Browse entries in the PDBbind-CN Database
HEADER 1EX8_COMPLEX COMPND 1EX8_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 158 THR VAL ALA TYR ILE ALA ILE GLY SER ASN LEU ALA SER SEQRES 2 A 158 PRO LEU GLU GLN VAL ASN ALA ALA LEU LYS ALA LEU GLY SEQRES 3 A 158 ASP ILE PRO GLU SER HIS ILE LEU THR VAL SER SER PHE SEQRES 4 A 158 TYR ARG THR PRO PRO LEU GLY PRO GLN ASP GLN PRO ASP SEQRES 5 A 158 TYR LEU ASN ALA ALA VAL ALA LEU GLU THR SER LEU ALA SEQRES 6 A 158 PRO GLU GLU LEU LEU ASN HIS THR GLN ARG ILE GLU LEU SEQRES 7 A 158 GLN GLN GLY ARG VAL ARG LYS ALA GLU ARG TRP GLY PRO SEQRES 8 A 158 ARG THR LEU ASP LEU ASP ILE MET LEU PHE GLY ASN GLU SEQRES 9 A 158 VAL ILE ASN THR GLU ARG LEU THR VAL PRO HIS TYR ASP SEQRES 10 A 158 MET LYS ASN ARG GLY PHE MET LEU TRP PRO LEU PHE GLU SEQRES 11 A 158 ILE ALA PRO GLU LEU VAL PHE PRO ASP GLY GLU MET LEU SEQRES 12 A 158 ARG GLN ILE LEU HIS THR ARG ALA PHE ASP LYS LEU ASN SEQRES 13 A 158 LYS TRP HET MG A 1 1 HET A A 4P 66 ATOM 1 N THR A 1 -7.650 6.687 5.840 1.00 10.05 N ATOM 2 CA THR A 1 -7.945 8.089 6.111 1.00 17.34 C ATOM 3 C THR A 1 -6.688 8.941 5.958 1.00 15.20 C ATOM 4 O THR A 1 -5.621 8.579 6.456 1.00 9.72 O ATOM 5 CB THR A 1 -8.517 8.297 7.525 1.00 19.12 C ATOM 6 OG1 THR A 1 -9.498 7.287 7.800 1.00 16.57 O ATOM 7 CG2 THR A 1 -9.245 9.629 7.658 1.00 14.48 C ATOM 8 HA THR A 1 -8.697 8.397 5.384 1.00 0.00 H ATOM 9 HB THR A 1 -7.670 8.259 8.210 1.00 0.00 H ATOM 10 HG1 THR A 1 -9.075 6.394 7.744 1.00 0.00 H ATOM 11 HG23 THR A 1 -8.549 10.444 7.459 1.00 0.00 H ATOM 12 HG21 THR A 1 -10.065 9.667 6.940 1.00 0.00 H ATOM 13 HG22 THR A 1 -9.641 9.726 8.669 1.00 0.00 H ATOM 14 HN3 THR A 1 -6.930 6.350 6.510 1.00 0.00 H ATOM 15 HN2 THR A 1 -7.293 6.591 4.868 1.00 0.00 H ATOM 16 HN1 THR A 1 -8.518 6.124 5.949 1.00 0.00 H ATOM 17 N VAL A 2 -6.831 10.076 5.282 1.00 9.41 N ATOM 18 CA VAL A 2 -5.716 10.995 5.109 1.00 3.75 C ATOM 19 C VAL A 2 -5.427 11.761 6.396 1.00 4.79 C ATOM 20 O VAL A 2 -6.200 12.631 6.796 1.00 23.20 O ATOM 21 CB VAL A 2 -5.945 12.039 4.000 1.00 14.07 C ATOM 22 CG1 VAL A 2 -4.904 13.137 4.162 1.00 21.58 C ATOM 23 CG2 VAL A 2 -5.880 11.428 2.610 1.00 25.52 C ATOM 24 HA VAL A 2 -4.876 10.360 4.828 1.00 0.00 H ATOM 25 HB VAL A 2 -6.949 12.450 4.101 1.00 0.00 H ATOM 26 HG11 VAL A 2 -5.015 13.600 5.143 1.00 0.00 H ATOM 27 HG12 VAL A 2 -3.907 12.706 4.073 1.00 0.00 H ATOM 28 HG13 VAL A 2 -5.047 13.889 3.386 1.00 0.00 H ATOM 29 HG21 VAL A 2 -4.898 10.981 2.456 1.00 0.00 H ATOM 30 HG22 VAL A 2 -6.648 10.660 2.516 1.00 0.00 H ATOM 31 HG23 VAL A 2 -6.048 12.205 1.865 1.00 0.00 H ATOM 32 H VAL A 2 -7.756 10.312 4.869 1.00 0.00 H ATOM 33 N ALA A 3 -4.301 11.429 7.007 1.00 9.81 N ATOM 34 CA ALA A 3 -3.800 12.124 8.185 1.00 11.89 C ATOM 35 C ALA A 3 -2.717 13.115 7.776 1.00 15.22 C ATOM 36 O ALA A 3 -1.684 12.765 7.203 1.00 6.71 O ATOM 37 CB ALA A 3 -3.306 11.115 9.202 1.00 7.00 C ATOM 38 HA ALA A 3 -4.602 12.694 8.655 1.00 0.00 H ATOM 39 HB1 ALA A 3 -4.128 10.460 9.491 1.00 0.00 H ATOM 40 HB2 ALA A 3 -2.504 10.522 8.763 1.00 0.00 H ATOM 41 HB3 ALA A 3 -2.932 11.640 10.081 1.00 0.00 H ATOM 42 H ALA A 3 -3.748 10.634 6.628 1.00 0.00 H ATOM 43 N TYR A 4 -2.959 14.397 8.065 1.00 11.25 N ATOM 44 CA TYR A 4 -1.951 15.404 7.732 1.00 5.66 C ATOM 45 C TYR A 4 -1.032 15.618 8.922 1.00 11.68 C ATOM 46 O TYR A 4 -1.486 16.084 9.970 1.00 11.75 O ATOM 47 CB TYR A 4 -2.601 16.725 7.326 1.00 5.21 C ATOM 48 CG TYR A 4 -3.229 16.661 5.954 1.00 6.55 C ATOM 49 CD1 TYR A 4 -2.440 16.795 4.822 1.00 8.53 C ATOM 50 CD2 TYR A 4 -4.596 16.458 5.804 1.00 6.63 C ATOM 51 CE1 TYR A 4 -2.993 16.738 3.561 1.00 14.63 C ATOM 52 CE2 TYR A 4 -5.147 16.401 4.537 1.00 12.23 C ATOM 53 CZ TYR A 4 -4.352 16.538 3.420 1.00 5.55 C ATOM 54 OH TYR A 4 -4.884 16.483 2.150 1.00 13.17 O ATOM 55 HA TYR A 4 -1.371 15.042 6.883 1.00 0.00 H ATOM 56 HB3 TYR A 4 -1.839 17.505 7.326 1.00 0.00 H ATOM 57 HB2 TYR A 4 -3.374 16.973 8.054 1.00 0.00 H ATOM 58 HD2 TYR A 4 -5.231 16.344 6.682 1.00 0.00 H ATOM 59 HE2 TYR A 4 -6.220 16.246 4.421 1.00 0.00 H ATOM 60 HE1 TYR A 4 -2.361 16.850 2.680 1.00 0.00 H ATOM 61 HD1 TYR A 4 -1.366 16.948 4.931 1.00 0.00 H ATOM 62 HH TYR A 4 -4.160 16.601 1.485 1.00 0.00 H ATOM 63 H TYR A 4 -3.852 14.675 8.520 1.00 0.00 H ATOM 64 N ILE A 5 0.245 15.258 8.743 1.00 8.19 N ATOM 65 CA ILE A 5 1.131 15.374 9.901 1.00 4.47 C ATOM 66 C ILE A 5 2.156 16.489 9.696 1.00 7.02 C ATOM 67 O ILE A 5 2.717 16.680 8.623 1.00 10.45 O ATOM 68 CB ILE A 5 1.857 14.061 10.222 1.00 6.56 C ATOM 69 CG1 ILE A 5 0.899 12.933 10.628 1.00 15.37 C ATOM 70 CG2 ILE A 5 2.910 14.255 11.304 1.00 9.51 C ATOM 71 CD1 ILE A 5 1.326 11.569 10.128 1.00 21.31 C ATOM 72 HA ILE A 5 0.493 15.618 10.751 1.00 0.00 H ATOM 73 HB ILE A 5 2.347 13.761 9.296 1.00 0.00 H ATOM 74 HG12 ILE A 5 0.845 12.901 11.716 1.00 0.00 H ATOM 75 HG13 ILE A 5 -0.088 13.156 10.223 1.00 0.00 H ATOM 76 HD11 ILE A 5 1.374 11.581 9.039 1.00 0.00 H ATOM 77 HD12 ILE A 5 2.308 11.326 10.534 1.00 0.00 H ATOM 78 HD13 ILE A 5 0.602 10.821 10.453 1.00 0.00 H ATOM 79 HG21 ILE A 5 3.647 14.983 10.966 1.00 0.00 H ATOM 80 HG22 ILE A 5 2.432 14.616 12.214 1.00 0.00 H ATOM 81 HG23 ILE A 5 3.403 13.304 11.504 1.00 0.00 H ATOM 82 H ILE A 5 0.590 14.913 7.825 1.00 0.00 H ATOM 83 N ALA A 6 2.346 17.202 10.802 1.00 7.55 N ATOM 84 CA ALA A 6 3.312 18.289 10.822 1.00 13.74 C ATOM 85 C ALA A 6 4.614 17.781 11.435 1.00 12.76 C ATOM 86 O ALA A 6 4.576 17.252 12.549 1.00 15.02 O ATOM 87 CB ALA A 6 2.754 19.479 11.583 1.00 11.37 C ATOM 88 HA ALA A 6 3.516 18.628 9.806 1.00 0.00 H ATOM 89 HB1 ALA A 6 1.841 19.823 11.097 1.00 0.00 H ATOM 90 HB2 ALA A 6 2.532 19.182 12.608 1.00 0.00 H ATOM 91 HB3 ALA A 6 3.490 20.283 11.588 1.00 0.00 H ATOM 92 H ALA A 6 1.800 16.981 11.659 1.00 0.00 H ATOM 93 N ILE A 7 5.714 17.939 10.706 1.00 14.89 N ATOM 94 CA ILE A 7 7.023 17.562 11.207 1.00 17.39 C ATOM 95 C ILE A 7 7.857 18.809 11.535 1.00 14.29 C ATOM 96 O ILE A 7 7.946 19.712 10.711 1.00 21.03 O ATOM 97 CB ILE A 7 7.859 16.722 10.233 1.00 20.20 C ATOM 98 CG1 ILE A 7 7.111 15.586 9.535 1.00 18.51 C ATOM 99 CG2 ILE A 7 9.087 16.173 10.956 1.00 27.12 C ATOM 100 CD1 ILE A 7 8.063 14.546 8.967 1.00 24.57 C ATOM 101 HA ILE A 7 6.809 16.959 12.089 1.00 0.00 H ATOM 102 HB ILE A 7 8.142 17.404 9.432 1.00 0.00 H ATOM 103 HG12 ILE A 7 6.450 15.104 10.255 1.00 0.00 H ATOM 104 HG13 ILE A 7 6.517 16.002 8.721 1.00 0.00 H ATOM 105 HD11 ILE A 7 8.723 15.018 8.240 1.00 0.00 H ATOM 106 HD12 ILE A 7 8.657 14.119 9.775 1.00 0.00 H ATOM 107 HD13 ILE A 7 7.489 13.757 8.480 1.00 0.00 H ATOM 108 HG21 ILE A 7 9.688 17.002 11.329 1.00 0.00 H ATOM 109 HG22 ILE A 7 8.767 15.550 11.791 1.00 0.00 H ATOM 110 HG23 ILE A 7 9.679 15.577 10.262 1.00 0.00 H ATOM 111 H ILE A 7 5.635 18.344 9.751 1.00 0.00 H ATOM 112 N GLY A 8 8.436 18.788 12.724 1.00 17.29 N ATOM 113 CA GLY A 8 9.315 19.831 13.220 1.00 13.79 C ATOM 114 C GLY A 8 10.529 19.267 13.933 1.00 14.09 C ATOM 115 O GLY A 8 10.466 18.194 14.536 1.00 14.50 O ATOM 116 HA3 GLY A 8 8.758 20.458 13.917 1.00 0.00 H ATOM 117 HA2 GLY A 8 9.652 20.436 12.378 1.00 0.00 H ATOM 118 H GLY A 8 8.250 17.973 13.342 1.00 0.00 H ATOM 119 N SER A 9 11.633 20.001 13.869 1.00 9.66 N ATOM 120 CA SER A 9 12.877 19.630 14.524 1.00 8.47 C ATOM 121 C SER A 9 13.836 20.809 14.588 1.00 6.08 C ATOM 122 O SER A 9 14.033 21.478 13.564 1.00 7.29 O ATOM 123 CB SER A 9 13.564 18.487 13.764 1.00 10.51 C ATOM 124 OG SER A 9 14.894 18.323 14.226 1.00 7.81 O ATOM 125 HA SER A 9 12.628 19.310 15.536 1.00 0.00 H ATOM 126 HB2 SER A 9 13.578 18.719 12.699 1.00 0.00 H ATOM 127 HB3 SER A 9 13.010 17.562 13.925 1.00 0.00 H ATOM 128 HG SER A 9 14.882 18.110 15.193 1.00 0.00 H ATOM 129 H SER A 9 11.607 20.886 13.323 1.00 0.00 H ATOM 130 N ASN A 10 14.449 21.081 15.736 1.00 5.04 N ATOM 131 CA ASN A 10 15.518 22.097 15.642 1.00 13.99 C ATOM 132 C ASN A 10 16.735 21.700 16.465 1.00 15.26 C ATOM 133 O ASN A 10 17.511 22.553 16.904 1.00 9.60 O ATOM 134 CB ASN A 10 14.978 23.473 16.033 1.00 6.03 C ATOM 135 CG ASN A 10 14.681 23.627 17.501 1.00 3.91 C ATOM 136 OD1 ASN A 10 14.343 22.675 18.210 1.00 14.26 O ATOM 137 ND2 ASN A 10 14.810 24.858 17.999 1.00 16.13 N ATOM 138 HA ASN A 10 15.852 22.155 14.606 1.00 0.00 H ATOM 139 HB2 ASN A 10 15.718 24.223 15.754 1.00 0.00 H ATOM 140 HB3 ASN A 10 14.057 23.649 15.478 1.00 0.00 H ATOM 141 HD22 ASN A 10 15.096 25.642 17.379 1.00 0.00 H ATOM 142 HD21 ASN A 10 14.624 25.033 19.007 1.00 0.00 H ATOM 143 H ASN A 10 14.196 20.615 16.631 1.00 0.00 H ATOM 144 N LEU A 11 16.907 20.399 16.682 1.00 12.99 N ATOM 145 CA LEU A 11 18.071 19.862 17.377 1.00 10.88 C ATOM 146 C LEU A 11 18.621 18.618 16.680 1.00 15.18 C ATOM 147 O LEU A 11 17.902 17.928 15.952 1.00 21.29 O ATOM 148 CB LEU A 11 17.719 19.515 18.821 1.00 5.80 C ATOM 149 CG LEU A 11 17.326 20.689 19.711 1.00 14.72 C ATOM 150 CD1 LEU A 11 16.777 20.193 21.038 1.00 24.53 C ATOM 151 CD2 LEU A 11 18.523 21.606 19.915 1.00 19.34 C ATOM 152 HA LEU A 11 18.839 20.635 17.362 1.00 0.00 H ATOM 153 HB2 LEU A 11 16.884 18.815 18.802 1.00 0.00 H ATOM 154 HB3 LEU A 11 18.587 19.031 19.270 1.00 0.00 H ATOM 155 HG LEU A 11 16.537 21.260 19.221 1.00 0.00 H ATOM 156 HD21 LEU A 11 19.330 21.048 20.390 1.00 0.00 H ATOM 157 HD22 LEU A 11 18.859 21.983 18.949 1.00 0.00 H ATOM 158 HD23 LEU A 11 18.234 22.442 20.552 1.00 0.00 H ATOM 159 HD11 LEU A 11 15.897 19.575 20.858 1.00 0.00 H ATOM 160 HD12 LEU A 11 17.539 19.602 21.547 1.00 0.00 H ATOM 161 HD13 LEU A 11 16.503 21.046 21.658 1.00 0.00 H ATOM 162 H LEU A 11 16.181 19.737 16.342 1.00 0.00 H ATOM 163 N ALA A 12 19.896 18.324 16.897 1.00 16.45 N ATOM 164 CA ALA A 12 20.539 17.113 16.414 1.00 13.23 C ATOM 165 C ALA A 12 20.444 16.935 14.905 1.00 13.11 C ATOM 166 O ALA A 12 20.124 15.839 14.444 1.00 16.09 O ATOM 167 CB ALA A 12 19.921 15.904 17.115 1.00 8.95 C ATOM 168 HA ALA A 12 21.600 17.201 16.648 1.00 0.00 H ATOM 169 HB1 ALA A 12 20.070 15.994 18.191 1.00 0.00 H ATOM 170 HB2 ALA A 12 18.854 15.865 16.896 1.00 0.00 H ATOM 171 HB3 ALA A 12 20.400 14.993 16.756 1.00 0.00 H ATOM 172 H ALA A 12 20.468 18.998 17.444 1.00 0.00 H ATOM 173 N SER A 13 20.723 17.989 14.162 1.00 6.18 N ATOM 174 CA SER A 13 20.685 18.047 12.712 1.00 4.45 C ATOM 175 C SER A 13 19.280 17.798 12.166 1.00 17.21 C ATOM 176 O SER A 13 18.952 16.687 11.739 1.00 19.91 O ATOM 177 CB SER A 13 21.690 17.051 12.128 1.00 4.66 C ATOM 178 OG SER A 13 21.715 17.161 10.703 1.00 8.19 O ATOM 179 HA SER A 13 20.965 19.055 12.405 1.00 0.00 H ATOM 180 HB2 SER A 13 21.399 16.038 12.407 1.00 0.00 H ATOM 181 HB3 SER A 13 22.683 17.265 12.524 1.00 0.00 H ATOM 182 HG SER A 13 20.814 16.965 10.342 1.00 0.00 H ATOM 183 H SER A 13 20.996 18.859 14.662 1.00 0.00 H ATOM 184 N PRO A 14 18.457 18.844 12.201 1.00 19.54 N ATOM 185 CA PRO A 14 17.065 18.786 11.753 1.00 4.16 C ATOM 186 C PRO A 14 16.848 18.021 10.465 1.00 10.49 C ATOM 187 O PRO A 14 15.954 17.168 10.404 1.00 8.87 O ATOM 188 CB PRO A 14 16.733 20.280 11.550 1.00 4.16 C ATOM 189 CG PRO A 14 17.456 20.914 12.697 1.00 3.94 C ATOM 190 CD PRO A 14 18.786 20.192 12.711 1.00 19.22 C ATOM 191 HA PRO A 14 16.438 18.255 12.469 1.00 0.00 H ATOM 192 HD3 PRO A 14 19.506 20.689 12.061 1.00 0.00 H ATOM 193 HD2 PRO A 14 19.189 20.138 13.722 1.00 0.00 H ATOM 194 HG3 PRO A 14 16.917 20.760 13.632 1.00 0.00 H ATOM 195 HG2 PRO A 14 17.593 21.982 12.530 1.00 0.00 H ATOM 196 HB2 PRO A 14 17.109 20.644 10.594 1.00 0.00 H ATOM 197 HB3 PRO A 14 15.660 20.460 11.609 1.00 0.00 H ATOM 198 N LEU A 15 17.623 18.266 9.417 1.00 10.44 N ATOM 199 CA LEU A 15 17.403 17.521 8.179 1.00 7.38 C ATOM 200 C LEU A 15 17.520 16.019 8.390 1.00 15.54 C ATOM 201 O LEU A 15 16.788 15.197 7.828 1.00 6.68 O ATOM 202 CB LEU A 15 18.400 17.982 7.112 1.00 6.08 C ATOM 203 CG LEU A 15 18.115 17.474 5.696 1.00 21.31 C ATOM 204 CD1 LEU A 15 16.904 18.183 5.111 1.00 10.61 C ATOM 205 CD2 LEU A 15 19.336 17.649 4.809 1.00 8.00 C ATOM 206 HA LEU A 15 16.386 17.725 7.844 1.00 0.00 H ATOM 207 HB2 LEU A 15 18.391 19.072 7.089 1.00 0.00 H ATOM 208 HB3 LEU A 15 19.391 17.635 7.403 1.00 0.00 H ATOM 209 HG LEU A 15 17.890 16.409 5.747 1.00 0.00 H ATOM 210 HD21 LEU A 15 19.599 18.706 4.759 1.00 0.00 H ATOM 211 HD22 LEU A 15 20.170 17.085 5.226 1.00 0.00 H ATOM 212 HD23 LEU A 15 19.112 17.282 3.808 1.00 0.00 H ATOM 213 HD11 LEU A 15 16.034 17.991 5.739 1.00 0.00 H ATOM 214 HD12 LEU A 15 17.096 19.255 5.072 1.00 0.00 H ATOM 215 HD13 LEU A 15 16.717 17.809 4.104 1.00 0.00 H ATOM 216 H LEU A 15 18.378 18.979 9.475 1.00 0.00 H ATOM 217 N GLU A 16 18.459 15.567 9.221 1.00 18.22 N ATOM 218 CA GLU A 16 18.514 14.107 9.389 1.00 20.45 C ATOM 219 C GLU A 16 17.348 13.595 10.219 1.00 11.68 C ATOM 220 O GLU A 16 16.760 12.542 9.958 1.00 16.66 O ATOM 221 CB GLU A 16 19.861 13.743 10.012 1.00 24.04 C ATOM 222 CG GLU A 16 21.028 14.095 9.091 1.00 23.34 C ATOM 223 CD GLU A 16 21.668 12.834 8.534 1.00 34.04 C ATOM 224 OE1 GLU A 16 21.978 11.946 9.358 1.00 40.89 O ATOM 225 OE2 GLU A 16 21.842 12.760 7.300 1.00 35.05 O ATOM 226 HA GLU A 16 18.425 13.623 8.416 1.00 0.00 H ATOM 227 HB2 GLU A 16 19.975 14.287 10.949 1.00 0.00 H ATOM 228 HB3 GLU A 16 19.880 12.672 10.211 1.00 0.00 H ATOM 229 HG2 GLU A 16 20.662 14.706 8.266 1.00 0.00 H ATOM 230 HG3 GLU A 16 21.773 14.656 9.655 1.00 0.00 H ATOM 231 H GLU A 16 19.111 16.206 9.719 1.00 0.00 H ATOM 232 N GLN A 17 17.006 14.340 11.265 1.00 7.20 N ATOM 233 CA GLN A 17 15.863 13.972 12.090 1.00 11.57 C ATOM 234 C GLN A 17 14.628 13.866 11.210 1.00 4.56 C ATOM 235 O GLN A 17 13.812 12.951 11.313 1.00 18.50 O ATOM 236 CB GLN A 17 15.650 15.002 13.193 1.00 14.24 C ATOM 237 CG GLN A 17 16.853 15.190 14.106 1.00 21.83 C ATOM 238 CD GLN A 17 17.160 13.932 14.900 1.00 24.93 C ATOM 239 OE1 GLN A 17 16.292 13.073 15.062 1.00 7.61 O ATOM 240 NE2 GLN A 17 18.390 13.816 15.396 1.00 16.89 N ATOM 241 HA GLN A 17 16.051 13.008 12.563 1.00 0.00 H ATOM 242 HB2 GLN A 17 15.420 15.960 12.727 1.00 0.00 H ATOM 243 HB3 GLN A 17 14.804 14.683 13.802 1.00 0.00 H ATOM 244 HG2 GLN A 17 17.721 15.445 13.498 1.00 0.00 H ATOM 245 HG3 GLN A 17 16.646 16.004 14.800 1.00 0.00 H ATOM 246 HE22 GLN A 17 19.090 14.568 15.233 1.00 0.00 H ATOM 247 HE21 GLN A 17 18.651 12.973 15.947 1.00 0.00 H ATOM 248 H GLN A 17 17.558 15.191 11.496 1.00 0.00 H ATOM 249 N VAL A 18 14.483 14.833 10.300 1.00 10.84 N ATOM 250 CA VAL A 18 13.257 14.840 9.503 1.00 11.04 C ATOM 251 C VAL A 18 13.244 13.703 8.494 1.00 17.45 C ATOM 252 O VAL A 18 12.195 13.114 8.226 1.00 16.33 O ATOM 253 CB VAL A 18 13.037 16.179 8.772 1.00 10.54 C ATOM 254 CG1 VAL A 18 11.873 16.061 7.794 1.00 4.71 C ATOM 255 CG2 VAL A 18 12.771 17.283 9.779 1.00 11.42 C ATOM 256 HA VAL A 18 12.438 14.702 10.209 1.00 0.00 H ATOM 257 HB VAL A 18 13.938 16.427 8.210 1.00 0.00 H ATOM 258 HG11 VAL A 18 12.094 15.286 7.060 1.00 0.00 H ATOM 259 HG12 VAL A 18 10.967 15.799 8.340 1.00 0.00 H ATOM 260 HG13 VAL A 18 11.730 17.014 7.285 1.00 0.00 H ATOM 261 HG21 VAL A 18 11.880 17.039 10.357 1.00 0.00 H ATOM 262 HG22 VAL A 18 13.626 17.376 10.449 1.00 0.00 H ATOM 263 HG23 VAL A 18 12.617 18.225 9.252 1.00 0.00 H ATOM 264 H VAL A 18 15.217 15.557 10.163 1.00 0.00 H ATOM 265 N ASN A 19 14.397 13.372 7.924 1.00 12.48 N ATOM 266 CA ASN A 19 14.415 12.288 6.938 1.00 13.74 C ATOM 267 C ASN A 19 14.124 10.946 7.603 1.00 16.79 C ATOM 268 O ASN A 19 13.489 10.081 7.006 1.00 30.34 O ATOM 269 CB ASN A 19 15.759 12.247 6.210 1.00 20.36 C ATOM 270 CG ASN A 19 15.864 13.357 5.180 1.00 24.42 C ATOM 271 OD1 ASN A 19 14.845 13.958 4.836 1.00 23.91 O ATOM 272 ND2 ASN A 19 17.075 13.618 4.707 1.00 33.71 N ATOM 273 HA ASN A 19 13.632 12.481 6.205 1.00 0.00 H ATOM 274 HB2 ASN A 19 16.561 12.362 6.939 1.00 0.00 H ATOM 275 HB3 ASN A 19 15.861 11.285 5.707 1.00 0.00 H ATOM 276 HD22 ASN A 19 17.893 13.070 5.042 1.00 0.00 H ATOM 277 HD21 ASN A 19 17.207 14.370 4.001 1.00 0.00 H ATOM 278 H ASN A 19 15.273 13.874 8.173 1.00 0.00 H ATOM 279 N ALA A 20 14.607 10.825 8.832 1.00 22.24 N ATOM 280 CA ALA A 20 14.398 9.666 9.686 1.00 21.48 C ATOM 281 C ALA A 20 12.907 9.489 9.947 1.00 21.07 C ATOM 282 O ALA A 20 12.326 8.429 9.745 1.00 14.94 O ATOM 283 CB ALA A 20 15.154 9.826 10.993 1.00 20.78 C ATOM 284 HA ALA A 20 14.779 8.777 9.183 1.00 0.00 H ATOM 285 HB1 ALA A 20 16.219 9.926 10.785 1.00 0.00 H ATOM 286 HB2 ALA A 20 14.798 10.717 11.510 1.00 0.00 H ATOM 287 HB3 ALA A 20 14.985 8.949 11.618 1.00 0.00 H ATOM 288 H ALA A 20 15.173 11.611 9.211 1.00 0.00 H ATOM 289 N ALA A 21 12.296 10.588 10.394 1.00 15.15 N ATOM 290 CA ALA A 21 10.864 10.563 10.649 1.00 6.18 C ATOM 291 C ALA A 21 10.109 10.111 9.408 1.00 3.93 C ATOM 292 O ALA A 21 9.148 9.348 9.488 1.00 11.45 O ATOM 293 CB ALA A 21 10.394 11.937 11.095 1.00 12.52 C ATOM 294 HA ALA A 21 10.660 9.849 11.447 1.00 0.00 H ATOM 295 HB1 ALA A 21 10.917 12.220 12.008 1.00 0.00 H ATOM 296 HB2 ALA A 21 10.608 12.665 10.312 1.00 0.00 H ATOM 297 HB3 ALA A 21 9.321 11.909 11.284 1.00 0.00 H ATOM 298 H ALA A 21 12.841 11.458 10.559 1.00 0.00 H ATOM 299 N LEU A 22 10.552 10.600 8.254 1.00 9.64 N ATOM 300 CA LEU A 22 9.837 10.324 7.015 1.00 14.71 C ATOM 301 C LEU A 22 9.974 8.843 6.654 1.00 17.68 C ATOM 302 O LEU A 22 9.081 8.303 5.998 1.00 20.75 O ATOM 303 CB LEU A 22 10.309 11.175 5.838 1.00 10.03 C ATOM 304 CG LEU A 22 9.822 12.626 5.792 1.00 11.36 C ATOM 305 CD1 LEU A 22 10.486 13.353 4.634 1.00 17.22 C ATOM 306 CD2 LEU A 22 8.307 12.715 5.680 1.00 12.14 C ATOM 307 HA LEU A 22 8.794 10.583 7.198 1.00 0.00 H ATOM 308 HB2 LEU A 22 11.399 11.194 5.861 1.00 0.00 H ATOM 309 HB3 LEU A 22 9.975 10.686 4.923 1.00 0.00 H ATOM 310 HG LEU A 22 10.102 13.105 6.730 1.00 0.00 H ATOM 311 HD21 LEU A 22 7.982 12.217 4.767 1.00 0.00 H ATOM 312 HD22 LEU A 22 7.851 12.229 6.543 1.00 0.00 H ATOM 313 HD23 LEU A 22 8.007 13.763 5.651 1.00 0.00 H ATOM 314 HD11 LEU A 22 11.567 13.338 4.770 1.00 0.00 H ATOM 315 HD12 LEU A 22 10.229 12.855 3.699 1.00 0.00 H ATOM 316 HD13 LEU A 22 10.136 14.385 4.606 1.00 0.00 H ATOM 317 H LEU A 22 11.413 11.183 8.236 1.00 0.00 H ATOM 318 N LYS A 23 11.073 8.232 7.085 1.00 15.74 N ATOM 319 CA LYS A 23 11.232 6.803 6.782 1.00 24.67 C ATOM 320 C LYS A 23 10.379 5.972 7.728 1.00 20.23 C ATOM 321 O LYS A 23 9.722 4.988 7.402 1.00 12.55 O ATOM 322 CB LYS A 23 12.695 6.365 6.863 1.00 21.78 C ATOM 323 CG LYS A 23 12.902 4.872 6.618 1.00 24.51 C ATOM 324 CD LYS A 23 13.466 4.167 7.837 1.00 31.52 C ATOM 325 CE LYS A 23 13.924 2.749 7.548 1.00 35.49 C ATOM 326 NZ LYS A 23 12.821 1.865 7.077 1.00 29.61 N ATOM 327 HA LYS A 23 10.898 6.641 5.757 1.00 0.00 H ATOM 328 HB2 LYS A 23 13.262 6.919 6.115 1.00 0.00 H ATOM 329 HB3 LYS A 23 13.073 6.607 7.856 1.00 0.00 H ATOM 330 HG2 LYS A 23 11.943 4.421 6.363 1.00 0.00 H ATOM 331 HG3 LYS A 23 13.595 4.745 5.786 1.00 0.00 H ATOM 332 HD2 LYS A 23 14.318 4.739 8.205 1.00 0.00 H ATOM 333 HD3 LYS A 23 12.694 4.132 8.606 1.00 0.00 H ATOM 334 HE2 LYS A 23 14.342 2.326 8.461 1.00 0.00 H ATOM 335 HE3 LYS A 23 14.695 2.783 6.778 1.00 0.00 H ATOM 336 HZ1 LYS A 23 12.082 1.816 7.807 1.00 0.00 H ATOM 337 HZ2 LYS A 23 12.418 2.252 6.200 1.00 0.00 H ATOM 338 HZ3 LYS A 23 13.195 0.912 6.897 1.00 0.00 H ATOM 339 H LYS A 23 11.799 8.750 7.621 1.00 0.00 H ATOM 340 N ALA A 24 10.380 6.385 8.998 1.00 14.56 N ATOM 341 CA ALA A 24 9.573 5.617 9.945 1.00 14.46 C ATOM 342 C ALA A 24 8.091 5.778 9.646 1.00 18.18 C ATOM 343 O ALA A 24 7.300 4.838 9.762 1.00 13.42 O ATOM 344 CB ALA A 24 9.939 6.061 11.346 1.00 4.75 C ATOM 345 HA ALA A 24 9.782 4.551 9.852 1.00 0.00 H ATOM 346 HB1 ALA A 24 10.999 5.876 11.519 1.00 0.00 H ATOM 347 HB2 ALA A 24 9.733 7.126 11.454 1.00 0.00 H ATOM 348 HB3 ALA A 24 9.348 5.500 12.070 1.00 0.00 H ATOM 349 H ALA A 24 10.930 7.215 9.300 1.00 0.00 H ATOM 350 N LEU A 25 7.685 6.986 9.248 1.00 11.78 N ATOM 351 CA LEU A 25 6.257 