16.196 -8.817 1.00 30.28 C ATOM 528 CD GLU A 55 24.246 -16.738 -8.067 1.00 32.95 C ATOM 529 OE1 GLU A 55 25.266 -17.042 -8.716 1.00 35.61 O ATOM 530 OE2 GLU A 55 24.166 -16.869 -6.829 1.00 35.40 O ATOM 531 H GLU A 55 23.673 -13.425 -11.728 1.00 0.00 H ATOM 532 N VAL A 56 22.325 -12.539 -8.801 1.00 23.59 N ATOM 533 CA VAL A 56 21.844 -11.695 -7.713 1.00 22.30 C ATOM 534 C VAL A 56 20.532 -11.007 -8.086 1.00 20.62 C ATOM 535 O VAL A 56 19.599 -10.945 -7.282 1.00 17.54 O ATOM 536 CB VAL A 56 22.879 -10.611 -7.352 1.00 24.06 C ATOM 537 CG1 VAL A 56 22.340 -9.726 -6.241 1.00 26.39 C ATOM 538 CG2 VAL A 56 24.180 -11.264 -6.916 1.00 26.52 C ATOM 539 H VAL A 56 23.250 -12.333 -9.230 1.00 0.00 H ATOM 540 N SER A 57 20.467 -10.480 -9.304 1.00 18.62 N ATOM 541 CA SER A 57 19.263 -9.803 -9.766 1.00 18.63 C ATOM 542 C SER A 57 18.089 -10.780 -9.778 1.00 18.67 C ATOM 543 O SER A 57 17.017 -10.483 -9.249 1.00 17.53 O ATOM 544 CB SER A 57 19.487 -9.218 -11.163 1.00 18.89 C ATOM 545 OG SER A 57 20.494 -8.220 -11.133 1.00 17.78 O ATOM 546 HG SER A 57 21.342 -8.618 -10.812 1.00 0.00 H ATOM 547 H SER A 57 21.289 -10.552 -9.937 1.00 0.00 H ATOM 548 N LEU A 58 18.298 -11.956 -10.366 1.00 17.54 N ATOM 549 CA LEU A 58 17.243 -12.965 -10.423 1.00 18.94 C ATOM 550 C LEU A 58 16.711 -13.306 -9.036 1.00 17.57 C ATOM 551 O LEU A 58 15.497 -13.353 -8.820 1.00 14.68 O ATOM 552 CB LEU A 58 17.757 -14.243 -11.089 1.00 21.20 C ATOM 553 CG LEU A 58 17.931 -14.210 -12.604 1.00 24.45 C ATOM 554 CD1 LEU A 58 18.444 -15.565 -13.085 1.00 27.12 C ATOM 555 CD2 LEU A 58 16.596 -13.878 -13.266 1.00 25.79 C ATOM 556 H LEU A 58 19.225 -12.159 -10.791 1.00 0.00 H ATOM 557 N LYS A 59 17.625 -13.550 -8.103 1.00 18.44 N ATOM 558 CA LYS A 59 17.254 -13.889 -6.736 1.00 18.84 C ATOM 559 C LYS A 59 16.503 -12.737 -6.072 1.00 17.17 C ATOM 560 O LYS A 59 15.549 -12.957 -5.326 1.00 17.83 O ATOM 561 CB LYS A 59 18.500 -14.209 -5.907 1.00 20.84 C ATOM 562 CG LYS A 59 19.258 -15.456 -6.329 1.00 24.87 C ATOM 563 CD LYS A 59 20.484 -15.650 -5.442 1.00 27.08 C ATOM 564 CE LYS A 59 21.147 -16.994 -5.687 1.00 28.57 C ATOM 565 NZ LYS A 59 22.313 -17.195 -4.786 1.00 27.98 N ATOM 566 HZ1 LYS A 59 23.013 -16.445 -4.955 1.00 0.00 H ATOM 567 HZ2 LYS A 59 21.995 -17.158 -3.796 1.00 0.00 H ATOM 568 HZ3 LYS A 59 22.743 -18.122 -4.979 1.00 0.00 H ATOM 569 H LYS A 59 18.632 -13.498 -8.356 1.00 0.00 H ATOM 570 N ALA A 60 16.944 -11.512 -6.338 1.00 16.53 N ATOM 571 CA ALA A 60 16.308 -10.334 -5.750 1.00 16.15 C ATOM 572 C ALA A 60 14.885 -10.191 -6.276 1.00 15.46 C ATOM 573 O ALA A 60 13.967 -9.885 -5.522 1.00 14.75 O ATOM 574 CB ALA A 60 17.115 -9.084 -6.070 1.00 16.38 C ATOM 575 H ALA A 60 17.756 -11.389 -6.976 1.00 0.00 H ATOM 576 N ILE A 61 14.711 -10.415 -7.574 1.00 13.39 N ATOM 577 CA ILE A 61 13.392 -10.322 -8.192 1.00 13.94 C ATOM 578 C ILE A 61 12.472 -11.359 -7.555 1.00 14.77 C ATOM 579 O ILE A 61 11.321 -11.073 -7.225 1.00 13.84 O ATOM 580 CB ILE A 61 13.484 -10.587 -9.711 1.00 13.85 C ATOM 581 CG1 ILE A 61 14.290 -9.465 -10.373 1.00 13.63 C ATOM 582 CG2 ILE A 61 12.088 -10.705 -10.315 1.00 13.40 C ATOM 583 CD1 ILE A 61 14.796 -9.796 -11.770 1.00 12.96 C ATOM 584 H ILE A 61 15.532 -10.662 -8.162 1.00 0.00 H ATOM 585 N GLU A 62 12.995 -12.566 -7.373 1.00 15.24 N ATOM 586 CA GLU A 62 12.213 -13.641 -6.782 1.00 17.33 C ATOM 587 C GLU A 62 11.776 -13.318 -5.355 1.00 14.98 C ATOM 588 O GLU A 62 10.606 -13.475 -5.008 1.00 14.51 O ATOM 589 CB GLU A 62 13.024 -14.941 -6.798 1.00 20.08 C ATOM 590 CG GLU A 62 12.325 -16.145 -6.175 1.00 27.81 C ATOM 591 CD GLU A 62 11.024 -16.508 -6.869 1.00 31.44 C ATOM 592 OE1 GLU A 62 10.949 -16.392 -8.112 1.00 34.63 O ATOM 593 OE2 GLU A 62 10.077 -16.929 -6.168 1.00 35.97 O ATOM 594 H GLU A 62 13.979 -12.746 -7.657 1.00 0.00 H ATOM 595 N GLU A 63 12.713 -12.857 -4.533 1.00 14.18 N ATOM 596 CA GLU A 63 12.410 -12.543 -3.144 1.00 16.19 C ATOM 597 C GLU A 63 11.487 -11.344 -2.966 1.00 15.46 C ATOM 598 O GLU A 63 10.580 -11.366 -2.131 1.00 16.09 O ATOM 599 CB GLU A 63 13.701 -12.308 -2.364 1.00 18.88 C ATOM 600 CG GLU A 63 13.476 -12.114 -0.882 1.00 22.30 C ATOM 601 CD GLU A 63 12.702 -13.264 -0.269 1.00 25.60 C ATOM 602 OE1 GLU A 63 13.118 -14.427 -0.458 1.00 24.98 O ATOM 603 OE2 GLU A 63 11.680 -13.002 0.399 1.00 25.85 O ATOM 604 H GLU A 63 13.680 -12.718 -4.888 1.00 0.00 H ATOM 605 N ILE A 64 11.718 -10.294 -3.739 1.00 14.55 N ATOM 606 CA ILE A 64 10.879 -9.112 -3.628 1.00 13.95 C ATOM 607 C ILE A 64 9.468 -9.439 -4.102 1.00 14.83 C ATOM 608 O ILE A 64 8.485 -8.983 -3.514 1.00 13.81 O ATOM 609 CB ILE A 64 11.466 -7.943 -4.443 1.00 12.89 C ATOM 610 CG1 ILE A 64 12.811 -7.527 -3.831 1.00 11.68 C ATOM 611 CG2 ILE A 64 10.495 -6.767 -4.446 1.00 13.18 C ATOM 612 CD1 ILE A 64 13.603 -6.536 -4.665 1.00 9.33 C ATOM 613 H ILE A 64 12.499 -10.315 -4.425 1.00 0.00 H ATOM 614 N SER A 65 9.366 -10.236 -5.161 1.00 15.02 N ATOM 615 CA SER A 65 8.057 -10.628 -5.676 1.00 15.40 C ATOM 616 C SER A 65 7.318 -11.441 -4.617 1.00 14.34 C ATOM 617 O SER A 65 6.118 -11.273 -4.420 1.00 14.92 O ATOM 618 CB SER A 65 8.199 -11.465 -6.954 1.00 14.93 C ATOM 619 OG SER A 65 8.635 -10.676 -8.047 1.00 17.95 O ATOM 620 HG SER A 65 9.516 -10.277 -7.834 1.00 0.00 H ATOM 621 H SER A 65 10.228 -10.584 -5.628 1.00 0.00 H ATOM 622 N LYS A 66 8.049 -12.318 -3.936 1.00 14.90 N ATOM 623 CA LYS A 66 7.465 -13.161 -2.900 1.00 14.34 C ATOM 624 C LYS A 66 6.818 -12.309 -1.817 1.00 13.87 C ATOM 625 O LYS A 66 5.669 -12.544 -1.437 1.00 15.36 O ATOM 626 CB LYS A 66 8.535 -14.066 -2.288 1.00 15.09 C ATOM 627 H LYS A 66 9.063 -12.405 -4.148 1.00 0.00 H ATOM 628 N VAL A 67 7.557 -11.321 -1.322 1.00 13.05 N ATOM 629 CA VAL A 67 7.047 -10.436 -0.282 1.00 13.05 C ATOM 630 C VAL A 67 5.848 -9.629 -0.773 1.00 13.04 C ATOM 631 O VAL A 67 4.866 -9.459 -0.048 1.00 13.74 O ATOM 632 CB VAL A 67 8.150 -9.466 0.213 1.00 13.65 C ATOM 633 CG1 VAL A 67 7.556 -8.420 1.133 1.00 11.05 C ATOM 634 CG2 VAL A 67 9.240 -10.252 0.946 1.00 15.00 C ATOM 635 H VAL A 67 8.521 -11.176 -1.685 1.00 0.00 H ATOM 636 N ALA A 68 5.927 -9.136 -2.006 1.00 12.31 N ATOM 637 CA ALA A 68 4.835 -8.356 -2.578 1.00 14.72 C ATOM 638 C ALA A 68 3.537 -9.160 -2.543 1.00 16.15 C ATOM 639 O ALA A 68 2.478 -8.638 -2.204 1.00 15.24 O ATOM 640 CB ALA A 68 5.170 -7.959 -4.004 1.00 14.18 C ATOM 641 H ALA A 68 6.782 -9.310 -2.572 1.00 0.00 H ATOM 642 N GLU A 69 3.621 -10.437 -2.895 1.00 17.33 N ATOM 643 CA GLU A 69 2.437 -11.285 -2.881 1.00 20.49 C ATOM 644 C GLU A 69 1.942 -11.507 -1.455 1.00 19.48 C ATOM 645 O GLU A 69 0.739 -11.455 -1.192 1.00 20.62 O ATOM 646 CB GLU A 69 2.741 -12.631 -3.541 1.00 22.89 C ATOM 647 CG GLU A 69 2.945 -12.544 -5.042 1.00 29.60 C ATOM 648 CD GLU A 69 1.718 -12.012 -5.758 1.00 33.18 C ATOM 649 OE1 GLU A 69 0.632 -12.612 -5.599 1.00 35.15 O ATOM 650 OE2 GLU A 69 1.838 -10.997 -6.477 1.00 34.77 O ATOM 651 H GLU A 69 4.538 -10.835 -3.183 1.00 0.00 H ATOM 652 N GLN A 70 2.873 -11.743 -0.534 1.00 20.04 N ATOM 653 CA GLN A 70 2.523 -11.980 0.866 1.00 19.78 C ATOM 654 C GLN A 70 1.752 -10.813 1.473 1.00 19.13 C ATOM 655 O GLN A 70 0.787 -11.015 2.210 1.00 17.50 O ATOM 656 CB GLN A 70 3.780 -12.225 1.710 1.00 21.99 C ATOM 657 CG GLN A 70 4.710 -13.301 1.189 1.00 27.42 C ATOM 658 CD GLN A 70 5.957 -13.466 2.053 1.00 30.03 C ATOM 659 OE1 GLN A 70 6.954 -14.053 1.622 1.00 31.65 O ATOM 660 NE2 GLN A 70 5.899 -12.958 3.279 1.00 28.91 N ATOM 661 HE22 GLN A 70 5.038 -12.471 3.600 1.00 0.00 H ATOM 662 HE21 GLN A 70 6.715 -13.047 3.918 1.00 0.00 H ATOM 663 H GLN A 70 3.874 -11.759 -0.817 1.00 0.00 H ATOM 664 N VAL A 71 2.180 -9.591 1.170 1.00 16.68 N ATOM 665 CA VAL A 71 1.519 -8.413 1.716 1.00 17.69 C ATOM 666 C VAL A 71 0.455 -7.862 0.777 1.00 16.59 C ATOM 667 O VAL A 71 -0.213 -6.881 1.091 1.00 16.28 O ATOM 668 CB VAL A 71 2.539 -7.293 2.042 1.00 18.35 C ATOM 669 CG1 VAL A 71 3.568 -7.816 3.029 1.00 16.78 C ATOM 670 CG2 VAL A 71 3.220 -6.801 0.766 1.00 17.65 C ATOM 671 H VAL A 71 2.996 -9.475 0.536 1.00 0.00 H ATOM 672 N LYS A 72 0.304 -8.506 -0.375 1.00 16.70 N ATOM 673 CA LYS A 72 -0.686 -8.101 -1.365 1.00 17.20 C ATOM 674 C LYS A 72 -0.397 -6.719 -1.949 1.00 17.55 C ATOM 675 O LYS A 72 -1.299 -5.893 -2.088 1.00 18.09 O ATOM 676 CB LYS A 72 -2.078 -8.129 -0.744 1.00 19.10 C ATOM 677 H LYS A 72 0.912 -9.325 -0.577 1.00 0.00 H ATOM 678 N ALA A 73 0.867 -6.469 -2.281 1.00 17.11 N ATOM 679 CA ALA A 73 1.258 -5.195 -2.871 1.00 16.78 C ATOM 680 C ALA A 73 1.288 -5.360 -4.388 1.00 16.46 C ATOM 681 O ALA A 73 1.899 -6.299 -4.903 1.00 15.19 O ATOM 682 CB ALA A 73 2.636 -4.773 -2.358 1.00 17.96 C ATOM 683 H ALA A 73 1.591 -7.198 -2.116 1.00 0.00 H ATOM 684 N GLU A 74 0.614 -4.456 -5.096 1.00 13.36 N ATOM 685 CA GLU A 74 0.566 -4.501 -6.556 1.00 14.01 C ATOM 686 C GLU A 74 1.581 -3.539 -7.151 1.00 13.00 C ATOM 687 O GLU A 74 1.941 -3.646 -8.323 1.00 11.72 O ATOM 688 CB GLU A 74 -0.817 -4.098 -7.062 1.00 15.73 C ATOM 689 CG GLU A 74 -1.952 -4.994 -6.614 1.00 18.76 C ATOM 690 CD GLU A 74 -3.279 -4.551 -7.198 1.00 20.83 C ATOM 691 OE1 GLU A 74 -3.745 -3.443 -6.851 1.00 24.28 O ATOM 692 OE2 GLU A 74 -3.849 -5.306 -8.008 1.00 24.25 O ATOM 693 H GLU A 74 0.108 -3.697 -4.596 1.00 0.00 H ATOM 694 N ASN A 75 2.024 -2.599 -6.324 1.00 11.59 N ATOM 695 CA ASN A 75 2.977 -1.572 -6.724 1.00 10.01 C ATOM 696 C ASN A 75 4.287 -1.790 -5.980 1.00 10.37 C ATOM 697 O ASN A 75 4.279 -2.065 -4.783 1.00 10.31 O ATOM 698 CB ASN A 75 2.408 -0.196 -6.359 1.00 11.00 C ATOM 699 CG ASN A 75 0.967 -0.034 -6.799 1.00 15.87 C ATOM 700 OD1 ASN A 75 0.104 0.389 -6.017 1.00 18.94 O ATOM 701 ND2 ASN A 75 0.695 -0.371 -8.051 1.00 11.87 N ATOM 702 HD22 ASN A 75 1.452 -0.722 -8.671 1.00 0.00 H ATOM 703 HD21 ASN A 75 -0.276 -0.285 -8.413 1.00 0.00 H ATOM 704 H ASN A 75 1.674 -2.596 -5.345 1.00 0.00 H ATOM 705 N VAL A 76 5.404 -1.647 -6.685 1.00 9.94 N ATOM 706 CA VAL A 76 6.725 -1.829 -6.088 1.00 10.14 C ATOM 707 C VAL A 76 7.628 -0.691 -6.545 1.00 10.66 C ATOM 708 O VAL A 76 7.600 -0.315 -7.713 1.00 10.67 O ATOM 709 CB VAL A 76 7.360 -3.170 -6.537 1.00 9.47 C ATOM 710 CG1 VAL A 76 8.763 -3.304 -5.957 1.00 11.40 C ATOM 711 CG2 VAL A 76 6.491 -4.334 -6.077 1.00 13.06 C ATOM 712 H VAL A 76 5.336 -1.398 -7.692 1.00 0.00 H ATOM 713 N PHE A 77 8.418 -0.138 -5.627 1.00 8.67 N ATOM 714 CA PHE A 77 9.320 0.954 -5.980 1.00 9.75 C ATOM 715 C PHE A 77 10.772 0.590 -5.678 1.00 10.39 C ATOM 716 O PHE A 77 11.108 0.265 -4.544 1.00 11.35 O ATOM 717 CB PHE A 77 8.950 2.225 -5.212 1.00 11.87 C ATOM 718 CG PHE A 77 9.527 3.477 -5.812 1.00 10.29 C ATOM 719 CD1 PHE A 77 8.843 4.161 -6.807 1.00 12.43 C ATOM 720 CD2 PHE A 77 10.784 3.930 -5.429 1.00 13.91 C ATOM 721 CE1 PHE A 77 9.403 5.283 -7.421 1.00 13.81 C ATOM 722 CE2 PHE A 77 11.357 5.049 -6.035 1.00 13.22 C ATOM 723 CZ PHE A 77 10.666 5.726 -7.034 1.00 12.83 C ATOM 724 H PHE A 77 8.392 -0.488 -4.648 1.00 0.00 H ATOM 725 N VAL A 78 11.628 0.644 -6.697 1.00 10.29 N ATOM 726 CA VAL A 78 13.049 0.331 -6.528 1.00 10.33 C ATOM 727 C VAL A 78 13.749 1.627 -6.147 1.00 12.14 C ATOM 728 O VAL A 78 13.860 2.558 -6.953 1.00 10.89 O ATOM 729 CB VAL A 78 13.648 -0.234 -7.821 1.00 9.23 C ATOM 730 CG1 VAL A 78 15.129 -0.521 -7.632 1.00 10.67 C ATOM 731 CG2 VAL A 78 12.906 -1.507 -8.207 1.00 11.21 C ATOM 732 H VAL A 78 11.278 0.916 -7.638 1.00 0.00 H ATOM 733 N TYR A 79 14.231 1.672 -4.912 1.00 10.16 N ATOM 734 CA TYR A 79 14.861 2.873 -4.387 1.00 11.99 C ATOM 735 C TYR A 79 16.340 2.709 -4.055 1.00 11.89 C ATOM 736 O TYR A 79 16.698 1.994 -3.118 1.00 12.12 O ATOM 737 CB TYR A 79 14.095 3.310 -3.133 1.00 11.37 C ATOM 738 CG TYR A 79 14.328 4.742 -2.710 1.00 11.54 C ATOM 739 CD1 TYR A 79 13.336 5.704 -2.886 1.00 13.02 C ATOM 740 CD2 TYR A 79 15.539 5.138 -2.144 1.00 12.55 C ATOM 741 CE1 TYR A 79 13.543 7.033 -2.508 1.00 14.50 C ATOM 742 CE2 TYR A 79 15.759 6.462 -1.760 1.00 12.89 C ATOM 743 CZ TYR A 79 14.754 7.402 -1.948 1.00 12.71 C ATOM 744 OH TYR A 79 14.964 8.716 -1.596 1.00 13.32 O ATOM 745 HH TYR A 79 15.163 8.769 -0.628 1.00 0.00 H ATOM 746 H TYR A 79 14.157 0.830 -4.306 1.00 0.00 H ATOM 747 N PRO A 80 17.226 3.372 -4.823 1.00 12.10 N ATOM 748 CA PRO A 80 18.662 3.265 -4.553 1.00 13.07 C ATOM 749 C PRO A 80 18.936 3.782 -3.140 1.00 13.65 C ATOM 750 O PRO A 80 18.611 4.926 -2.818 1.00 13.05 O ATOM 751 CB PRO A 80 19.286 4.160 -5.625 1.00 14.18 C ATOM 752 CG PRO A 80 18.292 4.095 -6.751 1.00 14.59 C ATOM 753 CD PRO A 80 16.974 4.198 -6.017 1.00 13.76 C ATOM 754 N PHE A 81 19.529 2.934 -2.304 1.00 14.36 N ATOM 755 CA PHE A 81 19.823 3.282 -0.918 1.00 16.06 C ATOM 756 C PHE A 81 21.182 2.666 -0.583 1.00 18.30 C ATOM 757 O PHE A 81 21.261 1.646 0.100 1.00 17.83 O ATOM 758 CB PHE A 81 18.738 2.685 -0.013 1.00 17.58 C ATOM 759 CG PHE A 81 18.434 3.504 1.207 1.00 19.35 C ATOM 760 CD1 PHE A 81 17.658 4.652 1.112 1.00 19.95 C ATOM 761 CD2 PHE A 81 18.907 3.117 2.456 1.00 23.17 C ATOM 762 CE1 PHE A 81 17.353 5.402 2.241 1.00 20.28 C ATOM 763 CE2 PHE A 81 18.608 3.862 3.594 1.00 23.78 C ATOM 764 CZ PHE A 81 17.829 5.006 3.486 1.00 24.19 C ATOM 765 H PHE A 81 19.792 1.990 -2.651 1.00 0.00 H ATOM 766 N ALA A 82 22.247 3.298 -1.067 1.00 18.43 N ATOM 767 CA ALA A 82 23.605 2.802 -0.877 1.00 21.96 C ATOM 768 C ALA A 82 24.037 2.495 0.554 1.00 22.98 C ATOM 769 O ALA A 82 24.709 1.495 0.795 1.00 23.54 O ATOM 770 CB ALA A 82 24.594 3.773 -1.510 1.00 22.06 C ATOM 771 H ALA A 82 22.106 4.179 -1.601 1.00 0.00 H ATOM 772 N HIS A 83 23.644 3.352 1.490 1.00 25.01 N ATOM 773 CA HIS A 83 24.012 3.217 2.899 1.00 28.19 C ATOM 774 C HIS A 83 23.804 1.852 3.566 1.00 28.91 C ATOM 775 O HIS A 83 24.481 1.540 4.547 1.00 30.72 O ATOM 776 CB HIS A 83 23.298 4.295 3.712 1.00 27.00 C ATOM 777 H HIS A 83 23.047 4.156 1.208 1.00 0.00 H ATOM 778 N LEU A 84 22.888 1.040 3.047 1.00 28.85 N ATOM 779 CA LEU A 84 22.609 -0.266 3.647 1.00 27.76 C ATOM 780 C LEU A 84 23.781 -1.245 3.707 1.00 29.00 C ATOM 781 O LEU A 84 23.695 -2.270 4.385 1.00 29.10 O ATOM 782 CB LEU A 84 21.424 -0.934 2.938 1.00 25.74 C ATOM 783 CG LEU A 84 20.073 -0.228 3.093 1.00 24.01 C ATOM 784 CD1 LEU A 84 19.000 -0.983 2.325 1.00 23.48 C ATOM 785 CD2 LEU A 84 19.710 -0.143 4.570 1.00 25.24 C ATOM 786 H LEU A 84 22.361 1.337 2.201 1.00 0.00 H ATOM 787 N SER A 85 24.868 -0.939 3.007 1.00 29.33 N ATOM 788 CA SER A 85 26.036 -1.814 3.006 1.00 30.17 C ATOM 789 C SER A 85 27.333 -1.014 3.007 1.00 29.97 C ATOM 790 O SER A 85 27.359 0.138 2.576 1.00 30.64 O ATOM 791 CB SER A 85 26.010 -2.736 1.788 1.00 29.93 C ATOM 792 OG SER A 85 27.151 -3.577 1.774 1.00 32.50 O ATOM 793 HG SER A 85 27.116 -4.166 0.979 1.00 0.00 H ATOM 794 H SER A 85 24.887 -0.061 2.450 1.00 0.00 H ATOM 795 N SER A 86 28.406 -1.637 3.487 1.00 30.20 N ATOM 796 CA SER A 86 29.712 -0.992 3.549 1.00 30.84 C ATOM 797 C SER A 86 30.559 -1.321 2.325 1.00 31.27 C ATOM 798 O SER A 86 31.344 -0.492 1.865 1.00 33.14 O ATOM 799 CB SER A 86 30.453 -1.425 4.815 1.00 31.37 C ATOM 800 OG SER A 86 29.727 -1.059 5.973 1.00 33.42 O ATOM 801 HG SER A 86 28.839 -1.497 5.957 1.00 0.00 H ATOM 802 H SER A 86 28.310 -2.615 3.829 1.00 0.00 H ATOM 803 N GLU A 87 30.406 -2.538 1.811 1.00 30.65 N ATOM 804 CA GLU A 87 31.148 -2.975 0.632 1.00 29.12 C ATOM 805 C GLU A 87 30.262 -2.775 -0.596 1.00 27.09 C ATOM 806 O GLU A 87 29.582 -3.698 -1.036 1.00 26.92 O ATOM 807 CB GLU A 87 31.536 -4.446 0.770 1.00 30.96 C ATOM 808 H GLU A 87 29.739 -3.197 2.261 1.00 0.00 H ATOM 809 N LEU A 88 30.280 -1.563 -1.142 1.00 26.72 N ATOM 810 CA LEU A 88 29.463 -1.223 -2.304 1.00 25.21 C ATOM 811 C LEU A 88 30.059 -1.617 -3.645 1.00 24.17 C ATOM 812 O LEU A 88 31.275 -1.607 -3.828 1.00 25.71 O ATOM 813 CB LEU A 88 29.185 0.284 -2.327 1.00 25.41 C ATOM 814 CG LEU A 88 28.380 0.875 -1.172 1.00 27.37 C ATOM 815 CD1 LEU A 88 28.285 2.384 -1.338 1.00 27.26 C ATOM 816 CD2 LEU A 88 26.992 0.254 -1.150 1.00 27.14 C ATOM 817 H LEU A 88 30.895 -0.834 -0.729 1.00 0.00 H ATOM 818 N ALA A 89 29.190 -1.967 -4.588 1.00 20.27 N ATOM 819 CA ALA A 89 29.631 -2.315 -5.929 1.00 19.79 C ATOM 820 C ALA A 89 29.879 -0.970 -6.598 1.00 19.09 C ATOM 821 O ALA A 89 29.368 0.053 -6.125 1.00 19.72 O ATOM 822 CB ALA A 89 28.537 -3.072 -6.662 1.00 19.90 C ATOM 823 H ALA A 89 28.175 -1.992 -4.362 1.00 0.00 H ATOM 824 N LYS A 90 30.658 -0.955 -7.676 1.00 19.42 N ATOM 825 CA LYS A 90 30.918 0.299 -8.366 1.00 18.88 C ATOM 826 C LYS A 90 29.616 0.772 -8.988 1.00 18.34 C ATOM 827 O LYS A 90 28.760 -0.038 -9.344 1.00 17.31 O ATOM 828 CB LYS A 90 32.015 0.149 -9.435 1.00 20.96 C ATOM 829 CG LYS A 90 31.797 -0.895 -10.523 1.00 23.45 C ATOM 830 CD LYS A 90 33.035 -0.921 -11.428 1.00 27.21 C ATOM 831 CE LYS A 90 33.146 -2.189 -12.267 1.00 29.21 C ATOM 832 NZ LYS A 90 32.226 -2.231 -13.436 1.00 32.46 N ATOM 833 HZ1 LYS A 90 31.242 -2.170 -13.104 1.00 0.00 H ATOM 834 HZ2 LYS A 90 32.431 -1.429 -14.066 1.00 0.00 H ATOM 835 HZ3 LYS A 90 32.364 -3.123 -13.952 1.00 0.00 H ATOM 836 H LYS A 90 31.081 -1.839 -8.025 1.00 0.00 H ATOM 837 N PRO A 91 29.446 2.097 -9.119 1.00 17.24 N ATOM 838 CA PRO A 91 28.243 2.708 -9.689 1.00 16.73 C ATOM 839 C PRO A 91 27.658 2.066 -10.948 1.00 17.15 C ATOM 840 O PRO A 91 26.471 1.742 -10.983 1.00 16.61 O ATOM 841 CB PRO A 91 28.679 4.152 -9.923 1.00 16.26 C ATOM 842 CG PRO A 91 29.603 4.395 -8.770 1.00 17.21 C ATOM 843 CD PRO A 91 30.436 3.133 -8.763 1.00 16.59 C ATOM 844 N SER A 92 28.476 1.879 -11.979 1.00 17.11 N ATOM 845 CA SER A 92 27.972 1.309 -13.225 1.00 16.98 C ATOM 846 C SER A 92 27.316 -0.056 -13.038 1.00 16.25 C ATOM 847 O SER A 92 26.267 -0.331 -13.621 1.00 13.76 O ATOM 848 CB SER A 92 29.093 1.216 -14.269 1.00 18.42 C ATOM 849 OG SER A 92 30.073 0.261 -13.901 1.00 