Browse entries in the PDBbind-CN Database
HEADER 1NH0_COMPLEX COMPND 1NH0_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 PRO GLN ILE THR LEU TRP GLN ARG PRO LEU VAL THR ILE SEQRES 2 A 99 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 A 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET SER LEU PRO SEQRES 4 A 99 GLY ARG TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 A 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE LEU ILE GLU SEQRES 6 A 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 A 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 A 99 GLN ILE GLY CYS THR LEU ASN PHE SEQRES 1 B 99 PRO GLN ILE THR LEU TRP GLN ARG PRO LEU VAL THR ILE SEQRES 2 B 99 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 B 99 GLY ALA ASP ASP THR VAL LEU GLU GLU MET SER LEU PRO SEQRES 4 B 99 GLY ARG TRP LYS PRO LYS MET ILE GLY GLY ILE GLY GLY SEQRES 5 B 99 PHE ILE LYS VAL ARG GLN TYR ASP GLN ILE LEU ILE GLU SEQRES 6 B 99 ILE CYS GLY HIS LYS ALA ILE GLY THR VAL LEU VAL GLY SEQRES 7 B 99 PRO THR PRO VAL ASN ILE ILE GLY ARG ASN LEU LEU THR SEQRES 8 B 99 GLN ILE GLY CYS THR LEU ASN PHE HET KI A 2 94 ATOM 1 N PRO A 1 8.631 -13.723 87.469 1.00 15.32 N ATOM 2 CA PRO A 1 8.135 -13.551 86.084 1.00 14.54 C ATOM 3 C PRO A 1 9.277 -13.306 85.145 1.00 11.34 C ATOM 4 O PRO A 1 10.417 -13.095 85.558 1.00 12.37 O ATOM 5 CB PRO A 1 7.196 -12.329 86.174 1.00 19.43 C ATOM 6 CG PRO A 1 7.997 -11.439 87.098 1.00 23.27 C ATOM 7 CD PRO A 1 8.328 -12.438 88.193 1.00 23.41 C ATOM 8 HA PRO A 1 7.622 -14.432 85.699 1.00 0.00 H ATOM 9 HD3 PRO A 1 9.195 -12.107 88.765 1.00 0.00 H ATOM 10 HD2 PRO A 1 7.479 -12.567 88.864 1.00 0.00 H ATOM 11 HG3 PRO A 1 7.404 -10.606 87.474 1.00 0.00 H ATOM 12 HG2 PRO A 1 8.895 -11.055 86.614 1.00 0.00 H ATOM 13 HB2 PRO A 1 7.043 -11.865 85.200 1.00 0.00 H ATOM 14 HB3 PRO A 1 6.230 -12.593 86.605 1.00 0.00 H ATOM 15 N GLN A 2 8.953 -13.299 83.851 1.00 10.53 N ATOM 16 CA GLN A 2 9.840 -12.914 82.772 1.00 9.95 C ATOM 17 C GLN A 2 9.112 -11.816 82.011 1.00 9.93 C ATOM 18 O GLN A 2 8.162 -12.071 81.305 1.00 11.97 O ATOM 19 CB GLN A 2 10.169 -14.103 81.852 1.00 10.18 C ATOM 20 CG GLN A 2 11.018 -13.660 80.675 1.00 10.54 C ATOM 21 CD GLN A 2 11.639 -14.809 79.904 1.00 10.53 C ATOM 22 OE1 GLN A 2 11.235 -15.980 80.005 1.00 12.04 O ATOM 23 NE2 GLN A 2 12.581 -14.533 79.059 1.00 11.35 N ATOM 24 HA GLN A 2 10.799 -12.568 83.158 1.00 0.00 H ATOM 25 HB2 GLN A 2 10.714 -14.855 82.422 1.00 0.00 H ATOM 26 HB3 GLN A 2 9.240 -14.534 81.480 1.00 0.00 H ATOM 27 HG2 GLN A 2 10.389 -13.088 79.993 1.00 0.00 H ATOM 28 HG3 GLN A 2 11.820 -13.023 81.049 1.00 0.00 H ATOM 29 HE22 GLN A 2 12.927 -13.557 78.966 1.00 0.00 H ATOM 30 HE21 GLN A 2 12.992 -15.288 78.473 1.00 0.00 H ATOM 31 H GLN A 2 7.988 -13.593 83.597 1.00 0.00 H ATOM 32 N ILE A 3 9.516 -10.570 82.265 1.00 9.55 N ATOM 33 CA ILE A 3 8.787 -9.384 81.841 1.00 9.30 C ATOM 34 C ILE A 3 9.421 -8.804 80.590 1.00 9.11 C ATOM 35 O ILE A 3 10.596 -8.423 80.620 1.00 9.73 O ATOM 36 CB ILE A 3 8.718 -8.374 82.991 1.00 10.11 C ATOM 37 CG1 ILE A 3 8.005 -8.975 84.226 1.00 11.51 C ATOM 38 CG2 ILE A 3 8.001 -7.114 82.530 1.00 12.60 C ATOM 39 CD1 ILE A 3 8.067 -8.061 85.441 1.00 13.76 C ATOM 40 HA ILE A 3 7.761 -9.650 81.585 1.00 0.00 H ATOM 41 HB ILE A 3 9.737 -8.122 83.285 1.00 0.00 H ATOM 42 HG12 ILE A 3 6.959 -9.151 83.974 1.00 0.00 H ATOM 43 HG13 ILE A 3 8.481 -9.923 84.477 1.00 0.00 H ATOM 44 HD11 ILE A 3 9.109 -7.885 85.709 1.00 0.00 H ATOM 45 HD12 ILE A 3 7.585 -7.112 85.205 1.00 0.00 H ATOM 46 HD13 ILE A 3 7.551 -8.534 86.277 1.00 0.00 H ATOM 47 HG21 ILE A 3 8.545 -6.673 81.695 1.00 0.00 H ATOM 48 HG22 ILE A 3 6.990 -7.368 82.213 1.00 0.00 H ATOM 49 HG23 ILE A 3 7.956 -6.401 83.353 1.00 0.00 H ATOM 50 H ILE A 3 10.401 -10.439 82.795 1.00 0.00 H ATOM 51 N THR A 4 8.643 -8.738 79.517 1.00 9.85 N ATOM 52 CA THR A 4 9.079 -8.068 78.302 1.00 9.77 C ATOM 53 C THR A 4 8.887 -6.560 78.431 1.00 9.17 C ATOM 54 O THR A 4 8.369 -6.065 79.427 1.00 11.26 O ATOM 55 CB THR A 4 8.346 -8.615 77.066 1.00 11.21 C ATOM 56 OG1 THR A 4 6.946 -8.466 77.295 1.00 13.08 O ATOM 57 CG2 THR A 4 8.707 -10.041 76.796 1.00 15.33 C ATOM 58 HA THR A 4 10.141 -8.270 78.165 1.00 0.00 H ATOM 59 HB THR A 4 8.644 -8.057 76.179 1.00 0.00 H ATOM 60 HG1 THR A 4 6.734 -7.508 77.427 1.00 0.00 H ATOM 61 HG23 THR A 4 9.781 -10.117 76.626 1.00 0.00 H ATOM 62 HG21 THR A 4 8.429 -10.653 77.654 1.00 0.00 H ATOM 63 HG22 THR A 4 8.173 -10.389 75.912 1.00 0.00 H ATOM 64 H THR A 4 7.700 -9.175 79.546 1.00 0.00 H ATOM 65 N LEU A 5 9.371 -5.853 77.421 1.00 8.58 N ATOM 66 CA LEU A 5 9.534 -4.395 77.520 1.00 8.57 C ATOM 67 C LEU A 5 8.769 -3.634 76.454 1.00 8.22 C ATOM 68 O LEU A 5 9.019 -2.464 76.197 1.00 8.58 O ATOM 69 CB LEU A 5 11.013 -4.046 77.530 1.00 8.90 C ATOM 70 CG LEU A 5 11.755 -4.588 78.764 1.00 9.91 C ATOM 71 CD1 LEU A 5 13.248 -4.480 78.560 1.00 11.01 C ATOM 72 CD2 LEU A 5 11.278 -3.870 80.035 1.00 10.96 C ATOM 73 HA LEU A 5 9.092 -4.074 78.463 1.00 0.00 H ATOM 74 HB2 LEU A 5 11.474 -4.465 76.636 1.00 0.00 H ATOM 75 HB3 LEU A 5 11.113 -2.961 77.514 1.00 0.00 H ATOM 76 HG LEU A 5 11.523 -5.645 78.894 1.00 0.00 H ATOM 77 HD21 LEU A 5 11.475 -2.802 79.943 1.00 0.00 H ATOM 78 HD22 LEU A 5 10.208 -4.034 80.164 1.00 0.00 H ATOM 79 HD23 LEU A 5 11.814 -4.266 80.897 1.00 0.00 H ATOM 80 HD11 LEU A 5 13.537 -5.061 77.684 1.00 0.00 H ATOM 81 HD12 LEU A 5 13.518 -3.435 78.409 1.00 0.00 H ATOM 82 HD13 LEU A 5 13.763 -4.867 79.440 1.00 0.00 H ATOM 83 H LEU A 5 9.641 -6.338 76.542 1.00 0.00 H ATOM 84 N TRP A 6 7.713 -4.270 75.887 1.00 8.69 N ATOM 85 CA TRP A 6 6.857 -3.633 74.920 1.00 9.04 C ATOM 86 C TRP A 6 6.013 -2.526 75.527 1.00 9.08 C ATOM 87 O TRP A 6 5.615 -1.604 74.818 1.00 12.35 O ATOM 88 CB TRP A 6 5.953 -4.677 74.244 1.00 10.01 C ATOM 89 CG TRP A 6 6.776 -5.742 73.548 1.00 9.73 C ATOM 90 CD1 TRP A 6 7.025 -7.011 73.961 1.00 9.68 C ATOM 91 CD2 TRP A 6 7.467 -5.602 72.306 1.00 9.74 C ATOM 92 NE1 TRP A 6 7.813 -7.692 73.068 1.00 10.78 N ATOM 93 CE2 TRP A 6 8.099 -6.825 72.029 1.00 10.25 C ATOM 94 CE3 TRP A 6 7.629 -4.564 71.368 1.00 10.30 C ATOM 95 CZ2 TRP A 6 8.866 -7.050 70.889 1.00 11.18 C ATOM 96 CZ3 TRP A 6 8.382 -4.772 70.238 1.00 11.10 C ATOM 97 CH2 TRP A 6 8.978 -6.019 70.046 1.00 10.79 C ATOM 98 HA TRP A 6 7.505 -3.170 74.175 1.00 0.00 H ATOM 99 HB2 TRP A 6 5.326 -5.149 75.001 1.00 0.00 H ATOM 100 HB3 TRP A 6 5.321 -4.179 73.509 1.00 0.00 H ATOM 101 HE1 TRP A 6 8.135 -8.677 73.156 1.00 0.00 H ATOM 102 HD1 TRP A 6 6.645 -7.437 74.889 1.00 0.00 H ATOM 103 HZ2 TRP A 6 9.346 -8.009 70.696 1.00 0.00 H ATOM 104 HH2 TRP A 6 9.576 -6.162 69.146 1.00 0.00 H ATOM 105 HZ3 TRP A 6 8.512 -3.977 69.504 1.00 0.00 H ATOM 106 HE3 TRP A 6 7.157 -3.596 71.539 1.00 0.00 H ATOM 107 H TRP A 6 7.515 -5.253 76.161 1.00 0.00 H ATOM 108 N GLN A 7 5.759 -2.582 76.823 1.00 8.42 N ATOM 109 CA GLN A 7 5.110 -1.546 77.606 1.00 8.56 C ATOM 110 C GLN A 7 5.987 -1.296 78.822 1.00 7.96 C ATOM 111 O GLN A 7 6.907 -2.059 79.130 1.00 8.43 O ATOM 112 CB GLN A 7 3.693 -1.894 78.002 1.00 9.14 C ATOM 113 CG GLN A 7 3.600 -3.104 78.916 1.00 10.16 C ATOM 114 CD GLN A 7 2.173 -3.539 79.140 1.00 10.68 C ATOM 115 OE1 GLN A 7 1.686 -4.472 78.501 1.00 14.32 O ATOM 116 NE2 GLN A 7 1.477 -2.828 79.991 1.00 11.41 N ATOM 117 HA GLN A 7 5.010 -0.645 77.002 1.00 0.00 H ATOM 118 HB2 GLN A 7 3.258 -1.038 78.517 1.00 0.00 H ATOM 119 HB3 GLN A 7 3.122 -2.100 77.097 1.00 0.00 H ATOM 120 HG2 GLN A 7 4.152 -3.929 78.465 1.00 0.00 H ATOM 121 HG3 GLN A 7 4.046 -2.853 79.878 1.00 0.00 H ATOM 122 HE22 GLN A 7 1.929 -2.048 80.510 1.00 0.00 H ATOM 123 HE21 GLN A 7 0.472 -3.043 80.148 1.00 0.00 H ATOM 124 H GLN A 7 6.050 -3.444 77.326 1.00 0.00 H ATOM 125 N ARG A 8 5.707 -0.216 79.537 1.00 7.87 N ATOM 126 CA ARG A 8 6.454 0.086 80.753 1.00 8.06 C ATOM 127 C ARG A 8 6.316 -1.056 81.765 1.00 7.72 C ATOM 128 O ARG A 8 5.191 -1.489 82.023 1.00 8.43 O ATOM 129 CB ARG A 8 5.968 1.386 81.348 1.00 8.91 C ATOM 130 CG ARG A 8 6.248 2.603 80.507 1.00 9.49 C ATOM 131 CD ARG A 8 5.557 3.875 80.969 1.00 18.49 C ATOM 132 NE ARG A 8 5.804 4.938 80.016 1.00 21.16 N ATOM 133 CZ ARG A 8 4.958 5.912 79.661 1.00 30.41 C ATOM 134 NH1 ARG A 8 3.699 6.056 80.126 1.00 34.59 N ATOM 135 NH2 ARG A 8 5.369 6.803 78.750 1.00 38.56 N ATOM 136 HA ARG A 8 7.509 0.191 80.501 1.00 0.00 H ATOM 137 HB2 ARG A 8 4.890 1.312 81.492 1.00 0.00 H ATOM 138 HB3 ARG A 8 6.454 1.521 82.314 1.00 0.00 H ATOM 139 HG2 ARG A 8 7.324 2.780 80.515 1.00 0.00 H ATOM 140 HG3 ARG A 8 5.923 2.392 79.488 1.00 0.00 H ATOM 141 HD2 ARG A 8 5.946 4.165 81.945 1.00 0.00 H ATOM 142 HD3 ARG A 8 4.484 3.698 81.045 1.00 0.00 H ATOM 143 HE ARG A 8 6.738 4.945 79.559 1.00 0.00 H ATOM 144 HH12 ARG A 8 3.109 6.846 79.794 1.00 0.00 H ATOM 145 HH11 ARG A 8 3.319 5.377 80.816 1.00 0.00 H ATOM 146 HH22 ARG A 8 4.736 7.572 78.452 1.00 0.00 H ATOM 147 HH21 ARG A 8 6.322 6.726 78.340 1.00 0.00 H ATOM 148 H ARG A 8 4.947 0.423 79.228 1.00 0.00 H ATOM 149 N PRO A 9 7.419 -1.482 82.375 1.00 7.70 N ATOM 150 CA PRO A 9 7.344 -2.622 83.333 1.00 7.95 C ATOM 151 C PRO A 9 6.932 -2.163 84.732 1.00 7.63 C ATOM 152 O PRO A 9 7.696 -2.088 85.687 1.00 8.86 O ATOM 153 CB PRO A 9 8.751 -3.167 83.289 1.00 8.29 C ATOM 154 CG PRO A 9 9.634 -1.983 82.998 1.00 8.92 C ATOM 155 CD PRO A 9 8.803 -1.189 81.999 1.00 8.34 C ATOM 156 HA PRO A 9 6.590 -3.366 83.076 1.00 0.00 H ATOM 157 HD3 PRO A 9 9.010 -0.122 82.084 1.00 0.00 H ATOM 158 HD2 PRO A 9 9.005 -1.517 80.979 1.00 0.00 H ATOM 159 HG3 PRO A 9 10.582 -2.296 82.561 1.00 0.00 H ATOM 160 HG2 PRO A 9 9.825 -1.403 83.901 1.00 0.00 H ATOM 161 HB2 PRO A 9 9.017 -3.614 84.247 1.00 0.00 H ATOM 162 HB3 PRO A 9 8.845 -3.915 82.502 1.00 0.00 H ATOM 163 N LEU A 10 5.647 -1.824 84.831 1.00 8.62 N ATOM 164 CA LEU A 10 5.027 -1.443 86.089 1.00 8.20 C ATOM 165 C LEU A 10 4.582 -2.685 86.848 1.00 8.25 C ATOM 166 O LEU A 10 4.031 -3.615 86.246 1.00 8.83 O ATOM 167 CB LEU A 10 3.810 -0.532 85.830 1.00 8.95 C ATOM 168 CG LEU A 10 4.164 0.838 85.267 1.00 10.20 C ATOM 169 CD1 LEU A 10 2.940 1.442 84.607 1.00 11.89 C ATOM 170 CD2 LEU A 10 4.638 1.729 86.415 1.00 13.20 C ATOM 171 HA LEU A 10 5.758 -0.899 86.686 1.00 0.00 H ATOM 172 HB2 LEU A 10 3.152 -1.034 85.121 1.00 0.00 H ATOM 173 HB3 LEU A 10 3.283 -0.388 86.773 1.00 0.00 H ATOM 174 HG LEU A 10 4.956 0.749 84.523 1.00 0.00 H ATOM 175 HD21 LEU A 10 3.841 1.825 87.152 1.00 0.00 H ATOM 176 HD22 LEU A 10 5.515 1.281 86.883 1.00 0.00 H ATOM 177 HD23 LEU A 10 4.895 2.714 86.026 1.00 0.00 H ATOM 178 HD11 LEU A 10 2.606 0.791 83.799 1.00 0.00 H ATOM 179 HD12 LEU A 10 2.145 1.545 85.345 1.00 0.00 H ATOM 180 HD13 LEU A 10 3.193 2.423 84.204 1.00 0.00 H ATOM 181 H LEU A 10 5.063 -1.832 83.971 1.00 0.00 H ATOM 182 N VAL A 11 4.783 -2.697 88.134 1.00 8.71 N ATOM 183 CA VAL A 11 4.402 -3.788 89.019 1.00 9.13 C ATOM 184 C VAL A 11 3.753 -3.269 90.279 1.00 9.27 C ATOM 185 O VAL A 11 3.903 -2.096 90.652 1.00 9.90 O ATOM 186 CB VAL A 11 5.594 -4.697 89.365 1.00 10.92 C ATOM 187 CG1 VAL A 11 6.216 -5.314 88.128 1.00 11.99 C ATOM 188 CG2 VAL A 11 6.597 -3.935 90.216 1.00 12.76 C ATOM 189 HA VAL A 11 3.674 -4.391 88.477 1.00 0.00 H ATOM 190 HB VAL A 11 5.231 -5.538 89.956 1.00 0.00 H ATOM 191 HG11 VAL A 11 5.469 -5.914 87.608 1.00 0.00 H ATOM 192 HG12 VAL A 11 6.571 -4.522 87.468 1.00 0.00 H ATOM 193 HG13 VAL A 11 7.053 -5.947 88.421 1.00 0.00 H ATOM 194 HG21 VAL A 11 6.955 -3.067 89.663 1.00 0.00 H ATOM 195 HG22 VAL A 11 6.115 -3.607 91.137 1.00 0.00 H ATOM 196 HG23 VAL A 11 7.437 -4.587 90.456 1.00 0.00 H ATOM 197 H VAL A 11 5.248 -1.869 88.559 1.00 0.00 H ATOM 198 N THR A 12 3.058 -4.133 90.988 1.00 10.12 N ATOM 199 CA THR A 12 2.474 -3.781 92.274 1.00 10.24 C ATOM 200 C THR A 12 3.564 -3.746 93.323 1.00 12.65 C ATOM 201 O THR A 12 4.447 -4.597 93.367 1.00 16.89 O ATOM 202 CB THR A 12 1.340 -4.803 92.588 1.00 10.81 C ATOM 203 OG1 THR A 12 0.239 -4.511 91.702 1.00 12.57 O ATOM 204 CG2 THR A 12 0.850 -4.771 94.011 1.00 12.27 C ATOM 205 HA THR A 12 2.026 -2.787 92.261 1.00 0.00 H ATOM 206 HB THR A 12 1.750 -5.802 92.440 1.00 0.00 H ATOM 207 HG1 THR A 12 -0.501 -5.145 91.877 1.00 0.00 H ATOM 208 HG23 THR A 12 1.678 -4.991 94.684 1.00 0.00 H ATOM 209 HG21 THR A 12 0.452 -3.781 94.235 1.00 0.00 H ATOM 210 HG22 THR A 12 0.066 -5.517 94.141 1.00 0.00 H ATOM 211 H THR A 12 2.922 -5.096 90.619 1.00 0.00 H ATOM 212 N ILE A 13 3.488 -2.741 94.195 1.00 11.90 N ATOM 213 CA ILE A 13 4.308 -2.696 95.407 1.00 13.14 C ATOM 214 C ILE A 13 3.402 -2.441 96.597 1.00 13.36 C ATOM 215 O ILE A 13 2.289 -1.841 96.490 1.00 15.22 O ATOM 216 CB ILE A 13 5.397 -1.617 95.335 1.00 13.44 C ATOM 217 CG1 ILE A 13 4.843 -0.224 95.240 1.00 15.12 C ATOM 218 CG2 ILE A 13 6.336 -1.951 94.156 1.00 13.81 C ATOM 219 CD1 ILE A 13 5.817 0.920 95.535 1.00 17.80 C ATOM 220 HA ILE A 13 4.818 -3.654 95.510 1.00 0.00 H ATOM 221 HB ILE A 13 5.960 -1.627 96.269 1.00 0.00 H ATOM 222 HG12 ILE A 13 4.466 -0.086 94.227 1.00 0.00 H ATOM 223 HG13 ILE A 13 4.017 -0.147 95.947 1.00 0.00 H ATOM 224 HD11 ILE A 13 6.197 0.819 96.551 1.00 0.00 H ATOM 225 HD12 ILE A 13 6.647 0.880 94.829 1.00 0.00 H ATOM 226 HD13 ILE A 13 5.298 1.873 95.433 1.00 0.00 H ATOM 227 HG21 ILE A 13 6.789 -2.929 94.320 1.00 0.00 H ATOM 228 HG22 ILE A 13 5.762 -1.965 93.229 1.00 0.00 H ATOM 229 HG23 ILE A 13 7.117 -1.194 94.090 1.00 0.00 H ATOM 230 H ILE A 13 2.824 -1.963 94.008 1.00 0.00 H ATOM 231 N LYS A 14 3.845 -2.920 97.742 1.00 14.45 N ATOM 232 CA LYS A 14 3.099 -2.775 98.978 1.00 14.91 C ATOM 233 C LYS A 14 4.085 -2.297 100.062 1.00 12.63 C ATOM 234 O LYS A 14 5.139 -2.924 100.227 1.00 13.45 O ATOM 235 CB LYS A 14 2.471 -4.097 99.465 1.00 18.86 C ATOM 236 CG LYS A 14 1.391 -3.873 100.504 1.00 25.23 C ATOM 237 CD LYS A 14 0.653 -5.134 100.965 1.00 36.84 C ATOM 238 CE LYS A 14 -0.032 -4.866 102.287 1.00 41.51 C ATOM 239 NZ LYS A 14 0.098 -5.848 103.392 1.00 52.44 N ATOM 240 HA LYS A 14 2.287 -2.071 98.796 1.00 0.00 H ATOM 241 HB2 LYS A 14 2.034 -4.613 98.610 1.00 0.00 H ATOM 242 HB3 LYS A 14 3.254 -4.717 99.901 1.00 0.00 H ATOM 243 HG2 LYS A 14 1.854 -3.415 101.378 1.00 0.00 H ATOM 244 HG3 LYS A 14 0.656 -3.187 100.083 1.00 0.00 H ATOM 245 HD2 LYS A 14 -0.092 -5.412 100.220 1.00 0.00 H ATOM 246 HD3 LYS A 14 1.367 -5.949 101.084 1.00 0.00 H ATOM 247 HE2 LYS A 14 -1.097 -4.764 102.077 1.00 0.00 H ATOM 248 HE3 LYS A 14 0.356 -3.918 102.659 1.00 0.00 H ATOM 249 HZ1 LYS A 14 -0.286 -6.765 103.086 1.00 0.00 H ATOM 250 HZ2 LYS A 14 1.102 -5.957 103.641 1.00 0.00 H ATOM 251 HZ3 LYS A 14 -0.431 -5.508 104.220 1.00 0.00 H ATOM 252 H LYS A 14 4.758 -3.418 97.760 1.00 0.00 H ATOM 253 N ILE A 15 3.743 -1.209 100.717 1.00 13.79 N ATOM 254 CA ILE A 15 4.511 -0.713 101.881 1.00 14.33 C ATOM 255 C ILE A 15 3.523 -0.310 102.979 1.00 15.79 C ATOM 256 O ILE A 15 2.603 0.509 102.672 1.00 17.38 O ATOM 257 CB ILE A 15 5.349 0.539 101.613 1.00 17.16 C ATOM 258 CG1 ILE A 15 6.317 0.257 100.479 1.00 18.90 C ATOM 259 CG2 ILE A 15 6.050 0.994 102.900 1.00 27.62 C ATOM 260 CD1 ILE A 15 7.220 1.482 100.205 1.00 21.10 C ATOM 261 HA ILE A 15 5.184 -1.528 102.148 1.00 0.00 H ATOM 262 HB ILE A 15 4.710 1.365 101.302 1.00 0.00 H ATOM 263 HG12 ILE A 15 6.942 -0.595 100.747 1.00 0.00 H ATOM 264 HG13 ILE A 15 5.752 0.022 99.577 1.00 0.00 H ATOM 265 HD11 ILE A 15 6.599 2.335 99.932 1.00 0.00 H ATOM 266 HD12 ILE A 15 7.791 1.719 101.103 1.00 0.00 H ATOM 267 HD13 ILE A 15 7.904 1.252 99.388 1.00 0.00 H ATOM 268 HG21 ILE A 15 5.301 1.221 103.659 1.00 0.00 H ATOM 269 HG22 ILE A 15 6.702 0.198 103.258 1.00 0.00 H ATOM 270 HG23 ILE A 15 6.642 1.885 102.694 1.00 0.00 H ATOM 271 H ILE A 15 2.904 -0.679 100.406 1.00 0.00 H ATOM 272 N GLY A 16 3.671 -0.811 104.181 1.00 19.42 N ATOM 273 CA GLY A 16 2.680 -0.463 105.193 1.00 25.94 C ATOM 274 C GLY A 16 1.276 -0.742 104.831 1.00 22.00 C ATOM 275 O GLY A 16 0.362 0.014 105.199 1.00 27.39 O ATOM 276 HA3 GLY A 16 2.769 0.604 105.397 1.00 0.00 H ATOM 277 HA2 GLY A 16 2.912 -1.025 106.098 1.00 0.00 H ATOM 278 H GLY A 16 4.470 -1.437 104.406 1.00 0.00 H ATOM 279 N GLY A 17 0.931 -1.885 104.223 1.00 25.43 N ATOM 280 CA GLY A 17 -0.547 -1.847 104.003 1.00 33.30 C ATOM 281 C GLY A 17 -1.009 -0.957 102.878 1.00 31.89 C ATOM 282 O GLY A 17 -2.180 -1.075 102.502 1.00 43.35 O ATOM 283 HA3 GLY A 17 -1.016 -1.498 104.923 1.00 0.00 H ATOM 284 HA2 GLY A 17 -0.882 -2.862 103.789 1.00 0.00 H ATOM 285 H GLY A 17 1.574 -2.657 103.954 1.00 0.00 H ATOM 286 N GLN A 18 -0.173 -0.101 102.246 1.00 22.13 N ATOM 287 CA GLN A 18 -0.577 0.736 101.118 1.00 23.50 C ATOM 288 C GLN A 18 -0.136 -0.011 99.840 1.00 20.69 C ATOM 289 O GLN A 18 1.003 -0.419 99.705 1.00 20.37 O ATOM 290 CB GLN A 18 0.144 2.086 101.123 1.00 28.08 C ATOM 291 CG GLN A 18 -0.527 3.124 102.007 1.00 39.61 C ATOM 292 CD GLN A 18 -0.466 4.525 101.426 1.00 48.09 C ATOM 293 OE1 GLN A 18 -1.295 4.963 100.618 1.00 57.03 O ATOM 294 NE2 GLN A 18 0.576 5.241 101.847 1.00 54.06 N ATOM 295 HA GLN A 18 -1.650 0.917 101.172 1.00 0.00 H ATOM 296 HB2 GLN A 18 1.162 1.933 101.481 1.00 0.00 H ATOM 297 HB3 GLN A 18 0.172 2.467 100.102 1.00 0.00 H ATOM 298 HG2 GLN A 18 -1.573 2.846 102.137 1.00 0.00 H ATOM 299 HG3 GLN A 18 -0.030 3.128 102.977 1.00 0.00 H ATOM 300 HE22 GLN A 18 1.248 4.831 102.527 1.00 0.00 H ATOM 301 HE21 GLN A 18 0.718 6.209 101.495 1.00 0.00 H ATOM 302 H GLN A 18 0.809 -0.035 102.581 1.00 0.00 H ATOM 303 N LEU A 19 -1.062 -0.181 98.930 1.00 18.42 N ATOM 304 CA LEU A 19 -0.801 -0.755 97.619 1.00 16.14 C ATOM 305 C LEU A 19 -0.596 0.360 96.624 1.00 14.56 C ATOM 306 O LEU A 19 -1.471 1.197 96.463 1.00 19.08 O ATOM 307 CB LEU A 19 -1.959 -1.615 97.161 1.00 20.96 C ATOM 308 CG LEU A 19 -1.764 -2.673 96.101 1.00 26.97 C ATOM 309 CD1 LEU A 19 -0.735 -3.677 96.660 1.00 48.70 C ATOM 310 CD2 LEU A 19 -3.084 -3.435 95.908 1.00 46.28 C ATOM 311 HA LEU A 19 0.091 -1.378 97.686 1.00 0.00 H ATOM 312 HB2 LEU A 19 -2.336 -2.127 98.046 1.00 0.00 H ATOM 313 HB3 LEU A 19 -2.722 -0.934 96.784 1.00 0.00 H ATOM 314 HG LEU A 19 -1.442 -2.226 95.161 1.00 0.00 H ATOM 315 HD21 LEU A 19 -3.372 -3.904 96.849 1.00 0.00 H ATOM 316 HD22 LEU A 19 -3.862 -2.738 95.595 1.00 0.00 H ATOM 317 HD23 LEU A 19 -2.951 -4.201 95.144 1.00 0.00 H ATOM 318 HD11 LEU A 19 0.201 -3.158 96.868 1.00 0.00 H ATOM 319 HD12 LEU A 19 -1.120 -4.116 97.580 1.00 0.00 H ATOM 320 HD13 LEU A 19 -0.561 -4.464 95.926 1.00 0.00 H ATOM 321 H LEU A 19 -2.035 0.109 99.156 1.00 0.00 H ATOM 322 N LYS A 20 0.519 0.314 95.900 1.00 13.72 N ATOM 323 CA LYS A 20 0.834 1.308 94.861 1.00 13.18 C ATOM 324 C LYS A 20 1.388 0.487 93.666 1.00 11.14 C ATOM 325 O LYS A 20 1.392 -0.743 93.637 1.00 11.89 O ATOM 326 CB LYS A 20 1.898 2.297 95.376 1.00 17.32 C ATOM 327 CG LYS A 20 1.485 3.067 96.599 1.00 20.85 C ATOM 328 CD LYS A 20 0.483 4.183 96.321 1.00 27.10 C ATOM 329 CE LYS A 20 -0.270 4.716 97.553 1.00 37.03 C ATOM 330 NZ LYS A 20 -0.865 6.021 97.193 1.00 46.44 N ATOM 331 HA LYS A 20 -0.038 1.897 94.578 1.00 0.00 H ATOM 332 HB2 LYS A 20 2.800 1.734 95.615 1.00 0.00 H ATOM 333 HB3 LYS A 20 2.116 3.010 94.581 1.00 0.00 H ATOM 334 HG2 LYS A 20 1.035 2.371 97.307 1.00 0.00 H ATOM 335 HG3 LYS A 20 2.377 3.509 97.043 1.00 0.00 H ATOM 336 HD2 LYS A 20 1.023 5.016 95.870 1.00 0.00 H ATOM 337 HD3 LYS A 20 -0.255 3.804 95.613 1.00 0.00 H ATOM 338 HE2 LYS A 20 0.423 4.841 98.385 1.00 0.00 H ATOM 339 HE3 LYS A 20 -1.056 4.017 97.838 1.00 0.00 H ATOM 340 HZ1 LYS A 20 -0.110 6.681 96.919 1.00 0.00 H ATOM 341 HZ2 LYS A 20 -1.522 5.893 96.397 1.00 0.00 H ATOM 342 HZ3 LYS A 20 -1.381 6.403 98.011 1.00 0.00 H ATOM 343 H LYS A 20 1.196 -0.456 96.075 1.00 0.00 H ATOM 344 N GLU A 21 1.794 1.226 92.647 1.00 10.36 N ATOM 345 CA GLU A 21 2.468 0.632 91.513 1.00 10.19 C ATOM 346 C GLU A 21 3.733 1.412 91.234 1.00 9.57 C ATOM 347 O GLU A 21 3.823 2.600 91.512 1.00 11.49 O ATOM 348 CB GLU A 21 1.578 0.410 90.301 1.00 11.99 C ATOM 349 CG GLU A 21 0.998 1.600 89.631 1.00 13.00 C ATOM 350 CD GLU A 21 0.026 1.116 88.549 1.00 12.78 C ATOM 351 OE1 GLU A 21 -1.094 0.681 88.927 1.00 11.91 O ATOM 352 OE2 GLU A 21 0.360 1.258 87.343 1.00 14.86 O ATOM 353 HA GLU A 21 2.749 -0.389 91.772 1.00 0.00 H ATOM 354 HB2 GLU A 21 2.171 -0.123 89.558 1.00 0.00 H ATOM 355 HB3 GLU A 21 0.747 -0.219 90.621 1.00 0.00 H ATOM 356 HG2 GLU A 21 0.465 2.211 90.360 1.00 0.00 H ATOM 357 HG3 GLU A 21 1.793 2.191 89.176 1.00 0.00 H ATOM 358 H GLU A 21 1.626 2.252 92.661 1.00 0.00 H ATOM 359 N ALA A 22 4.717 0.717 90.675 1.00 8.90 N ATOM 360 CA ALA A 22 6.017 1.320 90.443 1.00 9.11 C ATOM 361 C ALA A 22 6.691 0.665 89.258 1.00 8.51 C ATOM 362 O ALA A 22 6.422 -0.470 88.882 1.00 9.43 O ATOM 363 CB ALA A 22 6.911 1.174 91.668 1.00 10.30 C ATOM 364 HA ALA A 22 5.863 2.380 90.241 1.00 0.00 H ATOM 365 HB1 ALA A 22 6.442 1.668 92.519 1.00 0.00 H ATOM 366 HB2 ALA A 22 7.050 0.116 91.891 1.00 0.00 H ATOM 367 HB3 ALA A 22 7.878 1.634 91.467 1.00 0.00 H ATOM 368 H ALA A 22 4.554 -0.273 90.400 1.00 0.00 H ATOM 369 N LEU A 23 7.627 1.421 88.664 1.00 8.63 N ATOM 370 CA LEU A 23 8.356 1.041 87.448 1.00 8.30 C ATOM 371 C LEU A 23 9.625 0.316 87.813 1.00 8.58 C ATOM 372 O LEU A 23 10.480 0.891 88.527 1.00 9.85 O ATOM 373 CB LEU A 23 8.638 2.354 86.718 1.00 9.56 C ATOM 374 CG LEU A 23 9.322 2.256 85.382 1.00 10.37 C ATOM 375 CD1 LEU A 23 8.392 1.580 84.393 1.00 13.15 C ATOM 376 CD2 LEU A 23 9.661 3.676 84.898 1.00 12.18 C ATOM 377 HA LEU A 23 7.789 0.360 86.813 1.00 0.00 H ATOM 378 HB2 LEU A 23 7.683 2.857 86.564 1.00 0.00 H ATOM 379 HB3 LEU A 23 9.267 2.963 