7.205 9.029 1.00 7.45 C ATOM 352 C LEU A 25 5.699 6.271 7.969 1.00 12.87 C ATOM 353 O LEU A 25 4.585 5.766 8.125 1.00 13.55 O ATOM 354 CB LEU A 25 5.990 8.650 8.608 1.00 11.81 C ATOM 355 CG LEU A 25 5.717 9.658 9.719 1.00 18.23 C ATOM 356 CD1 LEU A 25 6.063 11.066 9.253 1.00 14.82 C ATOM 357 CD2 LEU A 25 4.269 9.579 10.174 1.00 38.36 C ATOM 358 HA LEU A 25 5.757 6.998 9.975 1.00 0.00 H ATOM 359 HB2 LEU A 25 6.863 8.998 8.056 1.00 0.00 H ATOM 360 HB3 LEU A 25 5.122 8.645 7.948 1.00 0.00 H ATOM 361 HG LEU A 25 6.351 9.413 10.571 1.00 0.00 H ATOM 362 HD21 LEU A 25 3.612 9.797 9.332 1.00 0.00 H ATOM 363 HD22 LEU A 25 4.061 8.577 10.549 1.00 0.00 H ATOM 364 HD23 LEU A 25 4.098 10.307 10.967 1.00 0.00 H ATOM 365 HD11 LEU A 25 7.118 11.109 8.984 1.00 0.00 H ATOM 366 HD12 LEU A 25 5.455 11.320 8.385 1.00 0.00 H ATOM 367 HD13 LEU A 25 5.862 11.773 10.058 1.00 0.00 H ATOM 368 H LEU A 25 8.370 7.754 9.097 1.00 0.00 H ATOM 369 N GLY A 26 6.428 6.042 6.885 1.00 12.59 N ATOM 370 CA GLY A 26 5.929 5.198 5.805 1.00 17.97 C ATOM 371 C GLY A 26 5.996 3.719 6.185 1.00 9.19 C ATOM 372 O GLY A 26 5.345 2.876 5.573 1.00 9.86 O ATOM 373 HA3 GLY A 26 6.535 5.365 4.914 1.00 0.00 H ATOM 374 HA2 GLY A 26 4.893 5.465 5.594 1.00 0.00 H ATOM 375 H GLY A 26 7.372 6.472 6.804 1.00 0.00 H ATOM 376 N ASP A 27 6.796 3.471 7.198 1.00 8.18 N ATOM 377 CA ASP A 27 6.973 2.193 7.847 1.00 21.45 C ATOM 378 C ASP A 27 5.815 1.915 8.804 1.00 20.98 C ATOM 379 O ASP A 27 5.719 0.801 9.319 1.00 16.66 O ATOM 380 CB ASP A 27 8.312 2.157 8.587 1.00 17.45 C ATOM 381 CG ASP A 27 9.504 1.907 7.690 1.00 5.84 C ATOM 382 OD1 ASP A 27 9.381 1.907 6.445 1.00 12.72 O ATOM 383 OD2 ASP A 27 10.611 1.708 8.227 1.00 18.99 O ATOM 384 HA ASP A 27 6.979 1.412 7.087 1.00 0.00 H ATOM 385 HB2 ASP A 27 8.454 3.115 9.087 1.00 0.00 H ATOM 386 HB3 ASP A 27 8.271 1.363 9.332 1.00 0.00 H ATOM 387 H ASP A 27 7.353 4.269 7.566 1.00 0.00 H ATOM 388 N ILE A 28 4.952 2.903 9.038 1.00 13.52 N ATOM 389 CA ILE A 28 3.795 2.664 9.913 1.00 12.94 C ATOM 390 C ILE A 28 2.880 1.641 9.253 1.00 5.45 C ATOM 391 O ILE A 28 2.644 1.666 8.040 1.00 9.95 O ATOM 392 CB ILE A 28 3.040 3.964 10.234 1.00 12.57 C ATOM 393 CG1 ILE A 28 3.898 4.996 10.979 1.00 20.42 C ATOM 394 CG2 ILE A 28 1.758 3.723 11.011 1.00 7.10 C ATOM 395 CD1 ILE A 28 3.178 6.293 11.297 1.00 9.87 C ATOM 396 HA ILE A 28 4.150 2.273 10.866 1.00 0.00 H ATOM 397 HB ILE A 28 2.785 4.375 9.257 1.00 0.00 H ATOM 398 HG12 ILE A 28 4.230 4.551 11.917 1.00 0.00 H ATOM 399 HG13 ILE A 28 4.765 5.229 10.361 1.00 0.00 H ATOM 400 HD11 ILE A 28 2.849 6.761 10.369 1.00 0.00 H ATOM 401 HD12 ILE A 28 2.313 6.082 11.926 1.00 0.00 H ATOM 402 HD13 ILE A 28 3.857 6.964 11.823 1.00 0.00 H ATOM 403 HG21 ILE A 28 1.094 3.087 10.425 1.00 0.00 H ATOM 404 HG22 ILE A 28 1.994 3.232 11.955 1.00 0.00 H ATOM 405 HG23 ILE A 28 1.269 4.677 11.208 1.00 0.00 H ATOM 406 H ILE A 28 5.096 3.837 8.604 1.00 0.00 H ATOM 407 N PRO A 29 2.370 0.697 10.028 1.00 7.64 N ATOM 408 CA PRO A 29 1.542 -0.370 9.443 1.00 9.41 C ATOM 409 C PRO A 29 0.280 0.159 8.767 1.00 15.83 C ATOM 410 O PRO A 29 -0.320 1.136 9.247 1.00 9.51 O ATOM 411 CB PRO A 29 1.138 -1.208 10.658 1.00 9.92 C ATOM 412 CG PRO A 29 2.065 -0.831 11.758 1.00 11.50 C ATOM 413 CD PRO A 29 2.543 0.560 11.480 1.00 11.20 C ATOM 414 HA PRO A 29 2.088 -0.911 8.670 1.00 0.00 H ATOM 415 HD3 PRO A 29 1.941 1.294 12.016 1.00 0.00 H ATOM 416 HD2 PRO A 29 3.590 0.676 11.761 1.00 0.00 H ATOM 417 HG3 PRO A 29 2.911 -1.518 11.785 1.00 0.00 H ATOM 418 HG2 PRO A 29 1.542 -0.862 12.714 1.00 0.00 H ATOM 419 HB2 PRO A 29 0.108 -0.989 10.941 1.00 0.00 H ATOM 420 HB3 PRO A 29 1.234 -2.270 10.432 1.00 0.00 H ATOM 421 N GLU A 30 -0.132 -0.492 7.677 1.00 13.08 N ATOM 422 CA GLU A 30 -1.361 -0.102 6.989 1.00 12.09 C ATOM 423 C GLU A 30 -1.370 1.393 6.664 1.00 13.38 C ATOM 424 O GLU A 30 -2.404 2.062 6.760 1.00 14.77 O ATOM 425 CB GLU A 30 -2.588 -0.404 7.841 1.00 17.77 C ATOM 426 CG GLU A 30 -3.171 -1.785 7.860 1.00 17.69 C ATOM 427 CD GLU A 30 -2.721 -2.761 6.809 1.00 16.44 C ATOM 428 OE1 GLU A 30 -3.228 -2.679 5.671 1.00 10.04 O ATOM 429 OE2 GLU A 30 -1.870 -3.634 7.095 1.00 33.34 O ATOM 430 HA GLU A 30 -1.395 -0.680 6.066 1.00 0.00 H ATOM 431 HB2 GLU A 30 -2.323 -0.161 8.870 1.00 0.00 H ATOM 432 HB3 GLU A 30 -3.378 0.266 7.502 1.00 0.00 H ATOM 433 HG2 GLU A 30 -2.935 -2.222 8.830 1.00 0.00 H ATOM 434 HG3 GLU A 30 -4.252 -1.681 7.763 1.00 0.00 H ATOM 435 H GLU A 30 0.429 -1.288 7.312 1.00 0.00 H ATOM 436 N SER A 31 -0.225 1.935 6.295 1.00 5.00 N ATOM 437 CA SER A 31 -0.109 3.357 6.023 1.00 3.63 C ATOM 438 C SER A 31 0.891 3.629 4.913 1.00 7.55 C ATOM 439 O SER A 31 1.874 2.925 4.696 1.00 7.36 O ATOM 440 CB SER A 31 0.343 4.135 7.258 1.00 5.09 C ATOM 441 OG SER A 31 -0.200 3.675 8.469 1.00 17.61 O ATOM 442 HA SER A 31 -1.103 3.688 5.722 1.00 0.00 H ATOM 443 HB2 SER A 31 0.052 5.178 7.129 1.00 0.00 H ATOM 444 HB3 SER A 31 1.429 4.067 7.324 1.00 0.00 H ATOM 445 HG SER A 31 0.064 2.731 8.610 1.00 0.00 H ATOM 446 H SER A 31 0.615 1.329 6.197 1.00 0.00 H ATOM 447 N HIS A 32 0.641 4.722 4.183 1.00 5.69 N ATOM 448 CA HIS A 32 1.691 5.114 3.246 1.00 4.19 C ATOM 449 C HIS A 32 1.649 6.623 3.016 1.00 14.36 C ATOM 450 O HIS A 32 0.617 7.270 3.216 1.00 13.83 O ATOM 451 CB HIS A 32 1.578 4.353 1.933 1.00 8.40 C ATOM 452 CG HIS A 32 0.361 4.660 1.130 1.00 11.71 C ATOM 453 ND1 HIS A 32 -0.907 4.299 1.529 1.00 11.75 N ATOM 454 CD2 HIS A 32 0.227 5.305 -0.052 1.00 3.91 C ATOM 455 CE1 HIS A 32 -1.778 4.708 0.626 1.00 10.88 C ATOM 456 NE2 HIS A 32 -1.123 5.315 -0.344 1.00 10.34 N ATOM 457 HA HIS A 32 2.655 4.856 3.683 1.00 0.00 H ATOM 458 HB2 HIS A 32 2.452 4.592 1.327 1.00 0.00 H ATOM 459 HB3 HIS A 32 1.574 3.287 2.159 1.00 0.00 H ATOM 460 HD2 HIS A 32 1.028 5.733 -0.655 1.00 0.00 H ATOM 461 HE1 HIS A 32 -2.858 4.568 0.674 1.00 0.00 H ATOM 462 H HIS A 32 -0.245 5.259 4.277 1.00 0.00 H ATOM 463 N ILE A 33 2.788 7.168 2.590 1.00 14.32 N ATOM 464 CA ILE A 33 2.848 8.619 2.401 1.00 12.66 C ATOM 465 C ILE A 33 2.373 9.013 1.011 1.00 10.39 C ATOM 466 O ILE A 33 2.960 8.664 -0.011 1.00 12.82 O ATOM 467 CB ILE A 33 4.274 9.155 2.658 1.00 12.91 C ATOM 468 CG1 ILE A 33 4.786 8.869 4.068 1.00 3.87 C ATOM 469 CG2 ILE A 33 4.331 10.634 2.307 1.00 19.90 C ATOM 470 CD1 ILE A 33 6.238 9.231 4.331 1.00 3.98 C ATOM 471 HA ILE A 33 2.177 9.073 3.130 1.00 0.00 H ATOM 472 HB ILE A 33 4.957 8.611 2.005 1.00 0.00 H ATOM 473 HG12 ILE A 33 4.169 9.431 4.769 1.00 0.00 H ATOM 474 HG13 ILE A 33 4.668 7.802 4.257 1.00 0.00 H ATOM 475 HD11 ILE A 33 6.880 8.668 3.653 1.00 0.00 H ATOM 476 HD12 ILE A 33 6.381 10.299 4.165 1.00 0.00 H ATOM 477 HD13 ILE A 33 6.491 8.985 5.362 1.00 0.00 H ATOM 478 HG21 ILE A 33 4.076 10.767 1.255 1.00 0.00 H ATOM 479 HG22 ILE A 33 3.620 11.181 2.926 1.00 0.00 H ATOM 480 HG23 ILE A 33 5.338 11.011 2.489 1.00 0.00 H ATOM 481 H ILE A 33 3.619 6.574 2.395 1.00 0.00 H ATOM 482 N LEU A 34 1.279 9.770 0.966 1.00 9.23 N ATOM 483 CA LEU A 34 0.778 10.335 -0.278 1.00 15.18 C ATOM 484 C LEU A 34 1.701 11.396 -0.865 1.00 8.50 C ATOM 485 O LEU A 34 1.980 11.434 -2.068 1.00 6.12 O ATOM 486 CB LEU A 34 -0.581 10.983 0.001 1.00 23.57 C ATOM 487 CG LEU A 34 -1.762 10.546 -0.859 1.00 27.59 C ATOM 488 CD1 LEU A 34 -3.005 11.333 -0.465 1.00 39.17 C ATOM 489 CD2 LEU A 34 -1.440 10.723 -2.335 1.00 8.81 C ATOM 490 HA LEU A 34 0.709 9.523 -1.002 1.00 0.00 H ATOM 491 HB2 LEU A 34 -0.837 10.770 1.039 1.00 0.00 H ATOM 492 HB3 LEU A 34 -0.463 12.059 -0.130 1.00 0.00 H ATOM 493 HG LEU A 34 -1.958 9.487 -0.689 1.00 0.00 H ATOM 494 HD21 LEU A 34 -1.224 11.773 -2.535 1.00 0.00 H ATOM 495 HD22 LEU A 34 -0.571 10.117 -2.591 1.00 0.00 H ATOM 496 HD23 LEU A 34 -2.295 10.406 -2.933 1.00 0.00 H ATOM 497 HD11 LEU A 34 -3.234 11.147 0.584 1.00 0.00 H ATOM 498 HD12 LEU A 34 -2.823 12.397 -0.615 1.00 0.00 H ATOM 499 HD13 LEU A 34 -3.845 11.016 -1.083 1.00 0.00 H ATOM 500 H LEU A 34 0.765 9.964 1.849 1.00 0.00 H ATOM 501 N THR A 35 2.148 12.277 0.028 1.00 14.80 N ATOM 502 CA THR A 35 2.843 13.498 -0.310 1.00 11.74 C ATOM 503 C THR A 35 3.657 14.047 0.853 1.00 3.84 C ATOM 504 O THR A 35 3.298 13.922 2.017 1.00 8.97 O ATOM 505 CB THR A 35 1.889 14.665 -0.682 1.00 19.63 C ATOM 506 OG1 THR A 35 0.635 14.169 -1.157 1.00 47.88 O ATOM 507 CG2 THR A 35 2.490 15.492 -1.802 1.00 5.49 C ATOM 508 HA THR A 35 3.466 13.201 -1.153 1.00 0.00 H ATOM 509 HB THR A 35 1.744 15.264 0.217 1.00 0.00 H ATOM 510 HG1 THR A 35 0.785 13.612 -1.961 1.00 0.00 H ATOM 511 HG23 THR A 35 3.452 15.891 -1.481 1.00 0.00 H ATOM 512 HG21 THR A 35 2.631 14.863 -2.681 1.00 0.00 H ATOM 513 HG22 THR A 35 1.817 16.314 -2.046 1.00 0.00 H ATOM 514 H THR A 35 1.986 12.073 1.035 1.00 0.00 H ATOM 515 N VAL A 36 4.769 14.708 0.517 1.00 4.81 N ATOM 516 CA VAL A 36 5.437 15.468 1.576 1.00 4.07 C ATOM 517 C VAL A 36 5.611 16.889 1.051 1.00 4.14 C ATOM 518 O VAL A 36 5.804 17.129 -0.137 1.00 7.25 O ATOM 519 CB VAL A 36 6.760 14.850 2.033 1.00 9.44 C ATOM 520 CG1 VAL A 36 7.343 15.650 3.188 1.00 4.74 C ATOM 521 CG2 VAL A 36 6.562 13.400 2.467 1.00 5.78 C ATOM 522 HA VAL A 36 4.824 15.457 2.477 1.00 0.00 H ATOM 523 HB VAL A 36 7.451 14.873 1.190 1.00 0.00 H ATOM 524 HG11 VAL A 36 7.521 16.676 2.865 1.00 0.00 H ATOM 525 HG12 VAL A 36 6.641 15.647 4.021 1.00 0.00 H ATOM 526 HG13 VAL A 36 8.284 15.199 3.503 1.00 0.00 H ATOM 527 HG21 VAL A 36 5.853 13.363 3.294 1.00 0.00 H ATOM 528 HG22 VAL A 36 6.175 12.821 1.629 1.00 0.00 H ATOM 529 HG23 VAL A 36 7.517 12.984 2.787 1.00 0.00 H ATOM 530 H VAL A 36 5.143 14.684 -0.453 1.00 0.00 H ATOM 531 N SER A 37 5.495 17.864 1.950 1.00 3.07 N ATOM 532 CA SER A 37 5.722 19.237 1.519 1.00 8.96 C ATOM 533 C SER A 37 7.208 19.481 1.281 1.00 22.19 C ATOM 534 O SER A 37 8.028 18.559 1.320 1.00 6.02 O ATOM 535 CB SER A 37 5.198 20.183 2.601 1.00 6.02 C ATOM 536 OG SER A 37 6.137 20.261 3.661 1.00 14.93 O ATOM 537 HA SER A 37 5.195 19.418 0.582 1.00 0.00 H ATOM 538 HB2 SER A 37 4.249 19.807 2.984 1.00 0.00 H ATOM 539 HB3 SER A 37 5.049 21.175 2.175 1.00 0.00 H ATOM 540 HG SER A 37 6.998 20.604 3.313 1.00 0.00 H ATOM 541 H SER A 37 5.248 17.650 2.937 1.00 0.00 H ATOM 542 N SER A 38 7.566 20.742 1.052 1.00 22.13 N ATOM 543 CA SER A 38 8.961 21.154 1.008 1.00 15.62 C ATOM 544 C SER A 38 9.501 21.295 2.429 1.00 10.74 C ATOM 545 O SER A 38 8.741 21.321 3.396 1.00 15.21 O ATOM 546 CB SER A 38 9.135 22.490 0.291 1.00 13.00 C ATOM 547 OG SER A 38 8.850 22.373 -1.089 1.00 13.88 O ATOM 548 HA SER A 38 9.510 20.389 0.459 1.00 0.00 H ATOM 549 HB2 SER A 38 10.164 22.828 0.414 1.00 0.00 H ATOM 550 HB3 SER A 38 8.458 23.221 0.733 1.00 0.00 H ATOM 551 HG SER A 38 7.915 22.071 -1.207 1.00 0.00 H ATOM 552 H SER A 38 6.825 21.456 0.900 1.00 0.00 H ATOM 553 N PHE A 39 10.820 21.398 2.524 1.00 8.31 N ATOM 554 CA PHE A 39 11.472 21.586 3.814 1.00 5.29 C ATOM 555 C PHE A 39 11.672 23.066 4.106 1.00 14.83 C ATOM 556 O PHE A 39 12.296 23.761 3.309 1.00 6.16 O ATOM 557 CB PHE A 39 12.814 20.858 3.805 1.00 11.27 C ATOM 558 CG PHE A 39 12.672 19.344 3.891 1.00 16.40 C ATOM 559 CD1 PHE A 39 11.431 18.740 3.769 1.00 14.55 C ATOM 560 CD2 PHE A 39 13.785 18.553 4.106 1.00 17.03 C ATOM 561 CE1 PHE A 39 11.318 17.364 3.859 1.00 13.31 C ATOM 562 CE2 PHE A 39 13.690 17.178 4.181 1.00 19.55 C ATOM 563 CZ PHE A 39 12.444 16.587 4.054 1.00 18.39 C ATOM 564 HA PHE A 39 10.839 21.174 4.600 1.00 0.00 H ATOM 565 HB2 PHE A 39 13.337 21.106 2.882 1.00 0.00 H ATOM 566 HB3 PHE A 39 13.401 21.201 4.657 1.00 0.00 H ATOM 567 HD2 PHE A 39 14.760 19.026 4.219 1.00 0.00 H ATOM 568 HE2 PHE A 39 14.580 16.568 4.337 1.00 0.00 H ATOM 569 HZ PHE A 39 12.351 15.502 4.108 1.00 0.00 H ATOM 570 HE1 PHE A 39 10.339 16.892 3.776 1.00 0.00 H ATOM 571 HD1 PHE A 39 10.543 19.349 3.602 1.00 0.00 H ATOM 572 H PHE A 39 11.400 21.344 1.662 1.00 0.00 H ATOM 573 N TYR A 40 11.166 23.575 5.223 1.00 11.13 N ATOM 574 CA TYR A 40 11.293 24.995 5.512 1.00 10.91 C ATOM 575 C TYR A 40 12.071 25.280 6.791 1.00 13.03 C ATOM 576 O TYR A 40 11.931 24.545 7.772 1.00 10.41 O ATOM 577 CB TYR A 40 9.898 25.634 5.632 1.00 8.51 C ATOM 578 CG TYR A 40 9.057 25.512 4.385 1.00 5.64 C ATOM 579 CD1 TYR A 40 9.240 26.355 3.300 1.00 3.80 C ATOM 580 CD2 TYR A 40 8.061 24.556 4.295 1.00 4.06 C ATOM 581 CE1 TYR A 40 8.461 26.240 2.171 1.00 7.82 C ATOM 582 CE2 TYR A 40 7.277 24.426 3.166 1.00 10.12 C ATOM 583 CZ TYR A 40 7.482 25.275 2.103 1.00 8.85 C ATOM 584 OH TYR A 40 6.706 25.143 0.973 1.00 7.24 O ATOM 585 HA TYR A 40 11.851 25.427 4.682 1.00 0.00 H ATOM 586 HB3 TYR A 40 10.024 26.693 5.858 1.00 0.00 H ATOM 587 HB2 TYR A 40 9.368 25.149 6.452 1.00 0.00 H ATOM 588 HD2 TYR A 40 7.891 23.887 5.139 1.00 0.00 H ATOM 589 HE2 TYR A 40 6.504 23.659 3.117 1.00 0.00 H ATOM 590 HE1 TYR A 40 8.620 26.914 1.329 1.00 0.00 H ATOM 591 HD1 TYR A 40 10.014 27.122 3.342 1.00 0.00 H ATOM 592 HH TYR A 40 6.831 24.238 0.592 1.00 0.00 H ATOM 593 H TYR A 40 10.675 22.953 5.897 1.00 0.00 H ATOM 594 N ARG A 41 12.854 26.362 6.758 1.00 12.59 N ATOM 595 CA ARG A 41 13.487 26.892 7.960 1.00 18.08 C ATOM 596 C ARG A 41 12.591 27.989 8.540 1.00 17.61 C ATOM 597 O ARG A 41 12.286 28.979 7.879 1.00 10.65 O ATOM 598 CB ARG A 41 14.891 27.434 7.688 1.00 12.25 C ATOM 599 CG ARG A 41 15.722 27.661 8.945 1.00 20.72 C ATOM 600 CD ARG A 41 17.094 28.246 8.634 1.00 22.00 C ATOM 601 NE ARG A 41 17.996 27.284 8.007 1.00 26.08 N ATOM 602 CZ ARG A 41 18.056 27.028 6.709 1.00 32.28 C ATOM 603 NH1 ARG A 41 17.259 27.664 5.857 1.00 51.43 N ATOM 604 NH2 ARG A 41 18.911 26.132 6.234 1.00 37.53 N ATOM 605 HA ARG A 41 13.604 26.079 8.676 1.00 0.00 H ATOM 606 HB2 ARG A 41 15.417 26.721 7.053 1.00 0.00 H ATOM 607 HB3 ARG A 41 14.796 28.385 7.163 1.00 0.00 H ATOM 608 HG2 ARG A 41 15.187 28.349 9.599 1.00 0.00 H ATOM 609 HG3 ARG A 41 15.855 26.707 9.455 1.00 0.00 H ATOM 610 HD2 ARG A 41 17.545 28.589 9.565 1.00 0.00 H ATOM 611 HD3 ARG A 41 16.966 29.093 7.960 1.00 0.00 H ATOM 612 HE ARG A 41 18.643 26.758 8.629 1.00 0.00 H ATOM 613 HH12 ARG A 41 17.314 27.456 4.839 1.00 0.00 H ATOM 614 HH11 ARG A 41 16.580 28.370 6.208 1.00 0.00 H ATOM 615 HH22 ARG A 41 18.949 25.940 5.213 1.00 0.00 H ATOM 616 HH21 ARG A 41 19.544 25.622 6.883 1.00 0.00 H ATOM 617 H ARG A 41 13.017 26.840 5.849 1.00 0.00 H ATOM 618 N THR A 42 12.143 27.819 9.777 1.00 10.41 N ATOM 619 CA THR A 42 11.175 28.768 10.338 1.00 11.92 C ATOM 620 C THR A 42 11.628 29.252 11.703 1.00 8.70 C ATOM 621 O THR A 42 12.220 28.498 12.484 1.00 15.08 O ATOM 622 CB THR A 42 9.781 28.120 10.439 1.00 3.80 C ATOM 623 OG1 THR A 42 9.867 26.983 11.316 1.00 13.80 O ATOM 624 CG2 THR A 42 9.323 27.567 9.099 1.00 5.81 C ATOM 625 HA THR A 42 11.114 29.627 9.670 1.00 0.00 H ATOM 626 HB THR A 42 9.089 28.885 10.791 1.00 0.00 H ATOM 627 HG1 THR A 42 8.977 26.557 11.390 1.00 0.00 H ATOM 628 HG23 THR A 42 9.236 28.383 8.381 1.00 0.00 H ATOM 629 HG21 THR A 42 10.052 26.841 8.739 1.00 0.00 H ATOM 630 HG22 THR A 42 8.354 27.083 9.219 1.00 0.00 H ATOM 631 H THR A 42 12.477 27.016 10.347 1.00 0.00 H ATOM 632 N PRO A 43 11.368 30.516 12.028 1.00 7.77 N ATOM 633 CA PRO A 43 11.813 31.031 13.328 1.00 6.04 C ATOM 634 C PRO A 43 11.022 30.407 14.467 1.00 6.21 C ATOM 635 O PRO A 43 9.845 30.089 14.306 1.00 19.46 O ATOM 636 CB PRO A 43 11.526 32.532 13.217 1.00 10.34 C ATOM 637 CG PRO A 43 10.420 32.621 12.225 1.00 4.18 C ATOM 638 CD PRO A 43 10.654 31.515 11.230 1.00 5.25 C ATOM 639 HA PRO A 43 12.857 30.805 13.544 1.00 0.00 H ATOM 640 HD3 PRO A 43 9.711 31.118 10.853 1.00 0.00 H ATOM 641 HD2 PRO A 43 11.262 31.859 10.394 1.00 0.00 H ATOM 642 HG3 PRO A 43 10.438 33.589 11.725 1.00 0.00 H ATOM 643 HG2 PRO A 43 9.458 32.487 12.719 1.00 0.00 H ATOM 644 HB2 PRO A 43 11.216 32.939 14.180 1.00 0.00 H ATOM 645 HB3 PRO A 43 12.406 33.069 12.864 1.00 0.00 H ATOM 646 N PRO A 44 11.676 30.235 15.609 1.00 8.71 N ATOM 647 CA PRO A 44 11.030 29.675 16.794 1.00 14.88 C ATOM 648 C PRO A 44 9.731 30.429 17.073 1.00 28.20 C ATOM 649 O PRO A 44 9.661 31.642 16.859 1.00 8.66 O ATOM 650 CB PRO A 44 12.032 29.937 17.913 1.00 16.94 C ATOM 651 CG PRO A 44 13.347 30.022 17.222 1.00 15.88 C ATOM 652 CD PRO A 44 13.082 30.595 15.858 1.00 12.94 C ATOM 653 HA PRO A 44 10.779 28.620 16.688 1.00 0.00 H ATOM 654 HD3 PRO A 44 13.215 31.677 15.856 1.00 0.00 H ATOM 655 HD2 PRO A 44 13.738 30.148 15.112 1.00 0.00 H ATOM 656 HG3 PRO A 44 13.790 29.030 17.133 1.00 0.00 H ATOM 657 HG2 PRO A 44 14.023 30.672 17.778 1.00 0.00 H ATOM 658 HB2 PRO A 44 11.804 30.872 18.424 1.00 0.00 H ATOM 659 HB3 PRO A 44 12.027 29.120 18.634 1.00 0.00 H ATOM 660 N LEU A 45 8.713 29.706 17.514 1.00 26.30 N ATOM 661 CA LEU A 45 7.400 30.326 17.705 1.00 23.48 C ATOM 662 C LEU A 45 7.363 31.107 19.014 1.00 18.94 C ATOM 663 O LEU A 45 6.702 32.144 19.105 1.00 14.10 O ATOM 664 CB LEU A 45 6.352 29.219 17.608 1.00 16.79 C ATOM 665 CG LEU A 45 5.035 29.414 18.347 1.00 13.13 C ATOM 666 CD1 LEU A 45 3.996 29.986 17.396 1.00 17.82 C ATOM 667 CD2 LEU A 45 4.571 28.103 18.969 1.00 7.47 C ATOM 668 HA LEU A 45 7.184 31.065 16.933 1.00 0.00 H ATOM 669 HB2 LEU A 45 6.115 29.088 16.552 1.00 0.00 H ATOM 670 HB3 LEU A 45 6.808 28.306 17.993 1.00 0.00 H ATOM 671 HG LEU A 45 5.178 30.124 19.162 1.00 0.00 H ATOM 672 HD21 LEU A 45 4.430 27.360 18.184 1.00 0.00 H ATOM 673 HD22 LEU A 45 5.324 27.750 19.674 1.00 0.00 H ATOM 674 HD23 LEU A 45 3.628 28.264 19.492 1.00 0.00 H ATOM 675 HD11 LEU A 45 4.344 30.946 17.015 1.00 0.00 H ATOM 676 HD12 LEU A 45 3.847 29.296 16.565 1.00 0.00 H ATOM 677 HD13 LEU A 45 3.055 30.124 17.928 1.00 0.00 H ATOM 678 H LEU A 45 8.846 28.696 17.725 1.00 0.00 H ATOM 679 N GLY A 46 8.080 30.615 20.016 1.00 6.92 N ATOM 680 CA GLY A 46 8.232 31.188 21.329 1.00 11.74 C ATOM 681 C GLY A 46 9.596 31.798 21.581 1.00 16.15 C ATOM 682 O GLY A 46 10.043 32.738 20.914 1.00 11.98 O ATOM 683 HA3 GLY A 46 8.065 30.403 22.067 1.00 0.00 H ATOM 684 HA2 GLY A 46 7.480 31.967 21.453 1.00 0.00 H ATOM 685 H GLY A 46 8.584 29.724 19.835 1.00 0.00 H ATOM 686 N PRO A 47 10.305 31.277 22.578 1.00 12.48 N ATOM 687 CA PRO A 47 11.625 31.832 22.902 1.00 13.39 C ATOM 688 C PRO A 47 12.560 31.797 21.698 1.00 13.16 C ATOM 689 O PRO A 47 12.544 30.875 20.889 1.00 18.11 O ATOM 690 CB PRO A 47 12.113 30.929 24.034 1.00 18.81 C ATOM 691 CG PRO A 47 11.210 29.746 24.077 1.00 16.26 C ATOM 692 CD PRO A 47 9.909 30.167 23.450 1.00 9.92 C ATOM 693 HA PRO A 47 11.590 32.883 23.188 1.00 0.00 H ATOM 694 HD3 PRO A 47 9.471 29.353 22.873 1.00 0.00 H ATOM 695 HD2 PRO A 47 9.198 30.498 24.207 1.00 0.00 H ATOM 696 HG3 PRO A 47 11.046 29.436 25.109 1.00 0.00 H ATOM 697 HG2 PRO A 47 11.647 28.920 23.516 1.00 0.00 H ATOM 698 HB2 PRO A 47 13.137 30.610 23.842 1.00 0.00 H ATOM 699 HB3 PRO A 47 12.072 31.464 24.983 1.00 0.00 H ATOM 700 N GLN A 48 13.412 32.806 21.527 1.00 15.57 N ATOM 701 CA GLN A 48 14.268 32.892 20.350 1.00 19.07 C ATOM 702 C GLN A 48 15.661 32.305 20.544 1.00 20.22 C ATOM 703 O GLN A 48 16.407 32.113 19.577 1.00 22.28 O ATOM 704 CB GLN A 48 14.416 34.361 19.929 1.00 16.34 C ATOM 705 CG GLN A 48 13.126 34.963 19.391 1.00 21.74 C ATOM 706 CD GLN A 48 12.599 34.199 18.191 1.00 21.97 C ATOM 707 OE1 GLN A 48 13.079 34.370 17.070 1.00 11.66 O ATOM 708 NE2 GLN A 48 11.603 33.353 18.445 1.00 10.34 N ATOM 709 HA GLN A 48 13.776 32.296 19.582 1.00 0.00 H ATOM 710 HB2 GLN A 48 14.734 34.940 20.796 1.00 0.00 H ATOM 711 HB3 GLN A 48 15.178 34.424 19.153 1.00 0.00 H ATOM 712 HG2 GLN A 48 12.373 34.944 20.179 1.00 0.00 H ATOM 713 HG3 GLN A 48 13.315 35.995 19.096 1.00 0.00 H ATOM 714 HE22 GLN A 48 11.240 33.253 19.415 1.00 0.00 H ATOM 715 HE21 GLN A 48 11.188 32.792 17.674 1.00 0.00 H ATOM 716 H GLN A 48 13.468 33.551 22.251 1.00 0.00 H ATOM 717 N ASP A 49 16.048 32.019 21.776 1.00 13.47 N ATOM 718 CA ASP A 49 17.385 31.508 22.064 1.00 16.54 C ATOM 719 C ASP A 49 