20.87 O ATOM 850 HG SER A 92 29.649 -0.630 -13.818 1.00 0.00 H ATOM 851 H SER A 92 29.479 2.140 -11.898 1.00 0.00 H ATOM 852 N VAL A 93 27.928 -0.910 -12.226 1.00 16.51 N ATOM 853 CA VAL A 93 27.377 -2.238 -11.987 1.00 15.90 C ATOM 854 C VAL A 93 26.134 -2.132 -11.114 1.00 15.08 C ATOM 855 O VAL A 93 25.125 -2.789 -11.365 1.00 15.42 O ATOM 856 CB VAL A 93 28.413 -3.157 -11.297 1.00 17.22 C ATOM 857 CG1 VAL A 93 27.795 -4.511 -10.995 1.00 17.03 C ATOM 858 CG2 VAL A 93 29.631 -3.326 -12.195 1.00 16.70 C ATOM 859 H VAL A 93 28.811 -0.628 -11.755 1.00 0.00 H ATOM 860 N ALA A 94 26.209 -1.291 -10.089 1.00 13.23 N ATOM 861 CA ALA A 94 25.080 -1.106 -9.188 1.00 12.71 C ATOM 862 C ALA A 94 23.835 -0.676 -9.964 1.00 13.28 C ATOM 863 O ALA A 94 22.749 -1.221 -9.762 1.00 11.41 O ATOM 864 CB ALA A 94 25.429 -0.066 -8.129 1.00 12.57 C ATOM 865 H ALA A 94 27.087 -0.757 -9.927 1.00 0.00 H ATOM 866 N MET A 95 23.996 0.293 -10.860 1.00 11.74 N ATOM 867 CA MET A 95 22.862 0.775 -11.642 1.00 12.78 C ATOM 868 C MET A 95 22.320 -0.313 -12.563 1.00 13.50 C ATOM 869 O MET A 95 21.109 -0.429 -12.754 1.00 13.85 O ATOM 870 CB MET A 95 23.258 1.998 -12.467 1.00 13.90 C ATOM 871 CG MET A 95 22.086 2.636 -13.188 1.00 15.92 C ATOM 872 SD MET A 95 22.535 4.192 -13.952 1.00 19.47 S ATOM 873 CE MET A 95 21.068 4.520 -14.945 1.00 20.41 C ATOM 874 H MET A 95 24.937 0.711 -11.005 1.00 0.00 H ATOM 875 N ASP A 96 23.213 -1.112 -13.136 1.00 12.76 N ATOM 876 CA ASP A 96 22.784 -2.190 -14.022 1.00 14.06 C ATOM 877 C ASP A 96 21.937 -3.208 -13.261 1.00 12.48 C ATOM 878 O ASP A 96 20.896 -3.651 -13.747 1.00 11.09 O ATOM 879 CB ASP A 96 23.994 -2.895 -14.638 1.00 14.11 C ATOM 880 CG ASP A 96 23.598 -4.072 -15.521 1.00 17.99 C ATOM 881 OD1 ASP A 96 22.909 -3.859 -16.544 1.00 19.56 O ATOM 882 OD2 ASP A 96 23.974 -5.212 -15.188 1.00 17.91 O ATOM 883 H ASP A 96 24.226 -0.968 -12.952 1.00 0.00 H ATOM 884 N ILE A 97 22.386 -3.577 -12.067 1.00 12.11 N ATOM 885 CA ILE A 97 21.654 -4.544 -11.257 1.00 12.05 C ATOM 886 C ILE A 97 20.297 -3.990 -10.803 1.00 11.78 C ATOM 887 O ILE A 97 19.303 -4.713 -10.796 1.00 12.04 O ATOM 888 CB ILE A 97 22.512 -5.002 -10.049 1.00 12.73 C ATOM 889 CG1 ILE A 97 23.647 -5.896 -10.561 1.00 13.71 C ATOM 890 CG2 ILE A 97 21.659 -5.756 -9.027 1.00 11.07 C ATOM 891 CD1 ILE A 97 24.586 -6.405 -9.486 1.00 13.86 C ATOM 892 H ILE A 97 23.272 -3.171 -11.704 1.00 0.00 H ATOM 893 N LEU A 98 20.249 -2.712 -10.438 1.00 12.40 N ATOM 894 CA LEU A 98 18.982 -2.107 -10.030 1.00 12.23 C ATOM 895 C LEU A 98 18.023 -2.114 -11.217 1.00 12.40 C ATOM 896 O LEU A 98 16.831 -2.370 -11.061 1.00 13.21 O ATOM 897 CB LEU A 98 19.196 -0.672 -9.541 1.00 13.35 C ATOM 898 CG LEU A 98 19.980 -0.542 -8.234 1.00 13.68 C ATOM 899 CD1 LEU A 98 20.174 0.920 -7.892 1.00 15.81 C ATOM 900 CD2 LEU A 98 19.234 -1.259 -7.112 1.00 18.16 C ATOM 901 H LEU A 98 21.117 -2.140 -10.443 1.00 0.00 H ATOM 902 N ASN A 99 18.543 -1.830 -12.408 1.00 11.97 N ATOM 903 CA ASN A 99 17.695 -1.840 -13.591 1.00 12.85 C ATOM 904 C ASN A 99 17.241 -3.259 -13.916 1.00 12.99 C ATOM 905 O ASN A 99 16.119 -3.459 -14.375 1.00 14.15 O ATOM 906 CB ASN A 99 18.420 -1.223 -14.789 1.00 14.95 C ATOM 907 CG ASN A 99 18.612 0.271 -14.633 1.00 14.36 C ATOM 908 OD1 ASN A 99 17.842 0.928 -13.934 1.00 17.71 O ATOM 909 ND2 ASN A 99 19.628 0.817 -15.292 1.00 19.74 N ATOM 910 HD22 ASN A 99 20.253 0.220 -15.871 1.00 0.00 H ATOM 911 HD21 ASN A 99 19.799 1.841 -15.229 1.00 0.00 H ATOM 912 H ASN A 99 19.554 -1.601 -12.494 1.00 0.00 H ATOM 913 N ARG A 100 18.105 -4.241 -13.677 1.00 12.60 N ATOM 914 CA ARG A 100 17.737 -5.634 -13.929 1.00 12.95 C ATOM 915 C ARG A 100 16.580 -6.039 -13.013 1.00 12.34 C ATOM 916 O ARG A 100 15.647 -6.724 -13.440 1.00 11.51 O ATOM 917 CB ARG A 100 18.930 -6.567 -13.688 1.00 12.87 C ATOM 918 CG ARG A 100 19.978 -6.543 -14.794 1.00 16.80 C ATOM 919 CD ARG A 100 21.184 -7.400 -14.431 1.00 19.08 C ATOM 920 NE ARG A 100 22.183 -7.427 -15.498 1.00 21.05 N ATOM 921 CZ ARG A 100 22.073 -8.140 -16.615 1.00 24.98 C ATOM 922 NH1 ARG A 100 21.005 -8.898 -16.823 1.00 26.48 N ATOM 923 NH2 ARG A 100 23.037 -8.096 -17.530 1.00 25.85 N ATOM 924 HE ARG A 100 23.039 -6.849 -15.375 1.00 0.00 H ATOM 925 HH12 ARG A 100 20.924 -9.454 -17.698 1.00 0.00 H ATOM 926 HH11 ARG A 100 20.248 -8.937 -16.111 1.00 0.00 H ATOM 927 HH22 ARG A 100 22.951 -8.654 -18.404 1.00 0.00 H ATOM 928 HH21 ARG A 100 23.877 -7.504 -17.372 1.00 0.00 H ATOM 929 H ARG A 100 19.051 -4.017 -13.308 1.00 0.00 H ATOM 930 N VAL A 101 16.654 -5.620 -11.752 1.00 12.31 N ATOM 931 CA VAL A 101 15.611 -5.931 -10.773 1.00 11.52 C ATOM 932 C VAL A 101 14.315 -5.245 -11.180 1.00 12.51 C ATOM 933 O VAL A 101 13.238 -5.843 -11.133 1.00 12.49 O ATOM 934 CB VAL A 101 16.032 -5.476 -9.351 1.00 11.15 C ATOM 935 CG1 VAL A 101 14.878 -5.639 -8.372 1.00 11.47 C ATOM 936 CG2 VAL A 101 17.215 -6.309 -8.883 1.00 11.99 C ATOM 937 H VAL A 101 17.475 -5.056 -11.454 1.00 0.00 H ATOM 938 N TYR A 102 14.435 -3.988 -11.594 1.00 10.53 N ATOM 939 CA TYR A 102 13.301 -3.194 -12.050 1.00 12.24 C ATOM 940 C TYR A 102 12.601 -3.914 -13.204 1.00 12.23 C ATOM 941 O TYR A 102 11.388 -4.119 -13.183 1.00 11.38 O ATOM 942 CB TYR A 102 13.806 -1.829 -12.516 1.00 11.62 C ATOM 943 CG TYR A 102 12.778 -0.990 -13.231 1.00 14.10 C ATOM 944 CD1 TYR A 102 11.776 -0.325 -12.525 1.00 14.88 C ATOM 945 CD2 TYR A 102 12.823 -0.841 -14.615 1.00 16.08 C ATOM 946 CE1 TYR A 102 10.847 0.475 -13.181 1.00 18.58 C ATOM 947 CE2 TYR A 102 11.896 -0.044 -15.285 1.00 19.31 C ATOM 948 CZ TYR A 102 10.914 0.611 -14.561 1.00 19.66 C ATOM 949 OH TYR A 102 10.005 1.414 -15.217 1.00 25.36 O ATOM 950 HH TYR A 102 9.376 1.804 -14.559 1.00 0.00 H ATOM 951 H TYR A 102 15.379 -3.552 -11.593 1.00 0.00 H ATOM 952 N GLN A 103 13.382 -4.305 -14.206 1.00 12.57 N ATOM 953 CA GLN A 103 12.846 -5.007 -15.374 1.00 14.52 C ATOM 954 C GLN A 103 12.225 -6.360 -15.047 1.00 13.35 C ATOM 955 O GLN A 103 11.209 -6.741 -15.631 1.00 12.48 O ATOM 956 CB GLN A 103 13.950 -5.205 -16.412 1.00 16.33 C ATOM 957 CG GLN A 103 14.213 -3.994 -17.266 1.00 20.29 C ATOM 958 CD GLN A 103 13.007 -3.614 -18.101 1.00 24.22 C ATOM 959 OE1 GLN A 103 12.097 -4.421 -18.308 1.00 24.26 O ATOM 960 NE2 GLN A 103 12.998 -2.386 -18.593 1.00 26.45 N ATOM 961 HE22 GLN A 103 13.788 -1.740 -18.392 1.00 0.00 H ATOM 962 HE21 GLN A 103 12.201 -2.067 -19.181 1.00 0.00 H ATOM 963 H GLN A 103 14.402 -4.107 -14.159 1.00 0.00 H ATOM 964 N GLY A 104 12.848 -7.098 -14.133 1.00 12.80 N ATOM 965 CA GLY A 104 12.323 -8.398 -13.760 1.00 12.45 C ATOM 966 C GLY A 104 10.974 -8.283 -13.075 1.00 13.60 C ATOM 967 O GLY A 104 10.067 -9.070 -13.339 1.00 12.23 O ATOM 968 H GLY A 104 13.716 -6.742 -13.684 1.00 0.00 H ATOM 969 N LEU A 105 10.839 -7.304 -12.185 1.00 10.82 N ATOM 970 CA LEU A 105 9.574 -7.104 -11.483 1.00 11.96 C ATOM 971 C LEU A 105 8.508 -6.624 -12.464 1.00 12.24 C ATOM 972 O LEU A 105 7.338 -6.997 -12.371 1.00 13.35 O ATOM 973 CB LEU A 105 9.754 -6.087 -10.351 1.00 12.56 C ATOM 974 CG LEU A 105 10.710 -6.525 -9.234 1.00 13.12 C ATOM 975 CD1 LEU A 105 10.965 -5.359 -8.289 1.00 13.62 C ATOM 976 CD2 LEU A 105 10.117 -7.710 -8.475 1.00 14.63 C ATOM 977 H LEU A 105 11.643 -6.674 -11.987 1.00 0.00 H ATOM 978 N LYS A 106 8.920 -5.787 -13.408 1.00 14.32 N ATOM 979 CA LYS A 106 8.002 -5.269 -14.413 1.00 15.64 C ATOM 980 C LYS A 106 7.515 -6.427 -15.291 1.00 15.67 C ATOM 981 O LYS A 106 6.344 -6.492 -15.672 1.00 15.16 O ATOM 982 CB LYS A 106 8.720 -4.210 -15.250 1.00 19.14 C ATOM 983 CG LYS A 106 7.830 -3.399 -16.169 1.00 23.56 C ATOM 984 CD LYS A 106 8.571 -2.162 -16.658 1.00 27.20 C ATOM 985 CE LYS A 106 7.712 -1.346 -17.596 1.00 30.84 C ATOM 986 NZ LYS A 106 6.427 -0.956 -16.955 1.00 32.92 N ATOM 987 HZ1 LYS A 106 5.901 -1.812 -16.686 1.00 0.00 H ATOM 988 HZ2 LYS A 106 6.623 -0.387 -16.107 1.00 0.00 H ATOM 989 HZ3 LYS A 106 5.862 -0.397 -17.626 1.00 0.00 H ATOM 990 H LYS A 106 9.918 -5.495 -13.431 1.00 0.00 H ATOM 991 N GLU A 107 8.421 -7.347 -15.601 1.00 15.15 N ATOM 992 CA GLU A 107 8.089 -8.508 -16.416 1.00 17.36 C ATOM 993 C GLU A 107 6.999 -9.335 -15.746 1.00 16.85 C ATOM 994 O GLU A 107 6.116 -9.866 -16.412 1.00 17.37 O ATOM 995 CB GLU A 107 9.336 -9.375 -16.621 1.00 17.55 C ATOM 996 CG GLU A 107 9.067 -10.769 -17.193 1.00 19.82 C ATOM 997 CD GLU A 107 8.364 -10.723 -18.536 1.00 22.35 C ATOM 998 OE1 GLU A 107 8.676 -9.812 -19.334 1.00 20.38 O ATOM 999 OE2 GLU A 107 7.513 -11.602 -18.795 1.00 20.96 O ATOM 1000 H GLU A 107 9.394 -7.236 -15.252 1.00 0.00 H ATOM 1001 N ARG A 108 7.057 -9.421 -14.422 1.00 16.45 N ATOM 1002 CA ARG A 108 6.089 -10.208 -13.672 1.00 17.55 C ATOM 1003 C ARG A 108 4.692 -9.614 -13.547 1.00 17.15 C ATOM 1004 O ARG A 108 3.796 -10.254 -12.990 1.00 18.32 O ATOM 1005 CB ARG A 108 6.643 -10.531 -12.286 1.00 17.35 C ATOM 1006 CG ARG A 108 7.892 -11.391 -12.339 1.00 22.86 C ATOM 1007 CD ARG A 108 8.094 -12.169 -11.055 1.00 24.68 C ATOM 1008 NE ARG A 108 9.332 -12.943 -11.075 1.00 26.61 N ATOM 1009 CZ ARG A 108 9.643 -13.869 -10.176 1.00 28.16 C ATOM 1010 NH1 ARG A 108 8.803 -14.136 -9.185 1.00 29.35 N ATOM 1011 NH2 ARG A 108 10.798 -14.518 -10.257 1.00 29.60 N ATOM 1012 HE ARG A 108 10.012 -12.758 -11.840 1.00 0.00 H ATOM 1013 HH12 ARG A 108 9.045 -14.861 -8.480 1.00 0.00 H ATOM 1014 HH11 ARG A 108 7.903 -13.620 -9.113 1.00 0.00 H ATOM 1015 HH22 ARG A 108 11.038 -15.243 -9.551 1.00 0.00 H ATOM 1016 HH21 ARG A 108 11.463 -14.302 -11.027 1.00 0.00 H ATOM 1017 H ARG A 108 7.809 -8.916 -13.911 1.00 0.00 H ATOM 1018 N GLY A 109 4.501 -8.399 -14.056 1.00 15.38 N ATOM 1019 CA GLY A 109 3.183 -7.786 -14.006 1.00 15.14 C ATOM 1020 C GLY A 109 2.940 -6.728 -12.945 1.00 15.11 C ATOM 1021 O GLY A 109 1.865 -6.130 -12.902 1.00 15.21 O ATOM 1022 H GLY A 109 5.295 -7.887 -14.490 1.00 0.00 H ATOM 1023 N PHE A 110 3.922 -6.494 -12.082 1.00 13.64 N ATOM 1024 CA PHE A 110 3.778 -5.483 -11.037 1.00 13.72 C ATOM 1025 C PHE A 110 3.869 -4.083 -11.634 1.00 13.83 C ATOM 1026 O PHE A 110 4.460 -3.890 -12.695 1.00 14.28 O ATOM 1027 CB PHE A 110 4.894 -5.637 -10.001 1.00 13.19 C ATOM 1028 CG PHE A 110 4.812 -6.894 -9.191 1.00 13.56 C ATOM 1029 CD1 PHE A 110 3.848 -7.032 -8.196 1.00 14.40 C ATOM 1030 CD2 PHE A 110 5.713 -7.934 -9.405 1.00 12.70 C ATOM 1031 CE1 PHE A 110 3.784 -8.189 -7.420 1.00 15.88 C ATOM 1032 CE2 PHE A 110 5.657 -9.093 -8.636 1.00 15.54 C ATOM 1033 CZ PHE A 110 4.690 -9.221 -7.641 1.00 13.89 C ATOM 1034 H PHE A 110 4.806 -7.038 -12.151 1.00 0.00 H ATOM 1035 N ASN A 111 3.260 -3.110 -10.964 1.00 13.50 N ATOM 1036 CA ASN A 111 3.350 -1.718 -11.397 1.00 13.24 C ATOM 1037 C ASN A 111 4.613 -1.287 -10.658 1.00 13.00 C ATOM 1038 O ASN A 111 4.601 -1.143 -9.440 1.00 13.94 O ATOM 1039 CB ASN A 111 2.134 -0.919 -10.921 1.00 13.76 C ATOM 1040 CG ASN A 111 2.328 0.580 -11.064 1.00 16.05 C ATOM 1041 OD1 ASN A 111 2.912 1.056 -12.044 1.00 18.98 O ATOM 1042 ND2 ASN A 111 1.831 1.334 -10.091 1.00 16.79 N ATOM 1043 HD22 ASN A 111 1.347 0.890 -9.285 1.00 0.00 H ATOM 1044 HD21 ASN A 111 1.926 2.369 -10.135 1.00 0.00 H ATOM 1045 H ASN A 111 2.708 -3.345 -10.114 1.00 0.00 H ATOM 1046 N VAL A 112 5.704 -1.120 -11.398 1.00 11.53 N ATOM 1047 CA VAL A 112 6.994 -0.782 -10.801 1.00 12.29 C ATOM 1048 C VAL A 112 7.525 0.606 -11.123 1.00 12.80 C ATOM 1049 O VAL A 112 7.388 1.100 -12.243 1.00 13.40 O ATOM 1050 CB VAL A 112 8.071 -1.813 -11.237 1.00 13.06 C ATOM 1051 CG1 VAL A 112 9.338 -1.646 -10.411 1.00 13.04 C ATOM 1052 CG2 VAL A 112 7.524 -3.214 -11.098 1.00 13.04 C ATOM 1053 H VAL A 112 5.638 -1.233 -12.430 1.00 0.00 H ATOM 1054 N GLY A 113 8.138 1.228 -10.122 1.00 14.02 N ATOM 1055 CA GLY A 113 8.719 2.539 -10.316 1.00 12.64 C ATOM 1056 C GLY A 113 10.138 2.487 -9.791 1.00 13.62 C ATOM 1057 O GLY A 113 10.507 1.547 -9.091 1.00 10.46 O ATOM 1058 H GLY A 113 8.201 0.769 -9.191 1.00 0.00 H ATOM 1059 N LYS A 114 10.950 3.474 -10.143 1.00 14.09 N ATOM 1060 CA LYS A 114 12.313 3.514 -9.642 1.00 14.89 C ATOM 1061 C LYS A 114 12.787 4.954 -9.663 1.00 16.55 C ATOM 1062 O LYS A 114 12.308 5.756 -10.463 1.00 16.85 O ATOM 1063 CB LYS A 114 13.240 2.620 -10.475 1.00 17.92 C ATOM 1064 CG LYS A 114 13.550 3.097 -11.880 1.00 21.55 C ATOM 1065 CD LYS A 114 14.543 2.133 -12.524 1.00 25.27 C ATOM 1066 CE LYS A 114 14.978 2.597 -13.896 1.00 25.92 C ATOM 1067 NZ LYS A 114 15.742 3.866 -13.830 1.00 25.83 N ATOM 1068 HZ1 LYS A 114 15.146 4.606 -13.407 1.00 0.00 H ATOM 1069 HZ2 LYS A 114 16.592 3.728 -13.246 1.00 0.00 H ATOM 1070 HZ3 LYS A 114 16.022 4.151 -14.790 1.00 0.00 H ATOM 1071 H LYS A 114 10.610 4.222 -10.780 1.00 0.00 H ATOM 1072 N ALA A 115 13.705 5.284 -8.763 1.00 14.66 N ATOM 1073 CA ALA A 115 14.227 6.640 -8.672 1.00 13.72 C ATOM 1074 C ALA A 115 15.533 6.787 -9.439 1.00 13.70 C ATOM 1075 O ALA A 115 16.246 5.807 -9.665 1.00 14.43 O ATOM 1076 CB ALA A 115 14.446 7.011 -7.210 1.00 13.94 C ATOM 1077 H ALA A 115 14.059 4.558 -8.108 1.00 0.00 H ATOM 1078 N PRO A 116 15.859 8.021 -9.854 1.00 13.13 N ATOM 1079 CA PRO A 116 17.097 8.282 -10.592 1.00 12.88 C ATOM 1080 C PRO A 116 18.296 7.781 -9.795 1.00 11.51 C ATOM 1081 O PRO A 116 18.268 7.772 -8.561 1.00 11.92 O ATOM 1082 CB PRO A 116 17.086 9.795 -10.744 1.00 12.61 C ATOM 1083 CG PRO A 116 15.622 10.077 -10.908 1.00 13.61 C ATOM 1084 CD PRO A 116 15.010 9.225 -9.823 1.00 11.85 C ATOM 1085 N PHE A 117 19.348 7.384 -10.506 1.00 11.18 N ATOM 1086 CA PHE A 117 20.557 6.838 -9.889 1.00 11.26 C ATOM 1087 C PHE A 117 21.725 7.824 -9.807 1.00 10.21 C ATOM 1088 O PHE A 117 22.025 8.513 -10.783 1.00 9.55 O ATOM 1089 CB PHE A 117 21.010 5.608 -10.689 1.00 12.53 C ATOM 1090 CG PHE A 117 22.195 4.891 -10.098 1.00 12.69 C ATOM 1091 CD1 PHE A 117 22.016 3.862 -9.177 1.00 13.91 C ATOM 1092 CD2 PHE A 117 23.490 5.241 -10.469 1.00 12.43 C ATOM 1093 CE1 PHE A 117 23.115 3.189 -8.634 1.00 14.10 C ATOM 1094 CE2 PHE A 117 24.593 4.577 -9.931 1.00 10.59 C ATOM 1095 CZ PHE A 117 24.401 3.549 -9.012 1.00 12.81 C ATOM 1096 H PHE A 117 19.309 7.465 -11.542 1.00 0.00 H ATOM 1097 N GLY A 118 22.373 7.871 -8.639 1.00 9.59 N ATOM 1098 CA GLY A 118 23.532 8.727 -8.428 1.00 10.54 C ATOM 1099 C GLY A 118 23.306 10.047 -7.711 1.00 10.27 C ATOM 1100 O GLY A 118 24.149 10.941 -7.788 1.00 11.36 O ATOM 1101 H GLY A 118 22.038 7.276 -7.854 1.00 0.00 H ATOM 1102 N TYR A 119 22.204 10.163 -6.982 1.00 10.22 N ATOM 1103 CA TYR A 119 21.871 11.415 -6.305 1.00 11.00 C ATOM 1104 C TYR A 119 21.575 11.323 -4.824 1.00 11.71 C ATOM 1105 O TYR A 119 21.370 10.240 -4.279 1.00 12.39 O ATOM 1106 CB TYR A 119 20.618 12.018 -6.941 1.00 10.73 C ATOM 1107 CG TYR A 119 20.739 12.344 -8.397 1.00 10.02 C ATOM 1108 CD1 TYR A 119 21.266 13.563 -8.806 1.00 11.03 C ATOM 1109 CD2 TYR A 119 20.331 11.430 -9.377 1.00 10.55 C ATOM 1110 CE1 TYR A 119 21.386 13.875 -10.141 1.00 10.77 C ATOM 1111 CE2 TYR A 119 20.454 11.732 -10.726 1.00 8.82 C ATOM 1112 CZ TYR A 119 20.983 12.960 -11.100 1.00 11.85 C ATOM 1113 OH TYR A 119 21.121 13.283 -12.427 1.00 11.67 O ATOM 1114 HH TYR A 119 21.718 12.626 -12.865 1.00 0.00 H ATOM 1115 H TYR A 119 21.565 9.348 -6.890 1.00 0.00 H ATOM 1116 N TYR A 120 21.559 12.494 -4.190 1.00 9.82 N ATOM 1117 CA TYR A 120 21.153 12.626 -2.799 1.00 12.07 C ATOM 1118 C TYR A 120 19.699 12.924 -3.096 1.00 11.72 C ATOM 1119 O TYR A 120 19.397 13.659 -4.036 1.00 12.07 O ATOM 1120 CB TYR A 120 21.846 13.807 -2.124 1.00 12.10 C ATOM 1121 CG TYR A 120 23.274 13.468 -1.785 1.00 13.16 C ATOM 1122 CD1 TYR A 120 23.564 12.387 -0.945 1.00 13.81 C ATOM 1123 CD2 TYR A 120 24.334 14.180 -2.334 1.00 14.68 C ATOM 1124 CE1 TYR A 120 24.874 12.024 -0.669 1.00 16.70 C ATOM 1125 CE2 TYR A 120 25.655 13.823 -2.060 1.00 16.38 C ATOM 1126 CZ TYR A 120 25.915 12.743 -1.229 1.00 18.31 C ATOM 1127 OH TYR A 120 27.215 12.376 -0.960 1.00 16.52 O ATOM 1128 HH TYR A 120 27.687 13.131 -0.526 1.00 0.00 H ATOM 1129 H TYR A 120 21.848 13.347 -4.709 1.00 0.00 H ATOM 1130 N MET A 121 18.793 12.370 -2.308 1.00 10.47 N ATOM 1131 CA MET A 121 17.393 12.518 -2.625 1.00 11.53 C ATOM 1132 C MET A 121 16.509 12.667 -1.393 1.00 10.41 C ATOM 1133 O MET A 121 16.647 11.917 -0.434 1.00 11.09 O ATOM 1134 CB MET A 121 17.022 11.265 -3.430 1.00 12.52 C ATOM 1135 CG MET A 121 15.611 11.084 -3.903 1.00 13.73 C ATOM 1136 SD MET A 121 15.563 9.510 -4.836 1.00 15.63 S ATOM 1137 CE MET A 121 16.628 9.903 -6.185 1.00 13.98 C ATOM 1138 H MET A 121 19.087 11.833 -1.467 1.00 0.00 H ATOM 1139 N ALA A 122 15.620 13.654 -1.413 1.00 10.07 N ATOM 1140 CA ALA A 122 14.689 13.838 -0.307 1.00 10.64 C ATOM 1141 C ALA A 122 13.569 12.826 -0.554 1.00 10.34 C ATOM 1142 O ALA A 122 13.281 12.487 -1.701 1.00 10.24 O ATOM 1143 CB ALA A 122 14.123 15.265 -0.318 1.00 13.71 C ATOM 1144 H ALA A 122 15.588 14.302 -2.226 1.00 0.00 H ATOM 1145 N PHE A 123 12.956 12.313 0.506 1.00 11.09 N ATOM 1146 CA PHE A 123 11.853 11.379 0.318 1.00 11.48 C ATOM 1147 C PHE A 123 10.890 11.431 1.486 1.00 11.83 C ATOM 1148 O PHE A 123 11.233 11.901 2.567 1.00 12.20 O ATOM 1149 CB PHE A 123 12.366 9.943 0.097 1.00 13.79 C ATOM 1150 CG PHE A 123 12.945 9.283 1.327 1.00 14.31 C ATOM 1151 CD1 PHE A 123 12.127 8.596 2.221 1.00 17.78 C ATOM 1152 CD2 PHE A 123 14.316 9.311 1.565 1.00 15.60 C ATOM 1153 CE1 PHE A 123 12.669 7.942 3.335 1.00 17.12 C ATOM 1154 CE2 PHE A 123 14.866 8.660 2.677 1.00 15.51 C ATOM 1155 CZ PHE A 123 14.039 7.976 3.559 1.00 17.89 C ATOM 1156 H PHE A 123 13.261 12.576 1.465 1.00 0.00 H ATOM 1157 N LYS A 124 9.667 10.985 1.232 1.00 11.10 N ATOM 1158 CA LYS A 124 8.621 10.938 2.240 1.00 11.97 C ATOM 1159 C LYS A 124 8.054 9.535 2.136 1.00 12.13 C ATOM 1160 O LYS A 124 7.770 9.055 1.042 1.00 10.05 O ATOM 1161 CB LYS A 124 