Browse entries in the PDBbind-CN Database
HEADER 4LUO_COMPLEX COMPND 4LUO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 123 GLY SER HIS MET VAL GLY GLN LEU SER ARG GLY ALA ILE SEQRES 2 A 123 ALA ALA ILE MET GLN LYS GLY ASP THR ASN ILE LYS PRO SEQRES 3 A 123 ILE LEU GLN VAL ILE ASN ILE ARG PRO ILE THR THR GLY SEQRES 4 A 123 ASN SER PRO PRO ARG TYR ARG LEU LEU MET SER ASP GLY SEQRES 5 A 123 LEU ASN THR LEU SER SER PHE MET LEU ALA THR GLN LEU SEQRES 6 A 123 ASN PRO LEU VAL GLU GLU GLU GLN LEU SER SER ASN CYS SEQRES 7 A 123 VAL CYS GLN ILE HIS ARG PHE ILE VAL ASN THR LEU LYS SEQRES 8 A 123 ASP GLY ARG ARG VAL VAL ILE LEU MET GLU LEU GLU VAL SEQRES 9 A 123 LEU LYS SER ALA GLU ALA VAL GLY VAL LYS ILE GLY ASN SEQRES 10 A 123 PRO VAL PRO TYR ASN GLU HET UNN A 217 34 ATOM 1 N GLY A -2 1.560 -4.793 8.741 1.00 51.73 N ATOM 2 CA GLY A -2 0.904 -3.856 9.699 1.00 48.19 C ATOM 3 C GLY A -2 -0.133 -2.980 9.028 1.00 31.59 C ATOM 4 O GLY A -2 -0.439 -3.146 7.847 1.00 31.95 O ATOM 5 HA3 GLY A -2 1.667 -3.218 10.144 1.00 0.00 H ATOM 6 HA2 GLY A -2 0.418 -4.438 10.482 1.00 0.00 H ATOM 7 HN3 GLY A -2 2.034 -4.247 7.994 1.00 0.00 H ATOM 8 HN2 GLY A -2 0.841 -5.412 8.316 1.00 0.00 H ATOM 9 HN1 GLY A -2 2.261 -5.370 9.248 1.00 0.00 H ATOM 10 N SER A -1 -0.686 -2.049 9.797 1.00 31.61 N ATOM 11 CA SER A -1 -1.681 -1.115 9.285 1.00 33.49 C ATOM 12 C SER A -1 -1.110 -0.308 8.138 1.00 32.81 C ATOM 13 O SER A -1 0.107 -0.250 7.953 1.00 34.03 O ATOM 14 CB SER A -1 -2.154 -0.167 10.388 1.00 31.74 C ATOM 15 OG SER A -1 -2.894 -0.861 11.383 1.00 42.82 O ATOM 16 HA SER A -1 -2.532 -1.695 8.928 1.00 0.00 H ATOM 17 HB2 SER A -1 -2.787 0.603 9.947 1.00 0.00 H ATOM 18 HB3 SER A -1 -1.285 0.300 10.852 1.00 0.00 H ATOM 19 HG SER A -1 -3.186 -0.222 12.081 1.00 0.00 H ATOM 20 H SER A -1 -0.400 -1.984 10.795 1.00 0.00 H ATOM 21 N HIS A 0 -1.998 0.315 7.370 1.00 26.24 N ATOM 22 CA HIS A 0 -1.590 1.073 6.193 1.00 23.06 C ATOM 23 C HIS A 0 -0.780 0.188 5.252 1.00 21.11 C ATOM 24 O HIS A 0 0.348 0.515 4.882 1.00 24.42 O ATOM 25 CB HIS A 0 -0.766 2.290 6.612 1.00 29.99 C ATOM 26 CG HIS A 0 -0.556 3.274 5.509 1.00 27.87 C ATOM 27 ND1 HIS A 0 -1.600 3.762 4.752 1.00 41.76 N ATOM 28 CD2 HIS A 0 0.567 3.853 5.022 1.00 25.30 C ATOM 29 CE1 HIS A 0 -1.131 4.603 3.851 1.00 39.04 C ATOM 30 NE2 HIS A 0 0.178 4.679 3.992 1.00 31.99 N ATOM 31 HA HIS A 0 -2.482 1.416 5.669 1.00 0.00 H ATOM 32 HB2 HIS A 0 -1.283 2.792 7.430 1.00 0.00 H ATOM 33 HB3 HIS A 0 0.209 1.945 6.958 1.00 0.00 H ATOM 34 HD2 HIS A 0 1.585 3.695 5.378 1.00 0.00 H ATOM 35 HE1 HIS A 0 -1.725 5.144 3.114 1.00 0.00 H ATOM 36 H HIS A 0 -3.007 0.261 7.614 1.00 0.00 H ATOM 37 N MET A 1 -1.368 -0.940 4.866 1.00 20.51 N ATOM 38 CA MET A 1 -0.646 -1.943 4.098 1.00 19.79 C ATOM 39 C MET A 1 -0.099 -1.386 2.799 1.00 16.95 C ATOM 40 O MET A 1 0.983 -1.760 2.382 1.00 18.28 O ATOM 41 CB MET A 1 -1.526 -3.166 3.819 1.00 23.79 C ATOM 42 CG MET A 1 -1.630 -4.104 5.009 1.00 27.50 C ATOM 43 SD MET A 1 -2.620 -5.562 4.681 1.00 30.39 S ATOM 44 CE MET A 1 -4.225 -4.856 4.945 1.00 54.85 C ATOM 45 HA MET A 1 0.202 -2.252 4.709 1.00 0.00 H ATOM 46 HB2 MET A 1 -2.527 -2.822 3.558 1.00 0.00 H ATOM 47 HB3 MET A 1 -1.102 -3.716 2.979 1.00 0.00 H ATOM 48 HG2 MET A 1 -2.080 -3.560 5.840 1.00 0.00 H ATOM 49 HG3 MET A 1 -0.625 -4.423 5.287 1.00 0.00 H ATOM 50 HE1 MET A 1 -4.292 -4.481 5.966 1.00 0.00 H ATOM 51 HE2 MET A 1 -4.379 -4.035 4.245 1.00 0.00 H ATOM 52 HE3 MET A 1 -4.987 -5.619 4.786 1.00 0.00 H ATOM 53 H MET A 1 -2.363 -1.109 5.118 1.00 0.00 H ATOM 54 N VAL A 2 -0.836 -0.482 2.164 1.00 16.78 N ATOM 55 CA VAL A 2 -0.379 0.047 0.887 1.00 15.29 C ATOM 56 C VAL A 2 0.915 0.824 1.043 1.00 15.36 C ATOM 57 O VAL A 2 1.658 0.995 0.081 1.00 15.51 O ATOM 58 CB VAL A 2 -1.444 0.921 0.217 1.00 18.05 C ATOM 59 CG1 VAL A 2 -1.630 2.240 0.958 1.00 23.11 C ATOM 60 CG2 VAL A 2 -1.102 1.137 -1.250 1.00 26.82 C ATOM 61 HA VAL A 2 -0.193 -0.810 0.240 1.00 0.00 H ATOM 62 HB VAL A 2 -2.399 0.398 0.266 1.00 0.00 H ATOM 63 HG11 VAL A 2 -1.942 2.039 1.983 1.00 0.00 H ATOM 64 HG12 VAL A 2 -0.687 2.787 0.965 1.00 0.00 H ATOM 65 HG13 VAL A 2 -2.393 2.834 0.454 1.00 0.00 H ATOM 66 HG21 VAL A 2 -0.134 1.632 -1.327 1.00 0.00 H ATOM 67 HG22 VAL A 2 -1.060 0.173 -1.758 1.00 0.00 H ATOM 68 HG23 VAL A 2 -1.868 1.760 -1.712 1.00 0.00 H ATOM 69 H VAL A 2 -1.733 -0.154 2.576 1.00 0.00 H ATOM 70 N GLY A 3 1.192 1.281 2.260 1.00 15.64 N ATOM 71 CA GLY A 3 2.439 1.971 2.536 1.00 15.42 C ATOM 72 C GLY A 3 3.645 1.049 2.466 1.00 15.24 C ATOM 73 O GLY A 3 4.788 1.512 2.436 1.00 18.55 O ATOM 74 HA3 GLY A 3 2.386 2.402 3.536 1.00 0.00 H ATOM 75 HA2 GLY A 3 2.566 2.769 1.804 1.00 0.00 H ATOM 76 H GLY A 3 0.504 1.142 3.027 1.00 0.00 H ATOM 77 N GLN A 4 3.402 -0.256 2.417 1.00 17.00 N ATOM 78 CA GLN A 4 4.492 -1.217 2.324 1.00 17.40 C ATOM 79 C GLN A 4 5.028 -1.330 0.903 1.00 15.17 C ATOM 80 O GLN A 4 6.070 -1.946 0.688 1.00 17.34 O ATOM 81 CB GLN A 4 4.026 -2.604 2.774 1.00 24.64 C ATOM 82 CG GLN A 4 3.550 -2.666 4.214 1.00 35.62 C ATOM 83 CD GLN A 4 4.687 -2.557 5.210 1.00 58.00 C ATOM 84 OE1 GLN A 4 4.899 -1.507 5.815 1.00 63.17 O ATOM 85 NE2 GLN A 4 5.425 -3.648 5.387 1.00 65.66 N ATOM 86 HA GLN A 4 5.287 -0.854 2.976 1.00 0.00 H ATOM 87 HB2 GLN A 4 3.204 -2.914 2.129 1.00 0.00 H ATOM 88 HB3 GLN A 4 4.859 -3.298 2.659 1.00 0.00 H ATOM 89 HG2 GLN A 4 2.854 -1.845 4.387 1.00 0.00 H ATOM 90 HG3 GLN A 4 3.037 -3.615 4.372 1.00 0.00 H ATOM 91 HE22 GLN A 4 5.209 -4.514 4.853 1.00 0.00 H ATOM 92 HE21 GLN A 4 6.219 -3.636 6.059 1.00 0.00 H ATOM 93 H GLN A 4 2.420 -0.596 2.445 1.00 0.00 H ATOM 94 N LEU A 5 4.306 -0.765 -0.064 1.00 12.19 N ATOM 95 CA LEU A 5 4.685 -0.880 -1.467 1.00 11.01 C ATOM 96 C LEU A 5 5.171 0.448 -2.035 1.00 12.65 C ATOM 97 O LEU A 5 4.773 1.514 -1.577 1.00 13.85 O ATOM 98 CB LEU A 5 3.499 -1.372 -2.281 1.00 12.71 C ATOM 99 CG LEU A 5 2.872 -2.695 -1.836 1.00 13.37 C ATOM 100 CD1 LEU A 5 1.743 -3.083 -2.781 1.00 15.06 C ATOM 101 CD2 LEU A 5 3.901 -3.816 -1.758 1.00 15.18 C ATOM 102 HA LEU A 5 5.506 -1.594 -1.529 1.00 0.00 H ATOM 103 HB2 LEU A 5 2.725 -0.606 -2.236 1.00 0.00 H ATOM 104 HB3 LEU A 5 3.831 -1.492 -3.312 1.00 0.00 H ATOM 105 HG LEU A 5 2.471 -2.548 -0.833 1.00 0.00 H ATOM 106 HD21 LEU A 5 4.350 -3.964 -2.740 1.00 0.00 H ATOM 107 HD22 LEU A 5 4.676 -3.547 -1.040 1.00 0.00 H ATOM 108 HD23 LEU A 5 3.411 -4.736 -1.438 1.00 0.00 H ATOM 109 HD11 LEU A 5 0.980 -2.304 -2.773 1.00 0.00 H ATOM 110 HD12 LEU A 5 2.138 -3.195 -3.791 1.00 0.00 H ATOM 111 HD13 LEU A 5 1.305 -4.026 -2.454 1.00 0.00 H ATOM 112 H LEU A 5 3.451 -0.229 0.188 1.00 0.00 H ATOM 113 N SER A 6 6.033 0.364 -3.039 1.00 11.48 N ATOM 114 CA SER A 6 6.600 1.551 -3.671 1.00 10.57 C ATOM 115 C SER A 6 5.631 2.222 -4.637 1.00 14.40 C ATOM 116 O SER A 6 5.803 2.156 -5.856 1.00 14.69 O ATOM 117 CB SER A 6 7.868 1.167 -4.408 1.00 12.29 C ATOM 118 OG SER A 6 8.895 0.868 -3.482 1.00 13.22 O ATOM 119 HA SER A 6 6.816 2.271 -2.882 1.00 0.00 H ATOM 120 HB2 SER A 6 8.183 1.996 -5.041 1.00 0.00 H ATOM 121 HB3 SER A 6 7.674 0.292 -5.028 1.00 0.00 H ATOM 122 HG SER A 6 9.718 0.619 -3.973 1.00 0.00 H ATOM 123 H SER A 6 6.313 -0.575 -3.386 1.00 0.00 H ATOM 124 N ARG A 7 4.626 2.889 -4.094 1.00 13.07 N ATOM 125 CA ARG A 7 3.589 3.494 -4.914 1.00 13.26 C ATOM 126 C ARG A 7 4.233 4.459 -5.883 1.00 16.03 C ATOM 127 O ARG A 7 5.014 5.320 -5.478 1.00 17.06 O ATOM 128 CB ARG A 7 2.585 4.233 -4.036 1.00 13.29 C ATOM 129 CG ARG A 7 1.670 3.328 -3.247 1.00 15.90 C ATOM 130 CD ARG A 7 0.768 4.112 -2.328 1.00 17.35 C ATOM 131 NE ARG A 7 1.522 4.606 -1.183 1.00 16.80 N ATOM 132 CZ ARG A 7 0.986 5.299 -0.188 1.00 21.07 C ATOM 133 NH1 ARG A 7 -0.295 5.592 -0.201 1.00 26.06 N ATOM 134 NH2 ARG A 7 1.739 5.708 0.818 1.00 25.67 N ATOM 135 HA ARG A 7 3.059 2.716 -5.463 1.00 0.00 H ATOM 136 HB2 ARG A 7 3.138 4.857 -3.334 1.00 0.00 H ATOM 137 HB3 ARG A 7 1.971 4.866 -4.677 1.00 0.00 H ATOM 138 HG2 ARG A 7 1.056 2.754 -3.941 1.00 0.00 H ATOM 139 HG3 ARG A 7 2.276 2.646 -2.651 1.00 0.00 H ATOM 140 HD2 ARG A 7 -0.038 3.467 -1.978 1.00 0.00 H ATOM 141 HD3 ARG A 7 0.345 4.956 -2.872 1.00 0.00 H ATOM 142 HE ARG A 7 2.541 4.403 -1.144 1.00 0.00 H ATOM 143 HH12 ARG A 7 -0.712 6.136 0.581 1.00 0.00 H ATOM 144 HH11 ARG A 7 -0.892 5.280 -0.994 1.00 0.00 H ATOM 145 HH22 ARG A 7 1.316 6.251 1.597 1.00 0.00 H ATOM 146 HH21 ARG A 7 2.755 5.486 0.831 1.00 0.00 H ATOM 147 H ARG A 7 4.577 2.983 -3.059 1.00 0.00 H ATOM 148 N GLY A 8 3.921 4.287 -7.163 1.00 16.43 N ATOM 149 CA GLY A 8 4.442 5.154 -8.200 1.00 15.71 C ATOM 150 C GLY A 8 5.601 4.530 -8.949 1.00 16.28 C ATOM 151 O GLY A 8 6.023 5.060 -9.981 1.00 18.83 O ATOM 152 HA3 GLY A 8 4.781 6.083 -7.742 1.00 0.00 H ATOM 153 HA2 GLY A 8 3.643 5.371 -8.909 1.00 0.00 H ATOM 154 H GLY A 8 3.285 3.508 -7.428 1.00 0.00 H ATOM 155 N ALA A 9 6.126 3.418 -8.447 1.00 14.14 N ATOM 156 CA ALA A 9 7.274 2.788 -9.090 1.00 13.17 C ATOM 157 C ALA A 9 6.941 2.242 -10.473 1.00 13.79 C ATOM 158 O ALA A 9 7.787 2.271 -11.363 1.00 15.75 O ATOM 159 CB ALA A 9 7.833 1.695 -8.217 1.00 14.10 C ATOM 160 HA ALA A 9 8.028 3.563 -9.224 1.00 0.00 H ATOM 161 HB1 ALA A 9 8.149 2.119 -7.264 1.00 0.00 H ATOM 162 HB2 ALA A 9 7.065 0.941 -8.044 1.00 0.00 H ATOM 163 HB3 ALA A 9 8.688 1.237 -8.713 1.00 0.00 H ATOM 164 H ALA A 9 5.716 2.994 -7.590 1.00 0.00 H ATOM 165 N ILE A 10 5.728 1.733 -10.662 1.00 14.32 N ATOM 166 CA ILE A 10 5.377 1.195 -11.972 1.00 15.20 C ATOM 167 C ILE A 10 5.402 2.314 -13.016 1.00 16.52 C ATOM 168 O ILE A 10 6.025 2.180 -14.082 1.00 16.38 O ATOM 169 CB ILE A 10 4.052 0.426 -11.941 1.00 17.15 C ATOM 170 CG1 ILE A 10 4.301 -0.958 -11.317 1.00 17.56 C ATOM 171 CG2 ILE A 10 3.465 0.261 -13.347 1.00 18.87 C ATOM 172 CD1 ILE A 10 3.074 -1.676 -10.931 1.00 21.35 C ATOM 173 HA ILE A 10 6.126 0.458 -12.263 1.00 0.00 H ATOM 174 HB ILE A 10 3.333 0.990 -11.347 1.00 0.00 H ATOM 175 HG12 ILE A 10 4.841 -1.568 -12.042 1.00 0.00 H ATOM 176 HG13 ILE A 10 4.915 -0.826 -10.426 1.00 0.00 H ATOM 177 HD11 ILE A 10 2.526 -1.087 -10.196 1.00 0.00 H ATOM 178 HD12 ILE A 10 2.452 -1.829 -11.813 1.00 0.00 H ATOM 179 HD13 ILE A 10 3.340 -2.641 -10.500 1.00 0.00 H ATOM 180 HG21 ILE A 10 3.284 1.244 -13.781 1.00 0.00 H ATOM 181 HG22 ILE A 10 4.169 -0.289 -13.971 1.00 0.00 H ATOM 182 HG23 ILE A 10 2.526 -0.289 -13.285 1.00 0.00 H ATOM 183 H ILE A 10 5.037 1.718 -9.885 1.00 0.00 H ATOM 184 N ALA A 11 4.766 3.436 -12.702 1.00 17.93 N ATOM 185 CA ALA A 11 4.821 4.570 -13.614 1.00 17.73 C ATOM 186 C ALA A 11 6.264 5.032 -13.819 1.00 19.88 C ATOM 187 O ALA A 11 6.644 5.412 -14.925 1.00 24.46 O ATOM 188 CB ALA A 11 3.966 5.713 -13.093 1.00 21.63 C ATOM 189 HA ALA A 11 4.425 4.252 -14.578 1.00 0.00 H ATOM 190 HB1 ALA A 11 2.932 5.380 -13.003 1.00 0.00 H ATOM 191 HB2 ALA A 11 4.335 6.025 -12.116 1.00 0.00 H ATOM 192 HB3 ALA A 11 4.020 6.551 -13.788 1.00 0.00 H ATOM 193 H ALA A 11 4.233 3.505 -11.812 1.00 0.00 H ATOM 194 N ALA A 12 7.061 5.022 -12.757 1.00 19.02 N ATOM 195 CA ALA A 12 8.446 5.476 -12.844 1.00 19.95 C ATOM 196 C ALA A 12 9.216 4.592 -13.805 1.00 22.14 C ATOM 197 O ALA A 12 9.990 5.074 -14.631 1.00 26.34 O ATOM 198 CB ALA A 12 9.102 5.457 -11.481 1.00 23.66 C ATOM 199 HA ALA A 12 8.454 6.501 -13.213 1.00 0.00 H ATOM 200 HB1 ALA A 12 8.556 6.117 -10.807 1.00 0.00 H ATOM 201 HB2 ALA A 12 9.088 4.441 -11.087 1.00 0.00 H ATOM 202 HB3 ALA A 12 10.133 5.799 -11.571 1.00 0.00 H ATOM 203 H ALA A 12 6.692 4.684 -11.845 1.00 0.00 H ATOM 204 N ILE A 13 8.997 3.292 -13.696 1.00 19.48 N ATOM 205 CA ILE A 13 9.666 2.338 -14.569 1.00 21.13 C ATOM 206 C ILE A 13 9.225 2.546 -16.009 1.00 18.35 C ATOM 207 O ILE A 13 10.062 2.595 -16.919 1.00 25.01 O ATOM 208 CB ILE A 13 9.378 0.890 -14.137 1.00 20.29 C ATOM 209 CG1 ILE A 13 10.061 0.591 -12.797 1.00 22.90 C ATOM 210 CG2 ILE A 13 9.875 -0.108 -15.187 1.00 31.53 C ATOM 211 CD1 ILE A 13 9.589 -0.694 -12.140 1.00 27.75 C ATOM 212 HA ILE A 13 10.740 2.509 -14.493 1.00 0.00 H ATOM 213 HB ILE A 13 8.298 0.783 -14.033 1.00 0.00 H ATOM 214 HG12 ILE A 13 11.135 0.515 -12.968 1.00 0.00 H ATOM 215 HG13 ILE A 13 9.860 1.419 -12.117 1.00 0.00 H ATOM 216 HD11 ILE A 13 8.518 -0.631 -11.950 1.00 0.00 H ATOM 217 HD12 ILE A 13 9.793 -1.535 -12.802 1.00 0.00 H ATOM 218 HD13 ILE A 13 10.119 -0.835 -11.198 1.00 0.00 H ATOM 219 HG21 ILE A 13 9.369 0.081 -16.134 1.00 0.00 H ATOM 220 HG22 ILE A 13 10.951 0.010 -15.318 1.00 0.00 H ATOM 221 HG23 ILE A 13 9.657 -1.123 -14.854 1.00 0.00 H ATOM 222 H ILE A 13 8.335 2.945 -12.973 1.00 0.00 H ATOM 223 N MET A 14 7.923 2.674 -16.223 1.00 19.45 N ATOM 224 CA MET A 14 7.411 2.762 -17.590 1.00 23.19 C ATOM 225 C MET A 14 7.573 4.135 -18.260 1.00 27.61 C ATOM 226 O MET A 14 7.686 4.204 -19.479 1.00 30.67 O ATOM 227 CB MET A 14 5.944 2.327 -17.622 1.00 25.00 C ATOM 228 CG MET A 14 5.730 0.877 -17.194 1.00 26.00 C ATOM 229 SD MET A 14 6.389 -0.352 -18.346 1.00 32.86 S ATOM 230 CE MET A 14 5.155 -0.297 -19.641 1.00 35.38 C ATOM 231 HA MET A 14 8.031 2.085 -18.179 1.00 0.00 H ATOM 232 HB2 MET A 14 5.378 2.973 -16.951 1.00 0.00 H ATOM 233 HB3 MET A 14 5.571 2.446 -18.639 1.00 0.00 H ATOM 234 HG2 MET A 14 4.658 0.707 -17.091 1.00 0.00 H ATOM 235 HG3 MET A 14 6.214 0.732 -16.228 1.00 0.00 H ATOM 236 HE1 MET A 14 4.183 -0.564 -19.226 1.00 0.00 H ATOM 237 HE2 MET A 14 5.110 0.710 -20.056 1.00 0.00 H ATOM 238 HE3 MET A 14 5.423 -1.003 -20.427 1.00 0.00 H ATOM 239 H MET A 14 7.265 2.712 -15.418 1.00 0.00 H ATOM 240 N GLN A 15 7.601 5.213 -17.477 1.00 23.02 N ATOM 241 CA GLN A 15 7.667 6.570 -18.029 1.00 23.63 C ATOM 242 C GLN A 15 9.086 7.142 -18.020 1.00 29.12 C ATOM 243 O GLN A 15 9.473 7.845 -18.952 1.00 33.08 O ATOM 244 CB GLN A 15 6.734 7.509 -17.257 1.00 32.76 C ATOM 245 CG GLN A 15 5.260 7.150 -17.383 1.00 30.63 C ATOM 246 CD GLN A 15 4.391 7.807 -16.322 1.00 43.59 C ATOM 247 OE1 GLN A 15 4.861 8.626 -15.527 1.00 40.19 O ATOM 248 NE2 GLN A 15 3.114 7.437 -16.297 1.00 41.90 N ATOM 249 HA GLN A 15 7.346 6.498 -19.068 1.00 0.00 H ATOM 250 HB2 GLN A 15 7.007 7.475 -16.202 1.00 0.00 H ATOM 251 HB3 GLN A 15 6.875 8.522 -17.635 1.00 0.00 H ATOM 252 HG2 GLN A 15 4.908 7.468 -18.365 1.00 0.00 H ATOM 253 HG3 GLN A 15 5.158 6.068 -17.294 1.00 0.00 H ATOM 254 HE22 GLN A 15 2.760 6.743 -16.986 1.00 0.00 H ATOM 255 HE21 GLN A 15 2.469 7.841 -15.588 1.00 0.00 H ATOM 256 H GLN A 15 7.575 5.088 -16.445 1.00 0.00 H ATOM 257 N LYS A 16 9.848 6.854 -16.966 1.00 34.62 N ATOM 258 CA LYS A 16 11.204 7.396 -16.820 1.00 36.51 C ATOM 259 C LYS A 16 12.262 6.379 -17.234 1.00 33.70 C ATOM 260 O LYS A 16 13.330 6.749 -17.724 1.00 38.57 O ATOM 261 CB LYS A 16 11.461 7.826 -15.374 1.00 50.25 C ATOM 262 CG LYS A 16 10.573 8.953 -14.891 1.00 53.05 C ATOM 263 