17.532 30.014 21.769 1.00 17.65 C ATOM 720 O ASP A 49 17.880 29.212 22.637 1.00 10.69 O ATOM 721 CB ASP A 49 17.723 31.783 23.529 1.00 20.61 C ATOM 722 CG ASP A 49 16.638 31.299 24.471 1.00 23.86 C ATOM 723 OD1 ASP A 49 15.484 31.123 24.032 1.00 36.06 O ATOM 724 OD2 ASP A 49 16.949 31.087 25.663 1.00 27.27 O ATOM 725 HA ASP A 49 18.080 32.027 21.404 1.00 0.00 H ATOM 726 HB2 ASP A 49 18.655 31.274 23.776 1.00 0.00 H ATOM 727 HB3 ASP A 49 17.851 32.857 23.664 1.00 0.00 H ATOM 728 H ASP A 49 15.381 32.162 22.561 1.00 0.00 H ATOM 729 N GLN A 50 17.260 29.653 20.525 1.00 23.73 N ATOM 730 CA GLN A 50 17.332 28.290 20.012 1.00 14.81 C ATOM 731 C GLN A 50 17.385 28.326 18.497 1.00 7.39 C ATOM 732 O GLN A 50 17.060 29.329 17.857 1.00 13.00 O ATOM 733 CB GLN A 50 16.150 27.469 20.537 1.00 15.49 C ATOM 734 CG GLN A 50 14.863 27.657 19.758 1.00 12.48 C ATOM 735 CD GLN A 50 13.681 26.905 20.330 1.00 20.15 C ATOM 736 OE1 GLN A 50 13.521 25.691 20.174 1.00 15.44 O ATOM 737 NE2 GLN A 50 12.823 27.660 21.006 1.00 11.71 N ATOM 738 HA GLN A 50 18.241 27.802 20.364 1.00 0.00 H ATOM 739 HB2 GLN A 50 16.422 26.414 20.497 1.00 0.00 H ATOM 740 HB3 GLN A 50 15.968 27.757 21.572 1.00 0.00 H ATOM 741 HG2 GLN A 50 14.621 28.720 19.747 1.00 0.00 H ATOM 742 HG3 GLN A 50 15.027 27.313 18.737 1.00 0.00 H ATOM 743 HE22 GLN A 50 12.999 28.680 21.112 1.00 0.00 H ATOM 744 HE21 GLN A 50 11.975 27.232 21.430 1.00 0.00 H ATOM 745 H GLN A 50 16.972 30.400 19.861 1.00 0.00 H ATOM 746 N PRO A 51 17.810 27.247 17.841 1.00 5.44 N ATOM 747 CA PRO A 51 17.919 27.293 16.393 1.00 4.49 C ATOM 748 C PRO A 51 16.558 27.376 15.714 1.00 11.63 C ATOM 749 O PRO A 51 15.522 27.048 16.284 1.00 19.87 O ATOM 750 CB PRO A 51 18.575 25.951 16.031 1.00 11.13 C ATOM 751 CG PRO A 51 18.970 25.301 17.299 1.00 4.37 C ATOM 752 CD PRO A 51 18.206 25.955 18.410 1.00 4.82 C ATOM 753 HA PRO A 51 18.478 28.170 16.068 1.00 0.00 H ATOM 754 HD3 PRO A 51 17.331 25.364 18.682 1.00 0.00 H ATOM 755 HD2 PRO A 51 18.837 26.093 19.288 1.00 0.00 H ATOM 756 HG3 PRO A 51 20.041 25.426 17.462 1.00 0.00 H ATOM 757 HG2 PRO A 51 18.731 24.238 17.261 1.00 0.00 H ATOM 758 HB2 PRO A 51 17.866 25.321 15.493 1.00 0.00 H ATOM 759 HB3 PRO A 51 19.453 26.120 15.408 1.00 0.00 H ATOM 760 N ASP A 52 16.584 27.819 14.459 1.00 20.92 N ATOM 761 CA ASP A 52 15.389 27.816 13.633 1.00 11.26 C ATOM 762 C ASP A 52 14.929 26.365 13.484 1.00 15.41 C ATOM 763 O ASP A 52 15.729 25.442 13.644 1.00 6.16 O ATOM 764 CB ASP A 52 15.630 28.419 12.255 1.00 8.20 C ATOM 765 CG ASP A 52 15.798 29.928 12.231 1.00 16.71 C ATOM 766 OD1 ASP A 52 15.781 30.572 13.300 1.00 4.23 O ATOM 767 OD2 ASP A 52 15.949 30.497 11.126 1.00 37.08 O ATOM 768 HA ASP A 52 14.630 28.431 14.117 1.00 0.00 H ATOM 769 HB2 ASP A 52 16.535 27.972 11.844 1.00 0.00 H ATOM 770 HB3 ASP A 52 14.781 28.164 11.621 1.00 0.00 H ATOM 771 H ASP A 52 17.477 28.174 14.062 1.00 0.00 H ATOM 772 N TYR A 53 13.657 26.198 13.171 1.00 11.63 N ATOM 773 CA TYR A 53 13.070 24.887 12.974 1.00 10.61 C ATOM 774 C TYR A 53 13.083 24.485 11.508 1.00 15.74 C ATOM 775 O TYR A 53 12.878 25.335 10.646 1.00 14.87 O ATOM 776 CB TYR A 53 11.608 24.873 13.455 1.00 3.84 C ATOM 777 CG TYR A 53 11.500 24.708 14.954 1.00 3.10 C ATOM 778 CD1 TYR A 53 11.892 25.738 15.800 1.00 12.35 C ATOM 779 CD2 TYR A 53 11.023 23.546 15.522 1.00 8.92 C ATOM 780 CE1 TYR A 53 11.796 25.590 17.174 1.00 15.24 C ATOM 781 CE2 TYR A 53 10.920 23.388 16.893 1.00 17.19 C ATOM 782 CZ TYR A 53 11.313 24.422 17.716 1.00 14.76 C ATOM 783 OH TYR A 53 11.221 24.284 19.079 1.00 8.54 O ATOM 784 HA TYR A 53 13.669 24.182 13.550 1.00 0.00 H ATOM 785 HB3 TYR A 53 11.088 24.046 12.972 1.00 0.00 H ATOM 786 HB2 TYR A 53 11.136 25.813 13.170 1.00 0.00 H ATOM 787 HD2 TYR A 53 10.718 22.727 14.871 1.00 0.00 H ATOM 788 HE2 TYR A 53 10.534 22.460 17.316 1.00 0.00 H ATOM 789 HE1 TYR A 53 12.105 26.404 17.829 1.00 0.00 H ATOM 790 HD1 TYR A 53 12.277 26.667 15.380 1.00 0.00 H ATOM 791 HH TYR A 53 11.542 25.112 19.516 1.00 0.00 H ATOM 792 H TYR A 53 13.054 27.038 13.062 1.00 0.00 H ATOM 793 N LEU A 54 13.289 23.192 11.273 1.00 17.71 N ATOM 794 CA LEU A 54 12.908 22.599 9.997 1.00 7.41 C ATOM 795 C LEU A 54 11.456 22.139 10.170 1.00 8.84 C ATOM 796 O LEU A 54 11.149 21.397 11.108 1.00 8.07 O ATOM 797 CB LEU A 54 13.765 21.425 9.558 1.00 7.11 C ATOM 798 CG LEU A 54 13.810 21.115 8.069 1.00 7.10 C ATOM 799 CD1 LEU A 54 15.015 20.237 7.740 1.00 14.16 C ATOM 800 CD2 LEU A 54 12.542 20.424 7.575 1.00 20.24 C ATOM 801 HA LEU A 54 13.044 23.345 9.214 1.00 0.00 H ATOM 802 HB2 LEU A 54 14.786 21.625 9.883 1.00 0.00 H ATOM 803 HB3 LEU A 54 13.390 20.537 10.067 1.00 0.00 H ATOM 804 HG LEU A 54 13.893 22.074 7.558 1.00 0.00 H ATOM 805 HD21 LEU A 54 12.411 19.483 8.110 1.00 0.00 H ATOM 806 HD22 LEU A 54 11.683 21.070 7.757 1.00 0.00 H ATOM 807 HD23 LEU A 54 12.630 20.227 6.507 1.00 0.00 H ATOM 808 HD11 LEU A 54 15.930 20.758 8.021 1.00 0.00 H ATOM 809 HD12 LEU A 54 14.943 19.301 8.294 1.00 0.00 H ATOM 810 HD13 LEU A 54 15.029 20.027 6.671 1.00 0.00 H ATOM 811 H LEU A 54 13.726 22.598 12.007 1.00 0.00 H ATOM 812 N ASN A 55 10.614 22.616 9.272 1.00 9.17 N ATOM 813 CA ASN A 55 9.201 22.278 9.341 1.00 10.33 C ATOM 814 C ASN A 55 8.789 21.636 8.029 1.00 7.23 C ATOM 815 O ASN A 55 9.303 22.038 6.986 1.00 17.32 O ATOM 816 CB ASN A 55 8.367 23.521 9.628 1.00 21.75 C ATOM 817 CG ASN A 55 8.110 23.748 11.103 1.00 23.61 C ATOM 818 OD1 ASN A 55 8.647 24.675 11.715 1.00 26.79 O ATOM 819 ND2 ASN A 55 7.275 22.902 11.689 1.00 3.94 N ATOM 820 HA ASN A 55 9.029 21.575 10.156 1.00 0.00 H ATOM 821 HB2 ASN A 55 8.893 24.389 9.231 1.00 0.00 H ATOM 822 HB3 ASN A 55 7.407 23.417 9.122 1.00 0.00 H ATOM 823 HD22 ASN A 55 6.842 22.133 11.138 1.00 0.00 H ATOM 824 HD21 ASN A 55 7.052 23.007 12.699 1.00 0.00 H ATOM 825 H ASN A 55 10.962 23.236 8.513 1.00 0.00 H ATOM 826 N ALA A 56 7.888 20.663 8.094 1.00 11.53 N ATOM 827 CA ALA A 56 7.329 20.066 6.889 1.00 14.43 C ATOM 828 C ALA A 56 5.910 19.568 7.170 1.00 16.91 C ATOM 829 O ALA A 56 5.530 19.457 8.340 1.00 13.30 O ATOM 830 CB ALA A 56 8.186 18.917 6.384 1.00 5.79 C ATOM 831 HA ALA A 56 7.306 20.832 6.114 1.00 0.00 H ATOM 832 HB1 ALA A 56 9.186 19.285 6.154 1.00 0.00 H ATOM 833 HB2 ALA A 56 8.249 18.147 7.153 1.00 0.00 H ATOM 834 HB3 ALA A 56 7.736 18.498 5.484 1.00 0.00 H ATOM 835 H ALA A 56 7.575 20.320 9.025 1.00 0.00 H ATOM 836 N ALA A 57 5.183 19.280 6.101 1.00 18.80 N ATOM 837 CA ALA A 57 3.849 18.700 6.214 1.00 17.49 C ATOM 838 C ALA A 57 3.755 17.384 5.455 1.00 10.28 C ATOM 839 O ALA A 57 4.225 17.257 4.326 1.00 6.03 O ATOM 840 CB ALA A 57 2.785 19.657 5.696 1.00 8.31 C ATOM 841 HA ALA A 57 3.672 18.513 7.273 1.00 0.00 H ATOM 842 HB1 ALA A 57 2.814 20.579 6.277 1.00 0.00 H ATOM 843 HB2 ALA A 57 2.979 19.881 4.647 1.00 0.00 H ATOM 844 HB3 ALA A 57 1.803 19.194 5.794 1.00 0.00 H ATOM 845 H ALA A 57 5.573 19.472 5.156 1.00 0.00 H ATOM 846 N VAL A 58 3.119 16.372 6.055 1.00 4.73 N ATOM 847 CA VAL A 58 2.948 15.167 5.238 1.00 9.84 C ATOM 848 C VAL A 58 1.489 14.751 5.171 1.00 4.60 C ATOM 849 O VAL A 58 0.787 14.846 6.176 1.00 8.90 O ATOM 850 CB VAL A 58 3.756 13.988 5.809 1.00 15.09 C ATOM 851 CG1 VAL A 58 3.367 12.689 5.118 1.00 7.99 C ATOM 852 CG2 VAL A 58 5.241 14.272 5.667 1.00 5.62 C ATOM 853 HA VAL A 58 3.308 15.413 4.239 1.00 0.00 H ATOM 854 HB VAL A 58 3.528 13.873 6.869 1.00 0.00 H ATOM 855 HG11 VAL A 58 2.305 12.499 5.275 1.00 0.00 H ATOM 856 HG12 VAL A 58 3.569 12.772 4.050 1.00 0.00 H ATOM 857 HG13 VAL A 58 3.949 11.868 5.536 1.00 0.00 H ATOM 858 HG21 VAL A 58 5.485 14.403 4.613 1.00 0.00 H ATOM 859 HG22 VAL A 58 5.490 15.181 6.214 1.00 0.00 H ATOM 860 HG23 VAL A 58 5.810 13.435 6.072 1.00 0.00 H ATOM 861 H VAL A 58 2.770 16.436 7.033 1.00 0.00 H ATOM 862 N ALA A 59 1.095 14.292 3.993 1.00 4.32 N ATOM 863 CA ALA A 59 -0.153 13.580 3.787 1.00 8.29 C ATOM 864 C ALA A 59 0.082 12.072 3.911 1.00 6.59 C ATOM 865 O ALA A 59 0.584 11.470 2.958 1.00 4.33 O ATOM 866 CB ALA A 59 -0.733 13.910 2.426 1.00 3.81 C ATOM 867 HA ALA A 59 -0.866 13.893 4.550 1.00 0.00 H ATOM 868 HB1 ALA A 59 -0.921 14.982 2.363 1.00 0.00 H ATOM 869 HB2 ALA A 59 -0.025 13.618 1.650 1.00 0.00 H ATOM 870 HB3 ALA A 59 -1.668 13.367 2.290 1.00 0.00 H ATOM 871 H ALA A 59 1.713 14.450 3.171 1.00 0.00 H ATOM 872 N LEU A 60 -0.267 11.492 5.043 1.00 7.34 N ATOM 873 CA LEU A 60 -0.187 10.067 5.299 1.00 14.40 C ATOM 874 C LEU A 60 -1.538 9.370 5.162 1.00 15.55 C ATOM 875 O LEU A 60 -2.449 9.640 5.945 1.00 6.52 O ATOM 876 CB LEU A 60 0.323 9.778 6.718 1.00 10.12 C ATOM 877 CG LEU A 60 0.591 8.303 7.031 1.00 6.08 C ATOM 878 CD1 LEU A 60 1.991 7.931 6.559 1.00 8.56 C ATOM 879 CD2 LEU A 60 0.425 7.992 8.510 1.00 3.86 C ATOM 880 HA LEU A 60 0.505 9.682 4.550 1.00 0.00 H ATOM 881 HB2 LEU A 60 1.254 10.327 6.860 1.00 0.00 H ATOM 882 HB3 LEU A 60 -0.423 10.142 7.425 1.00 0.00 H ATOM 883 HG LEU A 60 -0.147 7.705 6.498 1.00 0.00 H ATOM 884 HD21 LEU A 60 1.126 8.595 9.088 1.00 0.00 H ATOM 885 HD22 LEU A 60 -0.595 8.225 8.817 1.00 0.00 H ATOM 886 HD23 LEU A 60 0.625 6.935 8.682 1.00 0.00 H ATOM 887 HD11 LEU A 60 2.066 8.095 5.484 1.00 0.00 H ATOM 888 HD12 LEU A 60 2.724 8.552 7.074 1.00 0.00 H ATOM 889 HD13 LEU A 60 2.181 6.881 6.782 1.00 0.00 H ATOM 890 H LEU A 60 -0.625 12.100 5.807 1.00 0.00 H ATOM 891 N GLU A 61 -1.670 8.474 4.189 1.00 18.80 N ATOM 892 CA GLU A 61 -2.871 7.631 4.144 1.00 16.41 C ATOM 893 C GLU A 61 -2.723 6.559 5.217 1.00 14.41 C ATOM 894 O GLU A 61 -1.694 5.871 5.243 1.00 12.27 O ATOM 895 CB GLU A 61 -3.052 7.023 2.763 1.00 14.61 C ATOM 896 CG GLU A 61 -4.084 5.921 2.653 1.00 19.05 C ATOM 897 CD GLU A 61 -5.503 6.343 2.963 1.00 26.26 C ATOM 898 OE1 GLU A 61 -5.962 7.393 2.458 1.00 26.14 O ATOM 899 OE2 GLU A 61 -6.169 5.603 3.726 1.00 10.02 O ATOM 900 HA GLU A 61 -3.764 8.225 4.339 1.00 0.00 H ATOM 901 HB2 GLU A 61 -3.344 7.823 2.082 1.00 0.00 H ATOM 902 HB3 GLU A 61 -2.092 6.613 2.450 1.00 0.00 H ATOM 903 HG2 GLU A 61 -4.060 5.535 1.634 1.00 0.00 H ATOM 904 HG3 GLU A 61 -3.807 5.127 3.347 1.00 0.00 H ATOM 905 H GLU A 61 -0.929 8.371 3.466 1.00 0.00 H ATOM 906 N THR A 62 -3.693 6.406 6.116 1.00 9.50 N ATOM 907 CA THR A 62 -3.524 5.364 7.137 1.00 19.91 C ATOM 908 C THR A 62 -4.858 4.691 7.449 1.00 23.36 C ATOM 909 O THR A 62 -5.920 5.313 7.358 1.00 9.58 O ATOM 910 CB THR A 62 -2.891 5.886 8.437 1.00 19.01 C ATOM 911 OG1 THR A 62 -2.755 4.804 9.376 1.00 14.14 O ATOM 912 CG2 THR A 62 -3.764 6.928 9.124 1.00 3.91 C ATOM 913 HA THR A 62 -2.833 4.636 6.712 1.00 0.00 H ATOM 914 HB THR A 62 -1.932 6.324 8.159 1.00 0.00 H ATOM 915 HG1 THR A 62 -2.176 4.101 8.987 1.00 0.00 H ATOM 916 HG23 THR A 62 -3.905 7.779 8.457 1.00 0.00 H ATOM 917 HG21 THR A 62 -4.732 6.488 9.363 1.00 0.00 H ATOM 918 HG22 THR A 62 -3.278 7.260 10.041 1.00 0.00 H ATOM 919 H THR A 62 -4.543 7.005 6.096 1.00 0.00 H ATOM 920 N SER A 63 -4.773 3.409 7.810 1.00 18.35 N ATOM 921 CA SER A 63 -5.977 2.671 8.201 1.00 9.14 C ATOM 922 C SER A 63 -6.110 2.662 9.723 1.00 6.52 C ATOM 923 O SER A 63 -7.145 2.245 10.252 1.00 4.90 O ATOM 924 CB SER A 63 -5.965 1.254 7.626 1.00 16.67 C ATOM 925 OG SER A 63 -6.000 1.266 6.200 1.00 5.37 O ATOM 926 HA SER A 63 -6.850 3.175 7.786 1.00 0.00 H ATOM 927 HB2 SER A 63 -6.836 0.714 7.997 1.00 0.00 H ATOM 928 HB3 SER A 63 -5.058 0.747 7.954 1.00 0.00 H ATOM 929 HG SER A 63 -5.991 0.335 5.863 1.00 0.00 H ATOM 930 H SER A 63 -3.849 2.932 7.814 1.00 0.00 H ATOM 931 N LEU A 64 -5.078 3.134 10.417 1.00 8.91 N ATOM 932 CA LEU A 64 -5.063 3.240 11.870 1.00 17.23 C ATOM 933 C LEU A 64 -6.076 4.262 12.389 1.00 21.28 C ATOM 934 O LEU A 64 -6.399 5.240 11.718 1.00 11.07 O ATOM 935 CB LEU A 64 -3.683 3.655 12.384 1.00 17.09 C ATOM 936 CG LEU A 64 -2.555 2.633 12.391 1.00 17.26 C ATOM 937 CD1 LEU A 64 -1.201 3.323 12.540 1.00 22.46 C ATOM 938 CD2 LEU A 64 -2.732 1.610 13.507 1.00 6.94 C ATOM 939 HA LEU A 64 -5.326 2.248 12.239 1.00 0.00 H ATOM 940 HB2 LEU A 64 -3.352 4.491 11.768 1.00 0.00 H ATOM 941 HB3 LEU A 64 -3.814 3.992 13.412 1.00 0.00 H ATOM 942 HG LEU A 64 -2.589 2.109 11.436 1.00 0.00 H ATOM 943 HD21 LEU A 64 -2.740 2.122 14.469 1.00 0.00 H ATOM 944 HD22 LEU A 64 -3.675 1.082 13.368 1.00 0.00 H ATOM 945 HD23 LEU A 64 -1.907 0.898 13.479 1.00 0.00 H ATOM 946 HD11 LEU A 64 -1.050 4.009 11.706 1.00 0.00 H ATOM 947 HD12 LEU A 64 -1.179 3.879 13.477 1.00 0.00 H ATOM 948 HD13 LEU A 64 -0.411 2.573 12.542 1.00 0.00 H ATOM 949 H LEU A 64 -4.235 3.445 9.893 1.00 0.00 H ATOM 950 N ALA A 65 -6.565 4.041 13.602 1.00 21.05 N ATOM 951 CA ALA A 65 -7.451 5.005 14.252 1.00 21.59 C ATOM 952 C ALA A 65 -6.609 6.154 14.810 1.00 17.61 C ATOM 953 O ALA A 65 -5.411 5.930 15.035 1.00 9.36 O ATOM 954 CB ALA A 65 -8.285 4.340 15.333 1.00 20.04 C ATOM 955 HA ALA A 65 -8.153 5.406 13.521 1.00 0.00 H ATOM 956 HB1 ALA A 65 -8.893 3.552 14.888 1.00 0.00 H ATOM 957 HB2 ALA A 65 -7.625 3.910 16.086 1.00 0.00 H ATOM 958 HB3 ALA A 65 -8.934 5.082 15.798 1.00 0.00 H ATOM 959 H ALA A 65 -6.313 3.164 14.101 1.00 0.00 H ATOM 960 N PRO A 66 -7.235 7.307 14.993 1.00 14.30 N ATOM 961 CA PRO A 66 -6.519 8.521 15.403 1.00 15.54 C ATOM 962 C PRO A 66 -5.574 8.251 16.567 1.00 11.84 C ATOM 963 O PRO A 66 -4.374 8.447 16.390 1.00 14.48 O ATOM 964 CB PRO A 66 -7.626 9.489 15.829 1.00 16.49 C ATOM 965 CG PRO A 66 -8.801 9.059 15.012 1.00 20.09 C ATOM 966 CD PRO A 66 -8.677 7.574 14.832 1.00 12.34 C ATOM 967 HA PRO A 66 -5.897 8.913 14.599 1.00 0.00 H ATOM 968 HD3 PRO A 66 -9.255 7.043 15.588 1.00 0.00 H ATOM 969 HD2 PRO A 66 -9.017 7.275 13.841 1.00 0.00 H ATOM 970 HG3 PRO A 66 -8.789 9.558 14.043 1.00 0.00 H ATOM 971 HG2 PRO A 66 -9.729 9.299 15.531 1.00 0.00 H ATOM 972 HB2 PRO A 66 -7.837 9.395 16.894 1.00 0.00 H ATOM 973 HB3 PRO A 66 -7.351 10.519 15.604 1.00 0.00 H ATOM 974 N GLU A 67 -6.096 7.797 17.700 1.00 11.16 N ATOM 975 CA GLU A 67 -5.204 7.527 18.834 1.00 9.98 C ATOM 976 C GLU A 67 -4.300 6.336 18.547 1.00 18.58 C ATOM 977 O GLU A 67 -3.231 6.149 19.135 1.00 16.01 O ATOM 978 CB GLU A 67 -6.034 7.322 20.097 1.00 6.85 C ATOM 979 CG GLU A 67 -6.802 8.571 20.506 1.00 18.68 C ATOM 980 CD GLU A 67 -7.253 8.555 21.951 1.00 25.97 C ATOM 981 OE1 GLU A 67 -7.761 7.513 22.422 1.00 23.46 O ATOM 982 OE2 GLU A 67 -7.104 9.598 22.622 1.00 41.34 O ATOM 983 HA GLU A 67 -4.550 8.385 18.990 1.00 0.00 H ATOM 984 HB2 GLU A 67 -6.747 6.517 19.919 1.00 0.00 H ATOM 985 HB3 GLU A 67 -5.366 7.041 20.911 1.00 0.00 H ATOM 986 HG2 GLU A 67 -6.158 9.438 20.354 1.00 0.00 H ATOM 987 HG3 GLU A 67 -7.683 8.659 19.870 1.00 0.00 H ATOM 988 H GLU A 67 -7.120 7.635 17.783 1.00 0.00 H ATOM 989 N GLU A 68 -4.678 5.473 17.600 1.00 9.47 N ATOM 990 CA GLU A 68 -3.728 4.413 17.251 1.00 15.68 C ATOM 991 C GLU A 68 -2.584 5.029 16.455 1.00 14.86 C ATOM 992 O GLU A 68 -1.425 4.641 16.612 1.00 8.46 O ATOM 993 CB GLU A 68 -4.406 3.282 16.479 1.00 9.98 C ATOM 994 CG GLU A 68 -5.658 2.765 17.181 1.00 12.14 C ATOM 995 CD GLU A 68 -5.374 2.192 18.552 1.00 17.82 C ATOM 996 OE1 GLU A 68 -4.215 1.830 18.842 1.00 17.83 O ATOM 997 OE2 GLU A 68 -6.319 2.090 19.364 1.00 22.16 O ATOM 998 HA GLU A 68 -3.334 3.965 18.163 1.00 0.00 H ATOM 999 HB2 GLU A 68 -4.685 3.650 15.492 1.00 0.00 H ATOM 1000 HB3 GLU A 68 -3.700 2.459 16.372 1.00 0.00 H ATOM 1001 HG2 GLU A 68 -6.362 3.590 17.288 1.00 0.00 H ATOM 1002 HG3 GLU A 68 -6.105 1.985 16.564 1.00 0.00 H ATOM 1003 H GLU A 68 -5.604 5.550 17.132 1.00 0.00 H ATOM 1004 N LEU A 69 -2.921 6.000 15.604 1.00 9.52 N ATOM 1005 CA LEU A 69 -1.849 6.704 14.892 1.00 16.01 C ATOM 1006 C LEU A 69 -0.929 7.431 15.872 1.00 13.89 C ATOM 1007 O LEU A 69 0.274 7.566 15.632 1.00 15.45 O ATOM 1008 CB LEU A 69 -2.430 7.672 13.863 1.00 14.28 C ATOM 1009 CG LEU A 69 -1.422 8.536 13.102 1.00 12.64 C ATOM 1010 CD1 LEU A 69 -0.398 7.665 12.396 1.00 15.27 C ATOM 1011 CD2 LEU A 69 -2.115 9.439 12.092 1.00 3.37 C ATOM 1012 HA LEU A 69 -1.251 5.964 14.360 1.00 0.00 H ATOM 1013 HB2 LEU A 69 -2.985 7.085 13.131 1.00 0.00 H ATOM 1014 HB3 LEU A 69 -3.114 8.341 14.385 1.00 0.00 H ATOM 1015 HG LEU A 69 -0.914 9.166 13.832 1.00 0.00 H ATOM 1016 HD21 LEU A 69 -2.659 8.827 11.373 1.00 0.00 H ATOM 1017 HD22 LEU A 69 -2.812 10.096 12.612 1.00 0.00 H ATOM 1018 HD23 LEU A 69 -1.369 10.038 11.570 1.00 0.00 H ATOM 1019 HD11 LEU A 69 0.136 7.064 13.132 1.00 0.00 H ATOM 1020 HD12 LEU A 69 -0.906 7.009 11.689 1.00 0.00 H ATOM 1021 HD13 LEU A 69 0.309 8.299 11.861 1.00 0.00 H ATOM 1022 H LEU A 69 -3.918 6.251 15.449 1.00 0.00 H ATOM 1023 N LEU A 70 -1.457 7.900 16.999 1.00 13.85 N ATOM 1024 CA LEU A 70 -0.655 8.658 17.965 1.00 18.14 C ATOM 1025 C LEU A 70 0.339 7.764 18.690 1.00 20.95 C ATOM 1026 O LEU A 70 1.474 8.130 19.009 1.00 6.79 O ATOM 1027 CB LEU A 70 -1.584 9.366 18.953 1.00 4.24 C ATOM 1028 CG LEU A 70 -0.985 10.328 19.971 1.00 9.86 C ATOM 1029 CD1 LEU A 70 -0.336 11.527 19.289 1.00 5.28 C ATOM 1030 CD2 LEU A 70 -2.049 10.789 20.963 1.00 3.92 C ATOM 1031 HA LEU A 70 -0.073 9.405 17.425 1.00 0.00 H ATOM 1032 HB2 LEU A 70 -2.305 9.932 18.364 1.00 0.00 H ATOM 1033 HB3 LEU A 70 -2.105 8.590 19.514 1.00 0.00 H ATOM 1034 HG LEU A 70 -0.207 9.793 20.516 1.00 0.00 H ATOM 1035 HD21 LEU A 70 -2.850 11.296 20.425 1.00 0.00 H ATOM 1036 HD22 LEU A 70 -2.453 9.924 21.488 1.00 0.00 H ATOM 1037 HD23 LEU A 70 -1.601 11.475 21.682 1.00 0.00 H ATOM 1038 HD11 LEU A 70 0.460 11.181 18.629 1.00 0.00 H ATOM 1039 HD12 LEU A 70 -1.086 12.062 18.706 1.00 0.00 H ATOM 1040 HD13 LEU A 70 0.081 12.192 20.045 1.00 0.00 H ATOM 1041 H LEU A 70 -2.462 7.725 17.200 1.00 0.00 H ATOM 1042 N ASN A 71 -0.079 6.526 18.972 1.00 18.53 N ATOM 1043 CA ASN A 71 0.864 5.597 19.606 1.00 12.90 C ATOM 1044 C ASN A 71 2.074 5.413 18.705 1.00 7.83 C ATOM 1045 O ASN A 71 3.233 5.472 19.120 1.00 15.71 O ATOM 1046 CB ASN A 71 0.159 4.270 19.906 1.00 9.89 C ATOM 1047 CG ASN A 71 -0.825 4.423 21.050 1.00 9.99 C ATOM 1048 OD1 ASN A 71 -0.637 5.276 21.924 1.00 11.35 O ATOM 1049 ND2 ASN A 71 -1.878 3.609 21.068 1.00 14.14 N ATOM 1050 HA ASN A 71 1.215 6.002 20.555 1.00 0.00 H ATOM 1051 HB2 ASN A 71 -0.377 3.942 19.016 1.00 0.00 H ATOM 1052 HB3 ASN A 71 0.905 3.523 20.175 1.00 0.00 H ATOM 1053 HD22 ASN A 71 -2.003 2.903 20.314 1.00 0.00 H ATOM 1054 HD21 ASN A 71 -2.576 3.679 21.836 1.00 0.00 H ATOM 1055 H ASN A 71 -1.050 6.228 18.747 1.00 0.00 H ATOM 1056 N HIS A 72 1.791 5.207 17.416 1.00 9.25 N ATOM 1057 CA HIS A 72 2.865 5.014 16.444 1.00 8.62 C ATOM 1058 C HIS A 72 3.758 6.233 16.299 1.00 12.39 C ATOM 1059 O HIS A 72 4.964 6.106 16.560 1.00 16.26 O ATOM 1060 CB HIS A 72 2.224 4.572 15.118 1.00 6.85 C ATOM 1061 CG HIS A 72 1.660 3.183 15.318 1.00 13.35 C ATOM 1062 ND1 HIS A 72 2.267 2.048 14.848 1.00 16.38 N ATOM 1063 CD2 HIS A 72 0.552 2.768 15.976 1.00 5.68 C ATOM 1064 CE1 HIS A 72 1.553 0.987 15.187 1.00 15.65 C ATOM 1065 NE2 HIS A 72 0.500 1.398 15.874 1.00 14.25 N ATOM 1066 HA HIS A 72 3.542 4.236 16.796 1.00 0.00 H ATOM 1067 HB2 HIS A 72 1.425 5.261 14.844 1.00 0.00 H ATOM 1068 HB3 HIS A 72 2.976 4.557 14.329 1.00 0.00 H ATOM 1069 HD2 HIS A 72 -0.167 3.404 16.492 1.00 0.00 H ATOM 1070 HE1 HIS A 72 1.792 -0.048 14.942 1.00 0.00 H ATOM 1071 H HIS A 72 0.800 5.184 17.102 1.00 0.00 H ATOM 1072 N THR A 73 3.246 7.398 15.921 1.00 11.13 N ATOM 1073 CA THR A 73 4.080 8.600 15.855 1.00 16.13 C ATOM 1074 C THR A 73 4.835 8.871 17.149 1.00 9.19 C ATOM 1075 O THR A 73 5.974 9.346 17.150 1.00 17.91 O ATOM 1076 CB THR A 73 3.279 9.893 15.563 1.00 18.96 C ATOM 1077 OG1 THR A 73 2.324 10.112 16.611 1.00 20.26 O ATOM 1078 CG2 THR A 73 2.513 9.770 14.264 1.00 3.66 C ATOM 1079 HA THR A 73 4.764 8.377 15.036 1.00 0.00 H ATOM 1080 HB THR A 73 3.987 10.719 15.498 1.00 0.00 H ATOM 1081 HG1 THR A 73 2.799 10.206 17.474 1.00 0.00 H ATOM 1082 HG23 THR A 73 3.213 9.602 13.445 1.00 0.00 H ATOM 1083 HG21 THR A 73 1.821 8.930 14.330 1.00 