87.367 1.00 0.00 H ATOM 380 HG LEU A 23 10.237 1.670 85.467 1.00 0.00 H ATOM 381 HD21 LEU A 23 8.742 4.255 84.803 1.00 0.00 H ATOM 382 HD22 LEU A 23 10.322 4.156 85.619 1.00 0.00 H ATOM 383 HD23 LEU A 23 10.158 3.619 83.929 1.00 0.00 H ATOM 384 HD11 LEU A 23 8.146 0.581 84.752 1.00 0.00 H ATOM 385 HD12 LEU A 23 7.479 2.167 84.295 1.00 0.00 H ATOM 386 HD13 LEU A 23 8.885 1.508 83.424 1.00 0.00 H ATOM 387 H LEU A 23 7.852 2.340 89.095 1.00 0.00 H ATOM 388 N LEU A 24 9.836 -0.883 87.288 1.00 8.08 N ATOM 389 CA LEU A 24 11.112 -1.552 87.424 1.00 8.50 C ATOM 390 C LEU A 24 12.148 -0.873 86.541 1.00 8.59 C ATOM 391 O LEU A 24 11.986 -0.892 85.306 1.00 10.17 O ATOM 392 CB LEU A 24 10.983 -3.022 87.036 1.00 9.78 C ATOM 393 CG LEU A 24 9.984 -3.828 87.864 1.00 9.84 C ATOM 394 CD1 LEU A 24 9.945 -5.272 87.331 1.00 14.08 C ATOM 395 CD2 LEU A 24 10.231 -3.793 89.346 1.00 13.62 C ATOM 396 HA LEU A 24 11.432 -1.491 88.464 1.00 0.00 H ATOM 397 HB2 LEU A 24 10.672 -3.070 85.992 1.00 0.00 H ATOM 398 HB3 LEU A 24 11.963 -3.487 87.144 1.00 0.00 H ATOM 399 HG LEU A 24 9.010 -3.353 87.744 1.00 0.00 H ATOM 400 HD21 LEU A 24 11.220 -4.199 89.558 1.00 0.00 H ATOM 401 HD22 LEU A 24 10.177 -2.763 89.698 1.00 0.00 H ATOM 402 HD23 LEU A 24 9.475 -4.392 89.853 1.00 0.00 H ATOM 403 HD11 LEU A 24 9.636 -5.264 86.286 1.00 0.00 H ATOM 404 HD12 LEU A 24 10.937 -5.716 87.415 1.00 0.00 H ATOM 405 HD13 LEU A 24 9.234 -5.855 87.916 1.00 0.00 H ATOM 406 H LEU A 24 9.068 -1.353 86.767 1.00 0.00 H ATOM 407 N ASP A 25 13.109 -0.218 87.141 1.00 8.15 N ATOM 408 CA ASP A 25 13.970 0.726 86.424 1.00 7.82 C ATOM 409 C ASP A 25 15.458 0.425 86.599 1.00 7.71 C ATOM 410 O ASP A 25 16.082 0.862 87.556 1.00 8.31 O ATOM 411 CB ASP A 25 13.652 2.140 86.966 1.00 9.07 C ATOM 412 CG ASP A 25 14.382 3.197 86.231 1.00 9.84 C ATOM 413 OD1 ASP A 25 15.171 2.932 85.316 1.00 10.67 O ATOM 414 OD2 ASP A 25 14.184 4.388 86.659 1.00 11.11 O ATOM 415 HA ASP A 25 13.768 0.645 85.356 1.00 0.00 H ATOM 416 HB2 ASP A 25 12.581 2.321 86.870 1.00 0.00 H ATOM 417 HB3 ASP A 25 13.934 2.185 88.018 1.00 0.00 H ATOM 418 H ASP A 25 13.266 -0.372 88.157 1.00 0.00 H ATOM 419 N THR A 26 16.007 -0.314 85.644 1.00 7.89 N ATOM 420 CA THR A 26 17.409 -0.653 85.704 1.00 8.00 C ATOM 421 C THR A 26 18.341 0.515 85.501 1.00 7.90 C ATOM 422 O THR A 26 19.533 0.409 85.757 1.00 8.94 O ATOM 423 CB THR A 26 17.750 -1.744 84.693 1.00 7.83 C ATOM 424 OG1 THR A 26 17.449 -1.314 83.378 1.00 8.57 O ATOM 425 CG2 THR A 26 16.979 -3.022 84.963 1.00 8.76 C ATOM 426 HA THR A 26 17.566 -1.010 86.722 1.00 0.00 H ATOM 427 HB THR A 26 18.817 -1.943 84.793 1.00 0.00 H ATOM 428 HG1 THR A 26 17.978 -0.504 83.168 1.00 0.00 H ATOM 429 HG23 THR A 26 17.197 -3.370 85.973 1.00 0.00 H ATOM 430 HG21 THR A 26 15.911 -2.827 84.868 1.00 0.00 H ATOM 431 HG22 THR A 26 17.277 -3.784 84.242 1.00 0.00 H ATOM 432 H THR A 26 15.426 -0.650 84.850 1.00 0.00 H ATOM 433 N GLY A 27 17.793 1.645 85.014 1.00 8.42 N ATOM 434 CA GLY A 27 18.546 2.866 84.899 1.00 8.46 C ATOM 435 C GLY A 27 18.695 3.682 86.135 1.00 8.23 C ATOM 436 O GLY A 27 19.419 4.705 86.109 1.00 9.11 O ATOM 437 HA3 GLY A 27 18.054 3.488 84.151 1.00 0.00 H ATOM 438 HA2 GLY A 27 19.546 2.605 84.553 1.00 0.00 H ATOM 439 H GLY A 27 16.798 1.635 84.713 1.00 0.00 H ATOM 440 N ALA A 28 18.067 3.276 87.231 1.00 8.06 N ATOM 441 CA ALA A 28 18.114 4.015 88.490 1.00 7.95 C ATOM 442 C ALA A 28 18.998 3.305 89.479 1.00 8.06 C ATOM 443 O ALA A 28 18.809 2.102 89.761 1.00 8.52 O ATOM 444 CB ALA A 28 16.694 4.144 89.040 1.00 8.62 C ATOM 445 HA ALA A 28 18.529 5.008 88.317 1.00 0.00 H ATOM 446 HB1 ALA A 28 16.074 4.679 88.320 1.00 0.00 H ATOM 447 HB2 ALA A 28 16.280 3.150 89.210 1.00 0.00 H ATOM 448 HB3 ALA A 28 16.719 4.695 89.980 1.00 0.00 H ATOM 449 H ALA A 28 17.518 2.394 87.192 1.00 0.00 H ATOM 450 N ASP A 29 19.933 4.027 90.085 1.00 8.42 N ATOM 451 CA ASP A 29 20.733 3.459 91.166 1.00 8.54 C ATOM 452 C ASP A 29 19.855 3.162 92.373 1.00 8.92 C ATOM 453 O ASP A 29 20.075 2.194 93.104 1.00 10.19 O ATOM 454 CB ASP A 29 21.859 4.448 91.524 1.00 9.05 C ATOM 455 CG ASP A 29 22.944 4.655 90.510 1.00 8.87 C ATOM 456 OD1 ASP A 29 23.017 3.903 89.513 1.00 9.42 O ATOM 457 OD2 ASP A 29 23.759 5.594 90.734 1.00 11.38 O ATOM 458 HA ASP A 29 21.177 2.517 90.845 1.00 0.00 H ATOM 459 HB2 ASP A 29 21.396 5.417 91.711 1.00 0.00 H ATOM 460 HB3 ASP A 29 22.330 4.090 92.439 1.00 0.00 H ATOM 461 H ASP A 29 20.098 5.009 89.786 1.00 0.00 H ATOM 462 N ASP A 30 18.880 4.038 92.619 1.00 9.42 N ATOM 463 CA ASP A 30 18.091 4.157 93.836 1.00 9.53 C ATOM 464 C ASP A 30 16.606 3.968 93.532 1.00 8.79 C ATOM 465 O ASP A 30 16.174 4.057 92.407 1.00 10.92 O ATOM 466 CB ASP A 30 18.282 5.546 94.455 1.00 10.41 C ATOM 467 CG ASP A 30 19.695 5.971 94.641 1.00 11.20 C ATOM 468 OD1 ASP A 30 20.428 5.219 95.302 1.00 13.24 O ATOM 469 OD2 ASP A 30 20.102 7.088 94.192 1.00 12.10 O ATOM 470 HA ASP A 30 18.427 3.387 94.530 1.00 0.00 H ATOM 471 HB2 ASP A 30 17.794 6.274 93.807 1.00 0.00 H ATOM 472 HB3 ASP A 30 17.798 5.549 95.432 1.00 0.00 H ATOM 473 H ASP A 30 18.659 4.710 91.857 1.00 0.00 H ATOM 474 N THR A 31 15.831 3.735 94.575 1.00 9.79 N ATOM 475 CA THR A 31 14.372 3.631 94.532 1.00 8.51 C ATOM 476 C THR A 31 13.777 4.972 94.976 1.00 8.39 C ATOM 477 O THR A 31 14.186 5.488 96.039 1.00 9.40 O ATOM 478 CB THR A 31 13.914 2.472 95.438 1.00 8.63 C ATOM 479 OG1 THR A 31 14.364 1.273 94.816 1.00 9.58 O ATOM 480 CG2 THR A 31 12.403 2.430 95.605 1.00 9.43 C ATOM 481 HA THR A 31 14.025 3.415 93.522 1.00 0.00 H ATOM 482 HB THR A 31 14.329 2.600 96.438 1.00 0.00 H ATOM 483 HG1 THR A 31 15.351 1.294 94.738 1.00 0.00 H ATOM 484 HG23 THR A 31 12.066 3.350 96.082 1.00 0.00 H ATOM 485 HG21 THR A 31 11.933 2.333 94.626 1.00 0.00 H ATOM 486 HG22 THR A 31 12.131 1.577 96.226 1.00 0.00 H ATOM 487 H THR A 31 16.293 3.616 95.499 1.00 0.00 H ATOM 488 N VAL A 32 12.879 5.527 94.170 1.00 8.26 N ATOM 489 CA VAL A 32 12.321 6.857 94.405 1.00 8.26 C ATOM 490 C VAL A 32 10.813 6.785 94.327 1.00 8.40 C ATOM 491 O VAL A 32 10.271 6.371 93.304 1.00 9.16 O ATOM 492 CB VAL A 32 12.876 7.918 93.410 1.00 9.23 C ATOM 493 CG1 VAL A 32 12.503 9.289 93.901 1.00 10.39 C ATOM 494 CG2 VAL A 32 14.381 7.783 93.207 1.00 10.89 C ATOM 495 HA VAL A 32 12.624 7.180 95.401 1.00 0.00 H ATOM 496 HB VAL A 32 12.426 7.751 92.431 1.00 0.00 H ATOM 497 HG11 VAL A 32 11.418 9.370 93.959 1.00 0.00 H ATOM 498 HG12 VAL A 32 12.934 9.449 94.889 1.00 0.00 H ATOM 499 HG13 VAL A 32 12.888 10.038 93.209 1.00 0.00 H ATOM 500 HG21 VAL A 32 14.889 7.915 94.163 1.00 0.00 H ATOM 501 HG22 VAL A 32 14.605 6.793 92.809 1.00 0.00 H ATOM 502 HG23 VAL A 32 14.721 8.544 92.505 1.00 0.00 H ATOM 503 H VAL A 32 12.560 4.993 93.337 1.00 0.00 H ATOM 504 N LEU A 33 10.147 7.159 95.406 1.00 8.80 N ATOM 505 CA LEU A 33 8.701 7.053 95.539 1.00 9.23 C ATOM 506 C LEU A 33 8.082 8.375 95.894 1.00 10.07 C ATOM 507 O LEU A 33 8.728 9.250 96.484 1.00 10.93 O ATOM 508 CB LEU A 33 8.359 6.026 96.612 1.00 11.81 C ATOM 509 CG LEU A 33 8.905 4.628 96.416 1.00 12.72 C ATOM 510 CD1 LEU A 33 8.384 3.715 97.518 1.00 21.60 C ATOM 511 CD2 LEU A 33 8.517 4.026 95.089 1.00 13.20 C ATOM 512 HA LEU A 33 8.297 6.737 94.577 1.00 0.00 H ATOM 513 HB2 LEU A 33 8.742 6.400 97.561 1.00 0.00 H ATOM 514 HB3 LEU A 33 7.273 5.952 96.664 1.00 0.00 H ATOM 515 HG LEU A 33 9.991 4.713 96.446 1.00 0.00 H ATOM 516 HD21 LEU A 33 7.431 3.971 95.020 1.00 0.00 H ATOM 517 HD22 LEU A 33 8.902 4.649 94.282 1.00 0.00 H ATOM 518 HD23 LEU A 33 8.939 3.024 95.009 1.00 0.00 H ATOM 519 HD11 LEU A 33 8.706 4.097 98.487 1.00 0.00 H ATOM 520 HD12 LEU A 33 7.295 3.687 97.480 1.00 0.00 H ATOM 521 HD13 LEU A 33 8.780 2.710 97.373 1.00 0.00 H ATOM 522 H LEU A 33 10.686 7.551 96.204 1.00 0.00 H ATOM 523 N GLU A 34 6.792 8.457 95.660 1.00 12.49 N ATOM 524 CA GLU A 34 5.879 9.426 96.224 1.00 13.34 C ATOM 525 C GLU A 34 5.838 9.381 97.738 1.00 12.87 C ATOM 526 O GLU A 34 6.318 8.420 98.380 1.00 14.30 O ATOM 527 CB GLU A 34 4.470 9.148 95.654 1.00 14.42 C ATOM 528 CG GLU A 34 3.812 7.859 96.146 1.00 15.98 C ATOM 529 CD GLU A 34 2.477 7.555 95.511 1.00 22.05 C ATOM 530 OE1 GLU A 34 1.448 8.219 95.900 1.00 29.26 O ATOM 531 OE2 GLU A 34 2.336 6.723 94.610 1.00 27.30 O ATOM 532 HA GLU A 34 6.227 10.422 95.952 1.00 0.00 H ATOM 533 HB2 GLU A 34 3.824 9.982 95.928 1.00 0.00 H ATOM 534 HB3 GLU A 34 4.550 9.093 94.568 1.00 0.00 H ATOM 535 HG2 GLU A 34 4.487 7.030 95.934 1.00 0.00 H ATOM 536 HG3 GLU A 34 3.666 7.941 97.223 1.00 0.00 H ATOM 537 H GLU A 34 6.388 7.757 95.005 1.00 0.00 H ATOM 538 N GLU A 35 5.251 10.371 98.381 1.00 13.75 N ATOM 539 CA GLU A 35 5.051 10.364 99.810 1.00 14.51 C ATOM 540 C GLU A 35 4.171 9.200 100.257 1.00 15.71 C ATOM 541 O GLU A 35 3.118 8.927 99.700 1.00 19.75 O ATOM 542 CB GLU A 35 4.551 11.742 100.238 1.00 21.14 C ATOM 543 CG GLU A 35 4.287 11.867 101.723 1.00 22.53 C ATOM 544 CD GLU A 35 5.545 11.645 102.533 1.00 25.07 C ATOM 545 OE1 GLU A 35 5.452 10.960 103.580 1.00 37.74 O ATOM 546 OE2 GLU A 35 6.561 12.321 102.281 1.00 42.49 O ATOM 547 HA GLU A 35 5.995 10.186 100.325 1.00 0.00 H ATOM 548 HB2 GLU A 35 5.302 12.481 99.960 1.00 0.00 H ATOM 549 HB3 GLU A 35 3.623 11.951 99.706 1.00 0.00 H ATOM 550 HG2 GLU A 35 3.903 12.866 101.932 1.00 0.00 H ATOM 551 HG3 GLU A 35 3.543 11.125 102.014 1.00 0.00 H ATOM 552 H GLU A 35 4.918 11.191 97.835 1.00 0.00 H ATOM 553 N MET A 36 4.683 8.430 101.200 1.00 21.29 N ATOM 554 CA MET A 36 4.084 7.255 101.733 1.00 25.32 C ATOM 555 C MET A 36 3.936 7.243 103.239 1.00 24.75 C ATOM 556 O MET A 36 3.646 6.204 103.851 1.00 31.60 O ATOM 557 CB MET A 36 4.953 6.021 101.410 1.00 32.30 C ATOM 558 CG MET A 36 5.498 5.952 99.988 1.00 29.57 C ATOM 559 SD MET A 36 4.559 4.710 99.060 1.00 51.18 S ATOM 560 CE MET A 36 3.032 5.597 98.933 1.00112.34 C ATOM 561 HA MET A 36 3.095 7.234 101.274 1.00 0.00 H ATOM 562 HB2 MET A 36 5.801 6.019 102.095 1.00 0.00 H ATOM 563 HB3 MET A 36 4.348 5.131 101.581 1.00 0.00 H ATOM 564 HG2 MET A 36 6.551 5.672 100.012 1.00 0.00 H ATOM 565 HG3 MET A 36 5.393 6.925 99.508 1.00 0.00 H ATOM 566 HE1 MET A 36 2.651 5.807 99.932 1.00 0.00 H ATOM 567 HE2 MET A 36 3.201 6.534 98.403 1.00 0.00 H ATOM 568 HE3 MET A 36 2.307 4.994 98.386 1.00 0.00 H ATOM 569 H MET A 36 5.607 8.708 101.588 1.00 0.00 H ATOM 570 N SER A 37 4.123 8.408 103.851 1.00 28.43 N ATOM 571 CA SER A 37 4.016 8.503 105.309 1.00 31.19 C ATOM 572 C SER A 37 4.910 7.521 106.031 1.00 30.27 C ATOM 573 O SER A 37 4.599 6.952 107.075 1.00 29.97 O ATOM 574 CB SER A 37 2.566 8.417 105.792 1.00 36.95 C ATOM 575 OG SER A 37 1.728 7.707 104.896 1.00 58.76 O ATOM 576 HA SER A 37 4.381 9.497 105.569 1.00 0.00 H ATOM 577 HB2 SER A 37 2.176 9.429 105.906 1.00 0.00 H ATOM 578 HB3 SER A 37 2.550 7.912 106.758 1.00 0.00 H ATOM 579 HG SER A 37 2.067 6.783 104.791 1.00 0.00 H ATOM 580 H SER A 37 4.346 9.256 103.292 1.00 0.00 H ATOM 581 N LEU A 38 6.164 7.383 105.603 1.00 24.45 N ATOM 582 CA LEU A 38 7.108 6.499 106.265 1.00 21.76 C ATOM 583 C LEU A 38 7.504 7.055 107.618 1.00 22.25 C ATOM 584 O LEU A 38 7.906 8.222 107.723 1.00 30.96 O ATOM 585 CB LEU A 38 8.336 6.247 105.403 1.00 19.58 C ATOM 586 CG LEU A 38 8.084 5.583 104.047 1.00 21.45 C ATOM 587 CD1 LEU A 38 9.340 5.512 103.200 1.00 19.00 C ATOM 588 CD2 LEU A 38 7.393 4.234 104.187 1.00 26.85 C ATOM 589 HA LEU A 38 6.612 5.540 106.418 1.00 0.00 H ATOM 590 HB2 LEU A 38 8.817 7.208 105.219 1.00 0.00 H ATOM 591 HB3 LEU A 38 9.013 5.606 105.967 1.00 0.00 H ATOM 592 HG LEU A 38 7.390 6.226 103.507 1.00 0.00 H ATOM 593 HD21 LEU A 38 8.018 3.567 104.780 1.00 0.00 H ATOM 594 HD22 LEU A 38 6.432 4.369 104.682 1.00 0.00 H ATOM 595 HD23 LEU A 38 7.236 3.803 103.198 1.00 0.00 H ATOM 596 HD11 LEU A 38 9.712 6.520 103.019 1.00 0.00 H ATOM 597 HD12 LEU A 38 10.099 4.932 103.725 1.00 0.00 H ATOM 598 HD13 LEU A 38 9.109 5.033 102.249 1.00 0.00 H ATOM 599 H LEU A 38 6.476 7.924 104.771 1.00 0.00 H ATOM 600 N PRO A 39 7.408 6.277 108.674 1.00 23.53 N ATOM 601 CA PRO A 39 7.699 6.856 109.996 1.00 25.57 C ATOM 602 C PRO A 39 9.188 7.011 110.156 1.00 25.81 C ATOM 603 O PRO A 39 10.082 6.445 109.517 1.00 30.37 O ATOM 604 CB PRO A 39 7.158 5.783 110.949 1.00 30.64 C ATOM 605 CG PRO A 39 7.383 4.506 110.205 1.00 25.95 C ATOM 606 CD PRO A 39 7.073 4.855 108.773 1.00 26.39 C ATOM 607 HA PRO A 39 7.263 7.840 110.165 1.00 0.00 H ATOM 608 HD3 PRO A 39 7.683 4.264 108.089 1.00 0.00 H ATOM 609 HD2 PRO A 39 6.018 4.689 108.553 1.00 0.00 H ATOM 610 HG3 PRO A 39 6.715 3.724 110.566 1.00 0.00 H ATOM 611 HG2 PRO A 39 8.416 4.175 110.308 1.00 0.00 H ATOM 612 HB2 PRO A 39 7.706 5.787 111.891 1.00 0.00 H ATOM 613 HB3 PRO A 39 6.097 5.937 111.147 1.00 0.00 H ATOM 614 N GLY A 40 9.554 7.837 111.140 1.00 31.98 N ATOM 615 CA GLY A 40 10.976 7.678 111.457 1.00 30.81 C ATOM 616 C GLY A 40 11.762 8.732 110.703 1.00 29.60 C ATOM 617 O GLY A 40 11.177 9.448 109.892 1.00 32.54 O ATOM 618 HA3 GLY A 40 11.311 6.685 111.156 1.00 0.00 H ATOM 619 HA2 GLY A 40 11.129 7.802 112.529 1.00 0.00 H ATOM 620 H GLY A 40 8.915 8.504 111.618 1.00 0.00 H ATOM 621 N ARG A 41 13.007 8.813 111.134 1.00 26.11 N ATOM 622 CA ARG A 41 14.018 9.698 110.690 1.00 27.08 C ATOM 623 C ARG A 41 14.319 9.426 109.224 1.00 20.46 C ATOM 624 O ARG A 41 14.213 8.334 108.683 1.00 23.65 O ATOM 625 CB ARG A 41 15.281 9.481 111.537 1.00 36.43 C ATOM 626 HA ARG A 41 13.684 10.730 110.798 1.00 0.00 H ATOM 627 HB2 ARG A 41 15.053 9.679 112.584 1.00 0.00 H ATOM 628 HB3 ARG A 41 15.619 8.451 111.426 1.00 0.00 H ATOM 629 H ARG A 41 13.276 8.149 111.888 1.00 0.00 H ATOM 630 N TRP A 42 14.827 10.475 108.630 1.00 17.20 N ATOM 631 CA TRP A 42 15.338 10.462 107.268 1.00 14.72 C ATOM 632 C TRP A 42 16.631 11.291 107.235 1.00 14.74 C ATOM 633 O TRP A 42 16.939 12.056 108.147 1.00 18.43 O ATOM 634 CB TRP A 42 14.298 11.015 106.280 1.00 15.66 C ATOM 635 CG TRP A 42 14.143 12.511 106.447 1.00 16.54 C ATOM 636 CD1 TRP A 42 14.817 13.577 105.883 1.00 17.30 C ATOM 637 CD2 TRP A 42 13.169 13.117 107.268 1.00 18.88 C ATOM 638 NE1 TRP A 42 14.348 14.742 106.333 1.00 18.86 N ATOM 639 CE2 TRP A 42 13.304 14.509 107.204 1.00 20.99 C ATOM 640 CE3 TRP A 42 12.141 12.590 108.095 1.00 24.01 C ATOM 641 CZ2 TRP A 42 12.506 15.428 107.903 1.00 25.61 C ATOM 642 CZ3 TRP A 42 11.361 13.492 108.802 1.00 26.31 C ATOM 643 CH2 TRP A 42 11.514 14.883 108.724 1.00 25.73 C ATOM 644 HA TRP A 42 15.548 9.437 106.961 1.00 0.00 H ATOM 645 HB2 TRP A 42 14.622 10.800 105.262 1.00 0.00 H ATOM 646 HB3 TRP A 42 13.338 10.533 106.464 1.00 0.00 H ATOM 647 HE1 TRP A 42 14.713 15.679 106.068 1.00 0.00 H ATOM 648 HD1 TRP A 42 15.629 13.479 105.162 1.00 0.00 H ATOM 649 HZ2 TRP A 42 12.651 16.504 107.811 1.00 0.00 H ATOM 650 HH2 TRP A 42 10.862 15.538 109.302 1.00 0.00 H ATOM 651 HZ3 TRP A 42 10.584 13.097 109.456 1.00 0.00 H ATOM 652 HE3 TRP A 42 11.972 11.516 108.171 1.00 0.00 H ATOM 653 H TRP A 42 14.868 11.368 109.161 1.00 0.00 H ATOM 654 N LYS A 43 17.247 11.273 106.080 1.00 15.89 N ATOM 655 CA LYS A 43 18.407 12.093 105.734 1.00 17.66 C ATOM 656 C LYS A 43 18.025 12.814 104.430 1.00 15.04 C ATOM 657 O LYS A 43 17.692 12.151 103.454 1.00 16.03 O ATOM 658 CB LYS A 43 19.659 11.234 105.554 1.00 21.73 C ATOM 659 CG LYS A 43 20.935 11.994 105.163 1.00 24.97 C ATOM 660 CD LYS A 43 22.036 11.004 104.762 1.00 28.63 C ATOM 661 CE LYS A 43 21.717 10.410 103.404 1.00 37.47 C ATOM 662 NZ LYS A 43 22.932 9.957 102.670 1.00 44.81 N ATOM 663 HA LYS A 43 18.649 12.803 106.525 1.00 0.00 H ATOM 664 HB2 LYS A 43 19.850 10.719 106.495 1.00 0.00 H ATOM 665 HB3 LYS A 43 19.453 10.500 104.775 1.00 0.00 H ATOM 666 HG2 LYS A 43 20.719 12.653 104.322 1.00 0.00 H ATOM 667 HG3 LYS A 43 21.275 12.588 106.011 1.00 0.00 H ATOM 668 HD2 LYS A 43 22.993 11.525 104.715 1.00 0.00 H ATOM 669 HD3 LYS A 43 22.094 10.206 105.503 1.00 0.00 H ATOM 670 HE2 LYS A 43 21.209 11.165 102.804 1.00 0.00 H ATOM 671 HE3 LYS A 43 21.056 9.555 103.545 1.00 0.00 H ATOM 672 HZ1 LYS A 43 23.568 10.767 102.521 1.00 0.00 H ATOM 673 HZ2 LYS A 43 23.421 9.229 103.228 1.00 0.00 H ATOM 674 HZ3 LYS A 43 22.652 9.561 101.750 1.00 0.00 H ATOM 675 H LYS A 43 16.883 10.625 105.352 1.00 0.00 H ATOM 676 N PRO A 44 18.128 14.143 104.334 1.00 12.70 N ATOM 677 CA PRO A 44 17.914 14.797 103.034 1.00 12.95 C ATOM 678 C PRO A 44 19.094 14.572 102.098 1.00 12.12 C ATOM 679 O PRO A 44 20.270 14.494 102.528 1.00 15.69 O ATOM 680 CB PRO A 44 17.788 16.264 103.414 1.00 15.47 C ATOM 681 CG PRO A 44 18.627 16.386 104.644 1.00 16.49 C ATOM 682 CD PRO A 44 18.494 15.083 105.395 1.00 15.11 C ATOM 683 HA PRO A 44 17.047 14.412 102.497 1.00 0.00 H ATOM 684 HD3 PRO A 44 19.436 14.800 105.865 1.00 0.00 H ATOM 685 HD2 PRO A 44 17.715 15.143 106.155 1.00 0.00 H ATOM 686 HG3 PRO A 44 18.272 17.212 105.260 1.00 0.00 H ATOM 687 HG2 PRO A 44 19.668 16.558 104.372 1.00 0.00 H ATOM 688 HB2 PRO A 44 18.168 16.906 102.619 1.00 0.00 H ATOM 689 HB3 PRO A 44 16.750 16.524 103.624 1.00 0.00 H ATOM 690 N LYS A 45 18.837 14.469 100.805 1.00 11.79 N ATOM 691 CA LYS A 45 19.901 14.467 99.826 1.00 14.44 C ATOM 692 C LYS A 45 19.335 14.865 98.461 1.00 10.75 C ATOM 693 O LYS A 45 18.125 15.020 98.275 1.00 12.07 O ATOM 694 CB LYS A 45 20.819 13.287 99.770 1.00 16.13 C ATOM 695 CG LYS A 45 20.058 12.127 99.225 1.00 17.72 C ATOM 696 CD LYS A 45 20.994 10.915 99.102 1.00 23.21 C ATOM 697 CE LYS A 45 20.379 9.664 98.568 1.00 22.14 C ATOM 698 NZ LYS A 45 21.369 8.550 98.569 1.00 23.18 N ATOM 699 HA LYS A 45 20.603 15.219 100.186 1.00 0.00 H ATOM 700 HB2 LYS A 45 21.667 13.510 99.122 1.00 0.00 H ATOM 701 HB3 LYS A 45 21.181 13.053 100.771 1.00 0.00 H ATOM 702 HG2 LYS A 45 19.234 11.884 99.896 1.00 0.00 H ATOM 703 HG3 LYS A 45 19.661 12.381 98.242 1.00 0.00 H ATOM 704 HD2 LYS A 45 21.814 11.193 98.440 1.00 0.00 H ATOM 705 HD3 LYS A 45 21.388 10.696 100.094 1.00 0.00 H ATOM 706 HE2 LYS A 45 20.038 9.840 97.548 1.00 0.00 H ATOM 707 HE3 LYS A 45 19.529 9.388 99.192 1.00 0.00 H ATOM 708 HZ1 LYS A 45 22.180 8.808 97.972 1.00 0.00 H ATOM 709 HZ2 LYS A 45 21.694 8.377 99.542 1.00 0.00 H ATOM 710 HZ3 LYS A 45 20.921 7.690 98.194 1.00 0.00 H ATOM 711 H LYS A 45 17.850 14.388 100.486 1.00 0.00 H ATOM 712 N MET A 46 20.245 15.096 97.564 1.00 11.60 N ATOM 713 CA MET A 46 19.913 15.454 96.200 1.00 10.52 C ATOM 714 C MET A 46 20.201 14.245 95.320 1.00 10.38 C ATOM 715 O MET A 46 21.203 13.554 95.466 1.00 12.37 O ATOM 716 CB MET A 46 20.834 16.599 95.739 1.00 12.16 C ATOM 717 CG MET A 46 20.595 17.887 96.448 1.00 13.33 C ATOM 718 SD MET A 46 18.949 18.553 96.385 1.00 13.56 S ATOM 719 CE MET A 46 18.716 18.841 94.647 1.00 16.42 C ATOM 720 HA MET A 46 18.869 15.760 96.134 1.00 0.00 H ATOM 721 HB2 MET A 46 21.868 16.299 95.911 1.00 0.00 H ATOM 722 HB3 MET A 46 20.676 16.759 94.673 1.00 0.00 H ATOM 723 HG2 MET A 46 21.266 18.629 96.016 1.00 0.00 H ATOM 724 HG3 MET A 46 20.849 17.736 97.497 1.00 0.00 H ATOM 725 HE1 MET A 46 19.471 19.543 94.292 1.00 0.00 H ATOM 726 HE2 MET A 46 18.812 17.899 94.108 1.00 0.00 H ATOM 727 HE3 MET A 46 17.723 19.257 94.479 1.00 0.00 H ATOM 728 H MET A 46 21.247 15.021 97.834 1.00 0.00 H ATOM 729 N ILE A 47 19.321 14.042 94.336 1.00 9.50 N ATOM 730 CA ILE A 47 19.497 13.064 93.273 1.00 9.75 C ATOM 731 C ILE A 47 19.227 13.766 91.949 1.00 10.06 C ATOM 732 O ILE A 47 18.726 14.889 91.910 1.00 11.01 O ATOM 733 CB ILE A 47 18.646 11.798 93.445 1.00 9.65 C ATOM 734 CG1 ILE A 47 17.151 12.135 93.431 1.00 10.50 C ATOM 735 CG2 ILE A 47 19.040 11.042 94.699 1.00 11.05 C ATOM 736 CD1 ILE A 47 16.218 10.974 93.368 1.00 11.58 C ATOM 737 HA ILE A 47 20.522 12.693 93.305 1.00 0.00 H ATOM 738 HB ILE A 47 18.840 11.142 92.597 1.00 0.00 H ATOM 739 HG12 ILE A 47 16.927 12.694 94.339 1.00 0.00 H ATOM 740 HG13 ILE A 47 16.959 12.764 92.562 1.00 0.00 H ATOM 741 HD11 ILE A 47 16.408 10.405 92.458 1.00 0.00 H ATOM 742 HD12 ILE A 47 16.376 10.335 94.237 1.00 0.00 H ATOM 743 HD13 ILE A 47 15.190 11.336 93.364 1.00 0.00 H ATOM 744 HG21 ILE A 47 20.089 10.752 94.632 1.00 0.00 H ATOM 745 HG22 ILE A 47 18.893 11.682 95.569 1.00 0.00 H ATOM 746 HG23 ILE A 47 18.420 10.150 94.794 1.00 0.00 H ATOM 747 H ILE A 47 18.456 14.619 94.329 1.00 0.00 H ATOM 748 N GLY A 48 19.508 13.077 90.860 1.00 12.23 N ATOM 749 CA GLY A 48 19.202 13.664 89.592 1.00 15.09 C ATOM 750 C GLY A 48 19.104 12.614 88.503 1.00 10.41 C ATOM 751 O GLY A 48 19.334 11.433 88.668 1.00 11.44 O ATOM 752 HA3 GLY A 48 19.987 14.373 89.331 1.00 0.00 H ATOM 753 HA2 GLY A 48 18.250 14.189 89.665 1.00 0.00 H ATOM 754 H GLY A 48 19.940 12.133 90.922 1.00 0.00 H ATOM 755 N GLY A 49 18.679 13.107 87.391 1.00 11.35 N ATOM 756 CA GLY A 49 18.637 12.297 86.190 1.00 14.59 C ATOM 757 C GLY A 49 18.510 13.177 84.976 1.00 13.79 C ATOM 758 O GLY A 49 18.967 14.306 84.919 1.00 15.06 O ATOM 759 HA3 GLY A 49 17.781 11.624 86.239 1.00 0.00 H ATOM 760 HA2 GLY A 49 19.554 11.712 86.117 1.00 0.00 H ATOM 761 H GLY A 49 18.363 14.097 87.355 1.00 0.00 H ATOM 762 N ILE A 50 17.721 12.664 83.988 1.00 13.03 N ATOM 763 CA ILE A 50 17.466 13.558 82.828 1.00 13.52 C ATOM 764 C ILE A 50 16.636 14.744 83.334 1.00 12.87 C ATOM 765 O ILE A 50 15.609 14.546 84.014 1.00 15.66 O ATOM 766 CB ILE A 50 16.788 12.750 81.702 1.00 14.83 C ATOM 767 CG1 ILE A 50 17.841 11.864 81.030 1.00 18.13 C ATOM 768 CG2 ILE A 50 16.144 13.686 80.669 1.00 15.51 C ATOM 769 CD1 ILE A 50 17.445 11.054 79.879 1.00 23.89 C ATOM 770 HA ILE A 50 18.384 13.957 82.396 1.00 0.00 H ATOM 771 HB ILE A 50 15.998 12.131 82.128 1.00 0.00 H ATOM 772 HG12 ILE A 50 