7.517 11.952 1.931 1.00 13.28 C ATOM 1162 CG LYS A 124 7.996 13.388 1.817 1.00 14.20 C ATOM 1163 CD LYS A 124 6.838 14.331 1.513 1.00 17.16 C ATOM 1164 CE LYS A 124 7.335 15.736 1.212 1.00 19.29 C ATOM 1165 NZ LYS A 124 8.089 16.335 2.356 1.00 19.88 N ATOM 1166 HZ1 LYS A 124 7.469 16.386 3.189 1.00 0.00 H ATOM 1167 HZ2 LYS A 124 8.916 15.742 2.573 1.00 0.00 H ATOM 1168 HZ3 LYS A 124 8.405 17.292 2.098 1.00 0.00 H ATOM 1169 H LYS A 124 9.447 10.655 0.271 1.00 0.00 H ATOM 1170 N ILE A 125 7.899 8.871 3.271 1.00 13.04 N ATOM 1171 CA ILE A 125 7.353 7.528 3.265 1.00 12.19 C ATOM 1172 C ILE A 125 6.441 7.359 4.470 1.00 12.54 C ATOM 1173 O ILE A 125 6.577 8.066 5.472 1.00 11.17 O ATOM 1174 CB ILE A 125 8.488 6.472 3.297 1.00 14.65 C ATOM 1175 CG1 ILE A 125 7.919 5.075 3.050 1.00 14.77 C ATOM 1176 CG2 ILE A 125 9.210 6.525 4.635 1.00 12.22 C ATOM 1177 CD1 ILE A 125 8.989 4.008 2.809 1.00 18.19 C ATOM 1178 H ILE A 125 8.170 9.315 4.171 1.00 0.00 H ATOM 1179 N SER A 126 5.504 6.427 4.358 1.00 11.59 N ATOM 1180 CA SER A 126 4.560 6.139 5.431 1.00 11.55 C ATOM 1181 C SER A 126 4.455 4.626 5.592 1.00 12.08 C ATOM 1182 O SER A 126 3.725 3.966 4.860 1.00 13.77 O ATOM 1183 CB SER A 126 3.185 6.731 5.095 1.00 14.41 C ATOM 1184 OG SER A 126 2.217 6.433 6.097 1.00 13.48 O ATOM 1185 HG SER A 126 2.120 5.451 6.179 1.00 0.00 H ATOM 1186 H SER A 126 5.440 5.883 3.474 1.00 0.00 H ATOM 1187 N CYS A 127 5.200 4.078 6.545 1.00 10.62 N ATOM 1188 CA CYS A 127 5.173 2.639 6.783 1.00 11.57 C ATOM 1189 C CYS A 127 3.831 2.231 7.383 1.00 12.08 C ATOM 1190 O CYS A 127 3.351 2.853 8.330 1.00 9.89 O ATOM 1191 CB CYS A 127 6.306 2.246 7.726 1.00 13.80 C ATOM 1192 SG CYS A 127 6.341 0.483 8.111 1.00 13.65 S ATOM 1193 H CYS A 127 5.811 4.683 7.130 1.00 0.00 H ATOM 1194 N LYS A 128 3.234 1.179 6.831 1.00 11.87 N ATOM 1195 CA LYS A 128 1.936 0.699 7.288 1.00 12.53 C ATOM 1196 C LYS A 128 1.920 0.135 8.703 1.00 14.02 C ATOM 1197 O LYS A 128 0.872 0.096 9.346 1.00 15.09 O ATOM 1198 CB LYS A 128 1.393 -0.341 6.307 1.00 13.07 C ATOM 1199 CG LYS A 128 0.995 0.247 4.961 1.00 12.91 C ATOM 1200 CD LYS A 128 0.406 -0.816 4.055 1.00 13.15 C ATOM 1201 CE LYS A 128 -0.161 -0.212 2.781 1.00 14.17 C ATOM 1202 NZ LYS A 128 -1.290 0.722 3.062 1.00 13.05 N ATOM 1203 HZ1 LYS A 128 -2.053 0.206 3.546 1.00 0.00 H ATOM 1204 HZ2 LYS A 128 -0.954 1.497 3.669 1.00 0.00 H ATOM 1205 HZ3 LYS A 128 -1.647 1.111 2.166 1.00 0.00 H ATOM 1206 H LYS A 128 3.708 0.683 6.049 1.00 0.00 H ATOM 1207 N GLY A 129 3.073 -0.322 9.180 1.00 13.57 N ATOM 1208 CA GLY A 129 3.155 -0.843 10.535 1.00 13.67 C ATOM 1209 C GLY A 129 2.529 -2.201 10.784 1.00 13.67 C ATOM 1210 O GLY A 129 2.240 -2.553 11.931 1.00 13.85 O ATOM 1211 H GLY A 129 3.922 -0.307 8.580 1.00 0.00 H ATOM 1212 N HIS A 130 2.293 -2.961 9.721 1.00 14.22 N ATOM 1213 CA HIS A 130 1.735 -4.299 9.874 1.00 15.50 C ATOM 1214 C HIS A 130 2.901 -5.203 10.240 1.00 15.00 C ATOM 1215 O HIS A 130 4.055 -4.803 10.128 1.00 14.89 O ATOM 1216 CB HIS A 130 1.098 -4.754 8.564 1.00 17.03 C ATOM 1217 CG HIS A 130 -0.072 -3.921 8.153 1.00 20.12 C ATOM 1218 ND1 HIS A 130 -0.394 -3.684 6.835 1.00 23.00 N ATOM 1219 CD2 HIS A 130 -0.996 -3.264 8.892 1.00 21.91 C ATOM 1220 CE1 HIS A 130 -1.466 -2.914 6.780 1.00 27.54 C ATOM 1221 NE2 HIS A 130 -1.852 -2.644 8.014 1.00 29.18 N ATOM 1222 H HIS A 130 2.508 -2.598 8.770 1.00 0.00 H ATOM 1223 N PRO A 131 2.620 -6.437 10.682 1.00 14.33 N ATOM 1224 CA PRO A 131 3.711 -7.345 11.049 1.00 14.69 C ATOM 1225 C PRO A 131 4.753 -7.569 9.946 1.00 15.61 C ATOM 1226 O PRO A 131 5.940 -7.719 10.227 1.00 15.30 O ATOM 1227 CB PRO A 131 2.975 -8.631 11.420 1.00 14.66 C ATOM 1228 CG PRO A 131 1.681 -8.115 11.983 1.00 14.39 C ATOM 1229 CD PRO A 131 1.309 -7.033 10.992 1.00 13.98 C ATOM 1230 N LEU A 132 4.309 -7.568 8.694 1.00 15.36 N ATOM 1231 CA LEU A 132 5.209 -7.802 7.568 1.00 16.60 C ATOM 1232 C LEU A 132 5.574 -6.536 6.791 1.00 17.12 C ATOM 1233 O LEU A 132 6.141 -6.623 5.702 1.00 17.83 O ATOM 1234 CB LEU A 132 4.573 -8.811 6.606 1.00 17.90 C ATOM 1235 CG LEU A 132 4.169 -10.172 7.180 1.00 19.37 C ATOM 1236 CD1 LEU A 132 3.410 -10.961 6.129 1.00 19.68 C ATOM 1237 CD2 LEU A 132 5.409 -10.931 7.624 1.00 19.11 C ATOM 1238 H LEU A 132 3.299 -7.397 8.512 1.00 0.00 H ATOM 1239 N ALA A 133 5.268 -5.369 7.353 1.00 14.72 N ATOM 1240 CA ALA A 133 5.541 -4.102 6.679 1.00 15.21 C ATOM 1241 C ALA A 133 7.012 -3.697 6.655 1.00 14.65 C ATOM 1242 O ALA A 133 7.398 -2.819 5.885 1.00 15.95 O ATOM 1243 CB ALA A 133 4.703 -2.992 7.300 1.00 13.12 C ATOM 1244 H ALA A 133 4.824 -5.359 8.294 1.00 0.00 H ATOM 1245 N GLU A 134 7.824 -4.317 7.506 1.00 14.86 N ATOM 1246 CA GLU A 134 9.258 -4.034 7.546 1.00 14.21 C ATOM 1247 C GLU A 134 10.012 -5.357 7.479 1.00 16.38 C ATOM 1248 O GLU A 134 9.841 -6.215 8.341 1.00 15.33 O ATOM 1249 CB GLU A 134 9.635 -3.294 8.836 1.00 15.67 C ATOM 1250 CG GLU A 134 8.836 -2.022 9.068 1.00 14.53 C ATOM 1251 CD GLU A 134 9.257 -1.259 10.313 1.00 15.70 C ATOM 1252 OE1 GLU A 134 9.895 -1.853 11.207 1.00 17.46 O ATOM 1253 OE2 GLU A 134 8.931 -0.059 10.401 1.00 14.52 O ATOM 1254 H GLU A 134 7.429 -5.022 8.161 1.00 0.00 H ATOM 1255 N LEU A 135 10.831 -5.524 6.445 1.00 15.33 N ATOM 1256 CA LEU A 135 11.608 -6.747 6.276 1.00 17.23 C ATOM 1257 C LEU A 135 12.932 -6.431 5.605 1.00 19.55 C ATOM 1258 O LEU A 135 13.036 -5.471 4.844 1.00 16.59 O ATOM 1259 CB LEU A 135 10.851 -7.749 5.406 1.00 17.47 C ATOM 1260 CG LEU A 135 9.467 -8.225 5.845 1.00 17.62 C ATOM 1261 CD1 LEU A 135 8.836 -9.000 4.705 1.00 19.04 C ATOM 1262 CD2 LEU A 135 9.573 -9.087 7.099 1.00 16.96 C ATOM 1263 H LEU A 135 10.920 -4.765 5.740 1.00 0.00 H ATOM 1264 N SER A 136 13.947 -7.239 5.891 1.00 19.77 N ATOM 1265 CA SER A 136 15.250 -7.048 5.276 1.00 20.77 C ATOM 1266 C SER A 136 15.670 -8.377 4.672 1.00 21.31 C ATOM 1267 O SER A 136 15.245 -9.439 5.129 1.00 22.27 O ATOM 1268 CB SER A 136 16.285 -6.582 6.304 1.00 21.84 C ATOM 1269 OG SER A 136 16.471 -7.540 7.327 1.00 23.54 O ATOM 1270 HG SER A 136 16.786 -8.390 6.929 1.00 0.00 H ATOM 1271 H SER A 136 13.807 -8.019 6.564 1.00 0.00 H ATOM 1272 N ARG A 137 16.491 -8.315 3.633 1.00 20.14 N ATOM 1273 CA ARG A 137 16.957 -9.518 2.964 1.00 20.87 C ATOM 1274 C ARG A 137 18.376 -9.303 2.465 1.00 20.62 C ATOM 1275 O ARG A 137 18.735 -8.206 2.037 1.00 19.36 O ATOM 1276 CB ARG A 137 16.049 -9.848 1.774 1.00 20.25 C ATOM 1277 CG ARG A 137 14.601 -10.171 2.126 1.00 23.87 C ATOM 1278 CD ARG A 137 14.452 -11.601 2.630 1.00 24.20 C ATOM 1279 NE ARG A 137 13.055 -11.967 2.858 1.00 26.83 N ATOM 1280 CZ ARG A 137 12.372 -11.681 3.962 1.00 25.54 C ATOM 1281 NH1 ARG A 137 12.955 -11.021 4.954 1.00 27.78 N ATOM 1282 NH2 ARG A 137 11.107 -12.065 4.081 1.00 26.75 N ATOM 1283 HE ARG A 137 12.562 -12.487 2.104 1.00 0.00 H ATOM 1284 HH12 ARG A 137 12.418 -10.798 5.817 1.00 0.00 H ATOM 1285 HH11 ARG A 137 13.949 -10.726 4.869 1.00 0.00 H ATOM 1286 HH22 ARG A 137 10.574 -11.840 4.946 1.00 0.00 H ATOM 1287 HH21 ARG A 137 10.648 -12.591 3.310 1.00 0.00 H ATOM 1288 H ARG A 137 16.808 -7.386 3.289 1.00 0.00 H ATOM 1289 N THR A 138 19.186 -10.351 2.543 1.00 21.49 N ATOM 1290 CA THR A 138 20.552 -10.286 2.055 1.00 22.93 C ATOM 1291 C THR A 138 20.634 -11.293 0.922 1.00 24.22 C ATOM 1292 O THR A 138 20.322 -12.471 1.099 1.00 22.97 O ATOM 1293 CB THR A 138 21.575 -10.644 3.149 1.00 24.31 C ATOM 1294 OG1 THR A 138 21.575 -9.621 4.152 1.00 25.30 O ATOM 1295 CG2 THR A 138 22.974 -10.752 2.554 1.00 24.63 C ATOM 1296 HG1 THR A 138 22.232 -9.850 4.856 1.00 0.00 H ATOM 1297 H THR A 138 18.836 -11.236 2.962 1.00 0.00 H ATOM 1298 N ILE A 139 21.040 -10.819 -0.248 1.00 24.19 N ATOM 1299 CA ILE A 139 21.142 -11.670 -1.421 1.00 25.89 C ATOM 1300 C ILE A 139 22.505 -11.499 -2.076 1.00 26.37 C ATOM 1301 O ILE A 139 22.851 -10.406 -2.518 1.00 24.82 O ATOM 1302 CB ILE A 139 20.039 -11.316 -2.437 1.00 26.20 C ATOM 1303 CG1 ILE A 139 18.665 -11.462 -1.774 1.00 27.52 C ATOM 1304 CG2 ILE A 139 20.154 -12.206 -3.661 1.00 27.16 C ATOM 1305 CD1 ILE A 139 17.508 -10.967 -2.623 1.00 26.86 C ATOM 1306 H ILE A 139 21.292 -9.813 -0.328 1.00 0.00 H ATOM 1307 N VAL A 140 23.271 -12.582 -2.131 1.00 28.23 N ATOM 1308 CA VAL A 140 24.599 -12.553 -2.733 1.00 30.53 C ATOM 1309 C VAL A 140 24.815 -13.768 -3.632 1.00 31.92 C ATOM 1310 O VAL A 140 24.107 -14.771 -3.516 1.00 31.84 O ATOM 1311 CB VAL A 140 25.699 -12.537 -1.648 1.00 31.77 C ATOM 1312 CG1 VAL A 140 25.612 -11.254 -0.830 1.00 32.22 C ATOM 1313 CG2 VAL A 140 25.551 -13.754 -0.742 1.00 31.55 C ATOM 1314 H VAL A 140 22.915 -13.475 -1.734 1.00 0.00 H ATOM 1315 N PRO A 141 25.797 -13.693 -4.548 1.00 32.71 N ATOM 1316 CA PRO A 141 26.088 -14.806 -5.458 1.00 33.05 C ATOM 1317 C PRO A 141 26.390 -16.096 -4.695 1.00 34.02 C ATOM 1318 O PRO A 141 25.766 -17.135 -5.001 1.00 34.93 O ATOM 1319 CB PRO A 141 27.300 -14.302 -6.239 1.00 33.48 C ATOM 1320 CG PRO A 141 27.077 -12.826 -6.281 1.00 32.14 C ATOM 1321 CD PRO A 141 26.646 -12.529 -4.862 1.00 32.61 C TER 1322 PRO A 141 ATOM 1323 N MET B 1 25.420 -3.568 16.567 1.00 16.63 N ATOM 1324 CA MET B 1 24.258 -2.646 16.372 1.00 16.92 C ATOM 1325 C MET B 1 24.278 -2.001 14.992 1.00 16.17 C ATOM 1326 O MET B 1 25.333 -1.625 14.481 1.00 15.48 O ATOM 1327 CB MET B 1 24.274 -1.543 17.432 1.00 17.74 C ATOM 1328 CG MET B 1 23.121 -0.547 17.323 1.00 18.45 C ATOM 1329 SD MET B 1 23.348 0.902 18.372 1.00 20.84 S ATOM 1330 CE MET B 1 23.165 0.172 19.989 1.00 23.56 C ATOM 1331 HN3 MET B 1 26.306 -3.033 16.467 1.00 0.00 H ATOM 1332 HN2 MET B 1 25.387 -4.322 15.851 1.00 0.00 H ATOM 1333 HN1 MET B 1 25.372 -3.988 17.517 1.00 0.00 H ATOM 1334 N ARG B 2 23.100 -1.879 14.396 1.00 16.88 N ATOM 1335 CA ARG B 2 22.958 -1.259 13.091 1.00 16.86 C ATOM 1336 C ARG B 2 22.118 -0.014 13.305 1.00 16.68 C ATOM 1337 O ARG B 2 21.069 -0.072 13.945 1.00 16.30 O ATOM 1338 CB ARG B 2 22.258 -2.203 12.124 1.00 18.42 C ATOM 1339 H ARG B 2 22.252 -2.239 14.878 1.00 0.00 H ATOM 1340 N VAL B 3 22.588 1.110 12.782 1.00 16.75 N ATOM 1341 CA VAL B 3 21.870 2.367 12.925 1.00 15.63 C ATOM 1342 C VAL B 3 21.696 3.050 11.574 1.00 16.67 C ATOM 1343 O VAL B 3 22.634 3.137 10.786 1.00 17.60 O ATOM 1344 CB VAL B 3 22.625 3.338 13.859 1.00 16.37 C ATOM 1345 CG1 VAL B 3 21.771 4.580 14.129 1.00 18.23 C ATOM 1346 CG2 VAL B 3 22.987 2.636 15.161 1.00 16.89 C ATOM 1347 H VAL B 3 23.487 1.093 12.260 1.00 0.00 H ATOM 1348 N LEU B 4 20.482 3.511 11.300 1.00 15.21 N ATOM 1349 CA LEU B 4 20.217 4.234 10.064 1.00 14.91 C ATOM 1350 C LEU B 4 19.804 5.614 10.546 1.00 12.86 C ATOM 1351 O LEU B 4 18.825 5.752 11.280 1.00 11.34 O ATOM 1352 CB LEU B 4 19.086 3.581 9.271 1.00 17.52 C ATOM 1353 CG LEU B 4 18.733 4.271 7.949 1.00 19.88 C ATOM 1354 CD1 LEU B 4 19.973 4.406 7.071 1.00 19.19 C ATOM 1355 CD2 LEU B 4 17.664 3.468 7.239 1.00 19.34 C ATOM 1356 H LEU B 4 19.709 3.354 11.978 1.00 0.00 H ATOM 1357 N LEU B 5 20.569 6.629 10.157 1.00 11.38 N ATOM 1358 CA LEU B 5 20.296 7.993 10.581 1.00 12.37 C ATOM 1359 C LEU B 5 19.691 8.817 9.460 1.00 12.34 C ATOM 1360 O LEU B 5 20.315 9.021 8.417 1.00 12.33 O ATOM 1361 CB LEU B 5 21.585 8.651 11.074 1.00 12.95 C ATOM 1362 CG LEU B 5 22.198 8.014 12.326 1.00 13.75 C ATOM 1363 CD1 LEU B 5 23.622 8.497 12.492 1.00 15.24 C ATOM 1364 CD2 LEU B 5 21.360 8.376 13.550 1.00 16.19 C ATOM 1365 H LEU B 5 21.382 6.443 9.535 1.00 0.00 H ATOM 1366 N ILE B 6 18.469 9.285 9.691 1.00 10.63 N ATOM 1367 CA ILE B 6 17.749 10.082 8.705 1.00 11.33 C ATOM 1368 C ILE B 6 17.449 11.457 9.288 1.00 11.49 C ATOM 1369 O ILE B 6 16.719 11.564 10.272 1.00 10.17 O ATOM 1370 CB ILE B 6 16.396 9.423 8.330 1.00 12.60 C ATOM 1371 CG1 ILE B 6 16.614 7.998 7.807 1.00 14.45 C ATOM 1372 CG2 ILE B 6 15.665 10.291 7.309 1.00 12.36 C ATOM 1373 CD1 ILE B 6 17.468 7.904 6.566 1.00 16.19 C ATOM 1374 H ILE B 6 18.013 9.077 10.602 1.00 0.00 H ATOM 1375 N HIS B 7 18.021 12.505 8.698 1.00 10.15 N ATOM 1376 CA HIS B 7 17.762 13.865 9.169 1.00 11.76 C ATOM 1377 C HIS B 7 16.448 14.214 8.476 1.00 12.12 C ATOM 1378 O HIS B 7 16.387 14.288 7.245 1.00 11.63 O ATOM 1379 CB HIS B 7 18.902 14.799 8.745 1.00 11.94 C ATOM 1380 CG HIS B 7 18.812 16.179 9.326 1.00 11.59 C ATOM 1381 ND1 HIS B 7 18.223 16.445 10.545 1.00 15.30 N ATOM 1382 CD2 HIS B 7 19.254 17.369 8.856 1.00 9.98 C ATOM 1383 CE1 HIS B 7 18.302 17.740 10.798 1.00 11.03 C ATOM 1384 NE2 HIS B 7 18.922 18.323 9.788 1.00 14.91 N ATOM 1385 H HIS B 7 18.660 12.354 7.892 1.00 0.00 H ATOM 1386 N SER B 8 15.402 14.432 9.268 1.00 11.35 N ATOM 1387 CA SER B 8 14.070 14.669 8.714 1.00 10.45 C ATOM 1388 C SER B 8 13.340 15.929 9.142 1.00 10.98 C ATOM 1389 O SER B 8 13.630 16.513 10.184 1.00 11.96 O ATOM 1390 CB SER B 8 13.180 13.475 9.060 1.00 14.94 C ATOM 1391 OG SER B 8 13.953 12.296 9.180 1.00 19.91 O ATOM 1392 HG SER B 8 14.625 12.415 9.898 1.00 0.00 H ATOM 1393 H SER B 8 15.534 14.434 10.300 1.00 0.00 H ATOM 1394 N ASP B 9 12.364 16.327 8.332 1.00 9.38 N ATOM 1395 CA ASP B 9 11.558 17.496 8.644 1.00 10.61 C ATOM 1396 C ASP B 9 10.701 17.148 9.853 1.00 10.54 C ATOM 1397 O ASP B 9 10.317 18.021 10.633 1.00 10.97 O ATOM 1398 CB ASP B 9 10.683 17.865 7.447 1.00 10.57 C ATOM 1399 CG ASP B 9 11.507 18.203 6.215 1.00 13.65 C ATOM 1400 OD1 ASP B 9 12.306 19.158 6.282 1.00 11.43 O ATOM 1401 OD2 ASP B 9 11.359 17.513 5.186 1.00 14.15 O ATOM 1402 H ASP B 9 12.174 15.793 7.460 1.00 0.00 H ATOM 1403 N TYR B 10 10.416 15.858 10.012 1.00 10.92 N ATOM 1404 CA TYR B 10 9.619 15.391 11.139 1.00 11.31 C ATOM 1405 C TYR B 10 9.515 13.877 11.137 1.00 12.68 C ATOM 1406 O TYR B 10 9.908 13.211 10.177 1.00 10.13 O ATOM 1407 CB TYR B 10 8.201 15.966 11.065 1.00 14.33 C ATOM 1408 CG TYR B 10 7.350 15.332 9.983 1.00 14.28 C ATOM 1409 CD1 TYR B 10 6.685 14.124 10.209 1.00 17.83 C ATOM 1410 CD2 TYR B 10 7.259 15.909 8.715 1.00 15.59 C ATOM 1411 CE1 TYR B 10 5.956 13.502 9.201 1.00 21.13 C ATOM 1412 CE2 TYR B 10 6.527 15.293 7.693 1.00 19.14 C ATOM 1413 CZ TYR B 10 5.882 14.090 7.946 1.00 22.29 C ATOM 1414 OH TYR B 10 5.170 13.462 6.948 1.00 28.23 O ATOM 1415 HH TYR B 10 5.776 13.253 6.193 1.00 0.00 H ATOM 1416 H TYR B 10 10.769 15.169 9.318 1.00 0.00 H ATOM 1417 N ILE B 11 8.997 13.345 12.235 1.00 12.61 N ATOM 1418 CA ILE B 11 8.741 11.923 12.346 1.00 12.30 C ATOM 1419 C ILE B 11 7.458 11.790 13.147 1.00 13.17 C ATOM 1420 O ILE B 11 7.252 12.489 14.144 1.00 12.19 O ATOM 1421 CB ILE B 11 9.878 11.133 13.048 1.00 12.47 C ATOM 1422 CG1 ILE B 11 9.525 9.638 13.028 1.00 14.42 C ATOM 1423 CG2 ILE B 11 10.077 11.620 14.491 1.00 12.07 C ATOM 1424 CD1 ILE B 11 10.612 8.725 13.540 1.00 16.78 C ATOM 1425 H ILE B 11 8.768 13.965 13.038 1.00 0.00 H ATOM 1426 N GLU B 12 6.583 10.917 12.670 1.00 13.32 N ATOM 1427 CA GLU B 12 5.309 10.642 13.317 1.00 13.74 C ATOM 1428 C GLU B 12 5.246 9.134 13.466 1.00 12.89 C ATOM 1429 O GLU B 12 5.751 8.407 12.615 1.00 12.27 O ATOM 1430 CB GLU B 12 4.148 11.099 12.437 1.00 16.24 C ATOM 1431 CG GLU B 12 3.505 12.396 12.843 1.00 20.40 C ATOM 1432 CD GLU B 12 2.383 12.783 11.903 1.00 21.73 C ATOM 1433 OE1 GLU B 12 1.630 11.879 11.475 1.00 22.12 O ATOM 1434 OE2 GLU B 12 2.253 13.985 11.598 1.00 22.55 O ATOM 1435 H GLU B 12 6.817 10.406 11.795 1.00 0.00 H ATOM 1436 N TYR B 13 4.640 8.655 14.543 1.00 11.52 N ATOM 1437 CA TYR B 13 4.540 7.213 14.724 1.00 12.89 C ATOM 1438 C TYR B 13 3.227 6.852 15.391 1.00 12.60 C ATOM 1439 O TYR B 13 2.603 7.687 16.039 1.00 12.81 O ATOM 1440 CB TYR B 13 5.722 6.695 15.558 1.00 13.51 C ATOM 1441 CG TYR B 13 5.630 6.941 17.055 1.00 16.32 C ATOM 1442 CD1 TYR B 13 4.818 6.144 17.863 1.00 17.54 C ATOM 1443 CD2 TYR B 13 6.372 7.953 17.664 1.00 18.69 C ATOM 1444 CE1 TYR B 13 4.747 6.343 19.242 1.00 19.81 C ATOM 1445 CE2 TYR B 13 6.310 8.163 19.048 1.00 17.92 C ATOM 1446 CZ TYR B 13 5.492 7.350 19.828 1.00 19.36 C ATOM 1447 OH TYR B 13 5.414 7.538 21.190 1.00 19.69 O ATOM 1448 HH TYR B 13 4.790 6.875 21.578 1.00 0.00 H ATOM 1449 H TYR B 13 4.240 9.302 15.252 1.00 0.00 H ATOM 1450 N GLU B 14 2.809 5.605 15.211 1.00 12.91 N ATOM 1451 CA GLU B 14 1.579 5.117 15.816 1.00 14.31 C ATOM 1452 C GLU B 14 1.711 3.628 16.103 1.00 14.96 C ATOM 1453 O GLU B 14 1.952 2.838 15.197 1.00 11.32 O ATOM 1454 CB GLU B 14 0.376 5.341 14.885 1.00 16.37 C ATOM 1455 CG GLU B 14 -0.970 5.022 15.551 1.00 20.42 C ATOM 1456 CD GLU B 14 -2.148 5.053 14.587 1.00 23.70 C ATOM 1457 OE1 GLU B 14 -2.230 5.992 13.768 1.00 27.29 O ATOM 1458 OE2 GLU B 14 -3.004 4.145 14.659 1.00 26.68 O ATOM 1459 H GLU B 14 3.375 4.961 14.623 1.00 0.00 H ATOM 1460 N VAL B 15 1.572 3.250 17.370 1.00 15.70 N ATOM 1461 CA VAL B 15 1.631 1.843 17.751 1.00 16.16 C ATOM 1462 C VAL B 15 0.417 1.157 17.124 1.00 17.20 C ATOM 1463 O VAL B 15 -0.700 1.672 17.213 1.00 14.61 O ATOM 1464 CB VAL B 15 1.558 1.683 19.283 1.00 16.64 C ATOM 1465 CG1 VAL B 15 1.270 0.236 19.649 1.00 16.73 C ATOM 1466 CG2 VAL B 15 2.859 2.132 19.911 1.00 16.18 C ATOM 1467 H VAL B 15 1.418 3.971 18.104 1.00 0.00 H ATOM 1468 N LYS B 16 0.626 -0.004 16.510 1.00 18.21 N ATOM 1469 CA LYS B 16 -0.475 -0.718 15.865 1.00 20.80 C ATOM 1470 C LYS B 16 -0.891 -2.045 16.489 1.00 22.17 C ATOM 1471 O LYS B 16 -2.083 -2.367 16.552 1.00 23.88 O ATOM 1472 CB LYS B 16 -0.146 -0.969 14.397 1.00 22.00 C ATOM 1473 CG LYS B 16 -0.059 0.283 13.554 1.00 23.53 C ATOM 1474 CD LYS B 16 -0.010 -0.080 12.088 1.00 25.97 C ATOM 1475 CE LYS B 16 -1.268 -0.831 11.669 1.00 27.80 C ATOM 1476 NZ LYS B 16 -2.490 -0.020 11.918 1.00 28.24 N ATOM 1477 HZ1 LYS B 16 -2.558 0.200 12.932 1.00 0.00 H ATOM 1478 HZ2 LYS B 16 -2.435 0.864 11.373 1.00 0.00 H ATOM 1479 HZ3 LYS B 16 -3.329 -0.559 11.622 1.00 0.00 H ATOM 1480 H LYS B 16 1.584 -0.409 16.488 1.00 0.00 H ATOM 1481 N ASP B 17 0.091 -2.823 16.919 1.00 22.70 N ATOM 1482 CA ASP B 17 -0.154 -4.134 17.509 1.00 23.69 C ATOM 1483 C ASP B 17 1.107 -4.556 18.243 1.00 22.65 C ATOM 1484 O ASP B 17 2.214 -4.225 17.819 1.00 21.98 O ATOM 1485 CB ASP B 17 -0.437 -5.166 16.413 1.00 25.49 C ATOM 1486 CG ASP B 17 -1.914 -5.480 16.254 1.00 30.16 C ATOM 1487 OD1 ASP B 17 -2.681 -4.618 15.779 1.00 32.38 O ATOM 1488 OD2 ASP B 17 -2.313 -6.608 16.607 1.00 34.71 O ATOM 1489 H ASP B 17 1.071 -2.487 16.833 1.00 0.00 H ATOM 1490 N LYS B 18 0.952 -5.287 19.339 1.00 20.67 N ATOM 1491 CA LYS B 18 2.124 -5.747 20.064 1.00 19.93 C ATOM 1492 C LYS B 18 2.833 -6.766 19.178 1.00 19.04 C ATOM 1493 O LYS B 18 2.191 -7.480 18.402 1.00 19.55 O ATOM 1494 CB LYS B 18 1.721 -6.396 21.388 1.00 22.73 C ATOM 1495 CG LYS B 18 0.906 -7.666 21.242 1.00 25.60 C ATOM 1496 CD LYS B 18 0.595 -8.271 22.604 1.00 28.97 C ATOM 1497 CE LYS B 18 -0.234 -7.326 23.462 1.00 30.48 C ATOM 1498 NZ LYS B 18 -0.519 -7.927 24.797 1.00 35.02 N ATOM 1499 HZ1 LYS B 18 -1.047 -8.814 24.671 1.00 0.00 H ATOM 1500 HZ2 LYS B 18 0.378 -8.123 25.286 1.00 0.00 H ATOM 1501 HZ3 LYS B 18 -1.085 -7.262 25.361 1.00 0.00 H ATOM 1502 H LYS B 18 -0.001 -5.529 19.677 1.00 0.00 H ATOM 1503 N ALA B 19 4.155 -6.821 19.292 1.00 17.34 N ATOM 1504 CA ALA B 19 4.972 -7.743 18.514 1.00 16.04 C ATOM 1505 C ALA B 19 5.617 -8.765 19.442 1.00 17.34 C ATOM 1506 O ALA B 19 6.259 -9.711 18.991 1.00 19.03 O ATOM 1507 CB ALA B 19 6.042 -6.980 17.764 1.00 17.56 C ATOM 1508 H ALA B 19 4.626 -6.181 19.963 1.00 0.00 H ATOM 1509 N LEU B 20 5.462 -8.538 20.741 1.00 17.92 N ATOM 1510 CA LEU B 20 5.988 -9.427 21.772 1.00 18.67 C ATOM 1511 C LEU B 20 4.824 -9.691 22.716 1.00 18.59 C ATOM 1512 O LEU B 20 3.919 -8.863 22.826 1.00 17.42 O ATOM 1513 CB LEU B 20 7.131 -8.748 22.535 1.00 18.78 C ATOM 1514 CG LEU B 20 8.336 -8.278 21.716 1.00 18.85 C ATOM 1515 CD1 LEU B 20 9.292 -7.525 22.615 1.00 20.47 C ATOM 1516 CD2 LEU B 20 9.036 -9.470 21.075 1.00 21.79 C ATOM 1517 H LEU B 20 4.942 -7.688 21.037 1.00 0.00 H ATOM 1518 N LYS B 21 4.835 -10.834 23.397 1.00 19.03 N ATOM 1519 CA LYS B 21 3.747 -11.157 24.313 1.00 20.14 C ATOM 1520 C LYS B 21 3.626 -10.135 25.433 1.00 18.44 C ATOM 1521 O LYS B 21 2.520 -9.795 25.859 1.00 17.87 O ATOM 1522 CB LYS B 21 3.941 -12.560 24.897 1.00 21.48 C ATOM 1523 CG LYS B 21 3.843 -13.661 23.853 1.00 27.92 C ATOM 1524 CD LYS B 21 3.974 -15.045 24.470 1.00 31.11 C ATOM 1525 CE LYS B 21 3.967 -16.122 23.394 1.00 33.24 C ATOM 1526 NZ LYS B 21 4.064 -17.491 23.973 1.00 36.66 N ATOM 1527 HZ1 LYS B 21 4.949 -17.576 24.512 1.00 0.00 H ATOM 1528 HZ2 LYS B 21 3.255 -17.657 24.604 1.00 0.00 H ATOM 1529 HZ3 LYS B 21 4.056 -18.192 23.205 1.00 0.00 H ATOM 1530 H LYS B 21 5.624 -11.501 23.275 1.00 0.00 H ATOM 1531 N ASN B 22 4.768 -9.636 25.898 1.00 18.62 N ATOM 1532 CA ASN B 22 4.799 -8.650 26.971 1.00 16.40 C ATOM 1533 C ASN B 22 5.679 -7.469 26.583 1.00 17.07 C ATOM 1534 O ASN B 22 6.826 -7.362 27.017 1.00 16.43 O ATOM 1535 CB ASN B 22 5.332 -9.293 28.251 1.00 18.78 C ATOM 1536 CG ASN B 22 4.413 -10.376 28.778 1.00 16.08 C ATOM 1537 OD1 ASN B 22 3.451 -10.094 29.490 1.00 21.30 O ATOM 1538 ND2 ASN B 22 4.693 -11.621 28.413 1.00 16.94 N ATOM 1539 HD22 ASN B 22 5.518 -11.813 27.809 1.00 0.00 H ATOM 1540 HD21 ASN B 22 4.088 -12.405 28.731 1.00 0.00 H ATOM 1541 H ASN B 22 5.666 -9.959 25.484 1.00 0.00 H ATOM 1542 N PRO B 23 5.144 -6.557 25.762 1.00 16.77 N ATOM 1543 CA PRO B 23 5.904 -5.385 25.325 1.00 16.95 C ATOM 1544 C PRO B 23 6.042 -4.360 26.438 1.00 18.15 C ATOM 1545 O PRO B 23 5.567 -4.567 27.558 1.00 16.30 O ATOM 1546 CB PRO B 23 5.069 -4.862 24.167 1.00 14.25 C ATOM 1547 CG PRO B 23 3.685 -5.096 24.669 1.00 15.97 C ATOM 1548 CD PRO B 23 3.770 -6.511 25.229 1.00 16.27 C ATOM 1549 N GLU B 24 6.686 -3.245 26.116 1.00 18.78 N ATOM 1550 CA GLU B 24 6.891 -2.175 27.076 1.00 19.96 C ATOM 1551 C GLU B 24 5.552 -1.595 27.520 1.00 21.10 C ATOM 1552 O GLU B 24 4.736 -1.188 26.694 1.00 19.66 O ATOM 1553 CB GLU B 24 7.763 -1.082 26.452 1.00 23.39 C ATOM 1554 CG GLU B 24 7.974 0.143 27.327 1.00 24.41 C ATOM 1555 CD GLU B 24 9.122 1.004 26.839 1.00 27.01 C ATOM 1556 OE1 GLU B 24 9.214 1.237 25.614 1.00 25.26 O ATOM 1557 OE2 GLU B 24 9.930 1.449 27.681 1.00 27.17 O ATOM 1558 H GLU B 24 7.054 -3.135 25.150 1.00 0.00 H ATOM 1559 N PRO B 25 5.306 -1.566 28.840 1.00 22.32 N ATOM 1560 CA PRO B 25 4.055 -1.028 29.377 1.00 23.50 C ATOM 1561 C PRO B 25 4.010 0.476 29.157 1.00 24.72 C ATOM 1562 O PRO B 25 4.795 1.222 29.747 1.00 28.28 O ATOM 1563 CB PRO B 25 4.130 -1.398 30.853 1.00 23.41 C ATOM 1564 CG PRO B 25 5.582 -1.323 31.133 1.00 23.94 C ATOM 1565 CD PRO B 25 6.191 -2.011 29.930 1.00 23.24 C ATOM 1566 N ILE B 26 3.096 0.912 28.300 1.00 25.28 N ATOM 1567 CA ILE B 26 2.956 2.325 27.978 1.00 25.26 C ATOM 1568 C ILE B 26 1.524 2.794 28.195 1.00 25.63 C ATOM 1569 O ILE B 26 0.600 1.985 28.270 1.00 24.27 O ATOM 1570 CB ILE B 26 3.318 2.596 26.502 1.00 26.38 C ATOM 1571 CG1 ILE B 26 2.386 1.793 25.589 1.00 27.09 C ATOM 1572 CG2 ILE B 26 4.769 2.223 26.239 1.00 24.52 C ATOM 1573 CD1 ILE B 26 2.608 2.033 24.108 1.00 27.34 C ATOM 1574 H ILE B 26 2.461 0.225 27.845 1.00 0.00 H ATOM 1575 N SER B 27 1.345 4.106 28.298 1.00 24.89 N ATOM 1576 CA SER B 27 0.020 4.676 28.477 1.00 25.54 C ATOM 1577 C SER B 27 -0.540 4.982 27.091 1.00 26.93 C ATOM 1578 O SER B 27 0.209 5.063 26.119 1.00 25.23 O ATOM 1579 CB SER B 27 0.100 5.949 29.325 1.00 24.78 C ATOM 1580 OG SER B 27 1.113 6.815 28.853 1.00 28.46 O ATOM 1581 HG SER B 27 0.917 7.070 27.917 1.00 0.00 H ATOM 1582 H SER B 27 2.169 4.738 28.250 1.00 0.00 H ATOM 1583 N GLU B 28 -1.855 5.141 27.002 1.00 28.14 N ATOM 1584 CA GLU B 28 -2.515 5.408 25.728 1.00 31.13 C ATOM 1585 C GLU B 28 -1.876 6.547 24.932 1.00 30.10 C ATOM 1586 O GLU B 28 -1.749 6.461 23.710 1.00 30.78 O ATOM 1587 CB GLU B 28 -3.997 5.712 25.970 1.00 33.80 C ATOM 1588 CG GLU B 28 -4.848 5.811 24.710 1.00 38.34 C ATOM 1589 CD GLU B 28 -4.819 4.542 23.874 1.00 41.17 C ATOM 1590 OE1 GLU B 28 -4.775 3.440 24.464 1.00 42.35 O ATOM 1591 OE2 GLU B 28 -4.853 4.643 22.628 1.00 42.39 O ATOM 1592 H GLU B 28 -2.431 5.073 27.865 1.00 0.00 H ATOM 1593 N ASP B 29 -1.468 7.607 25.623 1.00 29.71 N ATOM 1594 CA ASP B 29 -0.860 8.758 24.961 1.00 28.61 C ATOM 1595 C ASP B 29 0.504 8.461 24.345 1.00 27.17 C ATOM 1596 O ASP B 29 0.938 9.159 23.427 1.00 28.05 O ATOM 1597 CB ASP B 29 -0.731 9.927 25.940 1.00 29.37 C ATOM 1598 CG ASP B 29 0.063 9.565 27.177 1.00 30.94 C ATOM 1599 OD1 ASP B 29 -0.417 8.721 27.965 1.00 32.63 O ATOM 1600 OD2 ASP B 29 1.166 10.120 27.360 1.00 30.51 O ATOM 1601 H ASP B 29 -1.584 7.617 26.656 1.00 0.00 H ATOM 1602 N MET B 30 1.180 7.436 24.852 1.00 24.67 N ATOM 1603 CA MET B 30 2.490 7.057 24.333 1.00 23.04 C ATOM 1604 C MET B 30 2.350 6.267 23.029 1.00 21.48 C ATOM 1605 O MET B 30 3.340 5.980 22.361 1.00 18.91 O ATOM 1606 CB MET B 30 3.247 6.211 25.360 1.00 24.45 C ATOM 1607 CG MET B 30 3.623 6.950 26.632 1.00 27.62 C ATOM 1608 SD MET B 30 4.399 5.863 27.852 1.00 30.10 S ATOM 1609 CE MET B 30 6.093 5.803 27.246 1.00 29.11 C ATOM 1610 H MET B 30 0.767 6.892 25.636 1.00 0.00 H ATOM 1611 N LYS B 31 1.114 5.928 22.673 1.00 19.89 N ATOM 1612 CA LYS B 31 0.840 5.170 21.460 1.00 18.95 C ATOM 1613 C LYS B 31 1.110 5.947 20.179 1.00 18.20 C ATOM 1614 O LYS B 31 1.290 5.355 19.120 1.00 16.79 O ATOM 1615 CB LYS B 31 -0.607 4.672 21.465 1.00 20.72 C ATOM 1616 CG LYS B 31 -0.805 3.388 22.252 1.00 25.09 C ATOM 1617 CD LYS B 31 -2.275 3.009 22.341 1.00 29.13 C ATOM 1618 CE LYS B 31 -2.446 1.558 22.772 1.00 32.15 C ATOM 1619 NZ LYS B 31 -1.664 1.241 23.996 1.00 34.52 N ATOM 1620 HZ1 LYS B 31 -0.654 1.408 23.813 1.00 0.00 H ATOM 1621 HZ2 LYS B 31 -1.982 1.850 24.776 1.00 0.00 H ATOM 1622 HZ3 LYS B 31 -1.811 0.244 24.251 1.00 0.00 H ATOM 1623 H LYS B 31 0.319 6.213 23.280 1.00 0.00 H ATOM 1624 N ARG B 32 1.133 7.272 20.275 1.00 16.70 N ATOM 1625 CA ARG B 32 1.393 8.107 19.109 1.00 16.92 C ATOM 1626 C ARG B 32 2.279 9.277 19.500 1.00 17.16 C ATOM 1627 O ARG B 32 2.286 9.704 20.654 1.00 17.54 O ATOM 1628 CB ARG B 32 0.085 8.619 18.524 1.00 16.56 C ATOM 1629 H ARG B 32 0.963 7.721 21.198 1.00 0.00 H ATOM 1630 N GLY B 33 3.028 9.794 18.535 1.00 15.76 N ATOM 1631 CA GLY B 33 3.897 10.917 18.817 1.00 14.53 C ATOM 1632 C GLY B 33 4.460 11.538 17.558 1.00 14.12 C ATOM 1633 O GLY B 33 4.409 10.945 16.481 1.00 12.19 O ATOM 1634 H GLY B 33 2.991 9.393 17.576 1.00 0.00 H ATOM 1635 N ARG B 34 4.992 12.744 17.700 1.00 12.86 N ATOM 1636 CA ARG B 34 5.584 13.456 16.579 1.00 13.05 C ATOM 1637 C ARG B 34 6.656 14.430 17.059 1.00 13.16 C ATOM 1638 O ARG B 34 6.515 15.068 18.109 1.00 14.02 O ATOM 1639 CB ARG B 34 4.510 14.217 15.790 1.00 13.98 C ATOM 1640 CG ARG B 34 5.101 15.215 14.799 1.00 14.88 C ATOM 1641 CD ARG B 34 4.146 15.629 13.694 1.00 15.33 C ATOM 1642 NE ARG B 34 4.759 16.662 12.858 1.00 14.12 N ATOM 1643 CZ ARG B 34 4.569 16.795 11.549 1.00 14.69 C ATOM 1644 NH1 ARG B 34 3.773 15.959 10.896 1.00 16.85 N ATOM 1645 NH2 ARG B 34 5.188 17.764 10.889 1.00 13.46 N ATOM 1646 HE ARG B 34 5.391 17.344 13.323 1.00 0.00 H ATOM 1647 HH12 ARG B 34 3.630 16.070 9.872 1.00 0.00 H ATOM 1648 HH11 ARG B 34 3.292 15.192 11.408 1.00 0.00 H ATOM 1649 HH22 ARG B 34 5.042 17.871 9.865 1.00 0.00 H ATOM 1650 HH21 ARG B 34 5.820 18.417 11.395 1.00 0.00 H ATOM 1651 H ARG B 34 4.986 13.193 18.638 1.00 0.00 H ATOM 1652 N MET B 35 7.729 14.530 16.285 1.00 10.81 N ATOM 1653 CA MET B 35 8.833 15.429 16.595 1.00 11.85 C ATOM 1654 C MET B 35 9.271 16.108 15.298 1.00 11.79 C ATOM 1655 O MET B 35 9.369 15.454 14.256 1.00 12.31 O ATOM 1656 CB MET B 35 10.004 14.647 17.202 1.00 12.00 C ATOM 1657 CG MET B 35 11.179 15.522 17.620 1.00 12.68 C ATOM 1658 SD MET B 35 12.458 14.611 18.508 1.00 15.03 S ATOM 1659 CE MET B 35 11.991 14.928 20.214 1.00 17.32 C ATOM 1660 H MET B 35 7.784 13.946 15.426 1.00 0.00 H ATOM 1661 N GLU B 36 9.525 17.415 15.370 1.00 11.62 N ATOM 1662 CA GLU B 36 9.944 18.208 14.207 1.00 11.99 C ATOM 1663 C GLU B 36 11.465 18.345 14.096 1.00 11.91 C ATOM 1664 O GLU B 36 12.174 18.207 15.092 1.00 12.58 O ATOM 1665 CB GLU B 36 9.377 19.625 14.304 1.00 14.27 C ATOM 1666 CG GLU B 36 7.926 19.731 14.733 1.00 14.16 C ATOM 1667 CD GLU B 36 6.957 19.234 13.676 1.00 14.75 C ATOM 1668 OE1 GLU B 36 7.347 19.166 12.490 1.00 11.79 O ATOM 1669 OE2 GLU B 36 5.798 18.932 14.032 1.00 14.37 O ATOM 1670 H GLU B 36 9.422 17.893 16.288 1.00 0.00 H ATOM 1671 N GLU B 37 11.943 18.642 12.883 1.00 9.78 N ATOM 1672 CA GLU B 37 13.366 18.869 12.612 1.00 11.18 C ATOM 1673 C GLU B 37 14.193 17.934 13.467 1.00 10.23 C ATOM 1674 O GLU B 37 14.849 18.354 14.422 1.00 12.78 O ATOM 1675 CB GLU B 37 13.694 20.323 12.939 1.00 10.78 C ATOM 1676 CG GLU B 37 12.782 21.290 12.211 1.00 11.65 C ATOM 1677 CD GLU B 37 12.806 21.046 10.717 1.00 12.58 C ATOM 1678 OE1 GLU B 37 13.921 21.008 10.160 1.00 14.91 O ATOM 1679 OE2 GLU B 37 11.723 20.893 10.109 1.00 10.70 O ATOM 1680 H GLU B 37 11.272 18.716 12.092 1.00 0.00 H ATOM 1681 N VAL B 38 14.206 16.672 13.067 1.00 10.46 N ATOM 1682 CA VAL B 38 14.837 15.641 13.867 1.00 10.74 C ATOM 1683 C VAL B 38 15.757 14.666 13.158 1.00 10.15 C ATOM 1684 O VAL B 38 15.516 14.269 12.016 1.00 11.87 O ATOM 1685 CB VAL B 38 13.715 14.823 14.557 1.00 11.60 C ATOM 1686 CG1 VAL B 38 12.738 14.307 13.489 1.00 11.67 C ATOM 1687 CG2 VAL B 38 14.289 13.658 15.353 1.00 11.51 C ATOM 1688 H VAL B 38 13.756 16.416 12.165 1.00 0.00 H ATOM 1689 N LEU B 39 16.816 14.284 13.861 1.00 11.27 N ATOM 1690 CA LEU B 39 17.738 13.286 13.356 1.00 10.23 C ATOM 1691 C LEU B 39 17.146 11.993 13.917 1.00 10.85 C ATOM 1692 O LEU B 39 17.187 11.753 15.126 1.00 11.62 O ATOM 1693 CB LEU B 39 19.149 13.493 13.913 1.00 9.62 C ATOM 1694 CG LEU B 39 20.153 12.418 13.478 1.00 9.87 C ATOM 1695 CD1 LEU B 39 20.267 12.415 11.954 1.00 13.01 C ATOM 1696 CD2 LEU B 39 21.516 12.684 14.123 1.00 11.75 C ATOM 1697 H LEU B 39 16.988 14.710 14.794 1.00 0.00 H ATOM 1698 N VAL B 40 16.556 11.184 13.049 1.00 10.39 N ATOM 1699 CA VAL B 40 15.956 9.934 13.493 1.00 11.79 C ATOM 1700 C VAL B 40 16.977 8.814 13.464 1.00 11.40 C ATOM 1701 O VAL B 40 17.617 8.570 12.443 1.00 10.99 O ATOM 1702 CB VAL B 40 14.770 9.525 12.605 1.00 10.95 C ATOM 1703 CG1 VAL B 40 14.102 8.286 13.186 1.00 10.20 C ATOM 1704 CG2 VAL B 40 13.781 10.670 12.501 1.00 11.02 C ATOM 1705 H VAL B 40 16.521 11.444 12.043 1.00 0.00 H ATOM 1706 N ALA B 41 17.128 8.134 14.595 1.00 12.26 N ATOM 1707 CA ALA B 41 18.065 7.032 14.683 1.00 10.74 C ATOM 1708 C ALA B 41 17.294 5.721 14.721 1.00 12.27 C ATOM 1709 O ALA B 41 16.770 5.326 15.764 1.00 11.97 O ATOM 1710 CB ALA B 41 18.937 7.173 15.934 1.00 11.79 C ATOM 1711 H ALA B 41 16.566 8.396 15.430 1.00 0.00 H ATOM 1712 N PHE B 42 17.190 5.078 13.562 1.00 11.11 N ATOM 1713 CA PHE B 42 16.521 3.791 13.446 1.00 12.06 C ATOM 1714 C PHE B 42 17.583 2.809 13.922 1.00 11.91 C ATOM 1715 O PHE B 42 18.676 2.758 13.359 1.00 13.41 O ATOM 1716 CB PHE B 42 16.144 3.533 11.985 1.00 11.39 C ATOM 1717 CG PHE B 42 14.974 4.353 11.510 1.00 13.04 C ATOM 1718 CD1 PHE B 42 13.675 4.014 11.884 1.00 12.57 C ATOM 1719 CD2 PHE B 42 15.170 5.475 10.708 1.00 12.24 C ATOM 1720 CE1 PHE B 42 12.587 4.782 11.467 1.00 14.16 C ATOM 1721 CE2 PHE B 42 14.085 6.252 10.283 1.00 14.37 C ATOM 1722 CZ PHE B 42 12.794 5.903 10.664 1.00 11.71 C ATOM 1723 H PHE B 42 17.601 5.509 12.709 1.00 0.00 H ATOM 1724 N ILE B 43 17.271 2.041 14.960 1.00 11.53 N ATOM 1725 CA ILE B 43 18.248 1.118 15.527 1.00 11.33 C ATOM 1726 C ILE B 43 17.810 -0.330 15.685 1.00 11.72 C ATOM 1727 O ILE B 43 16.711 -0.617 16.156 1.00 10.81 O ATOM 1728 CB ILE B 43 18.705 1.605 16.930 1.00 11.72 C ATOM 1729 CG1 ILE B 43 19.348 2.985 16.825 1.00 12.89 C ATOM 1730 CG2 ILE B 43 19.690 0.608 17.547 1.00 16.02 C ATOM 1731 CD1 ILE B 43 19.596 3.639 18.165 1.00 12.44 C ATOM 1732 H ILE B 43 16.318 2.098 15.374 1.00 0.00 H ATOM 1733 N SER B 44 18.699 -1.234 15.291 1.00 13.10 N ATOM 1734 CA SER B 44 18.479 -2.665 15.451 1.00 13.53 C ATOM 1735 C SER B 44 19.626 -3.139 16.341 1.00 14.33 C ATOM 1736 O SER B 44 20.794 -2.983 15.985 1.00 13.98 O ATOM 1737 CB SER B 44 18.547 -3.398 14.113 1.00 14.97 C ATOM 1738 OG SER B 44 18.399 -4.792 14.319 1.00 17.32 O ATOM 1739 HG SER B 44 17.524 -4.970 14.746 1.00 0.00 H ATOM 1740 H SER B 44 19.584 -0.909 14.852 1.00 0.00 H ATOM 1741 N VAL B 45 19.302 -3.691 17.504 1.00 14.53 N ATOM 1742 CA VAL B 45 20.345 -4.173 18.407 1.00 16.37 C ATOM 1743 C VAL B 45 20.693 -5.596 17.985 1.00 15.82 C ATOM 1744 O VAL B 45 19.814 -6.445 17.871 1.00 17.86 O ATOM 1745 CB VAL B 45 19.865 -4.148 19.865 1.00 16.79 C ATOM 1746 CG1 VAL B 45 21.000 -4.554 20.795 1.00 16.09 C ATOM 1747 CG2 VAL B 45 19.380 -2.745 20.216 1.00 16.41 C ATOM 1748 H VAL B 45 18.302 -3.781 17.774 1.00 0.00 H ATOM 1749 N GLU B 46 21.977 -5.844 17.748 1.00 17.92 N ATOM 1750 CA GLU B 46 22.437 -7.149 17.288 1.00 19.75 C ATOM 1751 C GLU B 46 22.993 -8.081 18.357 1.00 20.63 C ATOM 1752 O GLU B 46 23.417 -7.647 19.427 1.00 20.24 O ATOM 1753 CB GLU B 46 23.483 -6.953 16.192 1.00 19.08 C ATOM 1754 CG GLU B 46 22.989 -6.084 15.045 1.00 20.00 C ATOM 1755 CD GLU B 46 24.064 -5.810 14.018 1.00 19.48 C ATOM 1756 OE1 GLU B 46 25.049 -5.122 14.358 1.00 21.55 O ATOM 1757 OE2 GLU B 46 23.920 -6.284 12.871 1.00 22.80 O ATOM 1758 H GLU B 46 22.673 -5.086 17.895 1.00 0.00 H ATOM 1759 N LYS B 47 22.989 -9.371 18.035 1.00 20.73 N ATOM 1760 CA LYS B 47 23.484 -10.409 18.929 1.00 23.36 C ATOM 1761 C LYS B 47 24.861 -10.083 19.513 1.00 22.98 C ATOM 1762 O LYS B 47 25.097 -10.280 20.706 1.00 23.44 O ATOM 1763 CB LYS B 47 23.540 -11.743 18.175 1.00 24.48 C ATOM 1764 CG LYS B 47 24.102 -12.904 18.978 1.00 27.25 C ATOM 1765 CD LYS B 47 23.167 -13.310 20.102 1.00 29.07 C ATOM 1766 CE LYS B 47 23.761 -14.444 20.920 1.00 30.88 C ATOM 1767 NZ LYS B 47 22.859 -14.845 22.032 1.00 32.65 N ATOM 1768 HZ1 LYS B 47 22.703 -14.031 22.661 1.00 0.00 H ATOM 1769 HZ2 LYS B 47 21.949 -15.162 21.641 1.00 0.00 H ATOM 1770 HZ3 LYS B 47 23.296 -15.621 22.569 1.00 0.00 H ATOM 1771 H LYS B 47 22.617 -9.651 17.105 1.00 0.00 H ATOM 1772 N VAL B 48 25.768 -9.580 18.680 1.00 23.36 N ATOM 1773 CA VAL B 48 27.111 -9.253 19.147 1.00 23.29 C ATOM 1774 C VAL B 48 27.138 -8.149 20.200 1.00 22.40 C ATOM 1775 O VAL B 48 28.112 -8.024 20.939 1.00 22.26 O ATOM 1776 CB VAL B 48 28.038 -8.845 17.981 1.00 24.72 C ATOM 1777 CG1 VAL B 48 28.253 -10.032 17.054 1.00 25.51 C ATOM 1778 CG2 VAL B 48 27.445 -7.669 17.223 1.00 24.27 C ATOM 1779 H VAL B 48 25.517 -9.418 17.684 1.00 0.00 H ATOM 1780 N ASP B 49 26.074 -7.354 20.276 1.00 19.57 N ATOM 1781 CA ASP B 49 26.014 -6.272 21.254 1.00 19.41 C ATOM 1782 C ASP B 49 25.829 -6.804 22.678 1.00 19.53 C ATOM 1783 O ASP B 49 26.236 -6.162 23.645 1.00 19.06 O ATOM 1784 CB ASP B 49 24.861 -5.310 20.932 1.00 19.78 C ATOM 1785 CG ASP B 49 24.969 -4.705 19.545 1.00 20.81 C ATOM 1786 OD1 ASP B 49 26.105 -4.483 19.079 1.00 21.79 O ATOM 1787 OD2 ASP B 49 23.915 -4.436 18.928 1.00 22.01 O ATOM 1788 H ASP B 49 25.274 -7.506 19.629 1.00 0.00 H ATOM 1789 N GLU B 50 25.221 -7.978 22.798 1.00 20.69 N ATOM 1790 CA GLU B 50 24.961 -8.576 24.103 1.00 22.59 C ATOM 1791 C GLU B 50 26.224 -8.735 24.943 1.00 24.00 C ATOM 1792 O GLU B 50 26.148 -8.876 26.164 1.00 24.13 O ATOM 1793 CB GLU B 50 24.296 -9.944 23.933 1.00 23.54 C ATOM 1794 CG GLU B 50 23.134 -9.962 22.954 1.00 24.18 C ATOM 1795 CD GLU B 50 22.426 -11.300 22.927 1.00 26.15 C ATOM 1796 OE1 GLU B 50 23.084 -12.327 23.206 1.00 25.02 O ATOM 1797 OE2 GLU B 50 21.216 -11.327 22.615 1.00 25.47 O ATOM 1798 H GLU B 50 24.922 -8.484 21.940 1.00 0.00 H ATOM 1799 N LYS B 51 27.379 -8.705 24.287 