CD LYS A 16 11.178 10.306 -15.220 1.00 65.03 C ATOM 264 CE LYS A 16 10.259 11.442 -14.802 1.00 63.79 C ATOM 265 NZ LYS A 16 9.002 11.452 -15.599 1.00 70.99 N ATOM 266 HA LYS A 16 11.275 8.262 -17.478 1.00 0.00 H ATOM 267 HB2 LYS A 16 11.300 6.963 -14.727 1.00 0.00 H ATOM 268 HB3 LYS A 16 12.499 8.150 -15.293 1.00 0.00 H ATOM 269 HG2 LYS A 16 9.599 8.871 -15.374 1.00 0.00 H ATOM 270 HG3 LYS A 16 10.449 8.871 -13.811 1.00 0.00 H ATOM 271 HD2 LYS A 16 12.128 10.407 -14.695 1.00 0.00 H ATOM 272 HD3 LYS A 16 11.350 10.366 -16.295 1.00 0.00 H ATOM 273 HE2 LYS A 16 10.778 12.389 -14.948 1.00 0.00 H ATOM 274 HE3 LYS A 16 10.009 11.325 -13.748 1.00 0.00 H ATOM 275 HZ1 LYS A 16 9.233 11.569 -16.606 1.00 0.00 H ATOM 276 HZ2 LYS A 16 8.498 10.553 -15.460 1.00 0.00 H ATOM 277 HZ3 LYS A 16 8.401 12.240 -15.286 1.00 0.00 H ATOM 278 H LYS A 16 9.472 6.228 -16.226 1.00 0.00 H ATOM 279 N GLY A 17 11.960 5.104 -17.030 1.00 36.10 N ATOM 280 CA GLY A 17 12.886 4.039 -17.361 1.00 38.12 C ATOM 281 C GLY A 17 14.106 4.048 -16.464 1.00 39.87 C ATOM 282 O GLY A 17 15.146 3.504 -16.819 1.00 49.35 O ATOM 283 HA3 GLY A 17 13.208 4.161 -18.395 1.00 0.00 H ATOM 284 HA2 GLY A 17 12.376 3.082 -17.252 1.00 0.00 H ATOM 285 H GLY A 17 11.035 4.862 -16.622 1.00 0.00 H ATOM 286 N ASP A 18 13.978 4.671 -15.298 1.00 50.49 N ATOM 287 CA ASP A 18 15.069 4.703 -14.332 1.00 55.99 C ATOM 288 C ASP A 18 15.226 3.327 -13.701 1.00 42.84 C ATOM 289 O ASP A 18 14.237 2.707 -13.322 1.00 36.09 O ATOM 290 CB ASP A 18 14.810 5.765 -13.257 1.00 64.23 C ATOM 291 CG ASP A 18 13.446 5.618 -12.597 1.00 63.56 C ATOM 292 OD1 ASP A 18 12.582 4.895 -13.143 1.00 57.17 O ATOM 293 OD2 ASP A 18 13.238 6.245 -11.534 1.00 61.95 O ATOM 294 HA ASP A 18 15.993 4.968 -14.846 1.00 0.00 H ATOM 295 HB2 ASP A 18 15.579 5.679 -12.490 1.00 0.00 H ATOM 296 HB3 ASP A 18 14.869 6.750 -13.719 1.00 0.00 H ATOM 297 H ASP A 18 13.081 5.146 -15.070 1.00 0.00 H ATOM 298 N THR A 19 16.466 2.848 -13.610 1.00 32.35 N ATOM 299 CA THR A 19 16.734 1.510 -13.088 1.00 32.16 C ATOM 300 C THR A 19 17.481 1.533 -11.757 1.00 30.99 C ATOM 301 O THR A 19 17.781 0.480 -11.194 1.00 30.66 O ATOM 302 CB THR A 19 17.558 0.674 -14.085 1.00 33.63 C ATOM 303 OG1 THR A 19 18.750 1.384 -14.437 1.00 37.61 O ATOM 304 CG2 THR A 19 16.742 0.376 -15.345 1.00 35.38 C ATOM 305 HA THR A 19 15.754 1.058 -12.933 1.00 0.00 H ATOM 306 HB THR A 19 17.822 -0.272 -13.612 1.00 0.00 H ATOM 307 HG1 THR A 19 19.287 1.549 -13.622 1.00 0.00 H ATOM 308 HG23 THR A 19 15.836 -0.164 -15.070 1.00 0.00 H ATOM 309 HG21 THR A 19 16.474 1.313 -15.833 1.00 0.00 H ATOM 310 HG22 THR A 19 17.337 -0.232 -16.026 1.00 0.00 H ATOM 311 H THR A 19 17.263 3.441 -13.918 1.00 0.00 H ATOM 312 N ASN A 20 17.779 2.726 -11.258 1.00 32.21 N ATOM 313 CA ASN A 20 18.507 2.854 -10.001 1.00 39.16 C ATOM 314 C ASN A 20 17.611 2.552 -8.803 1.00 38.05 C ATOM 315 O ASN A 20 18.088 2.238 -7.710 1.00 39.35 O ATOM 316 CB ASN A 20 19.115 4.250 -9.889 1.00 41.35 C ATOM 317 CG ASN A 20 20.213 4.483 -10.907 1.00 57.05 C ATOM 318 OD1 ASN A 20 21.157 3.698 -11.009 1.00 62.54 O ATOM 319 ND2 ASN A 20 20.090 5.559 -11.676 1.00 60.51 N ATOM 320 HA ASN A 20 19.312 2.119 -9.997 1.00 0.00 H ATOM 321 HB2 ASN A 20 18.329 4.989 -10.046 1.00 0.00 H ATOM 322 HB3 ASN A 20 19.532 4.372 -8.889 1.00 0.00 H ATOM 323 HD22 ASN A 20 19.276 6.195 -11.555 1.00 0.00 H ATOM 324 HD21 ASN A 20 20.808 5.766 -12.399 1.00 0.00 H ATOM 325 H ASN A 20 17.489 3.583 -11.771 1.00 0.00 H ATOM 326 N ILE A 21 16.306 2.632 -9.015 1.00 21.56 N ATOM 327 CA ILE A 21 15.355 2.347 -7.951 1.00 19.65 C ATOM 328 C ILE A 21 15.346 0.860 -7.602 1.00 22.12 C ATOM 329 O ILE A 21 15.639 0.018 -8.453 1.00 19.76 O ATOM 330 CB ILE A 21 13.930 2.791 -8.338 1.00 20.88 C ATOM 331 CG1 ILE A 21 13.507 2.182 -9.679 1.00 20.95 C ATOM 332 CG2 ILE A 21 13.868 4.299 -8.428 1.00 25.18 C ATOM 333 CD1 ILE A 21 12.035 2.365 -9.976 1.00 28.97 C ATOM 334 HA ILE A 21 15.676 2.915 -7.077 1.00 0.00 H ATOM 335 HB ILE A 21 13.245 2.439 -7.567 1.00 0.00 H ATOM 336 HG12 ILE A 21 14.083 2.657 -10.473 1.00 0.00 H ATOM 337 HG13 ILE A 21 13.727 1.115 -9.661 1.00 0.00 H ATOM 338 HD11 ILE A 21 11.446 1.886 -9.194 1.00 0.00 H ATOM 339 HD12 ILE A 21 11.802 3.429 -10.008 1.00 0.00 H ATOM 340 HD13 ILE A 21 11.801 1.912 -10.939 1.00 0.00 H ATOM 341 HG21 ILE A 21 14.130 4.730 -7.462 1.00 0.00 H ATOM 342 HG22 ILE A 21 14.571 4.646 -9.185 1.00 0.00 H ATOM 343 HG23 ILE A 21 12.858 4.604 -8.702 1.00 0.00 H ATOM 344 H ILE A 21 15.956 2.903 -9.956 1.00 0.00 H ATOM 345 N LYS A 22 15.013 0.549 -6.350 1.00 17.10 N ATOM 346 CA LYS A 22 14.853 -0.835 -5.888 1.00 15.79 C ATOM 347 C LYS A 22 13.454 -0.984 -5.296 1.00 14.79 C ATOM 348 O LYS A 22 13.276 -1.140 -4.091 1.00 15.13 O ATOM 349 CB LYS A 22 15.949 -1.213 -4.881 1.00 16.44 C ATOM 350 CG LYS A 22 17.370 -1.132 -5.477 1.00 19.26 C ATOM 351 CD LYS A 22 18.399 -1.870 -4.638 1.00 33.53 C ATOM 352 CE LYS A 22 18.400 -1.407 -3.191 1.00 54.40 C ATOM 353 NZ LYS A 22 19.483 -2.063 -2.402 1.00 62.41 N ATOM 354 HA LYS A 22 14.961 -1.524 -6.726 1.00 0.00 H ATOM 355 HB2 LYS A 22 15.889 -0.533 -4.031 1.00 0.00 H ATOM 356 HB3 LYS A 22 15.772 -2.234 -4.542 1.00 0.00 H ATOM 357 HG2 LYS A 22 17.355 -1.569 -6.476 1.00 0.00 H ATOM 358 HG3 LYS A 22 17.661 -0.084 -5.545 1.00 0.00 H ATOM 359 HD2 LYS A 22 18.175 -2.936 -4.665 1.00 0.00 H ATOM 360 HD3 LYS A 22 19.388 -1.697 -5.063 1.00 0.00 H ATOM 361 HE2 LYS A 22 17.438 -1.651 -2.741 1.00 0.00 H ATOM 362 HE3 LYS A 22 18.548 -0.327 -3.165 1.00 0.00 H ATOM 363 HZ1 LYS A 22 19.345 -3.094 -2.416 1.00 0.00 H ATOM 364 HZ2 LYS A 22 20.406 -1.830 -2.821 1.00 0.00 H ATOM 365 HZ3 LYS A 22 19.451 -1.721 -1.420 1.00 0.00 H ATOM 366 H LYS A 22 14.860 1.321 -5.670 1.00 0.00 H ATOM 367 N PRO A 23 12.446 -0.928 -6.159 1.00 13.69 N ATOM 368 CA PRO A 23 11.075 -0.814 -5.672 1.00 13.22 C ATOM 369 C PRO A 23 10.558 -2.074 -5.018 1.00 12.93 C ATOM 370 O PRO A 23 10.972 -3.194 -5.337 1.00 14.37 O ATOM 371 CB PRO A 23 10.294 -0.507 -6.939 1.00 14.47 C ATOM 372 CG PRO A 23 11.100 -1.164 -8.030 1.00 14.60 C ATOM 373 CD PRO A 23 12.517 -0.979 -7.631 1.00 16.52 C ATOM 374 HA PRO A 23 10.986 -0.059 -4.891 1.00 0.00 H ATOM 375 HD3 PRO A 23 13.130 -1.816 -7.965 1.00 0.00 H ATOM 376 HD2 PRO A 23 12.920 -0.051 -8.036 1.00 0.00 H ATOM 377 HG3 PRO A 23 10.907 -0.685 -8.990 1.00 0.00 H ATOM 378 HG2 PRO A 23 10.857 -2.224 -8.099 1.00 0.00 H ATOM 379 HB2 PRO A 23 9.291 -0.931 -6.889 1.00 0.00 H ATOM 380 HB3 PRO A 23 10.225 0.569 -7.101 1.00 0.00 H ATOM 381 N ILE A 24 9.626 -1.877 -4.092 1.00 11.44 N ATOM 382 CA ILE A 24 8.980 -2.973 -3.388 1.00 11.54 C ATOM 383 C ILE A 24 7.598 -3.137 -3.999 1.00 9.72 C ATOM 384 O ILE A 24 6.798 -2.195 -4.031 1.00 12.12 O ATOM 385 CB ILE A 24 8.929 -2.691 -1.894 1.00 12.24 C ATOM 386 CG1 ILE A 24 10.361 -2.628 -1.346 1.00 14.71 C ATOM 387 CG2 ILE A 24 8.117 -3.773 -1.169 1.00 13.42 C ATOM 388 CD1 ILE A 24 10.468 -2.212 0.096 1.00 17.32 C ATOM 389 HA ILE A 24 9.538 -3.903 -3.495 1.00 0.00 H ATOM 390 HB ILE A 24 8.436 -1.734 -1.722 1.00 0.00 H ATOM 391 HG12 ILE A 24 10.807 -3.617 -1.448 1.00 0.00 H ATOM 392 HG13 ILE A 24 10.923 -1.914 -1.948 1.00 0.00 H ATOM 393 HD11 ILE A 24 10.040 -1.217 0.218 1.00 0.00 H ATOM 394 HD12 ILE A 24 9.924 -2.922 0.719 1.00 0.00 H ATOM 395 HD13 ILE A 24 11.517 -2.197 0.392 1.00 0.00 H ATOM 396 HG21 ILE A 24 7.100 -3.787 -1.562 1.00 0.00 H ATOM 397 HG22 ILE A 24 8.584 -4.745 -1.330 1.00 0.00 H ATOM 398 HG23 ILE A 24 8.093 -3.553 -0.102 1.00 0.00 H ATOM 399 H ILE A 24 9.348 -0.902 -3.862 1.00 0.00 H ATOM 400 N LEU A 25 7.357 -4.324 -4.552 1.00 11.09 N ATOM 401 CA LEU A 25 6.151 -4.597 -5.306 1.00 11.21 C ATOM 402 C LEU A 25 5.504 -5.852 -4.761 1.00 12.05 C ATOM 403 O LEU A 25 6.173 -6.685 -4.156 1.00 14.91 O ATOM 404 CB LEU A 25 6.491 -4.815 -6.776 1.00 13.92 C ATOM 405 CG LEU A 25 7.227 -3.667 -7.462 1.00 14.15 C ATOM 406 CD1 LEU A 25 7.635 -4.082 -8.867 1.00 19.59 C ATOM 407 CD2 LEU A 25 6.368 -2.429 -7.476 1.00 13.77 C ATOM 408 HA LEU A 25 5.472 -3.749 -5.216 1.00 0.00 H ATOM 409 HB2 LEU A 25 7.117 -5.705 -6.847 1.00 0.00 H ATOM 410 HB3 LEU A 25 5.558 -4.985 -7.314 1.00 0.00 H ATOM 411 HG LEU A 25 8.133 -3.432 -6.903 1.00 0.00 H ATOM 412 HD21 LEU A 25 5.445 -2.635 -8.018 1.00 0.00 H ATOM 413 HD22 LEU A 25 6.133 -2.140 -6.452 1.00 0.00 H ATOM 414 HD23 LEU A 25 6.907 -1.620 -7.968 1.00 0.00 H ATOM 415 HD11 LEU A 25 8.292 -4.950 -8.812 1.00 0.00 H ATOM 416 HD12 LEU A 25 6.745 -4.335 -9.443 1.00 0.00 H ATOM 417 HD13 LEU A 25 8.160 -3.258 -9.350 1.00 0.00 H ATOM 418 H LEU A 25 8.060 -5.082 -4.438 1.00 0.00 H ATOM 419 N GLN A 26 4.210 -6.000 -5.023 1.00 11.61 N ATOM 420 CA GLN A 26 3.516 -7.216 -4.649 1.00 11.65 C ATOM 421 C GLN A 26 3.247 -8.030 -5.892 1.00 11.00 C ATOM 422 O GLN A 26 2.828 -7.493 -6.907 1.00 11.03 O ATOM 423 CB GLN A 26 2.201 -6.901 -3.954 1.00 11.36 C ATOM 424 CG GLN A 26 1.527 -8.163 -3.451 1.00 12.42 C ATOM 425 CD GLN A 26 0.240 -7.899 -2.715 1.00 11.28 C ATOM 426 OE1 GLN A 26 -0.517 -7.003 -3.051 1.00 13.02 O ATOM 427 NE2 GLN A 26 -0.019 -8.716 -1.703 1.00 12.27 N ATOM 428 HA GLN A 26 4.142 -7.779 -3.956 1.00 0.00 H ATOM 429 HB2 GLN A 26 2.395 -6.241 -3.109 1.00 0.00 H ATOM 430 HB3 GLN A 26 1.537 -6.401 -4.659 1.00 0.00 H ATOM 431 HG2 GLN A 26 1.312 -8.805 -4.306 1.00 0.00 H ATOM 432 HG3 GLN A 26 2.212 -8.676 -2.777 1.00 0.00 H ATOM 433 HE22 GLN A 26 0.657 -9.466 -1.454 1.00 0.00 H ATOM 434 HE21 GLN A 26 -0.898 -8.607 -1.159 1.00 0.00 H ATOM 435 H GLN A 26 3.690 -5.236 -5.501 1.00 0.00 H ATOM 436 N VAL A 27 3.504 -9.328 -5.808 1.00 11.09 N ATOM 437 CA VAL A 27 3.128 -10.251 -6.873 1.00 11.15 C ATOM 438 C VAL A 27 1.641 -10.506 -6.775 1.00 11.33 C ATOM 439 O VAL A 27 1.137 -10.885 -5.726 1.00 14.18 O ATOM 440 CB VAL A 27 3.853 -11.586 -6.705 1.00 13.42 C ATOM 441 CG1 VAL A 27 3.399 -12.573 -7.774 1.00 12.35 C ATOM 442 CG2 VAL A 27 5.356 -11.385 -6.782 1.00 13.28 C ATOM 443 HA VAL A 27 3.395 -9.816 -7.836 1.00 0.00 H ATOM 444 HB VAL A 27 3.605 -11.993 -5.725 1.00 0.00 H ATOM 445 HG11 VAL A 27 2.325 -12.737 -7.683 1.00 0.00 H ATOM 446 HG12 VAL A 27 3.624 -12.167 -8.760 1.00 0.00 H ATOM 447 HG13 VAL A 27 3.925 -13.519 -7.640 1.00 0.00 H ATOM 448 HG21 VAL A 27 5.615 -10.959 -7.751 1.00 0.00 H ATOM 449 HG22 VAL A 27 5.672 -10.707 -5.989 1.00 0.00 H ATOM 450 HG23 VAL A 27 5.856 -12.346 -6.660 1.00 0.00 H ATOM 451 H VAL A 27 3.985 -9.697 -4.963 1.00 0.00 H ATOM 452 N ILE A 28 0.920 -10.272 -7.865 1.00 12.09 N ATOM 453 CA ILE A 28 -0.508 -10.539 -7.894 1.00 12.11 C ATOM 454 C ILE A 28 -0.724 -11.888 -8.546 1.00 14.88 C ATOM 455 O ILE A 28 -1.545 -12.698 -8.086 1.00 16.83 O ATOM 456 CB ILE A 28 -1.263 -9.458 -8.674 1.00 14.32 C ATOM 457 CG1 ILE A 28 -1.027 -8.073 -8.062 1.00 15.51 C ATOM 458 CG2 ILE A 28 -2.750 -9.764 -8.703 1.00 14.64 C ATOM 459 CD1 ILE A 28 -1.362 -7.972 -6.585 1.00 20.38 C ATOM 460 HA ILE A 28 -0.893 -10.537 -6.874 1.00 0.00 H ATOM 461 HB ILE A 28 -0.881 -9.454 -9.695 1.00 0.00 H ATOM 462 HG12 ILE A 28 0.025 -7.818 -8.191 1.00 0.00 H ATOM 463 HG13 ILE A 28 -1.643 -7.353 -8.601 1.00 0.00 H ATOM 464 HD11 ILE A 28 -2.415 -8.210 -6.436 1.00 0.00 H ATOM 465 HD12 ILE A 28 -0.746 -8.676 -6.025 1.00 0.00 H ATOM 466 HD13 ILE A 28 -1.164 -6.958 -6.237 1.00 0.00 H ATOM 467 HG21 ILE A 28 -2.912 -10.728 -9.185 1.00 0.00 H ATOM 468 HG22 ILE A 28 -3.133 -9.798 -7.683 1.00 0.00 H ATOM 469 HG23 ILE A 28 -3.269 -8.985 -9.261 1.00 0.00 H ATOM 470 H ILE A 28 1.386 -9.891 -8.713 1.00 0.00 H ATOM 471 N ASN A 29 0.033 -12.143 -9.605 1.00 12.81 N ATOM 472 CA ASN A 29 -0.111 -13.427 -10.278 1.00 14.55 C ATOM 473 C ASN A 29 1.145 -13.769 -11.011 1.00 11.96 C ATOM 474 O ASN A 29 1.902 -12.878 -11.392 1.00 13.56 O ATOM 475 CB ASN A 29 -1.292 -13.402 -11.258 1.00 15.15 C ATOM 476 CG ASN A 29 -1.689 -14.780 -11.727 1.00 28.32 C ATOM 477 OD1 ASN A 29 -1.640 -15.741 -10.965 1.00 28.94 O ATOM 478 ND2 ASN A 29 -2.079 -14.885 -12.991 1.00 40.98 N ATOM 479 HA ASN A 29 -0.304 -14.186 -9.520 1.00 0.00 H ATOM 480 HB2 ASN A 29 -2.147 -12.942 -10.762 1.00 0.00 H ATOM 481 HB3 ASN A 29 -1.013 -12.805 -12.126 1.00 0.00 H ATOM 482 HD22 ASN A 29 -2.104 -14.042 -13.599 1.00 0.00 H ATOM 483 HD21 ASN A 29 -2.359 -15.811 -13.373 1.00 0.00 H ATOM 484 H ASN A 29 0.717 -11.439 -9.949 1.00 0.00 H ATOM 485 N ILE A 30 1.378 -15.066 -11.167 1.00 12.39 N ATOM 486 CA ILE A 30 2.513 -15.587 -11.922 1.00 14.01 C ATOM 487 C ILE A 30 2.012 -16.654 -12.858 1.00 16.21 C ATOM 488 O ILE A 30 1.192 -17.482 -12.465 1.00 16.42 O ATOM 489 CB ILE A 30 3.573 -16.252 -11.020 1.00 14.47 C ATOM 490 CG1 ILE A 30 4.030 -15.284 -9.932 1.00 15.54 C ATOM 491 CG2 ILE A 30 4.778 -16.714 -11.855 1.00 18.76 C ATOM 492 CD1 ILE A 30 5.057 -15.852 -8.973 1.00 19.78 C ATOM 493 HA ILE A 30 2.969 -14.743 -12.440 1.00 0.00 H ATOM 494 HB ILE A 30 3.121 -17.124 -10.547 1.00 0.00 H ATOM 495 HG12 ILE A 30 4.464 -14.409 -10.416 1.00 0.00 H ATOM 496 HG13 ILE A 30 3.156 -14.983 -9.355 1.00 0.00 H ATOM 497 HD11 ILE A 30 4.638 -16.722 -8.467 1.00 0.00 H ATOM 498 HD12 ILE A 30 5.947 -16.147 -9.529 1.00 0.00 H ATOM 499 HD13 ILE A 30 5.322 -15.094 -8.236 1.00 0.00 H ATOM 500 HG21 ILE A 30 4.446 -17.435 -12.602 1.00 0.00 H ATOM 501 HG22 ILE A 30 5.225 -15.853 -12.352 1.00 0.00 H ATOM 502 HG23 ILE A 30 5.514 -17.180 -11.201 1.00 0.00 H ATOM 503 H ILE A 30 0.721 -15.743 -10.730 1.00 0.00 H ATOM 504 N ARG A 31 2.493 -16.656 -14.091 1.00 14.15 N ATOM 505 CA ARG A 31 2.165 -17.776 -14.959 1.00 15.40 C ATOM 506 C ARG A 31 3.266 -18.044 -15.963 1.00 17.45 C ATOM 507 O ARG A 31 3.999 -17.130 -16.340 1.00 18.04 O ATOM 508 CB ARG A 31 0.820 -17.576 -15.645 1.00 23.02 C ATOM 509 CG ARG A 31 0.792 -16.569 -16.737 1.00 26.43 C ATOM 510 CD ARG A 31 -0.460 -16.805 -17.575 1.00 38.70 C ATOM 511 NE ARG A 31 -0.616 -15.809 -18.624 1.00 41.42 N ATOM 512 CZ ARG A 31 -0.060 -15.888 -19.827 1.00 52.94 C ATOM 513 NH1 ARG A 31 0.705 -16.927 -20.153 1.00 47.06 N ATOM 514 NH2 ARG A 31 -0.273 -14.918 -20.707 1.00 49.54 N ATOM 515 HA ARG A 31 2.080 -18.661 -14.328 1.00 0.00 H ATOM 516 HB2 ARG A 31 0.514 -18.534 -16.066 1.00 0.00 H ATOM 517 HB3 ARG A 31 0.101 -17.267 -14.887 1.00 0.00 H ATOM 518 HG2 ARG A 31 0.768 -15.565 -16.313 1.00 0.00 H ATOM 519 HG3 ARG A 31 1.679 -16.677 -17.361 1.00 0.00 H ATOM 520 HD2 ARG A 31 -1.332 -16.767 -16.922 1.00 0.00 H ATOM 521 HD3 ARG A 31 -0.394 -17.791 -18.034 1.00 0.00 H ATOM 522 HE ARG A 31 -1.204 -14.977 -18.417 1.00 0.00 H ATOM 523 HH12 ARG A 31 1.136 -16.979 -21.098 1.00 0.00 H ATOM 524 HH11 ARG A 31 0.872 -17.687 -19.463 1.00 0.00 H ATOM 525 HH22 ARG A 31 0.158 -14.970 -21.652 1.00 0.00 H ATOM 526 HH21 ARG A 31 -0.871 -14.106 -20.451 1.00 0.00 H ATOM 527 H ARG A 31 3.091 -15.876 -14.431 