18.648 12.518 80.700 1.00 0.00 H ATOM 773 HG13 ILE A 50 18.218 11.180 81.790 1.00 0.00 H ATOM 774 HD11 ILE A 50 16.653 10.367 80.175 1.00 0.00 H ATOM 775 HD12 ILE A 50 17.083 11.707 79.084 1.00 0.00 H ATOM 776 HD13 ILE A 50 18.305 10.487 79.522 1.00 0.00 H ATOM 777 HG21 ILE A 50 15.392 14.304 81.160 1.00 0.00 H ATOM 778 HG22 ILE A 50 16.911 14.324 80.231 1.00 0.00 H ATOM 779 HG23 ILE A 50 15.673 13.092 79.886 1.00 0.00 H ATOM 780 H ILE A 50 17.322 11.705 84.043 1.00 0.00 H ATOM 781 N GLY A 51 17.040 15.939 82.940 1.00 15.48 N ATOM 782 CA GLY A 51 16.267 17.089 83.197 1.00 15.84 C ATOM 783 C GLY A 51 16.724 17.822 84.432 1.00 14.62 C ATOM 784 O GLY A 51 16.258 18.965 84.599 1.00 19.86 O ATOM 785 HA3 GLY A 51 15.227 16.790 83.331 1.00 0.00 H ATOM 786 HA2 GLY A 51 16.343 17.761 82.342 1.00 0.00 H ATOM 787 H GLY A 51 17.943 16.032 82.432 1.00 0.00 H ATOM 788 N GLY A 52 17.540 17.249 85.292 1.00 13.71 N ATOM 789 CA GLY A 52 18.018 17.994 86.434 1.00 13.31 C ATOM 790 C GLY A 52 17.953 17.175 87.726 1.00 10.88 C ATOM 791 O GLY A 52 17.954 15.971 87.739 1.00 12.36 O ATOM 792 HA3 GLY A 52 17.405 18.887 86.553 1.00 0.00 H ATOM 793 HA2 GLY A 52 19.053 18.286 86.255 1.00 0.00 H ATOM 794 H GLY A 52 17.840 16.263 85.150 1.00 0.00 H ATOM 795 N PHE A 53 17.828 17.920 88.808 1.00 10.72 N ATOM 796 CA PHE A 53 17.988 17.377 90.153 1.00 10.12 C ATOM 797 C PHE A 53 16.734 17.579 90.968 1.00 10.41 C ATOM 798 O PHE A 53 16.002 18.577 90.766 1.00 12.27 O ATOM 799 CB PHE A 53 19.190 18.037 90.886 1.00 11.28 C ATOM 800 CG PHE A 53 20.377 18.033 89.971 1.00 11.91 C ATOM 801 CD1 PHE A 53 20.719 19.147 89.266 1.00 13.96 C ATOM 802 CD2 PHE A 53 21.146 16.893 89.823 1.00 13.24 C ATOM 803 CE1 PHE A 53 21.796 19.133 88.422 1.00 17.50 C ATOM 804 CE2 PHE A 53 22.239 16.840 88.979 1.00 17.48 C ATOM 805 CZ PHE A 53 22.552 17.975 88.283 1.00 18.93 C ATOM 806 HA PHE A 53 18.180 16.309 90.050 1.00 0.00 H ATOM 807 HB2 PHE A 53 18.937 19.063 91.154 1.00 0.00 H ATOM 808 HB3 PHE A 53 19.422 17.474 91.790 1.00 0.00 H ATOM 809 HD2 PHE A 53 20.880 16.003 90.393 1.00 0.00 H ATOM 810 HE2 PHE A 53 22.828 15.929 88.872 1.00 0.00 H ATOM 811 HZ PHE A 53 23.408 17.971 87.608 1.00 0.00 H ATOM 812 HE1 PHE A 53 22.061 20.028 87.860 1.00 0.00 H ATOM 813 HD1 PHE A 53 20.130 20.057 89.375 1.00 0.00 H ATOM 814 H PHE A 53 17.608 18.930 88.698 1.00 0.00 H ATOM 815 N ILE A 54 16.490 16.713 91.939 1.00 10.20 N ATOM 816 CA ILE A 54 15.387 16.850 92.878 1.00 10.32 C ATOM 817 C ILE A 54 15.918 16.550 94.298 1.00 10.19 C ATOM 818 O ILE A 54 16.853 15.782 94.505 1.00 10.39 O ATOM 819 CB ILE A 54 14.162 16.004 92.562 1.00 11.21 C ATOM 820 CG1 ILE A 54 14.451 14.514 92.622 1.00 11.04 C ATOM 821 CG2 ILE A 54 13.562 16.405 91.224 1.00 12.75 C ATOM 822 CD1 ILE A 54 13.194 13.639 92.537 1.00 12.43 C ATOM 823 HA ILE A 54 15.026 17.876 92.798 1.00 0.00 H ATOM 824 HB ILE A 54 13.424 16.202 93.340 1.00 0.00 H ATOM 825 HG12 ILE A 54 15.107 14.256 91.790 1.00 0.00 H ATOM 826 HG13 ILE A 54 14.958 14.299 93.563 1.00 0.00 H ATOM 827 HD11 ILE A 54 12.531 13.876 93.369 1.00 0.00 H ATOM 828 HD12 ILE A 54 12.681 13.833 91.595 1.00 0.00 H ATOM 829 HD13 ILE A 54 13.480 12.588 92.586 1.00 0.00 H ATOM 830 HG21 ILE A 54 13.267 17.454 91.259 1.00 0.00 H ATOM 831 HG22 ILE A 54 14.303 16.261 90.437 1.00 0.00 H ATOM 832 HG23 ILE A 54 12.688 15.787 91.019 1.00 0.00 H ATOM 833 H ILE A 54 17.120 15.891 92.036 1.00 0.00 H ATOM 834 N LYS A 55 15.264 17.210 95.270 1.00 10.09 N ATOM 835 CA LYS A 55 15.469 16.962 96.652 1.00 10.69 C ATOM 836 C LYS A 55 14.655 15.759 97.099 1.00 10.41 C ATOM 837 O LYS A 55 13.445 15.706 96.783 1.00 12.25 O ATOM 838 CB LYS A 55 15.116 18.193 97.462 1.00 13.66 C ATOM 839 CG LYS A 55 15.601 19.491 97.012 1.00 16.74 C ATOM 840 CD LYS A 55 15.165 20.734 97.778 1.00 22.22 C ATOM 841 CE LYS A 55 16.006 21.924 97.313 1.00 25.02 C ATOM 842 NZ LYS A 55 15.136 22.865 96.528 1.00 51.80 N ATOM 843 HA LYS A 55 16.522 16.736 96.820 1.00 0.00 H ATOM 844 HB2 LYS A 55 14.028 18.252 97.498 1.00 0.00 H ATOM 845 HB3 LYS A 55 15.504 18.037 98.469 1.00 0.00 H ATOM 846 HG2 LYS A 55 16.690 19.457 97.045 1.00 0.00 H ATOM 847 HG3 LYS A 55 15.274 19.617 95.980 1.00 0.00 H ATOM 848 HD2 LYS A 55 14.111 20.933 97.584 1.00 0.00 H ATOM 849 HD3 LYS A 55 15.313 20.576 98.846 1.00 0.00 H ATOM 850 HE2 LYS A 55 16.822 21.570 96.683 1.00 0.00 H ATOM 851 HE3 LYS A 55 16.416 22.443 98.180 1.00 0.00 H ATOM 852 HZ1 LYS A 55 14.746 22.367 95.702 1.00 0.00 H ATOM 853 HZ2 LYS A 55 14.358 23.200 97.131 1.00 0.00 H ATOM 854 HZ3 LYS A 55 15.704 23.676 96.210 1.00 0.00 H ATOM 855 H LYS A 55 14.574 17.938 94.995 1.00 0.00 H ATOM 856 N VAL A 56 15.256 14.886 97.886 1.00 10.48 N ATOM 857 CA VAL A 56 14.560 13.722 98.428 1.00 10.06 C ATOM 858 C VAL A 56 14.877 13.575 99.902 1.00 10.17 C ATOM 859 O VAL A 56 15.819 14.156 100.444 1.00 11.91 O ATOM 860 CB VAL A 56 14.942 12.438 97.677 1.00 10.74 C ATOM 861 CG1 VAL A 56 14.504 12.556 96.223 1.00 12.17 C ATOM 862 CG2 VAL A 56 16.398 12.075 97.821 1.00 11.56 C ATOM 863 HA VAL A 56 13.489 13.878 98.299 1.00 0.00 H ATOM 864 HB VAL A 56 14.410 11.605 98.136 1.00 0.00 H ATOM 865 HG11 VAL A 56 13.424 12.697 96.180 1.00 0.00 H ATOM 866 HG12 VAL A 56 15.001 13.410 95.763 1.00 0.00 H ATOM 867 HG13 VAL A 56 14.774 11.645 95.688 1.00 0.00 H ATOM 868 HG21 VAL A 56 17.013 12.883 97.426 1.00 0.00 H ATOM 869 HG22 VAL A 56 16.630 11.922 98.875 1.00 0.00 H ATOM 870 HG23 VAL A 56 16.599 11.159 97.266 1.00 0.00 H ATOM 871 H VAL A 56 16.257 15.032 98.128 1.00 0.00 H ATOM 872 N ARG A 57 14.027 12.766 100.553 1.00 9.65 N ATOM 873 CA ARG A 57 14.253 12.287 101.915 1.00 10.13 C ATOM 874 C ARG A 57 14.603 10.804 101.860 1.00 9.77 C ATOM 875 O ARG A 57 13.786 10.040 101.314 1.00 10.35 O ATOM 876 CB ARG A 57 13.079 12.552 102.831 1.00 11.86 C ATOM 877 CG ARG A 57 12.849 14.031 103.050 1.00 12.89 C ATOM 878 CD ARG A 57 11.677 14.299 104.021 1.00 16.90 C ATOM 879 NE ARG A 57 11.677 15.728 104.407 1.00 20.05 N ATOM 880 CZ ARG A 57 10.794 16.329 105.170 1.00 22.63 C ATOM 881 NH1 ARG A 57 9.695 15.688 105.484 1.00 24.81 N ATOM 882 NH2 ARG A 57 10.963 17.604 105.497 1.00 28.14 N ATOM 883 HA ARG A 57 15.085 12.844 102.345 1.00 0.00 H ATOM 884 HB2 ARG A 57 12.182 12.119 102.388 1.00 0.00 H ATOM 885 HB3 ARG A 57 13.271 12.080 103.794 1.00 0.00 H ATOM 886 HG2 ARG A 57 13.756 14.471 103.464 1.00 0.00 H ATOM 887 HG3 ARG A 57 12.625 14.498 102.091 1.00 0.00 H ATOM 888 HD2 ARG A 57 11.793 13.681 104.911 1.00 0.00 H ATOM 889 HD3 ARG A 57 10.735 14.054 103.531 1.00 0.00 H ATOM 890 HE ARG A 57 12.453 16.313 104.037 1.00 0.00 H ATOM 891 HH12 ARG A 57 8.981 16.144 106.087 1.00 0.00 H ATOM 892 HH11 ARG A 57 9.537 14.723 105.130 1.00 0.00 H ATOM 893 HH22 ARG A 57 10.265 18.083 106.101 1.00 0.00 H ATOM 894 HH21 ARG A 57 11.793 18.124 105.149 1.00 0.00 H ATOM 895 H ARG A 57 13.161 12.464 100.062 1.00 0.00 H ATOM 896 N GLN A 58 15.745 10.411 102.401 1.00 10.33 N ATOM 897 CA GLN A 58 16.216 9.042 102.417 1.00 10.26 C ATOM 898 C GLN A 58 15.774 8.328 103.673 1.00 10.58 C ATOM 899 O GLN A 58 16.112 8.762 104.781 1.00 12.09 O ATOM 900 CB GLN A 58 17.738 8.996 102.312 1.00 11.20 C ATOM 901 CG GLN A 58 18.266 7.578 102.386 1.00 12.15 C ATOM 902 CD GLN A 58 19.771 7.520 102.271 1.00 14.77 C ATOM 903 OE1 GLN A 58 20.410 8.329 101.662 1.00 20.10 O ATOM 904 NE2 GLN A 58 20.368 6.529 102.910 1.00 18.44 N ATOM 905 HA GLN A 58 15.781 8.535 101.556 1.00 0.00 H ATOM 906 HB2 GLN A 58 18.040 9.436 101.361 1.00 0.00 H ATOM 907 HB3 GLN A 58 18.166 9.575 103.130 1.00 0.00 H ATOM 908 HG2 GLN A 58 17.970 7.143 103.341 1.00 0.00 H ATOM 909 HG3 GLN A 58 17.829 6.998 101.573 1.00 0.00 H ATOM 910 HE22 GLN A 58 19.801 5.833 103.435 1.00 0.00 H ATOM 911 HE21 GLN A 58 21.404 6.445 102.887 1.00 0.00 H ATOM 912 H GLN A 58 16.345 11.135 102.845 1.00 0.00 H ATOM 913 N TYR A 59 15.019 7.236 103.480 1.00 10.70 N ATOM 914 CA TYR A 59 14.553 6.370 104.546 1.00 11.32 C ATOM 915 C TYR A 59 15.174 4.991 104.393 1.00 10.93 C ATOM 916 O TYR A 59 15.121 4.407 103.315 1.00 12.30 O ATOM 917 CB TYR A 59 13.057 6.185 104.518 1.00 12.55 C ATOM 918 CG TYR A 59 12.282 7.422 104.803 1.00 12.29 C ATOM 919 CD1 TYR A 59 11.969 8.359 103.812 1.00 13.11 C ATOM 920 CD2 TYR A 59 11.804 7.657 106.083 1.00 16.28 C ATOM 921 CE1 TYR A 59 11.222 9.471 104.146 1.00 15.98 C ATOM 922 CE2 TYR A 59 11.083 8.740 106.441 1.00 19.17 C ATOM 923 CZ TYR A 59 10.795 9.647 105.443 1.00 18.26 C ATOM 924 OH TYR A 59 10.077 10.771 105.721 1.00 26.25 O ATOM 925 HA TYR A 59 14.841 6.845 105.484 1.00 0.00 H ATOM 926 HB3 TYR A 59 12.791 5.436 105.264 1.00 0.00 H ATOM 927 HB2 TYR A 59 12.776 5.826 103.528 1.00 0.00 H ATOM 928 HD2 TYR A 59 12.026 6.917 106.852 1.00 0.00 H ATOM 929 HE2 TYR A 59 10.746 8.890 107.467 1.00 0.00 H ATOM 930 HE1 TYR A 59 10.971 10.209 103.384 1.00 0.00 H ATOM 931 HD1 TYR A 59 12.311 8.213 102.788 1.00 0.00 H ATOM 932 HH TYR A 59 9.188 10.515 106.072 1.00 0.00 H ATOM 933 H TYR A 59 14.751 6.995 102.504 1.00 0.00 H ATOM 934 N ASP A 60 15.800 4.493 105.432 1.00 11.97 N ATOM 935 CA ASP A 60 16.474 3.217 105.405 1.00 12.64 C ATOM 936 C ASP A 60 15.557 2.140 105.973 1.00 12.01 C ATOM 937 O ASP A 60 14.589 2.434 106.693 1.00 13.05 O ATOM 938 CB ASP A 60 17.832 3.273 106.099 1.00 13.92 C ATOM 939 CG ASP A 60 18.788 4.268 105.448 1.00 17.67 C ATOM 940 OD1 ASP A 60 18.803 4.389 104.234 1.00 16.67 O ATOM 941 OD2 ASP A 60 19.512 4.935 106.211 1.00 26.34 O ATOM 942 HA ASP A 60 16.693 2.955 104.370 1.00 0.00 H ATOM 943 HB2 ASP A 60 17.681 3.564 107.138 1.00 0.00 H ATOM 944 HB3 ASP A 60 18.283 2.281 106.063 1.00 0.00 H ATOM 945 H ASP A 60 15.811 5.042 106.315 1.00 0.00 H ATOM 946 N GLN A 61 15.932 0.908 105.691 1.00 12.49 N ATOM 947 CA GLN A 61 15.276 -0.270 106.281 1.00 13.35 C ATOM 948 C GLN A 61 13.752 -0.251 106.120 1.00 12.03 C ATOM 949 O GLN A 61 13.014 -0.631 107.043 1.00 14.35 O ATOM 950 CB GLN A 61 15.599 -0.520 107.724 1.00 21.46 C ATOM 951 CG GLN A 61 16.500 0.269 108.485 1.00 23.85 C ATOM 952 CD GLN A 61 16.645 -0.082 109.926 1.00 16.70 C ATOM 953 OE1 GLN A 61 17.351 0.554 110.674 1.00 21.00 O ATOM 954 NE2 GLN A 61 16.144 -1.110 110.339 1.00 13.41 N ATOM 955 HA GLN A 61 15.699 -1.090 105.702 1.00 0.00 H ATOM 956 HB2 GLN A 61 14.647 -0.473 108.252 1.00 0.00 H ATOM 957 HB3 GLN A 61 15.988 -1.537 107.768 1.00 0.00 H ATOM 958 HG2 GLN A 61 17.484 0.185 108.024 1.00 0.00 H ATOM 959 HG3 GLN A 61 16.161 1.304 108.429 1.00 0.00 H ATOM 960 HE22 GLN A 61 15.533 -1.677 109.717 1.00 0.00 H ATOM 961 HE21 GLN A 61 16.327 -1.423 111.314 1.00 0.00 H ATOM 962 H GLN A 61 16.720 0.763 105.028 1.00 0.00 H ATOM 963 N ILE A 62 13.292 0.039 104.904 1.00 11.55 N ATOM 964 CA ILE A 62 11.878 -0.033 104.566 1.00 11.30 C ATOM 965 C ILE A 62 11.506 -1.422 104.034 1.00 11.35 C ATOM 966 O ILE A 62 12.194 -1.937 103.163 1.00 12.47 O ATOM 967 CB ILE A 62 11.520 1.041 103.529 1.00 12.25 C ATOM 968 CG1 ILE A 62 11.881 2.439 104.044 1.00 13.08 C ATOM 969 CG2 ILE A 62 10.060 0.957 103.115 1.00 13.34 C ATOM 970 CD1 ILE A 62 11.256 2.785 105.367 1.00 15.12 C ATOM 971 HA ILE A 62 11.307 0.148 105.477 1.00 0.00 H ATOM 972 HB ILE A 62 12.115 0.851 102.636 1.00 0.00 H ATOM 973 HG12 ILE A 62 12.964 2.496 104.151 1.00 0.00 H ATOM 974 HG13 ILE A 62 11.551 3.171 103.307 1.00 0.00 H ATOM 975 HD11 ILE A 62 10.171 2.746 105.276 1.00 0.00 H ATOM 976 HD12 ILE A 62 11.585 2.070 106.121 1.00 0.00 H ATOM 977 HD13 ILE A 62 11.561 3.789 105.660 1.00 0.00 H ATOM 978 HG21 ILE A 62 9.863 -0.022 102.678 1.00 0.00 H ATOM 979 HG22 ILE A 62 9.427 1.100 103.991 1.00 0.00 H ATOM 980 HG23 ILE A 62 9.847 1.734 102.380 1.00 0.00 H ATOM 981 H ILE A 62 13.968 0.328 104.169 1.00 0.00 H ATOM 982 N LEU A 63 10.473 -1.993 104.606 1.00 12.26 N ATOM 983 CA LEU A 63 9.917 -3.259 104.183 1.00 13.02 C ATOM 984 C LEU A 63 8.998 -3.004 103.007 1.00 12.66 C ATOM 985 O LEU A 63 8.019 -2.271 103.141 1.00 14.55 O ATOM 986 CB LEU A 63 9.235 -3.936 105.378 1.00 17.01 C ATOM 987 CG LEU A 63 9.935 -3.980 106.738 1.00 27.34 C ATOM 988 CD1 LEU A 63 9.049 -4.624 107.806 1.00 28.43 C ATOM 989 CD2 LEU A 63 11.288 -4.611 106.845 1.00 43.49 C ATOM 990 HA LEU A 63 10.686 -3.953 103.843 1.00 0.00 H ATOM 991 HB2 LEU A 63 8.285 -3.423 105.530 1.00 0.00 H ATOM 992 HB3 LEU A 63 9.046 -4.970 105.088 1.00 0.00 H ATOM 993 HG LEU A 63 10.109 -2.915 106.894 1.00 0.00 H ATOM 994 HD21 LEU A 63 11.226 -5.655 106.538 1.00 0.00 H ATOM 995 HD22 LEU A 63 11.987 -4.081 106.197 1.00 0.00 H ATOM 996 HD23 LEU A 63 11.633 -4.554 107.877 1.00 0.00 H ATOM 997 HD11 LEU A 63 8.130 -4.047 107.910 1.00 0.00 H ATOM 998 HD12 LEU A 63 8.808 -5.645 107.509 1.00 0.00 H ATOM 999 HD13 LEU A 63 9.580 -4.637 108.758 1.00 0.00 H ATOM 1000 H LEU A 63 10.028 -1.507 105.411 1.00 0.00 H ATOM 1001 N ILE A 64 9.264 -3.614 101.879 1.00 12.33 N ATOM 1002 CA ILE A 64 8.486 -3.416 100.658 1.00 12.20 C ATOM 1003 C ILE A 64 8.282 -4.760 100.005 1.00 13.62 C ATOM 1004 O ILE A 64 9.158 -5.618 100.043 1.00 18.89 O ATOM 1005 CB ILE A 64 9.220 -2.410 99.747 1.00 14.42 C ATOM 1006 CG1 ILE A 64 8.424 -2.154 98.450 1.00 13.87 C ATOM 1007 CG2 ILE A 64 10.598 -2.916 99.450 1.00 22.54 C ATOM 1008 CD1 ILE A 64 8.956 -1.003 97.633 1.00 14.86 C ATOM 1009 HA ILE A 64 7.503 -2.994 100.869 1.00 0.00 H ATOM 1010 HB ILE A 64 9.303 -1.455 100.266 1.00 0.00 H ATOM 1011 HG12 ILE A 64 8.460 -3.056 97.839 1.00 0.00 H ATOM 1012 HG13 ILE A 64 7.389 -1.938 98.717 1.00 0.00 H ATOM 1013 HD11 ILE A 64 8.916 -0.089 98.226 1.00 0.00 H ATOM 1014 HD12 ILE A 64 9.988 -1.208 97.348 1.00 0.00 H ATOM 1015 HD13 ILE A 64 8.347 -0.883 96.737 1.00 0.00 H ATOM 1016 HG21 ILE A 64 11.150 -3.032 100.383 1.00 0.00 H ATOM 1017 HG22 ILE A 64 10.529 -3.880 98.945 1.00 0.00 H ATOM 1018 HG23 ILE A 64 11.114 -2.204 98.806 1.00 0.00 H ATOM 1019 H ILE A 64 10.069 -4.272 101.851 1.00 0.00 H ATOM 1020 N GLU A 65 7.084 -4.998 99.460 1.00 12.64 N ATOM 1021 CA GLU A 65 6.827 -6.164 98.653 1.00 13.03 C ATOM 1022 C GLU A 65 6.682 -5.723 97.192 1.00 12.95 C ATOM 1023 O GLU A 65 5.899 -4.815 96.942 1.00 15.29 O ATOM 1024 CB GLU A 65 5.610 -6.930 99.123 1.00 17.07 C ATOM 1025 CG GLU A 65 5.507 -8.334 98.568 1.00 30.37 C ATOM 1026 CD GLU A 65 4.291 -9.127 98.941 1.00 47.37 C ATOM 1027 OE1 GLU A 65 3.265 -8.554 99.378 1.00 71.10 O ATOM 1028 OE2 GLU A 65 4.337 -10.377 98.833 1.00 61.58 O ATOM 1029 HA GLU A 65 7.667 -6.852 98.749 1.00 0.00 H ATOM 1030 HB2 GLU A 65 5.645 -6.994 100.211 1.00 0.00 H ATOM 1031 HB3 GLU A 65 4.720 -6.377 98.821 1.00 0.00 H ATOM 1032 HG2 GLU A 65 5.531 -8.260 97.481 1.00 0.00 H ATOM 1033 HG3 GLU A 65 6.380 -8.889 98.913 1.00 0.00 H ATOM 1034 H GLU A 65 6.313 -4.320 99.624 1.00 0.00 H ATOM 1035 N ILE A 66 7.467 -6.320 96.316 1.00 12.14 N ATOM 1036 CA ILE A 66 7.552 -5.919 94.911 1.00 12.06 C ATOM 1037 C ILE A 66 7.100 -7.127 94.105 1.00 12.69 C ATOM 1038 O ILE A 66 7.805 -8.141 94.099 1.00 13.66 O ATOM 1039 CB ILE A 66 8.977 -5.493 94.523 1.00 12.30 C ATOM 1040 CG1 ILE A 66 9.453 -4.344 95.364 1.00 14.17 C ATOM 1041 CG2 ILE A 66 8.945 -5.139 93.038 1.00 14.91 C ATOM 1042 CD1 ILE A 66 10.963 -4.119 95.363 1.00 15.05 C ATOM 1043 HA ILE A 66 6.924 -5.050 94.716 1.00 0.00 H ATOM 1044 HB ILE A 66 9.686 -6.302 94.703 1.00 0.00 H ATOM 1045 HG12 ILE A 66 8.976 -3.436 94.995 1.00 0.00 H ATOM 1046 HG13 ILE A 66 9.140 -4.526 96.392 1.00 0.00 H ATOM 1047 HD11 ILE A 66 11.462 -5.010 95.743 1.00 0.00 H ATOM 1048 HD12 ILE A 66 11.299 -3.919 94.345 1.00 0.00 H ATOM 1049 HD13 ILE A 66 11.203 -3.267 96.000 1.00 0.00 H ATOM 1050 HG21 ILE A 66 8.632 -6.012 92.464 1.00 0.00 H ATOM 1051 HG22 ILE A 66 8.240 -4.324 92.875 1.00 0.00 H ATOM 1052 HG23 ILE A 66 9.940 -4.830 92.718 1.00 0.00 H ATOM 1053 H ILE A 66 8.054 -7.115 96.640 1.00 0.00 H ATOM 1054 N CYS A 67 5.963 -7.042 93.438 1.00 14.59 N ATOM 1055 CA CYS A 67 5.447 -8.164 92.677 1.00 15.91 C ATOM 1056 C CYS A 67 5.441 -9.435 93.528 1.00 17.37 C ATOM 1057 O CYS A 67 5.771 -10.538 93.168 1.00 25.00 O ATOM 1058 CB CYS A 67 6.108 -8.270 91.287 1.00 12.39 C ATOM 1059 SG CYS A 67 5.684 -9.749 90.330 1.00 11.58 S ATOM 1060 HA CYS A 67 4.398 -7.994 92.435 1.00 0.00 H ATOM 1061 HB2 CYS A 67 7.189 -8.259 91.428 1.00 0.00 H ATOM 1062 HB3 CYS A 67 5.810 -7.397 90.706 1.00 0.00 H ATOM 1063 HG CYS A 67 6.068 -10.874 91.031 1.00 0.00 H ATOM 1064 H CYS A 67 5.426 -6.151 93.459 1.00 0.00 H ATOM 1065 N GLY A 68 5.041 -9.312 94.812 1.00 18.93 N ATOM 1066 CA GLY A 68 5.028 -10.437 95.681 1.00 20.60 C ATOM 1067 C GLY A 68 6.287 -10.845 96.410 1.00 20.41 C ATOM 1068 O GLY A 68 6.291 -11.833 97.164 1.00 28.71 O ATOM 1069 HA3 GLY A 68 4.720 -11.294 95.082 1.00 0.00 H ATOM 1070 HA2 GLY A 68 4.274 -10.238 96.443 1.00 0.00 H ATOM 1071 H GLY A 68 4.739 -8.383 95.169 1.00 0.00 H ATOM 1072 N HIS A 69 7.390 -10.223 96.035 1.00 15.97 N ATOM 1073 CA HIS A 69 8.694 -10.587 96.581 1.00 14.82 C ATOM 1074 C HIS A 69 9.036 -9.574 97.673 1.00 15.31 C ATOM 1075 O HIS A 69 9.114 -8.381 97.432 1.00 14.70 O ATOM 1076 CB HIS A 69 9.780 -10.526 95.484 1.00 15.80 C ATOM 1077 CG HIS A 69 9.698 -11.651 94.501 1.00 17.49 C ATOM 1078 ND1 HIS A 69 10.581 -12.706 94.478 1.00 20.50 N ATOM 1079 CD2 HIS A 69 8.769 -11.969 93.582 1.00 19.05 C ATOM 1080 CE1 HIS A 69 10.280 -13.559 93.532 1.00 22.65 C ATOM 1081 NE2 HIS A 69 9.159 -13.145 92.960 1.00 21.04 N ATOM 1082 HA HIS A 69 8.658 -11.603 96.975 1.00 0.00 H ATOM 1083 HB2 HIS A 69 9.672 -9.586 94.943 1.00 0.00 H ATOM 1084 HB3 HIS A 69 10.758 -10.557 95.964 1.00 0.00 H ATOM 1085 HD2 HIS A 69 7.865 -11.400 93.364 1.00 0.00 H ATOM 1086 HE1 HIS A 69 10.849 -14.449 93.263 1.00 0.00 H ATOM 1087 H HIS A 69 7.328 -9.456 95.335 1.00 0.00 H ATOM 1088 N LYS A 70 9.364 -10.097 98.844 1.00 16.75 N ATOM 1089 CA LYS A 70 9.652 -9.270 99.999 1.00 17.43 C ATOM 1090 C LYS A 70 11.084 -8.786 99.927 1.00 16.73 C ATOM 1091 O LYS A 70 11.978 -9.549 99.589 1.00 22.59 O ATOM 1092 CB LYS A 70 9.307 -9.972 101.308 1.00 22.82 C ATOM 1093 CG LYS A 70 7.803 -10.097 101.516 1.00 30.30 C ATOM 1094 CD LYS A 70 7.339 -9.608 102.885 1.00 43.05 C ATOM 1095 CE LYS A 70 6.306 -8.491 102.816 1.00 48.59 C ATOM 1096 NZ LYS A 70 6.858 -7.162 103.263 1.00 44.57 N ATOM 1097 HA LYS A 70 9.008 -8.391 99.982 1.00 0.00 H ATOM 1098 HB2 LYS A 70 9.744 -10.970 101.297 1.00 0.00 H ATOM 1099 HB3 LYS A 70 9.730 -9.401 102.135 1.00 0.00 H ATOM 1100 HG2 LYS A 70 7.298 -9.510 100.749 1.00 0.00 H ATOM 1101 HG3 LYS A 70 7.525 -11.146 101.411 1.00 0.00 H ATOM 1102 HD2 LYS A 70 6.901 -10.450 103.422 1.00 0.00 H ATOM 1103 HD3 LYS A 70 8.207 -9.241 103.433 1.00 0.00 H ATOM 1104 HE2 LYS A 70 5.465 -8.753 103.457 1.00 0.00 H ATOM 1105 HE3 LYS A 70 5.961 -8.397 101.786 1.00 0.00 H ATOM 1106 HZ1 LYS A 70 7.183 -7.237 104.248 1.00 0.00 H ATOM 1107 HZ2 LYS A 70 7.657 -6.897 102.652 1.00 0.00 H ATOM 1108 HZ3 LYS A 70 6.114 -6.439 103.196 1.00 0.00 H ATOM 1109 H LYS A 70 9.417 -11.131 98.938 1.00 0.00 H ATOM 1110 N ALA A 71 11.309 -7.556 100.301 1.00 14.71 N ATOM 1111 CA ALA A 71 12.632 -6.961 100.343 1.00 15.51 C ATOM 1112 C ALA A 71 12.688 -5.932 101.470 1.00 13.00 C ATOM 1113 O ALA A 71 11.653 -5.483 101.959 1.00 14.32 O ATOM 1114 CB ALA A 71 13.004 -6.226 99.059 1.00 18.12 C ATOM 1115 HA ALA A 71 13.330 -7.785 100.490 1.00 0.00 H ATOM 1116 HB1 ALA A 71 12.984 -6.925 98.223 1.00 0.00 H ATOM 1117 HB2 ALA A 71 12.288 -5.424 98.881 1.00 0.00 H ATOM 1118 HB3 ALA A 71 14.005 -5.806 99.159 1.00 0.00 H ATOM 1119 H ALA A 71 10.497 -6.971 100.584 1.00 0.00 H ATOM 1120 N ILE A 72 13.887 -5.547 101.848 1.00 13.44 N ATOM 1121 CA ILE A 72 14.111 -4.488 102.800 1.00 13.94 C ATOM 1122 C ILE A 72 15.231 -3.624 102.214 1.00 15.84 C ATOM 1123 O ILE A 72 16.288 -4.135 101.846 1.00 26.80 O ATOM 1124 CB ILE A 72 14.377 -5.027 104.209 1.00 15.49 C ATOM 1125 CG1 ILE A 72 13.349 -6.039 104.737 1.00 14.25 C ATOM 1126 CG2 ILE A 72 14.476 -3.891 105.237 1.00 14.90 C ATOM 1127 CD1 ILE A 72 13.694 -6.723 106.057 1.00 20.76 C ATOM 1128 HA ILE A 72 13.225 -3.871 102.946 1.00 0.00 H ATOM 1129 HB ILE A 72 15.324 -5.554 104.095 1.00 0.00 H ATOM 1130 HG12 ILE A 72 12.403 -5.514 104.871 1.00 0.00 H ATOM 1131 HG13 ILE A 72 13.228 -6.815 103.982 1.00 0.00 H ATOM 1132 HD11 ILE A 72 14.629 -7.273 105.947 1.00 0.00 H ATOM 1133 HD12 ILE A 72 13.804 -5.970 106.837 1.00 0.00 H ATOM 1134 HD13 ILE A 72 12.895 -7.413 106.327 1.00 0.00 H ATOM 1135 HG21 ILE A 72 15.293 -3.224 104.962 1.00 0.00 H ATOM 1136 HG22 ILE A 72 13.540 -3.333 105.252 1.00 0.00 H ATOM 1137 HG23 ILE A 72 14.665 -4.312 106.225 1.00 0.00 H ATOM 1138 H ILE A 72 14.713 -6.030 101.441 1.00 0.00 H ATOM 1139 N GLY A 73 15.033 -2.305 102.224 1.00 12.83 N ATOM 1140 CA GLY A 73 16.106 -1.489 101.681 1.00 13.81 C ATOM 1141 C GLY A 73 15.734 -0.007 101.815 1.00 10.63 C ATOM 1142 O GLY A 73 14.730 0.387 102.411 1.00 11.84 O ATOM 1143 HA3 GLY A 73 16.253 -1.734 100.629 1.00 0.00 H ATOM 1144 HA2 GLY A 73 17.027 -1.685 102.231 1.00 0.00 H ATOM 1145 H GLY A 73 14.159 -1.884 102.599 1.00 0.00 H ATOM 1146 N THR A 74 16.564 0.804 101.190 1.00 10.64 N ATOM 1147 CA THR A 74 16.409 2.236 101.263 1.00 10.43 C ATOM 1148 C THR A 74 15.444 2.723 100.196 1.00 9.51 C ATOM 1149 O THR A 74 15.470 2.309 99.035 1.00 10.30 O ATOM 1150 CB THR A 74 17.773 2.876 101.060 1.00 12.01 C ATOM 1151 OG1 THR A 74 18.623 2.509 102.148 1.00 14.64 O ATOM 1152 CG2 THR A 74 17.738 4.396 100.993 1.00 12.93 C ATOM 1153 HA THR A 74 16.004 2.512 102.236 1.00 0.00 H ATOM 1154 HB THR A 74 18.140 2.514 100.100 1.00 0.00 H ATOM 1155 HG1 THR A 74 18.226 2.828 102.997 1.00 0.00 H ATOM 1156 HG23 THR A 74 17.095 4.707 