0.00 H ATOM 1084 HG22 THR A 73 1.955 10.689 14.084 1.00 0.00 H ATOM 1085 H THR A 73 2.239 7.458 15.668 1.00 0.00 H ATOM 1086 N GLN A 74 4.204 8.610 18.294 1.00 13.32 N ATOM 1087 CA GLN A 74 4.914 8.935 19.530 1.00 8.03 C ATOM 1088 C GLN A 74 6.073 7.970 19.741 1.00 17.52 C ATOM 1089 O GLN A 74 7.083 8.312 20.355 1.00 15.12 O ATOM 1090 CB GLN A 74 3.969 8.922 20.727 1.00 10.86 C ATOM 1091 CG GLN A 74 2.838 9.942 20.648 1.00 6.89 C ATOM 1092 CD GLN A 74 2.195 10.078 22.016 1.00 13.65 C ATOM 1093 OE1 GLN A 74 2.142 9.105 22.774 1.00 13.64 O ATOM 1094 NE2 GLN A 74 1.709 11.270 22.327 1.00 15.35 N ATOM 1095 HA GLN A 74 5.316 9.944 19.439 1.00 0.00 H ATOM 1096 HB2 GLN A 74 3.528 7.928 20.802 1.00 0.00 H ATOM 1097 HB3 GLN A 74 4.552 9.128 21.624 1.00 0.00 H ATOM 1098 HG2 GLN A 74 3.237 10.907 20.335 1.00 0.00 H ATOM 1099 HG3 GLN A 74 2.093 9.607 19.926 1.00 0.00 H ATOM 1100 HE22 GLN A 74 1.782 12.055 21.648 1.00 0.00 H ATOM 1101 HE21 GLN A 74 1.255 11.422 23.250 1.00 0.00 H ATOM 1102 H GLN A 74 3.251 8.194 18.307 1.00 0.00 H ATOM 1103 N ARG A 75 5.949 6.743 19.228 1.00 14.88 N ATOM 1104 CA ARG A 75 7.091 5.836 19.367 1.00 12.11 C ATOM 1105 C ARG A 75 8.313 6.445 18.675 1.00 3.38 C ATOM 1106 O ARG A 75 9.358 6.567 19.300 1.00 11.21 O ATOM 1107 CB ARG A 75 6.763 4.468 18.785 1.00 10.91 C ATOM 1108 CG ARG A 75 7.932 3.496 18.746 1.00 10.04 C ATOM 1109 CD ARG A 75 7.927 2.570 19.958 1.00 8.24 C ATOM 1110 NE ARG A 75 8.746 1.380 19.701 1.00 7.82 N ATOM 1111 CZ ARG A 75 9.305 0.633 20.645 1.00 13.59 C ATOM 1112 NH1 ARG A 75 9.144 0.931 21.925 1.00 15.88 N ATOM 1113 NH2 ARG A 75 10.034 -0.430 20.325 1.00 26.62 N ATOM 1114 HA ARG A 75 7.315 5.701 20.425 1.00 0.00 H ATOM 1115 HB2 ARG A 75 5.971 4.023 19.388 1.00 0.00 H ATOM 1116 HB3 ARG A 75 6.405 4.610 17.765 1.00 0.00 H ATOM 1117 HG2 ARG A 75 7.863 2.895 17.840 1.00 0.00 H ATOM 1118 HG3 ARG A 75 8.864 4.062 18.735 1.00 0.00 H ATOM 1119 HD2 ARG A 75 6.903 2.262 20.170 1.00 0.00 H ATOM 1120 HD3 ARG A 75 8.330 3.104 20.819 1.00 0.00 H ATOM 1121 HE ARG A 75 8.899 1.103 18.710 1.00 0.00 H ATOM 1122 HH12 ARG A 75 9.587 0.339 22.656 1.00 0.00 H ATOM 1123 HH11 ARG A 75 8.575 1.757 22.199 1.00 0.00 H ATOM 1124 HH22 ARG A 75 10.467 -1.008 21.073 1.00 0.00 H ATOM 1125 HH21 ARG A 75 10.172 -0.685 19.326 1.00 0.00 H ATOM 1126 H ARG A 75 5.076 6.443 18.749 1.00 0.00 H ATOM 1127 N ILE A 76 8.117 6.803 17.419 1.00 6.05 N ATOM 1128 CA ILE A 76 9.088 7.398 16.527 1.00 13.91 C ATOM 1129 C ILE A 76 9.738 8.627 17.144 1.00 17.70 C ATOM 1130 O ILE A 76 10.964 8.760 17.139 1.00 14.37 O ATOM 1131 CB ILE A 76 8.422 7.762 15.185 1.00 13.48 C ATOM 1132 CG1 ILE A 76 7.962 6.534 14.400 1.00 4.15 C ATOM 1133 CG2 ILE A 76 9.349 8.656 14.378 1.00 17.96 C ATOM 1134 CD1 ILE A 76 7.252 6.821 13.097 1.00 5.97 C ATOM 1135 HA ILE A 76 9.873 6.663 16.351 1.00 0.00 H ATOM 1136 HB ILE A 76 7.509 8.318 15.400 1.00 0.00 H ATOM 1137 HG12 ILE A 76 8.841 5.929 14.177 1.00 0.00 H ATOM 1138 HG13 ILE A 76 7.282 5.965 15.034 1.00 0.00 H ATOM 1139 HD11 ILE A 76 6.358 7.412 13.294 1.00 0.00 H ATOM 1140 HD12 ILE A 76 7.918 7.376 12.437 1.00 0.00 H ATOM 1141 HD13 ILE A 76 6.970 5.881 12.624 1.00 0.00 H ATOM 1142 HG21 ILE A 76 9.552 9.568 14.940 1.00 0.00 H ATOM 1143 HG22 ILE A 76 10.284 8.129 14.187 1.00 0.00 H ATOM 1144 HG23 ILE A 76 8.873 8.910 13.431 1.00 0.00 H ATOM 1145 H ILE A 76 7.166 6.640 17.031 1.00 0.00 H ATOM 1146 N GLU A 77 8.929 9.523 17.702 1.00 8.82 N ATOM 1147 CA GLU A 77 9.495 10.621 18.480 1.00 15.90 C ATOM 1148 C GLU A 77 10.483 10.118 19.532 1.00 24.27 C ATOM 1149 O GLU A 77 11.644 10.536 19.525 1.00 8.70 O ATOM 1150 CB GLU A 77 8.389 11.428 19.158 1.00 10.30 C ATOM 1151 CG GLU A 77 7.589 12.285 18.168 1.00 8.61 C ATOM 1152 CD GLU A 77 6.561 13.105 18.935 1.00 6.41 C ATOM 1153 OE1 GLU A 77 6.291 12.723 20.092 1.00 13.78 O ATOM 1154 OE2 GLU A 77 6.050 14.102 18.394 1.00 12.90 O ATOM 1155 HA GLU A 77 10.035 11.263 17.784 1.00 0.00 H ATOM 1156 HB2 GLU A 77 7.706 10.737 19.653 1.00 0.00 H ATOM 1157 HB3 GLU A 77 8.842 12.084 19.901 1.00 0.00 H ATOM 1158 HG2 GLU A 77 8.265 12.953 17.635 1.00 0.00 H ATOM 1159 HG3 GLU A 77 7.080 11.638 17.453 1.00 0.00 H ATOM 1160 H GLU A 77 7.899 9.442 17.585 1.00 0.00 H ATOM 1161 N LEU A 78 10.036 9.233 20.411 1.00 29.59 N ATOM 1162 CA LEU A 78 10.863 8.617 21.443 1.00 22.73 C ATOM 1163 C LEU A 78 12.122 7.986 20.858 1.00 19.09 C ATOM 1164 O LEU A 78 13.213 8.061 21.418 1.00 17.70 O ATOM 1165 CB LEU A 78 10.053 7.552 22.192 1.00 17.97 C ATOM 1166 CG LEU A 78 8.867 8.075 23.000 1.00 6.00 C ATOM 1167 CD1 LEU A 78 8.094 6.950 23.664 1.00 12.06 C ATOM 1168 CD2 LEU A 78 9.350 9.070 24.048 1.00 17.72 C ATOM 1169 HA LEU A 78 11.172 9.402 22.133 1.00 0.00 H ATOM 1170 HB2 LEU A 78 9.673 6.841 21.458 1.00 0.00 H ATOM 1171 HB3 LEU A 78 10.727 7.038 22.878 1.00 0.00 H ATOM 1172 HG LEU A 78 8.189 8.575 22.308 1.00 0.00 H ATOM 1173 HD21 LEU A 78 10.053 8.576 24.719 1.00 0.00 H ATOM 1174 HD22 LEU A 78 9.844 9.906 23.553 1.00 0.00 H ATOM 1175 HD23 LEU A 78 8.497 9.437 24.619 1.00 0.00 H ATOM 1176 HD11 LEU A 78 7.715 6.271 22.900 1.00 0.00 H ATOM 1177 HD12 LEU A 78 8.755 6.406 24.339 1.00 0.00 H ATOM 1178 HD13 LEU A 78 7.260 7.367 24.228 1.00 0.00 H ATOM 1179 H LEU A 78 9.033 8.961 20.362 1.00 0.00 H ATOM 1180 N GLN A 79 11.967 7.359 19.703 1.00 13.11 N ATOM 1181 CA GLN A 79 13.063 6.713 19.006 1.00 15.99 C ATOM 1182 C GLN A 79 14.115 7.713 18.544 1.00 24.25 C ATOM 1183 O GLN A 79 15.280 7.363 18.350 1.00 11.81 O ATOM 1184 CB GLN A 79 12.525 5.954 17.791 1.00 18.90 C ATOM 1185 CG GLN A 79 11.370 5.016 18.123 1.00 28.82 C ATOM 1186 CD GLN A 79 11.380 3.781 17.240 1.00 32.92 C ATOM 1187 OE1 GLN A 79 11.566 2.662 17.722 1.00 33.01 O ATOM 1188 NE2 GLN A 79 11.189 3.995 15.941 1.00 47.38 N ATOM 1189 HA GLN A 79 13.536 6.025 19.707 1.00 0.00 H ATOM 1190 HB2 GLN A 79 12.180 6.680 17.055 1.00 0.00 H ATOM 1191 HB3 GLN A 79 13.337 5.365 17.365 1.00 0.00 H ATOM 1192 HG2 GLN A 79 11.454 4.707 19.165 1.00 0.00 H ATOM 1193 HG3 GLN A 79 10.430 5.547 17.977 1.00 0.00 H ATOM 1194 HE22 GLN A 79 11.037 4.962 15.590 1.00 0.00 H ATOM 1195 HE21 GLN A 79 11.192 3.195 15.276 1.00 0.00 H ATOM 1196 H GLN A 79 11.019 7.328 19.277 1.00 0.00 H ATOM 1197 N GLN A 80 13.690 8.963 18.368 1.00 23.20 N ATOM 1198 CA GLN A 80 14.524 10.020 17.901 1.00 8.07 C ATOM 1199 C GLN A 80 14.985 10.948 18.996 1.00 14.35 C ATOM 1200 O GLN A 80 15.212 12.143 18.794 1.00 24.66 O ATOM 1201 CB GLN A 80 13.962 10.705 16.679 1.00 6.09 C ATOM 1202 CG GLN A 80 13.602 9.745 15.560 1.00 17.61 C ATOM 1203 CD GLN A 80 13.408 10.351 14.192 1.00 18.54 C ATOM 1204 OE1 GLN A 80 12.764 9.748 13.322 1.00 17.24 O ATOM 1205 NE2 GLN A 80 13.960 11.536 13.960 1.00 5.57 N ATOM 1206 HA GLN A 80 15.447 9.556 17.555 1.00 0.00 H ATOM 1207 HB2 GLN A 80 13.063 11.249 16.970 1.00 0.00 H ATOM 1208 HB3 GLN A 80 14.706 11.409 16.305 1.00 0.00 H ATOM 1209 HG2 GLN A 80 14.401 9.007 15.486 1.00 0.00 H ATOM 1210 HG3 GLN A 80 12.673 9.246 15.837 1.00 0.00 H ATOM 1211 HE22 GLN A 80 14.495 12.017 14.711 1.00 0.00 H ATOM 1212 HE21 GLN A 80 13.858 11.984 13.027 1.00 0.00 H ATOM 1213 H GLN A 80 12.696 9.179 18.583 1.00 0.00 H ATOM 1214 N GLY A 81 15.058 10.414 20.211 1.00 9.14 N ATOM 1215 CA GLY A 81 15.432 11.123 21.408 1.00 14.78 C ATOM 1216 C GLY A 81 14.682 12.384 21.760 1.00 25.75 C ATOM 1217 O GLY A 81 15.243 13.273 22.421 1.00 32.45 O ATOM 1218 HA3 GLY A 81 16.484 11.391 21.309 1.00 0.00 H ATOM 1219 HA2 GLY A 81 15.311 10.432 22.243 1.00 0.00 H ATOM 1220 H GLY A 81 14.827 9.404 20.305 1.00 0.00 H ATOM 1221 N ARG A 82 13.417 12.542 21.378 1.00 28.74 N ATOM 1222 CA ARG A 82 12.652 13.722 21.783 1.00 24.27 C ATOM 1223 C ARG A 82 12.325 13.680 23.272 1.00 26.51 C ATOM 1224 O ARG A 82 11.791 12.695 23.772 1.00 23.95 O ATOM 1225 CB ARG A 82 11.347 13.845 20.997 1.00 27.68 C ATOM 1226 CG ARG A 82 10.342 14.798 21.640 1.00 28.94 C ATOM 1227 CD ARG A 82 8.976 14.619 21.013 1.00 31.23 C ATOM 1228 NE ARG A 82 8.258 15.874 20.795 1.00 27.09 N ATOM 1229 CZ ARG A 82 7.303 16.280 21.627 1.00 25.17 C ATOM 1230 NH1 ARG A 82 6.998 15.529 22.677 1.00 25.67 N ATOM 1231 NH2 ARG A 82 6.658 17.415 21.417 1.00 16.68 N ATOM 1232 HA ARG A 82 13.279 14.588 21.570 1.00 0.00 H ATOM 1233 HB2 ARG A 82 11.579 14.210 19.996 1.00 0.00 H ATOM 1234 HB3 ARG A 82 10.891 12.857 20.926 1.00 0.00 H ATOM 1235 HG2 ARG A 82 10.279 14.588 22.708 1.00 0.00 H ATOM 1236 HG3 ARG A 82 10.674 15.826 21.492 1.00 0.00 H ATOM 1237 HD2 ARG A 82 8.376 13.989 21.670 1.00 0.00 H ATOM 1238 HD3 ARG A 82 9.102 14.123 20.051 1.00 0.00 H ATOM 1239 HE ARG A 82 8.499 16.462 19.972 1.00 0.00 H ATOM 1240 HH12 ARG A 82 6.253 15.834 23.336 1.00 0.00 H ATOM 1241 HH11 ARG A 82 7.503 14.635 22.841 1.00 0.00 H ATOM 1242 HH22 ARG A 82 5.914 17.720 22.076 1.00 0.00 H ATOM 1243 HH21 ARG A 82 6.895 18.003 20.593 1.00 0.00 H ATOM 1244 H ARG A 82 12.966 11.817 20.784 1.00 0.00 H ATOM 1245 N VAL A 83 12.639 14.756 23.978 1.00 35.22 N ATOM 1246 CA VAL A 83 12.550 14.797 25.430 1.00 37.99 C ATOM 1247 C VAL A 83 11.333 15.536 25.972 1.00 46.84 C ATOM 1248 O VAL A 83 11.086 16.664 25.528 1.00 26.46 O ATOM 1249 CB VAL A 83 13.843 15.473 25.950 1.00 32.77 C ATOM 1250 CG1 VAL A 83 13.667 15.998 27.359 1.00 22.61 C ATOM 1251 CG2 VAL A 83 14.995 14.482 25.871 1.00 40.54 C ATOM 1252 HA VAL A 83 12.439 13.771 25.782 1.00 0.00 H ATOM 1253 HB VAL A 83 14.068 16.333 25.320 1.00 0.00 H ATOM 1254 HG11 VAL A 83 12.863 16.734 27.373 1.00 0.00 H ATOM 1255 HG12 VAL A 83 13.417 15.172 28.025 1.00 0.00 H ATOM 1256 HG13 VAL A 83 14.595 16.465 27.690 1.00 0.00 H ATOM 1257 HG21 VAL A 83 14.766 13.611 26.485 1.00 0.00 H ATOM 1258 HG22 VAL A 83 15.136 14.172 24.836 1.00 0.00 H ATOM 1259 HG23 VAL A 83 15.906 14.956 26.237 1.00 0.00 H ATOM 1260 H VAL A 83 12.962 15.606 23.474 1.00 0.00 H ATOM 1261 N ARG A 84 10.617 14.914 26.913 1.00 50.49 N ATOM 1262 CA ARG A 84 9.533 15.585 27.648 1.00 57.88 C ATOM 1263 C ARG A 84 10.109 16.682 28.499 1.00 63.71 C ATOM 1264 O ARG A 84 10.834 16.417 29.470 1.00 87.31 O ATOM 1265 CB ARG A 84 8.696 14.625 28.493 1.00 60.99 C ATOM 1266 CG ARG A 84 7.174 14.747 28.324 1.00 64.59 C ATOM 1267 CD ARG A 84 6.667 16.175 28.497 1.00 68.73 C ATOM 1268 NE ARG A 84 5.200 16.167 28.523 1.00 71.30 N ATOM 1269 CZ ARG A 84 4.391 17.008 27.839 1.00 70.60 C ATOM 1270 NH1 ARG A 84 4.961 17.985 27.146 1.00 69.28 N ATOM 1271 NH2 ARG A 84 3.049 16.892 27.891 1.00 67.73 N ATOM 1272 HA ARG A 84 8.851 16.007 26.910 1.00 0.00 H ATOM 1273 HB2 ARG A 84 8.983 13.607 28.228 1.00 0.00 H ATOM 1274 HB3 ARG A 84 8.933 14.807 29.541 1.00 0.00 H ATOM 1275 HG2 ARG A 84 6.906 14.402 27.325 1.00 0.00 H ATOM 1276 HG3 ARG A 84 6.690 14.114 29.068 1.00 0.00 H ATOM 1277 HD2 ARG A 84 7.014 16.788 27.665 1.00 0.00 H ATOM 1278 HD3 ARG A 84 7.046 16.586 29.433 1.00 0.00 H ATOM 1279 HE ARG A 84 4.741 15.450 29.121 1.00 0.00 H ATOM 1280 HH12 ARG A 84 4.373 18.652 26.607 1.00 0.00 H ATOM 1281 HH11 ARG A 84 5.996 18.084 27.142 1.00 0.00 H ATOM 1282 HH22 ARG A 84 2.449 17.551 27.356 1.00 0.00 H ATOM 1283 HH21 ARG A 84 2.614 16.143 28.466 1.00 0.00 H ATOM 1284 H ARG A 84 10.833 13.921 27.134 1.00 0.00 H ATOM 1285 N LYS A 85 9.753 17.856 28.088 1.00 59.85 N ATOM 1286 CA LYS A 85 10.182 19.077 28.726 1.00 62.60 C ATOM 1287 C LYS A 85 8.995 19.722 29.417 1.00 65.36 C ATOM 1288 O LYS A 85 7.858 19.645 28.929 1.00 81.26 O ATOM 1289 CB LYS A 85 10.786 20.046 27.707 1.00 57.25 C ATOM 1290 CG LYS A 85 12.278 19.861 27.473 1.00 51.35 C ATOM 1291 CD LYS A 85 12.622 19.936 25.992 1.00 48.71 C ATOM 1292 CE LYS A 85 12.560 21.359 25.472 1.00 47.05 C ATOM 1293 NZ LYS A 85 11.668 21.383 24.247 1.00 44.01 N ATOM 1294 HA LYS A 85 10.952 18.839 29.460 1.00 0.00 H ATOM 1295 HB2 LYS A 85 10.271 19.906 26.756 1.00 0.00 H ATOM 1296 HB3 LYS A 85 10.620 21.063 28.063 1.00 0.00 H ATOM 1297 HG2 LYS A 85 12.820 20.644 28.003 1.00 0.00 H ATOM 1298 HG3 LYS A 85 12.580 18.887 27.858 1.00 0.00 H ATOM 1299 HD2 LYS A 85 13.630 19.549 25.843 1.00 0.00 H ATOM 1300 HD3 LYS A 85 11.914 19.324 25.433 1.00 0.00 H ATOM 1301 HE2 LYS A 85 13.561 21.698 25.205 1.00 0.00 H ATOM 1302 HE3 LYS A 85 12.149 22.014 26.240 1.00 0.00 H ATOM 1303 HZ1 LYS A 85 12.064 20.755 23.519 1.00 0.00 H ATOM 1304 HZ2 LYS A 85 10.715 21.057 24.507 1.00 0.00 H ATOM 1305 HZ3 LYS A 85 11.615 22.354 23.877 1.00 0.00 H ATOM 1306 H LYS A 85 9.128 17.923 27.259 1.00 0.00 H ATOM 1307 N ALA A 86 9.292 20.342 30.539 1.00 57.58 N ATOM 1308 CA ALA A 86 8.284 21.056 31.329 1.00 57.32 C ATOM 1309 C ALA A 86 7.654 22.141 30.460 1.00 53.98 C ATOM 1310 O ALA A 86 6.629 21.907 29.811 1.00 47.66 O ATOM 1311 CB ALA A 86 8.900 21.624 32.590 1.00 66.62 C ATOM 1312 HA ALA A 86 7.501 20.367 31.645 1.00 0.00 H ATOM 1313 HB1 ALA A 86 9.310 20.812 33.190 1.00 0.00 H ATOM 1314 HB2 ALA A 86 9.697 22.318 32.323 1.00 0.00 H ATOM 1315 HB3 ALA A 86 8.135 22.150 33.162 1.00 0.00 H ATOM 1316 H ALA A 86 10.275 20.325 30.877 1.00 0.00 H ATOM 1317 N GLU A 87 8.277 23.320 30.474 1.00 46.89 N ATOM 1318 CA GLU A 87 7.834 24.484 29.726 1.00 37.10 C ATOM 1319 C GLU A 87 7.728 24.167 28.234 1.00 25.26 C ATOM 1320 O GLU A 87 8.585 23.492 27.663 1.00 30.28 O ATOM 1321 CB GLU A 87 8.770 25.690 29.890 1.00 47.10 C ATOM 1322 CG GLU A 87 9.427 26.117 28.585 1.00 60.34 C ATOM 1323 CD GLU A 87 9.657 27.599 28.396 1.00 66.40 C ATOM 1324 OE1 GLU A 87 9.284 28.410 29.271 1.00 69.77 O ATOM 1325 OE2 GLU A 87 10.228 27.991 27.347 1.00 61.41 O ATOM 1326 HA GLU A 87 6.857 24.742 30.135 1.00 0.00 H ATOM 1327 HB2 GLU A 87 8.192 26.528 30.278 1.00 0.00 H ATOM 1328 HB3 GLU A 87 9.552 25.428 30.603 1.00 0.00 H ATOM 1329 HG2 GLU A 87 10.396 25.621 28.525 1.00 0.00 H ATOM 1330 HG3 GLU A 87 8.793 25.774 27.767 1.00 0.00 H ATOM 1331 H GLU A 87 9.133 23.412 31.057 1.00 0.00 H ATOM 1332 N ARG A 88 6.662 24.669 27.620 1.00 16.00 N ATOM 1333 CA ARG A 88 6.466 24.487 26.193 1.00 15.46 C ATOM 1334 C ARG A 88 7.411 25.412 25.393 1.00 8.39 C ATOM 1335 O ARG A 88 8.077 26.260 26.010 1.00 9.25 O ATOM 1336 CB ARG A 88 5.038 24.807 25.759 1.00 20.53 C ATOM 1337 CG ARG A 88 3.955 23.789 26.063 1.00 16.09 C ATOM 1338 CD ARG A 88 2.642 24.485 26.387 1.00 13.71 C ATOM 1339 NE ARG A 88 1.551 23.547 26.623 1.00 29.58 N ATOM 1340 CZ ARG A 88 0.863 23.468 27.756 1.00 37.47 C ATOM 1341 NH1 ARG A 88 1.136 24.266 28.781 1.00 42.93 N ATOM 1342 NH2 ARG A 88 -0.117 22.581 27.875 1.00 56.76 N ATOM 1343 HA ARG A 88 6.679 23.437 25.990 1.00 0.00 H ATOM 1344 HB2 ARG A 88 4.752 25.739 26.246 1.00 0.00 H ATOM 1345 HB3 ARG A 88 5.052 24.952 24.679 1.00 0.00 H ATOM 1346 HG2 ARG A 88 3.815 23.145 25.195 1.00 0.00 H ATOM 1347 HG3 ARG A 88 4.261 23.184 26.917 1.00 0.00 H ATOM 1348 HD2 ARG A 88 2.373 25.130 25.550 1.00 0.00 H ATOM 1349 HD3 ARG A 88 2.780 25.092 27.282 1.00 0.00 H ATOM 1350 HE ARG A 88 1.295 22.897 25.853 1.00 0.00 H ATOM 1351 HH12 ARG A 88 0.586 24.189 29.660 1.00 0.00 H ATOM 1352 HH11 ARG A 88 1.900 24.968 28.705 1.00 0.00 H ATOM 1353 HH22 ARG A 88 -0.657 22.518 28.762 1.00 0.00 H ATOM 1354 HH21 ARG A 88 -0.345 21.949 27.081 1.00 0.00 H ATOM 1355 H ARG A 88 5.957 25.200 28.170 1.00 0.00 H ATOM 1356 N TRP A 89 7.430 25.084 24.115 1.00 11.44 N ATOM 1357 CA TRP A 89 8.114 25.788 23.012 1.00 20.57 C ATOM 1358 C TRP A 89 9.651 25.848 23.128 1.00 21.90 C ATOM 1359 O TRP A 89 10.238 26.575 22.322 1.00 8.49 O ATOM 1360 CB TRP A 89 7.532 27.195 22.835 1.00 14.85 C ATOM 1361 CG TRP A 89 6.053 27.150 22.575 1.00 17.12 C ATOM 1362 CD1 TRP A 89 5.305 26.048 22.271 1.00 18.55 C ATOM 1363 CD2 TRP A 89 5.141 28.256 22.602 1.00 15.16 C ATOM 1364 NE1 TRP A 89 3.986 26.386 22.104 1.00 18.08 N ATOM 1365 CE2 TRP A 89 3.861 27.745 22.302 1.00 19.69 C ATOM 1366 CE3 TRP A 89 5.283 29.627 22.851 1.00 13.83 C ATOM 1367 CZ2 TRP A 89 2.732 28.565 22.243 1.00 14.07 C ATOM 1368 CZ3 TRP A 89 4.163 30.437 22.790 1.00 13.63 C ATOM 1369 CH2 TRP A 89 2.902 29.905 22.488 1.00 15.53 C ATOM 1370 HA TRP A 89 7.921 25.185 22.124 1.00 0.00 H ATOM 1371 HB2 TRP A 89 7.715 27.771 23.742 1.00 0.00 H ATOM 1372 HB3 TRP A 89 8.026 27.679 21.992 1.00 0.00 H ATOM 1373 HE1 TRP A 89 3.214 25.730 21.869 1.00 0.00 H ATOM 1374 HD1 TRP A 89 5.702 25.038 22.174 1.00 0.00 H ATOM 1375 HZ2 TRP A 89 1.749 28.155 22.010 1.00 0.00 H ATOM 1376 HH2 TRP A 89 2.039 30.569 22.447 1.00 0.00 H ATOM 1377 HZ3 TRP A 89 4.263 31.506 22.980 1.00 0.00 H ATOM 1378 HE3 TRP A 89 6.260 30.049 23.089 1.00 0.00 H ATOM 1379 H TRP A 89 6.900 24.228 23.854 1.00 0.00 H ATOM 1380 N GLY A 90 10.268 25.114 24.045 1.00 13.30 N ATOM 1381 CA GLY A 90 11.723 24.963 24.053 1.00 19.26 C ATOM 1382 C GLY A 90 12.126 24.026 22.923 1.00 19.81 C ATOM 1383 O GLY A 90 11.227 23.453 22.296 1.00 31.55 O ATOM 1384 HA3 GLY A 90 12.043 24.545 25.007 1.00 0.00 H ATOM 1385 HA2 GLY A 90 12.193 25.936 23.908 1.00 0.00 H ATOM 1386 H GLY A 90 9.704 24.635 24.775 1.00 0.00 H ATOM 1387 N PRO A 91 13.395 23.813 22.617 1.00 12.12 N ATOM 1388 CA PRO A 91 13.767 23.074 21.398 1.00 8.36 C ATOM 1389 C PRO A 91 13.666 21.564 21.556 1.00 5.75 C ATOM 1390 O PRO A 91 13.580 21.057 22.672 1.00 10.70 O ATOM 1391 CB PRO A 91 15.243 23.474 21.212 1.00 15.02 C ATOM 1392 CG PRO A 91 15.726 23.605 22.623 1.00 5.31 C ATOM 1393 CD PRO A 91 14.584 24.228 23.384 1.00 7.89 C ATOM 1394 HA PRO A 91 13.108 23.312 20.563 1.00 0.00 H ATOM 1395 HD3 PRO A 91 14.542 23.848 24.405 1.00 0.00 H ATOM 1396 HD2 PRO A 91 14.675 25.314 23.405 1.00 0.00 H ATOM 1397 HG3 PRO A 91 16.607 24.245 22.666 1.00 0.00 H ATOM 1398 HG2 PRO A 91 15.969 22.626 23.035 1.00 0.00 H ATOM 1399 HB2 PRO A 91 15.796 22.702 20.677 1.00 0.00 H ATOM 1400 HB3 PRO A 91 15.330 24.419 20.676 1.00 0.00 H ATOM 1401 N ARG A 92 13.673 20.806 20.457 1.00 14.77 N ATOM 1402 CA ARG A 92 13.489 19.354 20.638 1.00 13.81 C ATOM 1403 C ARG A 92 13.896 18.596 19.395 1.00 13.50 C ATOM 1404 O ARG A 92 13.857 19.120 18.277 1.00 7.44 O ATOM 1405 CB ARG A 92 12.036 19.132 21.059 1.00 7.60 C ATOM 1406 CG ARG A 92 11.015 19.052 19.956 1.00 8.82 C ATOM 1407 CD ARG A 92 10.526 20.402 19.479 1.00 17.25 C ATOM 1408 NE ARG A 92 10.028 21.268 20.531 1.00 22.81 N ATOM 1409 CZ ARG A 92 8.839 21.318 21.105 1.00 26.57 C ATOM 1410 NH1 ARG A 92 7.864 20.488 20.748 1.00 17.70 N ATOM 1411 NH2 ARG A 92 8.615 22.219 22.063 1.00 9.61 N ATOM 1412 HA ARG A 92 14.138 18.960 21.420 1.00 0.00 H ATOM 1413 HB2 ARG A 92 11.993 18.197 21.617 1.00 0.00 H ATOM 1414 HB3 ARG A 92 11.752 19.957 21.713 1.00 0.00 H ATOM 1415 HG2 ARG A 92 11.462 18.529 19.110 1.00 0.00 H ATOM 1416 HG3 ARG A 92 10.158 18.485 20.320 1.00 0.00 H ATOM 1417 HD2 ARG A 92 9.721 20.239 18.762 1.00 0.00 H ATOM 1418 HD3 ARG A 92 11.354 20.909 18.984 1.00 0.00 H ATOM 1419 HE ARG A 92 10.717 21.960 20.891 1.00 0.00 H ATOM 1420 HH12 ARG A 92 6.936 20.545 21.214 1.00 0.00 H ATOM 1421 HH11 ARG A 92 8.029 19.781 20.003 1.00 0.00 H ATOM 1422 HH22 ARG A 92 7.683 22.269 22.523 1.00 0.00 H ATOM 1423 HH21 ARG A 92 9.372 22.872 22.350 1.00 0.00 H ATOM 1424 H ARG A 92 13.803 21.222 19.513 1.00 0.00 H ATOM 1425 N THR A 93 14.329 17.330 19.493 1.00 6.83 N ATOM 1426 CA THR A 93 14.821 16.699 18.264 1.00 5.66 C ATOM 1427 C THR A 93 13.715 16.444 17.259 1.00 5.53 C ATOM 1428 O THR A 93 13.925 16.472 16.040 1.00 5.77 O ATOM 1429 CB THR A 93 15.525 15.353 18.547 1.00 10.22 C ATOM 1430 OG1 THR A 93 14.646 14.495 19.282 1.00 10.33 O ATOM 1431 CG2 THR A 93 16.759 15.565 19.408 1.00 15.65 C ATOM 1432 HA THR A 93 15.533 17.410 17.845 1.00 0.00 H ATOM 1433 HB THR A 93 15.800 14.913 17.588 1.00 0.00 H ATOM 1434 HG1 THR A 93 15.101 13.634 19.461 1.00 0.00 H ATOM 1435 HG23 THR A 93 17.459 16.216 18.884 1.00 0.00 H ATOM 1436 HG21 THR A 93 16.467 16.027 20.351 1.00 0.00 H ATOM 1437 HG22 THR A 93 17.233 14.603 19.604 1.00 0.00 H ATOM 1438 H THR A 93 14.316 16.819 20.399 1.00 0.00 H ATOM 1439 N LEU A 94 12.515 16.166 17.780 1.00 9.47 