1.00 0.00 H ATOM 528 N PRO A 32 3.399 -19.303 -16.387 1.00 17.24 N ATOM 529 CA PRO A 32 4.384 -19.587 -17.425 1.00 18.23 C ATOM 530 C PRO A 32 3.959 -19.011 -18.748 1.00 20.99 C ATOM 531 O PRO A 32 2.760 -18.891 -19.004 1.00 21.56 O ATOM 532 CB PRO A 32 4.362 -21.118 -17.532 1.00 19.60 C ATOM 533 CG PRO A 32 3.584 -21.596 -16.345 1.00 19.03 C ATOM 534 CD PRO A 32 2.647 -20.512 -16.006 1.00 18.04 C ATOM 535 HA PRO A 32 5.360 -19.165 -17.186 1.00 0.00 H ATOM 536 HD3 PRO A 32 1.723 -20.597 -16.578 1.00 0.00 H ATOM 537 HD2 PRO A 32 2.415 -20.511 -14.941 1.00 0.00 H ATOM 538 HG3 PRO A 32 4.254 -21.793 -15.508 1.00 0.00 H ATOM 539 HG2 PRO A 32 3.037 -22.506 -16.593 1.00 0.00 H ATOM 540 HB2 PRO A 32 3.874 -21.428 -18.456 1.00 0.00 H ATOM 541 HB3 PRO A 32 5.377 -21.516 -17.507 1.00 0.00 H ATOM 542 N ILE A 33 4.916 -18.664 -19.594 1.00 18.96 N ATOM 543 CA ILE A 33 4.568 -18.283 -20.946 1.00 21.77 C ATOM 544 C ILE A 33 4.945 -19.443 -21.843 1.00 24.91 C ATOM 545 O ILE A 33 5.732 -20.296 -21.451 1.00 25.05 O ATOM 546 CB ILE A 33 5.274 -17.009 -21.401 1.00 24.27 C ATOM 547 CG1 ILE A 33 6.789 -17.180 -21.395 1.00 28.38 C ATOM 548 CG2 ILE A 33 4.885 -15.858 -20.503 1.00 26.20 C ATOM 549 CD1 ILE A 33 7.503 -16.155 -22.260 1.00 36.73 C ATOM 550 HA ILE A 33 3.501 -18.065 -20.995 1.00 0.00 H ATOM 551 HB ILE A 33 4.962 -16.798 -22.424 1.00 0.00 H ATOM 552 HG12 ILE A 33 7.147 -17.080 -20.370 1.00 0.00 H ATOM 553 HG13 ILE A 33 7.028 -18.176 -21.767 1.00 0.00 H ATOM 554 HD11 ILE A 33 7.162 -16.250 -23.291 1.00 0.00 H ATOM 555 HD12 ILE A 33 7.280 -15.153 -21.893 1.00 0.00 H ATOM 556 HD13 ILE A 33 8.578 -16.329 -22.215 1.00 0.00 H ATOM 557 HG21 ILE A 33 3.806 -15.709 -20.552 1.00 0.00 H ATOM 558 HG22 ILE A 33 5.176 -16.085 -19.477 1.00 0.00 H ATOM 559 HG23 ILE A 33 5.393 -14.952 -20.834 1.00 0.00 H ATOM 560 H ILE A 33 5.910 -18.665 -19.289 1.00 0.00 H ATOM 561 N THR A 34 4.371 -19.486 -23.034 1.00 27.68 N ATOM 562 CA THR A 34 4.652 -20.577 -23.952 1.00 31.24 C ATOM 563 C THR A 34 6.074 -20.497 -24.498 1.00 33.73 C ATOM 564 O THR A 34 6.458 -19.509 -25.121 1.00 42.16 O ATOM 565 CB THR A 34 3.643 -20.581 -25.093 1.00 33.82 C ATOM 566 OG1 THR A 34 2.332 -20.707 -24.533 1.00 35.41 O ATOM 567 CG2 THR A 34 3.899 -21.738 -26.048 1.00 37.95 C ATOM 568 HA THR A 34 4.563 -21.511 -23.397 1.00 0.00 H ATOM 569 HB THR A 34 3.737 -19.652 -25.656 1.00 0.00 H ATOM 570 HG1 THR A 34 2.158 -19.943 -23.928 1.00 0.00 H ATOM 571 HG23 THR A 34 4.898 -21.642 -26.474 1.00 0.00 H ATOM 572 HG21 THR A 34 3.824 -22.680 -25.504 1.00 0.00 H ATOM 573 HG22 THR A 34 3.158 -21.719 -26.847 1.00 0.00 H ATOM 574 H THR A 34 3.713 -18.732 -23.316 1.00 0.00 H ATOM 575 N THR A 35 6.838 -21.559 -24.261 1.00 35.85 N ATOM 576 CA THR A 35 8.240 -21.621 -24.657 1.00 41.90 C ATOM 577 C THR A 35 8.499 -22.805 -25.582 1.00 52.64 C ATOM 578 O THR A 35 8.586 -22.643 -26.798 1.00 70.17 O ATOM 579 CB THR A 35 9.152 -21.755 -23.426 1.00 47.09 C ATOM 580 OG1 THR A 35 8.733 -22.874 -22.632 1.00 58.76 O ATOM 581 CG2 THR A 35 9.102 -20.493 -22.589 1.00 34.87 C ATOM 582 HA THR A 35 8.464 -20.693 -25.183 1.00 0.00 H ATOM 583 HB THR A 35 10.176 -21.911 -23.767 1.00 0.00 H ATOM 584 HG1 THR A 35 9.323 -22.956 -21.841 1.00 0.00 H ATOM 585 HG23 THR A 35 9.421 -19.644 -23.194 1.00 0.00 H ATOM 586 HG21 THR A 35 8.082 -20.330 -22.241 1.00 0.00 H ATOM 587 HG22 THR A 35 9.767 -20.600 -21.732 1.00 0.00 H ATOM 588 H THR A 35 6.419 -22.377 -23.774 1.00 0.00 H ATOM 589 N GLY A 36 8.624 -23.994 -24.997 1.00 66.49 N ATOM 590 CA GLY A 36 8.906 -25.198 -25.758 1.00 67.90 C ATOM 591 C GLY A 36 10.352 -25.272 -26.219 1.00 79.25 C ATOM 592 O GLY A 36 10.840 -24.372 -26.903 1.00 82.30 O ATOM 593 HA3 GLY A 36 8.258 -25.217 -26.634 1.00 0.00 H ATOM 594 HA2 GLY A 36 8.694 -26.065 -25.132 1.00 0.00 H ATOM 595 H GLY A 36 8.517 -24.063 -23.965 1.00 0.00 H ATOM 596 N ASN A 37 11.035 -26.349 -25.837 1.00 77.02 N ATOM 597 CA ASN A 37 12.425 -26.584 -26.231 1.00 79.00 C ATOM 598 C ASN A 37 13.398 -25.567 -25.635 1.00 73.21 C ATOM 599 O ASN A 37 14.492 -25.358 -26.160 1.00 80.09 O ATOM 600 CB ASN A 37 12.557 -26.605 -27.758 1.00 78.87 C ATOM 601 HA ASN A 37 12.697 -27.559 -25.826 1.00 0.00 H ATOM 602 HB2 ASN A 37 11.935 -27.402 -28.164 1.00 0.00 H ATOM 603 HB3 ASN A 37 12.232 -25.647 -28.163 1.00 0.00 H ATOM 604 H ASN A 37 10.562 -27.052 -25.234 1.00 0.00 H ATOM 605 N SER A 38 12.990 -24.941 -24.536 1.00 61.37 N ATOM 606 CA SER A 38 13.828 -23.987 -23.817 1.00 68.23 C ATOM 607 C SER A 38 13.341 -23.967 -22.374 1.00 51.63 C ATOM 608 O SER A 38 12.228 -24.419 -22.104 1.00 57.76 O ATOM 609 CB SER A 38 13.701 -22.599 -24.445 1.00 72.52 C ATOM 610 OG SER A 38 12.376 -22.117 -24.330 1.00 74.83 O ATOM 611 HA SER A 38 14.878 -24.274 -23.864 1.00 0.00 H ATOM 612 HB2 SER A 38 13.971 -22.657 -25.500 1.00 0.00 H ATOM 613 HB3 SER A 38 14.377 -21.912 -23.936 1.00 0.00 H ATOM 614 HG SER A 38 12.316 -21.219 -24.742 1.00 0.00 H ATOM 615 H SER A 38 12.035 -25.139 -24.174 1.00 0.00 H ATOM 616 N PRO A 39 14.163 -23.455 -21.438 1.00 44.34 N ATOM 617 CA PRO A 39 13.677 -23.438 -20.054 1.00 37.82 C ATOM 618 C PRO A 39 12.387 -22.647 -19.939 1.00 30.67 C ATOM 619 O PRO A 39 12.157 -21.742 -20.741 1.00 35.05 O ATOM 620 CB PRO A 39 14.808 -22.745 -19.284 1.00 53.39 C ATOM 621 CG PRO A 39 15.577 -21.997 -20.306 1.00 60.76 C ATOM 622 CD PRO A 39 15.482 -22.812 -21.561 1.00 59.61 C ATOM 623 HA PRO A 39 13.450 -24.435 -19.675 1.00 0.00 H ATOM 624 HD3 PRO A 39 15.528 -22.177 -22.446 1.00 0.00 H ATOM 625 HD2 PRO A 39 16.278 -23.555 -21.607 1.00 0.00 H ATOM 626 HG3 PRO A 39 16.617 -21.892 -19.998 1.00 0.00 H ATOM 627 HG2 PRO A 39 15.144 -21.009 -20.460 1.00 0.00 H ATOM 628 HB2 PRO A 39 14.400 -22.063 -18.538 1.00 0.00 H ATOM 629 HB3 PRO A 39 15.443 -23.482 -18.792 1.00 0.00 H ATOM 630 N PRO A 40 11.543 -22.984 -18.957 1.00 29.11 N ATOM 631 CA PRO A 40 10.293 -22.234 -18.835 1.00 24.27 C ATOM 632 C PRO A 40 10.560 -20.783 -18.499 1.00 22.50 C ATOM 633 O PRO A 40 11.607 -20.472 -17.932 1.00 22.20 O ATOM 634 CB PRO A 40 9.575 -22.930 -17.677 1.00 33.09 C ATOM 635 CG PRO A 40 10.658 -23.554 -16.881 1.00 33.77 C ATOM 636 CD PRO A 40 11.712 -23.961 -17.869 1.00 36.33 C ATOM 637 HA PRO A 40 9.714 -22.225 -19.758 1.00 0.00 H ATOM 638 HD3 PRO A 40 12.708 -23.891 -17.431 1.00 0.00 H ATOM 639 HD2 PRO A 40 11.544 -24.977 -18.225 1.00 0.00 H ATOM 640 HG3 PRO A 40 10.282 -24.426 -16.346 1.00 0.00 H ATOM 641 HG2 PRO A 40 11.064 -22.838 -16.166 1.00 0.00 H ATOM 642 HB2 PRO A 40 9.024 -22.207 -17.076 1.00 0.00 H ATOM 643 HB3 PRO A 40 8.887 -23.688 -18.051 1.00 0.00 H ATOM 644 N ARG A 41 9.637 -19.909 -18.876 1.00 21.74 N ATOM 645 CA ARG A 41 9.737 -18.491 -18.562 1.00 20.28 C ATOM 646 C ARG A 41 8.475 -18.071 -17.838 1.00 17.89 C ATOM 647 O ARG A 41 7.372 -18.476 -18.205 1.00 20.04 O ATOM 648 CB ARG A 41 9.897 -17.648 -19.827 1.00 23.22 C ATOM 649 CG ARG A 41 11.132 -17.961 -20.639 1.00 29.56 C ATOM 650 CD ARG A 41 12.385 -17.849 -19.803 1.00 31.43 C ATOM 651 NE ARG A 41 12.529 -16.522 -19.197 1.00 32.70 N ATOM 652 CZ ARG A 41 13.257 -15.534 -19.710 1.00 34.77 C ATOM 653 NH1 ARG A 41 13.923 -15.708 -20.844 1.00 39.58 N ATOM 654 NH2 ARG A 41 13.323 -14.365 -19.083 1.00 32.06 N ATOM 655 HA ARG A 41 10.617 -18.331 -17.939 1.00 0.00 H ATOM 656 HB2 ARG A 41 9.024 -17.813 -20.458 1.00 0.00 H ATOM 657 HB3 ARG A 41 9.939 -16.599 -19.534 1.00 0.00 H ATOM 658 HG2 ARG A 41 11.054 -18.977 -21.027 1.00 0.00 H ATOM 659 HG3 ARG A 41 11.197 -17.260 -21.471 1.00 0.00 H ATOM 660 HD2 ARG A 41 13.250 -18.041 -20.438 1.00 0.00 H ATOM 661 HD3 ARG A 41 12.346 -18.595 -19.010 1.00 0.00 H ATOM 662 HE ARG A 41 12.027 -16.340 -18.304 1.00 0.00 H ATOM 663 HH12 ARG A 41 14.490 -14.931 -21.239 1.00 0.00 H ATOM 664 HH11 ARG A 41 13.878 -16.622 -21.338 1.00 0.00 H ATOM 665 HH22 ARG A 41 13.892 -13.592 -19.483 1.00 0.00 H ATOM 666 HH21 ARG A 41 12.806 -14.223 -18.192 1.00 0.00 H ATOM 667 H ARG A 41 8.814 -20.248 -19.414 1.00 0.00 H ATOM 668 N TYR A 42 8.633 -17.262 -16.801 1.00 14.09 N ATOM 669 CA TYR A 42 7.489 -16.835 -16.015 1.00 13.39 C ATOM 670 C TYR A 42 7.191 -15.357 -16.162 1.00 15.11 C ATOM 671 O TYR A 42 8.090 -14.524 -16.088 1.00 15.71 O ATOM 672 CB TYR A 42 7.735 -17.159 -14.549 1.00 12.24 C ATOM 673 CG TYR A 42 7.862 -18.642 -14.288 1.00 13.53 C ATOM 674 CD1 TYR A 42 6.739 -19.449 -14.225 1.00 16.22 C ATOM 675 CD2 TYR A 42 9.107 -19.230 -14.121 1.00 15.51 C ATOM 676 CE1 TYR A 42 6.849 -20.802 -13.992 1.00 17.16 C ATOM 677 CE2 TYR A 42 9.230 -20.584 -13.881 1.00 17.75 C ATOM 678 CZ TYR A 42 8.099 -21.366 -13.819 1.00 18.22 C ATOM 679 OH TYR A 42 8.208 -22.721 -13.571 1.00 19.53 O ATOM 680 HA TYR A 42 6.620 -17.376 -16.390 1.00 0.00 H ATOM 681 HB3 TYR A 42 6.902 -16.772 -13.962 1.00 0.00 H ATOM 682 HB2 TYR A 42 8.657 -16.670 -14.234 1.00 0.00 H ATOM 683 HD2 TYR A 42 10.003 -18.613 -14.180 1.00 0.00 H ATOM 684 HE2 TYR A 42 10.215 -21.030 -13.742 1.00 0.00 H ATOM 685 HE1 TYR A 42 5.955 -21.424 -13.944 1.00 0.00 H ATOM 686 HD1 TYR A 42 5.752 -19.007 -14.362 1.00 0.00 H ATOM 687 HH TYR A 42 7.305 -23.127 -13.560 1.00 0.00 H ATOM 688 H TYR A 42 9.585 -16.930 -16.547 1.00 0.00 H ATOM 689 N ARG A 43 5.911 -15.062 -16.376 1.00 13.16 N ATOM 690 CA ARG A 43 5.405 -13.706 -16.477 1.00 12.64 C ATOM 691 C ARG A 43 4.711 -13.372 -15.168 1.00 12.96 C ATOM 692 O ARG A 43 4.033 -14.231 -14.582 1.00 13.61 O ATOM 693 CB ARG A 43 4.406 -13.636 -17.630 1.00 14.02 C ATOM 694 CG ARG A 43 3.782 -12.277 -17.879 1.00 15.65 C ATOM 695 CD ARG A 43 2.791 -12.319 -19.036 1.00 20.39 C ATOM 696 NE ARG A 43 2.172 -11.012 -19.241 1.00 20.14 N ATOM 697 CZ ARG A 43 1.220 -10.770 -20.132 1.00 33.95 C ATOM 698 NH1 ARG A 43 0.766 -11.751 -20.904 1.00 39.08 N ATOM 699 NH2 ARG A 43 0.721 -9.549 -20.248 1.00 30.11 N ATOM 700 HA ARG A 43 6.212 -12.998 -16.664 1.00 0.00 H ATOM 701 HB2 ARG A 43 4.923 -13.939 -18.540 1.00 0.00 H ATOM 702 HB3 ARG A 43 3.601 -14.341 -17.419 1.00 0.00 H ATOM 703 HG2 ARG A 43 3.260 -11.956 -16.977 1.00 0.00 H ATOM 704 HG3 ARG A 43 4.571 -11.563 -18.114 1.00 0.00 H ATOM 705 HD2 ARG A 43 2.014 -13.051 -18.814 1.00 0.00 H ATOM 706 HD3 ARG A 43 3.316 -12.612 -19.945 1.00 0.00 H ATOM 707 HE ARG A 43 2.499 -10.221 -18.651 1.00 0.00 H ATOM 708 HH12 ARG A 43 0.019 -11.560 -21.602 1.00 0.00 H ATOM 709 HH11 ARG A 43 1.157 -12.710 -20.810 1.00 0.00 H ATOM 710 HH22 ARG A 43 -0.026 -9.357 -20.946 1.00 0.00 H ATOM 711 HH21 ARG A 43 1.076 -8.782 -19.641 1.00 0.00 H ATOM 712 H ARG A 43 5.236 -15.847 -16.476 1.00 0.00 H ATOM 713 N LEU A 44 4.888 -12.139 -14.701 1.00 11.90 N ATOM 714 CA LEU A 44 4.294 -11.710 -13.443 1.00 11.69 C ATOM 715 C LEU A 44 3.412 -10.500 -13.617 1.00 14.21 C ATOM 716 O LEU A 44 3.758 -9.538 -14.317 1.00 14.73 O ATOM 717 CB LEU A 44 5.354 -11.354 -12.409 1.00 11.81 C ATOM 718 CG LEU A 44 6.294 -12.478 -12.008 1.00 18.28 C ATOM 719 CD1 LEU A 44 7.431 -12.523 -12.988 1.00 22.49 C ATOM 720 CD2 LEU A 44 6.808 -12.299 -10.590 1.00 19.14 C ATOM 721 HA LEU A 44 3.701 -12.558 -13.099 1.00 0.00 H ATOM 722 HB2 LEU A 44 5.958 -10.542 -12.815 1.00 0.00 H ATOM 723 HB3 LEU A 44 4.842 -11.010 -11.510 1.00 0.00 H ATOM 724 HG LEU A 44 5.750 -13.422 -12.027 1.00 0.00 H ATOM 725 HD21 LEU A 44 7.349 -11.355 -10.517 1.00 0.00 H ATOM 726 HD22 LEU A 44 5.966 -12.291 -9.898 1.00 0.00 H ATOM 727 HD23 LEU A 44 7.477 -13.123 -10.341 1.00 0.00 H ATOM 728 HD11 LEU A 44 7.039 -12.705 -13.989 1.00 0.00 H ATOM 729 HD12 LEU A 44 7.961 -11.571 -12.971 1.00 0.00 H ATOM 730 HD13 LEU A 44 8.115 -13.326 -12.713 1.00 0.00 H ATOM 731 H LEU A 44 5.464 -11.466 -15.247 1.00 0.00 H ATOM 732 N LEU A 45 2.268 -10.560 -12.946 1.00 12.02 N ATOM 733 CA LEU A 45 1.432 -9.395 -12.740 1.00 11.17 C ATOM 734 C LEU A 45 1.820 -8.880 -11.371 1.00 11.25 C ATOM 735 O LEU A 45 1.630 -9.600 -10.375 1.00 13.21 O ATOM 736 CB LEU A 45 -0.040 -9.797 -12.769 1.00 13.54 C ATOM 737 CG LEU A 45 -1.067 -8.696 -12.489 1.00 14.88 C ATOM 738 CD1 LEU A 45 -1.042 -7.621 -13.548 1.00 16.33 C ATOM 739 CD2 LEU A 45 -2.464 -9.307 -12.369 1.00 15.41 C ATOM 740 HA LEU A 45 1.568 -8.639 -13.513 1.00 0.00 H ATOM 741 HB2 LEU A 45 -0.252 -10.200 -13.759 1.00 0.00 H ATOM 742 HB3 LEU A 45 -0.183 -10.578 -12.022 1.00 0.00 H ATOM 743 HG LEU A 45 -0.802 -8.220 -11.545 1.00 0.00 H ATOM 744 HD21 LEU A 45 -2.720 -9.810 -13.301 1.00 0.00 H ATOM 745 HD22 LEU A 45 -2.475 -10.027 -11.551 1.00 0.00 H ATOM 746 HD23 LEU A 45 -3.189 -8.517 -12.170 1.00 0.00 H ATOM 747 HD11 LEU A 45 -0.052 -7.166 -13.578 1.00 0.00 H ATOM 748 HD12 LEU A 45 -1.270 -8.063 -14.518 1.00 0.00 H ATOM 749 HD13 LEU A 45 -1.786 -6.861 -13.310 1.00 0.00 H ATOM 750 H LEU A 45 1.962 -11.474 -12.555 1.00 0.00 H ATOM 751 N MET A 46 2.388 -7.668 -11.343 1.00 12.77 N ATOM 752 CA MET A 46 2.833 -7.076 -10.092 1.00 11.96 C ATOM 753 C MET A 46 2.139 -5.761 -9.837 1.00 11.64 C ATOM 754 O MET A 46 1.591 -5.156 -10.751 1.00 13.88 O ATOM 755 CB MET A 46 4.343 -6.880 -10.117 1.00 16.66 C ATOM 756 CG MET A 46 5.071 -8.129 -10.549 1.00 17.16 C ATOM 757 SD MET A 46 6.829 -8.013 -10.243 1.00 15.82 S ATOM 758 CE MET A 46 6.860 -8.163 -8.457 1.00 20.09 C ATOM 759 HA MET A 46 2.575 -7.756 -9.280 1.00 0.00 H ATOM 760 HB2 MET A 46 4.582 -6.075 -10.813 1.00 0.00 H ATOM 761 HB3 MET A 46 4.679 -6.605 -9.117 1.00 0.00 H ATOM 762 HG2 MET A 46 4.908 -8.282 -11.616 1.00 0.00 H ATOM 763 HG3 MET A 46 4.672 -8.979 -9.996 1.00 0.00 H ATOM 764 HE1 MET A 46 6.282 -7.351 -8.015 1.00 0.00 H ATOM 765 HE2 MET A 46 6.425 -9.119 -8.166 1.00 0.00 H ATOM 766 HE3 MET A 46 7.891 -8.110 -8.107 1.00 0.00 H ATOM 767 H MET A 46 2.513 -7.141 -12.231 1.00 0.00 H ATOM 768 N SER A 47 2.168 -5.345 -8.577 1.00 10.46 N ATOM 769 CA SER A 47 1.457 -4.169 -8.110 1.00 11.43 C ATOM 770 C SER A 47 2.367 -3.304 -7.259 1.00 11.54 C ATOM 771 O SER A 47 3.143 -3.820 -6.461 1.00 13.05 O ATOM 772 CB SER A 47 0.282 -4.609 -7.259 1.00 12.59 C ATOM 773 OG SER A 47 -0.256 -3.507 -6.539 1.00 15.12 O ATOM 774 HA SER A 47 1.117 -3.597 -8.974 1.00 0.00 H ATOM 775 HB2 SER A 47 0.616 -5.370 -6.553 1.00 0.00 H ATOM 776 HB3 SER A 47 -0.491 -5.027 -7.904 1.00 0.00 H ATOM 777 HG SER A 47 -1.021 -3.814 -5.990 1.00 0.00 H ATOM 778 H SER A 47 2.728 -5.889 -7.890 1.00 0.00 H ATOM 779 N ASP A 48 2.272 -1.992 -7.428 1.00 12.23 N ATOM 780 CA ASP A 48 2.963 -1.069 -6.544 1.00 13.24 C ATOM 781 C ASP A 48 1.981 -0.393 -5.597 1.00 15.85 C ATOM 782 O ASP A 48 2.329 0.589 -4.942 1.00 18.69 O ATOM 783 CB ASP A 48 3.771 -0.034 -7.343 1.00 15.47 C ATOM 784 CG ASP A 48 2.900 0.949 -8.101 1.00 15.61 C ATOM 785 OD1 ASP A 48 1.656 0.829 -8.059 1.00 16.94 O ATOM 786 OD2 ASP A 48 3.480 1.863 -8.736 1.00 16.46 O ATOM 787 HA ASP A 48 3.669 -1.641 -5.943 1.00 0.00 H ATOM 788 HB2 ASP