1.00 24.18 N ATOM 1800 CA LYS B 51 28.658 -8.861 24.972 1.00 25.43 C ATOM 1801 C LYS B 51 29.006 -7.669 25.862 1.00 25.00 C ATOM 1802 O LYS B 51 29.652 -7.831 26.898 1.00 25.61 O ATOM 1803 CB LYS B 51 29.778 -9.059 23.945 1.00 27.33 C ATOM 1804 CG LYS B 51 29.530 -10.180 22.948 1.00 30.47 C ATOM 1805 CD LYS B 51 30.570 -10.160 21.833 1.00 31.36 C ATOM 1806 CE LYS B 51 30.321 -11.273 20.825 1.00 33.09 C ATOM 1807 NZ LYS B 51 31.309 -11.264 19.708 1.00 31.89 N ATOM 1808 HZ1 LYS B 51 31.252 -10.356 19.204 1.00 0.00 H ATOM 1809 HZ2 LYS B 51 32.267 -11.389 20.093 1.00 0.00 H ATOM 1810 HZ3 LYS B 51 31.094 -12.041 19.051 1.00 0.00 H ATOM 1811 H LYS B 51 27.371 -8.566 23.256 1.00 0.00 H ATOM 1812 N ASN B 52 28.574 -6.474 25.470 1.00 22.89 N ATOM 1813 CA ASN B 52 28.890 -5.279 26.243 1.00 22.48 C ATOM 1814 C ASN B 52 27.909 -4.138 25.963 1.00 21.29 C ATOM 1815 O ASN B 52 28.236 -3.191 25.248 1.00 21.82 O ATOM 1816 CB ASN B 52 30.313 -4.824 25.903 1.00 22.80 C ATOM 1817 CG ASN B 52 30.913 -3.922 26.964 1.00 23.07 C ATOM 1818 OD1 ASN B 52 30.220 -3.108 27.574 1.00 24.49 O ATOM 1819 ND2 ASN B 52 32.217 -4.052 27.174 1.00 22.09 N ATOM 1820 HD22 ASN B 52 32.763 -4.754 26.635 1.00 0.00 H ATOM 1821 HD21 ASN B 52 32.693 -3.452 27.878 1.00 0.00 H ATOM 1822 H ASN B 52 28.005 -6.391 24.603 1.00 0.00 H ATOM 1823 N PRO B 53 26.695 -4.213 26.530 1.00 20.70 N ATOM 1824 CA PRO B 53 25.674 -3.177 26.334 1.00 20.07 C ATOM 1825 C PRO B 53 26.186 -1.762 26.599 1.00 20.23 C ATOM 1826 O PRO B 53 25.918 -0.840 25.830 1.00 19.35 O ATOM 1827 CB PRO B 53 24.582 -3.591 27.314 1.00 19.38 C ATOM 1828 CG PRO B 53 24.661 -5.087 27.262 1.00 20.76 C ATOM 1829 CD PRO B 53 26.157 -5.327 27.332 1.00 19.45 C ATOM 1830 N GLU B 54 26.930 -1.594 27.689 1.00 19.99 N ATOM 1831 CA GLU B 54 27.459 -0.283 28.046 1.00 20.47 C ATOM 1832 C GLU B 54 28.394 0.303 26.989 1.00 20.43 C ATOM 1833 O GLU B 54 28.250 1.461 26.610 1.00 20.34 O ATOM 1834 CB GLU B 54 28.181 -0.359 29.392 1.00 20.52 C ATOM 1835 H GLU B 54 27.138 -2.412 28.297 1.00 0.00 H ATOM 1836 N GLU B 55 29.354 -0.492 26.524 1.00 20.33 N ATOM 1837 CA GLU B 55 30.308 -0.027 25.522 1.00 21.97 C ATOM 1838 C GLU B 55 29.631 0.306 24.197 1.00 20.91 C ATOM 1839 O GLU B 55 29.912 1.344 23.599 1.00 21.61 O ATOM 1840 CB GLU B 55 31.392 -1.078 25.270 1.00 23.67 C ATOM 1841 CG GLU B 55 32.473 -0.603 24.304 1.00 27.57 C ATOM 1842 CD GLU B 55 33.472 -1.691 23.948 1.00 30.14 C ATOM 1843 OE1 GLU B 55 33.997 -2.342 24.873 1.00 33.51 O ATOM 1844 OE2 GLU B 55 33.738 -1.887 22.744 1.00 31.30 O ATOM 1845 H GLU B 55 29.426 -1.466 26.882 1.00 0.00 H ATOM 1846 N VAL B 56 28.752 -0.580 23.736 1.00 21.14 N ATOM 1847 CA VAL B 56 28.053 -0.358 22.473 1.00 21.06 C ATOM 1848 C VAL B 56 27.179 0.887 22.559 1.00 20.02 C ATOM 1849 O VAL B 56 27.125 1.683 21.621 1.00 18.79 O ATOM 1850 CB VAL B 56 27.161 -1.555 22.092 1.00 22.45 C ATOM 1851 CG1 VAL B 56 26.528 -1.317 20.727 1.00 23.25 C ATOM 1852 CG2 VAL B 56 27.980 -2.816 22.060 1.00 25.07 C ATOM 1853 H VAL B 56 28.560 -1.443 24.283 1.00 0.00 H ATOM 1854 N SER B 57 26.491 1.051 23.684 1.00 19.19 N ATOM 1855 CA SER B 57 25.636 2.214 23.869 1.00 19.04 C ATOM 1856 C SER B 57 26.479 3.480 23.866 1.00 18.69 C ATOM 1857 O SER B 57 26.103 4.474 23.256 1.00 17.42 O ATOM 1858 CB SER B 57 24.865 2.106 25.184 1.00 17.87 C ATOM 1859 OG SER B 57 24.060 0.943 25.187 1.00 20.80 O ATOM 1860 HG SER B 57 24.636 0.144 25.083 1.00 0.00 H ATOM 1861 H SER B 57 26.564 0.341 24.440 1.00 0.00 H ATOM 1862 N LEU B 58 27.622 3.442 24.549 1.00 18.65 N ATOM 1863 CA LEU B 58 28.506 4.603 24.600 1.00 19.36 C ATOM 1864 C LEU B 58 28.923 5.028 23.194 1.00 18.35 C ATOM 1865 O LEU B 58 28.858 6.214 22.845 1.00 17.43 O ATOM 1866 CB LEU B 58 29.747 4.291 25.448 1.00 21.02 C ATOM 1867 CG LEU B 58 30.809 5.396 25.563 1.00 23.75 C ATOM 1868 CD1 LEU B 58 31.697 5.122 26.767 1.00 26.05 C ATOM 1869 CD2 LEU B 58 31.647 5.469 24.286 1.00 26.09 C ATOM 1870 H LEU B 58 27.889 2.572 25.053 1.00 0.00 H ATOM 1871 N LYS B 59 29.356 4.057 22.392 1.00 17.43 N ATOM 1872 CA LYS B 59 29.778 4.322 21.021 1.00 17.44 C ATOM 1873 C LYS B 59 28.622 4.857 20.179 1.00 16.99 C ATOM 1874 O LYS B 59 28.805 5.759 19.362 1.00 18.37 O ATOM 1875 CB LYS B 59 30.319 3.049 20.369 1.00 18.18 C ATOM 1876 CG LYS B 59 31.599 2.509 20.984 1.00 20.20 C ATOM 1877 CD LYS B 59 32.068 1.288 20.213 1.00 23.54 C ATOM 1878 CE LYS B 59 33.346 0.708 20.793 1.00 26.99 C ATOM 1879 NZ LYS B 59 33.803 -0.458 19.989 1.00 31.16 N ATOM 1880 HZ1 LYS B 59 33.066 -1.192 19.995 1.00 0.00 H ATOM 1881 HZ2 LYS B 59 33.983 -0.154 19.011 1.00 0.00 H ATOM 1882 HZ3 LYS B 59 34.678 -0.840 20.401 1.00 0.00 H ATOM 1883 H LYS B 59 29.394 3.083 22.753 1.00 0.00 H ATOM 1884 N ALA B 60 27.435 4.293 20.374 1.00 17.22 N ATOM 1885 CA ALA B 60 26.257 4.726 19.624 1.00 17.51 C ATOM 1886 C ALA B 60 25.944 6.174 19.971 1.00 17.48 C ATOM 1887 O ALA B 60 25.678 6.995 19.091 1.00 16.66 O ATOM 1888 CB ALA B 60 25.065 3.833 19.955 1.00 17.90 C ATOM 1889 H ALA B 60 27.342 3.529 21.073 1.00 0.00 H ATOM 1890 N ILE B 61 25.979 6.480 21.263 1.00 16.56 N ATOM 1891 CA ILE B 61 25.721 7.831 21.734 1.00 17.21 C ATOM 1892 C ILE B 61 26.724 8.774 21.088 1.00 17.58 C ATOM 1893 O ILE B 61 26.370 9.857 20.631 1.00 19.01 O ATOM 1894 CB ILE B 61 25.860 7.911 23.266 1.00 17.78 C ATOM 1895 CG1 ILE B 61 24.813 7.002 23.916 1.00 17.39 C ATOM 1896 CG2 ILE B 61 25.697 9.350 23.733 1.00 17.28 C ATOM 1897 CD1 ILE B 61 25.017 6.786 25.403 1.00 18.09 C ATOM 1898 H ILE B 61 26.196 5.735 21.955 1.00 0.00 H ATOM 1899 N GLU B 62 27.979 8.347 21.044 1.00 19.45 N ATOM 1900 CA GLU B 62 29.037 9.154 20.452 1.00 20.42 C ATOM 1901 C GLU B 62 28.813 9.371 18.955 1.00 18.95 C ATOM 1902 O GLU B 62 28.886 10.500 18.471 1.00 18.48 O ATOM 1903 CB GLU B 62 30.394 8.481 20.687 1.00 23.35 C ATOM 1904 CG GLU B 62 31.594 9.307 20.256 1.00 27.45 C ATOM 1905 CD GLU B 62 31.628 10.678 20.907 1.00 32.01 C ATOM 1906 OE1 GLU B 62 31.450 10.764 22.143 1.00 32.30 O ATOM 1907 OE2 GLU B 62 31.840 11.673 20.181 1.00 36.16 O ATOM 1908 H GLU B 62 28.213 7.415 21.441 1.00 0.00 H ATOM 1909 N GLU B 63 28.529 8.289 18.232 1.00 19.60 N ATOM 1910 CA GLU B 63 28.316 8.355 16.788 1.00 19.46 C ATOM 1911 C GLU B 63 27.097 9.183 16.394 1.00 18.57 C ATOM 1912 O GLU B 63 27.166 9.997 15.473 1.00 16.81 O ATOM 1913 CB GLU B 63 28.193 6.950 16.216 1.00 18.81 C ATOM 1914 H GLU B 63 28.457 7.368 18.710 1.00 0.00 H ATOM 1915 N ILE B 64 25.984 8.968 17.090 1.00 16.09 N ATOM 1916 CA ILE B 64 24.757 9.698 16.809 1.00 14.93 C ATOM 1917 C ILE B 64 24.936 11.183 17.136 1.00 16.30 C ATOM 1918 O ILE B 64 24.476 12.051 16.389 1.00 15.34 O ATOM 1919 CB ILE B 64 23.576 9.101 17.618 1.00 14.80 C ATOM 1920 CG1 ILE B 64 23.385 7.629 17.230 1.00 14.18 C ATOM 1921 CG2 ILE B 64 22.299 9.871 17.342 1.00 15.20 C ATOM 1922 CD1 ILE B 64 22.358 6.888 18.064 1.00 16.81 C ATOM 1923 H ILE B 64 25.991 8.261 17.853 1.00 0.00 H ATOM 1924 N SER B 65 25.616 11.475 18.244 1.00 15.69 N ATOM 1925 CA SER B 65 25.854 12.859 18.638 1.00 15.26 C ATOM 1926 C SER B 65 26.697 13.572 17.588 1.00 15.66 C ATOM 1927 O SER B 65 26.437 14.724 17.246 1.00 13.40 O ATOM 1928 CB SER B 65 26.579 12.922 19.988 1.00 17.24 C ATOM 1929 OG SER B 65 25.742 12.485 21.042 1.00 20.65 O ATOM 1930 HG SER B 65 25.465 11.549 20.876 1.00 0.00 H ATOM 1931 H SER B 65 25.983 10.704 18.837 1.00 0.00 H ATOM 1932 N LYS B 66 27.707 12.877 17.078 1.00 15.41 N ATOM 1933 CA LYS B 66 28.592 13.454 16.074 1.00 16.60 C ATOM 1934 C LYS B 66 27.814 13.847 14.822 1.00 16.42 C ATOM 1935 O LYS B 66 27.997 14.940 14.286 1.00 15.68 O ATOM 1936 CB LYS B 66 29.697 12.460 15.717 1.00 19.32 C ATOM 1937 CG LYS B 66 30.685 12.984 14.687 1.00 23.74 C ATOM 1938 CD LYS B 66 31.844 12.022 14.501 1.00 27.13 C ATOM 1939 CE LYS B 66 32.812 12.530 13.444 1.00 31.74 C ATOM 1940 NZ LYS B 66 33.355 13.878 13.781 1.00 33.30 N ATOM 1941 HZ1 LYS B 66 32.571 14.557 13.856 1.00 0.00 H ATOM 1942 HZ2 LYS B 66 33.861 13.830 14.688 1.00 0.00 H ATOM 1943 HZ3 LYS B 66 34.010 14.184 13.033 1.00 0.00 H ATOM 1944 H LYS B 66 27.870 11.902 17.401 1.00 0.00 H ATOM 1945 N VAL B 67 26.944 12.957 14.358 1.00 14.48 N ATOM 1946 CA VAL B 67 26.144 13.249 13.174 1.00 14.38 C ATOM 1947 C VAL B 67 25.207 14.422 13.445 1.00 14.92 C ATOM 1948 O VAL B 67 25.027 15.288 12.591 1.00 14.96 O ATOM 1949 CB VAL B 67 25.334 12.011 12.737 1.00 14.88 C ATOM 1950 CG1 VAL B 67 24.413 12.367 11.581 1.00 16.29 C ATOM 1951 CG2 VAL B 67 26.290 10.900 12.326 1.00 15.38 C ATOM 1952 H VAL B 67 26.832 12.044 14.843 1.00 0.00 H ATOM 1953 N ALA B 68 24.613 14.456 14.635 1.00 14.70 N ATOM 1954 CA ALA B 68 23.719 15.550 14.992 1.00 14.69 C ATOM 1955 C ALA B 68 24.495 16.862 14.928 1.00 14.69 C ATOM 1956 O ALA B 68 23.973 17.884 14.494 1.00 15.69 O ATOM 1957 CB ALA B 68 23.162 15.346 16.392 1.00 12.39 C ATOM 1958 H ALA B 68 24.789 13.692 15.319 1.00 0.00 H ATOM 1959 N GLU B 69 25.747 16.818 15.367 1.00 15.61 N ATOM 1960 CA GLU B 69 26.607 17.996 15.359 1.00 16.92 C ATOM 1961 C GLU B 69 26.926 18.445 13.929 1.00 16.90 C ATOM 1962 O GLU B 69 27.030 19.642 13.650 1.00 19.69 O ATOM 1963 CB GLU B 69 27.897 17.690 16.115 1.00 18.89 C ATOM 1964 H GLU B 69 26.125 15.918 15.727 1.00 0.00 H ATOM 1965 N GLN B 70 27.070 17.484 13.025 1.00 17.84 N ATOM 1966 CA GLN B 70 27.394 17.781 11.630 1.00 18.09 C ATOM 1967 C GLN B 70 26.224 18.357 10.838 1.00 18.47 C ATOM 1968 O GLN B 70 26.425 19.183 9.946 1.00 19.11 O ATOM 1969 CB GLN B 70 27.906 16.519 10.932 1.00 19.01 C ATOM 1970 CG GLN B 70 29.131 15.903 11.583 1.00 22.32 C ATOM 1971 CD GLN B 70 29.575 14.630 10.891 1.00 25.33 C ATOM 1972 OE1 GLN B 70 28.779 13.712 10.690 1.00 27.46 O ATOM 1973 NE2 GLN B 70 30.852 14.564 10.526 1.00 27.66 N ATOM 1974 HE22 GLN B 70 31.489 15.364 10.716 1.00 0.00 H ATOM 1975 HE21 GLN B 70 31.214 13.713 10.051 1.00 0.00 H ATOM 1976 H GLN B 70 26.949 16.493 13.316 1.00 0.00 H ATOM 1977 N VAL B 71 25.005 17.924 11.156 1.00 17.13 N ATOM 1978 CA VAL B 71 23.827 18.415 10.451 1.00 17.73 C ATOM 1979 C VAL B 71 23.079 19.493 11.238 1.00 16.67 C ATOM 1980 O VAL B 71 22.039 19.974 10.799 1.00 17.16 O ATOM 1981 CB VAL B 71 22.839 17.261 10.117 1.00 18.26 C ATOM 1982 CG1 VAL B 71 23.551 16.187 9.312 1.00 18.75 C ATOM 1983 CG2 VAL B 71 22.263 16.667 11.392 1.00 16.88 C ATOM 1984 H VAL B 71 24.892 17.226 11.918 1.00 0.00 H ATOM 1985 N LYS B 72 23.624 19.872 12.393 1.00 18.32 N ATOM 1986 CA LYS B 72 23.033 20.897 13.254 1.00 17.10 C ATOM 1987 C LYS B 72 21.671 20.484 13.808 1.00 16.98 C ATOM 1988 O LYS B 72 20.768 21.314 13.915 1.00 17.70 O ATOM 1989 CB LYS B 72 22.851 22.217 12.494 1.00 19.61 C ATOM 1990 CG LYS B 72 24.041 22.673 11.676 1.00 23.22 C ATOM 1991 CD LYS B 72 25.209 23.076 12.536 1.00 25.32 C ATOM 1992 CE LYS B 72 26.284 23.729 11.683 1.00 25.65 C ATOM 1993 NZ LYS B 72 27.474 24.081 12.488 1.00 26.88 N ATOM 1994 HZ1 LYS B 72 27.199 24.746 13.239 1.00 0.00 H ATOM 1995 HZ2 LYS B 72 27.870 23.219 12.915 1.00 0.00 H ATOM 1996 HZ3 LYS B 72 28.187 24.524 11.875 1.00 0.00 H ATOM 1997 H LYS B 72 24.510 19.419 12.696 1.00 0.00 H ATOM 1998 N ALA B 73 21.512 19.212 14.152 1.00 16.43 N ATOM 1999 CA ALA B 73 20.239 18.753 14.690 1.00 15.33 C ATOM 2000 C ALA B 73 20.229 18.916 16.204 1.00 14.71 C ATOM 2001 O ALA B 73 21.181 18.533 16.882 1.00 15.16 O ATOM 2002 CB ALA B 73 19.999 17.290 14.311 1.00 14.48 C ATOM 2003 H ALA B 73 22.299 18.541 14.037 1.00 0.00 H ATOM 2004 N GLU B 74 19.156 19.502 16.720 1.00 14.73 N ATOM 2005 CA GLU B 74 19.002 19.714 18.153 1.00 16.54 C ATOM 2006 C GLU B 74 18.070 18.648 18.726 1.00 15.83 C ATOM 2007 O GLU B 74 18.077 18.385 19.930 1.00 16.49 O ATOM 2008 CB GLU B 74 18.431 21.100 18.414 1.00 18.70 C ATOM 2009 H GLU B 74 18.400 19.820 16.080 1.00 0.00 H ATOM 2010 N ASN B 75 17.272 18.040 17.850 1.00 14.68 N ATOM 2011 CA ASN B 75 16.324 17.002 18.255 1.00 13.11 C ATOM 2012 C ASN B 75 16.761 15.660 17.685 1.00 11.83 C ATOM 2013 O ASN B 75 17.154 15.575 16.524 1.00 10.82 O ATOM 2014 CB ASN B 75 14.918 17.318 17.730 1.00 14.63 C ATOM 2015 CG ASN B 75 14.454 18.710 18.096 1.00 14.29 C ATOM 2016 OD1 ASN B 75 14.647 19.161 19.220 1.00 12.33 O ATOM 2017 ND2 ASN B 75 13.823 19.391 17.150 1.00 16.06 N ATOM 2018 HD22 ASN B 75 13.682 18.968 16.211 1.00 0.00 H ATOM 2019 HD21 ASN B 75 13.469 20.349 17.347 1.00 0.00 H ATOM 2020 H ASN B 75 17.324 18.311 16.847 1.00 0.00 H ATOM 2021 N VAL B 76 16.687 14.615 18.502 1.00 10.51 N ATOM 2022 CA VAL B 76 17.067 13.273 18.075 1.00 9.86 C ATOM 2023 C VAL B 76 15.950 12.332 18.500 1.00 11.25 C ATOM 2024 O VAL B 76 15.362 12.513 19.564 1.00 12.30 O ATOM 2025 CB VAL B 76 18.387 12.824 18.740 1.00 10.93 C ATOM 2026 CG1 VAL B 76 18.751 11.415 18.290 1.00 8.43 C ATOM 2027 CG2 VAL B 76 19.506 13.794 18.369 1.00 11.89 C ATOM 2028 H VAL B 76 16.348 14.758 19.475 1.00 0.00 H ATOM 2029 N PHE B 77 15.644 11.338 17.671 1.00 8.10 N ATOM 2030 CA PHE B 77 14.571 10.401 18.002 1.00 10.09 C ATOM 2031 C PHE B 77 15.055 8.962 17.892 1.00 10.91 C ATOM 2032 O PHE B 77 15.489 8.524 16.824 1.00 12.54 O ATOM 2033 CB PHE B 77 13.376 10.608 17.065 1.00 10.87 C ATOM 2034 CG PHE B 77 12.118 9.946 17.541 1.00 9.32 C ATOM 2035 CD1 PHE B 77 11.184 10.657 18.287 1.00 10.80 C ATOM 2036 CD2 PHE B 77 11.882 8.597 17.275 1.00 12.25 C ATOM 2037 CE1 PHE B 77 10.031 10.036 18.765 1.00 11.70 C ATOM 2038 CE2 PHE B 77 10.731 7.966 17.748 1.00 11.15 C ATOM 2039 CZ PHE B 77 9.806 8.688 18.494 1.00 12.33 C ATOM 2040 H PHE B 77 16.171 11.226 16.782 1.00 0.00 H ATOM 2041 N VAL B 78 14.965 8.227 18.998 1.00 9.91 N ATOM 2042 CA VAL B 78 15.409 6.835 19.030 1.00 12.38 C ATOM 2043 C VAL B 78 14.244 5.939 18.628 1.00 11.71 C ATOM 2044 O VAL B 78 13.260 5.808 19.359 1.00 12.98 O ATOM 2045 CB VAL B 78 15.919 6.462 20.429 1.00 10.79 C ATOM 2046 CG1 VAL B 78 16.469 5.040 20.426 1.00 12.11 C ATOM 2047 CG2 VAL B 78 17.000 7.451 20.860 1.00 13.52 C ATOM 2048 H VAL B 78 14.569 8.653 19.860 1.00 0.00 H ATOM 2049 N TYR B 79 14.385 5.302 17.472 1.00 10.34 N ATOM 2050 CA TYR B 79 13.331 4.471 16.904 1.00 11.90 C ATOM 2051 C TYR B 79 13.697 2.999 16.731 1.00 11.78 C ATOM 2052 O TYR B 79 14.559 2.661 15.925 1.00 12.43 O ATOM 2053 CB TYR B 79 12.951 5.050 15.539 1.00 11.97 C ATOM 2054 CG TYR B 79 11.614 4.594 15.016 1.00 10.68 C ATOM 2055 CD1 TYR B 79 10.496 5.429 15.084 1.00 11.15 C ATOM 2056 CD2 TYR B 79 11.459 3.326 14.468 1.00 11.71 C ATOM 2057 CE1 TYR B 79 9.251 5.002 14.613 1.00 11.13 C ATOM 2058 CE2 TYR B 79 10.225 2.888 14.001 1.00 12.38 C ATOM 2059 CZ TYR B 79 9.126 3.728 14.077 1.00 11.29 C ATOM 2060 OH TYR B 79 7.905 3.276 13.632 1.00 12.10 O ATOM 2061 HH TYR B 79 7.971 3.041 12.673 1.00 0.00 H ATOM 2062 H TYR B 79 15.281 5.400 16.952 1.00 0.00 H ATOM 2063 N PRO B 80 13.025 2.103 17.470 1.00 11.72 N ATOM 2064 CA PRO B 80 13.328 0.674 17.345 1.00 12.69 C ATOM 2065 C PRO B 80 12.961 0.175 15.949 1.00 11.42 C ATOM 2066 O PRO B 80 11.837 0.364 15.496 1.00 11.89 O ATOM 2067 CB PRO B 80 12.457 0.033 18.431 1.00 11.57 C ATOM 2068 CG PRO B 80 12.279 1.144 19.443 1.00 14.42 C ATOM 2069 CD PRO B 80 12.061 2.349 18.557 1.00 13.32 C ATOM 2070 N PHE B 81 13.917 -0.445 15.267 1.00 13.09 N ATOM 2071 CA PHE B 81 13.689 -0.975 13.927 1.00 14.44 C ATOM 2072 C PHE B 81 14.514 -2.249 13.833 1.00 15.15 C ATOM 2073 O PHE B 81 15.607 -2.256 13.279 1.00 12.89 O ATOM 2074 CB PHE B 81 14.146 0.032 12.869 1.00 15.95 C ATOM 2075 CG PHE B 81 13.565 -0.216 11.503 1.00 18.69 C ATOM 2076 CD1 PHE B 81 12.783 0.751 10.886 1.00 18.65 C ATOM 2077 CD2 PHE B 81 13.810 -1.410 10.827 1.00 19.25 C ATOM 2078 CE1 PHE B 81 12.252 0.539 9.617 1.00 19.49 C ATOM 2079 CE2 PHE B 81 13.283 -1.632 9.555 1.00 19.60 C ATOM 2080 CZ PHE B 81 12.503 -0.655 8.949 1.00 21.59 C ATOM 2081 H PHE B 81 14.856 -0.556 15.701 1.00 0.00 H ATOM 2082 N ALA B 82 13.970 -3.326 14.386 1.00 16.47 N ATOM 2083 CA ALA B 82 14.649 -4.615 14.428 1.00 19.09 C ATOM 2084 C ALA B 82 15.136 -5.174 13.102 1.00 20.69 C ATOM 2085 O ALA B 82 16.239 -5.714 13.026 1.00 21.45 O ATOM 2086 CB ALA B 82 13.753 -5.647 15.115 1.00 18.69 C ATOM 2087 H ALA B 82 13.022 -3.247 14.806 1.00 0.00 H ATOM 2088 N HIS B 83 14.337 -5.040 12.051 1.00 23.16 N ATOM 2089 CA HIS B 83 14.734 -5.608 10.774 1.00 24.77 C ATOM 2090 C HIS B 83 15.794 -4.883 9.947 1.00 24.58 C ATOM 2091 O HIS B 83 15.893 -5.094 8.739 1.00 25.94 O ATOM 2092 CB HIS B 83 13.490 -5.906 9.932 1.00 28.12 C ATOM 2093 CG HIS B 83 12.606 -6.957 10.533 1.00 31.36 C ATOM 2094 ND1 HIS B 83 13.099 -7.982 11.312 1.00 34.61 N ATOM 2095 CD2 HIS B 83 11.269 -7.153 10.457 1.00 31.57 C ATOM 2096 CE1 HIS B 83 12.103 -8.764 11.691 1.00 34.24 C ATOM 2097 NE2 HIS B 83 10.982 -8.283 11.184 1.00 35.31 N ATOM 2098 H HIS B 83 13.434 -4.532 12.141 1.00 0.00 H ATOM 2099 N LEU B 84 16.596 -4.042 10.594 1.00 23.65 N ATOM 2100 CA LEU B 84 17.685 -3.361 9.901 1.00 22.80 C ATOM 2101 C LEU B 84 18.839 -4.352 9.846 1.00 23.88 C ATOM 2102 O LEU B 84 19.756 -4.224 9.035 1.00 24.25 O ATOM 2103 CB LEU B 84 18.146 -2.115 10.660 1.00 23.53 C ATOM 2104 CG LEU B 84 17.378 -0.809 10.472 1.00 23.16 C ATOM 2105 CD1 LEU B 84 18.086 0.285 11.256 1.00 24.16 C ATOM 2106 CD2 LEU B 84 17.319 -0.441 8.993 1.00 23.16 C ATOM 2107 H LEU B 84 16.445 -3.867 11.608 1.00 0.00 H ATOM 2108 N SER B 85 18.780 -5.339 10.734 1.00 23.12 N ATOM 2109 CA SER B 85 19.797 -6.379 10.821 1.00 23.69 C ATOM 2110 C SER B 85 19.125 -7.745 10.751 1.00 23.19 C ATOM 2111 O SER B 85 17.917 -7.859 10.968 1.00 22.25 O ATOM 2112 CB SER B 85 20.567 -6.251 12.139 1.00 24.16 C ATOM 2113 OG SER B 85 21.477 -7.325 12.303 1.00 24.08 O ATOM 2114 HG SER B 85 21.960 -7.218 13.160 1.00 0.00 H ATOM 2115 H SER B 85 17.976 -5.370 11.393 1.00 0.00 H ATOM 2116 N SER