N ATOM 1440 CA LEU A 94 11.442 15.768 16.882 1.00 13.85 C ATOM 1441 C LEU A 94 10.053 16.020 17.453 1.00 7.61 C ATOM 1442 O LEU A 94 9.798 15.829 18.631 1.00 18.79 O ATOM 1443 CB LEU A 94 11.520 14.268 16.533 1.00 9.03 C ATOM 1444 CG LEU A 94 10.515 13.830 15.458 1.00 7.57 C ATOM 1445 CD1 LEU A 94 10.699 14.636 14.181 1.00 12.17 C ATOM 1446 CD2 LEU A 94 10.632 12.348 15.130 1.00 6.78 C ATOM 1447 HA LEU A 94 11.585 16.386 15.995 1.00 0.00 H ATOM 1448 HB2 LEU A 94 12.526 14.050 16.173 1.00 0.00 H ATOM 1449 HB3 LEU A 94 11.327 13.693 17.439 1.00 0.00 H ATOM 1450 HG LEU A 94 9.523 14.014 15.871 1.00 0.00 H ATOM 1451 HD21 LEU A 94 11.636 12.137 14.762 1.00 0.00 H ATOM 1452 HD22 LEU A 94 10.443 11.762 16.029 1.00 0.00 H ATOM 1453 HD23 LEU A 94 9.901 12.088 14.365 1.00 0.00 H ATOM 1454 HD11 LEU A 94 10.545 15.694 14.395 1.00 0.00 H ATOM 1455 HD12 LEU A 94 11.709 14.485 13.800 1.00 0.00 H ATOM 1456 HD13 LEU A 94 9.975 14.305 13.437 1.00 0.00 H ATOM 1457 H LEU A 94 12.352 16.233 18.805 1.00 0.00 H ATOM 1458 N ASP A 95 9.183 16.425 16.545 1.00 11.06 N ATOM 1459 CA ASP A 95 7.776 16.642 16.800 1.00 8.54 C ATOM 1460 C ASP A 95 6.995 15.987 15.671 1.00 6.30 C ATOM 1461 O ASP A 95 7.185 16.330 14.506 1.00 6.11 O ATOM 1462 CB ASP A 95 7.424 18.119 16.860 1.00 12.12 C ATOM 1463 CG ASP A 95 7.554 18.743 18.231 1.00 26.47 C ATOM 1464 OD1 ASP A 95 7.702 18.010 19.229 1.00 34.38 O ATOM 1465 OD2 ASP A 95 7.501 19.993 18.306 1.00 39.41 O ATOM 1466 HA ASP A 95 7.525 16.211 17.769 1.00 0.00 H ATOM 1467 HB2 ASP A 95 8.085 18.654 16.179 1.00 0.00 H ATOM 1468 HB3 ASP A 95 6.392 18.236 16.529 1.00 0.00 H ATOM 1469 H ASP A 95 9.534 16.600 15.582 1.00 0.00 H ATOM 1470 N LEU A 96 6.134 15.042 16.026 1.00 5.01 N ATOM 1471 CA LEU A 96 5.178 14.602 15.008 1.00 5.90 C ATOM 1472 C LEU A 96 3.805 14.939 15.580 1.00 4.84 C ATOM 1473 O LEU A 96 3.421 14.376 16.598 1.00 16.48 O ATOM 1474 CB LEU A 96 5.347 13.130 14.645 1.00 4.64 C ATOM 1475 CG LEU A 96 6.728 12.806 14.053 1.00 5.28 C ATOM 1476 CD1 LEU A 96 6.945 11.297 14.002 1.00 21.02 C ATOM 1477 CD2 LEU A 96 6.872 13.418 12.673 1.00 6.24 C ATOM 1478 HA LEU A 96 5.334 15.109 14.056 1.00 0.00 H ATOM 1479 HB2 LEU A 96 5.207 12.533 15.546 1.00 0.00 H ATOM 1480 HB3 LEU A 96 4.585 12.864 13.913 1.00 0.00 H ATOM 1481 HG LEU A 96 7.492 13.239 14.698 1.00 0.00 H ATOM 1482 HD21 LEU A 96 6.101 13.015 12.016 1.00 0.00 H ATOM 1483 HD22 LEU A 96 6.762 14.500 12.744 1.00 0.00 H ATOM 1484 HD23 LEU A 96 7.856 13.177 12.271 1.00 0.00 H ATOM 1485 HD11 LEU A 96 6.886 10.888 15.011 1.00 0.00 H ATOM 1486 HD12 LEU A 96 6.176 10.841 13.379 1.00 0.00 H ATOM 1487 HD13 LEU A 96 7.928 11.087 13.580 1.00 0.00 H ATOM 1488 H LEU A 96 6.138 14.633 16.982 1.00 0.00 H ATOM 1489 N ASP A 97 3.138 15.879 14.923 1.00 11.78 N ATOM 1490 CA ASP A 97 1.865 16.425 15.367 1.00 7.08 C ATOM 1491 C ASP A 97 0.786 16.152 14.330 1.00 9.71 C ATOM 1492 O ASP A 97 0.935 16.440 13.144 1.00 7.09 O ATOM 1493 CB ASP A 97 1.982 17.931 15.620 1.00 5.38 C ATOM 1494 CG ASP A 97 2.589 18.268 16.964 1.00 11.16 C ATOM 1495 OD1 ASP A 97 2.217 17.657 17.991 1.00 9.87 O ATOM 1496 OD2 ASP A 97 3.467 19.162 16.980 1.00 14.81 O ATOM 1497 HA ASP A 97 1.589 15.937 16.302 1.00 0.00 H ATOM 1498 HB2 ASP A 97 2.607 18.365 14.840 1.00 0.00 H ATOM 1499 HB3 ASP A 97 0.985 18.369 15.571 1.00 0.00 H ATOM 1500 H ASP A 97 3.548 16.246 14.041 1.00 0.00 H ATOM 1501 N ILE A 98 -0.327 15.572 14.785 1.00 7.30 N ATOM 1502 CA ILE A 98 -1.421 15.393 13.832 1.00 7.75 C ATOM 1503 C ILE A 98 -2.205 16.692 13.724 1.00 6.98 C ATOM 1504 O ILE A 98 -2.930 17.068 14.654 1.00 5.60 O ATOM 1505 CB ILE A 98 -2.354 14.252 14.266 1.00 15.76 C ATOM 1506 CG1 ILE A 98 -1.670 12.878 14.283 1.00 11.71 C ATOM 1507 CG2 ILE A 98 -3.606 14.213 13.413 1.00 8.79 C ATOM 1508 CD1 ILE A 98 -2.001 12.103 15.547 1.00 23.39 C ATOM 1509 HA ILE A 98 -1.000 15.130 12.861 1.00 0.00 H ATOM 1510 HB ILE A 98 -2.634 14.472 15.296 1.00 0.00 H ATOM 1511 HG12 ILE A 98 -2.005 12.305 13.419 1.00 0.00 H ATOM 1512 HG13 ILE A 98 -0.591 13.019 14.227 1.00 0.00 H ATOM 1513 HD11 ILE A 98 -1.663 12.667 16.416 1.00 0.00 H ATOM 1514 HD12 ILE A 98 -3.079 11.952 15.607 1.00 0.00 H ATOM 1515 HD13 ILE A 98 -1.498 11.136 15.521 1.00 0.00 H ATOM 1516 HG21 ILE A 98 -4.141 15.157 13.512 1.00 0.00 H ATOM 1517 HG22 ILE A 98 -3.329 14.059 12.370 1.00 0.00 H ATOM 1518 HG23 ILE A 98 -4.245 13.395 13.745 1.00 0.00 H ATOM 1519 H ILE A 98 -0.412 15.261 15.774 1.00 0.00 H ATOM 1520 N MET A 99 -2.055 17.375 12.606 1.00 7.02 N ATOM 1521 CA MET A 99 -2.762 18.626 12.388 1.00 18.08 C ATOM 1522 C MET A 99 -4.252 18.354 12.174 1.00 21.96 C ATOM 1523 O MET A 99 -5.101 18.954 12.835 1.00 17.12 O ATOM 1524 CB MET A 99 -2.188 19.373 11.190 1.00 14.31 C ATOM 1525 CG MET A 99 -0.764 19.875 11.376 1.00 18.29 C ATOM 1526 SD MET A 99 -0.238 20.952 10.030 1.00 21.34 S ATOM 1527 CE MET A 99 0.036 19.781 8.703 1.00 13.00 C ATOM 1528 HA MET A 99 -2.636 19.251 13.272 1.00 0.00 H ATOM 1529 HB2 MET A 99 -2.202 18.701 10.332 1.00 0.00 H ATOM 1530 HB3 MET A 99 -2.827 20.232 10.987 1.00 0.00 H ATOM 1531 HG2 MET A 99 -0.093 19.017 11.422 1.00 0.00 H ATOM 1532 HG3 MET A 99 -0.707 20.430 12.312 1.00 0.00 H ATOM 1533 HE1 MET A 99 0.802 19.066 9.003 1.00 0.00 H ATOM 1534 HE2 MET A 99 -0.893 19.252 8.490 1.00 0.00 H ATOM 1535 HE3 MET A 99 0.365 20.315 7.811 1.00 0.00 H ATOM 1536 H MET A 99 -1.419 17.012 11.867 1.00 0.00 H ATOM 1537 N LEU A 100 -4.518 17.454 11.238 1.00 13.25 N ATOM 1538 CA LEU A 100 -5.851 17.051 10.826 1.00 16.59 C ATOM 1539 C LEU A 100 -5.906 15.545 10.578 1.00 19.85 C ATOM 1540 O LEU A 100 -4.907 14.959 10.169 1.00 7.27 O ATOM 1541 CB LEU A 100 -6.262 17.822 9.564 1.00 14.92 C ATOM 1542 CG LEU A 100 -6.196 19.353 9.707 1.00 12.99 C ATOM 1543 CD1 LEU A 100 -5.902 20.027 8.389 1.00 9.97 C ATOM 1544 CD2 LEU A 100 -7.494 19.848 10.322 1.00 15.44 C ATOM 1545 HA LEU A 100 -6.552 17.287 11.626 1.00 0.00 H ATOM 1546 HB2 LEU A 100 -5.598 17.526 8.752 1.00 0.00 H ATOM 1547 HB3 LEU A 100 -7.286 17.546 9.314 1.00 0.00 H ATOM 1548 HG LEU A 100 -5.369 19.615 10.368 1.00 0.00 H ATOM 1549 HD21 LEU A 100 -8.328 19.574 9.676 1.00 0.00 H ATOM 1550 HD22 LEU A 100 -7.627 19.392 11.303 1.00 0.00 H ATOM 1551 HD23 LEU A 100 -7.455 20.932 10.427 1.00 0.00 H ATOM 1552 HD11 LEU A 100 -4.942 19.676 8.009 1.00 0.00 H ATOM 1553 HD12 LEU A 100 -6.688 19.783 7.674 1.00 0.00 H ATOM 1554 HD13 LEU A 100 -5.864 21.107 8.535 1.00 0.00 H ATOM 1555 H LEU A 100 -3.711 17.002 10.763 1.00 0.00 H ATOM 1556 N PHE A 101 -7.050 14.926 10.817 1.00 15.71 N ATOM 1557 CA PHE A 101 -7.281 13.511 10.663 1.00 5.99 C ATOM 1558 C PHE A 101 -8.540 13.328 9.802 1.00 6.62 C ATOM 1559 O PHE A 101 -9.627 13.380 10.388 1.00 10.01 O ATOM 1560 CB PHE A 101 -7.350 12.768 11.973 1.00 3.50 C ATOM 1561 CG PHE A 101 -7.348 11.248 11.832 1.00 8.56 C ATOM 1562 CD1 PHE A 101 -6.156 10.546 11.805 1.00 13.82 C ATOM 1563 CD2 PHE A 101 -8.520 10.528 11.723 1.00 15.72 C ATOM 1564 CE1 PHE A 101 -6.116 9.171 11.668 1.00 20.36 C ATOM 1565 CE2 PHE A 101 -8.500 9.154 11.576 1.00 15.83 C ATOM 1566 CZ PHE A 101 -7.301 8.468 11.544 1.00 21.93 C ATOM 1567 HA PHE A 101 -6.425 13.063 10.159 1.00 0.00 H ATOM 1568 HB2 PHE A 101 -6.489 13.057 12.576 1.00 0.00 H ATOM 1569 HB3 PHE A 101 -8.266 13.063 12.485 1.00 0.00 H ATOM 1570 HD2 PHE A 101 -9.476 11.051 11.753 1.00 0.00 H ATOM 1571 HE2 PHE A 101 -9.438 8.607 11.485 1.00 0.00 H ATOM 1572 HZ PHE A 101 -7.289 7.385 11.422 1.00 0.00 H ATOM 1573 HE1 PHE A 101 -5.161 8.646 11.658 1.00 0.00 H ATOM 1574 HD1 PHE A 101 -5.218 11.095 11.895 1.00 0.00 H ATOM 1575 H PHE A 101 -7.848 15.507 11.143 1.00 0.00 H ATOM 1576 N GLY A 102 -8.398 13.175 8.486 1.00 12.53 N ATOM 1577 CA GLY A 102 -9.572 13.243 7.610 1.00 16.55 C ATOM 1578 C GLY A 102 -10.283 14.559 7.944 1.00 23.05 C ATOM 1579 O GLY A 102 -9.602 15.516 8.320 1.00 17.83 O ATOM 1580 HA3 GLY A 102 -10.234 12.398 7.799 1.00 0.00 H ATOM 1581 HA2 GLY A 102 -9.264 13.235 6.564 1.00 0.00 H ATOM 1582 H GLY A 102 -7.455 13.007 8.080 1.00 0.00 H ATOM 1583 N ASN A 103 -11.598 14.569 7.857 1.00 22.69 N ATOM 1584 CA ASN A 103 -12.431 15.675 8.295 1.00 13.62 C ATOM 1585 C ASN A 103 -12.859 15.557 9.745 1.00 8.87 C ATOM 1586 O ASN A 103 -13.894 16.108 10.136 1.00 21.75 O ATOM 1587 CB ASN A 103 -13.706 15.753 7.448 1.00 11.40 C ATOM 1588 CG ASN A 103 -14.394 17.097 7.566 1.00 19.29 C ATOM 1589 OD1 ASN A 103 -13.743 18.143 7.585 1.00 11.77 O ATOM 1590 ND2 ASN A 103 -15.718 17.072 7.644 1.00 37.12 N ATOM 1591 HA ASN A 103 -11.818 16.569 8.179 1.00 0.00 H ATOM 1592 HB2 ASN A 103 -13.444 15.584 6.404 1.00 0.00 H ATOM 1593 HB3 ASN A 103 -14.395 14.976 7.779 1.00 0.00 H ATOM 1594 HD22 ASN A 103 -16.223 16.163 7.624 1.00 0.00 H ATOM 1595 HD21 ASN A 103 -16.251 17.961 7.725 1.00 0.00 H ATOM 1596 H ASN A 103 -12.067 13.735 7.450 1.00 0.00 H ATOM 1597 N GLU A 104 -12.119 14.842 10.586 1.00 3.91 N ATOM 1598 CA GLU A 104 -12.668 14.633 11.927 1.00 3.94 C ATOM 1599 C GLU A 104 -12.326 15.757 12.895 1.00 5.45 C ATOM 1600 O GLU A 104 -11.418 16.540 12.671 1.00 13.12 O ATOM 1601 CB GLU A 104 -12.172 13.302 12.514 1.00 7.73 C ATOM 1602 CG GLU A 104 -12.128 12.189 11.486 1.00 23.47 C ATOM 1603 CD GLU A 104 -12.241 10.781 12.023 1.00 24.80 C ATOM 1604 OE1 GLU A 104 -12.204 10.561 13.251 1.00 13.99 O ATOM 1605 OE2 GLU A 104 -12.365 9.875 11.162 1.00 29.09 O ATOM 1606 HA GLU A 104 -13.751 14.615 11.807 1.00 0.00 H ATOM 1607 HB2 GLU A 104 -11.168 13.449 12.912 1.00 0.00 H ATOM 1608 HB3 GLU A 104 -12.842 13.005 13.321 1.00 0.00 H ATOM 1609 HG2 GLU A 104 -12.951 12.347 10.789 1.00 0.00 H ATOM 1610 HG3 GLU A 104 -11.181 12.267 10.952 1.00 0.00 H ATOM 1611 H GLU A 104 -11.197 14.451 10.306 1.00 0.00 H ATOM 1612 N VAL A 105 -13.075 15.786 13.985 1.00 7.64 N ATOM 1613 CA VAL A 105 -12.850 16.683 15.106 1.00 14.50 C ATOM 1614 C VAL A 105 -12.741 15.860 16.389 1.00 16.07 C ATOM 1615 O VAL A 105 -13.736 15.347 16.899 1.00 21.07 O ATOM 1616 CB VAL A 105 -13.963 17.735 15.265 1.00 18.64 C ATOM 1617 CG1 VAL A 105 -13.808 18.448 16.604 1.00 17.32 C ATOM 1618 CG2 VAL A 105 -13.965 18.743 14.125 1.00 7.52 C ATOM 1619 HA VAL A 105 -11.925 17.225 14.909 1.00 0.00 H ATOM 1620 HB VAL A 105 -14.921 17.215 15.235 1.00 0.00 H ATOM 1621 HG11 VAL A 105 -13.880 17.720 17.412 1.00 0.00 H ATOM 1622 HG12 VAL A 105 -12.836 18.940 16.642 1.00 0.00 H ATOM 1623 HG13 VAL A 105 -14.598 19.191 16.712 1.00 0.00 H ATOM 1624 HG21 VAL A 105 -13.007 19.263 14.099 1.00 0.00 H ATOM 1625 HG22 VAL A 105 -14.122 18.221 13.181 1.00 0.00 H ATOM 1626 HG23 VAL A 105 -14.767 19.464 14.281 1.00 0.00 H ATOM 1627 H VAL A 105 -13.876 15.125 14.043 1.00 0.00 H ATOM 1628 N ILE A 106 -11.514 15.733 16.896 1.00 3.88 N ATOM 1629 CA ILE A 106 -11.262 14.912 18.079 1.00 15.37 C ATOM 1630 C ILE A 106 -10.842 15.743 19.278 1.00 19.26 C ATOM 1631 O ILE A 106 -9.903 16.540 19.191 1.00 19.24 O ATOM 1632 CB ILE A 106 -10.186 13.865 17.715 1.00 8.75 C ATOM 1633 CG1 ILE A 106 -10.525 13.164 16.401 1.00 12.35 C ATOM 1634 CG2 ILE A 106 -9.965 12.887 18.854 1.00 3.84 C ATOM 1635 CD1 ILE A 106 -9.365 12.882 15.483 1.00 6.09 C ATOM 1636 HA ILE A 106 -12.186 14.414 18.373 1.00 0.00 H ATOM 1637 HB ILE A 106 -9.241 14.386 17.561 1.00 0.00 H ATOM 1638 HG12 ILE A 106 -10.998 12.212 16.643 1.00 0.00 H ATOM 1639 HG13 ILE A 106 -11.233 13.793 15.861 1.00 0.00 H ATOM 1640 HD11 ILE A 106 -8.883 13.821 15.210 1.00 0.00 H ATOM 1641 HD12 ILE A 106 -8.648 12.239 15.993 1.00 0.00 H ATOM 1642 HD13 ILE A 106 -9.728 12.383 14.584 1.00 0.00 H ATOM 1643 HG21 ILE A 106 -9.636 13.431 19.740 1.00 0.00 H ATOM 1644 HG22 ILE A 106 -10.898 12.367 19.071 1.00 0.00 H ATOM 1645 HG23 ILE A 106 -9.202 12.163 18.567 1.00 0.00 H ATOM 1646 H ILE A 106 -10.721 16.228 16.441 1.00 0.00 H ATOM 1647 N ASN A 107 -11.530 15.560 20.407 1.00 14.29 N ATOM 1648 CA ASN A 107 -11.177 16.282 21.624 1.00 16.87 C ATOM 1649 C ASN A 107 -11.032 15.365 22.836 1.00 28.84 C ATOM 1650 O ASN A 107 -11.694 15.594 23.854 1.00 48.38 O ATOM 1651 CB ASN A 107 -12.216 17.355 21.953 1.00 26.17 C ATOM 1652 CG ASN A 107 -12.391 18.438 20.915 1.00 31.85 C ATOM 1653 OD1 ASN A 107 -11.560 19.330 20.734 1.00 23.90 O ATOM 1654 ND2 ASN A 107 -13.519 18.386 20.205 1.00 43.05 N ATOM 1655 HA ASN A 107 -10.211 16.743 21.420 1.00 0.00 H ATOM 1656 HB2 ASN A 107 -13.178 16.860 22.086 1.00 0.00 H ATOM 1657 HB3 ASN A 107 -11.921 17.831 22.888 1.00 0.00 H ATOM 1658 HD22 ASN A 107 -14.206 17.624 20.375 1.00 0.00 H ATOM 1659 HD21 ASN A 107 -13.712 19.108 19.481 1.00 0.00 H ATOM 1660 H ASN A 107 -12.328 14.894 20.419 1.00 0.00 H ATOM 1661 N THR A 108 -10.185 14.347 22.766 1.00 23.83 N ATOM 1662 CA THR A 108 -9.980 13.411 23.821 1.00 18.21 C ATOM 1663 C THR A 108 -8.878 13.870 24.821 1.00 9.43 C ATOM 1664 O THR A 108 -8.253 14.906 24.608 1.00 12.99 O ATOM 1665 CB THR A 108 -9.668 11.999 23.388 1.00 23.66 C ATOM 1666 OG1 THR A 108 -8.413 11.996 22.689 1.00 25.84 O ATOM 1667 CG2 THR A 108 -10.715 11.519 22.396 1.00 7.75 C ATOM 1668 HA THR A 108 -10.955 13.391 24.308 1.00 0.00 H ATOM 1669 HB THR A 108 -9.645 11.360 24.270 1.00 0.00 H ATOM 1670 HG1 THR A 108 -8.199 11.073 22.401 1.00 0.00 H ATOM 1671 HG23 THR A 108 -11.692 11.503 22.880 1.00 0.00 H ATOM 1672 HG21 THR A 108 -10.742 12.196 21.542 1.00 0.00 H ATOM 1673 HG22 THR A 108 -10.459 10.515 22.057 1.00 0.00 H ATOM 1674 H THR A 108 -9.638 14.224 21.890 1.00 0.00 H ATOM 1675 N GLU A 109 -8.663 13.054 25.840 1.00 14.00 N ATOM 1676 CA GLU A 109 -7.637 13.181 26.857 1.00 30.28 C ATOM 1677 C GLU A 109 -6.234 13.362 26.270 1.00 25.08 C ATOM 1678 O GLU A 109 -5.460 14.168 26.792 1.00 20.35 O ATOM 1679 CB GLU A 109 -7.640 11.942 27.764 1.00 46.83 C ATOM 1680 CG GLU A 109 -8.489 12.087 29.019 1.00 65.06 C ATOM 1681 CD GLU A 109 -7.862 13.036 30.028 1.00 79.22 C ATOM 1682 OE1 GLU A 109 -6.795 13.613 29.717 1.00 90.84 O ATOM 1683 OE2 GLU A 109 -8.443 13.197 31.125 1.00102.45 O ATOM 1684 HA GLU A 109 -7.876 14.078 27.428 1.00 0.00 H ATOM 1685 HB2 GLU A 109 -8.022 11.098 27.189 1.00 0.00 H ATOM 1686 HB3 GLU A 109 -6.613 11.738 28.068 1.00 0.00 H ATOM 1687 HG2 GLU A 109 -9.470 12.471 28.738 1.00 0.00 H ATOM 1688 HG3 GLU A 109 -8.603 11.107 29.482 1.00 0.00 H ATOM 1689 H GLU A 109 -9.298 12.234 25.920 1.00 0.00 H ATOM 1690 N ARG A 110 -5.948 12.614 25.219 1.00 18.60 N ATOM 1691 CA ARG A 110 -4.693 12.543 24.498 1.00 16.62 C ATOM 1692 C ARG A 110 -4.699 13.337 23.199 1.00 13.78 C ATOM 1693 O ARG A 110 -3.676 13.907 22.795 1.00 9.06 O ATOM 1694 CB ARG A 110 -4.362 11.077 24.171 1.00 12.82 C ATOM 1695 CG ARG A 110 -4.114 10.211 25.391 1.00 11.64 C ATOM 1696 CD ARG A 110 -3.778 8.783 24.994 1.00 17.60 C ATOM 1697 NE ARG A 110 -2.460 8.684 24.376 1.00 23.40 N ATOM 1698 CZ ARG A 110 -2.027 7.627 23.700 1.00 22.06 C ATOM 1699 NH1 ARG A 110 -2.804 6.567 23.543 1.00 4.02 N ATOM 1700 NH2 ARG A 110 -0.807 7.639 23.177 1.00 5.53 N ATOM 1701 HA ARG A 110 -3.940 12.983 25.152 1.00 0.00 H ATOM 1702 HB2 ARG A 110 -5.198 10.653 23.614 1.00 0.00 H ATOM 1703 HB3 ARG A 110 -3.466 11.058 23.550 1.00 0.00 H ATOM 1704 HG2 ARG A 110 -3.282 10.627 25.959 1.00 0.00 H ATOM 1705 HG3 ARG A 110 -5.010 10.206 26.012 1.00 0.00 H ATOM 1706 HD2 ARG A 110 -4.527 8.429 24.286 1.00 0.00 H ATOM 1707 HD3 ARG A 110 -3.797 8.156 25.885 1.00 0.00 H ATOM 1708 HE ARG A 110 -1.817 9.496 24.472 1.00 0.00 H ATOM 1709 HH12 ARG A 110 -2.458 5.743 23.012 1.00 0.00 H ATOM 1710 HH11 ARG A 110 -3.761 6.559 23.951 1.00 0.00 H ATOM 1711 HH22 ARG A 110 -0.461 6.815 22.646 1.00 0.00 H ATOM 1712 HH21 ARG A 110 -0.197 8.473 23.298 1.00 0.00 H ATOM 1713 H ARG A 110 -6.714 12.004 24.868 1.00 0.00 H ATOM 1714 N LEU A 111 -5.849 13.392 22.521 1.00 4.11 N ATOM 1715 CA LEU A 111 -5.877 14.014 21.207 1.00 3.81 C ATOM 1716 C LEU A 111 -6.806 15.203 21.033 1.00 15.77 C ATOM 1717 O LEU A 111 -7.998 15.158 21.329 1.00 19.11 O ATOM 1718 CB LEU A 111 -6.277 12.920 20.186 1.00 5.32 C ATOM 1719 CG LEU A 111 -5.589 13.027 18.829 1.00 10.99 C ATOM 1720 CD1 LEU A 111 -4.161 13.532 19.001 1.00 8.50 C ATOM 1721 CD2 LEU A 111 -5.613 11.697 18.087 1.00 3.96 C ATOM 1722 HA LEU A 111 -4.879 14.426 21.055 1.00 0.00 H ATOM 1723 HB2 LEU A 111 -6.031 11.949 20.615 1.00 0.00 H ATOM 1724 HB3 LEU A 111 -7.353 12.983 20.026 1.00 0.00 H ATOM 1725 HG LEU A 111 -6.141 13.746 18.224 1.00 0.00 H ATOM 1726 HD21 LEU A 111 -5.095 10.943 18.679 1.00 0.00 H ATOM 1727 HD22 LEU A 111 -6.647 11.390 17.928 1.00 0.00 H ATOM 1728 HD23 LEU A 111 -5.114 11.810 17.124 1.00 0.00 H ATOM 1729 HD11 LEU A 111 -4.179 14.515 19.471 1.00 0.00 H ATOM 1730 HD12 LEU A 111 -3.605 12.837 19.630 1.00 0.00 H ATOM 1731 HD13 LEU A 111 -3.682 13.603 18.024 1.00 0.00 H ATOM 1732 H LEU A 111 -6.718 12.993 22.930 1.00 0.00 H ATOM 1733 N THR A 112 -6.264 16.301 20.499 1.00 7.48 N ATOM 1734 CA THR A 112 -7.067 17.433 20.069 1.00 3.28 C ATOM 1735 C THR A 112 -6.937 17.624 18.564 1.00 4.27 C ATOM 1736 O THR A 112 -5.869 18.003 18.071 1.00 11.65 O ATOM 1737 CB THR A 112 -6.643 18.765 20.721 1.00 7.49 C ATOM 1738 OG1 THR A 112 -6.961 18.736 22.112 1.00 14.46 O ATOM 1739 CG2 THR A 112 -7.417 19.915 20.105 1.00 3.84 C ATOM 1740 HA THR A 112 -8.088 17.198 20.371 1.00 0.00 H ATOM 1741 HB THR A 112 -5.572 18.899 20.566 1.00 0.00 H ATOM 1742 HG1 THR A 112 -7.936 18.609 22.224 1.00 0.00 H ATOM 1743 HG23 THR A 112 -7.198 19.968 19.038 1.00 0.00 H ATOM 1744 HG21 THR A 112 -8.485 19.752 20.251 1.00 0.00 H ATOM 1745 HG22 THR A 112 -7.122 20.848 20.585 1.00 0.00 H ATOM 1746 H THR A 112 -5.231 16.347 20.387 1.00 0.00 H ATOM 1747 N VAL A 113 -8.002 17.370 17.799 1.00 5.00 N ATOM 1748 CA VAL A 113 -7.803 17.530 16.354 1.00 4.42 C ATOM 1749 C VAL A 113 -8.991 18.287 15.775 1.00 10.94 C ATOM 1750 O VAL A 113 -10.122 17.931 16.133 1.00 12.21 O ATOM 1751 CB VAL A 113 -7.543 16.210 15.621 1.00 13.57 C ATOM 1752 CG1 VAL A 113 -7.863 16.310 14.140 1.00 11.91 C ATOM 1753 CG2 VAL A 113 -6.081 15.808 15.819 1.00 12.24 C ATOM 1754 HA VAL A 113 -6.892 18.108 16.200 1.00 0.00 H ATOM 1755 HB VAL A 113 -8.201 15.450 16.041 1.00 0.00 H ATOM 1756 HG11 VAL A 113 -8.914 16.569 14.013 1.00 0.00 H ATOM 1757 HG12 VAL A 113 -7.240 17.081 13.686 1.00 0.00 H ATOM 1758 HG13 VAL A 113 -7.664 15.351 13.661 1.00 0.00 H ATOM 1759 HG21 VAL A 113 -5.434 16.586 15.415 1.00 0.00 H ATOM 1760 HG22 VAL A 113 -5.881 15.683 16.883 1.00 0.00 H ATOM 1761 HG23 VAL A 113 -5.890 14.869 15.299 1.00 0.00 H ATOM 1762 H VAL A 113 -8.915 17.077 18.202 1.00 0.00 H ATOM 1763 N PRO A 114 -8.793 19.297 14.932 1.00 11.74 N ATOM 1764 CA PRO A 114 -7.514 19.823 14.450 1.00 14.17 C ATOM 1765 C PRO A 114 -6.637 20.462 15.530 1.00 13.08 C ATOM 1766 O PRO A 114 -7.142 20.931 16.544 1.00 17.22 O ATOM 1767 CB PRO A 114 -7.907 20.896 13.425 1.00 21.02 C ATOM 1768 CG PRO A 114 -9.298 20.500 13.024 1.00 17.85 C ATOM 1769 CD PRO A 114 -9.922 20.051 14.324 1.00 6.09 C ATOM 1770 HA PRO A 114 -6.913 19.005 14.054 1.00 0.00 H ATOM 1771 HD3 PRO A 114 -10.216 20.899 14.942 1.00 0.00 H ATOM 1772 HD2 PRO A 114 -10.787 19.410 14.153 1.00 0.00 H ATOM 1773 HG3 PRO A 114 -9.279 19.687 12.299 1.00 0.00 H ATOM 1774 HG2 PRO A 114 -9.839 21.347 12.603 1.00 0.00 H ATOM 1775 HB2 PRO A 114 -7.898 21.888 13.876 1.00 0.00 H ATOM 1776 HB3 PRO A 114 -7.234 20.882 12.567 1.00 0.00 H ATOM 1777 N HIS A 115 -5.326 20.361 15.300 1.00 9.18 N ATOM 1778 CA HIS A 115 -4.333 20.687 16.314 1.00 3.94 C ATOM 1779 C HIS A 115 -4.618 22.080 16.872 1.00 3.82 C ATOM 1780 O HIS A 115 -4.940 22.997 16.123 1.00 11.79 O ATOM 1781 CB HIS A 115 -2.917 20.576 15.751 1.00 3.86 C ATOM 1782 CG HIS A 115 -1.815 20.666 16.756 1.00 8.96 C ATOM 1783 ND1 HIS A 115 -1.587 21.770 17.544 1.00 13.84 N ATOM 1784 CD2 HIS A 115 -0.857 19.777 17.108 1.00 4.61 C ATOM 1785 CE1 HIS A 115 -0.547 21.567 18.335 1.00 5.23 C ATOM 1786 NE2 HIS A 115 -0.085 20.360 18.085 1.00 7.79 N ATOM 1787 