A 48 4.401 0.524 -6.650 1.00 0.00 H ATOM 789 HB3 ASP A 48 4.400 -0.563 -8.059 1.00 0.00 H ATOM 790 H ASP A 48 1.693 -1.618 -8.207 1.00 0.00 H ATOM 791 N GLY A 49 0.763 -0.928 -5.518 1.00 13.64 N ATOM 792 CA GLY A 49 -0.291 -0.342 -4.692 1.00 16.71 C ATOM 793 C GLY A 49 -1.230 0.624 -5.416 1.00 19.89 C ATOM 794 O GLY A 49 -2.391 0.793 -5.019 1.00 24.64 O ATOM 795 HA3 GLY A 49 0.184 0.200 -3.874 1.00 0.00 H ATOM 796 HA2 GLY A 49 -0.892 -1.156 -4.286 1.00 0.00 H ATOM 797 H GLY A 49 0.556 -1.790 -6.061 1.00 0.00 H ATOM 798 N LEU A 50 -0.719 1.282 -6.451 1.00 17.49 N ATOM 799 CA LEU A 50 -1.506 2.203 -7.264 1.00 18.93 C ATOM 800 C LEU A 50 -1.883 1.535 -8.578 1.00 15.10 C ATOM 801 O LEU A 50 -3.030 1.591 -9.019 1.00 16.50 O ATOM 802 CB LEU A 50 -0.689 3.465 -7.550 1.00 21.61 C ATOM 803 CG LEU A 50 -1.088 4.779 -6.870 1.00 23.42 C ATOM 804 CD1 LEU A 50 -1.465 4.590 -5.406 1.00 22.80 C ATOM 805 CD2 LEU A 50 0.058 5.775 -6.988 1.00 24.41 C ATOM 806 HA LEU A 50 -2.413 2.473 -6.722 1.00 0.00 H ATOM 807 HB2 LEU A 50 0.339 3.253 -7.257 1.00 0.00 H ATOM 808 HB3 LEU A 50 -0.731 3.636 -8.626 1.00 0.00 H ATOM 809 HG LEU A 50 -1.974 5.158 -7.379 1.00 0.00 H ATOM 810 HD21 LEU A 50 0.944 5.366 -6.502 1.00 0.00 H ATOM 811 HD22 LEU A 50 0.271 5.958 -8.041 1.00 0.00 H ATOM 812 HD23 LEU A 50 -0.224 6.710 -6.505 1.00 0.00 H ATOM 813 HD11 LEU A 50 -2.310 3.906 -5.335 1.00 0.00 H ATOM 814 HD12 LEU A 50 -0.615 4.176 -4.864 1.00 0.00 H ATOM 815 HD13 LEU A 50 -1.739 5.553 -4.975 1.00 0.00 H ATOM 816 H LEU A 50 0.282 1.135 -6.691 1.00 0.00 H ATOM 817 N ASN A 51 -0.889 0.906 -9.201 1.00 14.96 N ATOM 818 CA ASN A 51 -1.061 0.277 -10.487 1.00 13.67 C ATOM 819 C ASN A 51 -0.683 -1.180 -10.439 1.00 14.11 C ATOM 820 O ASN A 51 0.151 -1.581 -9.616 1.00 13.71 O ATOM 821 CB ASN A 51 -0.143 0.911 -11.534 1.00 14.65 C ATOM 822 CG ASN A 51 -0.619 2.260 -12.006 1.00 18.42 C ATOM 823 OD1 ASN A 51 0.098 3.244 -11.893 1.00 19.83 O ATOM 824 ND2 ASN A 51 -1.811 2.303 -12.586 1.00 17.32 N ATOM 825 HA ASN A 51 -2.112 0.404 -10.746 1.00 0.00 H ATOM 826 HB2 ASN A 51 0.850 1.027 -11.099 1.00 0.00 H ATOM 827 HB3 ASN A 51 -0.086 0.244 -12.394 1.00 0.00 H ATOM 828 HD22 ASN A 51 -2.385 1.439 -12.659 1.00 0.00 H ATOM 829 HD21 ASN A 51 -2.171 3.201 -12.968 1.00 0.00 H ATOM 830 H ASN A 51 0.044 0.867 -8.744 1.00 0.00 H ATOM 831 N THR A 52 -1.267 -1.958 -11.340 1.00 14.04 N ATOM 832 CA THR A 52 -0.703 -3.254 -11.674 1.00 12.68 C ATOM 833 C THR A 52 -0.089 -3.165 -13.060 1.00 15.25 C ATOM 834 O THR A 52 -0.430 -2.284 -13.851 1.00 16.56 O ATOM 835 CB THR A 52 -1.747 -4.377 -11.658 1.00 15.17 C ATOM 836 OG1 THR A 52 -2.763 -4.105 -12.630 1.00 16.65 O ATOM 837 CG2 THR A 52 -2.395 -4.496 -10.299 1.00 18.26 C ATOM 838 HA THR A 52 0.044 -3.500 -10.919 1.00 0.00 H ATOM 839 HB THR A 52 -1.239 -5.313 -11.892 1.00 0.00 H ATOM 840 HG1 THR A 52 -2.352 -4.051 -13.529 1.00 0.00 H ATOM 841 HG23 THR A 52 -1.630 -4.703 -9.550 1.00 0.00 H ATOM 842 HG21 THR A 52 -2.900 -3.561 -10.056 1.00 0.00 H ATOM 843 HG22 THR A 52 -3.121 -5.309 -10.314 1.00 0.00 H ATOM 844 H THR A 52 -2.137 -1.637 -11.812 1.00 0.00 H ATOM 845 N LEU A 53 0.816 -4.090 -13.343 1.00 13.57 N ATOM 846 CA LEU A 53 1.475 -4.166 -14.641 1.00 13.42 C ATOM 847 C LEU A 53 1.822 -5.630 -14.881 1.00 13.05 C ATOM 848 O LEU A 53 2.366 -6.287 -13.992 1.00 13.17 O ATOM 849 CB LEU A 53 2.744 -3.318 -14.620 1.00 17.99 C ATOM 850 CG LEU A 53 3.492 -3.159 -15.949 1.00 19.29 C ATOM 851 CD1 LEU A 53 2.755 -2.219 -16.885 1.00 25.77 C ATOM 852 CD2 LEU A 53 4.907 -2.655 -15.710 1.00 23.88 C ATOM 853 HA LEU A 53 0.830 -3.790 -15.435 1.00 0.00 H ATOM 854 HB2 LEU A 53 2.469 -2.321 -14.275 1.00 0.00 H ATOM 855 HB3 LEU A 53 3.432 -3.771 -13.906 1.00 0.00 H ATOM 856 HG LEU A 53 3.542 -4.140 -16.421 1.00 0.00 H ATOM 857 HD21 LEU A 53 4.867 -1.688 -15.209 1.00 0.00 H ATOM 858 HD22 LEU A 53 5.444 -3.368 -15.085 1.00 0.00 H ATOM 859 HD23 LEU A 53 5.420 -2.549 -16.666 1.00 0.00 H ATOM 860 HD11 LEU A 53 1.762 -2.618 -17.090 1.00 0.00 H ATOM 861 HD12 LEU A 53 2.665 -1.239 -16.417 1.00 0.00 H ATOM 862 HD13 LEU A 53 3.311 -2.128 -17.818 1.00 0.00 H ATOM 863 H LEU A 53 1.065 -4.787 -12.613 1.00 0.00 H ATOM 864 N SER A 54 1.503 -6.147 -16.069 1.00 15.34 N ATOM 865 CA SER A 54 1.744 -7.562 -16.367 1.00 16.18 C ATOM 866 C SER A 54 2.936 -7.764 -17.303 1.00 16.92 C ATOM 867 O SER A 54 3.146 -8.860 -17.815 1.00 19.85 O ATOM 868 CB SER A 54 0.502 -8.203 -16.987 1.00 22.95 C ATOM 869 OG SER A 54 0.179 -7.574 -18.202 1.00 26.82 O ATOM 870 HA SER A 54 1.974 -8.045 -15.417 1.00 0.00 H ATOM 871 HB2 SER A 54 -0.336 -8.103 -16.297 1.00 0.00 H ATOM 872 HB3 SER A 54 0.697 -9.260 -17.170 1.00 0.00 H ATOM 873 HG SER A 54 -0.001 -6.614 -18.038 1.00 0.00 H ATOM 874 H SER A 54 1.077 -5.536 -16.795 1.00 0.00 H ATOM 875 N SER A 55 3.723 -6.710 -17.482 1.00 15.45 N ATOM 876 CA SER A 55 4.871 -6.699 -18.388 1.00 16.43 C ATOM 877 C SER A 55 6.152 -7.290 -17.793 1.00 13.85 C ATOM 878 O SER A 55 7.205 -7.224 -18.416 1.00 17.44 O ATOM 879 CB SER A 55 5.172 -5.248 -18.783 1.00 22.56 C ATOM 880 OG SER A 55 4.027 -4.588 -19.285 1.00 27.20 O ATOM 881 HA SER A 55 4.591 -7.324 -19.236 1.00 0.00 H ATOM 882 HB2 SER A 55 5.945 -5.245 -19.551 1.00 0.00 H ATOM 883 HB3 SER A 55 5.532 -4.711 -17.905 1.00 0.00 H ATOM 884 HG SER A 55 3.697 -5.066 -20.087 1.00 0.00 H ATOM 885 H SER A 55 3.511 -5.843 -16.948 1.00 0.00 H ATOM 886 N PHE A 56 6.069 -7.877 -16.606 1.00 14.95 N ATOM 887 CA PHE A 56 7.253 -8.387 -15.931 1.00 14.67 C ATOM 888 C PHE A 56 7.529 -9.813 -16.325 1.00 14.43 C ATOM 889 O PHE A 56 6.610 -10.624 -16.468 1.00 14.17 O ATOM 890 CB PHE A 56 7.067 -8.360 -14.417 1.00 12.01 C ATOM 891 CG PHE A 56 6.969 -6.973 -13.842 1.00 14.54 C ATOM 892 CD1 PHE A 56 8.107 -6.253 -13.534 1.00 13.90 C ATOM 893 CD2 PHE A 56 5.735 -6.396 -13.600 1.00 16.68 C ATOM 894 CE1 PHE A 56 8.017 -4.975 -12.994 1.00 15.47 C ATOM 895 CE2 PHE A 56 5.643 -5.130 -13.063 1.00 19.30 C ATOM 896 CZ PHE A 56 6.779 -4.419 -12.756 1.00 15.62 C ATOM 897 HA PHE A 56 8.084 -7.747 -16.226 1.00 0.00 H ATOM 898 HB2 PHE A 56 6.151 -8.899 -14.173 1.00 0.00 H ATOM 899 HB3 PHE A 56 7.917 -8.864 -13.957 1.00 0.00 H ATOM 900 HD2 PHE A 56 4.826 -6.949 -13.837 1.00 0.00 H ATOM 901 HE2 PHE A 56 4.663 -4.689 -12.880 1.00 0.00 H ATOM 902 HZ PHE A 56 6.701 -3.420 -12.326 1.00 0.00 H ATOM 903 HE1 PHE A 56 8.922 -4.415 -12.760 1.00 0.00 H ATOM 904 HD1 PHE A 56 9.088 -6.692 -13.717 1.00 0.00 H ATOM 905 H PHE A 56 5.140 -7.975 -16.149 1.00 0.00 H ATOM 906 N MET A 57 8.813 -10.105 -16.490 1.00 13.34 N ATOM 907 CA MET A 57 9.291 -11.456 -16.752 1.00 14.34 C ATOM 908 C MET A 57 10.434 -11.758 -15.789 1.00 16.91 C ATOM 909 O MET A 57 11.307 -10.917 -15.582 1.00 17.43 O ATOM 910 CB MET A 57 9.805 -11.582 -18.190 1.00 17.44 C ATOM 911 CG MET A 57 8.737 -11.513 -19.274 1.00 15.21 C ATOM 912 SD MET A 57 7.583 -12.905 -19.291 1.00 16.71 S ATOM 913 CE MET A 57 8.692 -14.307 -19.394 1.00 27.48 C ATOM 914 HA MET A 57 8.469 -12.159 -16.614 1.00 0.00 H ATOM 915 HB2 MET A 57 10.515 -10.774 -18.366 1.00 0.00 H ATOM 916 HB3 MET A 57 10.316 -12.540 -18.282 1.00 0.00 H ATOM 917 HG2 MET A 57 9.237 -11.475 -20.242 1.00 0.00 H ATOM 918 HG3 MET A 57 8.163 -10.598 -19.127 1.00 0.00 H ATOM 919 HE1 MET A 57 9.286 -14.233 -20.305 1.00 0.00 H ATOM 920 HE2 MET A 57 9.353 -14.310 -18.527 1.00 0.00 H ATOM 921 HE3 MET A 57 8.110 -15.228 -19.412 1.00 0.00 H ATOM 922 H MET A 57 9.509 -9.335 -16.430 1.00 0.00 H ATOM 923 N LEU A 58 10.440 -12.955 -15.227 1.00 13.41 N ATOM 924 CA LEU A 58 11.543 -13.392 -14.394 1.00 14.88 C ATOM 925 C LEU A 58 12.720 -13.796 -15.279 1.00 14.85 C ATOM 926 O LEU A 58 12.545 -14.525 -16.246 1.00 16.49 O ATOM 927 CB LEU A 58 11.092 -14.578 -13.542 1.00 17.73 C ATOM 928 CG LEU A 58 11.414 -14.559 -12.048 1.00 21.81 C ATOM 929 CD1 LEU A 58 10.859 -13.323 -11.354 1.00 20.26 C ATOM 930 CD2 LEU A 58 10.878 -15.825 -11.389 1.00 22.74 C ATOM 931 HA LEU A 58 11.856 -12.580 -13.738 1.00 0.00 H ATOM 932 HB2 LEU A 58 10.009 -14.652 -13.638 1.00 0.00 H ATOM 933 HB3 LEU A 58 11.555 -15.472 -13.961 1.00 0.00 H ATOM 934 HG LEU A 58 12.498 -14.523 -11.943 1.00 0.00 H ATOM 935 HD21 LEU A 58 9.798 -15.875 -11.525 1.00 0.00 H ATOM 936 HD22 LEU A 58 11.344 -16.697 -11.848 1.00 0.00 H ATOM 937 HD23 LEU A 58 11.111 -15.805 -10.324 1.00 0.00 H ATOM 938 HD11 LEU A 58 11.291 -12.430 -11.805 1.00 0.00 H ATOM 939 HD12 LEU A 58 9.775 -13.300 -11.467 1.00 0.00 H ATOM 940 HD13 LEU A 58 11.115 -13.357 -10.295 1.00 0.00 H ATOM 941 H LEU A 58 9.637 -13.596 -15.386 1.00 0.00 H ATOM 942 N ALA A 59 13.914 -13.317 -14.949 1.00 15.03 N ATOM 943 CA ALA A 59 15.103 -13.862 -15.578 1.00 13.59 C ATOM 944 C ALA A 59 15.111 -15.355 -15.250 1.00 16.83 C ATOM 945 O ALA A 59 14.670 -15.759 -14.181 1.00 16.84 O ATOM 946 CB ALA A 59 16.356 -13.190 -15.049 1.00 16.36 C ATOM 947 HA ALA A 59 15.090 -13.691 -16.654 1.00 0.00 H ATOM 948 HB1 ALA A 59 16.309 -12.121 -15.257 1.00 0.00 H ATOM 949 HB2 ALA A 59 16.425 -13.349 -13.973 1.00 0.00 H ATOM 950 HB3 ALA A 59 17.231 -13.619 -15.538 1.00 0.00 H ATOM 951 H ALA A 59 13.996 -12.556 -14.245 1.00 0.00 H ATOM 952 N THR A 60 15.609 -16.185 -16.160 1.00 17.09 N ATOM 953 CA THR A 60 15.572 -17.631 -15.975 1.00 18.69 C ATOM 954 C THR A 60 16.318 -18.063 -14.709 1.00 16.11 C ATOM 955 O THR A 60 15.946 -19.048 -14.063 1.00 19.55 O ATOM 956 CB THR A 60 16.163 -18.360 -17.198 1.00 24.85 C ATOM 957 OG1 THR A 60 15.675 -17.755 -18.403 1.00 24.57 O ATOM 958 CG2 THR A 60 15.776 -19.829 -17.181 1.00 26.98 C ATOM 959 HA THR A 60 14.523 -17.908 -15.865 1.00 0.00 H ATOM 960 HB THR A 60 17.249 -18.280 -17.158 1.00 0.00 H ATOM 961 HG1 THR A 60 15.945 -16.803 -18.426 1.00 0.00 H ATOM 962 HG23 THR A 60 16.146 -20.290 -16.266 1.00 0.00 H ATOM 963 HG21 THR A 60 14.690 -19.918 -17.221 1.00 0.00 H ATOM 964 HG22 THR A 60 16.215 -20.329 -18.045 1.00 0.00 H ATOM 965 H THR A 60 16.035 -15.794 -17.024 1.00 0.00 H ATOM 966 N GLN A 61 17.364 -17.321 -14.351 1.00 17.14 N ATOM 967 CA GLN A 61 18.151 -17.651 -13.166 1.00 18.30 C ATOM 968 C GLN A 61 17.315 -17.598 -11.884 1.00 18.56 C ATOM 969 O GLN A 61 17.687 -18.194 -10.865 1.00 24.49 O ATOM 970 CB GLN A 61 19.360 -16.713 -13.052 1.00 24.46 C ATOM 971 CG GLN A 61 18.991 -15.252 -12.802 1.00 30.80 C ATOM 972 CD GLN A 61 20.170 -14.303 -12.949 1.00 39.95 C ATOM 973 OE1 GLN A 61 21.250 -14.692 -13.400 1.00 41.30 O ATOM 974 NE2 GLN A 61 19.968 -13.049 -12.566 1.00 31.17 N ATOM 975 HA GLN A 61 18.500 -18.677 -13.284 1.00 0.00 H ATOM 976 HB2 GLN A 61 19.983 -17.056 -12.226 1.00 0.00 H ATOM 977 HB3 GLN A 61 19.927 -16.770 -13.981 1.00 0.00 H ATOM 978 HG2 GLN A 61 18.221 -14.962 -13.517 1.00 0.00 H ATOM 979 HG3 GLN A 61 18.598 -15.162 -11.789 1.00 0.00 H ATOM 980 HE22 GLN A 61 19.041 -12.763 -12.191 1.00 0.00 H ATOM 981 HE21 GLN A 61 20.736 -12.352 -12.641 1.00 0.00 H ATOM 982 H GLN A 61 17.625 -16.493 -14.924 1.00 0.00 H ATOM 983 N LEU A 62 16.194 -16.885 -11.935 1.00 16.31 N ATOM 984 CA LEU A 62 15.287 -16.794 -10.795 1.00 14.68 C ATOM 985 C LEU A 62 14.158 -17.822 -10.840 1.00 14.46 C ATOM 986 O LEU A 62 13.324 -17.865 -9.924 1.00 15.32 O ATOM 987 CB LEU A 62 14.681 -15.396 -10.717 1.00 17.77 C ATOM 988 CG LEU A 62 15.661 -14.245 -10.518 1.00 19.97 C ATOM 989 CD1 LEU A 62 14.870 -12.949 -10.400 1.00 20.06 C ATOM 990 CD2 LEU A 62 16.548 -14.461 -9.306 1.00 26.52 C ATOM 991 HA LEU A 62 15.887 -17.005 -9.910 1.00 0.00 H ATOM 992 HB2 LEU A 62 14.141 -15.216 -11.646 1.00 0.00 H ATOM 993 HB3 LEU A 62 13.980 -15.384 -9.882 1.00 0.00 H ATOM 994 HG LEU A 62 16.328 -14.192 -11.379 1.00 0.00 H ATOM 995 HD21 LEU A 62 15.928 -14.541 -8.413 1.00 0.00 H ATOM 996 HD22 LEU A 62 17.121 -15.379 -9.435 1.00 0.00 H ATOM 997 HD23 LEU A 62 17.230 -13.617 -9.202 1.00 0.00 H ATOM 998 HD11 LEU A 62 14.293 -12.793 -11.311 1.00 0.00 H ATOM 999 HD12 LEU A 62 14.194 -13.014 -9.547 1.00 0.00 H ATOM 1000 HD13 LEU A 62 15.559 -12.116 -10.257 1.00 0.00 H ATOM 1001 H LEU A 62 15.957 -16.378 -12.812 1.00 0.00 H ATOM 1002 N ASN A 63 14.122 -18.679 -11.856 1.00 14.70 N ATOM 1003 CA ASN A 63 13.060 -19.687 -11.911 1.00 14.70 C ATOM 1004 C ASN A 63 12.893 -20.528 -10.633 1.00 13.05 C ATOM 1005 O ASN A 63 11.765 -20.844 -10.246 1.00 14.89 O ATOM 1006 CB ASN A 63 13.289 -20.613 -13.095 1.00 14.78 C ATOM 1007 CG ASN A 63 12.873 -19.985 -14.401 1.00 17.37 C ATOM 1008 OD1 ASN A 63 12.470 -18.823 -14.443 1.00 16.75 O ATOM 1009 ND2 ASN A 63 12.962 -20.753 -15.481 1.00 19.83 N ATOM 1010 HA ASN A 63 12.134 -19.122 -12.019 1.00 0.00 H ATOM 1011 HB2 ASN A 63 14.349 -20.861 -13.147 1.00 0.00 H ATOM 1012 HB3 ASN A 63 12.711 -21.525 -12.944 1.00 0.00 H ATOM 1013 HD22 ASN A 63 13.309 -21.730 -15.397 1.00 0.00 H ATOM 1014 HD21 ASN A 63 12.685 -20.377 -16.410 1.00 0.00 H ATOM 1015 H ASN A 63 14.842 -18.634 -12.605 1.00 0.00 H ATOM 1016 N PRO A 64 14.003 -20.885 -9.974 1.00 15.25 N ATOM 1017 CA PRO A 64 13.855 -21.695 -8.761 1.00 14.86 C ATOM 1018 C PRO A 64 12.974 -21.026 -7.698 1.00 14.46 C ATOM 1019 O PRO A 64 12.374 -21.724 -6.878 1.00 16.99 O ATOM 1020 CB PRO A 64 15.296 -21.844 -8.275 1.00 17.96 C ATOM 1021 CG PRO A 64 16.115 -21.754 -9.522 1.00 19.01 C ATOM 1022 CD PRO A 64 15.420 -20.738 -10.366 1.00 14.15 C ATOM 1023 HA PRO A 64 13.355 -22.644 -8.956 1.00 0.00 H ATOM 1024 HD3 PRO A 64 15.784 -19.734 -10.148 1.00 0.00 H ATOM 1025 HD2 PRO A 64 15.557 -20.951 -11.426 1.00 0.00 H ATOM 1026 HG3 PRO A 64 16.147 -22.718 -10.030 1.00 0.00 H ATOM 1027 HG2 PRO A 64 17.131 -21.432 -9.292 1.00 0.00 H ATOM 1028 HB2 PRO A 64 15.556 -21.043 -7.583 1.00 0.00 H ATOM 1029 HB3 PRO A 64 15.441 -22.807 -7.785 1.00 0.00 H ATOM 1030 N LEU A 65 12.878 -19.702 -7.709 1.00 15.47 N ATOM 1031 CA LEU A 65 12.040 -19.023 -6.710 1.00 13.81 C ATOM 1032 C LEU A 65 10.577 -19.413 -6.873 1.00 14.10 C ATOM 1033 O LEU A 65 9.840 -19.544 -5.887 1.00 16.63 O ATOM 1034 CB LEU A 65 12.158 -17.514 -6.808 1.00 16.49 C ATOM 1035 CG LEU A 65 13.553 -16.952 -6.604 1.00 24.96 C ATOM 1036 CD1 LEU A 65 13.487 -15.434 -6.632 1.00 25.71 C ATOM 1037 CD2 LEU A 65 14.180 -17.452 -5.315 1.00 29.75 C ATOM 1038 HA LEU A 65 12.400 -19.341 -5.732 1.00 0.00 H ATOM 1039 HB2 LEU A 65 11.817 -17.214 -7.799 1.00 0.00 H ATOM 1040 HB3 LEU A 65 11.506 -17.076 -6.052 1.00 0.00 H ATOM 1041 HG LEU A 65 14.193 -17.300 -7.415 1.00 0.00 H ATOM 1042 HD21 LEU A 65 13.562 -17.149 -4.470 1.00 0.00 H ATOM 1043 HD22 LEU A 65 14.250 -18.539 -5.344 1.00 0.00 H ATOM 1044 HD23 LEU A 65 15.177 -17.026 -5.208 1.00 0.00 H ATOM 1045 HD11 LEU A 65 13.096 -15.106 -7.595 1.00 0.00 H ATOM 1046 HD12 LEU A 65 12.831 -15.085 -5.835 1.00 0.00 H ATOM 1047 HD13 LEU A 65 14.487 -15.025 -6.486 1.00 0.00 H ATOM 1048 H LEU A 65 13.394 -19.147 -8.422 