B 86 19.904 -8.780 10.448 1.00 24.01 N ATOM 2117 CA SER B 86 19.363 -10.135 10.356 1.00 26.61 C ATOM 2118 C SER B 86 19.733 -10.980 11.572 1.00 26.66 C ATOM 2119 O SER B 86 19.198 -12.070 11.766 1.00 28.30 O ATOM 2120 CB SER B 86 19.862 -10.819 9.082 1.00 27.63 C ATOM 2121 OG SER B 86 19.372 -10.155 7.928 1.00 31.65 O ATOM 2122 HG SER B 86 18.382 -10.173 7.934 1.00 0.00 H ATOM 2123 H SER B 86 20.917 -8.622 10.273 1.00 0.00 H ATOM 2124 N GLU B 87 20.656 -10.473 12.383 1.00 27.20 N ATOM 2125 CA GLU B 87 21.095 -11.166 13.592 1.00 26.05 C ATOM 2126 C GLU B 87 20.719 -10.296 14.790 1.00 25.24 C ATOM 2127 O GLU B 87 21.530 -9.515 15.280 1.00 25.70 O ATOM 2128 CB GLU B 87 22.603 -11.384 13.547 1.00 25.26 C ATOM 2129 H GLU B 87 21.080 -9.552 12.149 1.00 0.00 H ATOM 2130 N LEU B 88 19.484 -10.439 15.258 1.00 24.88 N ATOM 2131 CA LEU B 88 18.987 -9.636 16.367 1.00 23.78 C ATOM 2132 C LEU B 88 19.386 -10.100 17.760 1.00 23.49 C ATOM 2133 O LEU B 88 19.582 -11.292 18.010 1.00 22.69 O ATOM 2134 CB LEU B 88 17.461 -9.552 16.305 1.00 24.12 C ATOM 2135 CG LEU B 88 16.854 -9.074 14.986 1.00 24.85 C ATOM 2136 CD1 LEU B 88 15.338 -9.014 15.122 1.00 24.66 C ATOM 2137 CD2 LEU B 88 17.421 -7.710 14.627 1.00 24.38 C ATOM 2138 H LEU B 88 18.855 -11.143 14.821 1.00 0.00 H ATOM 2139 N ALA B 89 19.504 -9.132 18.663 1.00 21.49 N ATOM 2140 CA ALA B 89 19.831 -9.408 20.052 1.00 21.07 C ATOM 2141 C ALA B 89 18.507 -9.746 20.731 1.00 20.76 C ATOM 2142 O ALA B 89 17.438 -9.373 20.236 1.00 20.40 O ATOM 2143 CB ALA B 89 20.449 -8.176 20.697 1.00 19.96 C ATOM 2144 H ALA B 89 19.358 -8.146 18.366 1.00 0.00 H ATOM 2145 N LYS B 90 18.574 -10.462 21.848 1.00 20.83 N ATOM 2146 CA LYS B 90 17.375 -10.822 22.590 1.00 20.38 C ATOM 2147 C LYS B 90 16.664 -9.525 22.969 1.00 19.94 C ATOM 2148 O LYS B 90 17.309 -8.509 23.216 1.00 18.57 O ATOM 2149 CB LYS B 90 17.748 -11.607 23.847 1.00 20.37 C ATOM 2150 H LYS B 90 19.503 -10.772 22.199 1.00 0.00 H ATOM 2151 N PRO B 91 15.323 -9.549 23.026 1.00 20.91 N ATOM 2152 CA PRO B 91 14.498 -8.384 23.369 1.00 21.76 C ATOM 2153 C PRO B 91 14.944 -7.625 24.617 1.00 21.02 C ATOM 2154 O PRO B 91 15.101 -6.401 24.590 1.00 19.78 O ATOM 2155 CB PRO B 91 13.110 -8.990 23.539 1.00 22.33 C ATOM 2156 CG PRO B 91 13.126 -10.130 22.567 1.00 24.60 C ATOM 2157 CD PRO B 91 14.478 -10.741 22.829 1.00 22.15 C ATOM 2158 N SER B 92 15.141 -8.353 25.712 1.00 20.54 N ATOM 2159 CA SER B 92 15.558 -7.739 26.967 1.00 20.77 C ATOM 2160 C SER B 92 16.819 -6.895 26.800 1.00 18.65 C ATOM 2161 O SER B 92 16.909 -5.791 27.338 1.00 17.67 O ATOM 2162 CB SER B 92 15.798 -8.816 28.032 1.00 22.82 C ATOM 2163 OG SER B 92 16.885 -9.652 27.675 1.00 25.55 O ATOM 2164 HG SER B 92 16.689 -10.097 26.813 1.00 0.00 H ATOM 2165 H SER B 92 14.995 -9.382 25.673 1.00 0.00 H ATOM 2166 N VAL B 93 17.798 -7.417 26.069 1.00 18.89 N ATOM 2167 CA VAL B 93 19.041 -6.689 25.848 1.00 18.73 C ATOM 2168 C VAL B 93 18.805 -5.505 24.921 1.00 18.32 C ATOM 2169 O VAL B 93 19.327 -4.417 25.150 1.00 17.06 O ATOM 2170 CB VAL B 93 20.136 -7.597 25.233 1.00 20.46 C ATOM 2171 CG1 VAL B 93 21.349 -6.765 24.835 1.00 21.69 C ATOM 2172 CG2 VAL B 93 20.544 -8.669 26.236 1.00 20.28 C ATOM 2173 H VAL B 93 17.675 -8.360 25.648 1.00 0.00 H ATOM 2174 N ALA B 94 18.015 -5.717 23.874 1.00 17.05 N ATOM 2175 CA ALA B 94 17.727 -4.645 22.929 1.00 15.81 C ATOM 2176 C ALA B 94 17.096 -3.462 23.654 1.00 15.31 C ATOM 2177 O ALA B 94 17.518 -2.325 23.478 1.00 16.22 O ATOM 2178 CB ALA B 94 16.796 -5.146 21.824 1.00 16.60 C ATOM 2179 H ALA B 94 17.597 -6.658 23.727 1.00 0.00 H ATOM 2180 N MET B 95 16.093 -3.737 24.480 1.00 16.46 N ATOM 2181 CA MET B 95 15.408 -2.681 25.212 1.00 16.73 C ATOM 2182 C MET B 95 16.352 -1.918 26.134 1.00 16.27 C ATOM 2183 O MET B 95 16.297 -0.689 26.210 1.00 14.90 O ATOM 2184 CB MET B 95 14.239 -3.260 26.019 1.00 18.67 C ATOM 2185 CG MET B 95 13.265 -2.198 26.526 1.00 23.77 C ATOM 2186 SD MET B 95 11.806 -2.888 27.344 1.00 28.81 S ATOM 2187 CE MET B 95 11.691 -1.841 28.795 1.00 30.20 C ATOM 2188 H MET B 95 15.791 -4.724 24.606 1.00 0.00 H ATOM 2189 N ASP B 96 17.222 -2.644 26.833 1.00 16.39 N ATOM 2190 CA ASP B 96 18.171 -2.011 27.745 1.00 18.08 C ATOM 2191 C ASP B 96 19.117 -1.073 27.014 1.00 15.55 C ATOM 2192 O ASP B 96 19.357 0.053 27.447 1.00 14.66 O ATOM 2193 CB ASP B 96 19.003 -3.064 28.483 1.00 19.37 C ATOM 2194 CG ASP B 96 20.120 -2.444 29.307 1.00 21.68 C ATOM 2195 OD1 ASP B 96 19.814 -1.615 30.189 1.00 23.45 O ATOM 2196 OD2 ASP B 96 21.301 -2.775 29.073 1.00 23.97 O ATOM 2197 H ASP B 96 17.226 -3.679 26.728 1.00 0.00 H ATOM 2198 N ILE B 97 19.662 -1.550 25.903 1.00 14.90 N ATOM 2199 CA ILE B 97 20.595 -0.756 25.115 1.00 15.62 C ATOM 2200 C ILE B 97 19.913 0.479 24.536 1.00 14.74 C ATOM 2201 O ILE B 97 20.469 1.573 24.558 1.00 15.37 O ATOM 2202 CB ILE B 97 21.213 -1.622 23.995 1.00 15.54 C ATOM 2203 CG1 ILE B 97 22.180 -2.632 24.626 1.00 16.33 C ATOM 2204 CG2 ILE B 97 21.901 -0.748 22.961 1.00 15.32 C ATOM 2205 CD1 ILE B 97 22.762 -3.640 23.656 1.00 18.21 C ATOM 2206 H ILE B 97 19.418 -2.511 25.588 1.00 0.00 H ATOM 2207 N LEU B 98 18.698 0.310 24.027 1.00 15.19 N ATOM 2208 CA LEU B 98 17.972 1.442 23.473 1.00 14.05 C ATOM 2209 C LEU B 98 17.728 2.482 24.567 1.00 14.41 C ATOM 2210 O LEU B 98 17.784 3.679 24.312 1.00 13.20 O ATOM 2211 CB LEU B 98 16.644 0.979 22.865 1.00 14.07 C ATOM 2212 CG LEU B 98 16.783 0.123 21.599 1.00 14.68 C ATOM 2213 CD1 LEU B 98 15.433 -0.479 21.214 1.00 15.28 C ATOM 2214 CD2 LEU B 98 17.328 0.985 20.465 1.00 18.41 C ATOM 2215 H LEU B 98 18.264 -0.635 24.025 1.00 0.00 H ATOM 2216 N ASN B 99 17.464 2.026 25.791 1.00 13.74 N ATOM 2217 CA ASN B 99 17.240 2.961 26.891 1.00 13.82 C ATOM 2218 C ASN B 99 18.547 3.683 27.221 1.00 13.59 C ATOM 2219 O ASN B 99 18.552 4.885 27.482 1.00 13.55 O ATOM 2220 CB ASN B 99 16.733 2.232 28.139 1.00 18.03 C ATOM 2221 CG ASN B 99 16.280 3.192 29.229 1.00 20.31 C ATOM 2222 OD1 ASN B 99 15.351 3.972 29.029 1.00 21.42 O ATOM 2223 ND2 ASN B 99 16.938 3.140 30.387 1.00 20.24 N ATOM 2224 HD22 ASN B 99 17.718 2.464 30.512 1.00 0.00 H ATOM 2225 HD21 ASN B 99 16.671 3.776 31.166 1.00 0.00 H ATOM 2226 H ASN B 99 17.417 1.002 25.964 1.00 0.00 H ATOM 2227 N ARG B 100 19.653 2.942 27.214 1.00 13.47 N ATOM 2228 CA ARG B 100 20.965 3.523 27.504 1.00 14.44 C ATOM 2229 C ARG B 100 21.315 4.614 26.495 1.00 14.30 C ATOM 2230 O ARG B 100 21.828 5.674 26.862 1.00 14.59 O ATOM 2231 CB ARG B 100 22.050 2.437 27.478 1.00 17.54 C ATOM 2232 CG ARG B 100 22.051 1.511 28.686 1.00 20.78 C ATOM 2233 CD ARG B 100 23.012 0.340 28.483 1.00 24.95 C ATOM 2234 NE ARG B 100 23.191 -0.462 29.693 1.00 27.47 N ATOM 2235 CZ ARG B 100 23.992 -0.134 30.704 1.00 29.88 C ATOM 2236 NH1 ARG B 100 24.703 0.987 30.666 1.00 30.20 N ATOM 2237 NH2 ARG B 100 24.081 -0.929 31.761 1.00 31.60 N ATOM 2238 HE ARG B 100 22.655 -1.350 29.769 1.00 0.00 H ATOM 2239 HH12 ARG B 100 25.326 1.235 31.461 1.00 0.00 H ATOM 2240 HH11 ARG B 100 24.637 1.617 29.841 1.00 0.00 H ATOM 2241 HH22 ARG B 100 24.706 -0.674 32.552 1.00 0.00 H ATOM 2242 HH21 ARG B 100 23.525 -1.807 31.799 1.00 0.00 H ATOM 2243 H ARG B 100 19.583 1.927 26.998 1.00 0.00 H ATOM 2244 N VAL B 101 21.035 4.351 25.222 1.00 12.88 N ATOM 2245 CA VAL B 101 21.328 5.314 24.168 1.00 12.50 C ATOM 2246 C VAL B 101 20.468 6.556 24.358 1.00 11.67 C ATOM 2247 O VAL B 101 20.960 7.680 24.295 1.00 11.81 O ATOM 2248 CB VAL B 101 21.074 4.702 22.767 1.00 12.36 C ATOM 2249 CG1 VAL B 101 21.227 5.766 21.685 1.00 10.33 C ATOM 2250 CG2 VAL B 101 22.061 3.568 22.523 1.00 12.56 C ATOM 2251 H VAL B 101 20.598 3.440 24.974 1.00 0.00 H ATOM 2252 N TYR B 102 19.185 6.339 24.620 1.00 13.44 N ATOM 2253 CA TYR B 102 18.240 7.426 24.838 1.00 12.25 C ATOM 2254 C TYR B 102 18.700 8.330 25.984 1.00 13.88 C ATOM 2255 O TYR B 102 18.776 9.549 25.828 1.00 10.90 O ATOM 2256 CB TYR B 102 16.863 6.835 25.146 1.00 14.77 C ATOM 2257 CG TYR B 102 15.797 7.843 25.505 1.00 15.62 C ATOM 2258 CD1 TYR B 102 15.281 8.717 24.550 1.00 14.17 C ATOM 2259 CD2 TYR B 102 15.285 7.904 26.798 1.00 14.91 C ATOM 2260 CE1 TYR B 102 14.277 9.621 24.877 1.00 14.21 C ATOM 2261 CE2 TYR B 102 14.282 8.803 27.136 1.00 16.75 C ATOM 2262 CZ TYR B 102 13.780 9.658 26.170 1.00 16.79 C ATOM 2263 OH TYR B 102 12.770 10.534 26.497 1.00 19.19 O ATOM 2264 HH TYR B 102 13.078 11.137 27.219 1.00 0.00 H ATOM 2265 H TYR B 102 18.842 5.358 24.671 1.00 0.00 H ATOM 2266 N GLN B 103 19.016 7.730 27.130 1.00 13.22 N ATOM 2267 CA GLN B 103 19.466 8.495 28.292 1.00 14.84 C ATOM 2268 C GLN B 103 20.776 9.229 28.028 1.00 14.10 C ATOM 2269 O GLN B 103 20.956 10.369 28.461 1.00 14.31 O ATOM 2270 CB GLN B 103 19.635 7.574 29.507 1.00 15.35 C ATOM 2271 CG GLN B 103 18.326 7.064 30.105 1.00 16.49 C ATOM 2272 CD GLN B 103 17.404 8.186 30.549 1.00 19.22 C ATOM 2273 OE1 GLN B 103 17.853 9.210 31.061 1.00 20.07 O ATOM 2274 NE2 GLN B 103 16.106 7.988 30.370 1.00 19.91 N ATOM 2275 HE22 GLN B 103 15.770 7.106 29.933 1.00 0.00 H ATOM 2276 HE21 GLN B 103 15.423 8.714 30.667 1.00 0.00 H ATOM 2277 H GLN B 103 18.941 6.695 27.200 1.00 0.00 H ATOM 2278 N GLY B 104 21.684 8.566 27.319 1.00 14.48 N ATOM 2279 CA GLY B 104 22.972 9.156 27.004 1.00 14.43 C ATOM 2280 C GLY B 104 22.845 10.397 26.149 1.00 15.75 C ATOM 2281 O GLY B 104 23.526 11.398 26.379 1.00 15.06 O ATOM 2282 H GLY B 104 21.467 7.606 26.983 1.00 0.00 H ATOM 2283 N LEU B 105 21.976 10.338 25.147 1.00 14.42 N ATOM 2284 CA LEU B 105 21.773 11.487 24.279 1.00 14.45 C ATOM 2285 C LEU B 105 21.149 12.619 25.074 1.00 13.85 C ATOM 2286 O LEU B 105 21.437 13.786 24.831 1.00 14.45 O ATOM 2287 CB LEU B 105 20.870 11.115 23.102 1.00 12.40 C ATOM 2288 CG LEU B 105 21.501 10.107 22.138 1.00 13.25 C ATOM 2289 CD1 LEU B 105 20.476 9.683 21.098 1.00 14.38 C ATOM 2290 CD2 LEU B 105 22.718 10.730 21.472 1.00 17.14 C ATOM 2291 H LEU B 105 21.437 9.464 24.982 1.00 0.00 H ATOM 2292 N LYS B 106 20.285 12.271 26.024 1.00 15.32 N ATOM 2293 CA LYS B 106 19.653 13.287 26.856 1.00 16.68 C ATOM 2294 C LYS B 106 20.729 13.991 27.672 1.00 18.22 C ATOM 2295 O LYS B 106 20.715 15.211 27.819 1.00 17.68 O ATOM 2296 CB LYS B 106 18.633 12.654 27.803 1.00 19.02 C ATOM 2297 CG LYS B 106 17.354 12.183 27.133 1.00 23.47 C ATOM 2298 CD LYS B 106 16.401 11.570 28.156 1.00 25.55 C ATOM 2299 CE LYS B 106 16.096 12.555 29.277 1.00 28.25 C ATOM 2300 NZ LYS B 106 15.221 11.971 30.335 1.00 30.58 N ATOM 2301 HZ1 LYS B 106 14.317 11.678 29.913 1.00 0.00 H ATOM 2302 HZ2 LYS B 106 15.692 11.145 30.756 1.00 0.00 H ATOM 2303 HZ3 LYS B 106 15.046 12.684 31.071 1.00 0.00 H ATOM 2304 H LYS B 106 20.059 11.267 26.174 1.00 0.00 H ATOM 2305 N GLU B 107 21.662 13.207 28.202 1.00 19.11 N ATOM 2306 CA GLU B 107 22.752 13.746 29.007 1.00 21.30 C ATOM 2307 C GLU B 107 23.639 14.698 28.211 1.00 22.55 C ATOM 2308 O GLU B 107 24.248 15.603 28.782 1.00 23.14 O ATOM 2309 CB GLU B 107 23.589 12.608 29.582 1.00 21.41 C ATOM 2310 H GLU B 107 21.613 12.181 28.038 1.00 0.00 H ATOM 2311 N ARG B 108 23.715 14.495 26.896 1.00 23.58 N ATOM 2312 CA ARG B 108 24.528 15.355 26.037 1.00 24.14 C ATOM 2313 C ARG B 108 23.850 16.698 25.771 1.00 23.44 C ATOM 2314 O ARG B 108 24.439 17.584 25.148 1.00 23.79 O ATOM 2315 CB ARG B 108 24.825 14.665 24.702 1.00 25.43 C ATOM 2316 CG ARG B 108 25.701 13.424 24.792 1.00 29.17 C ATOM 2317 CD ARG B 108 27.062 13.723 25.405 1.00 33.46 C ATOM 2318 NE ARG B 108 27.996 12.610 25.242 1.00 36.30 N ATOM 2319 CZ ARG B 108 28.594 12.293 24.096 1.00 37.49 C ATOM 2320 NH1 ARG B 108 28.363 13.004 23.000 1.00 38.44 N ATOM 2321 NH2 ARG B 108 29.422 11.259 24.043 1.00 38.63 N ATOM 2322 HE ARG B 108 28.207 12.027 26.077 1.00 0.00 H ATOM 2323 HH12 ARG B 108 28.833 12.751 22.108 1.00 0.00 H ATOM 2324 HH11 ARG B 108 27.712 13.814 23.033 1.00 0.00 H ATOM 2325 HH22 ARG B 108 29.889 11.012 23.147 1.00 0.00 H ATOM 2326 HH21 ARG B 108 29.605 10.695 24.897 1.00 0.00 H ATOM 2327 H ARG B 108 23.184 13.708 26.471 1.00 0.00 H ATOM 2328 N GLY B 109 22.609 16.839 26.230 1.00 21.68 N ATOM 2329 CA GLY B 109 21.886 18.089 26.053 1.00 19.61 C ATOM 2330 C GLY B 109 20.919 18.163 24.884 1.00 19.33 C ATOM 2331 O GLY B 109 20.335 19.216 24.630 1.00 19.65 O ATOM 2332 H GLY B 109 22.150 16.046 26.721 1.00 0.00 H ATOM 2333 N PHE B 110 20.746 17.059 24.166 1.00 17.47 N ATOM 2334 CA PHE B 110 19.830 17.035 23.030 1.00 17.20 C ATOM 2335 C PHE B 110 18.391 16.882 23.507 1.00 16.57 C ATOM 2336 O PHE B 110 18.148 16.393 24.609 1.00 14.98 O ATOM 2337 CB PHE B 110 20.154 15.855 22.104 1.00 15.99 C ATOM 2338 CG PHE B 110 21.475 15.974 21.399 1.00 16.56 C ATOM 2339 CD1 PHE B 110 21.650 16.896 20.375 1.00 17.03 C ATOM 2340 CD2 PHE B 110 22.548 15.168 21.763 1.00 16.41 C ATOM 2341 CE1 PHE B 110 22.871 17.013 19.724 1.00 17.26 C ATOM 2342 CE2 PHE B 110 23.775 15.280 21.116 1.00 17.88 C ATOM 2343 CZ PHE B 110 23.936 16.204 20.094 1.00 15.46 C ATOM 2344 H PHE B 110 21.272 16.198 24.417 1.00 0.00 H ATOM 2345 N ASN B 111 17.444 17.334 22.688 1.00 15.67 N ATOM 2346 CA ASN B 111 16.027 17.161 22.996 1.00 16.17 C ATOM 2347 C ASN B 111 15.797 15.796 22.364 1.00 16.08 C ATOM 2348 O ASN B 111 15.835 15.669 21.139 1.00 16.05 O ATOM 2349 CB ASN B 111 15.169 18.216 22.294 1.00 17.22 C ATOM 2350 CG ASN B 111 13.685 17.900 22.365 1.00 19.44 C ATOM 2351 OD1 ASN B 111 13.188 17.449 23.393 1.00 19.70 O ATOM 2352 ND2 ASN B 111 12.970 18.146 21.275 1.00 18.40 N ATOM 2353 HD22 ASN B 111 13.432 18.528 20.425 1.00 0.00 H ATOM 2354 HD21 ASN B 111 11.947 17.957 21.270 1.00 0.00 H ATOM 2355 H ASN B 111 17.719 17.820 21.811 1.00 0.00 H ATOM 2356 N VAL B 112 15.575 14.780 23.190 1.00 13.90 N ATOM 2357 CA VAL B 112 15.421 13.425 22.681 1.00 13.34 C ATOM 2358 C VAL B 112 14.048 12.792 22.854 1.00 12.33 C ATOM 2359 O VAL B 112 13.381 12.977 23.870 1.00 11.56 O ATOM 2360 CB VAL B 112 16.463 12.492 23.329 1.00 13.29 C ATOM 2361 CG1 VAL B 112 16.549 11.186 22.555 1.00 13.78 C ATOM 2362 CG2 VAL B 112 17.817 13.182 23.378 1.00 14.33 C ATOM 2363 H VAL B 112 15.510 14.955 24.213 1.00 0.00 H ATOM 2364 N GLY B 113 13.640 12.042 21.837 1.00 11.47 N ATOM 2365 CA GLY B 113 12.368 11.352 21.877 1.00 13.70 C ATOM 2366 C GLY B 113 12.601 9.884 21.572 1.00 13.72 C ATOM 2367 O GLY B 113 13.667 9.507 21.086 1.00 12.70 O ATOM 2368 H GLY B 113 14.245 11.949 20.996 1.00 0.00 H ATOM 2369 N LYS B 114 11.617 9.043 21.863 1.00 14.13 N ATOM 2370 CA LYS B 114 11.757 7.620 21.588 1.00 15.37 C ATOM 2371 C LYS B 114 10.385 6.988 21.432 1.00 15.35 C ATOM 2372 O LYS B 114 9.409 7.468 22.003 1.00 15.82 O ATOM 2373 CB LYS B 114 12.515 6.925 22.724 1.00 17.92 C ATOM 2374 CG LYS B 114 11.731 6.808 24.021 1.00 23.84 C ATOM 2375 CD LYS B 114 12.509 6.007 25.058 1.00 26.17 C ATOM 2376 CE LYS B 114 11.654 5.711 26.271 1.00 28.99 C ATOM 2377 NZ LYS B 114 11.081 6.965 26.831 1.00 30.08 N ATOM 2378 HZ1 LYS B 114 11.853 7.603 27.111 1.00 0.00 H ATOM 2379 HZ2 LYS B 114 10.492 7.428 26.110 1.00 0.00 H ATOM 2380 HZ3 LYS B 114 10.498 6.738 27.662 1.00 0.00 H ATOM 2381 H LYS B 114 10.740 9.403 22.290 1.00 0.00 H ATOM 2382 N ALA B 115 10.313 5.917 20.648 1.00 14.67 N ATOM 2383 CA ALA B 115 9.052 5.217 20.446 1.00 15.70 C ATOM 2384 C ALA B 115 9.062 3.967 21.328 1.00 15.83 C ATOM 2385 O ALA B 115 10.124 3.428 21.634 1.00 14.95 O ATOM 2386 CB ALA B 115 8.892 4.830 18.974 1.00 17.30 C ATOM 2387 H ALA B 115 11.171 5.573 20.171 1.00 0.00 H ATOM 2388 N PRO B 116 7.877 3.500 21.751 1.00 15.41 N ATOM 2389 CA PRO B 116 7.721 2.311 22.602 1.00 16.23 C ATOM 2390 C PRO B 116 8.380 1.062 22.014 1.00 15.43 C ATOM 2391 O PRO B 116 8.410 0.880 20.799 1.00 14.47 O ATOM 2392 CB PRO B 116 6.210 2.169 22.710 1.00 18.37 C ATOM 2393 CG PRO B 116 5.742 3.586 22.650 1.00 18.41 C ATOM 2394 CD PRO B 116 6.577 4.163 21.541 1.00 16.33 C ATOM 2395 N PHE B 117 8.880 0.191 22.889 1.00 15.25 N ATOM 2396 CA PHE B 117 9.565 -1.032 22.477 1.00 15.42 C ATOM 2397 C PHE B 117 8.659 -2.260 22.503 1.00 15.71 C ATOM 2398 O PHE B 117 7.857 -2.423 23.424 1.00 14.70 O ATOM 2399 CB PHE B 117 10.755 -1.277 23.412 1.00 16.39 C ATOM 2400 CG PHE B 117 11.557 -2.499 23.076 1.00 16.85 C ATOM 2401 CD1 PHE B 117 12.654 -2.416 22.222 1.00 18.18 C ATOM 2402 CD2 PHE B 117 11.227 -3.734 23.623 1.00 17.39 C ATOM 2403 CE1 PHE B 117 13.412 -3.547 21.921 1.00 18.54 C ATOM 2404 CE2 PHE B 117 11.978 -4.869 23.327 1.00 18.02 C ATOM 2405 CZ PHE B 117 13.074 -4.774 22.475 1.00 18.06 C ATOM 2406 H PHE B 117 8.779 0.389 23.905 1.00 0.00 H ATOM 2407 N GLY B 118 8.800 -3.122 21.496 1.00 16.18 N ATOM 2408 CA GLY B 118 8.019 -4.347 21.438 1.00 16.23 C ATOM 2409 C GLY B 118 6.733 -4.318 20.636 1.00 18.35 C ATOM 2410 O GLY B 118 5.864 -5.172 20.826 1.00 17.27 O ATOM 2411 H GLY B 118 9.481 -2.914 20.738 1.00 0.00 H ATOM 2412 N TYR B 119 6.614 -3.365 19.718 1.00 14.66 N ATOM 2413 CA TYR B 119 5.396 -3.234 18.924 1.00 16.35 C ATOM 2414 C TYR B 119 5.614 -3.158 17.423 1.00 16.08 C ATOM 2415 O TYR B 119 6.720 -2.893 16.956 1.00 13.46 O ATOM 2416 CB TYR B 119 4.654 -1.960 19.332 1.00 15.84 C ATOM 2417 CG TYR B 119 4.224 -1.910 20.775 1.00 15.77 C ATOM 2418 CD1 TYR B 119 2.980 -2.395 21.163 1.00 17.32 C ATOM 2419 CD2 TYR B 119 5.064 -1.380 21.756 1.00 14.69 C ATOM 2420 CE1 TYR B 119 2.575 -2.356 22.489 1.00 16.04 C ATOM 2421 CE2 TYR B 119 4.670 -1.338 23.089 1.00 16.49 C ATOM 2422 CZ TYR B 119 3.424 -1.829 23.447 1.00 17.50 C ATOM 2423 OH TYR B 119 3.030 -1.799 24.760 1.00 16.95 O ATOM 2424 HH TYR B 119 3.664 -2.329 25.306 1.00 0.00 H ATOM 2425 H TYR B 119 7.400 -2.702 19.563 1.00 0.00 H ATOM 2426 N TYR B 120 4.541 -3.420 16.680 1.00 15.69 N ATOM 2427 CA TYR B 120 4.548 -3.270 15.231 1.00 17.12 C ATOM 2428 C TYR B 120 4.069 -1.833 15.210 1.00 16.32 C