HA HIS A 115 -4.401 19.968 17.131 1.00 0.00 H ATOM 1788 HB2 HIS A 115 -2.832 19.615 15.244 1.00 0.00 H ATOM 1789 HB3 HIS A 115 -2.779 21.380 15.028 1.00 0.00 H ATOM 1790 HD2 HIS A 115 -0.722 18.779 16.692 1.00 0.00 H ATOM 1791 HE1 HIS A 115 -0.145 22.272 19.063 1.00 0.00 H ATOM 1792 H HIS A 115 -5.003 20.039 14.365 1.00 0.00 H ATOM 1793 N TYR A 116 -4.525 22.174 18.186 1.00 4.50 N ATOM 1794 CA TYR A 116 -4.750 23.411 18.912 1.00 4.39 C ATOM 1795 C TYR A 116 -3.991 24.548 18.251 1.00 13.26 C ATOM 1796 O TYR A 116 -2.800 24.394 17.966 1.00 8.15 O ATOM 1797 CB TYR A 116 -4.308 23.213 20.358 1.00 3.50 C ATOM 1798 CG TYR A 116 -4.274 24.461 21.199 1.00 14.31 C ATOM 1799 CD1 TYR A 116 -5.455 25.114 21.534 1.00 16.91 C ATOM 1800 CD2 TYR A 116 -3.068 24.980 21.655 1.00 22.07 C ATOM 1801 CE1 TYR A 116 -5.443 26.259 22.305 1.00 21.29 C ATOM 1802 CE2 TYR A 116 -3.046 26.128 22.426 1.00 24.98 C ATOM 1803 CZ TYR A 116 -4.232 26.756 22.743 1.00 24.74 C ATOM 1804 OH TYR A 116 -4.216 27.897 23.508 1.00 26.88 O ATOM 1805 HA TYR A 116 -5.808 23.672 18.898 1.00 0.00 H ATOM 1806 HB3 TYR A 116 -3.305 22.786 20.348 1.00 0.00 H ATOM 1807 HB2 TYR A 116 -4.996 22.510 20.827 1.00 0.00 H ATOM 1808 HD2 TYR A 116 -2.133 24.479 21.403 1.00 0.00 H ATOM 1809 HE2 TYR A 116 -2.098 26.533 22.780 1.00 0.00 H ATOM 1810 HE1 TYR A 116 -6.375 26.762 22.564 1.00 0.00 H ATOM 1811 HD1 TYR A 116 -6.406 24.715 21.182 1.00 0.00 H ATOM 1812 HH TYR A 116 -3.805 27.698 24.386 1.00 0.00 H ATOM 1813 H TYR A 116 -4.279 21.321 18.727 1.00 0.00 H ATOM 1814 N ASP A 117 -4.678 25.660 18.016 1.00 9.49 N ATOM 1815 CA ASP A 117 -4.042 26.897 17.580 1.00 11.90 C ATOM 1816 C ASP A 117 -3.332 26.804 16.243 1.00 10.97 C ATOM 1817 O ASP A 117 -2.549 27.691 15.887 1.00 12.27 O ATOM 1818 CB ASP A 117 -3.029 27.341 18.653 1.00 11.99 C ATOM 1819 CG ASP A 117 -2.587 28.780 18.461 1.00 16.54 C ATOM 1820 OD1 ASP A 117 -3.459 29.601 18.110 1.00 15.02 O ATOM 1821 OD2 ASP A 117 -1.397 29.095 18.642 1.00 12.92 O ATOM 1822 HA ASP A 117 -4.845 27.622 17.447 1.00 0.00 H ATOM 1823 HB2 ASP A 117 -3.492 27.243 19.635 1.00 0.00 H ATOM 1824 HB3 ASP A 117 -2.153 26.694 18.599 1.00 0.00 H ATOM 1825 H ASP A 117 -5.709 25.648 18.148 1.00 0.00 H ATOM 1826 N MET A 118 -3.550 25.751 15.457 1.00 6.91 N ATOM 1827 CA MET A 118 -2.787 25.636 14.214 1.00 11.25 C ATOM 1828 C MET A 118 -3.209 26.687 13.197 1.00 7.46 C ATOM 1829 O MET A 118 -2.427 27.009 12.297 1.00 6.32 O ATOM 1830 CB MET A 118 -2.922 24.228 13.623 1.00 11.04 C ATOM 1831 CG MET A 118 -4.351 23.819 13.314 1.00 11.36 C ATOM 1832 SD MET A 118 -4.419 22.360 12.250 1.00 9.11 S ATOM 1833 CE MET A 118 -3.593 22.957 10.781 1.00 7.10 C ATOM 1834 HA MET A 118 -1.739 25.813 14.455 1.00 0.00 H ATOM 1835 HB2 MET A 118 -2.347 24.188 12.698 1.00 0.00 H ATOM 1836 HB3 MET A 118 -2.509 23.516 14.337 1.00 0.00 H ATOM 1837 HG2 MET A 118 -4.854 24.646 12.812 1.00 0.00 H ATOM 1838 HG3 MET A 118 -4.865 23.598 14.250 1.00 0.00 H ATOM 1839 HE1 MET A 118 -4.139 23.811 10.380 1.00 0.00 H ATOM 1840 HE2 MET A 118 -2.577 23.261 11.035 1.00 0.00 H ATOM 1841 HE3 MET A 118 -3.561 22.162 10.036 1.00 0.00 H ATOM 1842 H MET A 118 -4.248 25.026 15.721 1.00 0.00 H ATOM 1843 N LYS A 119 -4.418 27.233 13.333 1.00 10.42 N ATOM 1844 CA LYS A 119 -4.885 28.273 12.414 1.00 13.68 C ATOM 1845 C LYS A 119 -4.170 29.606 12.609 1.00 8.57 C ATOM 1846 O LYS A 119 -4.420 30.561 11.866 1.00 12.26 O ATOM 1847 CB LYS A 119 -6.396 28.485 12.566 1.00 7.75 C ATOM 1848 CG LYS A 119 -7.188 27.187 12.528 1.00 9.79 C ATOM 1849 CD LYS A 119 -8.656 27.478 12.275 1.00 3.87 C ATOM 1850 CE LYS A 119 -9.293 26.445 11.363 1.00 8.71 C ATOM 1851 NZ LYS A 119 -10.777 26.584 11.364 1.00 24.77 N ATOM 1852 HA LYS A 119 -4.653 27.918 11.410 1.00 0.00 H ATOM 1853 HB2 LYS A 119 -6.583 28.978 13.520 1.00 0.00 H ATOM 1854 HB3 LYS A 119 -6.740 29.125 11.754 1.00 0.00 H ATOM 1855 HG2 LYS A 119 -6.803 26.553 11.729 1.00 0.00 H ATOM 1856 HG3 LYS A 119 -7.082 26.672 13.483 1.00 0.00 H ATOM 1857 HD2 LYS A 119 -9.184 27.479 13.229 1.00 0.00 H ATOM 1858 HD3 LYS A 119 -8.745 28.460 11.811 1.00 0.00 H ATOM 1859 HE2 LYS A 119 -9.027 25.447 11.711 1.00 0.00 H ATOM 1860 HE3 LYS A 119 -8.921 26.585 10.348 1.00 0.00 H ATOM 1861 HZ1 LYS A 119 -11.136 26.447 12.330 1.00 0.00 H ATOM 1862 HZ2 LYS A 119 -11.035 27.534 11.028 1.00 0.00 H ATOM 1863 HZ3 LYS A 119 -11.191 25.868 10.734 1.00 0.00 H ATOM 1864 H LYS A 119 -5.039 26.915 14.104 1.00 0.00 H ATOM 1865 N ASN A 120 -3.283 29.703 13.596 1.00 3.90 N ATOM 1866 CA ASN A 120 -2.504 30.928 13.751 1.00 7.49 C ATOM 1867 C ASN A 120 -1.019 30.651 13.517 1.00 14.70 C ATOM 1868 O ASN A 120 -0.194 31.472 13.922 1.00 24.65 O ATOM 1869 CB ASN A 120 -2.705 31.535 15.135 1.00 3.02 C ATOM 1870 CG ASN A 120 -4.135 31.921 15.443 1.00 14.68 C ATOM 1871 OD1 ASN A 120 -4.833 32.486 14.601 1.00 15.20 O ATOM 1872 ND2 ASN A 120 -4.600 31.611 16.647 1.00 12.37 N ATOM 1873 HA ASN A 120 -2.855 31.642 13.006 1.00 0.00 H ATOM 1874 HB2 ASN A 120 -2.380 30.807 15.878 1.00 0.00 H ATOM 1875 HB3 ASN A 120 -2.086 32.429 15.209 1.00 0.00 H ATOM 1876 HD22 ASN A 120 -3.984 31.134 17.335 1.00 0.00 H ATOM 1877 HD21 ASN A 120 -5.581 31.846 16.902 1.00 0.00 H ATOM 1878 H ASN A 120 -3.145 28.910 14.254 1.00 0.00 H ATOM 1879 N ARG A 121 -0.685 29.531 12.880 1.00 11.95 N ATOM 1880 CA ARG A 121 0.714 29.117 12.769 1.00 4.42 C ATOM 1881 C ARG A 121 1.173 28.840 11.356 1.00 8.93 C ATOM 1882 O ARG A 121 0.893 27.823 10.725 1.00 15.46 O ATOM 1883 CB ARG A 121 0.928 27.884 13.663 1.00 5.99 C ATOM 1884 CG ARG A 121 0.582 28.196 15.106 1.00 10.86 C ATOM 1885 CD ARG A 121 0.942 27.047 16.041 1.00 13.13 C ATOM 1886 NE ARG A 121 0.526 27.369 17.402 1.00 4.88 N ATOM 1887 CZ ARG A 121 0.840 26.719 18.508 1.00 12.17 C ATOM 1888 NH1 ARG A 121 1.614 25.637 18.496 1.00 9.62 N ATOM 1889 NH2 ARG A 121 0.354 27.183 19.655 1.00 10.79 N ATOM 1890 HA ARG A 121 1.327 29.955 13.101 1.00 0.00 H ATOM 1891 HB2 ARG A 121 0.292 27.072 13.310 1.00 0.00 H ATOM 1892 HB3 ARG A 121 1.972 27.577 13.604 1.00 0.00 H ATOM 1893 HG2 ARG A 121 1.130 29.086 15.415 1.00 0.00 H ATOM 1894 HG3 ARG A 121 -0.489 28.386 15.178 1.00 0.00 H ATOM 1895 HD2 ARG A 121 2.020 26.887 16.020 1.00 0.00 H ATOM 1896 HD3 ARG A 121 0.435 26.140 15.712 1.00 0.00 H ATOM 1897 HE ARG A 121 -0.086 28.203 17.514 1.00 0.00 H ATOM 1898 HH12 ARG A 121 1.841 25.150 19.386 1.00 0.00 H ATOM 1899 HH11 ARG A 121 1.992 25.278 17.596 1.00 0.00 H ATOM 1900 HH22 ARG A 121 0.578 26.700 20.548 1.00 0.00 H ATOM 1901 HH21 ARG A 121 -0.250 28.029 19.659 1.00 0.00 H ATOM 1902 H ARG A 121 -1.429 28.942 12.455 1.00 0.00 H ATOM 1903 N GLY A 122 1.940 29.800 10.816 1.00 4.52 N ATOM 1904 CA GLY A 122 2.344 29.675 9.427 1.00 5.91 C ATOM 1905 C GLY A 122 3.206 28.454 9.169 1.00 7.82 C ATOM 1906 O GLY A 122 3.220 27.921 8.055 1.00 8.31 O ATOM 1907 HA3 GLY A 122 2.908 30.565 9.148 1.00 0.00 H ATOM 1908 HA2 GLY A 122 1.449 29.605 8.809 1.00 0.00 H ATOM 1909 H GLY A 122 2.240 30.619 11.383 1.00 0.00 H ATOM 1910 N PHE A 123 3.942 28.018 10.194 1.00 7.09 N ATOM 1911 CA PHE A 123 4.872 26.912 9.933 1.00 10.58 C ATOM 1912 C PHE A 123 4.048 25.641 9.771 1.00 15.76 C ATOM 1913 O PHE A 123 4.482 24.653 9.189 1.00 29.25 O ATOM 1914 CB PHE A 123 5.924 26.793 11.014 1.00 3.48 C ATOM 1915 CG PHE A 123 5.428 26.603 12.432 1.00 13.84 C ATOM 1916 CD1 PHE A 123 5.042 25.354 12.898 1.00 4.50 C ATOM 1917 CD2 PHE A 123 5.343 27.692 13.289 1.00 9.07 C ATOM 1918 CE1 PHE A 123 4.575 25.197 14.184 1.00 4.65 C ATOM 1919 CE2 PHE A 123 4.902 27.535 14.586 1.00 10.78 C ATOM 1920 CZ PHE A 123 4.533 26.282 15.041 1.00 15.25 C ATOM 1921 HA PHE A 123 5.431 27.098 9.016 1.00 0.00 H ATOM 1922 HB2 PHE A 123 6.555 25.939 10.768 1.00 0.00 H ATOM 1923 HB3 PHE A 123 6.523 27.703 10.993 1.00 0.00 H ATOM 1924 HD2 PHE A 123 5.628 28.682 12.933 1.00 0.00 H ATOM 1925 HE2 PHE A 123 4.844 28.396 15.251 1.00 0.00 H ATOM 1926 HZ PHE A 123 4.210 26.150 16.073 1.00 0.00 H ATOM 1927 HE1 PHE A 123 4.239 24.218 14.526 1.00 0.00 H ATOM 1928 HD1 PHE A 123 5.109 24.488 12.239 1.00 0.00 H ATOM 1929 H PHE A 123 3.860 28.444 11.139 1.00 0.00 H ATOM 1930 N MET A 124 2.824 25.702 10.297 1.00 10.70 N ATOM 1931 CA MET A 124 1.932 24.564 10.071 1.00 4.97 C ATOM 1932 C MET A 124 1.124 24.790 8.800 1.00 15.10 C ATOM 1933 O MET A 124 0.995 23.872 7.985 1.00 13.19 O ATOM 1934 CB MET A 124 1.039 24.360 11.279 1.00 10.52 C ATOM 1935 CG MET A 124 1.639 23.545 12.412 1.00 9.95 C ATOM 1936 SD MET A 124 0.360 23.113 13.617 1.00 20.56 S ATOM 1937 CE MET A 124 1.021 23.888 15.092 1.00 71.67 C ATOM 1938 HA MET A 124 2.518 23.655 9.937 1.00 0.00 H ATOM 1939 HB2 MET A 124 0.780 25.342 11.674 1.00 0.00 H ATOM 1940 HB3 MET A 124 0.134 23.853 10.945 1.00 0.00 H ATOM 1941 HG2 MET A 124 2.415 24.130 12.905 1.00 0.00 H ATOM 1942 HG3 MET A 124 2.076 22.632 12.007 1.00 0.00 H ATOM 1943 HE1 MET A 124 1.998 23.462 15.318 1.00 0.00 H ATOM 1944 HE2 MET A 124 1.121 24.960 14.924 1.00 0.00 H ATOM 1945 HE3 MET A 124 0.344 23.712 15.928 1.00 0.00 H ATOM 1946 H MET A 124 2.515 26.528 10.848 1.00 0.00 H ATOM 1947 N LEU A 125 0.608 26.005 8.626 1.00 12.48 N ATOM 1948 CA LEU A 125 -0.308 26.330 7.538 1.00 12.77 C ATOM 1949 C LEU A 125 0.333 26.381 6.164 1.00 21.10 C ATOM 1950 O LEU A 125 -0.269 25.958 5.163 1.00 11.77 O ATOM 1951 CB LEU A 125 -1.002 27.677 7.832 1.00 6.21 C ATOM 1952 CG LEU A 125 -1.831 27.734 9.120 1.00 5.53 C ATOM 1953 CD1 LEU A 125 -2.548 29.072 9.283 1.00 4.51 C ATOM 1954 CD2 LEU A 125 -2.861 26.610 9.176 1.00 6.18 C ATOM 1955 HA LEU A 125 -1.027 25.512 7.501 1.00 0.00 H ATOM 1956 HB2 LEU A 125 -0.230 28.444 7.897 1.00 0.00 H ATOM 1957 HB3 LEU A 125 -1.666 27.901 6.997 1.00 0.00 H ATOM 1958 HG LEU A 125 -1.121 27.614 9.939 1.00 0.00 H ATOM 1959 HD21 LEU A 125 -3.538 26.697 8.326 1.00 0.00 H ATOM 1960 HD22 LEU A 125 -2.350 25.648 9.138 1.00 0.00 H ATOM 1961 HD23 LEU A 125 -3.428 26.685 10.104 1.00 0.00 H ATOM 1962 HD11 LEU A 125 -1.812 29.875 9.316 1.00 0.00 H ATOM 1963 HD12 LEU A 125 -3.220 29.228 8.439 1.00 0.00 H ATOM 1964 HD13 LEU A 125 -3.122 29.065 10.210 1.00 0.00 H ATOM 1965 H LEU A 125 0.870 26.756 9.296 1.00 0.00 H ATOM 1966 N TRP A 126 1.557 26.900 6.037 1.00 18.05 N ATOM 1967 CA TRP A 126 2.116 27.012 4.686 1.00 11.52 C ATOM 1968 C TRP A 126 2.486 25.659 4.084 1.00 16.48 C ATOM 1969 O TRP A 126 2.078 25.387 2.947 1.00 6.93 O ATOM 1970 CB TRP A 126 3.332 27.939 4.682 1.00 11.00 C ATOM 1971 CG TRP A 126 3.037 29.406 4.661 1.00 4.64 C ATOM 1972 CD1 TRP A 126 3.409 30.311 5.616 1.00 15.07 C ATOM 1973 CD2 TRP A 126 2.324 30.152 3.666 1.00 3.73 C ATOM 1974 NE1 TRP A 126 2.975 31.573 5.284 1.00 14.07 N ATOM 1975 CE2 TRP A 126 2.305 31.503 4.088 1.00 8.00 C ATOM 1976 CE3 TRP A 126 1.695 29.838 2.457 1.00 9.26 C ATOM 1977 CZ2 TRP A 126 1.689 32.514 3.351 1.00 10.13 C ATOM 1978 CZ3 TRP A 126 1.084 30.839 1.726 1.00 12.96 C ATOM 1979 CH2 TRP A 126 1.083 32.173 2.174 1.00 9.56 C ATOM 1980 HA TRP A 126 1.332 27.438 4.060 1.00 0.00 H ATOM 1981 HB2 TRP A 126 3.915 27.728 5.578 1.00 0.00 H ATOM 1982 HB3 TRP A 126 3.927 27.705 3.799 1.00 0.00 H ATOM 1983 HE1 TRP A 126 3.129 32.435 5.845 1.00 0.00 H ATOM 1984 HD1 TRP A 126 3.972 30.066 6.517 1.00 0.00 H ATOM 1985 HZ2 TRP A 126 1.691 33.546 3.703 1.00 0.00 H ATOM 1986 HH2 TRP A 126 0.594 32.942 1.576 1.00 0.00 H ATOM 1987 HZ3 TRP A 126 0.594 30.591 0.785 1.00 0.00 H ATOM 1988 HE3 TRP A 126 1.687 28.810 2.094 1.00 0.00 H ATOM 1989 H TRP A 126 2.096 27.214 6.869 1.00 0.00 H ATOM 1990 N PRO A 127 3.239 24.797 4.757 1.00 13.43 N ATOM 1991 CA PRO A 127 3.531 23.473 4.189 1.00 10.76 C ATOM 1992 C PRO A 127 2.255 22.718 3.810 1.00 9.73 C ATOM 1993 O PRO A 127 2.175 22.125 2.732 1.00 11.98 O ATOM 1994 CB PRO A 127 4.233 22.733 5.324 1.00 13.72 C ATOM 1995 CG PRO A 127 4.755 23.794 6.229 1.00 16.14 C ATOM 1996 CD PRO A 127 3.869 24.993 6.069 1.00 17.07 C ATOM 1997 HA PRO A 127 4.123 23.553 3.277 1.00 0.00 H ATOM 1998 HD3 PRO A 127 3.118 25.028 6.858 1.00 0.00 H ATOM 1999 HD2 PRO A 127 4.454 25.912 6.085 1.00 0.00 H ATOM 2000 HG3 PRO A 127 5.779 24.048 5.955 1.00 0.00 H ATOM 2001 HG2 PRO A 127 4.732 23.448 7.262 1.00 0.00 H ATOM 2002 HB2 PRO A 127 3.529 22.092 5.854 1.00 0.00 H ATOM 2003 HB3 PRO A 127 5.051 22.127 4.935 1.00 0.00 H ATOM 2004 N LEU A 128 1.279 22.732 4.706 1.00 16.27 N ATOM 2005 CA LEU A 128 0.003 22.044 4.508 1.00 11.06 C ATOM 2006 C LEU A 128 -0.650 22.505 3.214 1.00 14.18 C ATOM 2007 O LEU A 128 -1.060 21.701 2.382 1.00 9.76 O ATOM 2008 CB LEU A 128 -0.924 22.300 5.691 1.00 4.44 C ATOM 2009 CG LEU A 128 -2.321 21.692 5.685 1.00 14.44 C ATOM 2010 CD1 LEU A 128 -2.288 20.168 5.691 1.00 3.99 C ATOM 2011 CD2 LEU A 128 -3.103 22.209 6.891 1.00 3.73 C ATOM 2012 HA LEU A 128 0.191 20.973 4.439 1.00 0.00 H ATOM 2013 HB2 LEU A 128 -0.417 21.925 6.580 1.00 0.00 H ATOM 2014 HB3 LEU A 128 -1.047 23.380 5.772 1.00 0.00 H ATOM 2015 HG LEU A 128 -2.815 21.996 4.762 1.00 0.00 H ATOM 2016 HD21 LEU A 128 -2.585 21.925 7.807 1.00 0.00 H ATOM 2017 HD22 LEU A 128 -3.177 23.295 6.836 1.00 0.00 H ATOM 2018 HD23 LEU A 128 -4.103 21.775 6.888 1.00 0.00 H ATOM 2019 HD11 LEU A 128 -1.761 19.814 4.805 1.00 0.00 H ATOM 2020 HD12 LEU A 128 -1.772 19.821 6.586 1.00 0.00 H ATOM 2021 HD13 LEU A 128 -3.308 19.784 5.686 1.00 0.00 H ATOM 2022 H LEU A 128 1.427 23.257 5.592 1.00 0.00 H ATOM 2023 N PHE A 129 -0.734 23.827 3.066 1.00 13.00 N ATOM 2024 CA PHE A 129 -1.329 24.439 1.882 1.00 6.85 C ATOM 2025 C PHE A 129 -0.588 24.039 0.620 1.00 3.45 C ATOM 2026 O PHE A 129 -1.157 23.999 -0.469 1.00 11.73 O ATOM 2027 CB PHE A 129 -1.300 25.963 2.036 1.00 4.51 C ATOM 2028 CG PHE A 129 -1.945 26.738 0.903 1.00 8.75 C ATOM 2029 CD1 PHE A 129 -3.298 26.642 0.645 1.00 8.76 C ATOM 2030 CD2 PHE A 129 -1.184 27.571 0.109 1.00 4.15 C ATOM 2031 CE1 PHE A 129 -3.876 27.357 -0.377 1.00 7.64 C ATOM 2032 CE2 PHE A 129 -1.753 28.294 -0.921 1.00 4.79 C ATOM 2033 CZ PHE A 129 -3.109 28.195 -1.157 1.00 11.23 C ATOM 2034 HA PHE A 129 -2.357 24.089 1.792 1.00 0.00 H ATOM 2035 HB2 PHE A 129 -1.820 26.219 2.959 1.00 0.00 H ATOM 2036 HB3 PHE A 129 -0.258 26.275 2.109 1.00 0.00 H ATOM 2037 HD2 PHE A 129 -0.114 27.660 0.298 1.00 0.00 H ATOM 2038 HE2 PHE A 129 -1.134 28.939 -1.544 1.00 0.00 H ATOM 2039 HZ PHE A 129 -3.571 28.776 -1.955 1.00 0.00 H ATOM 2040 HE1 PHE A 129 -4.944 27.261 -0.571 1.00 0.00 H ATOM 2041 HD1 PHE A 129 -3.917 25.990 1.261 1.00 0.00 H ATOM 2042 H PHE A 129 -0.364 24.442 3.818 1.00 0.00 H ATOM 2043 N GLU A 130 0.703 23.757 0.797 1.00 10.60 N ATOM 2044 CA GLU A 130 1.534 23.323 -0.320 1.00 12.61 C ATOM 2045 C GLU A 130 1.040 21.990 -0.873 1.00 8.45 C ATOM 2046 O GLU A 130 1.097 21.786 -2.085 1.00 19.34 O ATOM 2047 CB GLU A 130 3.005 23.159 0.079 1.00 8.91 C ATOM 2048 CG GLU A 130 3.904 22.831 -1.106 1.00 4.99 C ATOM 2049 CD GLU A 130 5.366 22.740 -0.699 1.00 7.42 C ATOM 2050 OE1 GLU A 130 5.653 22.961 0.493 1.00 12.47 O ATOM 2051 OE2 GLU A 130 6.202 22.447 -1.574 1.00 8.65 O ATOM 2052 HA GLU A 130 1.459 24.103 -1.078 1.00 0.00 H ATOM 2053 HB2 GLU A 130 3.349 24.089 0.531 1.00 0.00 H ATOM 2054 HB3 GLU A 130 3.081 22.352 0.808 1.00 0.00 H ATOM 2055 HG2 GLU A 130 3.595 21.875 -1.529 1.00 0.00 H ATOM 2056 HG3 GLU A 130 3.795 23.612 -1.858 1.00 0.00 H ATOM 2057 H GLU A 130 1.123 23.848 1.744 1.00 0.00 H ATOM 2058 N ILE A 131 0.584 21.120 0.021 1.00 7.03 N ATOM 2059 CA ILE A 131 0.212 19.751 -0.345 1.00 9.48 C ATOM 2060 C ILE A 131 -1.293 19.547 -0.431 1.00 15.23 C ATOM 2061 O ILE A 131 -1.789 18.579 -1.022 1.00 18.94 O ATOM 2062 CB ILE A 131 0.806 18.756 0.672 1.00 13.58 C ATOM 2063 CG1 ILE A 131 0.259 18.903 2.090 1.00 15.40 C ATOM 2064 CG2 ILE A 131 2.331 18.850 0.671 1.00 4.86 C ATOM 2065 CD1 ILE A 131 0.594 17.736 2.999 1.00 20.38 C ATOM 2066 HA ILE A 131 0.620 19.570 -1.339 1.00 0.00 H ATOM 2067 HB ILE A 131 0.492 17.766 0.341 1.00 0.00 H ATOM 2068 HG12 ILE A 131 0.676 19.810 2.527 1.00 0.00 H ATOM 2069 HG13 ILE A 131 -0.826 18.994 2.033 1.00 0.00 H ATOM 2070 HD11 ILE A 131 0.174 16.820 2.583 1.00 0.00 H ATOM 2071 HD12 ILE A 131 1.677 17.637 3.078 1.00 0.00 H ATOM 2072 HD13 ILE A 131 0.171 17.914 3.988 1.00 0.00 H ATOM 2073 HG21 ILE A 131 2.708 18.613 -0.324 1.00 0.00 H ATOM 2074 HG22 ILE A 131 2.632 19.862 0.943 1.00 0.00 H ATOM 2075 HG23 ILE A 131 2.738 18.142 1.393 1.00 0.00 H ATOM 2076 H ILE A 131 0.488 21.420 1.012 1.00 0.00 H ATOM 2077 N ALA A 132 -2.070 20.452 0.159 1.00 21.44 N ATOM 2078 CA ALA A 132 -3.525 20.385 -0.004 1.00 13.86 C ATOM 2079 C ALA A 132 -4.063 21.799 -0.162 1.00 3.66 C ATOM 2080 O ALA A 132 -4.562 22.404 0.787 1.00 16.68 O ATOM 2081 CB ALA A 132 -4.213 19.686 1.150 1.00 3.79 C ATOM 2082 HA ALA A 132 -3.738 19.791 -0.893 1.00 0.00 H ATOM 2083 HB1 ALA A 132 -3.839 18.665 1.230 1.00 0.00 H ATOM 2084 HB2 ALA A 132 -4.005 20.224 2.075 1.00 0.00 H ATOM 2085 HB3 ALA A 132 -5.288 19.667 0.973 1.00 0.00 H ATOM 2086 H ALA A 132 -1.645 21.206 0.735 1.00 0.00 H ATOM 2087 N PRO A 133 -3.965 22.327 -1.371 1.00 5.89 N ATOM 2088 CA PRO A 133 -4.375 23.736 -1.520 1.00 12.90 C ATOM 2089 C PRO A 133 -5.890 23.815 -1.388 1.00 15.57 C ATOM 2090 O PRO A 133 -6.459 24.867 -1.115 1.00 12.23 O ATOM 2091 CB PRO A 133 -3.904 24.093 -2.923 1.00 9.95 C ATOM 2092 CG PRO A 133 -3.872 22.790 -3.657 1.00 14.26 C ATOM 2093 CD PRO A 133 -3.541 21.732 -2.636 1.00 8.73 C ATOM 2094 HA PRO A 133 -3.961 24.415 -0.775 1.00 0.00 H ATOM 2095 HD3 PRO A 133 -4.090 20.812 -2.837 1.00 0.00 H ATOM 2096 HD2 PRO A 133 -2.472 21.521 -2.627 1.00 0.00 H ATOM 2097 HG3 PRO A 133 -3.109 22.814 -4.435 1.00 0.00 H ATOM 2098 HG2 PRO A 133 -4.843 22.588 -4.108 1.00 0.00 H ATOM 2099 HB2 PRO A 133 -4.600 24.785 -3.398 1.00 0.00 H ATOM 2100 HB3 PRO A 133 -2.911 24.542 -2.893 1.00 0.00 H ATOM 2101 N GLU A 134 -6.561 22.677 -1.571 1.00 14.89 N ATOM 2102 CA GLU A 134 -8.023 22.695 -1.600 1.00 11.37 C ATOM 2103 C GLU A 134 -8.661 22.469 -0.238 1.00 9.95 C ATOM 2104 O GLU A 134 -9.899 22.487 -0.174 1.00 16.92 O ATOM 2105 CB GLU A 134 -8.517 21.640 -2.590 1.00 16.32 C ATOM 2106 CG GLU A 134 -8.550 20.226 -2.034 1.00 18.46 C ATOM 2107 CD GLU A 134 -7.185 19.596 -1.854 1.00 20.39 C ATOM 2108 OE1 GLU A 134 -6.169 20.271 -2.115 1.00 19.00 O ATOM 2109 OE2 GLU A 134 -7.112 18.417 -1.447 1.00 23.87 O ATOM 2110 HA GLU A 134 -8.325 23.694 -1.914 1.00 0.00 H ATOM 2111 HB2 GLU A 134 -9.527 21.909 -2.900 1.00 0.00 H ATOM 2112 HB3 GLU A 134 -7.857 21.650 -3.458 1.00 0.00 H ATOM 2113 HG2 GLU A 134 -9.045 20.252 -1.063 1.00 0.00 H ATOM 2114 HG3 GLU A 134 -9.126 19.603 -2.718 1.00 0.00 H ATOM 2115 H GLU A 134 -6.047 21.781 -1.692 1.00 0.00 H ATOM 2116 N LEU A 135 -7.880 22.271 0.807 1.00 3.98 N ATOM 2117 CA LEU A 135 -8.296 21.949 2.160 1.00 5.19 C ATOM 2118 C LEU A 135 -9.237 22.955 2.827 1.00 12.65 C ATOM 2119 O LEU A 135 -9.036 24.165 2.775 1.00 22.58 O ATOM 2120 CB LEU A 135 -7.092 21.836 3.111 1.00 4.98 C ATOM 2121 CG LEU A 135 -7.319 21.106 4.432 1.00 8.76 C ATOM 2122 CD1 LEU A 135 -6.101 20.263 4.809 1.00 7.40 C ATOM 2123 CD2 LEU A 135 -7.620 22.072 5.563 1.00 10.14 C ATOM 2124 HA LEU A 135 -8.827 21.008 2.018 1.00 0.00 H ATOM 2125 HB2 LEU A 135 -6.299 21.312 2.577 1.00 0.00 H ATOM 2126 HB3 LEU A 135 -6.762 22.848 3.347 1.00 0.00 H ATOM 2127 HG LEU A 135 -8.182 20.456 4.286 1.00 0.00 H ATOM 2128 HD21 LEU A 135 -6.780 22.756 5.688 1.00 0.00 H ATOM 2129 HD22 LEU A 135 -8.520 22.639 5.325 1.00 0.00 H ATOM 2130 HD23 LEU A 135 -7.775 21.512 6.485 1.00 0.00 H ATOM 2131 HD11 LEU A 135 -5.916 19.525 4.029 1.00 0.00 H ATOM 2132 HD12 LEU A 135 -5.230 20.911 4.912 1.00 0.00 H ATOM 2133 HD13 LEU A 135 -6.291 19.754 5.754 1.00 0.00 H ATOM 2134 H LEU A 135 -6.856 22.355 0.644 1.00 0.00 H ATOM 2135 N VAL A 136 -10.233 22.393 3.482 1.00 8.62 N ATOM 2136 CA VAL A 136 -11.239 23.064 4.279 1.00 11.03 C ATOM 2137 C VAL A 136 -11.346 22.400 5.649 1.00 