1.00 0.00 H ATOM 1049 N VAL A 66 10.147 -19.574 -8.115 1.00 15.62 N ATOM 1050 CA VAL A 66 8.773 -19.972 -8.407 1.00 14.50 C ATOM 1051 C VAL A 66 8.599 -21.460 -8.205 1.00 16.80 C ATOM 1052 O VAL A 66 7.632 -21.920 -7.593 1.00 18.39 O ATOM 1053 CB VAL A 66 8.399 -19.614 -9.856 1.00 18.91 C ATOM 1054 CG1 VAL A 66 6.981 -20.079 -10.194 1.00 24.06 C ATOM 1055 CG2 VAL A 66 8.543 -18.125 -10.056 1.00 24.84 C ATOM 1056 HA VAL A 66 8.117 -19.433 -7.723 1.00 0.00 H ATOM 1057 HB VAL A 66 9.077 -20.133 -10.534 1.00 0.00 H ATOM 1058 HG11 VAL A 66 6.917 -21.161 -10.075 1.00 0.00 H ATOM 1059 HG12 VAL A 66 6.272 -19.596 -9.522 1.00 0.00 H ATOM 1060 HG13 VAL A 66 6.748 -19.811 -11.224 1.00 0.00 H ATOM 1061 HG21 VAL A 66 7.880 -17.601 -9.368 1.00 0.00 H ATOM 1062 HG22 VAL A 66 9.575 -17.832 -9.862 1.00 0.00 H ATOM 1063 HG23 VAL A 66 8.278 -17.870 -11.082 1.00 0.00 H ATOM 1064 H VAL A 66 10.806 -19.413 -8.904 1.00 0.00 H ATOM 1065 N GLU A 67 9.568 -22.218 -8.694 1.00 15.69 N ATOM 1066 CA GLU A 67 9.460 -23.653 -8.697 1.00 15.77 C ATOM 1067 C GLU A 67 9.620 -24.301 -7.336 1.00 16.11 C ATOM 1068 O GLU A 67 9.080 -25.386 -7.123 1.00 21.07 O ATOM 1069 CB GLU A 67 10.452 -24.230 -9.707 1.00 19.68 C ATOM 1070 CG GLU A 67 10.047 -23.809 -11.116 1.00 24.69 C ATOM 1071 CD GLU A 67 11.117 -23.980 -12.178 1.00 39.90 C ATOM 1072 OE1 GLU A 67 12.270 -24.336 -11.850 1.00 32.92 O ATOM 1073 OE2 GLU A 67 10.784 -23.737 -13.361 1.00 29.13 O ATOM 1074 HA GLU A 67 8.438 -23.890 -8.992 1.00 0.00 H ATOM 1075 HB2 GLU A 67 11.452 -23.855 -9.489 1.00 0.00 H ATOM 1076 HB3 GLU A 67 10.450 -25.318 -9.638 1.00 0.00 H ATOM 1077 HG2 GLU A 67 9.183 -24.404 -11.410 1.00 0.00 H ATOM 1078 HG3 GLU A 67 9.768 -22.756 -11.086 1.00 0.00 H ATOM 1079 H GLU A 67 10.422 -21.769 -9.083 1.00 0.00 H ATOM 1080 N GLU A 68 10.235 -23.601 -6.373 1.00 18.70 N ATOM 1081 CA GLU A 68 10.608 -24.240 -5.104 1.00 17.93 C ATOM 1082 C GLU A 68 10.362 -23.513 -3.761 1.00 31.81 C ATOM 1083 O GLU A 68 11.281 -23.468 -2.945 1.00 45.12 O ATOM 1084 CB GLU A 68 12.109 -24.603 -5.159 1.00 30.20 C ATOM 1085 CG GLU A 68 12.508 -25.495 -6.343 1.00 28.69 C ATOM 1086 CD GLU A 68 14.012 -25.523 -6.618 1.00 33.43 C ATOM 1087 OE1 GLU A 68 14.403 -26.022 -7.699 1.00 22.81 O ATOM 1088 OE2 GLU A 68 14.803 -25.052 -5.768 1.00 21.58 O ATOM 1089 HA GLU A 68 9.911 -25.077 -5.065 1.00 0.00 H ATOM 1090 HB2 GLU A 68 12.681 -23.677 -5.223 1.00 0.00 H ATOM 1091 HB3 GLU A 68 12.367 -25.125 -4.238 1.00 0.00 H ATOM 1092 HG2 GLU A 68 12.178 -26.512 -6.133 1.00 0.00 H ATOM 1093 HG3 GLU A 68 12.002 -25.127 -7.236 1.00 0.00 H ATOM 1094 H GLU A 68 10.450 -22.595 -6.526 1.00 0.00 H ATOM 1095 N GLU A 69 9.177 -22.967 -3.472 1.00 27.86 N ATOM 1096 CA GLU A 69 8.071 -22.757 -4.408 1.00 29.98 C ATOM 1097 C GLU A 69 7.195 -21.633 -3.820 1.00 18.09 C ATOM 1098 O GLU A 69 6.042 -21.817 -3.434 1.00 43.28 O ATOM 1099 CB GLU A 69 7.320 -24.073 -4.657 1.00 39.15 C ATOM 1100 CG GLU A 69 5.850 -24.002 -5.053 1.00 37.95 C ATOM 1101 CD GLU A 69 4.930 -24.513 -3.954 1.00 36.79 C ATOM 1102 OE1 GLU A 69 5.181 -25.621 -3.439 1.00 35.80 O ATOM 1103 OE2 GLU A 69 3.953 -23.813 -3.611 1.00 45.96 O ATOM 1104 HA GLU A 69 8.417 -22.446 -5.393 1.00 0.00 H ATOM 1105 HB2 GLU A 69 7.845 -24.598 -5.455 1.00 0.00 H ATOM 1106 HB3 GLU A 69 7.379 -24.658 -3.739 1.00 0.00 H ATOM 1107 HG2 GLU A 69 5.595 -22.965 -5.270 1.00 0.00 H ATOM 1108 HG3 GLU A 69 5.698 -24.607 -5.947 1.00 0.00 H ATOM 1109 H GLU A 69 9.026 -22.662 -2.489 1.00 0.00 H ATOM 1110 N GLN A 70 7.823 -20.474 -3.686 1.00 35.58 N ATOM 1111 CA GLN A 70 7.154 -19.212 -3.420 1.00 39.68 C ATOM 1112 C GLN A 70 8.327 -18.248 -3.347 1.00 43.71 C ATOM 1113 O GLN A 70 9.176 -18.458 -2.481 1.00 43.96 O ATOM 1114 CB GLN A 70 6.401 -19.252 -2.090 1.00 47.14 C ATOM 1115 HA GLN A 70 6.404 -18.948 -4.165 1.00 0.00 H ATOM 1116 HB2 GLN A 70 5.651 -20.043 -2.122 1.00 0.00 H ATOM 1117 HB3 GLN A 70 7.105 -19.449 -1.281 1.00 0.00 H ATOM 1118 H GLN A 70 8.859 -20.467 -3.777 1.00 0.00 H ATOM 1119 N LEU A 71 8.470 -17.217 -4.191 1.00 31.97 N ATOM 1120 CA LEU A 71 7.507 -16.572 -5.112 1.00 26.78 C ATOM 1121 C LEU A 71 6.154 -17.174 -5.523 1.00 24.15 C ATOM 1122 O LEU A 71 6.074 -18.173 -6.244 1.00 25.38 O ATOM 1123 CB LEU A 71 8.267 -16.200 -6.395 1.00 29.54 C ATOM 1124 CG LEU A 71 8.196 -14.751 -6.887 1.00 32.31 C ATOM 1125 CD1 LEU A 71 8.650 -13.763 -5.824 1.00 37.57 C ATOM 1126 CD2 LEU A 71 9.044 -14.592 -8.134 1.00 32.28 C ATOM 1127 HA LEU A 71 7.147 -15.776 -4.459 1.00 0.00 H ATOM 1128 HB2 LEU A 71 9.318 -16.433 -6.227 1.00 0.00 H ATOM 1129 HB3 LEU A 71 7.880 -16.832 -7.194 1.00 0.00 H ATOM 1130 HG LEU A 71 7.153 -14.530 -7.115 1.00 0.00 H ATOM 1131 HD21 LEU A 71 10.079 -14.845 -7.903 1.00 0.00 H ATOM 1132 HD22 LEU A 71 8.671 -15.257 -8.913 1.00 0.00 H ATOM 1133 HD23 LEU A 71 8.990 -13.560 -8.479 1.00 0.00 H ATOM 1134 HD11 LEU A 71 8.010 -13.856 -4.946 1.00 0.00 H ATOM 1135 HD12 LEU A 71 9.682 -13.978 -5.547 1.00 0.00 H ATOM 1136 HD13 LEU A 71 8.582 -12.749 -6.219 1.00 0.00 H ATOM 1137 H LEU A 71 9.422 -16.798 -4.201 1.00 0.00 H ATOM 1138 N SER A 72 5.089 -16.510 -5.085 1.00 22.28 N ATOM 1139 CA SER A 72 3.746 -16.806 -5.538 1.00 22.84 C ATOM 1140 C SER A 72 2.850 -15.611 -5.252 1.00 18.86 C ATOM 1141 O SER A 72 3.280 -14.626 -4.632 1.00 16.14 O ATOM 1142 CB SER A 72 3.201 -18.047 -4.835 1.00 31.06 C ATOM 1143 OG SER A 72 3.227 -17.886 -3.433 1.00 31.29 O ATOM 1144 HA SER A 72 3.767 -17.004 -6.610 1.00 0.00 H ATOM 1145 HB2 SER A 72 3.812 -18.908 -5.107 1.00 0.00 H ATOM 1146 HB3 SER A 72 2.173 -18.216 -5.156 1.00 0.00 H ATOM 1147 HG SER A 72 2.869 -18.702 -3.002 1.00 0.00 H ATOM 1148 H SER A 72 5.226 -15.748 -4.390 1.00 0.00 H ATOM 1149 N SER A 73 1.603 -15.714 -5.698 1.00 20.68 N ATOM 1150 CA SER A 73 0.635 -14.635 -5.555 1.00 17.17 C ATOM 1151 C SER A 73 0.543 -14.157 -4.122 1.00 14.43 C ATOM 1152 O SER A 73 0.429 -14.967 -3.194 1.00 16.74 O ATOM 1153 CB SER A 73 -0.744 -15.088 -6.043 1.00 20.67 C ATOM 1154 OG SER A 73 -0.675 -15.516 -7.391 1.00 38.69 O ATOM 1155 HA SER A 73 0.978 -13.802 -6.168 1.00 0.00 H ATOM 1156 HB2 SER A 73 -1.444 -14.256 -5.966 1.00 0.00 H ATOM 1157 HB3 SER A 73 -1.092 -15.913 -5.421 1.00 0.00 H ATOM 1158 HG SER A 73 -0.042 -16.274 -7.463 1.00 0.00 H ATOM 1159 H SER A 73 1.308 -16.595 -6.165 1.00 0.00 H ATOM 1160 N ASN A 74 0.609 -12.831 -3.984 1.00 13.41 N ATOM 1161 CA ASN A 74 0.474 -12.068 -2.733 1.00 13.88 C ATOM 1162 C ASN A 74 1.794 -11.770 -2.054 1.00 12.95 C ATOM 1163 O ASN A 74 1.837 -10.937 -1.170 1.00 13.66 O ATOM 1164 CB ASN A 74 -0.493 -12.682 -1.719 1.00 16.54 C ATOM 1165 CG ASN A 74 -1.898 -12.749 -2.237 1.00 21.07 C ATOM 1166 OD1 ASN A 74 -2.347 -11.856 -2.956 1.00 24.34 O ATOM 1167 ND2 ASN A 74 -2.603 -13.818 -1.888 1.00 24.40 N ATOM 1168 HA ASN A 74 0.042 -11.127 -3.073 1.00 0.00 H ATOM 1169 HB2 ASN A 74 -0.158 -13.692 -1.483 1.00 0.00 H ATOM 1170 HB3 ASN A 74 -0.482 -12.076 -0.813 1.00 0.00 H ATOM 1171 HD22 ASN A 74 -2.178 -14.545 -1.278 1.00 0.00 H ATOM 1172 HD21 ASN A 74 -3.581 -13.929 -2.225 1.00 0.00 H ATOM 1173 H ASN A 74 0.773 -12.280 -4.851 1.00 0.00 H ATOM 1174 N CYS A 75 2.875 -12.430 -2.453 1.00 12.71 N ATOM 1175 CA CYS A 75 4.113 -12.128 -1.764 1.00 15.71 C ATOM 1176 C CYS A 75 4.590 -10.718 -2.121 1.00 12.99 C ATOM 1177 O CYS A 75 4.223 -10.135 -3.144 1.00 13.17 O ATOM 1178 CB CYS A 75 5.171 -13.183 -2.040 1.00 15.22 C ATOM 1179 SG CYS A 75 5.999 -12.970 -3.591 1.00 17.06 S ATOM 1180 HA CYS A 75 3.928 -12.150 -0.690 1.00 0.00 H ATOM 1181 HB2 CYS A 75 4.691 -14.162 -2.037 1.00 0.00 H ATOM 1182 HB3 CYS A 75 5.914 -13.142 -1.244 1.00 0.00 H ATOM 1183 HG CYS A 75 5.077 -13.033 -4.616 1.00 0.00 H ATOM 1184 H CYS A 75 2.835 -13.129 -3.222 1.00 0.00 H ATOM 1185 N VAL A 76 5.375 -10.158 -1.209 1.00 13.31 N ATOM 1186 CA VAL A 76 5.894 -8.815 -1.370 1.00 12.72 C ATOM 1187 C VAL A 76 7.390 -8.937 -1.535 1.00 11.98 C ATOM 1188 O VAL A 76 8.067 -9.590 -0.720 1.00 14.09 O ATOM 1189 CB VAL A 76 5.520 -7.940 -0.176 1.00 14.40 C ATOM 1190 CG1 VAL A 76 6.246 -6.589 -0.229 1.00 16.46 C ATOM 1191 CG2 VAL A 76 4.024 -7.719 -0.172 1.00 14.58 C ATOM 1192 HA VAL A 76 5.461 -8.330 -2.245 1.00 0.00 H ATOM 1193 HB VAL A 76 5.825 -8.449 0.738 1.00 0.00 H ATOM 1194 HG11 VAL A 76 7.323 -6.756 -0.215 1.00 0.00 H ATOM 1195 HG12 VAL A 76 5.970 -6.065 -1.144 1.00 0.00 H ATOM 1196 HG13 VAL A 76 5.959 -5.989 0.635 1.00 0.00 H ATOM 1197 HG21 VAL A 76 3.729 -7.223 -1.097 1.00 0.00 H ATOM 1198 HG22 VAL A 76 3.516 -8.680 -0.096 1.00 0.00 H ATOM 1199 HG23 VAL A 76 3.753 -7.095 0.679 1.00 0.00 H ATOM 1200 H VAL A 76 5.624 -10.698 -0.356 1.00 0.00 H ATOM 1201 N CYS A 77 7.911 -8.315 -2.589 1.00 12.38 N ATOM 1202 CA CYS A 77 9.312 -8.477 -2.928 1.00 15.82 C ATOM 1203 C CYS A 77 9.946 -7.173 -3.365 1.00 13.97 C ATOM 1204 O CYS A 77 9.294 -6.300 -3.939 1.00 13.22 O ATOM 1205 CB CYS A 77 9.465 -9.517 -4.033 1.00 17.31 C ATOM 1206 SG CYS A 77 8.680 -9.048 -5.577 1.00 20.61 S ATOM 1207 HA CYS A 77 9.828 -8.813 -2.028 1.00 0.00 H ATOM 1208 HB2 CYS A 77 9.021 -10.452 -3.691 1.00 0.00 H ATOM 1209 HB3 CYS A 77 10.528 -9.668 -4.219 1.00 0.00 H ATOM 1210 HG CYS A 77 8.872 -10.046 -6.510 1.00 0.00 H ATOM 1211 H CYS A 77 7.307 -7.706 -3.177 1.00 0.00 H ATOM 1212 N GLN A 78 11.234 -7.056 -3.078 1.00 13.11 N ATOM 1213 CA GLN A 78 12.005 -5.908 -3.474 1.00 11.98 C ATOM 1214 C GLN A 78 12.796 -6.294 -4.708 1.00 14.37 C ATOM 1215 O GLN A 78 13.474 -7.315 -4.731 1.00 13.52 O ATOM 1216 CB GLN A 78 12.942 -5.480 -2.357 1.00 13.52 C ATOM 1217 CG GLN A 78 13.792 -4.315 -2.751 1.00 14.35 C ATOM 1218 CD GLN A 78 14.306 -3.583 -1.561 1.00 15.55 C ATOM 1219 OE1 GLN A 78 14.629 -4.191 -0.532 1.00 21.74 O ATOM 1220 NE2 GLN A 78 14.383 -2.265 -1.675 1.00 17.31 N ATOM 1221 HA GLN A 78 11.347 -5.066 -3.688 1.00 0.00 H ATOM 1222 HB2 GLN A 78 12.348 -5.203 -1.486 1.00 0.00 H ATOM 1223 HB3 GLN A 78 13.590 -6.318 -2.101 1.00 0.00 H ATOM 1224 HG2 GLN A 78 14.637 -4.676 -3.337 1.00 0.00 H ATOM 1225 HG3 GLN A 78 13.197 -3.632 -3.357 1.00 0.00 H ATOM 1226 HE22 GLN A 78 14.099 -1.802 -2.562 1.00 0.00 H ATOM 1227 HE21 GLN A 78 14.727 -1.693 -0.877 1.00 0.00 H ATOM 1228 H GLN A 78 11.703 -7.819 -2.549 1.00 0.00 H ATOM 1229 N ILE A 79 12.685 -5.477 -5.745 1.00 12.01 N ATOM 1230 CA ILE A 79 13.449 -5.684 -6.965 1.00 12.62 C ATOM 1231 C ILE A 79 14.802 -5.014 -6.831 1.00 13.89 C ATOM 1232 O ILE A 79 14.888 -3.792 -6.763 1.00 17.28 O ATOM 1233 CB ILE A 79 12.711 -5.107 -8.169 1.00 12.84 C ATOM 1234 CG1 ILE A 79 11.262 -5.595 -8.187 1.00 16.09 C ATOM 1235 CG2 ILE A 79 13.439 -5.474 -9.466 1.00 14.46 C ATOM 1236 CD1 ILE A 79 11.095 -7.106 -8.090 1.00 21.46 C ATOM 1237 HA ILE A 79 13.579 -6.755 -7.119 1.00 0.00 H ATOM 1238 HB ILE A 79 12.698 -4.020 -8.089 1.00 0.00 H ATOM 1239 HG12 ILE A 79 10.741 -5.141 -7.344 1.00 0.00 H ATOM 1240 HG13 ILE A 79 10.803 -5.262 -9.118 1.00 0.00 H ATOM 1241 HD11 ILE A 79 11.597 -7.581 -8.933 1.00 0.00 H ATOM 1242 HD12 ILE A 79 11.535 -7.460 -7.157 1.00 0.00 H ATOM 1243 HD13 ILE A 79 10.034 -7.355 -8.111 1.00 0.00 H ATOM 1244 HG21 ILE A 79 14.451 -5.069 -9.441 1.00 0.00 H ATOM 1245 HG22 ILE A 79 13.483 -6.559 -9.562 1.00 0.00 H ATOM 1246 HG23 ILE A 79 12.899 -5.055 -10.315 1.00 0.00 H ATOM 1247 H ILE A 79 12.035 -4.667 -5.685 1.00 0.00 H ATOM 1248 N HIS A 80 15.865 -5.813 -6.798 1.00 14.34 N ATOM 1249 CA HIS A 80 17.216 -5.275 -6.643 1.00 16.03 C ATOM 1250 C HIS A 80 17.915 -4.986 -7.953 1.00 17.18 C ATOM 1251 O HIS A 80 18.815 -4.166 -7.996 1.00 20.38 O ATOM 1252 CB HIS A 80 18.071 -6.202 -5.786 1.00 17.11 C ATOM 1253 CG HIS A 80 17.670 -6.182 -4.353 1.00 17.15 C ATOM 1254 ND1 HIS A 80 18.135 -5.234 -3.471 1.00 22.83 N ATOM 1255 CD2 HIS A 80 16.815 -6.964 -3.655 1.00 18.77 C ATOM 1256 CE1 HIS A 80 17.596 -5.442 -2.284 1.00 23.37 C ATOM 1257 NE2 HIS A 80 16.790 -6.486 -2.368 1.00 21.77 N ATOM 1258 HA HIS A 80 17.095 -4.315 -6.141 1.00 0.00 H ATOM 1259 HB2 HIS A 80 17.971 -7.220 -6.164 1.00 0.00 H ATOM 1260 HB3 HIS A 80 19.112 -5.889 -5.863 1.00 0.00 H ATOM 1261 HD2 HIS A 80 16.252 -7.814 -4.041 1.00 0.00 H ATOM 1262 HE1 HIS A 80 17.784 -4.853 -1.387 1.00 0.00 H ATOM 1263 H HIS A 80 15.733 -6.841 -6.884 1.00 0.00 H ATOM 1264 N ARG A 81 17.501 -5.658 -9.017 1.00 16.21 N ATOM 1265 CA ARG A 81 18.054 -5.401 -10.338 1.00 17.01 C ATOM 1266 C ARG A 81 17.043 -5.784 -11.389 1.00 15.71 C ATOM 1267 O ARG A 81 16.465 -6.872 -11.352 1.00 15.15 O ATOM 1268 CB ARG A 81 19.334 -6.192 -10.563 1.00 18.99 C ATOM 1269 CG ARG A 81 20.057 -5.817 -11.842 1.00 25.78 C ATOM 1270 CD ARG A 81 21.443 -6.448 -11.917 1.00 35.27 C ATOM 1271 NE ARG A 81 21.399 -7.891 -11.680 1.00 57.58 N ATOM 1272 CZ ARG A 81 22.147 -8.795 -12.311 1.00 62.16 C ATOM 1273 NH1 ARG A 81 23.019 -8.426 -13.243 1.00 69.93 N ATOM 1274 NH2 ARG A 81 22.018 -10.082 -12.009 1.00 53.37 N ATOM 1275 HA ARG A 81 18.288 -4.339 -10.408 1.00 0.00 H ATOM 1276 HB2 ARG A 81 20.004 -6.013 -9.722 1.00 0.00 H ATOM 1277 HB3 ARG A 81 19.083 -7.252 -10.606 1.00 0.00 H ATOM 1278 HG2 ARG A 81 19.468 -6.158 -12.693 1.00 0.00 H ATOM 1279 HG3 ARG A 81 20.160 -4.733 -11.884 1.00 0.00 H ATOM 1280 HD2 ARG A 81 22.082 -5.986 -11.164 1.00 0.00 H ATOM 1281 HD3 ARG A 81 21.860 -6.266 -12.907 1.00 0.00 H ATOM 1282 HE ARG A 81 20.731 -8.238 -10.962 1.00 0.00 H ATOM 1283 HH12 ARG A 81 23.596 -9.142 -13.728 1.00 0.00 H ATOM 1284 HH11 ARG A 81 23.124 -7.421 -13.488 1.00 0.00 H ATOM 1285 HH22 ARG A 81 22.599 -10.792 -12.499 1.00 0.00 H ATOM 1286 HH21 ARG A 81 21.336 -10.380 -11.283 1.00 0.00 H ATOM 1287 H ARG A 81 16.765 -6.385 -8.906 1.00 0.00 H ATOM 1288 N PHE A 82 16.811 -4.870 -12.316 1.00 15.57 N ATOM 1289 CA PHE A 82 15.941 -5.152 -13.440 1.00 14.63 C ATOM 1290 C PHE A 82 16.430 -4.411 -14.658 1.00 15.35 C ATOM 1291 O PHE A 82 17.203 -3.454 -14.561 1.00 17.06 O ATOM 1292 CB PHE A 82 14.491 -4.768 -13.141 1.00 15.53 C ATOM 1293 CG PHE A 82 14.260 -3.289 -12.985 1.00 17.45 C ATOM 1294 CD1 PHE A 82 14.495 -2.660 -11.774 1.00 21.10 C ATOM 1295 CD2 PHE A 82 13.797 -2.531 -14.047 1.00 16.47 C ATOM 1296 CE1 PHE A 82 14.277 -1.299 -11.634 1.00 20.68 C ATOM 1297 CE2 PHE A 82 13.572 -1.168 -13.906 1.00 21.15 C ATOM 1298 CZ PHE A 82 13.812 -0.562 -12.703 1.00 22.89 C ATOM 1299 HA PHE A 82 15.968 -6.226 -13.627 1.00 0.00 H ATOM 1300 HB2 PHE A 82 13.867 -5.126 -13.960 1.00 0.00 H ATOM 1301 HB3 PHE A 82 14.192 -5.260 -12.215 1.00 0.00 H ATOM 1302 HD2 PHE A 82 13.606 -3.011 -15.007 1.00 0.00 H ATOM 1303 HE2 PHE A 82 13.206 -0.583 -14.750 1.00 0.00 H ATOM 1304 HZ PHE A 82 13.635 0.507 -12.589 1.00 0.00 H ATOM 1305 HE1 PHE A 82 14.473 -0.811 -10.679 1.00 0.00 H ATOM 1306 HD1 PHE A 82 14.854 -3.240 -10.924 1.00 0.00 H ATOM 1307 H PHE A 82 17.260 -3.935 -12.237 1.00 0.00 