ATOM 2429 O TYR B 120 3.094 -1.490 15.877 1.00 17.03 O ATOM 2430 CB TYR B 120 3.552 -4.216 14.568 1.00 16.60 C ATOM 2431 CG TYR B 120 4.086 -5.624 14.517 1.00 17.97 C ATOM 2432 CD1 TYR B 120 5.325 -5.888 13.937 1.00 17.16 C ATOM 2433 CD2 TYR B 120 3.382 -6.684 15.085 1.00 18.95 C ATOM 2434 CE1 TYR B 120 5.856 -7.169 13.926 1.00 19.98 C ATOM 2435 CE2 TYR B 120 3.905 -7.976 15.079 1.00 18.57 C ATOM 2436 CZ TYR B 120 5.143 -8.209 14.498 1.00 19.88 C ATOM 2437 OH TYR B 120 5.679 -9.474 14.484 1.00 20.84 O ATOM 2438 HH TYR B 120 6.560 -9.453 14.033 1.00 0.00 H ATOM 2439 H TYR B 120 3.670 -3.742 17.149 1.00 0.00 H ATOM 2440 N MET B 121 4.751 -0.990 14.451 1.00 14.30 N ATOM 2441 CA MET B 121 4.439 0.423 14.481 1.00 12.87 C ATOM 2442 C MET B 121 4.465 1.090 13.116 1.00 12.84 C ATOM 2443 O MET B 121 5.309 0.784 12.275 1.00 13.92 O ATOM 2444 CB MET B 121 5.465 1.061 15.423 1.00 12.98 C ATOM 2445 CG MET B 121 5.377 2.538 15.697 1.00 15.11 C ATOM 2446 SD MET B 121 6.810 2.963 16.740 1.00 14.00 S ATOM 2447 CE MET B 121 6.289 2.333 18.323 1.00 16.76 C ATOM 2448 H MET B 121 5.510 -1.343 13.834 1.00 0.00 H ATOM 2449 N ALA B 122 3.523 1.998 12.899 1.00 12.77 N ATOM 2450 CA ALA B 122 3.465 2.734 11.645 1.00 11.18 C ATOM 2451 C ALA B 122 4.250 4.015 11.881 1.00 10.11 C ATOM 2452 O ALA B 122 4.381 4.464 13.017 1.00 10.45 O ATOM 2453 CB ALA B 122 2.024 3.069 11.294 1.00 10.04 C ATOM 2454 H ALA B 122 2.815 2.187 13.637 1.00 0.00 H ATOM 2455 N PHE B 123 4.788 4.598 10.816 1.00 9.79 N ATOM 2456 CA PHE B 123 5.518 5.848 10.963 1.00 9.24 C ATOM 2457 C PHE B 123 5.578 6.606 9.645 1.00 8.68 C ATOM 2458 O PHE B 123 5.460 6.027 8.569 1.00 9.86 O ATOM 2459 CB PHE B 123 6.941 5.601 11.503 1.00 9.39 C ATOM 2460 CG PHE B 123 7.905 5.027 10.492 1.00 9.87 C ATOM 2461 CD1 PHE B 123 8.542 5.848 9.568 1.00 12.13 C ATOM 2462 CD2 PHE B 123 8.191 3.662 10.480 1.00 11.63 C ATOM 2463 CE1 PHE B 123 9.448 5.326 8.648 1.00 13.45 C ATOM 2464 CE2 PHE B 123 9.099 3.126 9.563 1.00 10.72 C ATOM 2465 CZ PHE B 123 9.730 3.960 8.643 1.00 11.30 C ATOM 2466 H PHE B 123 4.688 4.161 9.877 1.00 0.00 H ATOM 2467 N LYS B 124 5.731 7.915 9.753 1.00 9.71 N ATOM 2468 CA LYS B 124 5.844 8.782 8.593 1.00 10.35 C ATOM 2469 C LYS B 124 7.094 9.605 8.818 1.00 11.45 C ATOM 2470 O LYS B 124 7.322 10.107 9.914 1.00 11.94 O ATOM 2471 CB LYS B 124 4.634 9.713 8.490 1.00 13.64 C ATOM 2472 CG LYS B 124 3.327 9.016 8.176 1.00 16.30 C ATOM 2473 CD LYS B 124 2.200 10.027 8.021 1.00 18.57 C ATOM 2474 CE LYS B 124 0.896 9.348 7.642 1.00 21.32 C ATOM 2475 NZ LYS B 124 -0.232 10.323 7.630 1.00 25.42 N ATOM 2476 HZ1 LYS B 124 -0.337 10.742 8.576 1.00 0.00 H ATOM 2477 HZ2 LYS B 124 -0.033 11.073 6.938 1.00 0.00 H ATOM 2478 HZ3 LYS B 124 -1.110 9.832 7.368 1.00 0.00 H ATOM 2479 H LYS B 124 5.772 8.339 10.702 1.00 0.00 H ATOM 2480 N ILE B 125 7.907 9.741 7.782 1.00 10.94 N ATOM 2481 CA ILE B 125 9.125 10.519 7.897 1.00 11.79 C ATOM 2482 C ILE B 125 9.321 11.295 6.607 1.00 11.29 C ATOM 2483 O ILE B 125 8.736 10.956 5.580 1.00 10.19 O ATOM 2484 CB ILE B 125 10.334 9.590 8.165 1.00 14.14 C ATOM 2485 CG1 ILE B 125 11.570 10.410 8.508 1.00 16.81 C ATOM 2486 CG2 ILE B 125 10.586 8.707 6.964 1.00 12.19 C ATOM 2487 CD1 ILE B 125 12.709 9.567 9.055 1.00 18.13 C ATOM 2488 H ILE B 125 7.670 9.286 6.878 1.00 0.00 H ATOM 2489 N SER B 126 10.123 12.351 6.674 1.00 10.79 N ATOM 2490 CA SER B 126 10.402 13.182 5.509 1.00 10.53 C ATOM 2491 C SER B 126 11.889 13.519 5.515 1.00 10.89 C ATOM 2492 O SER B 126 12.313 14.490 6.137 1.00 13.49 O ATOM 2493 CB SER B 126 9.561 14.465 5.568 1.00 11.08 C ATOM 2494 OG SER B 126 9.868 15.327 4.492 1.00 9.95 O ATOM 2495 HG SER B 126 10.826 15.574 4.532 1.00 0.00 H ATOM 2496 H SER B 126 10.565 12.592 7.584 1.00 0.00 H ATOM 2497 N CYS B 127 12.678 12.700 4.828 1.00 11.15 N ATOM 2498 CA CYS B 127 14.124 12.894 4.759 1.00 10.58 C ATOM 2499 C CYS B 127 14.459 14.158 3.985 1.00 10.55 C ATOM 2500 O CYS B 127 13.943 14.371 2.896 1.00 10.69 O ATOM 2501 CB CYS B 127 14.778 11.688 4.087 1.00 12.41 C ATOM 2502 SG CYS B 127 16.570 11.823 3.910 1.00 13.72 S ATOM 2503 H CYS B 127 12.253 11.896 4.324 1.00 0.00 H ATOM 2504 N LYS B 128 15.340 14.985 4.539 1.00 9.51 N ATOM 2505 CA LYS B 128 15.705 16.243 3.889 1.00 10.25 C ATOM 2506 C LYS B 128 16.476 16.078 2.577 1.00 10.22 C ATOM 2507 O LYS B 128 16.462 16.971 1.734 1.00 10.54 O ATOM 2508 CB LYS B 128 16.488 17.120 4.867 1.00 9.37 C ATOM 2509 CG LYS B 128 15.638 17.584 6.047 1.00 10.45 C ATOM 2510 CD LYS B 128 16.456 18.370 7.057 1.00 10.53 C ATOM 2511 CE LYS B 128 15.595 18.874 8.211 1.00 10.20 C ATOM 2512 NZ LYS B 128 14.626 19.931 7.807 1.00 12.50 N ATOM 2513 HZ1 LYS B 128 15.145 20.747 7.423 1.00 0.00 H ATOM 2514 HZ2 LYS B 128 13.986 19.553 7.080 1.00 0.00 H ATOM 2515 HZ3 LYS B 128 14.074 20.229 8.636 1.00 0.00 H ATOM 2516 H LYS B 128 15.776 14.733 5.449 1.00 0.00 H ATOM 2517 N GLY B 129 17.149 14.944 2.406 1.00 11.71 N ATOM 2518 CA GLY B 129 17.871 14.702 1.165 1.00 13.12 C ATOM 2519 C GLY B 129 19.187 15.430 0.960 1.00 11.56 C ATOM 2520 O GLY B 129 19.698 15.497 -0.161 1.00 11.47 O ATOM 2521 H GLY B 129 17.160 14.228 3.160 1.00 0.00 H ATOM 2522 N HIS B 130 19.732 15.994 2.030 1.00 12.75 N ATOM 2523 CA HIS B 130 21.014 16.676 1.953 1.00 12.86 C ATOM 2524 C HIS B 130 22.084 15.593 1.975 1.00 13.75 C ATOM 2525 O HIS B 130 21.804 14.449 2.334 1.00 13.83 O ATOM 2526 CB HIS B 130 21.188 17.602 3.152 1.00 13.02 C ATOM 2527 CG HIS B 130 20.245 18.759 3.153 1.00 18.28 C ATOM 2528 ND1 HIS B 130 19.645 19.231 4.301 1.00 18.66 N ATOM 2529 CD2 HIS B 130 19.820 19.559 2.148 1.00 15.71 C ATOM 2530 CE1 HIS B 130 18.893 20.275 4.004 1.00 24.68 C ATOM 2531 NE2 HIS B 130 18.981 20.496 2.703 1.00 26.38 N ATOM 2532 H HIS B 130 19.233 15.947 2.941 1.00 0.00 H ATOM 2533 N PRO B 131 23.323 15.933 1.584 1.00 13.51 N ATOM 2534 CA PRO B 131 24.403 14.943 1.577 1.00 14.89 C ATOM 2535 C PRO B 131 24.555 14.105 2.850 1.00 13.79 C ATOM 2536 O PRO B 131 24.833 12.912 2.777 1.00 15.04 O ATOM 2537 CB PRO B 131 25.636 15.793 1.287 1.00 15.40 C ATOM 2538 CG PRO B 131 25.090 16.816 0.336 1.00 15.13 C ATOM 2539 CD PRO B 131 23.781 17.209 1.002 1.00 14.38 C ATOM 2540 N LEU B 132 24.366 14.719 4.013 1.00 14.29 N ATOM 2541 CA LEU B 132 24.520 13.995 5.275 1.00 12.97 C ATOM 2542 C LEU B 132 23.203 13.646 5.971 1.00 12.81 C ATOM 2543 O LEU B 132 23.209 13.238 7.131 1.00 12.51 O ATOM 2544 CB LEU B 132 25.386 14.811 6.247 1.00 15.34 C ATOM 2545 CG LEU B 132 26.817 15.168 5.831 1.00 18.17 C ATOM 2546 CD1 LEU B 132 27.452 16.030 6.914 1.00 20.43 C ATOM 2547 CD2 LEU B 132 27.630 13.903 5.616 1.00 18.63 C ATOM 2548 H LEU B 132 24.106 15.726 4.026 1.00 0.00 H ATOM 2549 N ALA B 133 22.081 13.788 5.270 1.00 12.42 N ATOM 2550 CA ALA B 133 20.777 13.499 5.865 1.00 13.61 C ATOM 2551 C ALA B 133 20.412 12.020 5.853 1.00 13.93 C ATOM 2552 O ALA B 133 19.382 11.625 6.398 1.00 14.58 O ATOM 2553 CB ALA B 133 19.694 14.294 5.150 1.00 12.82 C ATOM 2554 H ALA B 133 22.132 14.110 4.282 1.00 0.00 H ATOM 2555 N GLU B 134 21.258 11.206 5.238 1.00 13.50 N ATOM 2556 CA GLU B 134 21.007 9.774 5.137 1.00 15.34 C ATOM 2557 C GLU B 134 22.322 9.025 5.346 1.00 16.54 C ATOM 2558 O GLU B 134 23.158 8.961 4.445 1.00 14.76 O ATOM 2559 CB GLU B 134 20.443 9.479 3.750 1.00 18.03 C ATOM 2560 CG GLU B 134 19.666 8.204 3.611 1.00 20.89 C ATOM 2561 CD GLU B 134 19.158 8.030 2.195 1.00 22.21 C ATOM 2562 OE1 GLU B 134 19.846 7.363 1.391 1.00 24.30 O ATOM 2563 OE2 GLU B 134 18.078 8.579 1.883 1.00 22.64 O ATOM 2564 H GLU B 134 22.124 11.599 4.816 1.00 0.00 H ATOM 2565 N LEU B 135 22.500 8.452 6.532 1.00 16.63 N ATOM 2566 CA LEU B 135 23.736 7.742 6.851 1.00 16.26 C ATOM 2567 C LEU B 135 23.497 6.430 7.593 1.00 18.82 C ATOM 2568 O LEU B 135 22.450 6.230 8.213 1.00 15.67 O ATOM 2569 CB LEU B 135 24.641 8.639 7.705 1.00 16.23 C ATOM 2570 CG LEU B 135 25.017 10.020 7.159 1.00 17.64 C ATOM 2571 CD1 LEU B 135 25.723 10.833 8.239 1.00 18.37 C ATOM 2572 CD2 LEU B 135 25.918 9.864 5.942 1.00 19.02 C ATOM 2573 H LEU B 135 21.746 8.510 7.246 1.00 0.00 H ATOM 2574 N SER B 136 24.482 5.538 7.521 1.00 19.50 N ATOM 2575 CA SER B 136 24.405 4.251 8.199 1.00 21.28 C ATOM 2576 C SER B 136 25.644 4.071 9.062 1.00 21.80 C ATOM 2577 O SER B 136 26.740 4.507 8.700 1.00 21.41 O ATOM 2578 CB SER B 136 24.319 3.107 7.188 1.00 22.40 C ATOM 2579 OG SER B 136 25.461 3.076 6.351 1.00 25.86 O ATOM 2580 HG SER B 136 25.378 2.327 5.709 1.00 0.00 H ATOM 2581 H SER B 136 25.331 5.766 6.965 1.00 0.00 H ATOM 2582 N ARG B 137 25.460 3.434 10.211 1.00 21.61 N ATOM 2583 CA ARG B 137 26.559 3.194 11.128 1.00 22.83 C ATOM 2584 C ARG B 137 26.411 1.817 11.753 1.00 22.36 C ATOM 2585 O ARG B 137 25.313 1.411 12.139 1.00 20.77 O ATOM 2586 CB ARG B 137 26.574 4.254 12.233 1.00 23.37 C ATOM 2587 CG ARG B 137 26.840 5.681 11.756 1.00 25.66 C ATOM 2588 CD ARG B 137 28.306 5.900 11.406 1.00 26.31 C ATOM 2589 NE ARG B 137 28.602 7.294 11.073 1.00 25.93 N ATOM 2590 CZ ARG B 137 28.453 7.832 9.865 1.00 26.77 C ATOM 2591 NH1 ARG B 137 28.011 7.096 8.852 1.00 28.39 N ATOM 2592 NH2 ARG B 137 28.751 9.109 9.666 1.00 26.44 N ATOM 2593 HE ARG B 137 28.954 7.908 11.835 1.00 0.00 H ATOM 2594 HH12 ARG B 137 27.897 7.522 7.910 1.00 0.00 H ATOM 2595 HH11 ARG B 137 27.779 6.093 9.000 1.00 0.00 H ATOM 2596 HH22 ARG B 137 28.634 9.529 8.722 1.00 0.00 H ATOM 2597 HH21 ARG B 137 29.101 9.690 10.454 1.00 0.00 H ATOM 2598 H ARG B 137 24.507 3.099 10.460 1.00 0.00 H ATOM 2599 N THR B 138 27.523 1.094 11.818 1.00 23.22 N ATOM 2600 CA THR B 138 27.558 -0.225 12.428 1.00 24.31 C ATOM 2601 C THR B 138 28.444 -0.058 13.650 1.00 24.30 C ATOM 2602 O THR B 138 29.589 0.378 13.539 1.00 23.17 O ATOM 2603 CB THR B 138 28.170 -1.281 11.491 1.00 25.89 C ATOM 2604 OG1 THR B 138 27.280 -1.516 10.393 1.00 27.54 O ATOM 2605 CG2 THR B 138 28.394 -2.591 12.240 1.00 25.93 C ATOM 2606 HG1 THR B 138 27.674 -2.195 9.790 1.00 0.00 H ATOM 2607 H THR B 138 28.400 1.485 11.418 1.00 0.00 H ATOM 2608 N ILE B 139 27.905 -0.395 14.814 1.00 23.91 N ATOM 2609 CA ILE B 139 28.631 -0.251 16.065 1.00 25.88 C ATOM 2610 C ILE B 139 28.620 -1.571 16.816 1.00 25.25 C ATOM 2611 O ILE B 139 27.562 -2.151 17.049 1.00 25.43 O ATOM 2612 CB ILE B 139 27.970 0.833 16.938 1.00 27.70 C ATOM 2613 CG1 ILE B 139 27.730 2.087 16.096 1.00 30.06 C ATOM 2614 CG2 ILE B 139 28.851 1.152 18.131 1.00 29.30 C ATOM 2615 CD1 ILE B 139 26.906 3.143 16.779 1.00 30.36 C ATOM 2616 H ILE B 139 26.936 -0.773 14.832 1.00 0.00 H ATOM 2617 N VAL B 140 29.799 -2.047 17.200 1.00 25.26 N ATOM 2618 CA VAL B 140 29.890 -3.309 17.912 1.00 25.64 C ATOM 2619 C VAL B 140 30.916 -3.268 19.042 1.00 26.30 C ATOM 2620 O VAL B 140 31.810 -2.421 19.053 1.00 26.48 O ATOM 2621 CB VAL B 140 30.248 -4.458 16.942 1.00 26.26 C ATOM 2622 CG1 VAL B 140 29.187 -4.566 15.858 1.00 25.22 C ATOM 2623 CG2 VAL B 140 31.611 -4.212 16.319 1.00 25.36 C ATOM 2624 H VAL B 140 30.665 -1.511 16.989 1.00 0.00 H ATOM 2625 N PRO B 141 30.789 -4.186 20.013 1.00 26.17 N ATOM 2626 CA PRO B 141 31.711 -4.251 21.153 1.00 27.41 C ATOM 2627 C PRO B 141 33.135 -4.588 20.721 1.00 26.69 C ATOM 2628 O PRO B 141 33.340 -5.317 19.753 1.00 26.72 O ATOM 2629 CB PRO B 141 31.117 -5.362 22.021 1.00 27.93 C ATOM 2630 CG PRO B 141 29.676 -5.391 21.638 1.00 28.40 C ATOM 2631 CD PRO B 141 29.727 -5.196 20.148 1.00 26.30 C ATOM 2632 N GLU B 142 34.112 -4.046 21.441 1.00 27.08 N ATOM 2633 CA GLU B 142 35.519 -4.315 21.162 1.00 27.42 C ATOM 2634 C GLU B 142 36.051 -5.231 22.257 1.00 27.65 C ATOM 2635 O GLU B 142 37.052 -5.925 22.078 1.00 26.94 O ATOM 2636 CB GLU B 142 36.326 -3.013 21.130 1.00 29.83 C ATOM 2637 CG GLU B 142 36.209 -2.248 19.818 1.00 32.23 C ATOM 2638 CD GLU B 142 37.022 -0.967 19.809 1.00 35.22 C ATOM 2639 OE1 GLU B 142 38.232 -1.022 20.117 1.00 36.72 O ATOM 2640 OE2 GLU B 142 36.451 0.096 19.486 1.00 37.29 O ATOM 2641 H GLU B 142 33.866 -3.411 22.227 1.00 0.00 H ATOM 2642 N GLU B 143 35.361 -5.229 23.392 1.00 26.65 N ATOM 2643 CA GLU B 143 35.740 -6.055 24.529 1.00 28.06 C ATOM 2644 C GLU B 143 34.496 -6.481 25.297 1.00 28.21 C ATOM 2645 O GLU B 143 33.482 -5.785 25.288 1.00 28.32 O ATOM 2646 CB GLU B 143 36.678 -5.281 25.446 1.00 29.15 C ATOM 2647 H GLU B 143 34.523 -4.618 23.471 1.00 0.00 H ATOM 2648 N ALA B 144 34.573 -7.632 25.953 1.00 28.28 N ATOM 2649 CA ALA B 144 33.449 -8.123 26.736 1.00 27.94 C ATOM 2650 C ALA B 144 33.380 -7.290 28.014 1.00 26.49 C ATOM 2651 O ALA B 144 34.396 -6.789 28.499 1.00 24.58 O ATOM 2652 CB ALA B 144 33.640 -9.596 27.067 1.00 28.63 C ATOM 2653 H ALA B 144 35.449 -8.191 25.907 1.00 0.00 H ATOM 2654 N ARG B 145 32.178 -7.136 28.553 1.00 26.75 N ATOM 2655 CA ARG B 145 32.001 -6.343 29.757 1.00 26.59 C ATOM 2656 C ARG B 145 32.471 -7.064 31.010 1.00 24.43 C ATOM 2657 O ARG B 145 32.524 -8.293 31.061 1.00 24.82 O ATOM 2658 CB ARG B 145 30.528 -5.969 29.938 1.00 28.23 C ATOM 2659 CG ARG B 145 29.655 -7.150 30.320 1.00 30.27 C ATOM 2660 CD ARG B 145 28.255 -6.712 30.700 1.00 33.48 C ATOM 2661 NE ARG B 145 27.413 -7.846 31.066 1.00 35.81 N ATOM 2662 CZ ARG B 145 27.060 -8.820 30.231 1.00 38.18 C ATOM 2663 NH1 ARG B 145 27.472 -8.803 28.970 1.00 38.15 N ATOM 2664 NH2 ARG B 145 26.293 -9.814 30.659 1.00 38.37 N ATOM 2665 HE ARG B 145 27.066 -7.896 32.045 1.00 0.00 H ATOM 2666 HH12 ARG B 145 27.193 -9.567 28.322 1.00 0.00 H ATOM 2667 HH11 ARG B 145 28.074 -8.026 28.630 1.00 0.00 H ATOM 2668 HH22 ARG B 145 26.017 -10.576 30.007 1.00 0.00 H ATOM 2669 HH21 ARG B 145 25.968 -9.832 31.647 1.00 0.00 H ATOM 2670 H ARG B 145 31.353 -7.588 28.109 1.00 0.00 H ATOM 2671 N VAL B 146 32.819 -6.276 32.018 1.00 22.42 N ATOM 2672 CA VAL B 146 33.237 -6.802 33.308 1.00 21.41 C ATOM 2673 C VAL B 146 32.147 -6.327 34.258 1.00 21.09 C ATOM 2674 O VAL B 146 31.873 -5.131 34.339 1.00 22.75 O ATOM 2675 CB VAL B 146 34.605 -6.222 33.747 1.00 21.82 C ATOM 2676 CG1 VAL B 146 34.861 -6.525 35.213 1.00 23.06 C ATOM 2677 CG2 VAL B 146 35.715 -6.823 32.899 1.00 21.39 C ATOM 2678 H VAL B 146 32.792 -5.245 31.881 1.00 0.00 H ATOM 2679 N GLU B 147 31.508 -7.265 34.950 1.00 19.06 N ATOM 2680 CA GLU B 147 30.441 -6.932 35.885 1.00 18.41 C ATOM 2681 C GLU B 147 30.353 -7.991 36.971 1.00 18.94 C ATOM 2682 O GLU B 147 30.792 -9.129 36.704 1.00 17.68 O ATOM 2683 CB GLU B 147 29.102 -6.839 35.142 1.00 20.25 C ATOM 2684 OXT GLU B 147 29.829 -7.671 38.058 1.00 18.02 O ATOM 2685 H GLU B 147 31.776 -8.261 34.821 1.00 0.00 H TER 2686 GLU B 147 HETATM 2687 O HOH 1 7.897 0.886 12.528 1.00 12.26 O HETATM 2688 O HOH 2 1.363 -8.220 8.028 1.00 17.56 O HETATM 2689 O HOH 3 -0.654 -2.337 -3.627 1.00 11.18 O HETATM 2690 O HOH 4 6.355 -3.618 10.925 1.00 17.98 O HETATM 2691 O HOH 5 4.195 -4.850 -15.331 1.00 14.12 O HETATM 2692 O HOH 6 13.411 7.421 -12.502 1.00 17.74 O HETATM 2693 O HOH 7 17.519 4.796 -12.099 1.00 16.28 O HETATM 2694 O HOH 8 20.549 17.394 -9.520 1.00 16.48 O HETATM 2695 O HOH 9 0.541 5.342 -7.395 1.00 19.96 O HETATM 2696 O HOH 10 18.059 7.351 -4.027 1.00 15.59 O HETATM 2697 O HOH 11 7.696 -5.324 3.724 1.00 16.21 O HETATM 2698 O HOH 12 8.036 -5.959 10.493 1.00 20.72 O HETATM 2699 O HOH 13 19.603 8.028 -6.146 1.00 17.15 O HETATM 2700 O HOH 14 0.340 -4.316 13.255 1.00 18.20 O HETATM 2701 O HOH 15 8.142 15.054 -2.084 1.00 16.36 O HETATM 2702 O HOH 16 -3.305 -2.436 -4.214 1.00 15.99 O HETATM 2703 O HOH 17 10.494 14.376 -0.897 1.00 19.85 O HETATM 2704 O HOH 18 2.088 5.708 8.802 1.00 16.77 O HETATM 2705 O HOH 19 30.589 -7.184 -1.000 1.00 24.46 O HETATM 2706 O HOH 20 31.305 2.696 -12.014 1.00 27.51 O HETATM 2707 O HOH 21 -3.832 -5.349 -2.982 1.00 24.00 O HETATM 2708 O HOH 22 9.940 17.129 -11.235 1.00 17.51 O HETATM 2709 O HOH 23 10.644 17.366 -1.464 1.00 20.44 O HETATM 2710 O HOH 24 -0.581 -2.576 -0.910 1.00 22.59 O HETATM 2711 O HOH 25 20.449 15.554 -15.645 1.00 19.60 O HETATM 2712 O HOH 26 15.595 6.577 -14.118 1.00 21.64 O HETATM 2713 O HOH 27 11.568 -3.994 11.817 1.00 18.41 O HETATM 2714 O HOH 28 19.956 8.971 -18.690 1.00 20.24 O HETATM 2715 O HOH 29 19.397 17.327 -13.941 1.00 20.08 O HETATM 2716 O HOH 30 22.819 15.034 -14.028 1.00 24.05 O HETATM 2717 O HOH 31 0.524 -7.672 5.487 1.00 26.07 O HETATM 2718 O HOH 32 25.022 13.687 -15.150 1.00 20.46 O HETATM 2719 O HOH 33 23.067 17.247 -10.275 1.00 18.48 O HETATM 2720 O HOH 34 -2.806 -1.425 0.055 1.00 26.31 O HETATM 2721 O HOH 35 29.229 2.863 -5.500 1.00 25.82 O HETATM 2722 O HOH 36 8.378 14.928 -4.791 1.00 21.40 O HETATM 2723 O HOH 37 4.563 -15.000 -1.510 1.00 18.00 O HETATM 2724 O HOH 38 29.106 14.328 -2.117 1.00 30.99 O HETATM 2725 O HOH 39 0.170 4.059 8.115 1.00 27.46 O HETATM 2726 O HOH 40 23.488 20.625 -0.748 1.00 20.93 O HETATM 2727 O HOH 41 -1.693 -4.195 11.566 1.00 29.17 O HETATM 2728 O HOH 42 21.078 19.601 -0.529 1.00 18.04 O HETATM 2729 O HOH 43 26.810 18.080 -2.605 1.00 19.42 O HETATM 2730 O HOH 44 5.324 -11.942 11.376 1.00 34.43 O HETATM 2731 O HOH 45 27.371 14.080 -16.337 1.00 35.89 O HETATM 2732 O HOH 46 4.701 16.556 -1.358 1.00 24.48 O HETATM 2733 O HOH 47 29.809 14.216 -6.583 1.00 25.53 O HETATM 2734 O HOH 48 -3.300 3.621 2.826 1.00 22.75 O HETATM 2735 O HOH 49 0.759 -10.564 8.988 1.00 24.02 O HETATM 2736 O HOH 50 8.828 7.129 -10.545 1.00 26.91 O HETATM 2737 O HOH 51 26.344 20.963 -4.347 1.00 22.88 O HETATM 2738 O HOH 52 23.866 -4.754 -18.931 1.00 29.24 O HETATM 2739 O HOH 53 16.158 -8.604 -15.342 1.00 23.91 O HETATM 2740 O HOH 54 31.402 -8.121 3.170 1.00 43.31 O HETATM 2741 O HOH 55 9.518 5.175 -12.132 1.00 22.62 O HETATM 2742 O HOH 56 13.701 -14.406 -10.653 1.00 27.09 O HETATM 2743 O HOH 57 22.153 7.224 -17.743 1.00 23.30 O HETATM 2744 O HOH 58 2.322 -5.264 5.357 1.00 23.46 O HETATM 2745 O HOH 59 17.338 