100.170 1.00 0.00 H ATOM 1157 HG21 THR A 74 17.347 4.791 101.931 1.00 0.00 H ATOM 1158 HG22 THR A 74 18.747 4.775 100.831 1.00 0.00 H ATOM 1159 H THR A 74 17.346 0.403 100.633 1.00 0.00 H ATOM 1160 N VAL A 75 14.603 3.679 100.587 1.00 9.64 N ATOM 1161 CA VAL A 75 13.666 4.358 99.695 1.00 10.32 C ATOM 1162 C VAL A 75 13.878 5.847 99.814 1.00 9.64 C ATOM 1163 O VAL A 75 14.037 6.394 100.917 1.00 11.45 O ATOM 1164 CB VAL A 75 12.209 4.041 100.158 1.00 11.12 C ATOM 1165 CG1 VAL A 75 11.132 4.837 99.461 1.00 13.02 C ATOM 1166 CG2 VAL A 75 11.901 2.561 100.001 1.00 15.11 C ATOM 1167 HA VAL A 75 13.824 4.026 98.669 1.00 0.00 H ATOM 1168 HB VAL A 75 12.188 4.337 101.207 1.00 0.00 H ATOM 1169 HG11 VAL A 75 11.294 5.900 99.641 1.00 0.00 H ATOM 1170 HG12 VAL A 75 11.171 4.638 98.390 1.00 0.00 H ATOM 1171 HG13 VAL A 75 10.157 4.546 99.851 1.00 0.00 H ATOM 1172 HG21 VAL A 75 12.006 2.278 98.954 1.00 0.00 H ATOM 1173 HG22 VAL A 75 12.596 1.980 100.607 1.00 0.00 H ATOM 1174 HG23 VAL A 75 10.880 2.367 100.330 1.00 0.00 H ATOM 1175 H VAL A 75 14.614 3.959 101.588 1.00 0.00 H ATOM 1176 N LEU A 76 13.932 6.519 98.675 1.00 8.83 N ATOM 1177 CA LEU A 76 14.006 7.971 98.593 1.00 9.13 C ATOM 1178 C LEU A 76 12.622 8.490 98.277 1.00 9.86 C ATOM 1179 O LEU A 76 11.992 8.009 97.347 1.00 13.07 O ATOM 1180 CB LEU A 76 15.002 8.349 97.502 1.00 9.36 C ATOM 1181 CG LEU A 76 16.384 7.718 97.596 1.00 9.58 C ATOM 1182 CD1 LEU A 76 17.325 8.232 96.531 1.00 10.83 C ATOM 1183 CD2 LEU A 76 17.005 7.900 98.978 1.00 11.68 C ATOM 1184 HA LEU A 76 14.345 8.410 99.532 1.00 0.00 H ATOM 1185 HB2 LEU A 76 14.570 8.060 96.544 1.00 0.00 H ATOM 1186 HB3 LEU A 76 15.129 9.431 97.530 1.00 0.00 H ATOM 1187 HG LEU A 76 16.236 6.652 97.426 1.00 0.00 H ATOM 1188 HD21 LEU A 76 17.101 8.964 99.194 1.00 0.00 H ATOM 1189 HD22 LEU A 76 16.366 7.432 99.727 1.00 0.00 H ATOM 1190 HD23 LEU A 76 17.990 7.433 98.997 1.00 0.00 H ATOM 1191 HD11 LEU A 76 16.916 8.004 95.546 1.00 0.00 H ATOM 1192 HD12 LEU A 76 17.439 9.311 96.638 1.00 0.00 H ATOM 1193 HD13 LEU A 76 18.296 7.750 96.643 1.00 0.00 H ATOM 1194 H LEU A 76 13.921 5.978 97.787 1.00 0.00 H ATOM 1195 N VAL A 77 12.166 9.471 99.043 1.00 9.29 N ATOM 1196 CA VAL A 77 10.846 10.026 98.844 1.00 9.51 C ATOM 1197 C VAL A 77 11.000 11.433 98.294 1.00 9.43 C ATOM 1198 O VAL A 77 11.729 12.262 98.879 1.00 9.83 O ATOM 1199 CB VAL A 77 10.042 10.053 100.158 1.00 10.88 C ATOM 1200 CG1 VAL A 77 8.740 10.769 100.008 1.00 12.56 C ATOM 1201 CG2 VAL A 77 9.802 8.622 100.625 1.00 12.89 C ATOM 1202 HA VAL A 77 10.295 9.400 98.142 1.00 0.00 H ATOM 1203 HB VAL A 77 10.624 10.600 100.900 1.00 0.00 H ATOM 1204 HG11 VAL A 77 8.926 11.799 99.703 1.00 0.00 H ATOM 1205 HG12 VAL A 77 8.136 10.268 99.251 1.00 0.00 H ATOM 1206 HG13 VAL A 77 8.211 10.761 100.961 1.00 0.00 H ATOM 1207 HG21 VAL A 77 9.241 8.081 99.862 1.00 0.00 H ATOM 1208 HG22 VAL A 77 10.760 8.130 100.791 1.00 0.00 H ATOM 1209 HG23 VAL A 77 9.233 8.635 101.555 1.00 0.00 H ATOM 1210 H VAL A 77 12.769 9.849 99.801 1.00 0.00 H ATOM 1211 N GLY A 78 10.375 11.752 97.179 1.00 9.68 N ATOM 1212 CA GLY A 78 10.523 13.074 96.597 1.00 11.30 C ATOM 1213 C GLY A 78 9.558 13.204 95.385 1.00 10.70 C ATOM 1214 O GLY A 78 8.752 12.321 95.094 1.00 11.01 O ATOM 1215 HA3 GLY A 78 11.551 13.214 96.263 1.00 0.00 H ATOM 1216 HA2 GLY A 78 10.279 13.831 97.342 1.00 0.00 H ATOM 1217 H GLY A 78 9.769 11.049 96.710 1.00 0.00 H ATOM 1218 N PRO A 79 9.689 14.328 94.698 1.00 10.04 N ATOM 1219 CA PRO A 79 8.743 14.717 93.668 1.00 10.42 C ATOM 1220 C PRO A 79 9.052 14.074 92.332 1.00 10.96 C ATOM 1221 O PRO A 79 9.216 14.703 91.303 1.00 13.29 O ATOM 1222 CB PRO A 79 8.906 16.228 93.581 1.00 11.65 C ATOM 1223 CG PRO A 79 10.344 16.475 93.996 1.00 11.82 C ATOM 1224 CD PRO A 79 10.570 15.459 95.082 1.00 11.03 C ATOM 1225 HA PRO A 79 7.728 14.401 93.910 1.00 0.00 H ATOM 1226 HD3 PRO A 79 11.614 15.146 95.110 1.00 0.00 H ATOM 1227 HD2 PRO A 79 10.286 15.860 96.055 1.00 0.00 H ATOM 1228 HG3 PRO A 79 10.473 17.488 94.376 1.00 0.00 H ATOM 1229 HG2 PRO A 79 11.025 16.312 93.161 1.00 0.00 H ATOM 1230 HB2 PRO A 79 8.732 16.577 92.563 1.00 0.00 H ATOM 1231 HB3 PRO A 79 8.216 16.731 94.259 1.00 0.00 H ATOM 1232 N THR A 80 9.055 12.761 92.333 1.00 15.04 N ATOM 1233 CA THR A 80 9.202 12.020 91.075 1.00 17.41 C ATOM 1234 C THR A 80 7.820 11.882 90.474 1.00 19.95 C ATOM 1235 O THR A 80 6.848 11.626 91.205 1.00 19.65 O ATOM 1236 CB THR A 80 9.829 10.634 91.310 1.00 14.52 C ATOM 1237 OG1 THR A 80 9.915 9.994 90.049 1.00 15.65 O ATOM 1238 CG2 THR A 80 9.064 9.792 92.348 1.00 12.48 C ATOM 1239 HA THR A 80 9.869 12.556 90.400 1.00 0.00 H ATOM 1240 HB THR A 80 10.822 10.749 91.744 1.00 0.00 H ATOM 1241 HG1 THR A 80 9.008 9.905 89.663 1.00 0.00 H ATOM 1242 HG23 THR A 80 9.028 10.330 93.295 1.00 0.00 H ATOM 1243 HG21 THR A 80 8.049 9.613 91.992 1.00 0.00 H ATOM 1244 HG22 THR A 80 9.575 8.839 92.489 1.00 0.00 H ATOM 1245 H THR A 80 8.953 12.244 93.229 1.00 0.00 H ATOM 1246 N PRO A 81 7.710 11.976 89.143 1.00 24.78 N ATOM 1247 CA PRO A 81 6.414 11.776 88.504 1.00 27.36 C ATOM 1248 C PRO A 81 5.897 10.346 88.455 1.00 22.98 C ATOM 1249 O PRO A 81 4.700 10.087 88.191 1.00 29.56 O ATOM 1250 CB PRO A 81 6.642 12.185 87.048 1.00 34.41 C ATOM 1251 CG PRO A 81 7.971 12.815 86.957 1.00 37.85 C ATOM 1252 CD PRO A 81 8.744 12.420 88.189 1.00 29.47 C ATOM 1253 HA PRO A 81 5.679 12.340 89.079 1.00 0.00 H ATOM 1254 HD3 PRO A 81 9.438 11.609 87.966 1.00 0.00 H ATOM 1255 HD2 PRO A 81 9.297 13.271 88.587 1.00 0.00 H ATOM 1256 HG3 PRO A 81 7.867 13.899 86.914 1.00 0.00 H ATOM 1257 HG2 PRO A 81 8.489 12.465 86.064 1.00 0.00 H ATOM 1258 HB2 PRO A 81 6.604 11.305 86.406 1.00 0.00 H ATOM 1259 HB3 PRO A 81 5.874 12.893 86.737 1.00 0.00 H ATOM 1260 N VAL A 82 6.766 9.383 88.640 1.00 16.45 N ATOM 1261 CA VAL A 82 6.508 7.971 88.561 1.00 14.99 C ATOM 1262 C VAL A 82 7.311 7.312 89.667 1.00 12.35 C ATOM 1263 O VAL A 82 8.466 7.633 89.933 1.00 13.27 O ATOM 1264 CB VAL A 82 6.970 7.413 87.203 1.00 15.16 C ATOM 1265 CG1 VAL A 82 8.442 7.431 86.961 1.00 21.13 C ATOM 1266 CG2 VAL A 82 6.484 5.945 87.267 1.00 30.19 C ATOM 1267 HA VAL A 82 5.441 7.775 88.665 1.00 0.00 H ATOM 1268 HB VAL A 82 6.573 8.024 86.392 1.00 0.00 H ATOM 1269 HG11 VAL A 82 8.804 8.458 87.008 1.00 0.00 H ATOM 1270 HG12 VAL A 82 8.942 6.833 87.723 1.00 0.00 H ATOM 1271 HG13 VAL A 82 8.652 7.015 85.975 1.00 0.00 H ATOM 1272 HG21 VAL A 82 6.953 5.445 88.114 1.00 0.00 H ATOM 1273 HG22 VAL A 82 5.401 5.927 87.388 1.00 0.00 H ATOM 1274 HG23 VAL A 82 6.757 5.433 86.344 1.00 0.00 H ATOM 1275 H VAL A 82 7.740 9.669 88.867 1.00 0.00 H ATOM 1276 N ASN A 83 6.700 6.377 90.376 1.00 12.26 N ATOM 1277 CA ASN A 83 7.437 5.595 91.362 1.00 10.44 C ATOM 1278 C ASN A 83 8.419 4.662 90.647 1.00 9.03 C ATOM 1279 O ASN A 83 8.002 3.989 89.704 1.00 10.18 O ATOM 1280 CB ASN A 83 6.449 4.790 92.151 1.00 11.56 C ATOM 1281 CG ASN A 83 5.525 5.571 93.031 1.00 12.04 C ATOM 1282 OD1 ASN A 83 5.899 6.637 93.551 1.00 12.85 O ATOM 1283 ND2 ASN A 83 4.312 5.110 93.195 1.00 11.74 N ATOM 1284 HA ASN A 83 8.000 6.251 92.025 1.00 0.00 H ATOM 1285 HB2 ASN A 83 5.840 4.224 91.446 1.00 0.00 H ATOM 1286 HB3 ASN A 83 7.008 4.100 92.782 1.00 0.00 H ATOM 1287 HD22 ASN A 83 4.031 4.215 92.746 1.00 0.00 H ATOM 1288 HD21 ASN A 83 3.629 5.639 93.774 1.00 0.00 H ATOM 1289 H ASN A 83 5.686 6.198 90.229 1.00 0.00 H ATOM 1290 N ILE A 84 9.654 4.640 91.090 1.00 8.60 N ATOM 1291 CA ILE A 84 10.710 3.905 90.447 1.00 8.90 C ATOM 1292 C ILE A 84 11.340 2.933 91.458 1.00 8.20 C ATOM 1293 O ILE A 84 11.770 3.329 92.535 1.00 9.39 O ATOM 1294 CB ILE A 84 11.686 4.651 89.527 1.00 8.85 C ATOM 1295 CG1 ILE A 84 12.499 5.659 90.338 1.00 9.35 C ATOM 1296 CG2 ILE A 84 11.027 5.391 88.391 1.00 10.41 C ATOM 1297 CD1 ILE A 84 13.597 6.376 89.632 1.00 11.28 C ATOM 1298 HA ILE A 84 10.223 3.334 89.657 1.00 0.00 H ATOM 1299 HB ILE A 84 12.316 3.877 89.088 1.00 0.00 H ATOM 1300 HG12 ILE A 84 11.806 6.411 90.716 1.00 0.00 H ATOM 1301 HG13 ILE A 84 12.944 5.123 91.176 1.00 0.00 H ATOM 1302 HD11 ILE A 84 14.321 5.652 89.258 1.00 0.00 H ATOM 1303 HD12 ILE A 84 13.182 6.941 88.797 1.00 0.00 H ATOM 1304 HD13 ILE A 84 14.089 7.058 90.326 1.00 0.00 H ATOM 1305 HG21 ILE A 84 10.479 4.684 87.768 1.00 0.00 H ATOM 1306 HG22 ILE A 84 10.338 6.133 88.794 1.00 0.00 H ATOM 1307 HG23 ILE A 84 11.790 5.889 87.792 1.00 0.00 H ATOM 1308 H ILE A 84 9.881 5.181 91.949 1.00 0.00 H ATOM 1309 N ILE A 85 11.437 1.682 91.058 1.00 7.94 N ATOM 1310 CA ILE A 85 12.192 0.663 91.780 1.00 7.83 C ATOM 1311 C ILE A 85 13.553 0.557 91.103 1.00 7.70 C ATOM 1312 O ILE A 85 13.654 0.115 89.960 1.00 9.33 O ATOM 1313 CB ILE A 85 11.488 -0.702 91.790 1.00 8.60 C ATOM 1314 CG1 ILE A 85 10.065 -0.632 92.327 1.00 9.81 C ATOM 1315 CG2 ILE A 85 12.331 -1.686 92.592 1.00 10.33 C ATOM 1316 CD1 ILE A 85 9.901 0.058 93.658 1.00 12.34 C ATOM 1317 HA ILE A 85 12.285 0.955 92.826 1.00 0.00 H ATOM 1318 HB ILE A 85 11.397 -1.044 90.759 1.00 0.00 H ATOM 1319 HG12 ILE A 85 9.457 -0.099 91.596 1.00 0.00 H ATOM 1320 HG13 ILE A 85 9.695 -1.652 92.431 1.00 0.00 H ATOM 1321 HD11 ILE A 85 10.487 -0.467 94.412 1.00 0.00 H ATOM 1322 HD12 ILE A 85 10.249 1.088 93.577 1.00 0.00 H ATOM 1323 HD13 ILE A 85 8.849 0.050 93.943 1.00 0.00 H ATOM 1324 HG21 ILE A 85 13.314 -1.781 92.130 1.00 0.00 H ATOM 1325 HG22 ILE A 85 12.441 -1.320 93.613 1.00 0.00 H ATOM 1326 HG23 ILE A 85 11.839 -2.658 92.604 1.00 0.00 H ATOM 1327 H ILE A 85 10.950 1.406 90.182 1.00 0.00 H ATOM 1328 N GLY A 86 14.579 1.038 91.801 1.00 8.30 N ATOM 1329 CA GLY A 86 15.935 1.026 91.265 1.00 8.26 C ATOM 1330 C GLY A 86 16.740 -0.193 91.679 1.00 7.90 C ATOM 1331 O GLY A 86 16.244 -1.112 92.339 1.00 8.46 O ATOM 1332 HA3 GLY A 86 16.453 1.918 91.617 1.00 0.00 H ATOM 1333 HA2 GLY A 86 15.876 1.048 90.177 1.00 0.00 H ATOM 1334 H GLY A 86 14.410 1.431 92.749 1.00 0.00 H ATOM 1335 N ARG A 87 18.018 -0.199 91.298 1.00 8.14 N ATOM 1336 CA ARG A 87 18.817 -1.385 91.445 1.00 8.12 C ATOM 1337 C ARG A 87 18.997 -1.799 92.866 1.00 8.53 C ATOM 1338 O ARG A 87 19.163 -2.997 93.127 1.00 9.51 O ATOM 1339 CB ARG A 87 20.165 -1.204 90.750 1.00 8.34 C ATOM 1340 CG ARG A 87 20.053 -1.068 89.236 1.00 8.22 C ATOM 1341 CD ARG A 87 21.403 -1.103 88.525 1.00 8.88 C ATOM 1342 NE ARG A 87 22.226 0.038 88.913 1.00 9.35 N ATOM 1343 CZ ARG A 87 23.158 0.083 89.861 1.00 9.31 C ATOM 1344 NH1 ARG A 87 23.534 -0.993 90.530 1.00 9.33 N ATOM 1345 NH2 ARG A 87 23.763 1.248 90.154 1.00 10.06 N ATOM 1346 HA ARG A 87 18.272 -2.196 90.963 1.00 0.00 H ATOM 1347 HB2 ARG A 87 20.639 -0.305 91.144 1.00 0.00 H ATOM 1348 HB3 ARG A 87 20.788 -2.070 90.974 1.00 0.00 H ATOM 1349 HG2 ARG A 87 19.442 -1.888 88.859 1.00 0.00 H ATOM 1350 HG3 ARG A 87 19.566 -0.119 89.009 1.00 0.00 H ATOM 1351 HD2 ARG A 87 21.240 -1.076 87.448 1.00 0.00 H ATOM 1352 HD3 ARG A 87 21.922 -2.024 88.790 1.00 0.00 H ATOM 1353 HE ARG A 87 22.065 0.920 88.386 1.00 0.00 H ATOM 1354 HH12 ARG A 87 24.266 -0.919 91.265 1.00 0.00 H ATOM 1355 HH11 ARG A 87 23.098 -1.914 90.322 1.00 0.00 H ATOM 1356 HH22 ARG A 87 24.492 1.284 90.895 1.00 0.00 H ATOM 1357 HH21 ARG A 87 23.502 2.113 89.639 1.00 0.00 H ATOM 1358 H ARG A 87 18.440 0.660 90.892 1.00 0.00 H ATOM 1359 N ASN A 88 18.980 -0.872 93.812 1.00 8.88 N ATOM 1360 CA ASN A 88 19.172 -1.222 95.205 1.00 9.33 C ATOM 1361 C ASN A 88 18.136 -2.230 95.675 1.00 9.30 C ATOM 1362 O ASN A 88 18.412 -3.018 96.558 1.00 11.57 O ATOM 1363 CB ASN A 88 19.181 0.014 96.116 1.00 9.58 C ATOM 1364 CG ASN A 88 17.781 0.607 96.301 1.00 9.62 C ATOM 1365 OD1 ASN A 88 17.133 0.952 95.300 1.00 10.40 O ATOM 1366 ND2 ASN A 88 17.380 0.691 97.530 1.00 10.42 N ATOM 1367 HA ASN A 88 20.155 -1.688 95.276 1.00 0.00 H ATOM 1368 HB2 ASN A 88 19.573 -0.272 97.092 1.00 0.00 H ATOM 1369 HB3 ASN A 88 19.828 0.772 95.674 1.00 0.00 H ATOM 1370 HD22 ASN A 88 18.000 0.374 98.302 1.00 0.00 H ATOM 1371 HD21 ASN A 88 16.438 1.076 97.744 1.00 0.00 H ATOM 1372 H ASN A 88 18.826 0.123 93.551 1.00 0.00 H ATOM 1373 N LEU A 89 16.918 -2.164 95.128 1.00 9.07 N ATOM 1374 CA LEU A 89 15.869 -3.138 95.447 1.00 9.43 C ATOM 1375 C LEU A 89 15.724 -4.211 94.389 1.00 9.14 C ATOM 1376 O LEU A 89 15.369 -5.349 94.754 1.00 10.18 O ATOM 1377 CB LEU A 89 14.523 -2.481 95.765 1.00 9.65 C ATOM 1378 CG LEU A 89 14.513 -1.633 97.028 1.00 11.54 C ATOM 1379 CD1 LEU A 89 13.163 -0.951 97.211 1.00 15.32 C ATOM 1380 CD2 LEU A 89 14.732 -2.520 98.248 1.00 24.19 C ATOM 1381 HA LEU A 89 16.203 -3.633 96.359 1.00 0.00 H ATOM 1382 HB2 LEU A 89 14.249 -1.843 94.925 1.00 0.00 H ATOM 1383 HB3 LEU A 89 13.779 -3.269 95.879 1.00 0.00 H ATOM 1384 HG LEU A 89 15.304 -0.889 96.931 1.00 0.00 H ATOM 1385 HD21 LEU A 89 13.935 -3.261 98.305 1.00 0.00 H ATOM 1386 HD22 LEU A 89 15.694 -3.025 98.160 1.00 0.00 H ATOM 1387 HD23 LEU A 89 14.724 -1.906 99.148 1.00 0.00 H ATOM 1388 HD11 LEU A 89 12.963 -0.308 96.354 1.00 0.00 H ATOM 1389 HD12 LEU A 89 12.383 -1.708 97.289 1.00 0.00 H ATOM 1390 HD13 LEU A 89 13.181 -0.351 98.121 1.00 0.00 H ATOM 1391 H LEU A 89 16.708 -1.399 94.456 1.00 0.00 H ATOM 1392 N LEU A 90 16.019 -3.968 93.122 1.00 8.85 N ATOM 1393 CA LEU A 90 15.951 -5.026 92.122 1.00 9.06 C ATOM 1394 C LEU A 90 16.875 -6.177 92.501 1.00 8.68 C ATOM 1395 O LEU A 90 16.546 -7.339 92.300 1.00 10.11 O ATOM 1396 CB LEU A 90 16.270 -4.485 90.726 1.00 8.54 C ATOM 1397 CG LEU A 90 15.295 -3.404 90.185 1.00 8.99 C ATOM 1398 CD1 LEU A 90 15.812 -2.838 88.890 1.00 10.92 C ATOM 1399 CD2 LEU A 90 13.905 -4.009 89.967 1.00 10.71 C ATOM 1400 HA LEU A 90 14.931 -5.410 92.095 1.00 0.00 H ATOM 1401 HB2 LEU A 90 17.269 -4.051 90.755 1.00 0.00 H ATOM 1402 HB3 LEU A 90 16.260 -5.324 90.031 1.00 0.00 H ATOM 1403 HG LEU A 90 15.223 -2.602 90.919 1.00 0.00 H ATOM 1404 HD21 LEU A 90 13.973 -4.823 89.245 1.00 0.00 H ATOM 1405 HD22 LEU A 90 13.525 -4.393 90.914 1.00 0.00 H ATOM 1406 HD23 LEU A 90 13.231 -3.241 89.588 1.00 0.00 H ATOM 1407 HD11 LEU A 90 16.790 -2.386 89.057 1.00 0.00 H ATOM 1408 HD12 LEU A 90 15.901 -3.638 88.155 1.00 0.00 H ATOM 1409 HD13 LEU A 90 15.118 -2.082 88.523 1.00 0.00 H ATOM 1410 H LEU A 90 16.303 -3.009 92.836 1.00 0.00 H ATOM 1411 N THR A 91 18.048 -5.871 93.012 1.00 8.96 N ATOM 1412 CA THR A 91 18.960 -6.926 93.456 1.00 9.90 C ATOM 1413 C THR A 91 18.363 -7.773 94.556 1.00 10.90 C ATOM 1414 O THR A 91 18.652 -8.964 94.647 1.00 12.27 O ATOM 1415 CB THR A 91 20.313 -6.348 93.908 1.00 10.96 C ATOM 1416 OG1 THR A 91 20.074 -5.445 94.962 1.00 13.19 O ATOM 1417 CG2 THR A 91 21.063 -5.724 92.759 1.00 11.22 C ATOM 1418 HA THR A 91 19.127 -7.570 92.593 1.00 0.00 H ATOM 1419 HB THR A 91 20.961 -7.147 94.269 1.00 0.00 H ATOM 1420 HG1 THR A 91 20.934 -5.061 95.268 1.00 0.00 H ATOM 1421 HG23 THR A 91 21.216 -6.470 91.979 1.00 0.00 H ATOM 1422 HG21 THR A 91 20.485 -4.891 92.359 1.00 0.00 H ATOM 1423 HG22 THR A 91 22.029 -5.361 93.111 1.00 0.00 H ATOM 1424 H THR A 91 18.329 -4.874 93.101 1.00 0.00 H ATOM 1425 N GLN A 92 17.581 -7.177 95.437 1.00 11.07 N ATOM 1426 CA GLN A 92 17.062 -7.872 96.601 1.00 11.65 C ATOM 1427 C GLN A 92 15.966 -8.862 96.224 1.00 12.17 C ATOM 1428 O GLN A 92 15.703 -9.772 97.010 1.00 16.64 O ATOM 1429 CB GLN A 92 16.458 -6.862 97.589 1.00 12.15 C ATOM 1430 CG GLN A 92 17.482 -5.818 98.035 1.00 14.84 C ATOM 1431 CD GLN A 92 18.679 -6.499 98.655 1.00 15.07 C ATOM 1432 OE1 GLN A 92 18.468 -7.076 99.751 1.00 17.37 O ATOM 1433 NE2 GLN A 92 19.844 -6.483 98.002 1.00 18.59 N ATOM 1434 HA GLN A 92 17.897 -8.410 97.050 1.00 0.00 H ATOM 1435 HB2 GLN A 92 15.623 -6.353 97.107 1.00 0.00 H ATOM 1436 HB3 GLN A 92 16.097 -7.399 98.466 1.00 0.00 H ATOM 1437 HG2 GLN A 92 17.805 -5.237 97.171 1.00 0.00 H ATOM 1438 HG3 GLN A 92 17.025 -5.154 98.768 1.00 0.00 H ATOM 1439 HE22 GLN A 92 19.926 -5.977 97.097 1.00 0.00 H ATOM 1440 HE21 GLN A 92 20.669 -6.976 98.399 1.00 0.00 H ATOM 1441 H GLN A 92 17.329 -6.178 95.293 1.00 0.00 H ATOM 1442 N ILE A 93 15.324 -8.700 95.083 1.00 11.57 N ATOM 1443 CA ILE A 93 14.316 -9.648 94.615 1.00 11.69 C ATOM 1444 C ILE A 93 14.886 -10.609 93.579 1.00 12.08 C ATOM 1445 O ILE A 93 14.139 -11.378 92.997 1.00 13.86 O ATOM 1446 CB ILE A 93 13.021 -8.955 94.146 1.00 12.38 C ATOM 1447 CG1 ILE A 93 13.246 -8.128 92.875 1.00 12.07 C ATOM 1448 CG2 ILE A 93 12.464 -8.108 95.275 1.00 14.37 C ATOM 1449 CD1 ILE A 93 11.962 -7.603 92.265 1.00 14.20 C ATOM 1450 HA ILE A 93 14.026 -10.253 95.474 1.00 0.00 H ATOM 1451 HB ILE A 93 12.289 -9.720 93.887 1.00 0.00 H ATOM 1452 HG12 ILE A 93 13.884 -7.279 93.123 1.00 0.00 H ATOM 1453 HG13 ILE A 93 13.748 -8.755 92.138 1.00 0.00 H ATOM 1454 HD11 ILE A 93 11.317 -8.441 92.002 1.00 0.00 H ATOM 1455 HD12 ILE A 93 11.453 -6.964 92.987 1.00 0.00 H ATOM 1456 HD13 ILE A 93 12.196 -7.027 91.369 1.00 0.00 H ATOM 1457 HG21 ILE A 93 12.246 -8.745 96.132 1.00 0.00 H ATOM 1458 HG22 ILE A 93 13.198 -7.354 95.558 1.00 0.00 H ATOM 1459 HG23 ILE A 93 11.549 -7.618 94.943 1.00 0.00 H ATOM 1460 H ILE A 93 15.543 -7.869 94.497 1.00 0.00 H ATOM 1461 N GLY A 94 16.177 -10.546 93.311 1.00 11.53 N ATOM 1462 CA GLY A 94 16.806 -11.429 92.365 1.00 12.87 C ATOM 1463 C GLY A 94 16.546 -11.096 90.922 1.00 11.20 C ATOM 1464 O GLY A 94 16.569 -11.984 90.046 1.00 13.75 O ATOM 1465 HA3 GLY A 94 16.443 -12.440 92.551 1.00 0.00 H ATOM 1466 HA2 GLY A 94 17.882 -11.395 92.533 1.00 0.00 H ATOM 1467 H GLY A 94 16.758 -9.835 93.799 1.00 0.00 H ATOM 1468 N CYS A 95 16.285 -9.843 90.604 1.00 10.23 N ATOM 1469 CA CYS A 95 15.987 -9.423 89.253 1.00 9.97 C ATOM 1470 C CYS A 95 17.260 -9.269 88.447 1.00 10.69 C ATOM 1471 O CYS A 95 18.182 -8.616 88.862 1.00 12.52 O ATOM 1472 CB CYS A 95 15.214 -8.116 89.298 1.00 11.77 C ATOM 1473 SG CYS A 95 14.539 -7.549 87.717 1.00 10.80 S ATOM 1474 HA CYS A 95 15.378 -10.183 88.764 1.00 0.00 H ATOM 1475 HB2 CYS A 95 15.884 -7.343 89.673 1.00 0.00 H ATOM 1476 HB3 CYS A 95 14.383 -8.242 89.992 1.00 0.00 H ATOM 1477 HG CYS A 95 13.867 -6.359 87.906 1.00 0.00 H ATOM 1478 H CYS A 95 16.294 -9.126 91.357 1.00 0.00 H ATOM 1479 N THR A 96 17.199 -9.816 87.226 1.00 10.34 N ATOM 1480 CA THR A 96 18.279 -9.701 86.262 1.00 10.07 C ATOM 1481 C THR A 96 17.722 -9.224 84.908 1.00 9.29 C ATOM 1482 O THR A 96 16.538 -9.397 84.645 1.00 10.37 O ATOM 1483 CB THR A 96 19.027 -11.040 86.086 1.00 11.93 C ATOM 1484 OG1 THR A 96 18.110 -12.047 85.633 1.00 11.87 O ATOM 1485 CG2 THR A 96 19.675 -11.498 87.390 1.00 12.69 C ATOM 1486 HA THR A 96 18.993 -8.969 86.641 1.00 0.00 H ATOM 1487 HB THR A 96 19.816 -10.888 85.349 1.00 0.00 H ATOM 1488 HG1 THR A 96 17.720 -11.771 84.766 1.00 0.00 H ATOM 1489 HG23 THR A 96 20.372 -10.734 87.736 1.00 0.00 H ATOM 1490 HG21 THR A 96 18.902 -11.654 88.143 1.00 0.00 H ATOM 1491 HG22 THR A 96 20.212 -12.431 87.219 1.00 0.00 H ATOM 1492 H THR A 96 16.344 -10.344 86.958 1.00 0.00 H ATOM 1493 N LEU A 97 18.625 -8.695 84.097 1.00 9.00 N ATOM 1494 CA LEU A 97 18.334 -8.461 82.687 1.00 9.38 C ATOM 1495 C LEU A 97 18.851 -9.627 81.887 1.00 9.49 C ATOM 1496 O LEU A 97 19.940 -10.164 82.147 1.00 11.53 O ATOM 1497 CB LEU A 97 19.063 -7.194 82.200 1.00 10.18 C ATOM 1498 CG LEU A 97 18.458 -5.914 82.617 1.00 10.27 C ATOM 1499 CD1 LEU A 97 19.413 -4.762 82.432 1.00 13.51 C ATOM 1500 CD2 LEU A 97 17.147 -5.621 81.867 1.00 14.19 C ATOM 1501 HA LEU A 97 17.258 -8.342 82.561 1.00 0.00 H ATOM 1502 HB2 LEU A 97 20.083 -7.225 82.583 1.00 0.00 H ATOM 1503 HB3 LEU A 97 19.085 -7.216 81.110 1.00 0.00 H ATOM 1504 HG LEU A 97 18.231 -6.018 83.678 1.00 0.00 H ATOM 1505 HD21 LEU A 97 17.346 -5.570 80.797 1.00 0.00 H ATOM 1506 HD22 LEU A 97 16.430 -6.417 82.067 1.00 0.00 H ATOM 1507 HD23 LEU A 97 16.740 -4.669 82.208 1.00 0.00 H ATOM 1508 HD11 LEU A 97 20.307 -4.933 83.032 1.00 0.00 H ATOM 1509 HD12 LEU A 97 19.689 -4.686 81.380 1.00 0.00 H ATOM 1510 HD13 LEU A 97 18.931 -3.838 82.750 1.00 0.00 H ATOM 1511 H LEU A 97 19.561 -8.441 84.473 1.00 0.00 H ATOM 1512 N ASN A 98 18.074 -10.059 80.889 1.00 9.82 N ATOM 1513 CA ASN A 98 18.393 -11.246 80.130 1.00 10.44 C ATOM 1514 C ASN A 98 18.143 -11.016 78.661 1.00 10.71 C ATOM 1515 O ASN A 98 17.116 -10.479 78.307 1.00 12.26 O ATOM 1516 CB ASN A 98 17.523 -12.389 80.589 1.00 11.76 C ATOM 1517 CG ASN A 98 17.765 -12.735 82.062 1.00 12.69 C ATOM 1518 OD1 ASN A 98 17.312 -12.019 82.964 1.00 16.13 O ATOM 1519 ND2 ASN A 98 18.661 -13.634 82.242 1.00 15.97 N ATOM 1520 HA ASN A 98 19.445 -11.482 80.288 1.00 0.00 H ATOM 1521 HB2 ASN A 98 16.477 -12.111 80.459 1.00 0.00 H ATOM 1522 HB3 ASN A 98 17.742 -13.266 79.980 1.00 0.00 H ATOM 1523 HD22 ASN A 98 18.997 -14.201 81.438 1.00 0.00 H ATOM 1524 HD21 ASN A 98 19.051 -13.796 83.192 1.00 0.00 H ATOM 1525 H ASN A 98 17.214 -9.525 80.652 1.00 0.00 H ATOM 1526 N PHE A 99 19.064 -11.491 77.812 1.00 11.11 N ATOM 1527 CA PHE A 99 18.863 -11.523 76.364 1.00 11.96 C ATOM 1528 C PHE A 99 19.835 -12.511 75.757 1.00 13.33 C ATOM 1529 O PHE A 99 20.556 -13.187 76.521 1.00 18.30 O ATOM 1530 CB PHE A 99 18.881 -10.139 75.717 1.00 12.95 C ATOM 1531 CG PHE A 99 20.155 -9.381 75.931 1.00 13.36 C ATOM 1532 CD1 PHE A 99 20.271 -8.547 77.021 1.00 15.16 C ATOM 1533 CD2 PHE A 99 21.223 -9.478 75.086 1.00 16.56 C ATOM 1534 CE1 PHE A 99 21.420 -7.824 77.268 1.00 18.71 C ATOM 1535 CE2 PHE A 99 22.370 -8.765 75.320 1.00 18.96 C ATOM 1536 CZ PHE A 99 22.501 -7.921 76.414 1.00 19.54 C ATOM 1537 HA PHE A 99 17.853 -11.874 76.153 1.00 0.00 H ATOM 1538 OXT PHE A 99 19.901 -12.553 74.501 1.00 14.80 O ATOM 1539 HB2 PHE A 99 18.730 -10.260 74.644 1.00 0.00 H ATOM 1540 HB3 PHE A 99 18.061 -9.555 76.134 