12.45 C ATOM 2138 O VAL A 136 -11.453 21.175 5.741 1.00 14.77 O ATOM 2139 CB VAL A 136 -12.612 23.030 3.586 1.00 15.29 C ATOM 2140 CG1 VAL A 136 -13.646 23.814 4.381 1.00 6.80 C ATOM 2141 CG2 VAL A 136 -12.498 23.571 2.174 1.00 5.98 C ATOM 2142 HA VAL A 136 -10.936 24.105 4.396 1.00 0.00 H ATOM 2143 HB VAL A 136 -12.946 21.994 3.538 1.00 0.00 H ATOM 2144 HG11 VAL A 136 -13.745 23.378 5.375 1.00 0.00 H ATOM 2145 HG12 VAL A 136 -13.325 24.852 4.469 1.00 0.00 H ATOM 2146 HG13 VAL A 136 -14.606 23.772 3.867 1.00 0.00 H ATOM 2147 HG21 VAL A 136 -12.140 24.600 2.208 1.00 0.00 H ATOM 2148 HG22 VAL A 136 -11.796 22.959 1.607 1.00 0.00 H ATOM 2149 HG23 VAL A 136 -13.477 23.541 1.695 1.00 0.00 H ATOM 2150 H VAL A 136 -10.304 21.357 3.420 1.00 0.00 H ATOM 2151 N PHE A 137 -11.319 23.204 6.698 1.00 3.94 N ATOM 2152 CA PHE A 137 -11.397 22.700 8.061 1.00 7.30 C ATOM 2153 C PHE A 137 -12.807 22.228 8.408 1.00 12.60 C ATOM 2154 O PHE A 137 -13.761 22.619 7.732 1.00 21.69 O ATOM 2155 CB PHE A 137 -10.926 23.786 9.015 1.00 3.53 C ATOM 2156 CG PHE A 137 -9.418 23.992 9.016 1.00 4.73 C ATOM 2157 CD1 PHE A 137 -8.826 24.795 8.056 1.00 11.06 C ATOM 2158 CD2 PHE A 137 -8.635 23.385 9.976 1.00 6.47 C ATOM 2159 CE1 PHE A 137 -7.452 24.979 8.073 1.00 9.91 C ATOM 2160 CE2 PHE A 137 -7.261 23.553 10.004 1.00 8.12 C ATOM 2161 CZ PHE A 137 -6.681 24.363 9.042 1.00 10.95 C ATOM 2162 HA PHE A 137 -10.748 21.829 8.156 1.00 0.00 H ATOM 2163 HB2 PHE A 137 -11.401 24.724 8.729 1.00 0.00 H ATOM 2164 HB3 PHE A 137 -11.237 23.516 10.024 1.00 0.00 H ATOM 2165 HD2 PHE A 137 -9.110 22.758 10.731 1.00 0.00 H ATOM 2166 HE2 PHE A 137 -6.652 23.061 10.763 1.00 0.00 H ATOM 2167 HZ PHE A 137 -5.602 24.517 9.049 1.00 0.00 H ATOM 2168 HE1 PHE A 137 -6.978 25.610 7.321 1.00 0.00 H ATOM 2169 HD1 PHE A 137 -9.435 25.279 7.293 1.00 0.00 H ATOM 2170 H PHE A 137 -11.239 24.230 6.544 1.00 0.00 H ATOM 2171 N PRO A 138 -12.948 21.393 9.433 1.00 3.43 N ATOM 2172 CA PRO A 138 -14.246 20.808 9.766 1.00 5.93 C ATOM 2173 C PRO A 138 -15.319 21.862 10.014 1.00 12.58 C ATOM 2174 O PRO A 138 -16.510 21.580 9.870 1.00 12.28 O ATOM 2175 CB PRO A 138 -13.976 20.076 11.089 1.00 3.76 C ATOM 2176 CG PRO A 138 -12.522 19.702 10.960 1.00 6.48 C ATOM 2177 CD PRO A 138 -11.899 20.943 10.365 1.00 5.71 C ATOM 2178 HA PRO A 138 -14.613 20.181 8.954 1.00 0.00 H ATOM 2179 HD3 PRO A 138 -11.700 21.693 11.130 1.00 0.00 H ATOM 2180 HD2 PRO A 138 -10.974 20.709 9.838 1.00 0.00 H ATOM 2181 HG3 PRO A 138 -12.396 18.845 10.299 1.00 0.00 H ATOM 2182 HG2 PRO A 138 -12.088 19.475 11.934 1.00 0.00 H ATOM 2183 HB2 PRO A 138 -14.141 20.732 11.944 1.00 0.00 H ATOM 2184 HB3 PRO A 138 -14.604 19.191 11.186 1.00 0.00 H ATOM 2185 N ASP A 139 -14.897 23.068 10.405 1.00 15.57 N ATOM 2186 CA ASP A 139 -15.875 24.110 10.746 1.00 4.52 C ATOM 2187 C ASP A 139 -16.251 24.886 9.489 1.00 6.17 C ATOM 2188 O ASP A 139 -17.028 25.841 9.515 1.00 15.46 O ATOM 2189 CB ASP A 139 -15.332 25.016 11.846 1.00 9.45 C ATOM 2190 CG ASP A 139 -14.263 25.992 11.386 1.00 3.91 C ATOM 2191 OD1 ASP A 139 -13.739 25.842 10.267 1.00 9.22 O ATOM 2192 OD2 ASP A 139 -13.938 26.908 12.174 1.00 12.22 O ATOM 2193 HA ASP A 139 -16.782 23.649 11.138 1.00 0.00 H ATOM 2194 HB2 ASP A 139 -16.163 25.589 12.257 1.00 0.00 H ATOM 2195 HB3 ASP A 139 -14.906 24.386 12.627 1.00 0.00 H ATOM 2196 H ASP A 139 -13.878 23.269 10.468 1.00 0.00 H ATOM 2197 N GLY A 140 -15.687 24.443 8.369 1.00 4.47 N ATOM 2198 CA GLY A 140 -15.943 25.062 7.084 1.00 9.51 C ATOM 2199 C GLY A 140 -14.960 26.155 6.699 1.00 9.06 C ATOM 2200 O GLY A 140 -15.008 26.625 5.560 1.00 6.59 O ATOM 2201 HA3 GLY A 140 -16.942 25.497 7.109 1.00 0.00 H ATOM 2202 HA2 GLY A 140 -15.905 24.286 6.319 1.00 0.00 H ATOM 2203 H GLY A 140 -15.043 23.628 8.417 1.00 0.00 H ATOM 2204 N GLU A 141 -14.069 26.558 7.599 1.00 10.99 N ATOM 2205 CA GLU A 141 -13.103 27.614 7.275 1.00 14.54 C ATOM 2206 C GLU A 141 -12.106 27.126 6.235 1.00 11.89 C ATOM 2207 O GLU A 141 -11.509 26.066 6.443 1.00 9.50 O ATOM 2208 CB GLU A 141 -12.348 28.069 8.521 1.00 15.19 C ATOM 2209 CG GLU A 141 -12.555 29.522 8.900 1.00 25.23 C ATOM 2210 CD GLU A 141 -11.473 30.058 9.818 1.00 30.39 C ATOM 2211 OE1 GLU A 141 -11.181 29.371 10.821 1.00 31.79 O ATOM 2212 OE2 GLU A 141 -10.938 31.151 9.523 1.00 29.40 O ATOM 2213 HA GLU A 141 -13.663 28.459 6.873 1.00 0.00 H ATOM 2214 HB2 GLU A 141 -12.673 27.451 9.358 1.00 0.00 H ATOM 2215 HB3 GLU A 141 -11.283 27.913 8.348 1.00 0.00 H ATOM 2216 HG2 GLU A 141 -12.565 30.120 7.989 1.00 0.00 H ATOM 2217 HG3 GLU A 141 -13.516 29.615 9.405 1.00 0.00 H ATOM 2218 H GLU A 141 -14.056 26.121 8.542 1.00 0.00 H ATOM 2219 N MET A 142 -11.945 27.871 5.145 1.00 3.94 N ATOM 2220 CA MET A 142 -11.060 27.439 4.082 1.00 4.73 C ATOM 2221 C MET A 142 -9.622 27.890 4.360 1.00 14.82 C ATOM 2222 O MET A 142 -9.391 29.025 4.782 1.00 14.54 O ATOM 2223 CB MET A 142 -11.464 27.963 2.718 1.00 9.03 C ATOM 2224 CG MET A 142 -12.874 27.637 2.266 1.00 15.45 C ATOM 2225 SD MET A 142 -13.311 28.666 0.846 1.00 30.90 S ATOM 2226 CE MET A 142 -13.282 30.289 1.597 1.00 11.51 C ATOM 2227 HA MET A 142 -11.131 26.351 4.064 1.00 0.00 H ATOM 2228 HB2 MET A 142 -11.362 29.048 2.735 1.00 0.00 H ATOM 2229 HB3 MET A 142 -10.774 27.546 1.984 1.00 0.00 H ATOM 2230 HG2 MET A 142 -13.570 27.830 3.082 1.00 0.00 H ATOM 2231 HG3 MET A 142 -12.930 26.586 1.983 1.00 0.00 H ATOM 2232 HE1 MET A 142 -14.010 30.326 2.407 1.00 0.00 H ATOM 2233 HE2 MET A 142 -12.286 30.487 1.993 1.00 0.00 H ATOM 2234 HE3 MET A 142 -13.532 31.039 0.847 1.00 0.00 H ATOM 2235 H MET A 142 -12.458 28.771 5.055 1.00 0.00 H ATOM 2236 N LEU A 143 -8.722 26.955 4.089 1.00 11.94 N ATOM 2237 CA LEU A 143 -7.294 27.165 4.293 1.00 11.94 C ATOM 2238 C LEU A 143 -6.721 28.279 3.427 1.00 11.95 C ATOM 2239 O LEU A 143 -5.902 29.090 3.873 1.00 5.43 O ATOM 2240 CB LEU A 143 -6.554 25.858 4.006 1.00 3.90 C ATOM 2241 CG LEU A 143 -5.038 25.885 4.221 1.00 3.44 C ATOM 2242 CD1 LEU A 143 -4.723 26.330 5.637 1.00 13.38 C ATOM 2243 CD2 LEU A 143 -4.434 24.513 3.928 1.00 7.70 C ATOM 2244 HA LEU A 143 -7.156 27.474 5.329 1.00 0.00 H ATOM 2245 HB2 LEU A 143 -6.970 25.089 4.657 1.00 0.00 H ATOM 2246 HB3 LEU A 143 -6.739 25.591 2.966 1.00 0.00 H ATOM 2247 HG LEU A 143 -4.593 26.601 3.530 1.00 0.00 H ATOM 2248 HD21 LEU A 143 -4.875 23.773 4.596 1.00 0.00 H ATOM 2249 HD22 LEU A 143 -4.642 24.239 2.894 1.00 0.00 H ATOM 2250 HD23 LEU A 143 -3.356 24.551 4.086 1.00 0.00 H ATOM 2251 HD11 LEU A 143 -5.127 27.329 5.801 1.00 0.00 H ATOM 2252 HD12 LEU A 143 -5.174 25.634 6.344 1.00 0.00 H ATOM 2253 HD13 LEU A 143 -3.642 26.346 5.780 1.00 0.00 H ATOM 2254 H LEU A 143 -9.046 26.039 3.718 1.00 0.00 H ATOM 2255 N ARG A 144 -7.127 28.338 2.160 1.00 9.41 N ATOM 2256 CA ARG A 144 -6.560 29.378 1.304 1.00 15.63 C ATOM 2257 C ARG A 144 -7.019 30.768 1.739 1.00 23.38 C ATOM 2258 O ARG A 144 -6.310 31.752 1.523 1.00 24.82 O ATOM 2259 CB ARG A 144 -6.932 29.149 -0.162 1.00 14.69 C ATOM 2260 CG ARG A 144 -6.043 29.918 -1.124 1.00 20.46 C ATOM 2261 CD ARG A 144 -6.512 29.781 -2.560 1.00 35.74 C ATOM 2262 NE ARG A 144 -5.453 29.337 -3.462 1.00 39.36 N ATOM 2263 CZ ARG A 144 -5.247 28.078 -3.828 1.00 39.17 C ATOM 2264 NH1 ARG A 144 -6.025 27.100 -3.378 1.00 35.68 N ATOM 2265 NH2 ARG A 144 -4.252 27.791 -4.655 1.00 34.45 N ATOM 2266 HA ARG A 144 -5.476 29.321 1.406 1.00 0.00 H ATOM 2267 HB2 ARG A 144 -6.844 28.085 -0.381 1.00 0.00 H ATOM 2268 HB3 ARG A 144 -7.964 29.466 -0.313 1.00 0.00 H ATOM 2269 HG2 ARG A 144 -6.054 30.973 -0.848 1.00 0.00 H ATOM 2270 HG3 ARG A 144 -5.026 29.535 -1.047 1.00 0.00 H ATOM 2271 HD2 ARG A 144 -6.877 30.750 -2.901 1.00 0.00 H ATOM 2272 HD3 ARG A 144 -7.325 29.056 -2.593 1.00 0.00 H ATOM 2273 HE ARG A 144 -4.813 30.061 -3.846 1.00 0.00 H ATOM 2274 HH12 ARG A 144 -5.850 26.119 -3.674 1.00 0.00 H ATOM 2275 HH11 ARG A 144 -6.809 27.316 -2.729 1.00 0.00 H ATOM 2276 HH22 ARG A 144 -4.085 26.807 -4.946 1.00 0.00 H ATOM 2277 HH21 ARG A 144 -3.638 28.550 -5.013 1.00 0.00 H ATOM 2278 H ARG A 144 -7.827 27.664 1.790 1.00 0.00 H ATOM 2279 N GLN A 145 -8.200 30.823 2.345 1.00 23.93 N ATOM 2280 CA GLN A 145 -8.770 32.067 2.843 1.00 24.27 C ATOM 2281 C GLN A 145 -8.052 32.522 4.106 1.00 23.55 C ATOM 2282 O GLN A 145 -7.698 33.684 4.294 1.00 11.68 O ATOM 2283 CB GLN A 145 -10.263 31.892 3.135 1.00 29.55 C ATOM 2284 CG GLN A 145 -10.891 33.103 3.801 1.00 44.36 C ATOM 2285 CD GLN A 145 -11.470 34.111 2.831 1.00 55.44 C ATOM 2286 OE1 GLN A 145 -11.133 34.150 1.647 1.00 62.99 O ATOM 2287 NE2 GLN A 145 -12.369 34.959 3.326 1.00 69.52 N ATOM 2288 HA GLN A 145 -8.643 32.828 2.073 1.00 0.00 H ATOM 2289 HB2 GLN A 145 -10.781 31.707 2.194 1.00 0.00 H ATOM 2290 HB3 GLN A 145 -10.389 31.031 3.792 1.00 0.00 H ATOM 2291 HG2 GLN A 145 -11.692 32.758 4.455 1.00 0.00 H ATOM 2292 HG3 GLN A 145 -10.126 33.601 4.397 1.00 0.00 H ATOM 2293 HE22 GLN A 145 -12.637 34.906 4.330 1.00 0.00 H ATOM 2294 HE21 GLN A 145 -12.803 35.675 2.709 1.00 0.00 H ATOM 2295 H GLN A 145 -8.739 29.942 2.469 1.00 0.00 H ATOM 2296 N ILE A 146 -7.843 31.549 4.989 1.00 19.72 N ATOM 2297 CA ILE A 146 -7.137 31.791 6.234 1.00 21.05 C ATOM 2298 C ILE A 146 -5.753 32.372 5.964 1.00 25.83 C ATOM 2299 O ILE A 146 -5.264 33.209 6.723 1.00 19.19 O ATOM 2300 CB ILE A 146 -6.972 30.496 7.041 1.00 23.44 C ATOM 2301 CG1 ILE A 146 -8.291 29.806 7.411 1.00 22.98 C ATOM 2302 CG2 ILE A 146 -6.141 30.750 8.290 1.00 31.98 C ATOM 2303 CD1 ILE A 146 -8.063 28.694 8.422 1.00 14.96 C ATOM 2304 HA ILE A 146 -7.733 32.501 6.808 1.00 0.00 H ATOM 2305 HB ILE A 146 -6.452 29.804 6.379 1.00 0.00 H ATOM 2306 HG12 ILE A 146 -8.971 30.543 7.839 1.00 0.00 H ATOM 2307 HG13 ILE A 146 -8.736 29.383 6.511 1.00 0.00 H ATOM 2308 HD11 ILE A 146 -7.388 27.951 7.997 1.00 0.00 H ATOM 2309 HD12 ILE A 146 -7.622 29.112 9.327 1.00 0.00 H ATOM 2310 HD13 ILE A 146 -9.016 28.224 8.664 1.00 0.00 H ATOM 2311 HG21 ILE A 146 -5.156 31.116 8.001 1.00 0.00 H ATOM 2312 HG22 ILE A 146 -6.639 31.494 8.911 1.00 0.00 H ATOM 2313 HG23 ILE A 146 -6.035 29.821 8.849 1.00 0.00 H ATOM 2314 H ILE A 146 -8.194 30.592 4.782 1.00 0.00 H ATOM 2315 N LEU A 147 -5.153 31.896 4.876 1.00 21.99 N ATOM 2316 CA LEU A 147 -3.794 32.290 4.520 1.00 14.82 C ATOM 2317 C LEU A 147 -3.810 33.590 3.726 1.00 16.46 C ATOM 2318 O LEU A 147 -2.776 34.238 3.560 1.00 26.90 O ATOM 2319 CB LEU A 147 -3.095 31.177 3.731 1.00 12.91 C ATOM 2320 CG LEU A 147 -2.472 30.074 4.597 1.00 16.05 C ATOM 2321 CD1 LEU A 147 -2.029 28.900 3.735 1.00 32.84 C ATOM 2322 CD2 LEU A 147 -1.300 30.600 5.411 1.00 11.33 C ATOM 2323 HA LEU A 147 -3.231 32.456 5.438 1.00 0.00 H ATOM 2324 HB2 LEU A 147 -3.829 30.716 3.070 1.00 0.00 H ATOM 2325 HB3 LEU A 147 -2.303 31.629 3.134 1.00 0.00 H ATOM 2326 HG LEU A 147 -3.238 29.731 5.293 1.00 0.00 H ATOM 2327 HD21 LEU A 147 -0.534 30.984 4.737 1.00 0.00 H ATOM 2328 HD22 LEU A 147 -1.644 31.401 6.066 1.00 0.00 H ATOM 2329 HD23 LEU A 147 -0.884 29.791 6.012 1.00 0.00 H ATOM 2330 HD11 LEU A 147 -2.892 28.491 3.209 1.00 0.00 H ATOM 2331 HD12 LEU A 147 -1.289 29.241 3.011 1.00 0.00 H ATOM 2332 HD13 LEU A 147 -1.590 28.130 4.370 1.00 0.00 H ATOM 2333 H LEU A 147 -5.665 31.228 4.265 1.00 0.00 H ATOM 2334 N HIS A 148 -4.995 33.953 3.255 1.00 17.70 N ATOM 2335 CA HIS A 148 -5.167 35.152 2.451 1.00 20.87 C ATOM 2336 C HIS A 148 -5.494 36.393 3.268 1.00 20.13 C ATOM 2337 O HIS A 148 -5.054 37.491 2.923 1.00 17.74 O ATOM 2338 CB HIS A 148 -6.291 34.931 1.422 1.00 31.58 C ATOM 2339 CG HIS A 148 -6.275 36.001 0.372 1.00 47.30 C ATOM 2340 ND1 HIS A 148 -5.140 36.255 -0.371 1.00 56.79 N ATOM 2341 CD2 HIS A 148 -7.215 36.869 -0.056 1.00 52.87 C ATOM 2342 CE1 HIS A 148 -5.389 37.238 -1.218 1.00 61.39 C ATOM 2343 NE2 HIS A 148 -6.641 37.630 -1.048 1.00 57.61 N ATOM 2344 HA HIS A 148 -4.209 35.329 1.962 1.00 0.00 H ATOM 2345 HB2 HIS A 148 -6.152 33.961 0.945 1.00 0.00 H ATOM 2346 HB3 HIS A 148 -7.253 34.948 1.935 1.00 0.00 H ATOM 2347 HD2 HIS A 148 -8.237 36.952 0.314 1.00 0.00 H ATOM 2348 HE1 HIS A 148 -4.682 37.655 -1.935 1.00 0.00 H ATOM 2349 H HIS A 148 -5.825 33.363 3.467 1.00 0.00 H ATOM 2350 N THR A 149 -6.262 36.245 4.343 1.00 20.42 N ATOM 2351 CA THR A 149 -6.767 37.403 5.068 1.00 19.30 C ATOM 2352 C THR A 149 -5.831 37.880 6.167 1.00 28.99 C ATOM 2353 O THR A 149 -6.160 38.863 6.833 1.00 18.46 O ATOM 2354 CB THR A 149 -8.142 37.120 5.710 1.00 10.74 C ATOM 2355 OG1 THR A 149 -7.962 36.148 6.746 1.00 8.72 O ATOM 2356 CG2 THR A 149 -9.067 36.528 4.670 1.00 4.00 C ATOM 2357 HA THR A 149 -6.851 38.185 4.314 1.00 0.00 H ATOM 2358 HB THR A 149 -8.564 38.044 6.106 1.00 0.00 H ATOM 2359 HG1 THR A 149 -7.336 36.504 7.425 1.00 0.00 H ATOM 2360 HG23 THR A 149 -9.220 37.251 3.868 1.00 0.00 H ATOM 2361 HG21 THR A 149 -8.621 35.621 4.263 1.00 0.00 H ATOM 2362 HG22 THR A 149 -10.024 36.287 5.132 1.00 0.00 H ATOM 2363 H THR A 149 -6.506 35.289 4.671 1.00 0.00 H ATOM 2364 N ARG A 150 -4.708 37.204 6.351 1.00 22.14 N ATOM 2365 CA ARG A 150 -3.596 37.740 7.116 1.00 17.62 C ATOM 2366 C ARG A 150 -2.343 37.525 6.258 1.00 20.56 C ATOM 2367 O ARG A 150 -2.228 36.500 5.582 1.00 19.40 O ATOM 2368 CB ARG A 150 -3.370 37.115 8.480 1.00 21.57 C ATOM 2369 CG ARG A 150 -4.467 37.282 9.513 1.00 16.58 C ATOM 2370 CD ARG A 150 -4.966 35.907 9.949 1.00 18.90 C ATOM 2371 NE ARG A 150 -4.422 35.494 11.220 1.00 19.31 N ATOM 2372 CZ ARG A 150 -4.549 34.325 11.813 1.00 15.26 C ATOM 2373 NH1 ARG A 150 -5.227 33.324 11.274 1.00 5.73 N ATOM 2374 NH2 ARG A 150 -3.953 34.175 12.989 1.00 14.17 N ATOM 2375 HA ARG A 150 -3.823 38.785 7.328 1.00 0.00 H ATOM 2376 HB2 ARG A 150 -3.222 36.046 8.330 1.00 0.00 H ATOM 2377 HB3 ARG A 150 -2.461 37.552 8.894 1.00 0.00 H ATOM 2378 HG2 ARG A 150 -4.075 37.818 10.377 1.00 0.00 H ATOM 2379 HG3 ARG A 150 -5.292 37.848 9.080 1.00 0.00 H ATOM 2380 HD2 ARG A 150 -4.680 35.176 9.193 1.00 0.00 H ATOM 2381 HD3 ARG A 150 -6.053 35.939 10.028 1.00 0.00 H ATOM 2382 HE ARG A 150 -3.861 36.206 11.730 1.00 0.00 H ATOM 2383 HH12 ARG A 150 -5.302 32.417 11.777 1.00 0.00 H ATOM 2384 HH11 ARG A 150 -5.684 33.445 10.348 1.00 0.00 H ATOM 2385 HH22 ARG A 150 -4.024 33.270 13.496 1.00 0.00 H ATOM 2386 HH21 ARG A 150 -3.414 34.962 13.403 1.00 0.00 H ATOM 2387 H ARG A 150 -4.619 36.256 5.933 1.00 0.00 H ATOM 2388 N ALA A 151 -1.439 38.488 6.292 1.00 15.52 N ATOM 2389 CA ALA A 151 -0.200 38.363 5.542 1.00 15.57 C ATOM 2390 C ALA A 151 0.801 37.543 6.354 1.00 16.27 C ATOM 2391 O ALA A 151 1.835 38.095 6.728 1.00 19.94 O ATOM 2392 CB ALA A 151 0.378 39.728 5.201 1.00 15.88 C ATOM 2393 HA ALA A 151 -0.409 37.853 4.602 1.00 0.00 H ATOM 2394 HB1 ALA A 151 -0.339 40.284 4.598 1.00 0.00 H ATOM 2395 HB2 ALA A 151 0.582 40.275 6.121 1.00 0.00 H ATOM 2396 HB3 ALA A 151 1.304 39.599 4.640 1.00 0.00 H ATOM 2397 H ALA A 151 -1.615 39.342 6.859 1.00 0.00 H ATOM 2398 N PHE A 152 0.472 36.281 6.614 1.00 18.15 N ATOM 2399 CA PHE A 152 1.383 35.385 7.323 1.00 11.05 C ATOM 2400 C PHE A 152 2.759 35.465 6.664 1.00 16.51 C ATOM 2401 O PHE A 152 2.828 35.532 5.435 1.00 10.09 O ATOM 2402 CB PHE A 152 0.901 33.948 7.303 1.00 7.70 C ATOM 2403 CG PHE A 152 -0.144 33.574 8.340 1.00 8.87 C ATOM 2404 CD1 PHE A 152 0.221 33.167 9.611 1.00 14.15 C ATOM 2405 CD2 PHE A 152 -1.498 33.623 8.028 1.00 8.61 C ATOM 2406 CE1 PHE A 152 -0.731 32.821 10.553 1.00 14.40 C ATOM 2407 CE2 PHE A 152 -2.458 33.281 8.963 1.00 4.45 C ATOM 2408 CZ PHE A 152 -2.071 32.864 10.220 1.00 4.48 C ATOM 2409 HA PHE A 152 1.429 35.702 8.365 1.00 0.00 H ATOM 2410 HB2 PHE A 152 0.476 33.754 6.318 1.00 0.00 H ATOM 2411 HB3 PHE A 152 1.767 33.305 7.457 1.00 0.00 H ATOM 2412 HD2 PHE A 152 -1.808 33.936 7.031 1.00 0.00 H ATOM 2413 HE2 PHE A 152 -3.516 33.341 8.708 1.00 0.00 H ATOM 2414 HZ PHE A 152 -2.823 32.568 10.951 1.00 0.00 H ATOM 2415 HE1 PHE A 152 -0.425 32.516 11.554 1.00 0.00 H ATOM 2416 HD1 PHE A 152 1.277 33.118 9.875 1.00 0.00 H ATOM 2417 H PHE A 152 -0.455 35.924 6.306 1.00 0.00 H ATOM 2418 N ASP A 153 3.815 35.488 7.469 1.00 21.62 N ATOM 2419 CA ASP A 153 5.146 35.595 6.881 1.00 21.68 C ATOM 2420 C ASP A 153 5.390 34.419 5.931 1.00 20.14 C ATOM 2421 O ASP A 153 5.013 33.296 6.260 1.00 17.99 O ATOM 2422 CB ASP A 153 6.247 35.622 7.940 1.00 18.01 C ATOM 2423 CG ASP A 153 6.247 36.905 8.746 1.00 25.26 C ATOM 2424 OD1 ASP A 153 5.193 37.228 9.325 1.00 18.05 O ATOM 2425 OD2 ASP A 153 7.292 37.585 8.803 1.00 48.75 O ATOM 2426 HA ASP A 153 5.183 36.538 6.336 1.00 0.00 H ATOM 2427 HB2 ASP A 153 6.099 34.782 8.619 1.00 0.00 H ATOM 2428 HB3 ASP A 153 7.212 35.521 7.444 1.00 0.00 H ATOM 2429 H ASP A 153 3.695 35.431 8.501 1.00 0.00 H ATOM 2430 N LYS A 154 6.012 34.739 4.812 1.00 16.97 N ATOM 2431 CA LYS A 154 6.475 33.796 3.813 1.00 20.24 C ATOM 2432 C LYS A 154 7.533 32.863 4.386 1.00 20.07 C ATOM 2433 O LYS A 154 8.404 33.259 5.171 1.00 16.48 O ATOM 2434 CB LYS A 154 7.027 34.557 2.600 1.00 28.36 C ATOM 2435 CG LYS A 154 5.970 34.806 1.531 1.00 35.72 C ATOM 2436 CD LYS A 154 4.781 33.872 1.716 1.00 38.32 C ATOM 2437 CE LYS A 154 3.705 34.127 0.673 1.00 36.93 C ATOM 2438 NZ LYS A 154 4.092 33.600 -0.666 1.00 52.17 N ATOM 2439 HA LYS A 154 5.631 33.183 3.497 1.00 0.00 H ATOM 2440 HB2 LYS A 154 7.415 35.518 2.938 1.00 0.00 H ATOM 2441 HB3 LYS A 154 7.837 33.974 2.161 1.00 0.00 H ATOM 2442 HG2 LYS A 154 5.628 35.838 1.601 1.00 0.00 H ATOM 2443 HG3 LYS A 154 6.409 34.636 0.548 1.00 0.00 H ATOM 2444 HD2 LYS A 154 5.123 32.841 1.628 1.00 0.00 H ATOM 2445 HD3 LYS A 154 4.358 34.029 2.708 1.00 0.00 H ATOM 2446 HE2 LYS A 154 3.538 35.201 0.594 1.00 0.00 H ATOM 2447 HE3 LYS A 154 2.783 33.640 0.991 1.00 0.00 H ATOM 2448 HZ1 LYS A 154 4.968 34.065 -0.980 1.00 0.00 H ATOM 2449 HZ2 LYS A 154 4.247 32.574 -0.602 1.00 0.00 H ATOM 2450 HZ3 LYS A 154 3.331 33.795 -1.347 1.00 0.00 H ATOM 2451 H LYS A 154 6.184 35.749 4.632 1.00 0.00 H ATOM 2452 N LEU A 155 7.465 31.588 3.997 1.00 18.98 N ATOM 2453 CA LEU A 155 8.477 30.661 4.502 1.00 15.02 C ATOM 2454 C LEU A 155 9.702 30.654 3.597 1.00 4.37 C ATOM 2455 O LEU A 155 9.636 30.688 2.369 1.00 17.61 O ATOM 2456 CB LEU A 155 7.894 29.253 4.648 1.00 13.62 C ATOM 2457 CG LEU A 155 6.741 29.066 5.631 1.00 14.82 C ATOM 2458 CD1 LEU A 155 6.410 27.587 5.802 1.00 4.54 C ATOM 2459 CD2 LEU A 155 7.040 29.667 6.995 1.00 3.75 C ATOM 2460 HA LEU A 155 8.791 31.001 5.489 1.00 0.00 H ATOM 2461 HB2 LEU A 155 7.539 28.943 3.665 1.00 0.00 H ATOM 2462 HB3 LEU A 155 8.703 28.595 4.965 1.00 0.00 H ATOM 2463 HG LEU A 155 5.886 29.592 5.206 1.00 0.00 H ATOM 2464 HD21 LEU A 155 7.924 29.187 7.416 1.00 0.00 H ATOM 2465 HD22 LEU A 155 7.222 30.736 6.888 1.00 0.00 H ATOM 2466 HD23 LEU A 155 6.188 29.507 7.656 1.00 0.00 H ATOM 2467 HD11 LEU A 155 6.123 27.166 4.838 1.00 0.00 H ATOM 2468 HD12 LEU A 155 7.286 27.062 6.183 1.00 0.00 H ATOM 2469 HD13 LEU A 155 5.586 27.480 6.507 1.00 0.00 H ATOM 2470 H LEU A 155 6.715 31.264 3.354 1.00 0.00 H ATOM 2471 N ASN A 156 10.874 30.600 4.228 1.00 3.79 N ATOM 2472 CA ASN A 156 12.079 30.313 3.456 1.00 9.11 C ATOM 2473 C ASN A 156 12.263 28.801 3.394 1.00 4.74 C ATOM 2474 O ASN A 156 11.936 28.091 4.338 1.00 12.13 O ATOM 2475 CB ASN A 156 13.303 30.996 4.072 1.00 4.12 C ATOM 2476 CG ASN A 156 13.029 32.495 4.154 1.00 11.92 C ATOM 2477 OD1 ASN A 156 12.707 33.107 3.139 1.00 31.10 O ATOM 2478 ND2 ASN A 156 13.131 33.058 5.344 1.00 11.65 N ATOM 2479 HA ASN A 156 11.972 30.709 2.446 1.00 0.00 H ATOM 2480 HB2 ASN A 156 13.482 30.599 5.071 1.00 0.00 H ATOM 2481 HB3 ASN A 156 14.178 30.815 3.448 1.00 0.00 H ATOM 2482 HD22 ASN A 156 13.408 32.487 6.168 1.00 0.00 H ATOM 2483 HD21 ASN A 156 12.934 34.073 5.458 1.00 0.00 H ATOM 2484 H ASN A 156 10.929 30.760 5.254 1.00 0.00 H ATOM 2485 N LYS A 157 12.777 28.290 2.286 1.00 5.13 N ATOM 2486 CA LYS A 157 13.062 26.861 2.225 1.00 7.41 C ATOM 2487 C LYS A 157 