H ATOM 1308 N ILE A 83 15.981 -4.882 -15.810 1.00 15.09 N ATOM 1309 CA ILE A 83 16.209 -4.133 -17.038 1.00 16.30 C ATOM 1310 C ILE A 83 14.918 -4.074 -17.819 1.00 16.18 C ATOM 1311 O ILE A 83 14.045 -4.929 -17.666 1.00 18.90 O ATOM 1312 CB ILE A 83 17.312 -4.745 -17.910 1.00 23.23 C ATOM 1313 CG1 ILE A 83 17.032 -6.219 -18.171 1.00 24.11 C ATOM 1314 CG2 ILE A 83 18.663 -4.577 -17.241 1.00 23.69 C ATOM 1315 CD1 ILE A 83 17.900 -6.806 -19.269 1.00 30.61 C ATOM 1316 HA ILE A 83 16.543 -3.133 -16.761 1.00 0.00 H ATOM 1317 HB ILE A 83 17.326 -4.222 -18.866 1.00 0.00 H ATOM 1318 HG12 ILE A 83 17.213 -6.775 -17.251 1.00 0.00 H ATOM 1319 HG13 ILE A 83 15.987 -6.328 -18.460 1.00 0.00 H ATOM 1320 HD11 ILE A 83 17.722 -6.266 -20.199 1.00 0.00 H ATOM 1321 HD12 ILE A 83 18.949 -6.714 -18.989 1.00 0.00 H ATOM 1322 HD13 ILE A 83 17.650 -7.858 -19.405 1.00 0.00 H ATOM 1323 HG21 ILE A 83 18.867 -3.516 -17.099 1.00 0.00 H ATOM 1324 HG22 ILE A 83 18.653 -5.079 -16.273 1.00 0.00 H ATOM 1325 HG23 ILE A 83 19.436 -5.016 -17.871 1.00 0.00 H ATOM 1326 H ILE A 83 15.466 -5.785 -15.839 1.00 0.00 H ATOM 1327 N VAL A 84 14.792 -3.048 -18.643 1.00 15.62 N ATOM 1328 CA VAL A 84 13.648 -2.939 -19.523 1.00 15.94 C ATOM 1329 C VAL A 84 14.117 -3.282 -20.922 1.00 14.93 C ATOM 1330 O VAL A 84 15.143 -2.791 -21.386 1.00 18.20 O ATOM 1331 CB VAL A 84 13.046 -1.522 -19.498 1.00 19.75 C ATOM 1332 CG1 VAL A 84 11.946 -1.373 -20.541 1.00 26.83 C ATOM 1333 CG2 VAL A 84 12.500 -1.205 -18.111 1.00 22.54 C ATOM 1334 HA VAL A 84 12.865 -3.622 -19.193 1.00 0.00 H ATOM 1335 HB VAL A 84 13.840 -0.815 -19.739 1.00 0.00 H ATOM 1336 HG11 VAL A 84 12.359 -1.559 -21.532 1.00 0.00 H ATOM 1337 HG12 VAL A 84 11.153 -2.092 -20.336 1.00 0.00 H ATOM 1338 HG13 VAL A 84 11.541 -0.362 -20.498 1.00 0.00 H ATOM 1339 HG21 VAL A 84 11.725 -1.927 -17.853 1.00 0.00 H ATOM 1340 HG22 VAL A 84 13.308 -1.262 -17.382 1.00 0.00 H ATOM 1341 HG23 VAL A 84 12.078 -0.200 -18.109 1.00 0.00 H ATOM 1342 H VAL A 84 15.524 -2.310 -18.659 1.00 0.00 H ATOM 1343 N ASN A 85 13.362 -4.145 -21.585 1.00 14.38 N ATOM 1344 CA ASN A 85 13.595 -4.444 -22.980 1.00 15.21 C ATOM 1345 C ASN A 85 12.368 -4.055 -23.756 1.00 20.37 C ATOM 1346 O ASN A 85 11.275 -4.026 -23.222 1.00 22.02 O ATOM 1347 CB ASN A 85 13.882 -5.929 -23.159 1.00 16.44 C ATOM 1348 CG ASN A 85 15.338 -6.257 -22.986 1.00 34.95 C ATOM 1349 OD1 ASN A 85 15.707 -7.138 -22.217 1.00 46.69 O ATOM 1350 ND2 ASN A 85 16.180 -5.544 -23.703 1.00 28.98 N ATOM 1351 HA ASN A 85 14.459 -3.886 -23.342 1.00 0.00 H ATOM 1352 HB2 ASN A 85 13.307 -6.488 -22.421 1.00 0.00 H ATOM 1353 HB3 ASN A 85 13.573 -6.227 -24.161 1.00 0.00 H ATOM 1354 HD22 ASN A 85 15.823 -4.806 -24.343 1.00 0.00 H ATOM 1355 HD21 ASN A 85 17.203 -5.718 -23.630 1.00 0.00 H ATOM 1356 H ASN A 85 12.581 -4.620 -21.089 1.00 0.00 H ATOM 1357 N THR A 86 12.554 -3.737 -25.023 1.00 15.31 N ATOM 1358 CA THR A 86 11.448 -3.290 -25.847 1.00 15.11 C ATOM 1359 C THR A 86 11.392 -4.205 -27.041 1.00 16.07 C ATOM 1360 O THR A 86 12.405 -4.424 -27.706 1.00 17.69 O ATOM 1361 CB THR A 86 11.654 -1.834 -26.266 1.00 15.84 C ATOM 1362 OG1 THR A 86 11.835 -1.022 -25.092 1.00 16.52 O ATOM 1363 CG2 THR A 86 10.475 -1.312 -27.058 1.00 17.93 C ATOM 1364 HA THR A 86 10.506 -3.330 -25.301 1.00 0.00 H ATOM 1365 HB THR A 86 12.538 -1.786 -26.902 1.00 0.00 H ATOM 1366 HG1 THR A 86 11.969 -0.079 -25.362 1.00 0.00 H ATOM 1367 HG23 THR A 86 10.336 -1.926 -27.948 1.00 0.00 H ATOM 1368 HG21 THR A 86 9.577 -1.355 -26.442 1.00 0.00 H ATOM 1369 HG22 THR A 86 10.665 -0.280 -27.353 1.00 0.00 H ATOM 1370 H THR A 86 13.506 -3.808 -25.436 1.00 0.00 H ATOM 1371 N LEU A 87 10.207 -4.747 -27.299 1.00 16.19 N ATOM 1372 CA LEU A 87 9.969 -5.610 -28.443 1.00 17.44 C ATOM 1373 C LEU A 87 9.871 -4.780 -29.710 1.00 17.76 C ATOM 1374 O LEU A 87 9.687 -3.567 -29.657 1.00 17.04 O ATOM 1375 CB LEU A 87 8.658 -6.361 -28.250 1.00 19.91 C ATOM 1376 CG LEU A 87 8.552 -7.216 -26.985 1.00 23.66 C ATOM 1377 CD1 LEU A 87 7.163 -7.829 -26.895 1.00 28.82 C ATOM 1378 CD2 LEU A 87 9.613 -8.290 -26.995 1.00 33.12 C ATOM 1379 HA LEU A 87 10.797 -6.314 -28.529 1.00 0.00 H ATOM 1380 HB2 LEU A 87 7.854 -5.626 -28.224 1.00 0.00 H ATOM 1381 HB3 LEU A 87 8.521 -7.018 -29.109 1.00 0.00 H ATOM 1382 HG LEU A 87 8.712 -6.587 -26.109 1.00 0.00 H ATOM 1383 HD21 LEU A 87 9.476 -8.926 -27.870 1.00 0.00 H ATOM 1384 HD22 LEU A 87 10.598 -7.825 -27.032 1.00 0.00 H ATOM 1385 HD23 LEU A 87 9.528 -8.892 -26.090 1.00 0.00 H ATOM 1386 HD11 LEU A 87 6.418 -7.034 -26.858 1.00 0.00 H ATOM 1387 HD12 LEU A 87 6.986 -8.454 -27.770 1.00 0.00 H ATOM 1388 HD13 LEU A 87 7.093 -8.437 -25.993 1.00 0.00 H ATOM 1389 H LEU A 87 9.416 -4.545 -26.655 1.00 0.00 H ATOM 1390 N LYS A 88 9.966 -5.446 -30.858 1.00 19.73 N ATOM 1391 CA LYS A 88 9.860 -4.768 -32.137 1.00 19.57 C ATOM 1392 C LYS A 88 8.552 -3.991 -32.264 1.00 19.15 C ATOM 1393 O LYS A 88 8.516 -2.941 -32.906 1.00 21.97 O ATOM 1394 CB LYS A 88 9.970 -5.779 -33.286 1.00 22.14 C ATOM 1395 CG LYS A 88 11.343 -6.410 -33.414 1.00 34.13 C ATOM 1396 CD LYS A 88 11.431 -7.372 -34.597 1.00 36.90 C ATOM 1397 CE LYS A 88 10.599 -8.619 -34.381 1.00 48.22 C ATOM 1398 NZ LYS A 88 10.977 -9.689 -35.347 1.00 59.73 N ATOM 1399 HA LYS A 88 10.683 -4.055 -32.194 1.00 0.00 H ATOM 1400 HB2 LYS A 88 9.241 -6.572 -33.118 1.00 0.00 H ATOM 1401 HB3 LYS A 88 9.738 -5.266 -34.219 1.00 0.00 H ATOM 1402 HG2 LYS A 88 12.081 -5.619 -33.549 1.00 0.00 H ATOM 1403 HG3 LYS A 88 11.564 -6.959 -32.498 1.00 0.00 H ATOM 1404 HD2 LYS A 88 11.075 -6.862 -35.492 1.00 0.00 H ATOM 1405 HD3 LYS A 88 12.472 -7.664 -34.737 1.00 0.00 H ATOM 1406 HE2 LYS A 88 9.546 -8.373 -34.516 1.00 0.00 H ATOM 1407 HE3 LYS A 88 10.759 -8.983 -33.366 1.00 0.00 H ATOM 1408 HZ1 LYS A 88 10.822 -9.349 -36.317 1.00 0.00 H ATOM 1409 HZ2 LYS A 88 11.980 -9.931 -35.219 1.00 0.00 H ATOM 1410 HZ3 LYS A 88 10.391 -10.531 -35.176 1.00 0.00 H ATOM 1411 H LYS A 88 10.119 -6.474 -30.838 1.00 0.00 H ATOM 1412 N ASP A 89 7.483 -4.506 -31.652 1.00 21.35 N ATOM 1413 CA ASP A 89 6.173 -3.870 -31.760 1.00 26.45 C ATOM 1414 C ASP A 89 5.979 -2.703 -30.789 1.00 25.43 C ATOM 1415 O ASP A 89 4.952 -2.031 -30.827 1.00 22.46 O ATOM 1416 CB ASP A 89 5.033 -4.899 -31.620 1.00 28.40 C ATOM 1417 CG ASP A 89 5.015 -5.614 -30.265 1.00 34.04 C ATOM 1418 OD1 ASP A 89 5.473 -5.047 -29.254 1.00 27.81 O ATOM 1419 OD2 ASP A 89 4.508 -6.758 -30.208 1.00 35.86 O ATOM 1420 HA ASP A 89 6.134 -3.443 -32.762 1.00 0.00 H ATOM 1421 HB2 ASP A 89 4.083 -4.381 -31.749 1.00 0.00 H ATOM 1422 HB3 ASP A 89 5.146 -5.648 -32.404 1.00 0.00 H ATOM 1423 H ASP A 89 7.585 -5.374 -31.089 1.00 0.00 H ATOM 1424 N GLY A 90 6.963 -2.470 -29.924 1.00 18.11 N ATOM 1425 CA GLY A 90 6.951 -1.321 -29.037 1.00 17.48 C ATOM 1426 C GLY A 90 6.568 -1.611 -27.604 1.00 16.20 C ATOM 1427 O GLY A 90 6.718 -0.753 -26.731 1.00 19.18 O ATOM 1428 HA3 GLY A 90 6.241 -0.596 -29.435 1.00 0.00 H ATOM 1429 HA2 GLY A 90 7.950 -0.886 -29.037 1.00 0.00 H ATOM 1430 H GLY A 90 7.765 -3.131 -29.882 1.00 0.00 H ATOM 1431 N ARG A 91 6.077 -2.816 -27.346 1.00 19.74 N ATOM 1432 CA ARG A 91 5.720 -3.187 -25.990 1.00 17.29 C ATOM 1433 C ARG A 91 6.986 -3.399 -25.184 1.00 18.12 C ATOM 1434 O ARG A 91 8.003 -3.881 -25.695 1.00 19.82 O ATOM 1435 CB ARG A 91 4.872 -4.454 -25.980 1.00 22.35 C ATOM 1436 CG ARG A 91 3.436 -4.223 -26.422 1.00 30.64 C ATOM 1437 CD ARG A 91 2.658 -5.521 -26.423 1.00 29.75 C ATOM 1438 NE ARG A 91 3.277 -6.505 -27.302 1.00 33.14 N ATOM 1439 CZ ARG A 91 2.937 -7.789 -27.349 1.00 44.18 C ATOM 1440 NH1 ARG A 91 1.979 -8.257 -26.561 1.00 46.05 N ATOM 1441 NH2 ARG A 91 3.562 -8.605 -28.185 1.00 39.14 N ATOM 1442 HA ARG A 91 5.131 -2.385 -25.545 1.00 0.00 H ATOM 1443 HB2 ARG A 91 5.328 -5.181 -26.652 1.00 0.00 H ATOM 1444 HB3 ARG A 91 4.862 -4.855 -24.967 1.00 0.00 H ATOM 1445 HG2 ARG A 91 2.960 -3.521 -25.737 1.00 0.00 H ATOM 1446 HG3 ARG A 91 3.435 -3.805 -27.428 1.00 0.00 H ATOM 1447 HD2 ARG A 91 1.642 -5.327 -26.766 1.00 0.00 H ATOM 1448 HD3 ARG A 91 2.628 -5.919 -25.409 1.00 0.00 H ATOM 1449 HE ARG A 91 4.036 -6.181 -27.935 1.00 0.00 H ATOM 1450 HH12 ARG A 91 1.717 -9.263 -26.602 1.00 0.00 H ATOM 1451 HH11 ARG A 91 1.490 -7.619 -25.902 1.00 0.00 H ATOM 1452 HH22 ARG A 91 3.299 -9.610 -28.225 1.00 0.00 H ATOM 1453 HH21 ARG A 91 4.316 -8.240 -28.802 1.00 0.00 H ATOM 1454 H ARG A 91 5.947 -3.498 -28.120 1.00 0.00 H ATOM 1455 N ARG A 92 6.924 -3.021 -23.921 1.00 21.45 N ATOM 1456 CA ARG A 92 8.067 -3.180 -23.059 1.00 19.72 C ATOM 1457 C ARG A 92 7.919 -4.416 -22.189 1.00 18.46 C ATOM 1458 O ARG A 92 6.814 -4.797 -21.810 1.00 19.48 O ATOM 1459 CB ARG A 92 8.331 -1.887 -22.278 1.00 29.20 C ATOM 1460 CG ARG A 92 9.373 -1.012 -23.029 1.00 30.91 C ATOM 1461 CD ARG A 92 9.144 0.494 -22.987 1.00 32.55 C ATOM 1462 NE ARG A 92 10.174 1.221 -23.745 1.00 26.79 N ATOM 1463 CZ ARG A 92 10.384 2.531 -23.658 1.00 31.55 C ATOM 1464 NH1 ARG A 92 9.643 3.273 -22.847 1.00 41.70 N ATOM 1465 NH2 ARG A 92 11.339 3.105 -24.379 1.00 30.72 N ATOM 1466 HA ARG A 92 8.960 -3.354 -23.660 1.00 0.00 H ATOM 1467 HB2 ARG A 92 7.399 -1.331 -22.176 1.00 0.00 H ATOM 1468 HB3 ARG A 92 8.715 -2.135 -21.288 1.00 0.00 H ATOM 1469 HG2 ARG A 92 10.352 -1.212 -22.592 1.00 0.00 H ATOM 1470 HG3 ARG A 92 9.373 -1.319 -24.075 1.00 0.00 H ATOM 1471 HD2 ARG A 92 9.168 0.827 -21.949 1.00 0.00 H ATOM 1472 HD3 ARG A 92 8.167 0.715 -23.416 1.00 0.00 H ATOM 1473 HE ARG A 92 10.778 0.674 -24.392 1.00 0.00 H ATOM 1474 HH12 ARG A 92 9.810 4.297 -22.782 1.00 0.00 H ATOM 1475 HH11 ARG A 92 8.895 2.831 -22.276 1.00 0.00 H ATOM 1476 HH22 ARG A 92 11.499 4.130 -24.308 1.00 0.00 H ATOM 1477 HH21 ARG A 92 11.927 2.530 -25.015 1.00 0.00 H ATOM 1478 H ARG A 92 6.047 -2.607 -23.547 1.00 0.00 H ATOM 1479 N VAL A 93 9.039 -5.075 -21.942 1.00 17.45 N ATOM 1480 CA VAL A 93 9.095 -6.166 -20.996 1.00 16.44 C ATOM 1481 C VAL A 93 10.076 -5.725 -19.927 1.00 15.33 C ATOM 1482 O VAL A 93 11.110 -5.127 -20.222 1.00 15.50 O ATOM 1483 CB VAL A 93 9.538 -7.486 -21.666 1.00 24.15 C ATOM 1484 CG1 VAL A 93 8.696 -7.763 -22.900 1.00 31.16 C ATOM 1485 CG2 VAL A 93 10.988 -7.439 -22.058 1.00 16.96 C ATOM 1486 HA VAL A 93 8.112 -6.376 -20.575 1.00 0.00 H ATOM 1487 HB VAL A 93 9.397 -8.286 -20.939 1.00 0.00 H ATOM 1488 HG11 VAL A 93 7.648 -7.845 -22.612 1.00 0.00 H ATOM 1489 HG12 VAL A 93 8.816 -6.946 -23.611 1.00 0.00 H ATOM 1490 HG13 VAL A 93 9.022 -8.696 -23.359 1.00 0.00 H ATOM 1491 HG21 VAL A 93 11.147 -6.622 -22.762 1.00 0.00 H ATOM 1492 HG22 VAL A 93 11.598 -7.278 -21.169 1.00 0.00 H ATOM 1493 HG23 VAL A 93 11.267 -8.383 -22.526 1.00 0.00 H ATOM 1494 H VAL A 93 9.907 -4.799 -22.445 1.00 0.00 H ATOM 1495 N VAL A 94 9.722 -5.975 -18.678 1.00 14.51 N ATOM 1496 CA VAL A 94 10.590 -5.646 -17.558 1.00 13.71 C ATOM 1497 C VAL A 94 11.142 -6.957 -17.041 1.00 13.21 C ATOM 1498 O VAL A 94 10.407 -7.780 -16.493 1.00 16.93 O ATOM 1499 CB VAL A 94 9.827 -4.893 -16.464 1.00 14.76 C ATOM 1500 CG1 VAL A 94 10.752 -4.558 -15.305 1.00 17.58 C ATOM 1501 CG2 VAL A 94 9.209 -3.623 -17.043 1.00 16.95 C ATOM 1502 HA VAL A 94 11.396 -4.983 -17.873 1.00 0.00 H ATOM 1503 HB VAL A 94 9.028 -5.531 -16.087 1.00 0.00 H ATOM 1504 HG11 VAL A 94 11.156 -5.480 -14.886 1.00 0.00 H ATOM 1505 HG12 VAL A 94 11.569 -3.932 -15.663 1.00 0.00 H ATOM 1506 HG13 VAL A 94 10.192 -4.023 -14.538 1.00 0.00 H ATOM 1507 HG21 VAL A 94 9.999 -2.983 -17.437 1.00 0.00 H ATOM 1508 HG22 VAL A 94 8.520 -3.889 -17.845 1.00 0.00 H ATOM 1509 HG23 VAL A 94 8.668 -3.093 -16.259 1.00 0.00 H ATOM 1510 H VAL A 94 8.800 -6.418 -18.492 1.00 0.00 H ATOM 1511 N ILE A 95 12.440 -7.163 -17.231 1.00 14.74 N ATOM 1512 CA ILE A 95 13.061 -8.401 -16.787 1.00 14.21 C ATOM 1513 C ILE A 95 13.623 -8.204 -15.396 1.00 15.15 C ATOM 1514 O ILE A 95 14.449 -7.301 -15.166 1.00 13.64 O ATOM 1515 CB ILE A 95 14.163 -8.864 -17.739 1.00 17.03 C ATOM 1516 CG1 ILE A 95 13.579 -9.104 -19.129 1.00 18.68 C ATOM 1517 CG2 ILE A 95 14.803 -10.151 -17.233 1.00 20.76 C ATOM 1518 CD1 ILE A 95 14.546 -8.823 -20.209 1.00 16.42 C ATOM 1519 HA ILE A 95 12.298 -9.179 -16.777 1.00 0.00 H ATOM 1520 HB ILE A 95 14.924 -8.086 -17.789 1.00 0.00 H ATOM 1521 HG12 ILE A 95 13.267 -10.146 -19.202 1.00 0.00 H ATOM 1522 HG13 ILE A 95 12.712 -8.457 -19.260 1.00 0.00 H ATOM 1523 HD11 ILE A 95 14.859 -7.780 -20.153 1.00 0.00 H ATOM 1524 HD12 ILE A 95 15.415 -9.471 -20.095 1.00 0.00 H ATOM 1525 HD13 ILE A 95 14.076 -9.011 -21.174 1.00 0.00 H ATOM 1526 HG21 ILE A 95 15.236 -9.977 -16.248 1.00 0.00 H ATOM 1527 HG22 ILE A 95 14.044 -10.930 -17.165 1.00 0.00 H ATOM 1528 HG23 ILE A 95 15.585 -10.463 -17.925 1.00 0.00 H ATOM 1529 H ILE A 95 13.016 -6.435 -17.700 1.00 0.00 H ATOM 1530 N LEU A 96 13.141 -9.048 -14.479 1.00 12.94 N ATOM 1531 CA LEU A 96 13.581 -9.028 -13.093 1.00 16.12 C ATOM 1532 C LEU A 96 14.777 -9.944 -12.956 1.00 14.15 C ATOM 1533 O LEU A 96 14.685 -11.149 -13.209 1.00 16.98 O ATOM 1534 CB LEU A 96 12.451 -9.486 -12.174 1.00 13.30 C ATOM 1535 CG LEU A 96 11.150 -8.705 -12.315 1.00 14.59 C ATOM 1536 CD1 LEU A 96 10.116 -9.327 -11.397 1.00 16.67 C ATOM 1537 CD2 LEU A 96 11.354 -7.227 -12.010 1.00 15.18 C ATOM 1538 HA LEU A 96 13.859 -8.014 -12.806 1.00 0.00 H ATOM 1539 HB2 LEU A 96 12.242 -10.534 -12.391 1.00 0.00 H ATOM 1540 HB3 LEU A 96 12.793 -9.391 -11.143 1.00 0.00 H ATOM 1541 HG LEU A 96 10.799 -8.760 -13.346 1.00 0.00 H ATOM 1542 HD21 LEU A 96 11.717 -7.115 -10.988 1.00 0.00 H ATOM 1543 HD22 LEU A 96 12.085 -6.812 -12.704 1.00 0.00 H ATOM 1544 HD23 LEU A 96 10.406 -6.700 -12.120 1.00 0.00 H ATOM 1545 HD11 LEU A 96 9.959 -10.368 -11.681 1.00 0.00 H ATOM 1546 HD12 LEU A 96 10.470 -9.279 -10.367 1.00 0.00 H ATOM 1547 HD13 LEU A 96 9.177 -8.780 -11.485 1.00 0.00 H ATOM 1548 H LEU A 96 12.425 -9.745 -14.767 1.00 0.00 H ATOM 1549 N MET A 97 15.911 -9.358 -12.566 1.00 13.73 N ATOM 1550 CA MET A 97 17.196 -10.051 -12.535 1.00 14.99 C ATOM 1551 C MET A 97 17.556 -10.494 -11.125 1.00 18.06 C ATOM 1552 O MET A 97 18.088 -11.587 -10.913 1.00 18.91 O ATOM 1553 CB MET A 97 18.293 -9.120 -13.054 1.00 19.01 C ATOM 1554 CG MET A 97 18.107 -8.678 -14.488 1.00 20.68 C ATOM 1555 SD MET A 97 18.113 -10.061 -15.640 1.00 26.67 S ATOM 1556 CE MET A 97 19.757 -10.731 -15.391 1.00 43.10 C ATOM 1557 HA MET A 97 17.114 -10.935 -13.167 1.00 0.00 H ATOM 1558 HB2 MET A 97 18.314 -8.232 -12.423 1.00 0.00 H ATOM 1559 HB3 MET A 97 19.247 -9.641 -12.978 1.00 0.00 H ATOM 1560 HG2 MET A 97 18.917 -7.998 -14.753 1.00 0.00 H ATOM 1561 HG3 MET A 97 17.154 -8.156 -14.573 1.00 0.00 H ATOM 1562 HE1 MET A 97 20.499 -9.969 -15.630 1.00 0.00 H ATOM 1563 HE2 MET A 97 19.870 -11.037 -14.351 1.00 0.00 H ATOM 1564 HE3 MET A 97 19.899 -11.594 -16.042 1.00 0.00 