1.00 0.00 H ATOM 1541 HD2 PHE A 99 21.163 -10.130 74.215 1.00 0.00 H ATOM 1542 HE2 PHE A 99 23.205 -8.864 74.626 1.00 0.00 H ATOM 1543 HZ PHE A 99 23.418 -7.359 76.592 1.00 0.00 H ATOM 1544 HE1 PHE A 99 21.475 -7.174 78.141 1.00 0.00 H ATOM 1545 HD1 PHE A 99 19.430 -8.455 77.709 1.00 0.00 H ATOM 1546 H PHE A 99 19.959 -11.852 78.199 1.00 0.00 H TER 1547 PHE A 99 ATOM 1548 N PRO B 1 23.120 -12.988 77.500 1.00 22.90 N ATOM 1549 CA PRO B 1 23.651 -13.137 78.865 1.00 22.04 C ATOM 1550 C PRO B 1 22.566 -12.850 79.885 1.00 15.54 C ATOM 1551 O PRO B 1 21.482 -12.419 79.520 1.00 17.77 O ATOM 1552 CB PRO B 1 24.714 -12.046 78.976 1.00 24.92 C ATOM 1553 CG PRO B 1 24.081 -10.950 78.158 1.00 28.39 C ATOM 1554 CD PRO B 1 23.446 -11.648 76.982 1.00 28.42 C ATOM 1555 HA PRO B 1 24.031 -14.142 79.047 1.00 0.00 H ATOM 1556 HD3 PRO B 1 22.545 -11.126 76.661 1.00 0.00 H ATOM 1557 HD2 PRO B 1 24.143 -11.714 76.147 1.00 0.00 H ATOM 1558 HG3 PRO B 1 24.836 -10.241 77.819 1.00 0.00 H ATOM 1559 HG2 PRO B 1 23.327 -10.424 78.743 1.00 0.00 H ATOM 1560 HB2 PRO B 1 24.866 -11.738 80.010 1.00 0.00 H ATOM 1561 HB3 PRO B 1 25.665 -12.367 78.550 1.00 0.00 H ATOM 1562 N GLN B 2 22.907 -13.155 81.109 1.00 14.33 N ATOM 1563 CA GLN B 2 22.163 -12.773 82.298 1.00 13.43 C ATOM 1564 C GLN B 2 23.032 -11.743 83.009 1.00 13.85 C ATOM 1565 O GLN B 2 24.183 -12.002 83.316 1.00 19.24 O ATOM 1566 CB GLN B 2 21.853 -13.978 83.206 1.00 15.69 C ATOM 1567 CG GLN B 2 21.049 -13.574 84.465 1.00 19.48 C ATOM 1568 CD GLN B 2 20.244 -14.720 85.068 1.00 20.70 C ATOM 1569 OE1 GLN B 2 20.830 -15.178 86.121 1.00 28.23 O ATOM 1570 NE2 GLN B 2 19.082 -15.376 84.916 1.00 26.59 N ATOM 1571 HA GLN B 2 21.188 -12.364 82.034 1.00 0.00 H ATOM 1572 HB2 GLN B 2 21.273 -14.705 82.638 1.00 0.00 H ATOM 1573 HB3 GLN B 2 22.793 -14.431 83.521 1.00 0.00 H ATOM 1574 HG2 GLN B 2 21.747 -13.209 85.218 1.00 0.00 H ATOM 1575 HG3 GLN B 2 20.360 -12.774 84.193 1.00 0.00 H ATOM 1576 HE22 GLN B 2 18.457 -15.149 84.116 1.00 0.00 H ATOM 1577 HE21 GLN B 2 18.807 -16.111 85.598 1.00 0.00 H ATOM 1578 H GLN B 2 23.775 -13.712 81.242 1.00 0.00 H ATOM 1579 N ILE B 3 22.446 -10.548 83.200 1.00 11.62 N ATOM 1580 CA ILE B 3 23.109 -9.425 83.810 1.00 11.32 C ATOM 1581 C ILE B 3 22.510 -9.129 85.154 1.00 10.68 C ATOM 1582 O ILE B 3 21.338 -8.756 85.264 1.00 11.11 O ATOM 1583 CB ILE B 3 23.059 -8.193 82.882 1.00 11.46 C ATOM 1584 CG1 ILE B 3 23.621 -8.553 81.514 1.00 15.39 C ATOM 1585 CG2 ILE B 3 23.661 -6.959 83.505 1.00 14.35 C ATOM 1586 CD1 ILE B 3 23.488 -7.453 80.475 1.00 18.52 C ATOM 1587 HA ILE B 3 24.158 -9.679 83.962 1.00 0.00 H ATOM 1588 HB ILE B 3 22.017 -7.911 82.731 1.00 0.00 H ATOM 1589 HG12 ILE B 3 24.679 -8.787 81.630 1.00 0.00 H ATOM 1590 HG13 ILE B 3 23.093 -9.434 81.149 1.00 0.00 H ATOM 1591 HD11 ILE B 3 22.434 -7.213 80.335 1.00 0.00 H ATOM 1592 HD12 ILE B 3 24.022 -6.566 80.817 1.00 0.00 H ATOM 1593 HD13 ILE B 3 23.913 -7.793 79.531 1.00 0.00 H ATOM 1594 HG21 ILE B 3 23.116 -6.710 84.415 1.00 0.00 H ATOM 1595 HG22 ILE B 3 24.707 -7.149 83.747 1.00 0.00 H ATOM 1596 HG23 ILE B 3 23.594 -6.129 82.802 1.00 0.00 H ATOM 1597 H ILE B 3 21.460 -10.428 82.890 1.00 0.00 H ATOM 1598 N THR B 4 23.296 -9.283 86.224 1.00 11.14 N ATOM 1599 CA THR B 4 22.844 -8.909 87.544 1.00 10.63 C ATOM 1600 C THR B 4 22.968 -7.397 87.690 1.00 9.98 C ATOM 1601 O THR B 4 23.574 -6.741 86.839 1.00 11.60 O ATOM 1602 CB THR B 4 23.665 -9.662 88.619 1.00 12.24 C ATOM 1603 OG1 THR B 4 25.046 -9.313 88.454 1.00 13.28 O ATOM 1604 CG2 THR B 4 23.450 -11.143 88.550 1.00 14.25 C ATOM 1605 HA THR B 4 21.800 -9.188 87.684 1.00 0.00 H ATOM 1606 HB THR B 4 23.329 -9.362 89.612 1.00 0.00 H ATOM 1607 HG1 THR B 4 25.588 -9.786 89.134 1.00 0.00 H ATOM 1608 HG23 THR B 4 22.390 -11.361 88.680 1.00 0.00 H ATOM 1609 HG21 THR B 4 23.782 -11.512 87.580 1.00 0.00 H ATOM 1610 HG22 THR B 4 24.022 -11.629 89.340 1.00 0.00 H ATOM 1611 H THR B 4 24.250 -9.679 86.104 1.00 0.00 H ATOM 1612 N LEU B 5 22.401 -6.872 88.759 1.00 9.59 N ATOM 1613 CA LEU B 5 22.143 -5.442 88.895 1.00 9.11 C ATOM 1614 C LEU B 5 22.856 -4.821 90.077 1.00 8.85 C ATOM 1615 O LEU B 5 22.498 -3.718 90.500 1.00 9.73 O ATOM 1616 CB LEU B 5 20.658 -5.165 88.856 1.00 9.10 C ATOM 1617 CG LEU B 5 19.983 -5.503 87.498 1.00 9.46 C ATOM 1618 CD1 LEU B 5 18.467 -5.460 87.672 1.00 10.87 C ATOM 1619 CD2 LEU B 5 20.450 -4.593 86.404 1.00 11.86 C ATOM 1620 HA LEU B 5 22.579 -4.939 88.032 1.00 0.00 H ATOM 1621 HB2 LEU B 5 20.178 -5.759 89.634 1.00 0.00 H ATOM 1622 HB3 LEU B 5 20.502 -4.106 89.062 1.00 0.00 H ATOM 1623 HG LEU B 5 20.274 -6.509 87.194 1.00 0.00 H ATOM 1624 HD21 LEU B 5 20.206 -3.562 86.661 1.00 0.00 H ATOM 1625 HD22 LEU B 5 21.529 -4.693 86.285 1.00 0.00 H ATOM 1626 HD23 LEU B 5 19.954 -4.863 85.472 1.00 0.00 H ATOM 1627 HD11 LEU B 5 18.168 -6.191 88.424 1.00 0.00 H ATOM 1628 HD12 LEU B 5 18.168 -4.463 87.994 1.00 0.00 H ATOM 1629 HD13 LEU B 5 17.987 -5.696 86.722 1.00 0.00 H ATOM 1630 H LEU B 5 22.126 -7.504 89.538 1.00 0.00 H ATOM 1631 N TRP B 6 23.913 -5.461 90.579 1.00 9.39 N ATOM 1632 CA TRP B 6 24.723 -4.902 91.645 1.00 10.85 C ATOM 1633 C TRP B 6 25.498 -3.672 91.193 1.00 9.81 C ATOM 1634 O TRP B 6 25.756 -2.804 92.023 1.00 15.01 O ATOM 1635 CB TRP B 6 25.669 -5.983 92.188 1.00 12.21 C ATOM 1636 CG TRP B 6 24.976 -7.189 92.690 1.00 12.96 C ATOM 1637 CD1 TRP B 6 24.911 -8.394 92.055 1.00 14.48 C ATOM 1638 CD2 TRP B 6 24.205 -7.319 93.898 1.00 13.83 C ATOM 1639 NE1 TRP B 6 24.175 -9.277 92.794 1.00 18.03 N ATOM 1640 CE2 TRP B 6 23.750 -8.621 93.949 1.00 15.95 C ATOM 1641 CE3 TRP B 6 23.919 -6.462 94.971 1.00 15.25 C ATOM 1642 CZ2 TRP B 6 22.972 -9.150 94.979 1.00 17.82 C ATOM 1643 CZ3 TRP B 6 23.176 -6.995 95.980 1.00 16.18 C ATOM 1644 CH2 TRP B 6 22.709 -8.299 96.032 1.00 18.97 C ATOM 1645 HA TRP B 6 24.057 -4.571 92.442 1.00 0.00 H ATOM 1646 HB2 TRP B 6 26.344 -6.283 91.386 1.00 0.00 H ATOM 1647 HB3 TRP B 6 26.247 -5.554 93.006 1.00 0.00 H ATOM 1648 HE1 TRP B 6 23.968 -10.264 92.540 1.00 0.00 H ATOM 1649 HD1 TRP B 6 25.378 -8.620 91.097 1.00 0.00 H ATOM 1650 HZ2 TRP B 6 22.595 -10.173 94.953 1.00 0.00 H ATOM 1651 HH2 TRP B 6 22.141 -8.648 96.894 1.00 0.00 H ATOM 1652 HZ3 TRP B 6 22.928 -6.342 96.817 1.00 0.00 H ATOM 1653 HE3 TRP B 6 24.271 -5.431 94.996 1.00 0.00 H ATOM 1654 H TRP B 6 24.165 -6.393 90.193 1.00 0.00 H ATOM 1655 N GLN B 7 25.808 -3.589 89.927 1.00 8.69 N ATOM 1656 CA GLN B 7 26.437 -2.412 89.302 1.00 8.76 C ATOM 1657 C GLN B 7 25.561 -1.978 88.149 1.00 8.82 C ATOM 1658 O GLN B 7 24.644 -2.698 87.709 1.00 8.94 O ATOM 1659 CB GLN B 7 27.857 -2.745 88.832 1.00 9.37 C ATOM 1660 CG GLN B 7 27.933 -3.747 87.725 1.00 10.46 C ATOM 1661 CD GLN B 7 29.369 -4.152 87.417 1.00 10.72 C ATOM 1662 OE1 GLN B 7 29.846 -5.205 87.874 1.00 14.40 O ATOM 1663 NE2 GLN B 7 30.059 -3.340 86.677 1.00 11.87 N ATOM 1664 HA GLN B 7 26.526 -1.599 90.022 1.00 0.00 H ATOM 1665 HB2 GLN B 7 28.325 -1.823 88.488 1.00 0.00 H ATOM 1666 HB3 GLN B 7 28.413 -3.137 89.684 1.00 0.00 H ATOM 1667 HG2 GLN B 7 27.371 -4.635 88.015 1.00 0.00 H ATOM 1668 HG3 GLN B 7 27.489 -3.315 86.828 1.00 0.00 H ATOM 1669 HE22 GLN B 7 29.622 -2.469 86.314 1.00 0.00 H ATOM 1670 HE21 GLN B 7 31.049 -3.560 86.447 1.00 0.00 H ATOM 1671 H GLN B 7 25.597 -4.407 89.320 1.00 0.00 H ATOM 1672 N ARG B 8 25.845 -0.808 87.605 1.00 8.42 N ATOM 1673 CA ARG B 8 25.054 -0.321 86.461 1.00 8.38 C ATOM 1674 C ARG B 8 25.182 -1.269 85.272 1.00 7.82 C ATOM 1675 O ARG B 8 26.335 -1.664 84.949 1.00 8.49 O ATOM 1676 CB ARG B 8 25.522 1.064 86.062 1.00 8.84 C ATOM 1677 CG ARG B 8 25.228 2.152 87.049 1.00 9.64 C ATOM 1678 CD ARG B 8 25.631 3.512 86.582 1.00 10.90 C ATOM 1679 NE ARG B 8 25.248 4.526 87.554 1.00 11.32 N ATOM 1680 CZ ARG B 8 25.502 5.818 87.405 1.00 11.39 C ATOM 1681 NH1 ARG B 8 26.216 6.233 86.339 1.00 14.04 N ATOM 1682 NH2 ARG B 8 25.057 6.660 88.311 1.00 13.21 N ATOM 1683 HA ARG B 8 24.007 -0.278 86.761 1.00 0.00 H ATOM 1684 HB2 ARG B 8 26.601 1.025 85.916 1.00 0.00 H ATOM 1685 HB3 ARG B 8 25.038 1.324 85.121 1.00 0.00 H ATOM 1686 HG2 ARG B 8 24.156 2.159 87.245 1.00 0.00 H ATOM 1687 HG3 ARG B 8 25.763 1.933 87.973 1.00 0.00 H ATOM 1688 HD2 ARG B 8 25.141 3.724 85.632 1.00 0.00 H ATOM 1689 HD3 ARG B 8 26.712 3.538 86.445 1.00 0.00 H ATOM 1690 HE ARG B 8 24.747 4.219 88.413 1.00 0.00 H ATOM 1691 HH12 ARG B 8 26.421 7.245 86.212 1.00 0.00 H ATOM 1692 HH11 ARG B 8 26.562 5.541 85.643 1.00 0.00 H ATOM 1693 HH22 ARG B 8 25.246 7.678 88.212 1.00 0.00 H ATOM 1694 HH21 ARG B 8 24.516 6.308 89.127 1.00 0.00 H ATOM 1695 H ARG B 8 26.624 -0.232 87.983 1.00 0.00 H ATOM 1696 N PRO B 9 24.114 -1.588 84.575 1.00 8.21 N ATOM 1697 CA PRO B 9 24.160 -2.544 83.425 1.00 8.14 C ATOM 1698 C PRO B 9 24.597 -1.814 82.158 1.00 7.81 C ATOM 1699 O PRO B 9 23.828 -1.609 81.214 1.00 9.32 O ATOM 1700 CB PRO B 9 22.758 -3.071 83.350 1.00 8.99 C ATOM 1701 CG PRO B 9 21.908 -1.956 83.863 1.00 9.42 C ATOM 1702 CD PRO B 9 22.702 -1.380 85.021 1.00 8.77 C ATOM 1703 HA PRO B 9 24.879 -3.355 83.543 1.00 0.00 H ATOM 1704 HD3 PRO B 9 22.484 -0.321 85.161 1.00 0.00 H ATOM 1705 HD2 PRO B 9 22.497 -1.918 85.947 1.00 0.00 H ATOM 1706 HG3 PRO B 9 20.943 -2.331 84.205 1.00 0.00 H ATOM 1707 HG2 PRO B 9 21.750 -1.203 83.090 1.00 0.00 H ATOM 1708 HB2 PRO B 9 22.493 -3.315 82.321 1.00 0.00 H ATOM 1709 HB3 PRO B 9 22.646 -3.958 83.973 1.00 0.00 H ATOM 1710 N LEU B 10 25.875 -1.508 82.108 1.00 8.70 N ATOM 1711 CA LEU B 10 26.521 -0.904 80.949 1.00 8.97 C ATOM 1712 C LEU B 10 26.973 -1.996 80.000 1.00 8.62 C ATOM 1713 O LEU B 10 27.516 -3.034 80.443 1.00 9.82 O ATOM 1714 CB LEU B 10 27.729 -0.070 81.344 1.00 9.76 C ATOM 1715 CG LEU B 10 27.390 1.155 82.197 1.00 10.93 C ATOM 1716 CD1 LEU B 10 28.574 1.640 82.977 1.00 12.84 C ATOM 1717 CD2 LEU B 10 26.828 2.243 81.289 1.00 16.09 C ATOM 1718 HA LEU B 10 25.794 -0.248 80.469 1.00 0.00 H ATOM 1719 HB2 LEU B 10 28.412 -0.703 81.910 1.00 0.00 H ATOM 1720 HB3 LEU B 10 28.222 0.272 80.434 1.00 0.00 H ATOM 1721 HG LEU B 10 26.638 0.878 82.936 1.00 0.00 H ATOM 1722 HD21 LEU B 10 27.572 2.508 80.538 1.00 0.00 H ATOM 1723 HD22 LEU B 10 25.929 1.874 80.796 1.00 0.00 H ATOM 1724 HD23 LEU B 10 26.583 3.122 81.886 1.00 0.00 H ATOM 1725 HD11 LEU B 10 28.920 0.847 83.640 1.00 0.00 H ATOM 1726 HD12 LEU B 10 29.373 1.914 82.289 1.00 0.00 H ATOM 1727 HD13 LEU B 10 28.287 2.510 83.567 1.00 0.00 H ATOM 1728 H LEU B 10 26.459 -1.709 82.945 1.00 0.00 H ATOM 1729 N VAL B 11 26.772 -1.768 78.728 1.00 8.97 N ATOM 1730 CA VAL B 11 27.169 -2.744 77.685 1.00 9.80 C ATOM 1731 C VAL B 11 27.805 -2.015 76.533 1.00 9.21 C ATOM 1732 O VAL B 11 27.612 -0.810 76.331 1.00 9.86 O ATOM 1733 CB VAL B 11 26.013 -3.587 77.206 1.00 11.73 C ATOM 1734 CG1 VAL B 11 25.396 -4.385 78.341 1.00 12.64 C ATOM 1735 CG2 VAL B 11 24.966 -2.753 76.497 1.00 14.20 C ATOM 1736 HA VAL B 11 27.888 -3.431 78.132 1.00 0.00 H ATOM 1737 HB VAL B 11 26.415 -4.295 76.482 1.00 0.00 H ATOM 1738 HG11 VAL B 11 26.149 -5.045 78.771 1.00 0.00 H ATOM 1739 HG12 VAL B 11 25.030 -3.701 79.107 1.00 0.00 H ATOM 1740 HG13 VAL B 11 24.567 -4.979 77.957 1.00 0.00 H ATOM 1741 HG21 VAL B 11 24.580 -1.998 77.182 1.00 0.00 H ATOM 1742 HG22 VAL B 11 25.416 -2.265 75.633 1.00 0.00 H ATOM 1743 HG23 VAL B 11 24.151 -3.398 76.168 1.00 0.00 H ATOM 1744 H VAL B 11 26.321 -0.876 78.440 1.00 0.00 H ATOM 1745 N THR B 12 28.580 -2.734 75.747 1.00 11.08 N ATOM 1746 CA THR B 12 29.107 -2.196 74.519 1.00 10.85 C ATOM 1747 C THR B 12 28.019 -2.063 73.464 1.00 11.21 C ATOM 1748 O THR B 12 27.178 -2.958 73.269 1.00 12.65 O ATOM 1749 CB THR B 12 30.218 -3.128 73.975 1.00 13.00 C ATOM 1750 OG1 THR B 12 31.322 -2.947 74.863 1.00 12.99 O ATOM 1751 CG2 THR B 12 30.783 -2.739 72.629 1.00 11.91 C ATOM 1752 HA THR B 12 29.512 -1.207 74.733 1.00 0.00 H ATOM 1753 HB THR B 12 29.784 -4.124 73.892 1.00 0.00 H ATOM 1754 HG1 THR B 12 32.076 -3.519 74.572 1.00 0.00 H ATOM 1755 HG23 THR B 12 30.010 -2.843 71.868 1.00 0.00 H ATOM 1756 HG21 THR B 12 31.123 -1.704 72.664 1.00 0.00 H ATOM 1757 HG22 THR B 12 31.623 -3.390 72.387 1.00 0.00 H ATOM 1758 H THR B 12 28.816 -3.710 76.019 1.00 0.00 H ATOM 1759 N ILE B 13 28.026 -0.922 72.761 1.00 10.80 N ATOM 1760 CA ILE B 13 27.183 -0.697 71.618 1.00 11.10 C ATOM 1761 C ILE B 13 28.056 -0.278 70.445 1.00 11.00 C ATOM 1762 O ILE B 13 29.180 0.227 70.631 1.00 13.01 O ATOM 1763 CB ILE B 13 26.090 0.335 71.861 1.00 11.80 C ATOM 1764 CG1 ILE B 13 26.608 1.746 72.126 1.00 13.16 C ATOM 1765 CG2 ILE B 13 25.174 -0.124 72.999 1.00 11.84 C ATOM 1766 CD1 ILE B 13 25.586 2.823 72.074 1.00 13.03 C ATOM 1767 HA ILE B 13 26.664 -1.631 71.403 1.00 0.00 H ATOM 1768 HB ILE B 13 25.526 0.400 70.931 1.00 0.00 H ATOM 1769 HG12 ILE B 13 27.058 1.758 73.119 1.00 0.00 H ATOM 1770 HG13 ILE B 13 27.370 1.970 71.380 1.00 0.00 H ATOM 1771 HD11 ILE B 13 25.131 2.843 71.084 1.00 0.00 H ATOM 1772 HD12 ILE B 13 24.819 2.631 72.824 1.00 0.00 H ATOM 1773 HD13 ILE B 13 26.061 3.783 72.276 1.00 0.00 H ATOM 1774 HG21 ILE B 13 24.714 -1.076 72.732 1.00 0.00 H ATOM 1775 HG22 ILE B 13 25.761 -0.245 73.910 1.00 0.00 H ATOM 1776 HG23 ILE B 13 24.397 0.623 73.162 1.00 0.00 H ATOM 1777 H ILE B 13 28.672 -0.163 73.056 1.00 0.00 H ATOM 1778 N LYS B 14 27.554 -0.490 69.256 1.00 11.16 N ATOM 1779 CA LYS B 14 28.190 -0.006 68.022 1.00 11.80 C ATOM 1780 C LYS B 14 27.139 0.820 67.286 1.00 11.23 C ATOM 1781 O LYS B 14 26.055 0.303 66.969 1.00 11.48 O ATOM 1782 CB LYS B 14 28.726 -1.120 67.165 1.00 13.50 C ATOM 1783 CG LYS B 14 29.574 -0.565 66.006 1.00 16.56 C ATOM 1784 CD LYS B 14 29.996 -1.728 65.089 1.00 26.82 C ATOM 1785 CE LYS B 14 31.127 -2.498 65.687 1.00 36.56 C ATOM 1786 NZ LYS B 14 31.958 -3.150 64.668 1.00 56.57 N ATOM 1787 HA LYS B 14 29.064 0.598 68.265 1.00 0.00 H ATOM 1788 HB2 LYS B 14 29.345 -1.776 67.778 1.00 0.00 H ATOM 1789 HB3 LYS B 14 27.891 -1.689 66.756 1.00 0.00 H ATOM 1790 HG2 LYS B 14 28.987 0.155 65.436 1.00 0.00 H ATOM 1791 HG3 LYS B 14 30.461 -0.074 66.405 1.00 0.00 H ATOM 1792 HD2 LYS B 14 29.146 -2.396 64.946 1.00 0.00 H ATOM 1793 HD3 LYS B 14 30.308 -1.327 64.125 1.00 0.00 H ATOM 1794 HE2 LYS B 14 30.720 -3.262 66.349 1.00 0.00 H ATOM 1795 HE3 LYS B 14 31.751 -1.815 66.263 1.00 0.00 H ATOM 1796 HZ1 LYS B 14 31.374 -3.811 64.117 1.00 0.00 H ATOM 1797 HZ2 LYS B 14 32.358 -2.428 64.035 1.00 0.00 H ATOM 1798 HZ3 LYS B 14 32.729 -3.671 65.133 1.00 0.00 H ATOM 1799 H LYS B 14 26.665 -1.025 69.180 1.00 0.00 H ATOM 1800 N ILE B 15 27.448 2.070 67.034 1.00 11.78 N ATOM 1801 CA ILE B 15 26.523 2.997 66.372 1.00 12.32 C ATOM 1802 C ILE B 15 27.376 3.944 65.534 1.00 13.48 C ATOM 1803 O ILE B 15 28.464 4.377 65.982 1.00 13.29 O ATOM 1804 CB ILE B 15 25.680 3.736 67.403 1.00 12.81 C ATOM 1805 CG1 ILE B 15 24.638 4.565 66.625 1.00 14.09 C ATOM 1806 CG2 ILE B 15 26.482 4.504 68.404 1.00 14.04 C ATOM 1807 CD1 ILE B 15 23.675 5.275 67.528 1.00 15.84 C ATOM 1808 HA ILE B 15 25.817 2.471 65.730 1.00 0.00 H ATOM 1809 HB ILE B 15 25.160 3.025 68.045 1.00 0.00 H ATOM 1810 HG12 ILE B 15 25.162 5.306 66.021 1.00 0.00 H ATOM 1811 HG13 ILE B 15 24.077 3.897 65.972 1.00 0.00 H ATOM 1812 HD11 ILE B 15 23.138 4.543 68.132 1.00 0.00 H ATOM 1813 HD12 ILE B 15 24.224 5.954 68.181 1.00 0.00 H ATOM 1814 HD13 ILE B 15 22.965 5.842 66.926 1.00 0.00 H ATOM 1815 HG21 ILE B 15 27.132 3.820 68.949 1.00 0.00 H ATOM 1816 HG22 ILE B 15 27.088 5.249 67.888 1.00 0.00 H ATOM 1817 HG23 ILE B 15 25.809 5.001 69.102 1.00 0.00 H ATOM 1818 H ILE B 15 28.387 2.418 67.315 1.00 0.00 H ATOM 1819 N GLY B 16 26.914 4.248 64.327 1.00 14.03 N ATOM 1820 CA GLY B 16 27.715 5.164 63.514 1.00 16.51 C ATOM 1821 C GLY B 16 29.078 4.611 63.187 1.00 15.53 C ATOM 1822 O GLY B 16 30.037 5.309 62.893 1.00 17.98 O ATOM 1823 HA3 GLY B 16 27.840 6.098 64.061 1.00 0.00 H ATOM 1824 HA2 GLY B 16 27.184 5.358 62.582 1.00 0.00 H ATOM 1825 H GLY B 16 26.020 3.852 63.974 1.00 0.00 H ATOM 1826 N GLY B 17 29.429 3.378 63.313 1.00 15.54 N ATOM 1827 CA GLY B 17 30.558 2.572 63.032 1.00 15.84 C ATOM 1828 C GLY B 17 31.514 2.596 64.208 1.00 16.57 C ATOM 1829 O GLY B 17 32.662 2.188 64.010 1.00 19.61 O ATOM 1830 HA3 GLY B 17 31.065 2.955 62.146 1.00 0.00 H ATOM 1831 HA2 GLY B 17 30.235 1.547 62.850 1.00 0.00 H ATOM 1832 H GLY B 17 28.667 2.816 63.743 1.00 0.00 H ATOM 1833 N GLN B 18 31.096 3.141 65.349 1.00 14.70 N ATOM 1834 CA GLN B 18 31.965 3.357 66.472 1.00 16.65 C ATOM 1835 C GLN B 18 31.540 2.588 67.699 1.00 13.71 C ATOM 1836 O GLN B 18 30.332 2.508 67.936 1.00 13.97 O ATOM 1837 CB GLN B 18 31.970 4.860 66.794 1.00 18.78 C ATOM 1838 CG GLN B 18 32.627 5.672 65.663 1.00 20.67 C ATOM 1839 CD GLN B 18 34.001 5.245 65.236 1.00 35.39 C ATOM 1840 OE1 GLN B 18 34.764 4.606 65.957 1.00 60.87 O ATOM 1841 NE2 GLN B 18 34.405 5.662 64.033 1.00 36.46 N ATOM 1842 HA GLN B 18 32.959 3.000 66.201 1.00 0.00 H ATOM 1843 HB2 GLN B 18 30.942 5.199 66.924 1.00 0.00 H ATOM 1844 HB3 GLN B 18 32.525 5.024 67.718 1.00 0.00 H ATOM 1845 HG2 GLN B 18 31.976 5.611 64.791 1.00 0.00 H ATOM 1846 HG3 GLN B 18 32.691 6.708 65.995 1.00 0.00 H ATOM 1847 HE22 GLN B 18 33.757 6.203 63.425 1.00 0.00 H ATOM 1848 HE21 GLN B 18 35.368 5.446 63.704 1.00 0.00 H ATOM 1849 H GLN B 18 30.098 3.422 65.430 1.00 0.00 H ATOM 1850 N LEU B 19 32.467 2.086 68.477 1.00 15.19 N ATOM 1851 CA LEU B 19 32.146 1.411 69.717 1.00 13.56 C ATOM 1852 C LEU B 19 32.006 2.460 70.807 1.00 13.42 C ATOM 1853 O LEU B 19 32.819 3.344 71.012 1.00 17.56 O ATOM 1854 CB LEU B 19 33.228 0.422 70.124 1.00 16.13 C ATOM 1855 CG LEU B 19 33.297 -0.831 69.249 1.00 22.82 C ATOM 1856 CD1 LEU B 19 34.258 -1.868 69.848 1.00 30.80 C ATOM 1857 CD2 LEU B 19 31.945 -1.515 69.049 1.00 26.81 C ATOM 1858 HA LEU B 19 31.220 0.853 69.575 1.00 0.00 H ATOM 1859 HB2 LEU B 19 34.192 0.929 70.071 1.00 0.00 H ATOM 1860 HB3 LEU B 19 33.038 0.111 71.151 1.00 0.00 H ATOM 1861 HG LEU B 19 33.651 -0.477 68.281 1.00 0.00 H ATOM 1862 HD21 LEU B 19 31.545 -1.816 70.017 1.00 0.00 H ATOM 1863 HD22 LEU B 19 31.255 -0.821 68.569 1.00 0.00 H ATOM 1864 HD23 LEU B 19 32.074 -2.395 68.419 1.00 0.00 H ATOM 1865 HD11 LEU B 19 35.256 -1.437 69.921 1.00 0.00 H ATOM 1866 HD12 LEU B 19 33.910 -2.153 70.841 1.00 0.00 H ATOM 1867 HD13 LEU B 19 34.287 -2.748 69.205 1.00 0.00 H ATOM 1868 H LEU B 19 33.464 2.175 68.195 1.00 0.00 H ATOM 1869 N LYS B 20 30.928 2.335 71.556 1.00 12.09 N ATOM 1870 CA LYS B 20 30.607 3.144 72.705 1.00 11.92 C ATOM 1871 C LYS B 20 30.091 2.219 73.802 1.00 10.73 C ATOM 1872 O LYS B 20 30.051 1.008 73.624 1.00 12.05 O ATOM 1873 CB LYS B 20 29.591 4.217 72.352 1.00 13.46 C ATOM 1874 CG LYS B 20 29.994 5.196 71.276 1.00 17.21 C ATOM 1875 CD LYS B 20 28.876 6.182 70.930 1.00 21.32 C ATOM 1876 CE LYS B 20 29.358 7.190 69.905 1.00 33.34 C ATOM 1877 NZ LYS B 20 30.490 8.029 70.388 1.00 54.06 N ATOM 1878 HA LYS B 20 31.496 3.667 73.057 1.00 0.00 H ATOM 1879 HB2 LYS B 20 28.681 3.716 72.021 1.00 0.00 H ATOM 1880 HB3 LYS B 20 29.382 4.787 73.257 1.00 0.00 H ATOM 1881 HG2 LYS B 20 30.861 5.758 71.622 1.00 0.00 H ATOM 1882 HG3 LYS B 20 30.259 4.639 70.378 1.00 0.00 H ATOM 1883 HD2 LYS B 20 28.026 5.634 70.523 1.00 0.00 H ATOM 1884 HD3 LYS B 20 28.568 6.708 71.834 1.00 0.00 H ATOM 1885 HE2 LYS B 20 28.527 7.846 69.647 1.00 0.00 H ATOM 1886 HE3 LYS B 20 29.682 6.650 69.015 1.00 0.00 H ATOM 1887 HZ1 LYS B 20 30.192 8.559 71.232 1.00 0.00 H ATOM 1888 HZ2 LYS B 20 31.296 7.417 70.628 1.00 0.00 H ATOM 1889 HZ3 LYS B 20 30.770 8.695 69.640 1.00 0.00 H ATOM 1890 H LYS B 20 30.252 1.589 71.296 1.00 0.00 H ATOM 1891 N GLU B 21 29.695 2.794 74.938 1.00 9.94 N ATOM 1892 CA GLU B 21 29.021 1.993 75.956 1.00 10.14 C ATOM 1893 C GLU B 21 27.796 2.744 76.396 1.00 9.69 C ATOM 1894 O GLU B 21 27.709 3.964 76.331 1.00 11.33 O ATOM 1895 CB GLU B 21 29.897 1.527 77.108 1.00 12.62 C ATOM 1896 CG GLU B 21 30.489 2.535 77.983 1.00 13.01 C ATOM 1897 CD GLU B 21 31.470 1.888 78.997 1.00 13.16 C ATOM 1898 OE1 GLU B 21 31.144 1.820 80.210 1.00 15.61 O ATOM 1899 OE2 GLU B 21 32.595 1.489 78.511 1.00 12.30 O ATOM 1900 HA GLU B 21 28.736 1.043 75.504 1.00 0.00 H ATOM 1901 HB2 GLU B 21 29.287 0.875 77.734 1.00 0.00 H ATOM 1902 HB3 GLU B 21 30.717 0.952 76.677 1.00 0.00 H ATOM 1903 HG2 GLU B 21 31.031 3.260 77.376 1.00 0.00 H ATOM 1904 HG3 GLU B 21 29.695 3.043 78.530 1.00 0.00 H ATOM 1905 H GLU B 21 29.865 3.807 75.098 1.00 0.00 H ATOM 1906 N ALA B 22 26.788 1.996 76.817 1.00 9.31 N ATOM 1907 CA ALA B 22 25.514 2.592 77.157 1.00 8.61 C ATOM 1908 C ALA B 22 24.827 1.725 78.213 1.00 8.41 C ATOM 1909 O ALA B 22 25.090 0.534 78.356 1.00 9.23 O ATOM 1910 CB ALA B 22 24.610 2.661 75.929 1.00 9.56 C ATOM 1911 HA ALA B 22 25.688 3.600 77.534 1.00 0.00 H ATOM 1912 HB1 ALA B 22 25.090 3.266 75.160 1.00 0.00 H ATOM 1913 HB2 ALA B 22 24.440 1.654 75.548 1.00 0.00 H ATOM 1914 HB3 ALA B 22 23.657 3.112 76.206 1.00 0.00 H ATOM 1915 H ALA B 22 26.913 0.967 76.904 1.00 0.00 H ATOM 1916 N LEU B 23 23.921 2.374 78.932 1.00 8.47 N ATOM 1917 CA LEU B 23 23.196 1.781 80.062 1.00 8.71 C ATOM 1918 C LEU B 23 21.915 1.154 79.553 1.00 8.63 C ATOM 1919 O LEU B 23 21.082 1.852 78.944 1.00 10.22 O ATOM 1920 CB LEU B 23 22.939 2.953 81.038 1.00 10.07 C ATOM 1921 CG LEU B 23 22.249 2.607 82.332 1.00 12.05 C ATOM 1922 CD1 LEU B 23 23.184 1.769 83.166 1.00 15.16 C ATOM 1923 CD2 LEU B 23 21.866 3.930 83.034 1.00 14.03 C ATOM 1924 HA LEU B 23 23.746 0.987 80.566 1.00 0.00 H ATOM 1925 HB2 LEU B 23 23.903 3.398 81.284 1.00 0.00 H ATOM 1926 HB3 LEU B 23 22.323 3.688 80.520 1.00 0.00 H ATOM 1927 HG LEU B 23 21.340 2.028 82.169 1.00 0.00 