14.289 26.536 3.068 1.00 15.15 C ATOM 2488 O LYS A 157 15.254 27.301 3.096 1.00 10.49 O ATOM 2489 CB LYS A 157 13.301 26.424 0.787 1.00 6.73 C ATOM 2490 CG LYS A 157 12.133 26.587 -0.163 1.00 15.02 C ATOM 2491 CD LYS A 157 11.199 25.393 -0.128 1.00 11.04 C ATOM 2492 CE LYS A 157 9.846 25.670 -0.761 1.00 3.88 C ATOM 2493 NZ LYS A 157 9.938 26.139 -2.160 1.00 3.87 N ATOM 2494 HA LYS A 157 12.200 26.322 2.618 1.00 0.00 H ATOM 2495 HB2 LYS A 157 14.133 27.009 0.395 1.00 0.00 H ATOM 2496 HB3 LYS A 157 13.575 25.369 0.801 1.00 0.00 H ATOM 2497 HG2 LYS A 157 11.574 27.480 0.117 1.00 0.00 H ATOM 2498 HG3 LYS A 157 12.517 26.704 -1.176 1.00 0.00 H ATOM 2499 HD2 LYS A 157 11.670 24.569 -0.664 1.00 0.00 H ATOM 2500 HD3 LYS A 157 11.043 25.106 0.912 1.00 0.00 H ATOM 2501 HE2 LYS A 157 9.339 26.435 -0.173 1.00 0.00 H ATOM 2502 HE3 LYS A 157 9.261 24.751 -0.742 1.00 0.00 H ATOM 2503 HZ1 LYS A 157 10.486 27.022 -2.193 1.00 0.00 H ATOM 2504 HZ2 LYS A 157 10.411 25.414 -2.737 1.00 0.00 H ATOM 2505 HZ3 LYS A 157 8.981 26.309 -2.531 1.00 0.00 H ATOM 2506 H LYS A 157 12.975 28.901 1.468 1.00 0.00 H ATOM 2507 N TRP A 158 14.240 25.393 3.744 1.00 13.58 N ATOM 2508 CA TRP A 158 15.411 24.938 4.482 1.00 15.70 C ATOM 2509 C TRP A 158 16.644 24.928 3.577 1.00 6.72 C ATOM 2510 O TRP A 158 17.741 25.230 4.072 1.00 13.48 O ATOM 2511 CB TRP A 158 15.188 23.546 5.075 1.00 11.69 C ATOM 2512 CG TRP A 158 16.376 23.065 5.850 1.00 13.24 C ATOM 2513 CD1 TRP A 158 17.413 22.296 5.406 1.00 16.91 C ATOM 2514 CD2 TRP A 158 16.637 23.341 7.234 1.00 10.19 C ATOM 2515 NE1 TRP A 158 18.303 22.077 6.432 1.00 19.50 N ATOM 2516 CE2 TRP A 158 17.848 22.706 7.561 1.00 13.78 C ATOM 2517 CE3 TRP A 158 15.950 24.063 8.212 1.00 13.92 C ATOM 2518 CZ2 TRP A 158 18.395 22.772 8.842 1.00 14.02 C ATOM 2519 CZ3 TRP A 158 16.488 24.134 9.483 1.00 15.81 C ATOM 2520 CH2 TRP A 158 17.700 23.489 9.778 1.00 9.39 C ATOM 2521 HA TRP A 158 15.577 25.636 5.303 1.00 0.00 H ATOM 2522 OXT TRP A 158 16.464 24.621 2.376 1.00 9.07 O ATOM 2523 HB2 TRP A 158 14.325 23.581 5.740 1.00 0.00 H ATOM 2524 HB3 TRP A 158 14.991 22.846 4.263 1.00 0.00 H ATOM 2525 HE1 TRP A 158 19.180 21.523 6.362 1.00 0.00 H ATOM 2526 HD1 TRP A 158 17.520 21.913 4.391 1.00 0.00 H ATOM 2527 HZ2 TRP A 158 19.334 22.275 9.087 1.00 0.00 H ATOM 2528 HH2 TRP A 158 18.102 23.562 10.789 1.00 0.00 H ATOM 2529 HZ3 TRP A 158 15.969 24.694 10.261 1.00 0.00 H ATOM 2530 HE3 TRP A 158 15.009 24.560 7.978 1.00 0.00 H ATOM 2531 H TRP A 158 13.369 24.825 3.746 1.00 0.00 H TER 2532 TRP A 158 HETATM 2533 MG MG A 1 3.608 19.552 20.800 1.00 18.53 MG HETATM 2534 O HOH 2 2.028 19.110 20.004 1.00 14.09 O HETATM 2535 O HOH 3 4.601 18.887 19.225 1.00 19.48 O HETATM 2536 O HOH 4 4.992 5.623 1.410 1.00 8.37 O HETATM 2537 O HOH 5 -9.206 16.889 11.131 1.00 6.10 O HETATM 2538 O HOH 6 3.673 31.441 12.265 1.00 5.86 O HETATM 2539 O HOH 7 5.053 21.837 10.202 1.00 13.33 O HETATM 2540 O HOH 8 13.144 6.788 13.784 1.00 14.53 O HETATM 2541 O HOH 9 7.646 30.248 13.683 1.00 25.17 O HETATM 2542 O HOH 10 -4.659 17.146 -1.688 1.00 26.00 O HETATM 2543 O HOH 11 -6.339 27.250 15.642 1.00 15.29 O HETATM 2544 O HOH 12 20.449 21.218 3.910 1.00 22.02 O HETATM 2545 O HOH 13 3.350 11.921 18.114 1.00 30.44 O HETATM 2546 O HOH 14 4.303 32.451 8.682 1.00 15.28 O HETATM 2547 O HOH 15 3.735 34.674 10.214 1.00 24.26 O HETATM 2548 O HOH 16 -17.669 19.340 9.661 1.00 22.78 O HETATM 2549 O HOH 17 -8.479 2.478 18.685 1.00 8.67 O HETATM 2550 O HOH 18 13.556 6.385 10.975 1.00 21.24 O HETATM 2551 O HOH 19 0.002 18.905 21.970 1.00 15.85 O HETATM 2552 O HOH 20 -6.558 34.786 7.953 1.00 14.05 O HETATM 2553 O HOH 21 -13.086 30.415 4.815 1.00 28.81 O HETATM 2554 O HOH 22 4.982 10.317 -1.097 1.00 17.45 O HETATM 2555 O HOH 23 5.300 1.769 13.168 1.00 12.53 O HETATM 2556 O HOH 24 -1.469 1.505 17.694 1.00 16.89 O HETATM 2557 O HOH 25 10.903 30.988 7.224 1.00 12.74 O HETATM 2558 O HOH 26 -5.857 30.282 19.564 1.00 5.09 O HETATM 2559 O HOH 27 0.999 27.075 -2.059 1.00 22.76 O HETATM 2560 O HOH 28 3.884 39.294 5.670 1.00 20.49 O HETATM 2561 O HOH 29 -2.142 2.245 2.982 1.00 15.96 O HETATM 2562 O HOH 30 -8.605 5.181 21.927 1.00 23.29 O HETATM 2563 O HOH 31 -11.714 20.251 -0.418 1.00 11.25 O HETATM 2564 O HOH 32 -9.350 2.651 8.533 1.00 15.51 O HETATM 2565 O HOH 33 14.742 16.722 22.064 1.00 15.57 O HETATM 2566 O HOH 34 -8.793 7.138 18.170 1.00 10.46 O HETATM 2567 O HOH 35 -11.471 20.144 18.585 1.00 40.69 O HETATM 2568 O HOH 36 -10.919 10.643 26.578 1.00 52.24 O HETATM 2569 O HOH 37 -0.444 10.777 24.744 1.00 13.39 O HETATM 2570 O HOH 38 -4.496 -4.840 4.575 1.00 24.03 O HETATM 2571 O HOH 39 7.362 32.194 9.759 1.00 15.41 O HETATM 2572 O HOH 40 2.006 36.354 3.330 1.00 19.29 O HETATM 2573 O HOH 41 21.448 20.844 14.691 1.00 10.23 O HETATM 2574 O HOH 42 18.507 24.428 12.827 1.00 13.53 O HETATM 2575 O HOH 43 -9.026 21.647 18.083 1.00 15.76 O HETATM 2576 O HOH 44 9.260 6.220 4.022 1.00 26.41 O HETATM 2577 O HOH 45 -15.499 14.037 13.711 1.00 17.88 O HETATM 2578 O HOH 46 5.778 3.588 15.320 1.00 32.08 O HETATM 2579 O HOH 47 9.655 22.740 25.296 1.00 16.23 O HETATM 2580 O HOH 48 5.466 30.406 2.549 1.00 17.69 O HETATM 2581 O HOH 49 -6.346 3.387 21.989 1.00 21.96 O HETATM 2582 O HOH 50 -8.385 28.790 15.718 1.00 19.65 O HETATM 2583 O HOH 51 14.915 28.408 24.741 1.00 26.83 O HETATM 2584 O HOH 52 8.386 18.769 24.857 1.00 31.48 O HETATM 2585 O HOH 53 13.539 30.220 -0.115 1.00 46.17 O HETATM 2586 O HOH 54 8.933 33.064 7.646 1.00 21.95 O HETATM 2587 O HOH 55 -9.085 23.294 19.732 1.00 16.51 O HETATM 2588 O HOH 56 20.294 23.769 3.313 1.00 17.52 O HETATM 2589 O HOH 57 6.448 10.916 22.268 1.00 19.62 O HETATM 2590 O HOH 58 7.788 12.845 23.399 1.00 46.87 O HETATM 2591 O HOH 59 -8.180 34.561 10.862 1.00 47.19 O HETATM 2592 O HOH 60 -2.155 20.473 22.009 1.00 17.09 O HETATM 2593 O HOH 61 6.281 39.090 6.100 1.00 18.75 O HETATM 2594 O HOH 62 3.338 1.080 5.817 1.00 11.87 O HETATM 2595 O HOH 63 -11.150 18.819 7.844 1.00 28.54 O HETATM 2596 O HOH 64 2.594 26.946 0.636 1.00 10.32 O HETATM 2597 O HOH 65 7.566 41.028 8.086 1.00 29.05 O HETATM 2598 O HOH 66 1.735 -0.487 5.208 1.00 33.31 O HETATM 2599 O HOH 67 3.743 5.944 -0.710 1.00 13.87 O HETATM 2600 O HOH 68 -3.630 19.752 19.763 1.00 15.69 O HETATM 2601 O HOH 69 7.669 6.347 1.730 1.00 19.60 O HETATM 2602 O HOH 70 9.951 35.347 22.125 1.00 19.40 O HETATM 2603 O HOH 71 -10.372 19.652 3.117 1.00 24.58 O HETATM 2604 O HOH 72 0.683 25.792 22.458 1.00 16.52 O HETATM 2605 O HOH 73 -7.482 24.560 15.224 1.00 29.83 O HETATM 2606 O HOH 74 -10.345 9.387 18.556 1.00 16.89 O HETATM 2607 O HOH 75 -0.506 25.205 -3.056 1.00 23.31 O HETATM 2608 O HOH 76 -15.919 19.721 19.187 1.00 47.10 O HETATM 2609 O HOH 77 3.648 1.194 3.299 1.00 37.84 O HETATM 2610 O HOH 78 -13.660 13.593 20.415 1.00 20.31 O HETATM 2611 O HOH 79 8.343 29.527 0.002 1.00 25.41 O HETATM 2612 O HOH 80 0.838 13.392 27.360 1.00 33.49 O HETATM 2613 O HOH 81 6.848 20.744 27.180 1.00 29.23 O HETATM 2614 O HOH 82 -13.729 8.395 25.062 1.00 89.80 O HETATM 2615 O HOH 83 -9.589 19.166 23.227 1.00 33.84 O HETATM 2616 O HOH 84 7.391 3.127 11.673 1.00 20.55 O HETATM 2617 O HOH 85 -10.128 4.517 23.681 1.00 40.68 O HETATM 2618 O HOH 86 2.975 4.766 -3.449 1.00 20.56 O HETATM 2619 O HOH 87 -1.847 40.701 8.087 1.00 10.34 O HETATM 2620 O HOH 88 5.398 3.082 2.835 1.00 8.91 O HETATM 2621 O HOH 89 15.323 33.763 15.750 1.00 19.90 O HETATM 2622 O HOH 90 6.720 -1.292 8.466 1.00 51.67 O HETATM 2623 O HOH 91 -7.098 25.593 18.745 1.00 20.11 O HETATM 2624 O HOH 92 9.292 28.031 20.161 1.00 14.52 O HETATM 2625 O HOH 93 17.261 26.564 25.330 1.00 39.98 O HETATM 2626 O HOH 94 -9.942 4.700 18.974 1.00 19.37 O HETATM 2627 O HOH 95 -2.721 15.468 -0.685 1.00 41.41 O HETATM 2628 O HOH 96 -8.348 26.093 0.874 1.00 25.88 O HETATM 2629 O HOH 97 6.186 29.794 10.736 1.00 13.12 O HETATM 2630 O HOH 98 -9.532 4.825 6.543 1.00 16.33 O HETATM 2631 O HOH 99 0.419 23.440 21.341 1.00 26.84 O HETATM 2632 O HOH 100 19.073 26.429 11.222 1.00 21.89 O HETATM 2633 O HOH 101 -6.063 16.744 24.118 1.00 15.69 O HETATM 2634 O HOH 102 -4.126 33.274 -0.720 1.00 39.42 O HETATM 2635 O HOH 103 18.971 27.864 12.922 1.00 47.20 O HETATM 2636 O HOH 104 -8.394 22.727 22.892 1.00 35.10 O HETATM 2637 O HOH 105 2.052 13.282 20.615 1.00 20.91 O HETATM 2638 O HOH 106 10.175 17.029 0.736 1.00 21.80 O HETATM 2639 O HOH 107 -12.783 3.703 23.692 1.00 26.70 O HETATM 2640 O HOH 108 -12.585 8.147 21.852 1.00 44.79 O HETATM 2641 O HOH 109 -5.172 41.650 8.375 1.00 24.85 O HETATM 2642 O HOH 110 19.612 22.864 15.205 1.00 23.18 O HETATM 2643 O HOH 111 12.113 20.886 0.102 1.00 16.53 O HETATM 2644 O HOH 112 4.315 16.510 19.354 1.00 22.67 O HETATM 2645 O HOH 113 3.181 21.841 17.591 1.00 14.68 O HETATM 2646 O HOH 114 3.558 20.688 29.567 1.00 22.54 O HETATM 2647 O HOH 115 18.485 10.469 8.353 1.00 28.93 O HETATM 2648 O HOH 116 -16.222 29.166 9.647 1.00 28.05 O HETATM 2649 O HOH 117 14.125 22.880 1.472 1.00 17.34 O HETATM 2650 O HOH 118 -10.915 35.261 10.425 1.00 23.60 O HETATM 2651 O HOH 119 -10.728 18.412 0.683 1.00 32.18 O HETATM 2652 O HOH 120 -7.866 40.691 5.994 1.00 28.79 O HETATM 2653 O HOH 121 -11.650 7.652 5.341 1.00 75.15 O HETATM 2654 O HOH 122 15.352 33.822 12.876 1.00 49.91 O HETATM 2655 O HOH 123 3.496 23.594 30.279 1.00 25.30 O HETATM 2656 O HOH 124 -13.362 5.694 21.123 1.00 83.54 O HETATM 2657 O HOH 125 8.620 2.534 15.398 1.00 46.60 O HETATM 2658 O HOH 126 -2.966 30.961 -4.343 1.00 36.24 O HETATM 2659 O HOH 127 13.496 35.091 22.618 1.00 37.09 O HETATM 2660 O HOH 128 -10.334 6.100 26.325 1.00 22.32 O HETATM 2661 O HOH 129 -12.488 10.322 16.481 1.00 39.03 O HETATM 2662 O HOH 130 19.156 26.350 23.221 1.00 41.53 O HETATM 2663 O HOH 131 -8.210 5.465 9.856 1.00 24.76 O HETATM 2664 O HOH 132 12.913 17.995 0.333 1.00 24.76 O HETATM 2665 O HOH 133 -15.018 22.498 13.747 1.00 22.95 O HETATM 2666 O HOH 134 22.251 24.070 15.987 1.00 27.65 O HETATM 2667 O HOH 135 17.865 11.399 17.874 1.00 34.78 O HETATM 2668 O HOH 136 0.176 23.728 24.435 1.00 25.19 O HETATM 2669 O HOH 137 5.086 19.420 14.605 1.00 27.93 O HETATM 2670 O HOH 138 -12.392 7.299 16.137 1.00 72.08 O HETATM 2671 O HOH 139 16.347 5.634 20.785 1.00 65.33 O HETATM 2672 O HOH 140 -9.159 17.489 7.112 1.00 26.92 O HETATM 2673 O HOH 141 16.709 29.022 27.332 1.00 41.12 O HETATM 2674 O HOH 142 -11.914 7.562 9.774 1.00 33.67 O HETATM 2675 O HOH 143 17.404 8.624 23.398 1.00 34.02 O HETATM 2676 O HOH 144 4.517 14.253 21.300 1.00 20.04 O HETATM 2677 O HOH 145 19.070 13.450 21.267 1.00 35.44 O HETATM 2678 O HOH 146 -1.421 33.519 -5.690 1.00 43.39 O HETATM 2679 O HOH 147 -3.837 27.388 26.411 1.00 34.65 O HETATM 2680 O HOH 148 9.728 3.580 4.308 1.00 36.11 O HETATM 2681 O HOH 149 19.019 9.811 20.562 1.00 62.98 O HETATM 2682 O HOH 150 -11.752 7.596 13.440 1.00 19.47 O HETATM 2683 O HOH 151 21.677 9.319 7.107 1.00 28.51 O HETATM 2684 O HOH 152 -2.266 37.986 2.465 1.00 30.35 O HETATM 2685 O HOH 153 4.172 13.632 24.454 1.00 37.55 O HETATM 2686 O HOH 154 -9.664 11.357 4.019 1.00 58.85 O HETATM 2687 O HOH 155 11.001 -0.413 9.258 1.00 37.68 O HETATM 2688 O HOH 156 3.409 25.385 -3.943 1.00 33.79 O HETATM 2689 O HOH 157 20.591 6.403 8.115 1.00 24.90 O HETATM 2690 O HOH 158 -15.103 20.397 5.554 1.00 27.50 O HETATM 2691 O HOH 159 14.007 32.833 26.158 1.00 23.70 O HETATM 2692 O HOH 160 13.767 10.167 23.667 1.00 64.61 O HETATM 2693 O HOH 161 14.390 31.945 9.719 1.00 35.84 O HETATM 2694 O HOH 162 -2.594 31.748 0.516 1.00 36.69 O HETATM 2695 O HOH 163 20.218 28.009 21.720 1.00 50.91 O HETATM 2696 O HOH 164 -0.312 12.050 30.310 1.00 31.83 O HETATM 2697 O HOH 165 20.229 12.820 18.820 1.00 47.28 O HETATM 2698 O HOH 166 16.816 31.102 16.039 1.00 43.75 O HETATM 2699 O HOH 167 14.350 29.496 28.565 1.00 56.56 O HETATM 2700 O HOH 168 -10.047 24.047 15.383 1.00 30.19 O HETATM 2701 N9R A A 4 -1.731 16.020 21.745 1.00 -0.19 N HETATM 2702 C4R A A 4 -1.312 15.894 20.434 1.00 0.16 C HETATM 2703 C5R A A 4 -2.338 16.440 19.667 1.00 0.10 C HETATM 2704 N7R A A 4 -3.421 16.922 20.450 1.00 -0.30 N HETATM 2705 C8R A A 4 -3.008 16.649 21.661 1.00 0.11 C HETATM 2706 H1 A A 4 -3.599 16.886 22.544 1.00 0.13 H HETATM 2707 C6R A A 4 -2.244 16.479 18.243 1.00 0.13 C HETATM 2708 N1R A A 4 -1.014 15.912 17.670 1.00 -0.27 N HETATM 2709 C2R A A 4 -0.102 15.418 18.498 1.00 0.05 C HETATM 2710 N3R A A 4 -0.122 15.345 19.891 1.00 -0.27 N HETATM 2711 H5 A A 4 0.785 15.014 18.024 1.00 0.10 H HETATM 2712 N6R A A 4 -3.075 16.934 17.408 1.00 -0.32 N HETATM 2713 H2 A A 4 -2.867 16.893 16.400 1.00 0.18 H HETATM 2714 H3 A A 4 -3.960 17.346 17.735 1.00 0.18 H HETATM 2715 C1R A A 4 -1.250 15.581 23.085 1.00 0.20 C HETATM 2716 C2' A A 4 -0.526 14.243 23.143 1.00 0.14 C HETATM 2717 C3' A A 4 0.811 14.606 23.774 1.00 0.11 C HETATM 2718 C4' A A 4 0.524 15.864 24.495 1.00 0.12 C HETATM 2719 O4' A A 4 -0.383 16.552 23.604 1.00 -0.34 O HETATM 2720 C5' A A 4 1.679 16.748 24.797 1.00 0.11 C HETATM 2721 O5' A A 4 2.338 17.056 23.485 1.00 -0.25 O HETATM 2722 PA A A 4 3.731 17.847 23.459 1.00 0.30 P HETATM 2723 O3A A A 4 3.503 19.032 24.417 1.00 -0.13 O HETATM 2724 PB A A 4 2.852 20.442 23.871 1.00 0.34 P HETATM 2725 O3B A A 4 4.132 21.466 23.999 1.00 -0.12 O HETATM 2726 PG A A 4 5.002 21.847 22.869 1.00 0.34 P HETATM 2727 O3G A A 4 4.272 23.014 22.102 1.00 -0.13 O HETATM 2728 PD A A 4 3.682 22.874 20.610 1.00 0.30 P HETATM 2729 O3D A A 4 4.704 22.997 19.523 1.00 -0.23 O HETATM 2730 C6A A A 4 6.012 23.266 19.904 1.00 0.14 C HETATM 2731 C6 A A 4 6.601 24.146 18.877 1.00 0.08 C HETATM 2732 C7 A A 4 7.016 25.534 19.335 1.00 0.04 C HETATM 2733 N8 A A 4 7.543 26.268 18.333 1.00 -0.28 N HETATM 2734 C9 A A 4 7.749 25.957 17.027 1.00 0.10 C HETATM 2735 C10 A A 4 7.326 24.591 16.635 1.00 0.15 C HETATM 2736 N5 A A 4 6.756 23.708 17.580 1.00 -0.26 N HETATM 2737 C4 A A 4 7.535 24.230 15.242 1.00 0.26 C HETATM 2738 N3 A A 4 8.104 25.211 14.451 1.00 -0.17 N HETATM 2739 C2 A A 4 8.494 26.505 14.862 1.00 0.24 C HETATM 2740 N1 A A 4 8.299 26.822 16.133 1.00 -0.28 N HETATM 2741 N2 A A 4 9.022 27.320 13.981 1.00 -0.28 N HETATM 2742 H13 A A 4 9.312 28.267 14.264 1.00 0.19 H HETATM 2743 H14 A A 4 9.147 27.013 13.006 1.00 0.19 H HETATM 2744 H15 A A 4 8.255 24.981 13.490 1.00 0.25 H HETATM 2745 O4 A A 4 7.248 23.110 14.683 1.00 -0.38 O HETATM 2746 H18 A A 4 6.902 25.894 20.351 1.00 0.09 H HETATM 2747 H16 A A 4 6.585 22.329 19.969 1.00 0.08 H HETATM 2748 H17 A A 4 6.022 23.770 20.881 1.00 0.08 H HETATM 2749 O2D A A 4 3.060 21.494 20.588 1.00 -0.61 O HETATM 2750 O1D A A 4 2.547 23.875 20.595 1.00 -0.61 O HETATM 2751 O2G A A 4 6.298 22.301 23.461 1.00 -0.61 O HETATM 2752 O1G A A 4 5.137 20.691 21.874 1.00 -0.61 O HETATM 2753 O2B A A 4 2.468 20.334 22.420 1.00 -0.61 O HETATM 2754 O1B A A 4 1.855 21.008 24.850 1.00 -0.61 O HETATM 2755 O2A A A 4 4.889 17.053 24.022 1.00 -0.61 O HETATM 2756 O1A A A 4 3.901 18.216 22.028 1.00 -0.61 O HETATM 2757 H6 A A 4 2.386 16.234 25.465 1.00 0.06 H HETATM 2758 H7 A A 4 1.332 17.676 25.274 1.00 0.06 H HETATM 2759 H8 A A 4 0.026 15.625 25.446 1.00 0.07 H HETATM 2760 O3' A A 4 1.324 13.604 24.613 1.00 -0.39 O HETATM 2761 H10 A A 4 0.711 13.439 25.320 1.00 0.21 H HETATM 2762 H9 A A 4 1.552 14.793 22.983 1.00 0.06 H HETATM 2763 O2' A A 4 -1.261 13.305 23.974 1.00 -0.38 O HETATM 2764 H12 A A 4 -0.750 12.511 24.081 1.00 0.21 H HETATM 2765 H11 A A 4 -0.389 13.819 22.138 1.00 0.07 H HETATM 2766 H4 A A 4 -2.133 15.506 23.737 1.00 0.10 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 2701 2702 2705 2715 CONECT 2702 2701 2703 2710 CONECT 2703 2702 2704 2707 CONECT 2704 2703 2705 CONECT 2705 2701 2704 2706 CONECT 2706 2705 CONECT 2707 2703 2708 2712 CONECT 2708 2707 2709 CONECT 2709 2708 2710 2711 CONECT 2710 2702 2709 CONECT 2711 2709 CONECT 2712 2707 2713 2714 CONECT 2713 2712 CONECT 2714 2712 CONECT 2715 2701 2716 2719 2766 CONECT 2716 2715 2717 2763 2765 CONECT 2717 2716 2718 2760 2762 CONECT 2718 2717 2719 2720 2759 CONECT 2719 2715 2718 CONECT 2720 2718 2721 2757 2758 CONECT 2721 2720 2722 CONECT 2722 2721 2723 2755 2756 CONECT 2723 2722 2724 CONECT 2724 2723 2725 2753 2754 CONECT 2725 2724 2726 CONECT 2726 2725 2727 2751 2752 CONECT 2727 2726 2728 CONECT 2728 2727 2729 2749 2750 CONECT 2729 2728 2730 CONECT 2730 2729 2731 2747 2748 CONECT 2731 2730 2732 2736 CONECT 2732 2731 2733 2746 CONECT 2733 2732 2734 CONECT 2734 2733 2735 2740 CONECT 2735 2734 2736 2737 CONECT 2736 2731 2735 CONECT 2737 2735 2738 2745 CONECT 2738 2737 2739 2744 CONECT 2739 2738 2740 2741 CONECT 2740 2734 2739 CONECT 2741 2739 2742 2743 CONECT 2742 2741 CONECT 2743 2741 CONECT 2744 2738 CONECT 2745 2737 CONECT 2746 2732 CONECT 2747 2730 CONECT 2748 2730 CONECT 2749 2728 CONECT 2750 2728 CONECT 2751 2726 CONECT 2752 2726 CONECT 2753 2724 CONECT 2754 2724 CONECT 2755 2722 CONECT 2756 2722 CONECT 2757 2720 CONECT 2758 2720 CONECT 2759 2718 CONECT 2760 2717 2761 CONECT 2761 2760 CONECT 2762 2717 CONECT 2763 2716 2764 CONECT 2764 2763 CONECT 2765 2716 CONECT 2766 2715 MASTER 0 0 0 0 0 0 0 0 2765 1 70 13 END
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Related entries of code: 1ex8
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
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PDBbind
152aa, >1RU1_1|Chains... at 99%
1ru2
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152aa, >1RU2_1|Chain... at 99%
1tmm
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158aa, >1TMM_1|Chains... at 99%
3ud5
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PDBbind
158aa, >3UD5_1|Chain... at 100%
3udv
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PDBbind
158aa, >3UDV_1|Chain... at 100%
4f7v
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PDBbind
158aa, >4F7V_1|Chain... at 100%
4m5g
RCSB PDB
PDBbind
162aa, >4M5G_1|Chain... *
4m5h
RCSB PDB
PDBbind
162aa, >4M5H_1|Chain... at 100%
4m5i
RCSB PDB
PDBbind
162aa, >4M5I_1|Chain... at 100%
4m5j
RCSB PDB
PDBbind
162aa, >4M5J_1|Chain... at 100%
4m5k
RCSB PDB
PDBbind
162aa, >4M5K_1|Chain... at 100%
4m5l
RCSB PDB
PDBbind
162aa, >4M5L_1|Chain... at 100%
4m5m
RCSB PDB
PDBbind
162aa, >4M5M_1|Chain... at 100%
4m5n
RCSB PDB
PDBbind
162aa, >4M5N_1|Chains... at 100%
5etk
RCSB PDB
PDBbind
162aa, >5ETK_1|Chain... at 99%
5etl
RCSB PDB
PDBbind
162aa, >5ETL_1|Chains... at 99%
5etm
RCSB PDB
PDBbind
162aa, >5ETM_1|Chain... at 99%
5etn
RCSB PDB
PDBbind
162aa, >5ETN_1|Chain... at 99%
5eto
RCSB PDB
PDBbind
162aa, >5ETO_1|Chain... at 99%
5etp
RCSB PDB
PDBbind
162aa, >5ETP_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
1ex8
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
6-hydroxymethyl-7,8-dihydropterin pyrophosphokinase
Ligand Name
A4P
EC.Number
E.C.2.7.6.3
Resolution
1.85(Å)
Affinity (Kd/Ki/IC50)
Kd=0.47uM
Release Year
2001
Protein/NA Sequence
Check fasta file
Primary Reference
J.Med.Chem. v44 pp. 1364-71, 2001
Ligand Properties
Formula
C
1
7
H
2
6
N
1
0
O
1
7
P
4
Molecular Weight
766.340
Exact Mass
766.043
No. of atoms
74
No. of bonds
78
Polar Surface Area
479.21
LOGP Value
-8.37 (
Computed with XLOGP3
)
-2.27 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 15
No. of Nitrogen and Oxygen Atoms: 27
No. of Rings: 5
Canonical SMILES
Nc1nc2ncc(nc2c(=O)[nH]1)COP(OP(OP(OP(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)(O)O)(O)O)(O)O)(O)O
InChI String
InChI=1S/C17H30N10O17P4/c18-12-8-14(22-4-21-12)27(5-23-8)16-11(29)10(28)7(41-16)3-40-46(33,34)43-48(37,38)44-47(35,36)42-45(31,32)39-2-6-1-20-13-9(24-6)15(30)26-17(19)25-13/h1,4-5,7,10-11,16,28-29,31-38,45-48H,2-3H2,(H2,18,21,22)(H3,19,20,25,26,30)/t7-,10-,11-,16-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P26281
Entrez Gene ID
NCBI Entrez Gene ID:
948792
ASD
Information of known allosteric effects of PDB entries
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