H ATOM 1565 H MET A 97 15.878 -8.361 -12.270 1.00 0.00 H ATOM 1566 N GLU A 98 17.281 -9.621 -10.167 1.00 15.14 N ATOM 1567 CA GLU A 98 17.518 -9.925 -8.764 1.00 14.98 C ATOM 1568 C GLU A 98 16.315 -9.457 -7.991 1.00 13.76 C ATOM 1569 O GLU A 98 15.870 -8.318 -8.166 1.00 14.41 O ATOM 1570 CB GLU A 98 18.761 -9.209 -8.224 1.00 16.26 C ATOM 1571 CG GLU A 98 20.069 -9.686 -8.820 1.00 22.93 C ATOM 1572 CD GLU A 98 21.263 -9.013 -8.187 1.00 44.30 C ATOM 1573 OE1 GLU A 98 21.075 -7.955 -7.547 1.00 37.25 O ATOM 1574 OE2 GLU A 98 22.383 -9.544 -8.324 1.00 52.84 O ATOM 1575 HA GLU A 98 17.683 -10.997 -8.657 1.00 0.00 H ATOM 1576 HB2 GLU A 98 18.659 -8.144 -8.434 1.00 0.00 H ATOM 1577 HB3 GLU A 98 18.802 -9.363 -7.146 1.00 0.00 H ATOM 1578 HG2 GLU A 98 20.152 -10.762 -8.670 1.00 0.00 H ATOM 1579 HG3 GLU A 98 20.068 -9.469 -9.888 1.00 0.00 H ATOM 1580 H GLU A 98 16.885 -8.694 -10.425 1.00 0.00 H ATOM 1581 N LEU A 99 15.773 -10.336 -7.158 1.00 14.86 N ATOM 1582 CA LEU A 99 14.690 -9.922 -6.285 1.00 20.01 C ATOM 1583 C LEU A 99 14.738 -10.664 -4.970 1.00 17.78 C ATOM 1584 O LEU A 99 15.248 -11.784 -4.865 1.00 18.93 O ATOM 1585 CB LEU A 99 13.328 -10.068 -6.961 1.00 31.94 C ATOM 1586 CG LEU A 99 12.686 -11.438 -7.132 1.00 25.40 C ATOM 1587 CD1 LEU A 99 12.029 -11.955 -5.838 1.00 26.65 C ATOM 1588 CD2 LEU A 99 11.645 -11.397 -8.249 1.00 27.54 C ATOM 1589 HA LEU A 99 14.828 -8.862 -6.074 1.00 0.00 H ATOM 1590 HB2 LEU A 99 12.627 -9.466 -6.383 1.00 0.00 H ATOM 1591 HB3 LEU A 99 13.430 -9.645 -7.960 1.00 0.00 H ATOM 1592 HG LEU A 99 13.488 -12.129 -7.390 1.00 0.00 H ATOM 1593 HD21 LEU A 99 10.873 -10.669 -7.998 1.00 0.00 H ATOM 1594 HD22 LEU A 99 12.127 -11.109 -9.183 1.00 0.00 H ATOM 1595 HD23 LEU A 99 11.194 -12.383 -8.360 1.00 0.00 H ATOM 1596 HD11 LEU A 99 12.784 -12.036 -5.056 1.00 0.00 H ATOM 1597 HD12 LEU A 99 11.251 -11.259 -5.524 1.00 0.00 H ATOM 1598 HD13 LEU A 99 11.589 -12.935 -6.022 1.00 0.00 H ATOM 1599 H LEU A 99 16.122 -11.315 -7.131 1.00 0.00 H ATOM 1600 N GLU A 100 14.197 -10.004 -3.963 1.00 14.64 N ATOM 1601 CA GLU A 100 14.204 -10.514 -2.618 1.00 14.38 C ATOM 1602 C GLU A 100 12.779 -10.587 -2.163 1.00 14.14 C ATOM 1603 O GLU A 100 12.038 -9.623 -2.301 1.00 16.44 O ATOM 1604 CB GLU A 100 14.963 -9.556 -1.721 1.00 17.13 C ATOM 1605 CG GLU A 100 14.867 -9.877 -0.253 1.00 21.49 C ATOM 1606 CD GLU A 100 15.544 -8.832 0.602 1.00 32.78 C ATOM 1607 OE1 GLU A 100 15.536 -8.986 1.844 1.00 32.80 O ATOM 1608 OE2 GLU A 100 16.087 -7.854 0.032 1.00 25.47 O ATOM 1609 HA GLU A 100 14.680 -11.494 -2.577 1.00 0.00 H ATOM 1610 HB2 GLU A 100 16.014 -9.579 -2.008 1.00 0.00 H ATOM 1611 HB3 GLU A 100 14.566 -8.553 -1.878 1.00 0.00 H ATOM 1612 HG2 GLU A 100 13.815 -9.933 0.027 1.00 0.00 H ATOM 1613 HG3 GLU A 100 15.342 -10.841 -0.072 1.00 0.00 H ATOM 1614 H GLU A 100 13.750 -9.083 -4.148 1.00 0.00 H ATOM 1615 N VAL A 101 12.388 -11.726 -1.616 1.00 14.11 N ATOM 1616 CA VAL A 101 11.069 -11.842 -1.017 1.00 14.41 C ATOM 1617 C VAL A 101 11.138 -11.270 0.392 1.00 14.77 C ATOM 1618 O VAL A 101 11.857 -11.790 1.246 1.00 18.56 O ATOM 1619 CB VAL A 101 10.599 -13.292 -0.997 1.00 17.50 C ATOM 1620 CG1 VAL A 101 9.221 -13.396 -0.350 1.00 21.07 C ATOM 1621 CG2 VAL A 101 10.562 -13.837 -2.427 1.00 19.10 C ATOM 1622 HA VAL A 101 10.344 -11.284 -1.609 1.00 0.00 H ATOM 1623 HB VAL A 101 11.297 -13.886 -0.407 1.00 0.00 H ATOM 1624 HG11 VAL A 101 9.273 -13.025 0.674 1.00 0.00 H ATOM 1625 HG12 VAL A 101 8.508 -12.799 -0.919 1.00 0.00 H ATOM 1626 HG13 VAL A 101 8.901 -14.438 -0.344 1.00 0.00 H ATOM 1627 HG21 VAL A 101 9.873 -13.240 -3.024 1.00 0.00 H ATOM 1628 HG22 VAL A 101 11.561 -13.784 -2.860 1.00 0.00 H ATOM 1629 HG23 VAL A 101 10.226 -14.874 -2.411 1.00 0.00 H ATOM 1630 H VAL A 101 13.029 -12.545 -1.615 1.00 0.00 H ATOM 1631 N LEU A 102 10.426 -10.170 0.614 1.00 14.62 N ATOM 1632 CA LEU A 102 10.383 -9.519 1.923 1.00 15.59 C ATOM 1633 C LEU A 102 9.309 -10.124 2.802 1.00 16.31 C ATOM 1634 O LEU A 102 9.483 -10.233 4.023 1.00 17.39 O ATOM 1635 CB LEU A 102 10.097 -8.028 1.775 1.00 15.72 C ATOM 1636 CG LEU A 102 11.122 -7.224 0.993 1.00 16.28 C ATOM 1637 CD1 LEU A 102 10.682 -5.781 0.919 1.00 18.79 C ATOM 1638 CD2 LEU A 102 12.504 -7.333 1.618 1.00 20.94 C ATOM 1639 HA LEU A 102 11.359 -9.668 2.386 1.00 0.00 H ATOM 1640 HB2 LEU A 102 9.136 -7.922 1.272 1.00 0.00 H ATOM 1641 HB3 LEU A 102 10.031 -7.601 2.776 1.00 0.00 H ATOM 1642 HG LEU A 102 11.188 -7.632 -0.016 1.00 0.00 H ATOM 1643 HD21 LEU A 102 12.471 -6.953 2.639 1.00 0.00 H ATOM 1644 HD22 LEU A 102 12.816 -8.377 1.627 1.00 0.00 H ATOM 1645 HD23 LEU A 102 13.213 -6.746 1.034 1.00 0.00 H ATOM 1646 HD11 LEU A 102 9.715 -5.722 0.419 1.00 0.00 H ATOM 1647 HD12 LEU A 102 10.595 -5.377 1.928 1.00 0.00 H ATOM 1648 HD13 LEU A 102 11.419 -5.206 0.358 1.00 0.00 H ATOM 1649 H LEU A 102 9.881 -9.758 -0.170 1.00 0.00 H ATOM 1650 N LYS A 103 8.181 -10.463 2.189 1.00 16.03 N ATOM 1651 CA LYS A 103 7.102 -11.121 2.925 1.00 17.05 C ATOM 1652 C LYS A 103 6.492 -12.219 2.076 1.00 16.98 C ATOM 1653 O LYS A 103 6.118 -11.977 0.934 1.00 16.58 O ATOM 1654 CB LYS A 103 6.016 -10.115 3.304 1.00 20.05 C ATOM 1655 CG LYS A 103 6.467 -9.043 4.276 1.00 29.57 C ATOM 1656 CD LYS A 103 5.297 -8.173 4.748 1.00 32.41 C ATOM 1657 CE LYS A 103 4.440 -8.883 5.783 1.00 46.98 C ATOM 1658 NZ LYS A 103 5.172 -9.092 7.067 1.00 55.34 N ATOM 1659 HA LYS A 103 7.521 -11.550 3.835 1.00 0.00 H ATOM 1660 HB2 LYS A 103 5.671 -9.626 2.393 1.00 0.00 H ATOM 1661 HB3 LYS A 103 5.189 -10.661 3.758 1.00 0.00 H ATOM 1662 HG2 LYS A 103 6.923 -9.522 5.143 1.00 0.00 H ATOM 1663 HG3 LYS A 103 7.203 -8.408 3.784 1.00 0.00 H ATOM 1664 HD2 LYS A 103 5.694 -7.258 5.187 1.00 0.00 H ATOM 1665 HD3 LYS A 103 4.675 -7.922 3.888 1.00 0.00 H ATOM 1666 HE2 LYS A 103 4.140 -9.853 5.387 1.00 0.00 H ATOM 1667 HE3 LYS A 103 3.552 -8.281 5.978 1.00 0.00 H ATOM 1668 HZ1 LYS A 103 6.018 -9.671 6.892 1.00 0.00 H ATOM 1669 HZ2 LYS A 103 5.456 -8.171 7.457 1.00 0.00 H ATOM 1670 HZ3 LYS A 103 4.550 -9.579 7.744 1.00 0.00 H ATOM 1671 H LYS A 103 8.064 -10.259 1.176 1.00 0.00 H ATOM 1672 N SER A 104 6.398 -13.420 2.640 1.00 17.24 N ATOM 1673 CA SER A 104 5.817 -14.556 1.930 1.00 17.18 C ATOM 1674 C SER A 104 4.348 -14.331 1.654 1.00 15.76 C ATOM 1675 O SER A 104 3.693 -13.545 2.325 1.00 15.71 O ATOM 1676 CB SER A 104 5.941 -15.825 2.761 1.00 18.70 C ATOM 1677 OG SER A 104 5.038 -15.774 3.857 1.00 26.01 O ATOM 1678 HA SER A 104 6.361 -14.659 0.991 1.00 0.00 H ATOM 1679 HB2 SER A 104 6.961 -15.914 3.136 1.00 0.00 H ATOM 1680 HB3 SER A 104 5.707 -16.689 2.139 1.00 0.00 H ATOM 1681 HG SER A 104 4.112 -15.695 3.517 1.00 0.00 H ATOM 1682 H SER A 104 6.747 -13.553 3.611 1.00 0.00 H ATOM 1683 N ALA A 105 3.829 -15.057 0.670 1.00 17.41 N ATOM 1684 CA ALA A 105 2.432 -14.943 0.289 1.00 15.88 C ATOM 1685 C ALA A 105 1.535 -15.196 1.497 1.00 16.77 C ATOM 1686 O ALA A 105 0.525 -14.520 1.698 1.00 18.50 O ATOM 1687 CB ALA A 105 2.123 -15.941 -0.808 1.00 18.75 C ATOM 1688 HA ALA A 105 2.242 -13.935 -0.079 1.00 0.00 H ATOM 1689 HB1 ALA A 105 2.754 -15.735 -1.673 1.00 0.00 H ATOM 1690 HB2 ALA A 105 2.320 -16.950 -0.445 1.00 0.00 H ATOM 1691 HB3 ALA A 105 1.074 -15.854 -1.092 1.00 0.00 H ATOM 1692 H ALA A 105 4.440 -15.725 0.158 1.00 0.00 H ATOM 1693 N GLU A 106 1.924 -16.170 2.303 1.00 18.79 N ATOM 1694 CA GLU A 106 1.090 -16.599 3.414 1.00 19.44 C ATOM 1695 C GLU A 106 1.065 -15.543 4.506 1.00 20.24 C ATOM 1696 O GLU A 106 0.110 -15.459 5.283 1.00 23.21 O ATOM 1697 CB GLU A 106 1.601 -17.928 3.978 1.00 20.71 C ATOM 1698 CG GLU A 106 1.525 -19.105 2.997 1.00 27.32 C ATOM 1699 CD GLU A 106 2.580 -19.061 1.890 1.00 40.00 C ATOM 1700 OE1 GLU A 106 3.643 -18.437 2.089 1.00 28.36 O ATOM 1701 OE2 GLU A 106 2.343 -19.659 0.816 1.00 48.03 O ATOM 1702 HA GLU A 106 0.074 -16.739 3.046 1.00 0.00 H ATOM 1703 HB2 GLU A 106 2.642 -17.796 4.272 1.00 0.00 H ATOM 1704 HB3 GLU A 106 1.006 -18.177 4.856 1.00 0.00 H ATOM 1705 HG2 GLU A 106 1.656 -20.029 3.559 1.00 0.00 H ATOM 1706 HG3 GLU A 106 0.539 -19.101 2.532 1.00 0.00 H ATOM 1707 H GLU A 106 2.840 -16.636 2.140 1.00 0.00 H ATOM 1708 N ALA A 107 2.116 -14.733 4.564 1.00 16.78 N ATOM 1709 CA ALA A 107 2.219 -13.696 5.579 1.00 17.56 C ATOM 1710 C ALA A 107 1.494 -12.422 5.177 1.00 23.39 C ATOM 1711 O ALA A 107 1.253 -11.560 6.010 1.00 25.50 O ATOM 1712 CB ALA A 107 3.675 -13.397 5.864 1.00 21.67 C ATOM 1713 HA ALA A 107 1.736 -14.072 6.481 1.00 0.00 H ATOM 1714 HB1 ALA A 107 4.167 -14.301 6.222 1.00 0.00 H ATOM 1715 HB2 ALA A 107 4.160 -13.055 4.950 1.00 0.00 H ATOM 1716 HB3 ALA A 107 3.743 -12.620 6.625 1.00 0.00 H ATOM 1717 H ALA A 107 2.882 -14.842 3.869 1.00 0.00 H ATOM 1718 N VAL A 108 1.146 -12.303 3.900 1.00 15.03 N ATOM 1719 CA VAL A 108 0.429 -11.136 3.401 1.00 15.78 C ATOM 1720 C VAL A 108 -1.040 -11.489 3.166 1.00 18.27 C ATOM 1721 O VAL A 108 -1.938 -10.903 3.776 1.00 19.20 O ATOM 1722 CB VAL A 108 1.059 -10.616 2.103 1.00 16.09 C ATOM 1723 CG1 VAL A 108 0.351 -9.339 1.652 1.00 15.15 C ATOM 1724 CG2 VAL A 108 2.542 -10.348 2.317 1.00 17.30 C ATOM 1725 HA VAL A 108 0.495 -10.347 4.150 1.00 0.00 H ATOM 1726 HB VAL A 108 0.946 -11.372 1.326 1.00 0.00 H ATOM 1727 HG11 VAL A 108 -0.704 -9.552 1.479 1.00 0.00 H ATOM 1728 HG12 VAL A 108 0.447 -8.579 2.427 1.00 0.00 H ATOM 1729 HG13 VAL A 108 0.807 -8.979 0.730 1.00 0.00 H ATOM 1730 HG21 VAL A 108 2.665 -9.601 3.101 1.00 0.00 H ATOM 1731 HG22 VAL A 108 3.038 -11.272 2.613 1.00 0.00 H ATOM 1732 HG23 VAL A 108 2.981 -9.979 1.390 1.00 0.00 H ATOM 1733 H VAL A 108 1.393 -13.065 3.237 1.00 0.00 H ATOM 1734 N GLY A 109 -1.279 -12.427 2.258 1.00 17.34 N ATOM 1735 CA GLY A 109 -2.563 -13.106 2.176 1.00 19.67 C ATOM 1736 C GLY A 109 -3.638 -12.462 1.328 1.00 17.20 C ATOM 1737 O GLY A 109 -4.655 -13.096 1.053 1.00 18.32 O ATOM 1738 HA3 GLY A 109 -2.953 -13.191 3.190 1.00 0.00 H ATOM 1739 HA2 GLY A 109 -2.381 -14.102 1.773 1.00 0.00 H ATOM 1740 H GLY A 109 -0.528 -12.684 1.586 1.00 0.00 H ATOM 1741 N VAL A 110 -3.423 -11.217 0.918 1.00 16.63 N ATOM 1742 CA VAL A 110 -4.411 -10.458 0.159 1.00 15.92 C ATOM 1743 C VAL A 110 -3.711 -9.510 -0.797 1.00 14.47 C ATOM 1744 O VAL A 110 -2.573 -9.116 -0.551 1.00 16.43 O ATOM 1745 CB VAL A 110 -5.306 -9.607 1.091 1.00 17.52 C ATOM 1746 CG1 VAL A 110 -6.173 -10.494 1.964 1.00 30.66 C ATOM 1747 CG2 VAL A 110 -4.458 -8.674 1.944 1.00 16.95 C ATOM 1748 HA VAL A 110 -5.026 -11.177 -0.382 1.00 0.00 H ATOM 1749 HB VAL A 110 -5.963 -8.999 0.469 1.00 0.00 H ATOM 1750 HG11 VAL A 110 -6.811 -11.112 1.332 1.00 0.00 H ATOM 1751 HG12 VAL A 110 -5.536 -11.134 2.575 1.00 0.00 H ATOM 1752 HG13 VAL A 110 -6.793 -9.872 2.610 1.00 0.00 H ATOM 1753 HG21 VAL A 110 -3.773 -9.263 2.553 1.00 0.00 H ATOM 1754 HG22 VAL A 110 -3.889 -8.008 1.296 1.00 0.00 H ATOM 1755 HG23 VAL A 110 -5.107 -8.085 2.592 1.00 0.00 H ATOM 1756 H VAL A 110 -2.515 -10.766 1.147 1.00 0.00 H ATOM 1757 N LYS A 111 -4.401 -9.134 -1.871 1.00 16.12 N ATOM 1758 CA LYS A 111 -3.927 -8.073 -2.737 1.00 14.97 C ATOM 1759 C LYS A 111 -4.050 -6.768 -1.975 1.00 13.87 C ATOM 1760 O LYS A 111 -5.138 -6.380 -1.567 1.00 18.15 O ATOM 1761 CB LYS A 111 -4.779 -8.016 -4.004 1.00 18.58 C ATOM 1762 CG LYS A 111 -4.450 -6.836 -4.908 1.00 17.50 C ATOM 1763 CD LYS A 111 -5.103 -6.959 -6.292 1.00 26.40 C ATOM 1764 CE LYS A 111 -6.609 -7.072 -6.204 1.00 36.93 C ATOM 1765 NZ LYS A 111 -7.219 -5.919 -5.487 1.00 57.86 N ATOM 1766 HA LYS A 111 -2.892 -8.251 -3.027 1.00 0.00 H ATOM 1767 HB2 LYS A 111 -4.622 -8.936 -4.567 1.00 0.00 H ATOM 1768 HB3 LYS A 111 -5.827 -7.945 -3.712 1.00 0.00 H ATOM 1769 HG2 LYS A 111 -4.805 -5.921 -4.433 1.00 0.00 H ATOM 1770 HG3 LYS A 111 -3.369 -6.782 -5.034 1.00 0.00 H ATOM 1771 HD2 LYS A 111 -4.850 -6.076 -6.880 1.00 0.00 H ATOM 1772 HD3 LYS A 111 -4.712 -7.848 -6.787 1.00 0.00 H ATOM 1773 HE2 LYS A 111 -6.862 -7.990 -5.673 1.00 0.00 H ATOM 1774 HE3 LYS A 111 -7.018 -7.114 -7.214 1.00 0.00 H ATOM 1775 HZ1 LYS A 111 -6.841 -5.875 -4.519 1.00 0.00 H ATOM 1776 HZ2 LYS A 111 -6.990 -5.038 -5.991 1.00 0.00 H ATOM 1777 HZ3 LYS A 111 -8.251 -6.041 -5.452 1.00 0.00 H ATOM 1778 H LYS A 111 -5.298 -9.611 -2.093 1.00 0.00 H ATOM 1779 N ILE A 112 -2.924 -6.090 -1.805 1.00 12.94 N ATOM 1780 CA ILE A 112 -2.866 -4.859 -1.041 1.00 14.24 C ATOM 1781 C ILE A 112 -3.452 -3.706 -1.840 1.00 14.57 C ATOM 1782 O ILE A 112 -3.107 -3.515 -3.013 1.00 16.24 O ATOM 1783 CB ILE A 112 -1.405 -4.544 -0.706 1.00 14.65 C ATOM 1784 CG1 ILE A 112 -0.860 -5.547 0.311 1.00 14.31 C ATOM 1785 CG2 ILE A 112 -1.232 -3.124 -0.173 1.00 18.33 C ATOM 1786 CD1 ILE A 112 0.659 -5.578 0.341 1.00 16.88 C ATOM 1787 HA ILE A 112 -3.446 -4.985 -0.127 1.00 0.00 H ATOM 1788 HB ILE A 112 -0.840 -4.624 -1.635 1.00 0.00 H ATOM 1789 HG12 ILE A 112 -1.224 -5.274 1.301 1.00 0.00 H ATOM 1790 HG13 ILE A 112 -1.225 -6.541 0.052 1.00 0.00 H ATOM 1791 HD11 ILE A 112 1.035 -5.859 -0.643 1.00 0.00 H ATOM 1792 HD12 ILE A 112 1.036 -4.591 0.607 1.00 0.00 H ATOM 1793 HD13 ILE A 112 0.992 -6.307 1.080 1.00 0.00 H ATOM 1794 HG21 ILE A 112 -1.570 -2.411 -0.925 1.00 0.00 H ATOM 1795 HG22 ILE A 112 -1.823 -3.004 0.735 1.00 0.00 H ATOM 1796 HG23 ILE A 112 -0.180 -2.947 0.051 1.00 0.00 H ATOM 1797 H ILE A 112 -2.050 -6.454 -2.235 1.00 0.00 H ATOM 1798 N GLY A 113 -4.316 -2.925 -1.203 1.00 18.65 N ATOM 1799 CA GLY A 113 -4.868 -1.753 -1.847 1.00 20.27 C ATOM 1800 C GLY A 113 -5.827 -2.125 -2.953 1.00 22.19 C ATOM 1801 O GLY A 113 -6.365 -3.228 -2.973 1.00 20.21 O ATOM 1802 HA3 GLY A 113 -4.053 -1.164 -2.268 1.00 0.00 H ATOM 1803 HA2 GLY A 113 -5.399 -1.158 -1.104 1.00 0.00 H ATOM 1804 H GLY A 113 -4.599 -3.158 -0.230 1.00 0.00 H ATOM 1805 N ASN A 114 -6.042 -1.187 -3.867 1.00 19.29 N ATOM 1806 CA ASN A 114 -6.938 -1.384 -4.997 1.00 19.67 C ATOM 1807 C ASN A 114 -6.235 -0.884 -6.239 1.00 18.60 C ATOM 1808 O ASN A 114 -6.653 0.109 -6.840 1.00 21.03 O ATOM 1809 CB ASN A 114 -8.258 -0.639 -4.790 1.00 29.01 C ATOM 1810 CG ASN A 114 -9.317 -1.020 -5.820 1.00 44.27 C ATOM 1811 OD1 ASN A 114 -9.123 -1.935 -6.623 1.00 45.41 O ATOM 1812 ND2 ASN A 114 -10.451 -0.324 -5.788 1.00 59.84 N ATOM 1813 HA ASN A 114 -7.180 -2.442 -5.097 1.00 0.00 H ATOM 1814 HB2 ASN A 114 -8.638 -0.873 -3.796 1.00 0.00 H ATOM 1815 HB3 ASN A 114 -8.069 0.432 -4.863 1.00 0.00 H ATOM 1816 HD22 ASN A 114 -10.573 0.440 -5.093 1.00 0.00 H ATOM 1817 HD21 ASN A 114 -11.216 -0.545 -6.458 1.00 0.00 H ATOM 1818 H ASN A 114 -5.551 -0.275 -3.772 1.00 0.00 H ATOM 1819 N PRO A 115 -5.137 -1.553 -6.616 1.00 17.21 N ATOM 1820 CA PRO A 115 -4.374 -1.090 -7.777 1.00 16.14 C ATOM 1821 C PRO A 115 -5.138 -1.298 -9.081 1.00 18.43 C ATOM 1822 O PRO A 115 -5.916 -2.252 -9.201 1.00 19.87 O ATOM 1823 CB PRO