H ATOM 1928 HD21 LEU B 23 22.768 4.510 83.230 1.00 0.00 H ATOM 1929 HD22 LEU B 23 21.197 4.501 82.390 1.00 0.00 H ATOM 1930 HD23 LEU B 23 21.364 3.708 83.976 1.00 0.00 H ATOM 1931 HD11 LEU B 23 23.435 0.858 82.623 1.00 0.00 H ATOM 1932 HD12 LEU B 23 24.093 2.335 83.369 1.00 0.00 H ATOM 1933 HD13 LEU B 23 22.697 1.511 84.107 1.00 0.00 H ATOM 1934 H LEU B 23 23.712 3.361 78.680 1.00 0.00 H ATOM 1935 N LEU B 24 21.676 -0.102 79.872 1.00 8.80 N ATOM 1936 CA LEU B 24 20.402 -0.759 79.570 1.00 9.04 C ATOM 1937 C LEU B 24 19.362 -0.281 80.599 1.00 9.11 C ATOM 1938 O LEU B 24 19.480 -0.577 81.770 1.00 10.81 O ATOM 1939 CB LEU B 24 20.563 -2.244 79.611 1.00 10.22 C ATOM 1940 CG LEU B 24 21.584 -2.841 78.691 1.00 11.37 C ATOM 1941 CD1 LEU B 24 21.566 -4.349 78.860 1.00 19.82 C ATOM 1942 CD2 LEU B 24 21.377 -2.404 77.232 1.00 17.37 C ATOM 1943 HA LEU B 24 20.066 -0.498 78.566 1.00 0.00 H ATOM 1944 HB2 LEU B 24 20.837 -2.518 80.630 1.00 0.00 H ATOM 1945 HB3 LEU B 24 19.598 -2.687 79.364 1.00 0.00 H ATOM 1946 HG LEU B 24 22.573 -2.469 78.958 1.00 0.00 H ATOM 1947 HD21 LEU B 24 20.390 -2.722 76.895 1.00 0.00 H ATOM 1948 HD22 LEU B 24 21.453 -1.319 77.165 1.00 0.00 H ATOM 1949 HD23 LEU B 24 22.141 -2.863 76.605 1.00 0.00 H ATOM 1950 HD11 LEU B 24 21.805 -4.600 79.893 1.00 0.00 H ATOM 1951 HD12 LEU B 24 20.575 -4.729 78.612 1.00 0.00 H ATOM 1952 HD13 LEU B 24 22.305 -4.797 78.196 1.00 0.00 H ATOM 1953 H LEU B 24 22.419 -0.646 80.356 1.00 0.00 H ATOM 1954 N ASP B 25 18.389 0.498 80.135 1.00 9.13 N ATOM 1955 CA ASP B 25 17.509 1.277 81.020 1.00 8.83 C ATOM 1956 C ASP B 25 16.039 0.951 80.772 1.00 8.84 C ATOM 1957 O ASP B 25 15.385 1.492 79.882 1.00 9.11 O ATOM 1958 CB ASP B 25 17.746 2.777 80.836 1.00 10.06 C ATOM 1959 CG ASP B 25 16.978 3.649 81.748 1.00 10.34 C ATOM 1960 OD1 ASP B 25 16.145 3.109 82.521 1.00 12.25 O ATOM 1961 OD2 ASP B 25 17.147 4.868 81.657 1.00 13.55 O ATOM 1962 HA ASP B 25 17.753 1.002 82.046 1.00 0.00 H ATOM 1963 HB2 ASP B 25 18.806 2.973 80.994 1.00 0.00 H ATOM 1964 HB3 ASP B 25 17.478 3.039 79.812 1.00 0.00 H ATOM 1965 H ASP B 25 18.245 0.559 79.107 1.00 0.00 H ATOM 1966 N THR B 26 15.495 0.047 81.578 1.00 8.36 N ATOM 1967 CA THR B 26 14.116 -0.351 81.425 1.00 8.07 C ATOM 1968 C THR B 26 13.118 0.740 81.803 1.00 8.19 C ATOM 1969 O THR B 26 11.937 0.617 81.491 1.00 9.12 O ATOM 1970 CB THR B 26 13.805 -1.629 82.230 1.00 8.24 C ATOM 1971 OG1 THR B 26 14.071 -1.384 83.618 1.00 8.62 O ATOM 1972 CG2 THR B 26 14.691 -2.772 81.771 1.00 9.28 C ATOM 1973 HA THR B 26 13.995 -0.548 80.360 1.00 0.00 H ATOM 1974 HB THR B 26 12.759 -1.894 82.076 1.00 0.00 H ATOM 1975 HG1 THR B 26 13.499 -0.641 83.936 1.00 0.00 H ATOM 1976 HG23 THR B 26 14.504 -2.974 80.716 1.00 0.00 H ATOM 1977 HG21 THR B 26 15.737 -2.498 81.910 1.00 0.00 H ATOM 1978 HG22 THR B 26 14.467 -3.662 82.358 1.00 0.00 H ATOM 1979 H THR B 26 16.071 -0.381 82.331 1.00 0.00 H ATOM 1980 N GLY B 27 13.577 1.766 82.484 1.00 8.65 N ATOM 1981 CA GLY B 27 12.760 2.888 82.805 1.00 9.20 C ATOM 1982 C GLY B 27 12.638 3.953 81.750 1.00 8.91 C ATOM 1983 O GLY B 27 11.910 4.949 81.951 1.00 10.26 O ATOM 1984 HA3 GLY B 27 13.173 3.354 83.700 1.00 0.00 H ATOM 1985 HA2 GLY B 27 11.758 2.518 83.019 1.00 0.00 H ATOM 1986 H GLY B 27 14.568 1.759 82.799 1.00 0.00 H ATOM 1987 N ALA B 28 13.364 3.819 80.635 1.00 9.03 N ATOM 1988 CA ALA B 28 13.339 4.792 79.557 1.00 8.91 C ATOM 1989 C ALA B 28 12.494 4.263 78.407 1.00 8.56 C ATOM 1990 O ALA B 28 12.708 3.162 77.928 1.00 9.37 O ATOM 1991 CB ALA B 28 14.745 5.047 79.055 1.00 9.86 C ATOM 1992 HA ALA B 28 12.912 5.721 79.934 1.00 0.00 H ATOM 1993 HB1 ALA B 28 15.357 5.431 79.871 1.00 0.00 H ATOM 1994 HB2 ALA B 28 15.173 4.114 78.687 1.00 0.00 H ATOM 1995 HB3 ALA B 28 14.714 5.778 78.247 1.00 0.00 H ATOM 1996 H ALA B 28 13.973 2.982 80.535 1.00 0.00 H ATOM 1997 N ASP B 29 11.528 5.065 77.942 1.00 8.70 N ATOM 1998 CA ASP B 29 10.715 4.627 76.800 1.00 8.80 C ATOM 1999 C ASP B 29 11.545 4.528 75.521 1.00 8.97 C ATOM 2000 O ASP B 29 11.333 3.630 74.729 1.00 10.63 O ATOM 2001 CB ASP B 29 9.586 5.619 76.566 1.00 10.57 C ATOM 2002 CG ASP B 29 8.558 5.748 77.647 1.00 10.35 C ATOM 2003 OD1 ASP B 29 8.408 4.831 78.518 1.00 10.57 O ATOM 2004 OD2 ASP B 29 7.820 6.745 77.640 1.00 14.48 O ATOM 2005 HA ASP B 29 10.320 3.639 77.038 1.00 0.00 H ATOM 2006 HB2 ASP B 29 10.036 6.601 76.421 1.00 0.00 H ATOM 2007 HB3 ASP B 29 9.069 5.320 75.654 1.00 0.00 H ATOM 2008 H ASP B 29 11.355 5.990 78.385 1.00 0.00 H ATOM 2009 N ASP B 30 12.494 5.442 75.362 1.00 9.82 N ATOM 2010 CA ASP B 30 13.319 5.456 74.106 1.00 8.67 C ATOM 2011 C ASP B 30 14.773 5.717 74.497 1.00 10.02 C ATOM 2012 O ASP B 30 15.168 6.146 75.575 1.00 10.10 O ATOM 2013 CB ASP B 30 12.809 6.533 73.161 1.00 9.54 C ATOM 2014 CG ASP B 30 11.530 6.312 72.448 1.00 13.65 C ATOM 2015 OD1 ASP B 30 11.549 5.444 71.557 1.00 14.98 O ATOM 2016 OD2 ASP B 30 10.591 7.133 72.594 1.00 34.46 O ATOM 2017 HA ASP B 30 13.245 4.499 73.589 1.00 0.00 H ATOM 2018 HB2 ASP B 30 12.696 7.445 73.747 1.00 0.00 H ATOM 2019 HB3 ASP B 30 13.577 6.683 72.402 1.00 0.00 H ATOM 2020 H ASP B 30 12.667 6.148 76.106 1.00 0.00 H ATOM 2021 N THR B 31 15.612 5.624 73.513 1.00 10.72 N ATOM 2022 CA THR B 31 17.052 5.606 73.588 1.00 9.13 C ATOM 2023 C THR B 31 17.608 7.024 73.417 1.00 8.93 C ATOM 2024 O THR B 31 17.169 7.737 72.487 1.00 9.99 O ATOM 2025 CB THR B 31 17.574 4.678 72.486 1.00 9.31 C ATOM 2026 OG1 THR B 31 17.179 3.340 72.826 1.00 10.13 O ATOM 2027 CG2 THR B 31 19.044 4.740 72.329 1.00 9.24 C ATOM 2028 HA THR B 31 17.378 5.240 74.562 1.00 0.00 H ATOM 2029 HB THR B 31 17.151 4.997 71.533 1.00 0.00 H ATOM 2030 HG1 THR B 31 16.192 3.292 72.880 1.00 0.00 H ATOM 2031 HG23 THR B 31 19.338 5.757 72.071 1.00 0.00 H ATOM 2032 HG21 THR B 31 19.521 4.449 73.265 1.00 0.00 H ATOM 2033 HG22 THR B 31 19.352 4.059 71.536 1.00 0.00 H ATOM 2034 H THR B 31 15.199 5.554 72.561 1.00 0.00 H ATOM 2035 N VAL B 32 18.491 7.448 74.318 1.00 9.11 N ATOM 2036 CA VAL B 32 19.072 8.786 74.283 1.00 9.71 C ATOM 2037 C VAL B 32 20.566 8.686 74.482 1.00 9.11 C ATOM 2038 O VAL B 32 21.036 8.085 75.428 1.00 10.02 O ATOM 2039 CB VAL B 32 18.500 9.569 75.550 1.00 9.39 C ATOM 2040 CG1 VAL B 32 18.818 11.051 75.403 1.00 9.65 C ATOM 2041 CG2 VAL B 32 16.995 9.384 75.764 1.00 9.81 C ATOM 2042 HA VAL B 32 18.841 9.276 73.337 1.00 0.00 H ATOM 2043 HB VAL B 32 18.986 9.146 76.429 1.00 0.00 H ATOM 2044 HG11 VAL B 32 19.898 11.185 75.344 1.00 0.00 H ATOM 2045 HG12 VAL B 32 18.353 11.433 74.494 1.00 0.00 H ATOM 2046 HG13 VAL B 32 18.430 11.592 76.266 1.00 0.00 H ATOM 2047 HG21 VAL B 32 16.457 9.748 74.888 1.00 0.00 H ATOM 2048 HG22 VAL B 32 16.778 8.326 75.912 1.00 0.00 H ATOM 2049 HG23 VAL B 32 16.683 9.947 76.644 1.00 0.00 H ATOM 2050 H VAL B 32 18.779 6.799 75.078 1.00 0.00 H ATOM 2051 N LEU B 33 21.289 9.267 73.527 1.00 9.71 N ATOM 2052 CA LEU B 33 22.737 9.230 73.487 1.00 9.95 C ATOM 2053 C LEU B 33 23.319 10.627 73.558 1.00 10.11 C ATOM 2054 O LEU B 33 22.675 11.584 73.120 1.00 10.91 O ATOM 2055 CB LEU B 33 23.252 8.520 72.236 1.00 11.16 C ATOM 2056 CG LEU B 33 22.758 7.092 72.036 1.00 12.12 C ATOM 2057 CD1 LEU B 33 23.325 6.518 70.744 1.00 15.00 C ATOM 2058 CD2 LEU B 33 23.054 6.174 73.206 1.00 13.87 C ATOM 2059 HA LEU B 33 23.063 8.664 74.360 1.00 0.00 H ATOM 2060 HB2 LEU B 33 22.946 9.105 71.369 1.00 0.00 H ATOM 2061 HB3 LEU B 33 24.340 8.494 72.290 1.00 0.00 H ATOM 2062 HG LEU B 33 21.671 7.147 71.969 1.00 0.00 H ATOM 2063 HD21 LEU B 33 24.131 6.126 73.365 1.00 0.00 H ATOM 2064 HD22 LEU B 33 22.570 6.562 74.102 1.00 0.00 H ATOM 2065 HD23 LEU B 33 22.672 5.176 72.989 1.00 0.00 H ATOM 2066 HD11 LEU B 33 23.001 7.130 69.903 1.00 0.00 H ATOM 2067 HD12 LEU B 33 24.414 6.517 70.796 1.00 0.00 H ATOM 2068 HD13 LEU B 33 22.965 5.498 70.612 1.00 0.00 H ATOM 2069 H LEU B 33 20.788 9.774 72.770 1.00 0.00 H ATOM 2070 N GLU B 34 24.521 10.743 74.073 1.00 11.87 N ATOM 2071 CA GLU B 34 25.236 12.005 74.148 1.00 13.54 C ATOM 2072 C GLU B 34 25.543 12.428 72.721 1.00 13.85 C ATOM 2073 O GLU B 34 25.498 11.678 71.755 1.00 14.10 O ATOM 2074 CB GLU B 34 26.564 11.864 74.946 1.00 18.21 C ATOM 2075 CG GLU B 34 26.326 11.303 76.349 1.00 22.53 C ATOM 2076 CD GLU B 34 27.451 11.408 77.337 1.00 38.23 C ATOM 2077 OE1 GLU B 34 28.047 12.485 77.535 1.00 60.76 O ATOM 2078 OE2 GLU B 34 27.604 10.408 78.068 1.00 49.32 O ATOM 2079 HA GLU B 34 24.625 12.744 74.666 1.00 0.00 H ATOM 2080 HB2 GLU B 34 27.231 11.193 74.406 1.00 0.00 H ATOM 2081 HB3 GLU B 34 27.030 12.846 75.032 1.00 0.00 H ATOM 2082 HG2 GLU B 34 25.470 11.830 76.771 1.00 0.00 H ATOM 2083 HG3 GLU B 34 26.083 10.246 76.241 1.00 0.00 H ATOM 2084 H GLU B 34 24.984 9.889 74.446 1.00 0.00 H ATOM 2085 N GLU B 35 25.889 13.746 72.576 1.00 15.28 N ATOM 2086 CA GLU B 35 26.194 14.328 71.294 1.00 15.27 C ATOM 2087 C GLU B 35 27.104 13.500 70.401 1.00 15.71 C ATOM 2088 O GLU B 35 28.161 13.007 70.791 1.00 17.04 O ATOM 2089 CB GLU B 35 26.818 15.706 71.447 1.00 17.36 C ATOM 2090 CG GLU B 35 27.053 16.394 70.102 1.00 17.10 C ATOM 2091 CD GLU B 35 25.738 16.503 69.330 1.00 18.75 C ATOM 2092 OE1 GLU B 35 24.795 17.160 69.804 1.00 22.92 O ATOM 2093 OE2 GLU B 35 25.617 16.004 68.197 1.00 23.65 O ATOM 2094 HA GLU B 35 25.222 14.380 70.803 1.00 0.00 H ATOM 2095 HB2 GLU B 35 26.152 16.327 72.046 1.00 0.00 H ATOM 2096 HB3 GLU B 35 27.775 15.602 71.959 1.00 0.00 H ATOM 2097 HG2 GLU B 35 27.455 17.393 70.273 1.00 0.00 H ATOM 2098 HG3 GLU B 35 27.766 15.812 69.519 1.00 0.00 H ATOM 2099 H GLU B 35 25.933 14.348 73.423 1.00 0.00 H ATOM 2100 N MET B 36 26.643 13.270 69.179 1.00 16.54 N ATOM 2101 CA MET B 36 27.332 12.491 68.175 1.00 15.82 C ATOM 2102 C MET B 36 26.668 12.785 66.826 1.00 17.31 C ATOM 2103 O MET B 36 25.606 13.374 66.742 1.00 19.21 O ATOM 2104 CB MET B 36 27.203 11.004 68.496 1.00 16.11 C ATOM 2105 CG MET B 36 25.794 10.455 68.345 1.00 18.67 C ATOM 2106 SD MET B 36 25.712 8.658 68.489 1.00 21.62 S ATOM 2107 CE MET B 36 26.662 8.218 67.042 1.00 23.44 C ATOM 2108 HA MET B 36 28.391 12.750 68.149 1.00 0.00 H ATOM 2109 HB2 MET B 36 27.860 10.451 67.825 1.00 0.00 H ATOM 2110 HB3 MET B 36 27.523 10.847 69.526 1.00 0.00 H ATOM 2111 HG2 MET B 36 25.413 10.742 67.365 1.00 0.00 H ATOM 2112 HG3 MET B 36 25.166 10.894 69.120 1.00 0.00 H ATOM 2113 HE1 MET B 36 26.177 8.622 66.154 1.00 0.00 H ATOM 2114 HE2 MET B 36 27.667 8.632 67.129 1.00 0.00 H ATOM 2115 HE3 MET B 36 26.721 7.132 66.964 1.00 0.00 H ATOM 2116 H MET B 36 25.721 13.679 68.925 1.00 0.00 H ATOM 2117 N SER B 37 27.381 12.398 65.782 1.00 18.40 N ATOM 2118 CA SER B 37 26.853 12.490 64.414 1.00 18.68 C ATOM 2119 C SER B 37 26.063 11.239 64.003 1.00 16.49 C ATOM 2120 O SER B 37 26.518 10.121 64.221 1.00 20.71 O ATOM 2121 CB SER B 37 28.067 12.612 63.469 1.00 26.42 C ATOM 2122 OG SER B 37 28.730 13.811 63.788 1.00 32.49 O ATOM 2123 HA SER B 37 26.178 13.344 64.359 1.00 0.00 H ATOM 2124 HB2 SER B 37 27.731 12.636 62.432 1.00 0.00 H ATOM 2125 HB3 SER B 37 28.738 11.765 63.613 1.00 0.00 H ATOM 2126 HG SER B 37 28.112 14.573 63.659 1.00 0.00 H ATOM 2127 H SER B 37 28.338 12.020 65.933 1.00 0.00 H ATOM 2128 N LEU B 38 24.927 11.437 63.375 1.00 15.84 N ATOM 2129 CA LEU B 38 24.080 10.369 62.843 1.00 14.08 C ATOM 2130 C LEU B 38 23.532 10.804 61.474 1.00 14.55 C ATOM 2131 O LEU B 38 23.370 12.003 61.265 1.00 15.77 O ATOM 2132 CB LEU B 38 22.890 10.029 63.760 1.00 12.74 C ATOM 2133 CG LEU B 38 23.243 9.325 65.061 1.00 13.49 C ATOM 2134 CD1 LEU B 38 22.043 9.169 65.977 1.00 13.65 C ATOM 2135 CD2 LEU B 38 23.933 7.985 64.817 1.00 16.25 C ATOM 2136 HA LEU B 38 24.700 9.476 62.766 1.00 0.00 H ATOM 2137 HB2 LEU B 38 22.382 10.960 64.010 1.00 0.00 H ATOM 2138 HB3 LEU B 38 22.211 9.384 63.203 1.00 0.00 H ATOM 2139 HG LEU B 38 23.955 9.971 65.575 1.00 0.00 H ATOM 2140 HD21 LEU B 38 23.270 7.335 64.246 1.00 0.00 H ATOM 2141 HD22 LEU B 38 24.854 8.149 64.257 1.00 0.00 H ATOM 2142 HD23 LEU B 38 24.166 7.518 65.774 1.00 0.00 H ATOM 2143 HD11 LEU B 38 21.645 10.153 66.223 1.00 0.00 H ATOM 2144 HD12 LEU B 38 21.276 8.581 65.472 1.00 0.00 H ATOM 2145 HD13 LEU B 38 22.349 8.661 66.891 1.00 0.00 H ATOM 2146 H LEU B 38 24.608 12.419 63.247 1.00 0.00 H ATOM 2147 N PRO B 39 23.219 9.821 60.637 1.00 15.99 N ATOM 2148 CA PRO B 39 22.688 10.108 59.315 1.00 16.97 C ATOM 2149 C PRO B 39 21.213 10.456 59.316 1.00 15.47 C ATOM 2150 O PRO B 39 20.450 9.996 60.170 1.00 16.96 O ATOM 2151 CB PRO B 39 22.889 8.801 58.537 1.00 20.54 C ATOM 2152 CG PRO B 39 22.763 7.770 59.599 1.00 20.52 C ATOM 2153 CD PRO B 39 23.423 8.368 60.822 1.00 17.37 C ATOM 2154 HA PRO B 39 23.192 10.975 58.888 1.00 0.00 H ATOM 2155 HD3 PRO B 39 22.943 8.018 61.736 1.00 0.00 H ATOM 2156 HD2 PRO B 39 24.485 8.123 60.854 1.00 0.00 H ATOM 2157 HG3 PRO B 39 23.271 6.852 59.302 1.00 0.00 H ATOM 2158 HG2 PRO B 39 21.713 7.555 59.799 1.00 0.00 H ATOM 2159 HB2 PRO B 39 22.122 8.675 57.773 1.00 0.00 H ATOM 2160 HB3 PRO B 39 23.874 8.768 58.070 1.00 0.00 H ATOM 2161 N GLY B 40 20.797 11.166 58.277 1.00 16.90 N ATOM 2162 CA GLY B 40 19.373 11.376 57.989 1.00 17.97 C ATOM 2163 C GLY B 40 18.922 12.702 58.600 1.00 14.37 C ATOM 2164 O GLY B 40 19.640 13.438 59.259 1.00 14.62 O ATOM 2165 HA3 GLY B 40 18.791 10.561 58.418 1.00 0.00 H ATOM 2166 HA2 GLY B 40 19.220 11.402 56.910 1.00 0.00 H ATOM 2167 H GLY B 40 21.505 11.589 57.643 1.00 0.00 H ATOM 2168 N ARG B 41 17.652 12.967 58.399 1.00 14.51 N ATOM 2169 CA ARG B 41 16.954 14.108 58.948 1.00 13.58 C ATOM 2170 C ARG B 41 16.696 13.857 60.427 1.00 12.88 C ATOM 2171 O ARG B 41 16.491 12.723 60.873 1.00 17.94 O ATOM 2172 CB ARG B 41 15.581 14.233 58.282 1.00 16.09 C ATOM 2173 CG ARG B 41 15.696 14.617 56.787 1.00 18.70 C ATOM 2174 CD ARG B 41 16.309 15.959 56.615 1.00 19.18 C ATOM 2175 NE ARG B 41 16.020 16.404 55.245 1.00 25.35 N ATOM 2176 CZ ARG B 41 16.851 16.730 54.291 1.00 18.07 C ATOM 2177 NH1 ARG B 41 16.336 17.056 53.117 1.00 23.32 N ATOM 2178 NH2 ARG B 41 18.181 16.693 54.430 1.00 24.05 N ATOM 2179 HA ARG B 41 17.553 15.004 58.787 1.00 0.00 H ATOM 2180 HB2 ARG B 41 15.062 13.278 58.362 1.00 0.00 H ATOM 2181 HB3 ARG B 41 15.007 15.001 58.800 1.00 0.00 H ATOM 2182 HG2 ARG B 41 16.314 13.877 56.278 1.00 0.00 H ATOM 2183 HG3 ARG B 41 14.700 14.623 56.345 1.00 0.00 H ATOM 2184 HD2 ARG B 41 17.387 15.899 56.768 1.00 0.00 H ATOM 2185 HD3 ARG B 41 15.880 16.659 57.332 1.00 0.00 H ATOM 2186 HE ARG B 41 15.011 16.469 55.000 1.00 0.00 H ATOM 2187 HH12 ARG B 41 16.962 17.322 52.330 1.00 0.00 H ATOM 2188 HH11 ARG B 41 15.305 17.046 52.981 1.00 0.00 H ATOM 2189 HH22 ARG B 41 18.795 16.964 53.635 1.00 0.00 H ATOM 2190 HH21 ARG B 41 18.601 16.393 55.333 1.00 0.00 H ATOM 2191 H ARG B 41 17.110 12.310 57.803 1.00 0.00 H ATOM 2192 N TRP B 42 16.738 14.919 61.207 1.00 11.28 N ATOM 2193 CA TRP B 42 16.351 14.881 62.619 1.00 10.89 C ATOM 2194 C TRP B 42 15.179 15.816 62.836 1.00 10.05 C ATOM 2195 O TRP B 42 14.911 16.717 62.065 1.00 10.49 O ATOM 2196 CB TRP B 42 17.494 15.208 63.552 1.00 11.25 C ATOM 2197 CG TRP B 42 18.095 16.562 63.362 1.00 11.33 C ATOM 2198 CD1 TRP B 42 19.143 16.895 62.543 1.00 12.69 C ATOM 2199 CD2 TRP B 42 17.688 17.799 63.982 1.00 10.72 C ATOM 2200 NE1 TRP B 42 19.380 18.254 62.588 1.00 13.29 N ATOM 2201 CE2 TRP B 42 18.535 18.822 63.476 1.00 11.52 C ATOM 2202 CE3 TRP B 42 16.701 18.112 64.902 1.00 10.93 C ATOM 2203 CZ2 TRP B 42 18.354 20.119 63.893 1.00 12.60 C ATOM 2204 CZ3 TRP B 42 16.545 19.424 65.337 1.00 12.55 C ATOM 2205 CH2 TRP B 42 17.404 20.412 64.818 1.00 12.67 C ATOM 2206 HA TRP B 42 16.058 13.859 62.861 1.00 0.00 H ATOM 2207 HB2 TRP B 42 17.125 15.142 64.576 1.00 0.00 H ATOM 2208 HB3 TRP B 42 18.278 14.465 63.401 1.00 0.00 H ATOM 2209 HE1 TRP B 42 20.095 18.760 62.028 1.00 0.00 H ATOM 2210 HD1 TRP B 42 19.710 16.185 61.940 1.00 0.00 H ATOM 2211 HZ2 TRP B 42 18.975 20.914 63.480 1.00 0.00 H ATOM 2212 HH2 TRP B 42 17.304 21.439 65.168 1.00 0.00 H ATOM 2213 HZ3 TRP B 42 15.775 19.682 66.064 1.00 0.00 H ATOM 2214 HE3 TRP B 42 16.046 17.330 65.285 1.00 0.00 H ATOM 2215 H TRP B 42 17.059 15.822 60.803 1.00 0.00 H ATOM 2216 N LYS B 43 14.442 15.516 63.935 1.00 9.75 N ATOM 2217 CA LYS B 43 13.335 16.342 64.343 1.00 10.41 C ATOM 2218 C LYS B 43 13.525 16.769 65.781 1.00 9.83 C ATOM 2219 O LYS B 43 13.985 15.983 66.615 1.00 10.11 O ATOM 2220 CB LYS B 43 11.993 15.601 64.245 1.00 13.05 C ATOM 2221 CG LYS B 43 11.613 15.125 62.887 1.00 17.12 C ATOM 2222 CD LYS B 43 10.313 14.328 62.893 1.00 32.88 C ATOM 2223 CE LYS B 43 10.161 13.610 61.545 1.00 43.23 C ATOM 2224 NZ LYS B 43 9.203 12.481 61.558 1.00 61.93 N ATOM 2225 HA LYS B 43 13.312 17.201 63.672 1.00 0.00 H ATOM 2226 HB2 LYS B 43 12.041 14.733 64.902 1.00 0.00 H ATOM 2227 HB3 LYS B 43 11.212 16.276 64.594 1.00 0.00 H ATOM 2228 HG2 LYS B 43 11.491 15.989 62.234 1.00 0.00 H ATOM 2229 HG3 LYS B 43 12.411 14.490 62.502 1.00 0.00 H ATOM 2230 HD2 LYS B 43 10.338 13.593 63.698 1.00 0.00 H ATOM 2231 HD3 LYS B 43 9.471 15.003 63.045 1.00 0.00 H ATOM 2232 HE2 LYS B 43 11.138 13.225 61.251 1.00 0.00 H ATOM 2233 HE3 LYS B 43 9.821 14.337 60.807 1.00 0.00 H ATOM 2234 HZ1 LYS B 43 9.517 11.769 62.248 1.00 0.00 H ATOM 2235 HZ2 LYS B 43 8.260 12.831 61.824 1.00 0.00 H ATOM 2236 HZ3 LYS B 43 9.161 12.053 60.611 1.00 0.00 H ATOM 2237 H LYS B 43 14.681 14.672 64.494 1.00 0.00 H ATOM 2238 N PRO B 44 13.179 18.002 66.123 1.00 9.80 N ATOM 2239 CA PRO B 44 13.300 18.460 67.517 1.00 9.45 C ATOM 2240 C PRO B 44 12.270 17.823 68.396 1.00 10.15 C ATOM 2241 O PRO B 44 11.075 17.783 68.055 1.00 13.50 O ATOM 2242 CB PRO B 44 13.142 19.969 67.434 1.00 10.94 C ATOM 2243 CG PRO B 44 12.316 20.176 66.200 1.00 11.06 C ATOM 2244 CD PRO B 44 12.700 19.111 65.271 1.00 10.13 C ATOM 2245 HA PRO B 44 14.252 18.181 67.968 1.00 0.00 H ATOM 2246 HD3 PRO B 44 11.842 18.794 64.678 1.00 0.00 H ATOM 2247 HD2 PRO B 44 13.494 19.452 64.606 1.00 0.00 H ATOM 2248 HG3 PRO B 44 12.525 21.153 65.764 1.00 0.00 H ATOM 2249 HG2 PRO B 44 11.255 20.106 66.439 1.00 0.00 H ATOM 2250 HB2 PRO B 44 12.628 20.355 68.315 1.00 0.00 H ATOM 2251 HB3 PRO B 44 14.112 20.456 67.338 1.00 0.00 H ATOM 2252 N LYS B 45 12.640 17.367 69.592 1.00 10.27 N ATOM 2253 CA LYS B 45 11.741 16.778 70.540 1.00 10.45 C ATOM 2254 C LYS B 45 12.150 17.164 71.943 1.00 10.12 C ATOM 2255 O LYS B 45 13.309 17.456 72.197 1.00 10.90 O ATOM 2256 CB LYS B 45 11.716 15.250 70.415 1.00 12.29 C ATOM 2257 CG LYS B 45 11.120 14.729 69.153 1.00 16.16 C ATOM 2258 CD LYS B 45 9.659 15.039 68.924 1.00 22.73 C ATOM 2259 CE LYS B 45 9.265 14.652 67.500 1.00 27.16 C ATOM 2260 NZ LYS B 45 9.165 13.190 67.319 1.00 44.23 N ATOM 2261 HA LYS B 45 10.739 17.153 70.330 1.00 0.00 H ATOM 2262 HB2 LYS B 45 12.742 14.889 70.478 1.00 0.00 H ATOM 2263 HB3 LYS B 45 11.140 14.852 71.250 1.00 0.00 H ATOM 2264 HG2 LYS B 45 11.684 15.151 68.321 1.00 0.00 H ATOM 2265 HG3 LYS B 45 11.233 13.645 69.155 1.00 0.00 H ATOM 2266 HD2 LYS B 45 9.054 14.475 69.633 1.00 0.00 H ATOM 2267 HD3 LYS B 45 9.488 16.106 69.070 1.00 0.00 H ATOM 2268 HE2 LYS B 45 10.016 15.039 66.812 1.00 0.00 H ATOM 2269 HE3 LYS B 45 8.298 15.100 67.270 1.00 0.00 H ATOM 2270 HZ1 LYS B 45 10.085 12.752 67.528 1.00 0.00 H ATOM 2271 HZ2 LYS B 45 8.445 12.810 67.966 1.00 0.00 H ATOM 2272 HZ3 LYS B 45 8.895 12.981 66.337 1.00 0.00 H ATOM 2273 H LYS B 45 13.644 17.443 69.854 1.00 0.00 H ATOM 2274 N MET B 46 11.188 17.137 72.864 1.00 11.77 N ATOM 2275 CA MET B 46 11.432 17.306 74.281 1.00 13.56 C ATOM 2276 C MET B 46 11.134 15.970 74.978 1.00 12.50 C ATOM 2277 O MET B 46 10.076 15.384 74.710 1.00 16.38 O ATOM 2278 CB MET B 46 10.462 18.298 74.875 1.00 19.74 C ATOM 2279 CG MET B 46 10.333 19.618 74.190 1.00 21.98 C ATOM 2280 SD MET B 46 11.772 20.588 74.466 1.00 32.70 S ATOM 2281 CE MET B 46 12.135 20.568 76.164 1.00 21.50 C ATOM 2282 HA MET B 46 12.460 17.643 74.415 1.00 0.00 H ATOM 2283 HB2 MET B 46 9.477 17.832 74.878 1.00 0.00 H ATOM 2284 HB3 MET B 46 10.775 18.490 75.901 1.00 0.00 H ATOM 2285 HG2 MET B 46 9.463 20.144 74.583 1.00 0.00 H ATOM 2286 HG3 MET B 46 10.206 19.458 73.119 1.00 0.00 H ATOM 2287 HE1 MET B 46 11.294 20.984 76.719 1.00 0.00 H ATOM 2288 HE2 MET B 46 12.311 19.541 76.484 1.00 0.00 H ATOM 2289 HE3 MET B 46 13.027 21.166 76.351 1.00 0.00 H ATOM 2290 H MET B 46 10.209 16.986 72.548 1.00 0.00 H ATOM 2291 N ILE B 47 11.968 15.592 75.894 1.00 10.99 N ATOM 2292 CA ILE B 47 11.738 14.379 76.683 1.00 11.70 C ATOM 2293 C ILE B 47 11.900 14.721 78.181 1.00 11.20 C ATOM 2294 O ILE B 47 12.695 15.589 78.530 1.00 13.33 O ATOM 2295 CB ILE B 47 12.662 13.228 76.274 1.00 12.73 C ATOM 2296 CG1 ILE B 47 14.141 13.571 76.419 1.00 13.77 C ATOM 2297 CG2 ILE B 47 12.334 12.718 74.896 1.00 14.80 C ATOM 2298 CD1 ILE B 47 15.089 12.397 76.267 1.00 15.45 C ATOM 2299 HA ILE B 47 10.724 14.030 76.491 1.00 0.00 H ATOM 2300 HB ILE B 47 12.473 12.417 76.977 1.00 0.00 H ATOM 2301 HG12 ILE B 47 14.393 14.310 75.659 1.00 0.00 H ATOM 2302 HG13 ILE B 47 14.293 14.003 77.408 1.00 0.00 H ATOM 2303 HD11 ILE B 47 14.865 11.650 77.028 1.00 0.00 H ATOM 2304 HD12 ILE B 47 14.965 11.958 75.277 1.00 0.00 H ATOM 2305 HD13 ILE B 47 16.116 12.743 76.387 1.00 0.00 H ATOM 2306 HG21 ILE B 47 11.305 12.358 74.879 1.00 0.00 H ATOM 2307 HG22 ILE B 47 12.449 13.526 74.174 1.00 0.00 H ATOM 2308 HG23 ILE B 47 13.011 11.902 74.641 1.00 0.00 H ATOM 2309 H ILE B 47 12.819 16.162 76.073 1.00 0.00 H ATOM 2310 N GLY B 48 11.123 14.021 78.975 1.00 13.03 N ATOM 2311 CA GLY B 48 11.120 14.276 80.400 1.00 14.59 C ATOM 2312 C GLY B 48 11.643 13.093 