17.940 -15.563 1.00 25.42 O HETATM 2746 O HOH 60 8.498 10.571 -11.813 1.00 35.86 O HETATM 2747 O HOH 61 -2.086 6.008 -0.218 1.00 31.72 O HETATM 2748 O HOH 62 32.869 -5.538 -12.089 1.00 29.46 O HETATM 2749 O HOH 63 15.495 19.740 -6.201 1.00 32.47 O HETATM 2750 O HOH 64 -2.368 2.538 6.461 1.00 23.88 O HETATM 2751 O HOH 65 26.727 -9.501 -16.622 1.00 34.73 O HETATM 2752 O HOH 66 1.696 4.303 -9.713 1.00 22.97 O HETATM 2753 O HOH 67 36.479 -7.536 -4.304 1.00 29.54 O HETATM 2754 O HOH 68 13.977 18.598 -18.517 1.00 23.55 O HETATM 2755 O HOH 69 -0.154 -13.708 2.533 1.00 36.28 O HETATM 2756 O HOH 70 17.876 4.081 -15.764 1.00 28.28 O HETATM 2757 O HOH 71 12.260 -11.380 8.020 1.00 30.18 O HETATM 2758 O HOH 72 33.411 -8.859 -6.684 1.00 30.31 O HETATM 2759 O HOH 73 12.221 -16.920 0.596 1.00 47.10 O HETATM 2760 O HOH 74 -1.895 -4.608 0.619 1.00 35.87 O HETATM 2761 O HOH 75 6.637 5.754 -9.907 1.00 26.64 O HETATM 2762 O HOH 76 14.966 -10.958 -15.029 1.00 35.29 O HETATM 2763 O HOH 77 20.808 -17.817 -11.369 1.00 32.99 O HETATM 2764 O HOH 78 -1.674 -9.092 -4.310 1.00 25.23 O HETATM 2765 O HOH 79 15.539 -15.400 -4.041 1.00 31.60 O HETATM 2766 O HOH 80 28.954 -6.535 -15.043 1.00 24.82 O HETATM 2767 O HOH 81 1.070 -3.140 -14.005 1.00 41.90 O HETATM 2768 O HOH 82 5.514 -12.967 -8.941 1.00 37.59 O HETATM 2769 O HOH 83 4.619 10.673 -9.769 1.00 32.06 O HETATM 2770 O HOH 84 16.324 -10.540 7.820 1.00 31.79 O HETATM 2771 O HOH 85 11.831 -18.215 -3.333 1.00 43.97 O HETATM 2772 O HOH 86 19.987 20.178 -5.167 1.00 32.38 O HETATM 2773 O HOH 87 28.108 16.429 -5.058 1.00 38.27 O HETATM 2774 O HOH 88 18.799 -9.844 -15.539 1.00 31.46 O HETATM 2775 O HOH 89 28.534 6.238 -3.530 1.00 25.41 O HETATM 2776 O HOH 90 0.569 -8.492 -5.699 1.00 31.38 O HETATM 2777 O HOH 91 19.475 -7.138 7.253 1.00 32.33 O HETATM 2778 O HOH 92 12.156 9.732 -11.881 1.00 19.93 O HETATM 2779 O HOH 93 -1.356 -1.072 -9.616 1.00 22.67 O HETATM 2780 O HOH 94 34.708 -8.941 -2.894 1.00 30.14 O HETATM 2781 O HOH 95 17.395 7.315 -17.774 1.00 23.81 O HETATM 2782 O HOH 96 33.408 -7.601 -0.804 1.00 25.12 O HETATM 2783 O HOH 97 13.322 -15.813 -2.574 1.00 31.63 O HETATM 2784 O HOH 98 22.928 -19.369 -3.258 1.00 35.77 O HETATM 2785 O HOH 99 27.016 12.023 -18.191 1.00 25.54 O HETATM 2786 O HOH 100 13.268 -12.938 -13.326 1.00 30.56 O HETATM 2787 O HOH 101 19.060 16.141 -11.657 1.00 39.05 O HETATM 2788 O HOH 102 8.848 -14.870 -6.578 1.00 31.96 O HETATM 2789 O HOH 103 7.526 -10.086 10.491 1.00 30.56 O HETATM 2790 O HOH 104 10.890 11.894 -19.197 1.00 29.24 O HETATM 2791 O HOH 105 -3.302 -0.538 4.597 1.00 32.46 O HETATM 2792 O HOH 106 30.541 -6.992 -12.682 1.00 28.47 O HETATM 2793 O HOH 107 29.293 8.935 -3.574 1.00 33.96 O HETATM 2794 O HOH 108 22.127 -14.955 -0.826 1.00 24.40 O HETATM 2795 O HOH 109 20.924 4.698 -18.761 1.00 32.00 O HETATM 2796 O HOH 110 25.709 1.060 -15.872 1.00 24.20 O HETATM 2797 O HOH 111 22.895 22.634 -3.866 1.00 28.24 O HETATM 2798 O HOH 112 3.756 -14.265 4.780 1.00 37.07 O HETATM 2799 O HOH 113 -1.601 0.894 8.577 1.00 33.37 O HETATM 2800 O HOH 114 9.368 18.182 -4.754 1.00 28.93 O HETATM 2801 O HOH 115 15.230 17.125 -20.416 1.00 30.77 O HETATM 2802 O HOH 116 23.100 15.630 -19.261 1.00 44.08 O HETATM 2803 O HOH 117 16.006 -17.340 -5.957 1.00 38.37 O HETATM 2804 O HOH 118 29.097 -1.637 -15.636 1.00 31.95 O HETATM 2805 O HOH 119 2.885 -0.515 -14.624 1.00 23.66 O HETATM 2806 O HOH 120 -0.513 -9.878 4.509 1.00 38.15 O HETATM 2807 O HOH 121 -1.022 -6.364 3.631 1.00 27.92 O HETATM 2808 O HOH 122 29.221 -7.540 1.459 1.00 35.09 O HETATM 2809 O HOH 123 24.516 -14.061 3.721 1.00 35.27 O HETATM 2810 O HOH 124 0.846 12.068 1.295 1.00 31.61 O HETATM 2811 O HOH 125 5.113 -16.403 0.739 1.00 33.94 O HETATM 2812 O HOH 126 -0.200 9.388 -6.431 1.00 38.94 O HETATM 2813 O HOH 127 30.610 -18.015 -5.186 1.00 33.99 O HETATM 2814 O HOH 128 -1.424 -12.799 0.060 1.00 35.73 O HETATM 2815 O HOH 129 10.766 -11.883 -13.674 1.00 37.50 O HETATM 2816 O HOH 130 18.817 2.467 -11.364 1.00 31.81 O HETATM 2817 O HOH 131 -5.537 -5.004 -0.776 1.00 36.51 O HETATM 2818 O HOH 132 35.254 -3.206 -9.451 1.00 33.11 O HETATM 2819 O HOH 133 32.417 0.439 -0.326 1.00 33.93 O HETATM 2820 O HOH 134 27.217 -3.041 6.405 1.00 33.03 O HETATM 2821 O HOH 135 19.523 -16.620 -9.321 1.00 32.32 O HETATM 2822 O HOH 136 10.897 9.307 -18.372 1.00 36.28 O HETATM 2823 O HOH 137 19.604 21.509 -2.079 1.00 33.23 O HETATM 2824 O HOH 138 29.358 6.051 -0.850 1.00 32.97 O HETATM 2825 O HOH 139 -2.217 4.469 -7.376 1.00 33.20 O HETATM 2826 O HOH 140 -1.873 -3.929 4.239 1.00 32.75 O HETATM 2827 O HOH 141 -0.013 -12.068 6.494 1.00 37.47 O HETATM 2828 O HOH 142 0.236 12.173 -7.407 1.00 36.85 O HETATM 2829 O HOH 143 5.666 11.382 5.062 1.00 15.86 O HETATM 2830 O HOH 144 25.770 -2.207 39.439 1.00 34.94 O HETATM 2831 O HOH 145 4.359 18.401 7.861 1.00 4.23 O HETATM 2832 O HOH 146 21.439 17.229 -1.742 1.00 10.21 O HETATM 2833 O HOH 147 11.636 21.518 7.483 1.00 14.78 O HETATM 2834 O HOH 148 16.201 22.028 11.104 1.00 12.36 O HETATM 2835 O HOH 149 17.756 20.023 12.427 1.00 17.25 O HETATM 2836 O HOH 150 29.110 -9.737 39.545 1.00 14.35 O HETATM 2837 O HOH 151 16.918 20.165 15.034 1.00 13.82 O HETATM 2838 O HOH 152 8.761 -0.661 18.551 1.00 15.47 O HETATM 2839 O HOH 153 17.205 9.158 -0.447 1.00 15.96 O HETATM 2840 O HOH 154 2.075 6.858 11.521 1.00 19.92 O HETATM 2841 O HOH 155 10.954 15.118 1.885 1.00 17.54 O HETATM 2842 O HOH 156 9.183 0.829 16.401 1.00 11.99 O HETATM 2843 O HOH 157 20.705 17.656 6.400 1.00 15.94 O HETATM 2844 O HOH 158 9.170 18.790 17.925 1.00 17.36 O HETATM 2845 O HOH 159 23.598 10.475 2.243 1.00 25.33 O HETATM 2846 O HOH 160 -1.951 -6.013 19.964 1.00 25.37 O HETATM 2847 O HOH 161 6.876 -12.400 27.517 1.00 24.05 O HETATM 2848 O HOH 162 1.089 9.331 11.809 1.00 22.33 O HETATM 2849 O HOH 163 7.429 -10.549 25.706 1.00 25.59 O HETATM 2850 O HOH 164 21.761 11.531 8.973 1.00 18.22 O HETATM 2851 O HOH 165 25.327 -10.009 15.760 1.00 20.53 O HETATM 2852 O HOH 166 30.231 10.901 11.540 1.00 25.33 O HETATM 2853 O HOH 167 7.662 6.668 23.862 1.00 24.40 O HETATM 2854 O HOH 168 2.289 -13.533 28.543 1.00 21.36 O HETATM 2855 O HOH 169 3.495 19.970 13.016 1.00 19.53 O HETATM 2856 O HOH 170 14.915 -9.727 19.348 1.00 23.46 O HETATM 2857 O HOH 171 10.490 -7.829 14.172 1.00 22.87 O HETATM 2858 O HOH 172 23.236 19.178 6.327 1.00 14.72 O HETATM 2859 O HOH 173 9.266 10.735 22.926 1.00 25.83 O HETATM 2860 O HOH 174 1.170 18.353 13.686 1.00 26.54 O HETATM 2861 O HOH 175 20.988 -6.208 28.936 1.00 29.92 O HETATM 2862 O HOH 176 25.484 -4.932 31.024 1.00 25.53 O HETATM 2863 O HOH 177 32.184 7.808 12.241 1.00 38.14 O HETATM 2864 O HOH 178 32.194 -0.499 16.161 1.00 28.59 O HETATM 2865 O HOH 179 21.582 4.550 31.188 1.00 37.12 O HETATM 2866 O HOH 180 18.894 17.018 27.290 1.00 22.54 O HETATM 2867 O HOH 181 19.814 21.424 10.961 1.00 22.46 O HETATM 2868 O HOH 182 -0.998 1.027 30.879 1.00 32.44 O HETATM 2869 O HOH 183 28.932 -4.001 33.682 1.00 29.22 O HETATM 2870 O HOH 184 -0.665 5.816 11.652 1.00 23.00 O HETATM 2871 O HOH 185 -7.057 2.138 26.598 1.00 31.59 O HETATM 2872 O HOH 186 15.826 21.800 6.207 1.00 26.22 O HETATM 2873 O HOH 187 23.208 -3.308 31.032 1.00 32.76 O HETATM 2874 O HOH 188 21.312 11.748 1.743 1.00 24.56 O HETATM 2875 O HOH 189 36.230 -8.462 29.515 1.00 25.58 O HETATM 2876 O HOH 190 -0.727 -6.842 13.795 1.00 29.10 O HETATM 2877 O HOH 191 14.819 21.449 20.323 1.00 22.13 O HETATM 2878 O HOH 192 28.042 -5.947 38.820 1.00 23.92 O HETATM 2879 O HOH 193 14.927 15.359 25.949 1.00 23.77 O HETATM 2880 O HOH 194 23.150 5.676 29.175 1.00 22.31 O HETATM 2881 O HOH 195 14.803 4.508 23.957 1.00 25.27 O HETATM 2882 O HOH 196 27.504 -3.577 29.798 1.00 25.34 O HETATM 2883 O HOH 197 9.638 -5.621 12.915 1.00 23.68 O HETATM 2884 O HOH 198 15.962 22.865 15.847 1.00 36.97 O HETATM 2885 O HOH 199 34.762 -9.949 31.561 1.00 20.02 O HETATM 2886 O HOH 200 35.185 -4.881 17.539 1.00 32.59 O HETATM 2887 O HOH 201 19.116 21.145 7.634 1.00 26.37 O HETATM 2888 O HOH 202 23.842 -8.890 27.482 1.00 33.55 O HETATM 2889 O HOH 203 12.419 -10.600 19.651 1.00 33.04 O HETATM 2890 O HOH 204 13.227 13.198 26.757 1.00 27.45 O HETATM 2891 O HOH 205 24.314 17.603 4.428 1.00 21.72 O HETATM 2892 O HOH 206 25.957 -12.664 15.586 1.00 28.84 O HETATM 2893 O HOH 207 25.584 20.155 7.565 1.00 32.57 O HETATM 2894 O HOH 208 14.417 6.267 29.450 1.00 28.49 O HETATM 2895 O HOH 209 25.203 3.742 29.486 1.00 27.64 O HETATM 2896 O HOH 210 8.745 4.694 25.382 1.00 27.49 O HETATM 2897 O HOH 211 15.212 18.994 26.287 1.00 32.30 O HETATM 2898 O HOH 212 25.604 -7.385 38.700 1.00 35.67 O HETATM 2899 O HOH 213 7.265 18.283 6.428 1.00 20.76 O HETATM 2900 O HOH 214 35.404 -4.133 29.255 1.00 43.37 O HETATM 2901 O HOH 215 26.527 6.124 5.485 1.00 26.73 O HETATM 2902 O HOH 216 40.044 -2.903 20.793 1.00 27.72 O HETATM 2903 O HOH 217 2.307 3.757 31.181 1.00 36.48 O HETATM 2904 O HOH 218 22.374 -8.356 9.116 1.00 28.97 O HETATM 2905 O HOH 219 20.615 9.029 32.633 1.00 35.65 O HETATM 2906 O HOH 220 31.186 -10.312 30.055 1.00 35.53 O HETATM 2907 O HOH 221 -4.432 9.686 24.070 1.00 37.43 O HETATM 2908 O HOH 222 26.679 18.647 3.081 1.00 33.94 O HETATM 2909 O HOH 223 33.472 -3.399 31.227 1.00 29.38 O HETATM 2910 O HOH 224 4.932 19.479 16.526 1.00 24.95 O HETATM 2911 O HOH 225 29.229 -2.270 31.676 1.00 30.57 O HETATM 2912 O HOH 226 14.505 18.812 1.561 1.00 33.31 O HETATM 2913 O HOH 227 -4.194 -1.223 15.057 1.00 33.03 O HETATM 2914 O HOH 228 27.936 21.373 11.880 1.00 26.23 O HETATM 2915 O HOH 229 31.447 -2.142 30.031 1.00 22.75 O HETATM 2916 O HOH 230 7.235 -12.761 22.880 1.00 23.29 O HETATM 2917 O HOH 231 12.359 1.983 22.707 1.00 23.69 O HETATM 2918 O HOH 232 9.335 -5.778 26.336 1.00 31.48 O HETATM 2919 O HOH 233 0.805 9.438 14.938 1.00 20.84 O HETATM 2920 O HOH 234 13.635 23.487 6.192 1.00 28.93 O HETATM 2921 O HOH 235 15.009 -11.363 26.265 1.00 28.70 O HETATM 2922 O HOH 236 10.890 -9.569 17.763 1.00 29.35 O HETATM 2923 O HOH 237 24.293 -3.400 10.395 1.00 43.94 O HETATM 2924 O HOH 238 21.829 20.858 8.209 1.00 34.26 O HETATM 2925 O HOH 239 12.140 17.498 2.641 1.00 25.70 O HETATM 2926 O HOH 240 28.693 -6.014 41.946 1.00 35.08 O HETATM 2927 O HOH 241 8.114 -7.002 29.819 1.00 31.85 O HETATM 2928 O HOH 242 8.382 -10.187 17.617 1.00 29.34 O HETATM 2929 O HOH 243 17.173 21.988 8.790 1.00 41.39 O HETATM 2930 O HOH 244 3.813 14.078 20.157 1.00 35.47 O HETATM 2931 O HOH 245 23.334 -7.527 29.761 1.00 33.26 O HETATM 2932 O HOH 246 16.511 23.883 12.910 1.00 31.57 O HETATM 2933 O HOH 247 27.475 20.028 5.565 1.00 35.05 O HETATM 2934 O HOH 248 12.228 22.153 17.637 1.00 41.09 O HETATM 2935 O HOH 249 -3.548 -1.432 24.607 1.00 39.94 O HETATM 2936 O HOH 250 11.527 -7.355 26.298 1.00 35.95 O HETATM 2937 O HOH 251 26.870 -12.602 25.852 1.00 34.69 O HETATM 2938 O HOH 252 27.014 11.574 2.935 1.00 35.53 O HETATM 2939 O HOH 253 9.995 -10.227 25.379 1.00 38.29 O HETATM 2940 O HOH 254 18.079 -12.557 14.101 1.00 37.11 O HETATM 2941 O HOH 255 2.542 18.153 16.971 1.00 37.36 O HETATM 2942 O HOH 256 22.787 -11.312 27.438 1.00 30.28 O HETATM 2943 O HOH 257 11.241 14.967 23.993 1.00 33.40 O HETATM 2944 O HOH 258 27.239 -3.619 37.379 1.00 31.26 O HETATM 2945 O HOH 259 -2.047 -7.866 11.795 1.00 31.11 O HETATM 2946 O HOH 260 24.594 9.835 30.307 1.00 41.72 O HETATM 2947 O HOH 261 15.676 -9.438 10.159 1.00 33.92 O HETATM 2948 O HOH 262 11.327 -12.924 20.497 1.00 33.67 O HETATM 2949 O HOH 263 9.904 17.906 20.514 1.00 25.04 O HETATM 2950 O HOH 264 17.184 11.565 32.104 1.00 28.77 O HETATM 2951 O HOH 265 0.922 -1.155 28.572 1.00 37.98 O HETATM 2952 O HOH 266 21.472 1.033 8.009 1.00 30.78 O HETATM 2953 O HOH 267 20.192 23.783 14.695 1.00 36.98 O HETATM 2954 O HOH 268 0.140 -13.102 26.909 1.00 33.14 O HETATM 2955 O HOH 269 1.272 11.744 15.939 1.00 33.60 O HETATM 2956 O HOH 270 34.235 -1.983 27.897 1.00 30.49 O HETATM 2957 O HOH 271 15.661 -4.861 29.469 1.00 32.70 O HETATM 2958 O HOH 272 -0.102 -9.164 15.062 1.00 30.71 O HETATM 2959 O HOH 273 28.491 0.220 32.504 1.00 38.33 O HETATM 2960 O HOH 274 15.074 -13.853 25.258 1.00 36.04 O HETATM 2961 O HOH 275 13.722 3.794 21.528 1.00 34.99 O HETATM 2962 O HOH 276 6.431 17.990 18.404 1.00 34.48 O HETATM 2963 O HOH 277 9.401 -4.606 29.275 1.00 35.99 O HETATM 2964 O HOH 278 16.257 -13.377 16.258 1.00 33.31 O HETATM 2965 O HOH 279 -3.740 1.823 16.174 1.00 40.40 O HETATM 2966 O HOH 280 3.080 -5.126 28.633 1.00 37.67 O HETATM 2967 O HOH 281 17.634 -0.648 31.172 1.00 35.08 O HETATM 2968 O5' A A 3 25.960 6.575 -3.468 1.00 -0.39 O HETATM 2969 C5' A A 3 25.373 7.804 -3.906 1.00 0.07 C HETATM 2970 C4' A A 3 24.252 7.517 -4.909 1.00 0.11 C HETATM 2971 O4' A A 3 24.768 6.755 -6.015 1.00 -0.34 O HETATM 2972 C1' A A 3 23.944 5.594 -6.219 1.00 0.20 C HETATM 2973 N9 A A 3 24.730 4.405 -5.814 1.00 -0.19 N HETATM 2974 C4 A A 3 24.276 3.242 -5.352 1.00 0.16 C HETATM 2975 N3 A A 3 23.057 2.790 -5.019 1.00 -0.27 N HETATM 2976 C2 A A 3 22.888 1.555 -4.576 1.00 0.05 C HETATM 2977 N1 A A 3 23.912 0.726 -4.451 1.00 -0.27 N HETATM 2978 C6 A A 3 25.159 1.107 -4.764 1.00 0.13 C HETATM 2979 N6 A A 3 26.177 0.256 -4.657 1.00 -0.32 N HETATM 2980 H7 A A 3 27.130 0.560 -4.900 1.00 0.18 H HETATM 2981 H8 A A 3 26.011 -0.707 -4.331 1.00 0.18 H HETATM 2982 C5 A A 3 25.372 2.400 -5.228 1.00 0.10 C HETATM 2983 N7 A A 3 26.449 3.079 -5.609 1.00 -0.30 N HETATM 2984 C8 A A 3 26.050 4.298 -5.960 1.00 0.11 C HETATM 2985 H9 A A 3 26.706 5.092 -6.315 1.00 0.13 H HETATM 2986 H6 A A 3 21.893 1.216 -4.311 1.00 0.10 H HETATM 2987 C2' A A 3 22.654 5.845 -5.435 1.00 0.14 C HETATM 2988 O2' A A 3 21.775 6.662 -6.213 1.00 -0.38 O HETATM 2989 H11 A A 3 20.974 6.817 -5.726 1.00 0.21 H HETATM 2990 C3' A A 3 23.195 6.635 -4.246 1.00 0.10 C HETATM 2991 N8 A A 3 22.169 7.480 -3.616 1.00 -0.27 N HETATM 2992 C A A 3 21.454 7.107 -2.559 1.00 0.23 C HETATM 2993 CA A A 3 20.426 8.099 -2.009 1.00 0.09 C HETATM 2994 N A A 3 19.428 7.389 -1.196 1.00 0.24 N HETATM 2995 H14 A A 3 18.755 8.049 -0.838 1.00 0.20 H HETATM 2996 H15 A A 3 19.888 6.927 -0.427 1.00 0.20 H HETATM 2997 H16 A A 3 18.956 6.704 -1.766 1.00 0.20 H HETATM 2998 CB A A 3 21.134 9.148 -1.148 1.00 0.10 C HETATM 2999 OG A A 3 20.181 10.108 -0.683 1.00 -0.39 O HETATM 3000 H20 A A 3 20.623 10.758 -0.149 1.00 0.21 H HETATM 3001 H18 A A 3 21.903 9.656 -1.748 1.00 0.06 H HETATM 3002 H19 A A 3 21.608 8.655 -0.286 1.00 0.06 H HETATM 3003 H17 A A 3 19.920 8.599 -2.848 1.00 0.11 H HETATM 3004 O A A 3 21.573 5.898 -1.949 1.00 -0.39 O HETATM 3005 H13 A A 3 22.000 8.386 -4.005 1.00 0.19 H HETATM 3006 H12 A A 3 23.636 5.966 -3.493 1.00 0.06 H HETATM 3007 H10 A A 3 22.154 4.914 -5.130 1.00 0.07 H HETATM 3008 H5 A A 3 23.690 5.491 -7.284 1.00 0.10 H HETATM 3009 H4 A A 3 23.809 8.461 -5.260 1.00 0.06 H HETATM 3010 H2 A A 3 26.143 8.425 -4.387 1.00 0.06 H HETATM 3011 H3 A A 3 24.959 8.340 -3.039 1.00 0.06 H HETATM 3012 H1 A A 3 26.654 6.761 -2.846 1.00 0.21 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1323 1324 1331 1332 1333 CONECT 1331 1323 CONECT 1332 1323 CONECT 1333 1323 CONECT 2968 2969 3012 CONECT 2969 2968 2970 3010 3011 CONECT 2970 2969 2971 2990 3009 CONECT 2971 2970 2972 CONECT 2972 2971 2973 2987 3008 CONECT 2973 2972 2974 2984 CONECT 2974 2973 2975 2982 CONECT 2975 2974 2976 CONECT 2976 2975 2977 2986 CONECT 2977 2976 2978 CONECT 2978 2977 2979 2982 CONECT 2979 2978 2980 2981 CONECT 2980 2979 CONECT 2981 2979 CONECT 2982 2974 2978 2983 CONECT 2983 2982 2984 CONECT 2984 2973 2983 2985 CONECT 2985 2984 CONECT 2986 2976 CONECT 2987 2972 2988 2990 3007 CONECT 2988 2987 2989 CONECT 2989 2988 CONECT 2990 2970 2987 2991 3006 CONECT 2991 2990 2992 3005 CONECT 2992 2991 2993 3004 CONECT 2993 2992 2994 2998 3003 CONECT 2994 2993 2995 2996 2997 CONECT 2995 2994 CONECT 2996 2994 CONECT 2997 2994 CONECT 2998 2993 2999 3001 3002 CONECT 2999 2998 3000 CONECT 3000 2999 CONECT 3001 2998 CONECT 3002 2998 CONECT 3003 2993 CONECT 3004 2992 CONECT 3005 2991 CONECT 3006 2990 CONECT 3007 2987 CONECT 3008 2972 CONECT 3009 2970 CONECT 3010 2969 CONECT 3011 2969 CONECT 3012 2968 MASTER 0 0 0 0 0 0 0 0 3010 2 53 23 END
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Related entries of code: 4rrq
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3pd2
RCSB PDB
PDBbind
147aa, >3PD2_1|Chains... *
3pd3
RCSB PDB
PDBbind
147aa, >3PD3_1|Chains... at 100%
3pd4
RCSB PDB
PDBbind
147aa, >3PD4_1|Chains... at 100%
4rrr
RCSB PDB
PDBbind
147aa, >4RRR_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3pd2
RCSB PDB
PDBbind
A3S
4rr6
RCSB PDB
PDBbind
A3S
4rrf
RCSB PDB
PDBbind
A3S
Entry Information
PDB ID
4rrq
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
K121M mutant of N-terminal editing domain of threonyl-tRNA synthetase from Pyrococcus abyssi
Ligand Name
A3S
EC.Number
E.C.6.1.1.3
Resolution
1.79(Å)
Affinity (Kd/Ki/IC50)
Kd=3.4uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Nat Commun Vol. 6: pp. 7552-7552
Ligand Properties
Formula
C
1
3
H
2
0
N
7
O
5
Molecular Weight
354.342
Exact Mass
354.153
No. of atoms
45
No. of bonds
47
Polar Surface Area
196.28
LOGP Value
-3.47 (
Computed with XLOGP3
)
-3.28 (
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](C(=O)N[C@@H]1[C@@H](CO)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N)[NH3+]
InChI String
InChI=1S/C13H19N7O5/c14-5(1-21)12(24)19-7-6(2-22)25-13(9(7)23)20-4-18-8-10(15)16-3-17-11(8)20/h3-7,9,13,21-23H,1-2,14H2,(H,19,24)(H2,15,16,17)/p+1/t5-,6+,7+,9+,13+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9UZ14
Entrez Gene ID
NCBI Entrez Gene ID:
1496731
ASD
Information of known allosteric effects of PDB entries
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