A 115 -3.121 -1.969 -7.732 1.00 17.11 C ATOM 1824 CG PRO A 115 -3.581 -3.236 -7.064 1.00 15.43 C ATOM 1825 CD PRO A 115 -4.513 -2.743 -5.998 1.00 16.42 C ATOM 1826 HA PRO A 115 -4.162 -0.021 -7.743 1.00 0.00 H ATOM 1827 HD3 PRO A 115 -5.263 -3.496 -5.756 1.00 0.00 H ATOM 1828 HD2 PRO A 115 -3.966 -2.473 -5.095 1.00 0.00 H ATOM 1829 HG3 PRO A 115 -2.740 -3.776 -6.629 1.00 0.00 H ATOM 1830 HG2 PRO A 115 -4.101 -3.883 -7.770 1.00 0.00 H ATOM 1831 HB2 PRO A 115 -2.756 -2.173 -8.738 1.00 0.00 H ATOM 1832 HB3 PRO A 115 -2.333 -1.490 -7.151 1.00 0.00 H ATOM 1833 N VAL A 116 -4.921 -0.405 -10.039 1.00 18.63 N ATOM 1834 CA VAL A 116 -5.590 -0.478 -11.332 1.00 18.66 C ATOM 1835 C VAL A 116 -4.555 -0.670 -12.422 1.00 16.44 C ATOM 1836 O VAL A 116 -3.412 -0.267 -12.270 1.00 17.17 O ATOM 1837 CB VAL A 116 -6.425 0.787 -11.623 1.00 21.44 C ATOM 1838 CG1 VAL A 116 -7.541 0.920 -10.610 1.00 26.61 C ATOM 1839 CG2 VAL A 116 -5.546 2.031 -11.621 1.00 26.36 C ATOM 1840 HA VAL A 116 -6.275 -1.325 -11.308 1.00 0.00 H ATOM 1841 HB VAL A 116 -6.864 0.689 -12.616 1.00 0.00 H ATOM 1842 HG11 VAL A 116 -8.187 0.044 -10.666 1.00 0.00 H ATOM 1843 HG12 VAL A 116 -7.115 0.995 -9.610 1.00 0.00 H ATOM 1844 HG13 VAL A 116 -8.122 1.816 -10.827 1.00 0.00 H ATOM 1845 HG21 VAL A 116 -5.074 2.139 -10.645 1.00 0.00 H ATOM 1846 HG22 VAL A 116 -4.778 1.933 -12.388 1.00 0.00 H ATOM 1847 HG23 VAL A 116 -6.159 2.908 -11.829 1.00 0.00 H ATOM 1848 H VAL A 116 -4.252 0.371 -9.861 1.00 0.00 H ATOM 1849 N PRO A 117 -4.950 -1.285 -13.537 1.00 19.22 N ATOM 1850 CA PRO A 117 -3.944 -1.526 -14.575 1.00 17.45 C ATOM 1851 C PRO A 117 -3.295 -0.260 -15.096 1.00 21.44 C ATOM 1852 O PRO A 117 -3.964 0.749 -15.330 1.00 20.32 O ATOM 1853 CB PRO A 117 -4.746 -2.202 -15.688 1.00 20.81 C ATOM 1854 CG PRO A 117 -5.919 -2.791 -15.005 1.00 24.72 C ATOM 1855 CD PRO A 117 -6.255 -1.864 -13.889 1.00 24.08 C ATOM 1856 HA PRO A 117 -3.114 -2.118 -14.190 1.00 0.00 H ATOM 1857 HD3 PRO A 117 -6.951 -1.092 -14.217 1.00 0.00 H ATOM 1858 HD2 PRO A 117 -6.685 -2.405 -13.046 1.00 0.00 H ATOM 1859 HG3 PRO A 117 -5.674 -3.779 -14.616 1.00 0.00 H ATOM 1860 HG2 PRO A 117 -6.758 -2.872 -15.696 1.00 0.00 H ATOM 1861 HB2 PRO A 117 -5.062 -1.471 -16.432 1.00 0.00 H ATOM 1862 HB3 PRO A 117 -4.153 -2.978 -16.172 1.00 0.00 H ATOM 1863 N TYR A 118 -1.976 -0.322 -15.252 1.00 17.41 N ATOM 1864 CA TYR A 118 -1.236 0.743 -15.884 1.00 19.19 C ATOM 1865 C TYR A 118 -1.491 0.628 -17.367 1.00 22.76 C ATOM 1866 O TYR A 118 -1.419 -0.457 -17.927 1.00 23.68 O ATOM 1867 CB TYR A 118 0.259 0.606 -15.585 1.00 17.53 C ATOM 1868 CG TYR A 118 1.056 1.729 -16.172 1.00 18.82 C ATOM 1869 CD1 TYR A 118 1.127 2.955 -15.528 1.00 19.13 C ATOM 1870 CD2 TYR A 118 1.721 1.575 -17.375 1.00 22.47 C ATOM 1871 CE1 TYR A 118 1.841 3.991 -16.061 1.00 23.51 C ATOM 1872 CE2 TYR A 118 2.439 2.609 -17.917 1.00 28.46 C ATOM 1873 CZ TYR A 118 2.494 3.815 -17.254 1.00 30.12 C ATOM 1874 OH TYR A 118 3.211 4.854 -17.789 1.00 36.11 O ATOM 1875 HA TYR A 118 -1.553 1.716 -15.508 1.00 0.00 H ATOM 1876 HB3 TYR A 118 0.617 -0.335 -16.003 1.00 0.00 H ATOM 1877 HB2 TYR A 118 0.403 0.600 -14.505 1.00 0.00 H ATOM 1878 HD2 TYR A 118 1.673 0.620 -17.898 1.00 0.00 H ATOM 1879 HE2 TYR A 118 2.962 2.478 -18.864 1.00 0.00 H ATOM 1880 HE1 TYR A 118 1.891 4.949 -15.543 1.00 0.00 H ATOM 1881 HD1 TYR A 118 0.605 3.095 -14.581 1.00 0.00 H ATOM 1882 HH TYR A 118 2.843 5.084 -18.679 1.00 0.00 H ATOM 1883 H TYR A 118 -1.464 -1.160 -14.909 1.00 0.00 H ATOM 1884 N ASN A 119 -1.799 1.754 -17.999 1.00 27.94 N ATOM 1885 CA ASN A 119 -2.144 1.772 -19.408 1.00 33.97 C ATOM 1886 C ASN A 119 -0.936 2.114 -20.272 1.00 35.23 C ATOM 1887 O ASN A 119 -0.619 3.286 -20.484 1.00 43.48 O ATOM 1888 CB ASN A 119 -3.275 2.775 -19.641 1.00 33.86 C ATOM 1889 CG ASN A 119 -4.505 2.460 -18.808 1.00 46.87 C ATOM 1890 OD1 ASN A 119 -5.013 3.313 -18.080 1.00 58.11 O ATOM 1891 ND2 ASN A 119 -4.974 1.220 -18.893 1.00 43.65 N ATOM 1892 HA ASN A 119 -2.478 0.776 -19.697 1.00 0.00 H ATOM 1893 HB2 ASN A 119 -2.920 3.772 -19.379 1.00 0.00 H ATOM 1894 HB3 ASN A 119 -3.551 2.754 -20.695 1.00 0.00 H ATOM 1895 HD22 ASN A 119 -4.513 0.532 -19.522 1.00 0.00 H ATOM 1896 HD21 ASN A 119 -5.802 0.938 -18.331 1.00 0.00 H ATOM 1897 H ASN A 119 -1.793 2.649 -17.469 1.00 0.00 H ATOM 1898 N GLU A 120 -0.263 1.075 -20.755 1.00 33.05 N ATOM 1899 CA GLU A 120 0.870 1.228 -21.660 1.00 44.69 C ATOM 1900 C GLU A 120 1.432 -0.141 -22.034 1.00 58.67 C ATOM 1901 O GLU A 120 2.648 -0.328 -22.108 1.00 71.05 O ATOM 1902 CB GLU A 120 1.965 2.079 -21.020 1.00 55.35 C ATOM 1903 HA GLU A 120 0.521 1.732 -22.561 1.00 0.00 H ATOM 1904 HB2 GLU A 120 1.566 3.066 -20.786 1.00 0.00 H ATOM 1905 HB3 GLU A 120 2.309 1.598 -20.104 1.00 0.00 H ATOM 1906 H GLU A 120 -0.555 0.116 -20.477 1.00 0.00 H TER 1907 GLU A 120 HETATM 1908 O HOH 1 11.954 -21.504 1.523 1.00 11.56 O HETATM 1909 O HOH 2 11.471 -17.004 -16.209 1.00 15.31 O HETATM 1910 O HOH 3 -1.376 -4.723 -4.494 1.00 15.47 O HETATM 1911 O HOH 4 4.048 3.736 -0.131 1.00 16.85 O HETATM 1912 O HOH 5 2.575 3.543 -10.637 1.00 17.54 O HETATM 1913 O HOH 6 -1.417 -13.909 6.779 1.00 21.31 O HETATM 1914 O HOH 7 13.470 -5.975 -29.747 1.00 21.63 O HETATM 1915 O HOH 8 -2.132 -4.760 -15.190 1.00 22.51 O HETATM 1916 O HOH 9 7.201 -7.533 -31.395 1.00 26.37 O HETATM 1917 O HOH 10 13.861 -24.755 -10.337 1.00 32.46 O HETATM 1918 O HOH 11 18.008 -2.270 -11.455 1.00 26.66 O HETATM 1919 O HOH 12 16.386 -2.421 -8.942 1.00 26.89 O HETATM 1920 O HOH 13 4.236 -4.457 -21.844 1.00 25.44 O HETATM 1921 O HOH 14 7.193 -13.630 5.460 1.00 25.74 O HETATM 1922 O HOH 15 0.107 5.783 -13.012 1.00 27.45 O HETATM 1923 O HOH 16 -1.176 -18.798 -12.897 1.00 27.74 O HETATM 1924 O HOH 17 -1.643 -3.135 -17.341 1.00 25.33 O HETATM 1925 O HOH 18 4.582 -1.348 -22.993 1.00 26.46 O HETATM 1926 O HOH 19 -0.061 -17.199 -9.270 1.00 33.00 O HETATM 1927 O HOH 20 3.286 0.642 -26.472 1.00 29.95 O HETATM 1928 O HOH 21 10.566 -8.290 -30.672 1.00 28.84 O HETATM 1929 O HOH 22 7.613 -26.831 -8.762 1.00 30.49 O HETATM 1930 O HOH 23 -0.030 -17.698 -3.066 1.00 28.32 O HETATM 1931 O HOH 24 5.368 -20.562 -6.654 1.00 26.17 O HETATM 1932 O HOH 25 2.627 0.830 8.544 1.00 33.36 O HETATM 1933 O HOH 26 2.840 0.188 5.873 1.00 32.98 O HETATM 1934 O HOH 27 10.651 2.104 -19.665 1.00 33.75 O HETATM 1935 O HOH 28 1.585 -18.187 -7.567 1.00 35.93 O HETATM 1936 O HOH 29 18.819 -15.510 -16.199 1.00 31.77 O HETATM 1937 O HOH 30 14.160 -10.982 3.052 1.00 35.40 O HETATM 1938 O HOH 31 5.551 0.667 -24.835 1.00 28.68 O HETATM 1939 O HOH 32 -3.910 -6.488 -16.105 1.00 49.80 O HETATM 1940 O HOH 33 13.616 -23.466 -14.900 1.00 33.30 O HETATM 1941 O HOH 34 4.083 4.346 -20.241 1.00 43.09 O HETATM 1942 O HOH 35 19.759 -19.773 -10.835 1.00 33.23 O HETATM 1943 O HOH 36 -6.837 0.479 -16.166 1.00 51.50 O HETATM 1944 O HOH 37 -4.463 1.228 -3.544 1.00 35.48 O HETATM 1945 O HOH 38 16.441 -14.037 -5.932 1.00 34.48 O HETATM 1946 O HOH 39 13.947 -3.505 2.200 1.00 34.06 O HETATM 1947 O HOH 40 8.419 -9.406 -31.046 1.00 51.16 O HETATM 1948 O HOH 41 5.876 7.712 -10.593 1.00 31.80 O HETATM 1949 O HOH 42 11.094 -20.608 3.231 1.00 35.49 O HETATM 1950 O HOH 43 15.343 -23.520 -12.759 1.00 38.72 O HETATM 1951 O HOH 44 1.566 6.285 -10.475 1.00 40.45 O HETATM 1952 O HOH 45 -3.023 -17.233 -14.053 1.00 42.52 O HETATM 1953 O HOH 46 -0.508 -19.022 -5.840 1.00 36.67 O HETATM 1954 O HOH 47 12.206 5.444 -23.552 1.00 37.36 O HETATM 1955 O HOH 48 -5.480 -6.926 -14.329 1.00 45.87 O HETATM 1956 O HOH 49 -3.386 -18.130 -16.292 1.00 43.86 O HETATM 1957 O HOH 50 6.906 -16.244 6.288 1.00 44.55 O HETATM 1958 O HOH 51 20.925 0.663 -12.902 1.00 50.70 O HETATM 1959 O HOH 52 2.983 -1.202 -28.557 1.00 37.11 O HETATM 1960 O HOH 53 6.997 8.915 -13.243 1.00 42.08 O HETATM 1961 O HOH 54 -7.208 4.819 -7.236 1.00 25.44 O HETATM 1962 O HOH 55 -5.334 -7.231 -10.010 1.00 36.14 O HETATM 1963 O HOH 56 -7.287 -3.857 -7.612 1.00 33.22 O HETATM 1964 O HOH 57 -5.459 2.450 -7.700 1.00 25.71 O HETATM 1965 O HOH 58 7.044 2.524 -21.499 1.00 41.15 O HETATM 1966 O HOH 59 16.512 -5.281 1.090 1.00 38.40 O HETATM 1967 O HOH 60 -5.792 3.151 -4.557 1.00 45.60 O HETATM 1968 O HOH 61 3.511 -21.435 -4.676 1.00 41.26 O HETATM 1969 O HOH 62 6.630 -8.031 -34.150 1.00 40.75 O HETATM 1970 O HOH 63 0.487 7.650 2.743 1.00 38.09 O HETATM 1971 O HOH 64 -1.595 7.197 1.878 1.00 44.86 O HETATM 1972 O HOH 65 7.592 -7.163 -36.178 1.00 47.64 O HETATM 1973 O HOH 66 -1.366 -15.776 -0.029 1.00 32.93 O HETATM 1974 O HOH 67 -4.980 -5.738 -12.250 1.00 39.17 O HETATM 1975 O HOH 68 -6.153 -9.683 -13.186 1.00 47.84 O HETATM 1976 O HOH 69 15.932 -14.459 5.789 1.00 32.42 O HETATM 1977 O HOH 70 3.872 -7.782 -34.511 1.00 46.32 O HETATM 1978 O HOH 71 10.203 5.870 -21.834 1.00 39.80 O HETATM 1979 O HOH 72 13.526 -15.674 6.201 1.00 38.07 O HETATM 1980 O HOH 73 12.480 -15.673 3.268 1.00 40.57 O HETATM 1981 O HOH 74 13.350 -13.739 2.338 1.00 43.89 O HETATM 1982 O HOH 75 6.394 -29.434 -8.055 1.00 46.86 O HETATM 1983 O HOH 76 19.920 -2.823 -14.404 1.00 36.57 O HETATM 1984 O HOH 77 13.922 -26.178 -15.802 1.00 46.67 O HETATM 1985 O HOH 78 17.878 -2.875 0.731 1.00 43.36 O HETATM 1986 O HOH 79 20.705 -3.860 -4.513 1.00 47.99 O HETATM 1987 O HOH 80 -2.159 -11.751 -22.377 1.00 45.70 O HETATM 1988 O HOH 81 6.442 -24.164 -11.870 1.00 45.47 O HETATM 1989 O HOH 82 -2.969 4.601 -14.500 1.00 30.06 O HETATM 1990 O HOH 83 17.608 -7.260 1.777 1.00 21.25 O HETATM 1991 O HOH 84 1.074 -4.982 -19.481 1.00 30.70 O HETATM 1992 O HOH 85 16.142 -4.038 3.824 1.00 50.38 O HETATM 1993 O HOH 86 20.014 -21.259 -12.876 1.00 50.45 O HETATM 1994 O HOH 87 -4.823 -13.763 -9.466 1.00 51.70 O HETATM 1995 O HOH 88 -4.970 -12.010 -11.342 1.00 53.73 O HETATM 1996 O HOH 89 16.152 -7.048 3.467 1.00 51.22 O HETATM 1997 O HOH 90 16.764 -14.925 -18.643 1.00 30.32 O HETATM 1998 O HOH 91 0.208 -4.498 -17.781 1.00 33.78 O HETATM 1999 O HOH 92 18.796 -12.600 -18.194 1.00 49.85 O HETATM 2000 O HOH 93 1.863 -18.181 -23.212 1.00 42.02 O HETATM 2001 C01 UNN A 94 5.095 -12.867 -24.059 1.00 0.11 C HETATM 2002 N02 UNN A 94 4.527 -12.265 -23.013 1.00 -0.15 N HETATM 2003 N03 UNN A 94 3.552 -13.009 -22.529 1.00 -0.18 N HETATM 2004 C04 UNN A 94 3.442 -14.128 -23.236 1.00 0.07 C HETATM 2005 C05 UNN A 94 4.426 -14.101 -24.256 1.00 -0.02 C HETATM 2006 H1 UNN A 94 4.623 -14.855 -25.017 1.00 0.04 H HETATM 2007 C19 UNN A 94 2.462 -15.214 -22.979 1.00 0.07 C HETATM 2008 O20 UNN A 94 2.470 -16.260 -23.681 1.00 -0.56 O HETATM 2009 O21 UNN A 94 1.643 -15.065 -22.041 1.00 -0.56 O HETATM 2010 C07 UNN A 94 4.893 -10.993 -22.478 1.00 0.11 C HETATM 2011 C13 UNN A 94 5.328 -10.889 -21.169 1.00 -0.03 C HETATM 2012 C14 UNN A 94 5.679 -9.651 -20.661 1.00 -0.07 C HETATM 2013 C15 UNN A 94 5.586 -8.525 -21.463 1.00 -0.07 C HETATM 2014 C16 UNN A 94 5.149 -8.637 -22.771 1.00 -0.05 C HETATM 2015 C17 UNN A 94 4.802 -9.875 -23.283 1.00 -0.02 C HETATM 2016 H10 UNN A 94 4.461 -9.966 -24.308 1.00 0.05 H HETATM 2017 C18 UNN A 94 5.052 -7.433 -23.647 1.00 -0.03 C HETATM 2018 H11 UNN A 94 5.364 -6.542 -23.082 1.00 0.04 H HETATM 2019 H12 UNN A 94 4.013 -7.308 -23.984 1.00 0.04 H HETATM 2020 H13 UNN A 94 5.708 -7.561 -24.520 1.00 0.04 H HETATM 2021 H9 UNN A 94 5.856 -7.554 -21.065 1.00 0.05 H HETATM 2022 H8 UNN A 94 6.026 -9.562 -19.638 1.00 0.06 H HETATM 2023 H7 UNN A 94 5.394 -11.773 -20.545 1.00 0.05 H HETATM 2024 C06 UNN A 94 6.226 -12.352 -24.885 1.00 0.01 C HETATM 2025 C08 UNN A 94 6.153 -12.440 -26.266 1.00 -0.05 C HETATM 2026 C09 UNN A 94 7.196 -11.966 -27.047 1.00 -0.06 C HETATM 2027 C10 UNN A 94 8.313 -11.406 -26.447 1.00 -0.06 C HETATM 2028 C11 UNN A 94 8.385 -11.314 -25.066 1.00 -0.06 C HETATM 2029 C12 UNN A 94 7.346 -11.794 -24.285 1.00 -0.05 C HETATM 2030 H6 UNN A 94 7.408 -11.734 -23.204 1.00 0.06 H HETATM 2031 H5 UNN A 94 9.254 -10.867 -24.597 1.00 0.06 H HETATM 2032 H4 UNN A 94 9.130 -11.040 -27.058 1.00 0.06 H HETATM 2033 H3 UNN A 94 7.138 -12.033 -28.127 1.00 0.06 H HETATM 2034 H2 UNN A 94 5.280 -12.879 -26.736 1.00 0.06 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 2001 2002 2005 2024 CONECT 2002 2001 2003 2010 CONECT 2003 2002 2004 CONECT 2004 2003 2005 2007 CONECT 2005 2001 2004 2006 CONECT 2006 2005 CONECT 2007 2004 2008 2009 CONECT 2008 2007 CONECT 2009 2007 CONECT 2010 2002 2011 2015 CONECT 2011 2010 2012 2023 CONECT 2012 2011 2013 2022 CONECT 2013 2012 2014 2021 CONECT 2014 2013 2015 2017 CONECT 2015 2010 2014 2016 CONECT 2016 2015 CONECT 2017 2014 2018 2019 2020 CONECT 2018 2017 CONECT 2019 2017 CONECT 2020 2017 CONECT 2021 2013 CONECT 2022 2012 CONECT 2023 2011 CONECT 2024 2001 2025 2029 CONECT 2025 2024 2026 2034 CONECT 2026 2025 2027 2033 CONECT 2027 2026 2028 2032 CONECT 2028 2027 2029 2031 CONECT 2029 2024 2028 2030 CONECT 2030 2029 CONECT 2031 2028 CONECT 2032 2027 CONECT 2033 2026 CONECT 2034 2025 MASTER 0 0 0 0 0 0 0 0 2033 1 38 10 END
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Related entries of code: 4luo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
4ijh
RCSB PDB
PDBbind
123aa, >4IJH_1|Chain... *
4ijl
RCSB PDB
PDBbind
123aa, >4IJL_1|Chain... at 100%
4luv
RCSB PDB
PDBbind
123aa, >4LUV_1|Chain... at 100%
4luz
RCSB PDB
PDBbind
123aa, >4LUZ_1|Chain... at 100%
4lw1
RCSB PDB
PDBbind
123aa, >4LW1_1|Chain... at 100%
4lwc
RCSB PDB
PDBbind
123aa, >4LWC_1|Chain... at 100%
4o0a
RCSB PDB
PDBbind
123aa, >4O0A_1|Chain... at 100%
4r4c
RCSB PDB
PDBbind
123aa, >4R4C_1|Chain... at 100%
4r4i
RCSB PDB
PDBbind
123aa, >4R4I_1|Chain... at 100%
4r4o
RCSB PDB
PDBbind
123aa, >4R4O_1|Chain... at 100%
4r4q
RCSB PDB
PDBbind
123aa, >4R4Q_1|Chain... at 100%
4r4t
RCSB PDB
PDBbind
123aa, >4R4T_1|Chain... at 100%
5e7n
RCSB PDB
PDBbind
123aa, >5E7N_1|Chain... at 100%
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
4luo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Replication protein A 70 kDa DNA-binding subunit
Ligand Name
1DZ
EC.Number
E.C.-.-.-.-
Resolution
1.54(Å)
Affinity (Kd/Ki/IC50)
Kd=580uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) J.Med.Chem. Vol. 56: pp. 9242-9250
Ligand Properties
Formula
C
1
7
H
1
4
N
2
O
2
Molecular Weight
278.305
Exact Mass
278.106
No. of atoms
35
No. of bonds
37
Polar Surface Area
55.12
LOGP Value
4.56 (
Computed with XLOGP3
)
3.55 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
Cc1cccc(c1)n1nc(cc1c1ccccc1)C(=O)O
InChI String
InChI=1S/C17H14N2O2/c1-12-6-5-9-14(10-12)19-16(11-15(18-19)17(20)21)13-7-3-2-4-8-13/h2-11H,1H3,(H,20,21)
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):
P27694
Entrez Gene ID
NCBI Entrez Gene ID:
6117
ASD
Information of known allosteric effects of PDB entries
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