81.200 1.00 12.27 C ATOM 2313 O GLY B 48 11.436 11.938 80.933 1.00 14.94 O ATOM 2314 HA3 GLY B 48 10.099 14.489 80.716 1.00 0.00 H ATOM 2315 HA2 GLY B 48 11.750 15.142 80.603 1.00 0.00 H ATOM 2316 H GLY B 48 10.508 13.281 78.579 1.00 0.00 H ATOM 2317 N GLY B 49 12.368 13.455 82.228 1.00 13.37 N ATOM 2318 CA GLY B 49 13.025 12.555 83.131 1.00 15.80 C ATOM 2319 C GLY B 49 12.662 12.936 84.554 1.00 13.07 C ATOM 2320 O GLY B 49 11.822 13.750 84.831 1.00 15.91 O ATOM 2321 HA3 GLY B 49 14.104 12.625 82.997 1.00 0.00 H ATOM 2322 HA2 GLY B 49 12.701 11.534 82.931 1.00 0.00 H ATOM 2323 H GLY B 49 12.476 14.474 82.404 1.00 0.00 H ATOM 2324 N ILE B 50 13.428 12.407 85.500 1.00 13.59 N ATOM 2325 CA ILE B 50 13.157 12.656 86.850 1.00 15.38 C ATOM 2326 C ILE B 50 13.239 14.088 87.235 1.00 15.30 C ATOM 2327 O ILE B 50 12.581 14.518 88.171 1.00 18.10 O ATOM 2328 CB ILE B 50 14.061 11.782 87.724 1.00 15.33 C ATOM 2329 CG1 ILE B 50 13.450 11.581 89.096 1.00 19.37 C ATOM 2330 CG2 ILE B 50 15.504 12.193 87.700 1.00 18.26 C ATOM 2331 CD1 ILE B 50 14.035 10.378 89.829 1.00 24.35 C ATOM 2332 HA ILE B 50 12.114 12.388 87.018 1.00 0.00 H ATOM 2333 HB ILE B 50 14.106 10.788 87.279 1.00 0.00 H ATOM 2334 HG12 ILE B 50 13.630 12.475 89.693 1.00 0.00 H ATOM 2335 HG13 ILE B 50 12.376 11.432 88.982 1.00 0.00 H ATOM 2336 HD11 ILE B 50 13.853 9.475 89.246 1.00 0.00 H ATOM 2337 HD12 ILE B 50 15.108 10.519 89.958 1.00 0.00 H ATOM 2338 HD13 ILE B 50 13.560 10.283 90.806 1.00 0.00 H ATOM 2339 HG21 ILE B 50 15.881 12.132 86.679 1.00 0.00 H ATOM 2340 HG22 ILE B 50 15.595 13.217 88.061 1.00 0.00 H ATOM 2341 HG23 ILE B 50 16.081 11.528 88.342 1.00 0.00 H ATOM 2342 H ILE B 50 14.234 11.804 85.237 1.00 0.00 H ATOM 2343 N GLY B 51 14.129 14.852 86.607 1.00 15.52 N ATOM 2344 CA GLY B 51 14.340 16.256 86.997 1.00 16.12 C ATOM 2345 C GLY B 51 13.655 17.307 86.151 1.00 16.85 C ATOM 2346 O GLY B 51 13.610 18.495 86.542 1.00 22.08 O ATOM 2347 HA3 GLY B 51 15.412 16.451 86.963 1.00 0.00 H ATOM 2348 HA2 GLY B 51 13.984 16.372 88.021 1.00 0.00 H ATOM 2349 H GLY B 51 14.686 14.450 85.826 1.00 0.00 H ATOM 2350 N GLY B 52 13.036 16.953 85.078 1.00 15.10 N ATOM 2351 CA GLY B 52 12.411 17.889 84.133 1.00 15.22 C ATOM 2352 C GLY B 52 12.684 17.444 82.694 1.00 13.13 C ATOM 2353 O GLY B 52 12.963 16.287 82.454 1.00 14.16 O ATOM 2354 HA3 GLY B 52 12.823 18.886 84.287 1.00 0.00 H ATOM 2355 HA2 GLY B 52 11.335 17.912 84.306 1.00 0.00 H ATOM 2356 H GLY B 52 12.974 15.937 84.866 1.00 0.00 H ATOM 2357 N PHE B 53 12.563 18.382 81.797 1.00 12.33 N ATOM 2358 CA PHE B 53 12.667 18.130 80.375 1.00 12.36 C ATOM 2359 C PHE B 53 13.984 18.566 79.796 1.00 12.04 C ATOM 2360 O PHE B 53 14.589 19.584 80.193 1.00 14.26 O ATOM 2361 CB PHE B 53 11.513 18.827 79.630 1.00 14.48 C ATOM 2362 CG PHE B 53 10.148 18.133 79.806 1.00 14.76 C ATOM 2363 CD1 PHE B 53 9.698 17.167 78.904 1.00 16.08 C ATOM 2364 CD2 PHE B 53 9.340 18.466 80.877 1.00 17.50 C ATOM 2365 CE1 PHE B 53 8.479 16.532 79.043 1.00 17.93 C ATOM 2366 CE2 PHE B 53 8.118 17.844 81.034 1.00 18.59 C ATOM 2367 CZ PHE B 53 7.711 16.895 80.125 1.00 19.78 C ATOM 2368 HA PHE B 53 12.602 17.050 80.242 1.00 0.00 H ATOM 2369 HB2 PHE B 53 11.430 19.848 80.003 1.00 0.00 H ATOM 2370 HB3 PHE B 53 11.753 18.848 78.567 1.00 0.00 H ATOM 2371 HD2 PHE B 53 9.667 19.218 81.595 1.00 0.00 H ATOM 2372 HE2 PHE B 53 7.477 18.104 81.876 1.00 0.00 H ATOM 2373 HZ PHE B 53 6.744 16.413 80.267 1.00 0.00 H ATOM 2374 HE1 PHE B 53 8.142 15.780 78.330 1.00 0.00 H ATOM 2375 HD1 PHE B 53 10.333 16.904 78.058 1.00 0.00 H ATOM 2376 H PHE B 53 12.384 19.355 82.117 1.00 0.00 H ATOM 2377 N ILE B 54 14.453 17.876 78.739 1.00 10.75 N ATOM 2378 CA ILE B 54 15.591 18.289 77.906 1.00 10.52 C ATOM 2379 C ILE B 54 15.188 18.272 76.442 1.00 10.27 C ATOM 2380 O ILE B 54 14.253 17.548 76.030 1.00 11.22 O ATOM 2381 CB ILE B 54 16.870 17.438 78.129 1.00 11.66 C ATOM 2382 CG1 ILE B 54 16.685 15.993 77.703 1.00 12.65 C ATOM 2383 CG2 ILE B 54 17.293 17.530 79.600 1.00 12.78 C ATOM 2384 CD1 ILE B 54 17.971 15.190 77.657 1.00 14.17 C ATOM 2385 HA ILE B 54 15.851 19.302 78.212 1.00 0.00 H ATOM 2386 HB ILE B 54 17.661 17.844 77.498 1.00 0.00 H ATOM 2387 HG12 ILE B 54 16.006 15.513 78.408 1.00 0.00 H ATOM 2388 HG13 ILE B 54 16.240 15.984 76.708 1.00 0.00 H ATOM 2389 HD11 ILE B 54 18.659 15.648 76.947 1.00 0.00 H ATOM 2390 HD12 ILE B 54 18.425 15.177 78.648 1.00 0.00 H ATOM 2391 HD13 ILE B 54 17.750 14.170 77.344 1.00 0.00 H ATOM 2392 HG21 ILE B 54 17.498 18.570 79.853 1.00 0.00 H ATOM 2393 HG22 ILE B 54 16.489 17.153 80.232 1.00 0.00 H ATOM 2394 HG23 ILE B 54 18.191 16.932 79.757 1.00 0.00 H ATOM 2395 H ILE B 54 13.975 16.986 78.494 1.00 0.00 H ATOM 2396 N LYS B 55 15.879 19.068 75.652 1.00 10.45 N ATOM 2397 CA LYS B 55 15.752 19.093 74.205 1.00 9.91 C ATOM 2398 C LYS B 55 16.711 18.069 73.560 1.00 10.05 C ATOM 2399 O LYS B 55 17.892 17.994 73.917 1.00 12.10 O ATOM 2400 CB LYS B 55 16.164 20.500 73.697 1.00 10.28 C ATOM 2401 CG LYS B 55 15.141 21.553 74.071 1.00 10.66 C ATOM 2402 CD LYS B 55 15.605 22.947 73.551 1.00 10.23 C ATOM 2403 CE LYS B 55 14.493 23.947 73.801 1.00 11.92 C ATOM 2404 NZ LYS B 55 14.880 25.324 73.421 1.00 12.81 N ATOM 2405 HA LYS B 55 14.722 18.854 73.940 1.00 0.00 H ATOM 2406 HB2 LYS B 55 17.124 20.768 74.138 1.00 0.00 H ATOM 2407 HB3 LYS B 55 16.260 20.470 72.612 1.00 0.00 H ATOM 2408 HG2 LYS B 55 14.180 21.300 73.622 1.00 0.00 H ATOM 2409 HG3 LYS B 55 15.036 21.587 75.155 1.00 0.00 H ATOM 2410 HD2 LYS B 55 16.505 23.257 74.082 1.00 0.00 H ATOM 2411 HD3 LYS B 55 15.816 22.890 72.483 1.00 0.00 H ATOM 2412 HE2 LYS B 55 14.241 23.933 74.861 1.00 0.00 H ATOM 2413 HE3 LYS B 55 13.620 23.654 73.217 1.00 0.00 H ATOM 2414 HZ1 LYS B 55 15.708 25.616 73.978 1.00 0.00 H ATOM 2415 HZ2 LYS B 55 15.115 25.350 72.408 1.00 0.00 H ATOM 2416 HZ3 LYS B 55 14.088 25.970 73.610 1.00 0.00 H ATOM 2417 H LYS B 55 16.559 19.720 76.092 1.00 0.00 H ATOM 2418 N VAL B 56 16.163 17.307 72.620 1.00 9.87 N ATOM 2419 CA VAL B 56 16.939 16.304 71.913 1.00 9.61 C ATOM 2420 C VAL B 56 16.635 16.376 70.418 1.00 9.14 C ATOM 2421 O VAL B 56 15.613 16.943 69.983 1.00 9.92 O ATOM 2422 CB VAL B 56 16.591 14.888 72.402 1.00 10.36 C ATOM 2423 CG1 VAL B 56 17.048 14.728 73.863 1.00 12.59 C ATOM 2424 CG2 VAL B 56 15.152 14.503 72.156 1.00 11.94 C ATOM 2425 HA VAL B 56 17.993 16.505 72.104 1.00 0.00 H ATOM 2426 HB VAL B 56 17.143 14.166 71.800 1.00 0.00 H ATOM 2427 HG11 VAL B 56 18.125 14.881 73.924 1.00 0.00 H ATOM 2428 HG12 VAL B 56 16.539 15.465 74.484 1.00 0.00 H ATOM 2429 HG13 VAL B 56 16.802 13.725 74.211 1.00 0.00 H ATOM 2430 HG21 VAL B 56 14.496 15.200 72.678 1.00 0.00 H ATOM 2431 HG22 VAL B 56 14.945 14.540 71.086 1.00 0.00 H ATOM 2432 HG23 VAL B 56 14.979 13.492 72.526 1.00 0.00 H ATOM 2433 H VAL B 56 15.157 17.431 72.386 1.00 0.00 H ATOM 2434 N ARG B 57 17.525 15.820 69.617 1.00 9.28 N ATOM 2435 CA ARG B 57 17.308 15.621 68.200 1.00 9.53 C ATOM 2436 C ARG B 57 16.913 14.154 67.987 1.00 9.21 C ATOM 2437 O ARG B 57 17.629 13.260 68.395 1.00 10.03 O ATOM 2438 CB ARG B 57 18.580 15.930 67.397 1.00 9.87 C ATOM 2439 CG ARG B 57 19.171 17.314 67.598 1.00 11.18 C ATOM 2440 CD ARG B 57 20.206 17.655 66.547 1.00 11.46 C ATOM 2441 NE ARG B 57 21.262 16.687 66.303 1.00 12.22 N ATOM 2442 CZ ARG B 57 22.365 16.455 66.983 1.00 12.30 C ATOM 2443 NH1 ARG B 57 22.578 17.151 68.092 1.00 15.10 N ATOM 2444 NH2 ARG B 57 23.229 15.524 66.599 1.00 15.33 N ATOM 2445 HA ARG B 57 16.523 16.294 67.854 1.00 0.00 H ATOM 2446 HB2 ARG B 57 19.338 15.199 67.677 1.00 0.00 H ATOM 2447 HB3 ARG B 57 18.343 15.818 66.339 1.00 0.00 H ATOM 2448 HG2 ARG B 57 18.367 18.049 67.550 1.00 0.00 H ATOM 2449 HG3 ARG B 57 19.642 17.355 68.580 1.00 0.00 H ATOM 2450 HD2 ARG B 57 20.682 18.588 66.848 1.00 0.00 H ATOM 2451 HD3 ARG B 57 19.678 17.806 65.606 1.00 0.00 H ATOM 2452 HE ARG B 57 21.126 16.087 65.465 1.00 0.00 H ATOM 2453 HH12 ARG B 57 23.441 16.989 68.650 1.00 0.00 H ATOM 2454 HH11 ARG B 57 21.882 17.858 68.404 1.00 0.00 H ATOM 2455 HH22 ARG B 57 24.094 15.358 67.152 1.00 0.00 H ATOM 2456 HH21 ARG B 57 23.041 14.960 65.745 1.00 0.00 H ATOM 2457 H ARG B 57 18.429 15.509 70.026 1.00 0.00 H ATOM 2458 N GLN B 58 15.787 13.957 67.333 1.00 9.46 N ATOM 2459 CA GLN B 58 15.279 12.610 67.032 1.00 9.55 C ATOM 2460 C GLN B 58 15.665 12.149 65.651 1.00 9.73 C ATOM 2461 O GLN B 58 15.291 12.799 64.662 1.00 10.96 O ATOM 2462 CB GLN B 58 13.762 12.605 67.167 1.00 9.84 C ATOM 2463 CG GLN B 58 13.154 11.260 66.801 1.00 11.62 C ATOM 2464 CD GLN B 58 11.671 11.314 66.977 1.00 15.80 C ATOM 2465 OE1 GLN B 58 11.168 11.596 68.036 1.00 23.25 O ATOM 2466 NE2 GLN B 58 10.976 11.250 65.864 1.00 35.85 N ATOM 2467 HA GLN B 58 15.729 11.918 67.744 1.00 0.00 H ATOM 2468 HB2 GLN B 58 13.501 12.839 68.199 1.00 0.00 H ATOM 2469 HB3 GLN B 58 13.349 13.368 66.507 1.00 0.00 H ATOM 2470 HG2 GLN B 58 13.388 11.027 65.762 1.00 0.00 H ATOM 2471 HG3 GLN B 58 13.568 10.487 67.448 1.00 0.00 H ATOM 2472 HE22 GLN B 58 11.447 11.003 64.970 1.00 0.00 H ATOM 2473 HE21 GLN B 58 9.955 11.446 65.877 1.00 0.00 H ATOM 2474 H GLN B 58 15.238 14.782 67.019 1.00 0.00 H ATOM 2475 N TYR B 59 16.386 11.044 65.562 1.00 10.07 N ATOM 2476 CA TYR B 59 16.758 10.362 64.327 1.00 10.49 C ATOM 2477 C TYR B 59 15.976 9.048 64.250 1.00 11.55 C ATOM 2478 O TYR B 59 15.830 8.356 65.230 1.00 13.52 O ATOM 2479 CB TYR B 59 18.249 10.068 64.263 1.00 11.19 C ATOM 2480 CG TYR B 59 19.097 11.323 64.232 1.00 11.32 C ATOM 2481 CD1 TYR B 59 19.499 11.977 65.398 1.00 11.17 C ATOM 2482 CD2 TYR B 59 19.588 11.813 63.032 1.00 11.47 C ATOM 2483 CE1 TYR B 59 20.318 13.090 65.333 1.00 11.16 C ATOM 2484 CE2 TYR B 59 20.384 12.940 62.965 1.00 11.79 C ATOM 2485 CZ TYR B 59 20.740 13.591 64.134 1.00 11.69 C ATOM 2486 OH TYR B 59 21.565 14.686 64.134 1.00 12.85 O ATOM 2487 HA TYR B 59 16.519 11.013 63.486 1.00 0.00 H ATOM 2488 HB3 TYR B 59 18.451 9.489 63.362 1.00 0.00 H ATOM 2489 HB2 TYR B 59 18.526 9.482 65.139 1.00 0.00 H ATOM 2490 HD2 TYR B 59 19.337 11.291 62.109 1.00 0.00 H ATOM 2491 HE2 TYR B 59 20.729 13.313 62.001 1.00 0.00 H ATOM 2492 HE1 TYR B 59 20.633 13.577 66.256 1.00 0.00 H ATOM 2493 HD1 TYR B 59 19.165 11.608 66.368 1.00 0.00 H ATOM 2494 HH TYR B 59 21.154 15.408 63.595 1.00 0.00 H ATOM 2495 H TYR B 59 16.718 10.623 66.453 1.00 0.00 H ATOM 2496 N ASP B 60 15.481 8.725 63.069 1.00 13.38 N ATOM 2497 CA ASP B 60 14.652 7.551 62.858 1.00 14.82 C ATOM 2498 C ASP B 60 15.406 6.445 62.148 1.00 13.81 C ATOM 2499 O ASP B 60 16.346 6.657 61.368 1.00 15.72 O ATOM 2500 CB ASP B 60 13.335 7.892 62.176 1.00 20.00 C ATOM 2501 CG ASP B 60 12.465 8.723 63.133 1.00 27.58 C ATOM 2502 OD1 ASP B 60 12.438 8.518 64.389 1.00 33.78 O ATOM 2503 OD2 ASP B 60 11.885 9.707 62.643 1.00 45.81 O ATOM 2504 HA ASP B 60 14.393 7.165 63.844 1.00 0.00 H ATOM 2505 HB2 ASP B 60 13.532 8.467 61.271 1.00 0.00 H ATOM 2506 HB3 ASP B 60 12.812 6.972 61.914 1.00 0.00 H ATOM 2507 H ASP B 60 15.694 9.337 62.256 1.00 0.00 H ATOM 2508 N GLN B 61 15.040 5.219 62.482 1.00 14.39 N ATOM 2509 CA GLN B 61 15.566 4.029 61.822 1.00 17.42 C ATOM 2510 C GLN B 61 17.084 3.947 61.793 1.00 15.47 C ATOM 2511 O GLN B 61 17.683 3.652 60.764 1.00 18.48 O ATOM 2512 CB GLN B 61 15.035 3.954 60.394 1.00 24.13 C ATOM 2513 CG GLN B 61 13.544 4.137 60.325 1.00 27.73 C ATOM 2514 CD GLN B 61 12.736 3.130 61.080 1.00 35.03 C ATOM 2515 OE1 GLN B 61 11.541 3.363 61.302 1.00 50.36 O ATOM 2516 NE2 GLN B 61 13.257 1.978 61.447 1.00 36.15 N ATOM 2517 HA GLN B 61 15.222 3.184 62.418 1.00 0.00 H ATOM 2518 HB2 GLN B 61 15.511 4.735 59.802 1.00 0.00 H ATOM 2519 HB3 GLN B 61 15.288 2.979 59.977 1.00 0.00 H ATOM 2520 HG2 GLN B 61 13.308 5.124 60.723 1.00 0.00 H ATOM 2521 HG3 GLN B 61 13.248 4.088 59.277 1.00 0.00 H ATOM 2522 HE22 GLN B 61 14.261 1.779 61.262 1.00 0.00 H ATOM 2523 HE21 GLN B 61 12.665 1.267 61.922 1.00 0.00 H ATOM 2524 H GLN B 61 14.347 5.098 63.248 1.00 0.00 H ATOM 2525 N ILE B 62 17.655 4.183 62.942 1.00 13.25 N ATOM 2526 CA ILE B 62 19.091 4.089 63.162 1.00 12.80 C ATOM 2527 C ILE B 62 19.481 2.683 63.590 1.00 13.46 C ATOM 2528 O ILE B 62 18.806 2.076 64.419 1.00 14.66 O ATOM 2529 CB ILE B 62 19.495 5.110 64.233 1.00 12.10 C ATOM 2530 CG1 ILE B 62 19.202 6.537 63.757 1.00 12.86 C ATOM 2531 CG2 ILE B 62 20.942 4.950 64.685 1.00 13.40 C ATOM 2532 CD1 ILE B 62 19.953 6.988 62.547 1.00 16.03 C ATOM 2533 HA ILE B 62 19.615 4.307 62.231 1.00 0.00 H ATOM 2534 HB ILE B 62 18.884 4.912 65.113 1.00 0.00 H ATOM 2535 HG12 ILE B 62 18.137 6.603 63.533 1.00 0.00 H ATOM 2536 HG13 ILE B 62 19.443 7.218 64.573 1.00 0.00 H ATOM 2537 HD11 ILE B 62 21.023 6.948 62.750 1.00 0.00 H ATOM 2538 HD12 ILE B 62 19.716 6.333 61.709 1.00 0.00 H ATOM 2539 HD13 ILE B 62 19.666 8.011 62.303 1.00 0.00 H ATOM 2540 HG21 ILE B 62 21.082 3.954 65.104 1.00 0.00 H ATOM 2541 HG22 ILE B 62 21.605 5.083 63.830 1.00 0.00 H ATOM 2542 HG23 ILE B 62 21.170 5.700 65.443 1.00 0.00 H ATOM 2543 H ILE B 62 17.051 4.453 63.745 1.00 0.00 H ATOM 2544 N LEU B 63 20.553 2.191 63.009 1.00 15.00 N ATOM 2545 CA LEU B 63 21.121 0.905 63.429 1.00 16.21 C ATOM 2546 C LEU B 63 22.037 1.030 64.618 1.00 15.36 C ATOM 2547 O LEU B 63 22.938 1.833 64.681 1.00 14.18 O ATOM 2548 CB LEU B 63 21.943 0.306 62.288 1.00 20.03 C ATOM 2549 CG LEU B 63 22.596 -1.025 62.636 1.00 24.45 C ATOM 2550 CD1 LEU B 63 21.688 -2.141 63.109 1.00 27.29 C ATOM 2551 CD2 LEU B 63 23.266 -1.483 61.340 1.00 35.15 C ATOM 2552 HA LEU B 63 20.276 0.273 63.700 1.00 0.00 H ATOM 2553 HB2 LEU B 63 21.285 0.153 61.433 1.00 0.00 H ATOM 2554 HB3 LEU B 63 22.727 1.014 62.020 1.00 0.00 H ATOM 2555 HG LEU B 63 23.253 -0.844 63.487 1.00 0.00 H ATOM 2556 HD21 LEU B 63 22.511 -1.594 60.562 1.00 0.00 H ATOM 2557 HD22 LEU B 63 24.002 -0.740 61.031 1.00 0.00 H ATOM 2558 HD23 LEU B 63 23.761 -2.439 61.507 1.00 0.00 H ATOM 2559 HD11 LEU B 63 21.169 -1.826 64.014 1.00 0.00 H ATOM 2560 HD12 LEU B 63 20.959 -2.369 62.331 1.00 0.00 H ATOM 2561 HD13 LEU B 63 22.285 -3.028 63.321 1.00 0.00 H ATOM 2562 H LEU B 63 21.006 2.723 62.238 1.00 0.00 H ATOM 2563 N ILE B 64 21.874 0.144 65.575 1.00 18.18 N ATOM 2564 CA ILE B 64 22.652 0.049 66.807 1.00 17.49 C ATOM 2565 C ILE B 64 22.859 -1.452 67.019 1.00 15.28 C ATOM 2566 O ILE B 64 21.921 -2.209 66.984 1.00 24.43 O ATOM 2567 CB ILE B 64 22.243 0.685 68.177 1.00 15.26 C ATOM 2568 CG1 ILE B 64 21.810 2.165 68.144 1.00 13.63 C ATOM 2569 CG2 ILE B 64 23.242 0.515 69.269 1.00 12.50 C ATOM 2570 CD1 ILE B 64 21.707 2.867 69.476 1.00 14.67 C ATOM 2571 HA ILE B 64 23.497 0.702 66.589 1.00 0.00 H ATOM 2572 HB ILE B 64 21.358 0.089 68.400 1.00 0.00 H ATOM 2573 HG12 ILE B 64 22.535 2.709 67.538 1.00 0.00 H ATOM 2574 HG13 ILE B 64 20.831 2.213 67.667 1.00 0.00 H ATOM 2575 HD11 ILE B 64 20.973 2.355 70.099 1.00 0.00 H ATOM 2576 HD12 ILE B 64 22.679 2.851 69.970 1.00 0.00 H ATOM 2577 HD13 ILE B 64 21.395 3.899 69.318 1.00 0.00 H ATOM 2578 HG21 ILE B 64 23.402 -0.548 69.451 1.00 0.00 H ATOM 2579 HG22 ILE B 64 24.183 0.980 68.975 1.00 0.00 H ATOM 2580 HG23 ILE B 64 22.870 0.988 70.177 1.00 0.00 H ATOM 2581 H ILE B 64 21.118 -0.557 65.442 1.00 0.00 H ATOM 2582 N GLU B 65 24.106 -1.871 67.225 1.00 11.66 N ATOM 2583 CA GLU B 65 24.355 -3.256 67.657 1.00 12.27 C ATOM 2584 C GLU B 65 24.643 -3.208 69.163 1.00 12.70 C ATOM 2585 O GLU B 65 25.527 -2.452 69.631 1.00 15.09 O ATOM 2586 CB GLU B 65 25.534 -3.819 66.895 1.00 16.65 C ATOM 2587 CG GLU B 65 25.218 -3.949 65.421 1.00 23.15 C ATOM 2588 CD GLU B 65 26.376 -4.223 64.511 1.00 29.89 C ATOM 2589 OE1 GLU B 65 27.263 -4.963 64.975 1.00 43.24 O ATOM 2590 OE2 GLU B 65 26.346 -3.751 63.354 1.00 42.04 O ATOM 2591 HA GLU B 65 23.498 -3.900 67.459 1.00 0.00 H ATOM 2592 HB2 GLU B 65 26.389 -3.154 67.019 1.00 0.00 H ATOM 2593 HB3 GLU B 65 25.780 -4.803 67.295 1.00 0.00 H ATOM 2594 HG2 GLU B 65 24.505 -4.766 65.306 1.00 0.00 H ATOM 2595 HG3 GLU B 65 24.756 -3.016 65.098 1.00 0.00 H ATOM 2596 H GLU B 65 24.904 -1.220 67.081 1.00 0.00 H ATOM 2597 N ILE B 66 23.839 -3.926 69.923 1.00 11.40 N ATOM 2598 CA ILE B 66 23.898 -3.905 71.379 1.00 11.66 C ATOM 2599 C ILE B 66 24.432 -5.238 71.848 1.00 12.74 C ATOM 2600 O ILE B 66 23.751 -6.261 71.624 1.00 12.58 O ATOM 2601 CB ILE B 66 22.483 -3.653 71.962 1.00 11.84 C ATOM 2602 CG1 ILE B 66 21.912 -2.340 71.460 1.00 13.74 C ATOM 2603 CG2 ILE B 66 22.542 -3.675 73.472 1.00 13.81 C ATOM 2604 CD1 ILE B 66 20.420 -2.219 71.615 1.00 14.75 C ATOM 2605 HA ILE B 66 24.552 -3.103 71.721 1.00 0.00 H ATOM 2606 HB ILE B 66 21.819 -4.448 71.624 1.00 0.00 H ATOM 2607 HG12 ILE B 66 22.381 -1.528 72.015 1.00 0.00 H ATOM 2608 HG13 ILE B 66 22.155 -2.243 70.402 1.00 0.00 H ATOM 2609 HD11 ILE B 66 19.932 -3.017 71.055 1.00 0.00 H ATOM 2610 HD12 ILE B 66 20.158 -2.301 72.670 1.00 0.00 H ATOM 2611 HD13 ILE B 66 20.093 -1.252 71.232 1.00 0.00 H ATOM 2612 HG21 ILE B 66 22.903 -4.648 73.806 1.00 0.00 H ATOM 2613 HG22 ILE B 66 23.220 -2.896 73.819 1.00 0.00 H ATOM 2614 HG23 ILE B 66 21.545 -3.497 73.876 1.00 0.00 H ATOM 2615 H ILE B 66 23.132 -4.534 69.463 1.00 0.00 H ATOM 2616 N CYS B 67 25.670 -5.274 72.363 1.00 13.65 N ATOM 2617 CA CYS B 67 26.295 -6.558 72.677 1.00 17.14 C ATOM 2618 C CYS B 67 26.238 -7.514 71.487 1.00 16.72 C ATOM 2619 O CYS B 67 25.992 -8.695 71.686 1.00 21.66 O ATOM 2620 CB CYS B 67 25.644 -7.375 73.782 1.00 17.22 C ATOM 2621 SG CYS B 67 25.951 -6.403 75.258 1.00 16.60 S ATOM 2622 HA CYS B 67 27.294 -6.239 72.976 1.00 0.00 H ATOM 2623 HB2 CYS B 67 26.104 -8.360 73.861 1.00 0.00 H ATOM 2624 HB3 CYS B 67 24.574 -7.488 73.605 1.00 0.00 H ATOM 2625 HG CYS B 67 27.312 -6.263 75.440 1.00 0.00 H ATOM 2626 H CYS B 67 26.186 -4.388 72.539 1.00 0.00 H ATOM 2627 N GLY B 68 26.435 -6.957 70.311 1.00 15.36 N ATOM 2628 CA GLY B 68 26.449 -7.807 69.142 1.00 18.07 C ATOM 2629 C GLY B 68 25.103 -8.098 68.521 1.00 17.04 C ATOM 2630 O GLY B 68 25.027 -8.794 67.474 1.00 26.22 O ATOM 2631 HA3 GLY B 68 26.899 -8.758 69.426 1.00 0.00 H ATOM 2632 HA2 GLY B 68 27.069 -7.325 68.386 1.00 0.00 H ATOM 2633 H GLY B 68 26.577 -5.930 70.225 1.00 0.00 H ATOM 2634 N HIS B 69 24.000 -7.648 69.103 1.00 13.14 N ATOM 2635 CA HIS B 69 22.645 -7.889 68.626 1.00 13.51 C ATOM 2636 C HIS B 69 22.120 -6.683 67.876 1.00 12.34 C ATOM 2637 O HIS B 69 22.133 -5.566 68.369 1.00 13.15 O ATOM 2638 CB HIS B 69 21.699 -8.197 69.779 1.00 12.52 C ATOM 2639 CG HIS B 69 22.080 -9.451 70.477 1.00 13.22 C ATOM 2640 ND1 HIS B 69 22.760 -9.628 71.631 1.00 16.64 N ATOM 2641 CD2 HIS B 69 21.862 -10.694 69.953 1.00 17.18 C ATOM 2642 CE1 HIS B 69 22.960 -10.931 71.846 1.00 16.28 C ATOM 2643 NE2 HIS B 69 22.413 -11.594 70.856 1.00 23.95 N ATOM 2644 HA HIS B 69 22.688 -8.750 67.958 1.00 0.00 H ATOM 2645 HB2 HIS B 69 21.728 -7.372 70.491 1.00 0.00 H ATOM 2646 HB3 HIS B 69 20.687 -8.302 69.388 1.00 0.00 H ATOM 2647 HD2 HIS B 69 21.358 -10.931 69.016 1.00 0.00 H ATOM 2648 HE1 HIS B 69 23.486 -11.367 72.696 1.00 0.00 H ATOM 2649 H HIS B 69 24.111 -7.079 69.967 1.00 0.00 H ATOM 2650 N LYS B 70 21.589 -6.879 66.662 1.00 13.60 N ATOM 2651 CA LYS B 70 21.116 -5.790 65.842 1.00 13.66 C ATOM 2652 C LYS B 70 19.783 -5.218 66.284 1.00 13.54 C ATOM 2653 O LYS B 70 18.852 -5.994 66.556 1.00 15.04 O ATOM 2654 CB LYS B 70 20.956 -6.299 64.383 1.00 21.39 C ATOM 2655 CG LYS B 70 20.566 -5.311 63.334 1.00 32.38 C ATOM 2656 CD LYS B 70 19.955 -6.014 62.129 1.00 39.20 C ATOM 2657 CE LYS B 70 18.649 -5.365 61.707 1.00 42.82 C ATOM 2658 NZ LYS B 70 17.570 -5.280 62.749 1.00 55.72 N ATOM 2659 HA LYS B 70 21.855 -4.994 65.932 1.00 0.00 H ATOM 2660 HB2 LYS B 70 21.911 -6.730 64.083 1.00 0.00 H ATOM 2661 HB3 LYS B 70 20.194 -7.079 64.393 1.00 0.00 H ATOM 2662 HG2 LYS B 70 19.837 -4.616 63.751 1.00 0.00 H ATOM 2663 HG3 LYS B 70 21.451 -4.759 63.016 1.00 0.00 H ATOM 2664 HD2 LYS B 70 20.658 -5.968 61.298 1.00 0.00 H ATOM 2665 HD3 LYS B 70 19.766 -7.056 62.385 1.00 0.00 H ATOM 2666 HE2 LYS B 70 18.253 -5.935 60.867 1.00 0.00 H ATOM 2667 HE3 LYS B 70 18.875 -4.350 61.381 1.00 0.00 H ATOM 2668 HZ1 LYS B 70 17.320 -6.238 63.067 1.00 0.00 H ATOM 2669 HZ2 LYS B 70 17.914 -4.724 63.558 1.00 0.00 H ATOM 2670 HZ3 LYS B 70 16.732 -4.819 62.341 1.00 0.00 H ATOM 2671 H LYS B 70 21.515 -7.850 66.298 1.00 0.00 H ATOM 2672 N ALA B 71 19.694 -3.921 66.303 1.00 13.70 N ATOM 2673 CA ALA B 71 18.425 -3.243 66.621 1.00 15.99 C ATOM 2674 C ALA B 71 18.357 -2.058 65.661 1.00 16.58 C ATOM 2675 O ALA B 71 19.336 -1.412 65.348 1.00 25.00 O ATOM 2676 CB ALA B 71 18.384 -2.829 68.090 1.00 17.24 C ATOM 2677 HA ALA B 71 17.556 -3.889 66.492 1.00 0.00 H ATOM 2678 HB1 ALA B 71 18.477 -3.715 68.718 1.00 0.00 H ATOM 2679 HB2 ALA B 71 19.209 -2.147 68.297 1.00 0.00 H ATOM 2680 HB3 ALA B 71 17.437 -2.331 68.299 1.00 0.00 H ATOM 2681 H ALA B 71 20.536 -3.350 66.089 1.00 0.00 H ATOM 2682 N ILE B 72 17.166 -1.757 65.192 1.00 13.17 N ATOM 2683 CA ILE B 72 16.943 -0.579 64.381 1.00 13.36 C ATOM 2684 C ILE B 72 15.772 0.186 64.963 1.00 12.92 C ATOM 2685 O ILE B 72 14.705 -0.400 65.258 1.00 16.71 O ATOM 2686 CB ILE B 72 16.623 -0.919 62.931 1.00 14.94 C ATOM 2687 CG1 ILE B 72 17.720 -1.731 62.225 1.00 21.25 C ATOM 2688 CG2 ILE B 72 16.275 0.350 62.142 1.00 18.32 C ATOM 2689 CD1 ILE B 72 17.359 -2.157 60.832 1.00 33.75 C ATOM 2690 HA ILE B 72 17.860 0.010 64.389 1.00 0.00 H ATOM 2691 HB ILE B 72 15.751 -1.572 62.958 1.00 0.00 H ATOM 2692 HG12 ILE B 72 18.621 -1.120 62.175 1.00 0.00 H ATOM 2693 HG13 ILE B 72 17.921 -2.624 62.816 1.00 0.00 H ATOM 2694 HD11 ILE B 72 16.465 -2.780 60.864 1.00 0.00 H ATOM 2695 HD12 ILE B 72 17.166 -1.274 60.222 1.00 0.00 H ATOM 2696 HD13 ILE B 72 18.184 -2.725 60.402 1.00 0.00 H ATOM 2697 HG21 ILE B 72 15.406 0.830 62.593 1.00 0.00 H ATOM 2698 HG22 ILE B 72 17.123 1.035 62.166 1.00 0.00 H ATOM 2699 HG23 ILE B 72 16.050 0.084 61.109 1.00 0.00 H ATOM 2700 H ILE B 72 16.363 -2.382 65.409 1.00 0.00 H ATOM 2701 N GLY B 73 15.934 1.479 65.180 1.00 11.69 N ATOM 2702 CA GLY B 73 14.828 2.230 65.730 1.00 13.17 C ATOM 2703 C GLY B 73 15.247 3.677 65.970 1.00 11.95 C ATOM 2704 O GLY B 73 16.284 4.146 65.512 1.00 13.17 O ATOM 2705 HA3 GLY B 73 14.521 1.781 66.675 1.00 0.00 H ATOM 2706 HA2 GLY B 73 13.993 2.207 65.030 1.00 0.00 H ATOM 2707 H GLY B 73 16.837 1.946 64.960 1.00 0.00 H ATOM 2708 N THR B 74 14.391 4.345 66.698 1.00 11.63 N ATOM 2709 CA THR B 74 14.613 5.757 66.991 1.00 11.79 C ATOM 2710 C THR B 74 15.751 5.961 67.970 1.00 10.65 C ATOM 2711 O THR B 74 15.831 5.255 68.981 1.00 11.11 O ATOM 2712 CB THR B 74 13.307 6.317 67.566 1.00 13.70 C ATOM 2713 OG1 THR B 74 12.336 6.176 66.501 1.00 19.90 O ATOM 2714 CG2 THR B 74 13.444 7.806 67.894 1.00 16.88 C ATOM 2715 HA THR B 74 14.895 6.278 66.076 1.00 0.00 H ATOM 2716 HB THR B 74 13.030 5.796 68.482 1.00 0.00 H ATOM 2717 HG1 THR B 74 12.638 6.690 65.711 1.00 0.00 H ATOM 2718 HG23 THR B 74 14.172 7.935 68.695 1.00 0.00 H ATOM 2719 HG21 THR B 74 13.780 8.343 67.007 1.00 0.00 H ATOM 2720 HG22 THR B 74 12.478 8.197 68.213 1.00 0.00 H ATOM 2721 H THR B 74 13.546 3.867 67.071 1.00 0.00 H ATOM 2722 N VAL B 75 16.581 6.950 67.701 1.00 10.61 N ATOM 2723 CA VAL B 75 17.665 7.324 68.603 1.00 10.34 C ATOM 2724 C VAL B 75 17.581 8.852 68.794 1.00 9.97 C ATOM 2725 O VAL B 75 17.503 9.590 67.813 1.00 11.44 O ATOM 2726 CB VAL B 75 19.046 6.902 68.086 1.00 12.03 C ATOM 2727 CG1 VAL B 75 20.173 7.465 68.888 1.00 13.25 C ATOM 2728 CG2 VAL B 75 19.086 5.384 67.969 1.00 13.16 C ATOM 2729 HA VAL B 75 17.548 6.800 69.552 1.00 0.00 H ATOM 2730 HB VAL B 75 19.195 7.330 67.095 1.00 0.00 H ATOM 2731 HG11 VAL B 75 20.129 8.554 68.859 1.00 0.00 H ATOM 2732 HG12 VAL B 75 20.089 7.124 69.920 1.00 0.00 H ATOM 2733 HG13 VAL B 75 21.120 7.127 68.468 1.00 0.00 H ATOM 2734 HG21 VAL B 75 18.907 4.941 68.949 1.00 0.00 H ATOM 2735 HG22 VAL B 75 18.315 5.054 67.273 1.00 0.00 H ATOM 2736 HG23 VAL B 75 20.065 5.075 67.602 1.00 0.00 H ATOM 2737 H VAL B 75 16.459 7.482 66.816 1.00 0.00 H ATOM 2738 N LEU B 76 17.522 9.251 70.035 1.00 9.44 N ATOM 2739 CA LEU B 76 17.518 10.663 70.444 1.00 9.84 C ATOM 2740 C LEU B 76 18.940 11.046 70.840 1.00 10.45 C ATOM 2741 O LEU B 76 19.640 10.272 71.464 1.00 13.40 O ATOM 2742 CB LEU B 76 16.561 10.860 71.592 1.00 10.02 C ATOM 2743 CG LEU B 76 15.162 10.272 71.403 1.00 10.28 C ATOM 2744 CD1 LEU B 76 14.310 10.450 72.647 1.00 11.97 C ATOM 2745 CD2 LEU B 76 14.465 10.803 70.175 1.00 12.25 C ATOM 2746 HA LEU B 76 17.187 11.301 69.625 1.00 0.00 H ATOM 2747 HB2 LEU B 76 17.001 10.399 72.477 1.00 0.00 H ATOM 2748 HB3 LEU B 76 16.454 11.932 71.758 1.00 0.00 H ATOM 2749 HG LEU B 76 15.298 9.203 71.242 1.00 0.00 H ATOM 2750 HD21 LEU B 76 14.364 11.885 70.256 1.00 0.00 H ATOM 2751 HD22 LEU B 76 15.052 10.557 69.290 1.00 0.00 H ATOM 2752 HD23 LEU B 76 13.477 10.349 70.095 1.00 0.00 H ATOM 2753 HD11 LEU B 76 14.786 9.945 73.487 1.00 0.00 H ATOM 2754 HD12 LEU B 76 14.211 11.513 72.869 1.00 0.00 H ATOM 2755 HD13 LEU B 76 13.323 10.020 72.475 1.00 0.00 H ATOM 2756 H LEU B 76 17.475 8.526 70.780 1.00 0.00 H ATOM 2757 N VAL B 77 19.371 12.264 70.437 1.00 9.56 N ATOM 2758 CA VAL B 77 20.692 12.781 70.733 1.00 10.15 C ATOM 2759 C VAL B 77 20.545 14.026 71.538 1.00 10.10 C ATOM 2760 O VAL B 77 19.863 14.973 71.151 1.00 10.92 O ATOM 2761 CB VAL B 77 21.533 13.008 69.490 1.00 10.87 C ATOM 2762 CG1 VAL B 77 22.896 13.596 69.790 1.00 11.91 C ATOM 2763 CG2 VAL B 77 21.679 11.693 68.703 1.00 12.42 C ATOM 2764 HA VAL B 77 21.236 12.032 71.309 1.00 0.00 H ATOM 2765 HB VAL B 77 21.005 13.745 68.884 1.00 0.00 H ATOM 2766 HG11 VAL B 77 22.774 14.559 70.286 1.00 0.00 H ATOM 2767 HG12 VAL B 77 23.447 12.918 70.442 1.00 0.00 H ATOM 2768 HG13 VAL B 77 23.445 13.733 68.858 1.00 0.00 H ATOM 2769 HG21 VAL B 77 22.164 10.946 69.332 1.00 0.00 H ATOM 2770 HG22 VAL B 77 20.692 11.336 68.408 1.00 0.00 H ATOM 2771 HG23 VAL B 77 22.284 11.869 67.814 1.00 0.00 H ATOM 2772 H VAL B 77 18.720 12.860 69.886 1.00 0.00 H ATOM 2773 N GLY B 78 21.165 14.102 72.703 1.00 11.46 N ATOM 2774 CA GLY B 78 21.038 15.288 73.567 1.00 12.37 C ATOM 2775 C GLY B 78 21.821 15.158 74.824 1.00 12.57 C ATOM 2776 O GLY B 78 22.604 14.206 74.991 1.00 14.88 O ATOM 2777 HA3 GLY B 78 19.987 15.426 73.821 1.00 0.00 H ATOM 2778 HA2 GLY B 78 21.395 16.160 73.020 1.00 0.00 H ATOM 2779 H GLY B 78 21.756 13.306 73.017 1.00 0.00 H ATOM 2780 N PRO B 79 21.658 16.127 75.724 1.00 14.58 N ATOM 2781 CA PRO B 79 22.540 16.313 76.874 1.00 16.67 C ATOM 2782 C PRO B 79 22.193 15.394 78.033 1.00 16.33 C ATOM 2783 O PRO B 79 22.243 15.766 79.196 1.00 21.35 O ATOM 2784 CB PRO B 79 22.349 17.806 77.260 1.00 17.73 C ATOM 2785 CG PRO B 79 20.937 18.059 76.841 1.00 17.77 C ATOM 2786 CD PRO B 79 20.784 17.292 75.553 1.00 15.31 C ATOM 2787 HA PRO B 79 23.573 16.066 76.631 1.00 0.00 H ATOM 2788 HD3 PRO B 79 19.749 16.982 75.408 1.00 0.00 H ATOM 2789 HD2 PRO B 79 21.104 17.895 74.703 1.00 0.00 H ATOM 2790 HG3 PRO B 79 20.767 19.123 76.679 1.00 0.00 H ATOM 2791 HG2 PRO B 79 20.239 17.692 77.594 1.00 0.00 H ATOM 2792 HB2 PRO B 79 22.477 17.958 78.332 1.00 0.00 H ATOM 2793 HB3 PRO B 79 23.044 18.447 76.718 1.00 0.00 H ATOM 2794 N THR B 80 22.016 14.099 77.732 1.00 16.59 N ATOM 2795 CA THR B 80 21.818 13.099 78.793 1.00 15.09 C ATOM 2796 C THR B 80 23.087 12.902 79.602 1.00 15.51 C ATOM 2797 O THR B 80 24.159 13.000 79.004 1.00 15.59 O ATOM 2798 CB THR B 80 21.405 11.765 78.137 1.00 14.61 C ATOM 2799 OG1 THR B 80 21.286 10.819 79.172 1.00 15.41 O ATOM 2800 CG2 THR B 80 22.356 11.233 77.071 1.00 13.62 C ATOM 2801 HA THR B 80 21.040 13.447 79.472 1.00 0.00 H ATOM 2802 HB THR B 80 20.472 11.946 77.604 1.00 0.00 H ATOM 2803 HG1 THR B 80 21.021 9.945 78.790 1.00 0.00 H ATOM 2804 HG23 THR B 80 22.448 11.966 76.269 1.00 0.00 H ATOM 2805 HG21 THR B 80 23.335 11.054 77.516 1.00 0.00 H ATOM 2806 HG22 THR B 80 21.963 10.300 76.668 1.00 0.00 H ATOM 2807 H THR B 80 22.019 13.798 76.737 1.00 0.00 H ATOM 2808 N PRO B 81 22.993 12.615 80.894 1.00 15.87 N ATOM 2809 CA PRO B 81 24.206 12.388 81.690 1.00 16.74 C ATOM 2810 C PRO B 81 24.976 11.137 81.233 1.00 15.12 C ATOM 2811 O PRO B 81 26.174 11.053 81.455 1.00 16.97 O ATOM 2812 CB PRO B 81 23.724 12.258 83.121 1.00 21.46 C ATOM 2813 CG PRO B 81 22.326 12.742 83.158 1.00 22.17 C ATOM 2814 CD PRO B 81 21.783 12.641 81.742 1.00 20.33 C ATOM 2815 HA PRO B 81 24.915 13.208 81.574 1.00 0.00 H ATOM 2816 HD3 PRO B 81 21.201 11.728 81.614 1.00 0.00 H ATOM 2817 HD2 PRO B 81 21.161 13.504 81.503 1.00 0.00 H ATOM 2818 HG3 PRO B 81 22.297 13.777 83.497 1.00 0.00 H ATOM 2819 HG2 PRO B 81 21.733 12.123 83.832 1.00 0.00 H ATOM 2820 HB2 PRO B 81 23.767 11.216 83.437 1.00 0.00 H ATOM 2821 HB3 PRO B 81 24.346 12.862 83.781 1.00 0.00 H ATOM 2822 N VAL B 82 24.312 10.140 80.671 1.00 14.85 N ATOM 2823 CA VAL B 82 24.877 8.847 80.297 1.00 13.40 C ATOM 2824 C VAL B 82 24.100 8.387 79.062 1.00 12.68 C ATOM 2825 O VAL B 82 22.911 8.625 78.898 1.00 14.37 O ATOM 2826 CB VAL B 82 24.602 7.921 81.518 1.00 15.38 C ATOM 2827 CG1 VAL B 82 24.850 6.441 81.305 1.00 17.99 C ATOM 2828 CG2 VAL B 82 25.438 8.274 82.775 1.00 16.85 C ATOM 2829 HA VAL B 82 25.942 8.857 80.065 1.00 0.00 H ATOM 2830 HB VAL B 82 23.537 8.107 81.656 1.00 0.00 H ATOM 2831 HG11 VAL B 82 24.209 6.078 80.501 1.00 0.00 H ATOM 2832 HG12 VAL B 82 25.895 6.284 81.037 1.00 0.00 H ATOM 2833 HG13 VAL B 82 24.624 5.900 82.224 1.00 0.00 H ATOM 2834 HG21 VAL B 82 26.499 8.191 82.539 1.00 0.00 H ATOM 2835 HG22 VAL B 82 25.212 9.294 83.085 1.00 0.00 H ATOM 2836 HG23 VAL B 82 25.189 7.584 83.581 1.00 0.00 H ATOM 2837 H VAL B 82 23.301 10.290 80.479 1.00 0.00 H ATOM 2838 N ASN B 83 24.769 7.652 78.180 1.00 11.82 N ATOM 2839 CA ASN B 83 24.081 7.009 77.096 1.00 10.55 C ATOM 2840 C ASN B 83 23.089 5.952 77.643 1.00 9.28 C ATOM 2841 O ASN B 83 23.517 5.135 78.437 1.00 10.67 O ATOM 2842 CB ASN B 83 25.070 6.287 76.200 1.00 10.86 C ATOM 2843 CG ASN B 83 25.996 7.158 75.411 1.00 11.87 C ATOM 2844 OD1 ASN B 83 25.681 8.289 75.072 1.00 14.28 O ATOM 2845 ND2 ASN B 83 27.188 6.680 75.134 1.00 12.24 N ATOM 2846 HA ASN B 83 23.550 7.778 76.536 1.00 0.00 H ATOM 2847 HB2 ASN B 83 25.678 5.637 76.829 1.00 0.00 H ATOM 2848 HB3 ASN B 83 24.501 5.680 75.496 1.00 0.00 H ATOM 2849 HD22 ASN B 83 27.443 5.716 75.428 1.00 0.00 H ATOM 2850 HD21 ASN B 83 27.877 7.266 74.620 1.00 0.00 H ATOM 2851 H ASN B 83 25.799 7.542 78.276 1.00 0.00 H ATOM 2852 N ILE B 84 21.852 6.012 77.171 1.00 9.51 N ATOM 2853 CA ILE B 84 20.785 5.120 77.659 1.00 9.81 C ATOM 2854 C ILE B 84 20.133 4.403 76.484 1.00 9.03 C ATOM 2855 O ILE B 84 19.705 5.009 75.513 1.00 10.32 O ATOM 2856 CB ILE B 84 19.695 6.082 78.223 1.00 10.81 C ATOM 2857 CG1 ILE B 84 20.250 6.752 79.491 1.00 11.69 C ATOM 2858 CG2 ILE B 84 18.393 5.345 78.436 1.00 12.64 C ATOM 2859 CD1 ILE B 84 19.420 7.886 80.019 1.00 16.18 C ATOM 2860 HA ILE B 84 21.174 4.395 78.374 1.00 0.00 H ATOM 2861 HB ILE B 84 19.461 6.872 77.510 1.00 0.00 H ATOM 2862 HG12 ILE B 84 20.324 5.994 80.271 1.00 0.00 H ATOM 2863 HG13 ILE B 84 21.244 7.136 79.264 1.00 0.00 H ATOM 2864 HD11 ILE B 84 19.345 8.664 79.259 1.00 0.00 H ATOM 2865 HD12 ILE B 84 18.423 7.521 80.267 1.00 0.00 H ATOM 2866 HD13 ILE B 84 19.891 8.294 80.913 1.00 0.00 H ATOM 2867 HG21 ILE B 84 18.048 4.938 77.486 1.00 0.00 H ATOM 2868 HG22 ILE B 84 18.549 4.532 79.146 1.00 0.00 H ATOM 2869 HG23 ILE B 84 17.647 6.035 78.830 1.00 0.00 H ATOM 2870 H ILE B 84 21.627 6.710 76.434 1.00 0.00 H ATOM 2871 N ILE B 85 20.077 3.077 76.599 1.00 8.37 N ATOM 2872 CA ILE B 85 19.306 2.239 75.685 1.00 8.26 C ATOM 2873 C ILE B 85 17.950 1.992 76.352 1.00 8.36 C ATOM 2874 O ILE B 85 17.868 1.361 77.393 1.00 9.54 O ATOM 2875 CB ILE B 85 19.997 0.902 75.397 1.00 9.01 C ATOM 2876 CG1 ILE B 85 21.447 1.084 74.929 1.00 10.90 C ATOM 2877 CG2 ILE B 85 19.128 0.124 74.412 1.00 10.52 C ATOM 2878 CD1 ILE B 85 21.585 1.999 73.731 1.00 12.97 C ATOM 2879 HA ILE B 85 19.203 2.745 74.725 1.00 0.00 H ATOM 2880 HB ILE B 85 20.088 0.322 76.315 1.00 0.00 H ATOM 2881 HG12 ILE B 85 22.025 1.503 75.752 1.00 0.00 H ATOM 2882 HG13 ILE B 85 21.850 0.106 74.665 1.00 0.00 H ATOM 2883 HD11 ILE B 85 21.021 1.587 72.894 1.00 0.00 H ATOM 2884 HD12 ILE B 85 21.196 2.986 73.982 1.00 0.00 H ATOM 2885 HD13 ILE B 85 22.637 2.080 73.457 1.00 0.00 H ATOM 2886 HG21 ILE B 85 18.146 -0.047 74.852 1.00 0.00 H ATOM 2887 HG22 ILE B 85 19.020 0.699 73.492 1.00 0.00 H ATOM 2888 HG23 ILE B 85 19.600 -0.833 74.191 1.00 0.00 H ATOM 2889 H ILE B 85 20.604 2.620 77.371 1.00 0.00 H ATOM 2890 N GLY B 86 16.906 2.505 75.735 1.00 8.12 N ATOM 2891 CA GLY B 86 15.590 2.393 76.268 1.00 8.38 C ATOM 2892 C GLY B 86 14.772 1.280 75.633 1.00 7.89 C ATOM 2893 O GLY B 86 15.267 0.519 74.795 1.00 8.22 O ATOM 2894 HA3 GLY B 86 15.071 3.338 76.108 1.00 0.00 H ATOM 2895 HA2 GLY B 86 15.666 2.199 77.338 1.00 0.00 H ATOM 2896 H GLY B 86 17.046 3.005 74.834 1.00 0.00 H ATOM 2897 N ARG B 87 13.505 1.189 76.036 1.00 7.98 N ATOM 2898 CA ARG B 87 12.695 0.050 75.673 1.00 7.93 C ATOM 2899 C ARG B 87 12.535 -0.130 74.194 1.00 8.12 C ATOM 2900 O ARG B 87 12.389 -1.237 73.690 1.00 8.89 O ATOM 2901 CB ARG B 87 11.319 0.102 76.356 1.00 8.40 C ATOM 2902 CG ARG B 87 11.417 -0.019 77.879 1.00 8.07 C ATOM 2903 CD ARG B 87 10.042 -0.165 78.527 1.00 8.29 C ATOM 2904 NE ARG B 87 9.191 0.994 78.321 1.00 8.58 N ATOM 2905 CZ ARG B 87 8.271 1.158 77.376 1.00 8.75 C ATOM 2906 NH1 ARG B 87 7.918 0.200 76.549 1.00 8.83 N ATOM 2907 NH2 ARG B 87 7.673 2.333 77.262 1.00 9.86 N ATOM 2908 HA ARG B 87 13.242 -0.821 76.034 1.00 0.00 H ATOM 2909 HB2 ARG B 87 10.842 1.051 76.110 1.00 0.00 H ATOM 2910 HB3 ARG B 87 10.709 -0.719 75.978 1.00 0.00 H ATOM 2911 HG2 ARG B 87 12.018 -0.894 78.126 1.00 0.00 H ATOM 2912 HG3 ARG B 87 11.900 0.875 78.274 1.00 0.00 H ATOM 2913 HD2 ARG B 87 10.177 -0.311 79.599 1.00 0.00 H ATOM 2914 HD3 ARG B 87 9.548 -1.039 78.102 1.00 0.00 H ATOM 2915 HE ARG B 87 9.315 1.783 78.987 1.00 0.00 H ATOM 2916 HH12 ARG B 87 7.192 0.379 75.826 1.00 0.00 H ATOM 2917 HH11 ARG B 87 8.364 -0.737 76.618 1.00 0.00 H ATOM 2918 HH22 ARG B 87 6.951 2.480 76.528 1.00 0.00 H ATOM 2919 HH21 ARG B 87 7.925 3.110 77.906 1.00 0.00 H ATOM 2920 H ARG B 87 13.095 1.947 76.618 1.00 0.00 H ATOM 2921 N ASN B 88 12.498 0.990 73.439 1.00 8.45 N ATOM 2922 CA ASN B 88 12.277 0.887 72.015 1.00 8.53 C ATOM 2923 C ASN B 88 13.317 0.018 71.343 1.00 8.69 C ATOM 2924 O ASN B 88 13.017 -0.597 70.311 1.00 9.90 O ATOM 2925 CB ASN B 88 12.250 2.273 71.365 1.00 9.19 C ATOM 2926 CG ASN B 88 13.599 2.945 71.249 1.00 8.76 C ATOM 2927 OD1 ASN B 88 14.334 3.070 72.222 1.00 9.54 O ATOM 2928 ND2 ASN B 88 13.941 3.342 70.015 1.00 10.00 N ATOM 2929 HA ASN B 88 11.306 0.412 71.877 1.00 0.00 H ATOM 2930 HB2 ASN B 88 11.835 2.170 70.362 1.00 0.00 H ATOM 2931 HB3 ASN B 88 11.601 2.915 71.961 1.00 0.00 H ATOM 2932 HD22 ASN B 88 13.278 3.212 69.224 1.00 0.00 H ATOM 2933 HD21 ASN B 88 14.869 3.780 69.848 1.00 0.00 H ATOM 2934 H ASN B 88 12.628 1.922 73.881 1.00 0.00 H ATOM 2935 N LEU B 89 14.560 -0.024 71.857 1.00 7.99 N ATOM 2936 CA LEU B 89 15.598 -0.904 71.340 1.00 8.82 C ATOM 2937 C LEU B 89 15.782 -2.152 72.159 1.00 8.41 C ATOM 2938 O LEU B 89 16.120 -3.217 71.607 1.00 9.54 O ATOM 2939 CB LEU B 89 16.912 -0.138 71.186 1.00 9.36 C ATOM 2940 CG LEU B 89 16.894 1.000 70.191 1.00 10.30 C ATOM 2941 CD1 LEU B 89 18.287 1.618 70.131 1.00 12.55 C ATOM 2942 CD2 LEU B 89 16.324 0.700 68.818 1.00 12.67 C ATOM 2943 HA LEU B 89 15.268 -1.243 70.358 1.00 0.00 H ATOM 2944 HB2 LEU B 89 17.177 0.273 72.160 1.00 0.00 H ATOM 2945 HB3 LEU B 89 17.678 -0.846 70.871 1.00 0.00 H ATOM 2946 HG LEU B 89 16.168 1.720 70.569 1.00 0.00 H ATOM 2947 HD21 LEU B 89 16.907 -0.093 68.349 1.00 0.00 H ATOM 2948 HD22 LEU B 89 15.287 0.379 68.919 1.00 0.00 H ATOM 2949 HD23 LEU B 89 16.370 1.599 68.203 1.00 0.00 H ATOM 2950 HD11 LEU B 89 18.560 1.992 71.118 1.00 0.00 H ATOM 2951 HD12 LEU B 89 19.006 0.861 69.816 1.00 0.00 H ATOM 2952 HD13 LEU B 89 18.288 2.441 69.416 1.00 0.00 H ATOM 2953 H LEU B 89 14.789 0.599 72.658 1.00 0.00 H ATOM 2954 N LEU B 90 15.502 -2.123 73.456 1.00 8.40 N ATOM 2955 CA LEU B 90 15.614 -3.347 74.268 1.00 8.40 C ATOM 2956 C LEU B 90 14.678 -4.418 73.765 1.00 8.42 C ATOM 2957 O LEU B 90 15.026 -5.608 73.785 1.00 9.05 O ATOM 2958 CB LEU B 90 15.363 -3.034 75.734 1.00 8.51 C ATOM 2959 CG LEU B 90 16.358 -2.099 76.421 1.00 9.99 C ATOM 2960 CD1 LEU B 90 15.834 -1.711 77.813 1.00 11.07 C ATOM 2961 CD2 LEU B 90 17.739 -2.719 76.483 1.00 12.07 C ATOM 2962 HA LEU B 90 16.629 -3.732 74.174 1.00 0.00 H ATOM 2963 HB2 LEU B 90 14.376 -2.578 75.809 1.00 0.00 H ATOM 2964 HB3 LEU B 90 15.368 -3.978 76.278 1.00 0.00 H ATOM 2965 HG LEU B 90 16.453 -1.187 75.831 1.00 0.00 H ATOM 2966 HD21 LEU B 90 17.692 -3.652 77.045 1.00 0.00 H ATOM 2967 HD22 LEU B 90 18.091 -2.920 75.471 1.00 0.00 H ATOM 2968 HD23 LEU B 90 18.424 -2.030 76.977 1.00 0.00 H ATOM 2969 HD11 LEU B 90 14.875 -1.204 77.710 1.00 0.00 H ATOM 2970 HD12 LEU B 90 15.709 -2.610 78.416 1.00 0.00 H ATOM 2971 HD13 LEU B 90 16.549 -1.045 78.296 1.00 0.00 H ATOM 2972 H LEU B 90 15.202 -1.232 73.901 1.00 0.00 H ATOM 2973 N THR B 91 13.490 -4.033 73.308 1.00 8.20 N ATOM 2974 CA THR B 91 12.547 -5.006 72.762 1.00 8.20 C ATOM 2975 C THR B 91 13.117 -5.700 71.526 1.00 8.45 C ATOM 2976 O THR B 91 12.772 -6.853 71.246 1.00 10.02 O ATOM 2977 CB THR B 91 11.218 -4.343 72.390 1.00 8.62 C ATOM 2978 OG1 THR B 91 11.470 -3.285 71.484 1.00 9.58 O ATOM 2979 CG2 THR B 91 10.453 -3.870 73.616 1.00 9.63 C ATOM 2980 HA THR B 91 12.374 -5.748 73.542 1.00 0.00 H ATOM 2981 HB THR B 91 10.577 -5.081 71.907 1.00 0.00 H ATOM 2982 HG1 THR B 91 10.615 -2.851 71.239 1.00 0.00 H ATOM 2983 HG23 THR B 91 10.282 -4.714 74.284 1.00 0.00 H ATOM 2984 HG21 THR B 91 11.035 -3.108 74.134 1.00 0.00 H ATOM 2985 HG22 THR B 91 9.496 -3.450 73.306 1.00 0.00 H ATOM 2986 H THR B 91 13.229 -3.027 73.340 1.00 0.00 H ATOM 2987 N GLN B 92 13.938 -4.984 70.770 1.00 8.82 N ATOM 2988 CA GLN B 92 14.464 -5.485 69.499 1.00 9.79 C ATOM 2989 C GLN B 92 15.524 -6.564 69.674 1.00 9.31 C ATOM 2990 O GLN B 92 15.763 -7.298 68.723 1.00 10.84 O ATOM 2991 CB GLN B 92 15.042 -4.330 68.690 1.00 10.39 C ATOM 2992 CG GLN B 92 14.031 -3.216 68.426 1.00 10.85 C ATOM 2993 CD GLN B 92 12.814 -3.735 67.762 1.00 11.00 C ATOM 2994 OE1 GLN B 92 12.867 -4.106 66.588 1.00 13.92 O ATOM 2995 NE2 GLN B 92 11.676 -3.744 68.453 1.00 13.27 N ATOM 2996 HA GLN B 92 13.627 -5.942 68.971 1.00 0.00 H ATOM 2997 HB2 GLN B 92 15.885 -3.910 69.238 1.00 0.00 H ATOM 2998 HB3 GLN B 92 15.390 -4.717 67.732 1.00 0.00 H ATOM 2999 HG2 GLN B 92 13.750 -2.760 69.375 1.00 0.00 H ATOM 3000 HG3 GLN B 92 14.491 -2.464 67.785 1.00 0.00 H ATOM 3001 HE22 GLN B 92 11.666 -3.424 69.443 1.00 0.00 H ATOM 3002 HE21 GLN B 92 10.797 -4.071 68.003 1.00 0.00 H ATOM 3003 H GLN B 92 14.218 -4.035 71.091 1.00 0.00 H ATOM 3004 N ILE B 93 16.120 -6.657 70.867 1.00 9.23 N ATOM 3005 CA ILE B 93 17.087 -7.685 71.219 1.00 9.60 C ATOM 3006 C ILE B 93 16.492 -8.760 72.143 1.00 9.32 C ATOM 3007 O ILE B 93 17.175 -9.676 72.556 1.00 10.78 O ATOM 3008 CB ILE B 93 18.390 -7.088 71.751 1.00 10.61 C ATOM 3009 CG1 ILE B 93 18.250 -6.532 73.169 1.00 11.28 C ATOM 3010 CG2 ILE B 93 18.926 -6.041 70.774 1.00 11.79 C ATOM 3011 CD1 ILE B 93 19.535 -6.012 73.758 1.00 13.46 C ATOM 3012 HA ILE B 93 17.347 -8.204 70.297 1.00 0.00 H ATOM 3013 HB ILE B 93 19.118 -7.896 71.824 1.00 0.00 H ATOM 3014 HG12 ILE B 93 17.529 -5.715 73.146 1.00 0.00 H ATOM 3015 HG13 ILE B 93 17.876 -7.328 73.813 1.00 0.00 H ATOM 3016 HD11 ILE B 93 20.266 -6.819 73.801 1.00 0.00 H ATOM 3017 HD12 ILE B 93 19.919 -5.205 73.134 1.00 0.00 H ATOM 3018 HD13 ILE B 93 19.346 -5.637 74.764 1.00 0.00 H ATOM 3019 HG21 ILE B 93 19.115 -6.510 69.808 1.00 0.00 H ATOM 3020 HG22 ILE B 93 18.190 -5.246 70.655 1.00 0.00 H ATOM 3021 HG23 ILE B 93 19.854 -5.623 71.164 1.00 0.00 H ATOM 3022 H ILE B 93 15.877 -5.949 71.589 1.00 0.00 H ATOM 3023 N GLY B 94 15.195 -8.660 72.443 1.00 9.20 N ATOM 3024 CA GLY B 94 14.567 -9.658 73.281 1.00 9.89 C ATOM 3025 C GLY B 94 14.937 -9.584 74.732 1.00 9.23 C ATOM 3026 O GLY B 94 14.919 -10.589 75.440 1.00 10.93 O ATOM 3027 HA3 GLY B 94 14.851 -10.642 72.908 1.00 0.00 H ATOM 3028 HA2 GLY B 94 13.487 -9.538 73.200 1.00 0.00 H ATOM 3029 H GLY B 94 14.636 -7.864 72.074 1.00 0.00 H ATOM 3030 N CYS B 95 15.226 -8.371 75.219 1.00 9.30 N ATOM 3031 CA CYS B 95 15.615 -8.196 76.599 1.00 9.56 C ATOM 3032 C CYS B 95 14.382 -8.332 77.498 1.00 8.84 C ATOM 3033 O CYS B 95 13.344 -7.719 77.273 1.00 10.71 O ATOM 3034 CB CYS B 95 16.240 -6.830 76.762 1.00 10.75 C ATOM 3035 SG CYS B 95 17.004 -6.483 78.350 1.00 10.07 S ATOM 3036 HA CYS B 95 16.340 -8.958 76.885 1.00 0.00 H ATOM 3037 HB2 CYS B 95 15.459 -6.087 76.600 1.00 0.00 H ATOM 3038 HB3 CYS B 95 17.007 -6.723 75.995 1.00 0.00 H ATOM 3039 HG CYS B 95 17.525 -5.205 78.339 1.00 0.00 H ATOM 3040 H CYS B 95 15.170 -7.542 74.594 1.00 0.00 H ATOM 3041 N THR B 96 14.568 -9.055 78.606 1.00 8.82 N ATOM 3042 CA THR B 96 13.546 -9.229 79.615 1.00 8.64 C ATOM 3043 C THR B 96 14.112 -9.070 81.025 1.00 8.73 C ATOM 3044 O THR B 96 15.327 -9.246 81.255 1.00 9.71 O ATOM 3045 CB THR B 96 12.842 -10.596 79.536 1.00 9.43 C ATOM 3046 OG1 THR B 96 13.826 -11.637 79.688 1.00 9.92 O ATOM 3047 CG2 THR B 96 12.128 -10.793 78.225 1.00 10.38 C ATOM 3048 HA THR B 96 12.815 -8.447 79.410 1.00 0.00 H ATOM 3049 HB THR B 96 12.099 -10.634 80.332 1.00 0.00 H ATOM 3050 HG1 THR B 96 14.497 -11.563 78.964 1.00 0.00 H ATOM 3051 HG23 THR B 96 11.380 -10.010 78.099 1.00 0.00 H ATOM 3052 HG21 THR B 96 12.849 -10.743 77.409 1.00 0.00 H ATOM 3053 HG22 THR B 96 11.640 -11.768 78.221 1.00 0.00 H ATOM 3054 H THR B 96 15.490 -9.514 78.750 1.00 0.00 H ATOM 3055 N LEU B 97 13.210 -8.671 81.935 1.00 8.35 N ATOM 3056 CA LEU B 97 13.499 -8.647 83.364 1.00 8.47 C ATOM 3057 C LEU B 97 13.010 -9.963 83.973 1.00 8.75 C ATOM 3058 O LEU B 97 11.861 -10.341 83.776 1.00 11.19 O ATOM 3059 CB LEU B 97 12.741 -7.505 84.047 1.00 8.69 C ATOM 3060 CG LEU B 97 13.286 -6.106 83.717 1.00 9.54 C ATOM 3061 CD1 LEU B 97 12.227 -5.057 83.987 1.00 12.42 C ATOM 3062 CD2 LEU B 97 14.578 -5.865 84.472 1.00 13.03 C ATOM 3063 HA LEU B 97 14.571 -8.509 83.508 1.00 0.00 H ATOM 3064 HB2 LEU B 97 11.698 -7.550 83.733 1.00 0.00 H ATOM 3065 HB3 LEU B 97 12.801 -7.651 85.126 1.00 0.00 H ATOM 3066 HG LEU B 97 13.526 -6.036 82.656 1.00 0.00 H ATOM 3067 HD21 LEU B 97 14.390 -5.935 85.543 1.00 0.00 H ATOM 3068 HD22 LEU B 97 15.313 -6.616 84.181 1.00 0.00 H ATOM 3069 HD23 LEU B 97 14.957 -4.872 84.233 1.00 0.00 H ATOM 3070 HD11 LEU B 97 11.353 -5.256 83.367 1.00 0.00 H ATOM 3071 HD12 LEU B 97 11.943 -5.092 85.039 1.00 0.00 H ATOM 3072 HD13 LEU B 97 12.625 -4.071 83.749 1.00 0.00 H ATOM 3073 H LEU B 97 12.270 -8.368 81.609 1.00 0.00 H ATOM 3074 N ASN B 98 13.879 -10.668 84.680 1.00 9.53 N ATOM 3075 CA ASN B 98 13.567 -11.986 85.186 1.00 10.04 C ATOM 3076 C ASN B 98 13.795 -12.038 86.687 1.00 10.03 C ATOM 3077 O ASN B 98 14.840 -11.658 87.156 1.00 10.64 O ATOM 3078 CB ASN B 98 14.490 -13.028 84.537 1.00 10.34 C ATOM 3079 CG ASN B 98 14.299 -13.289 83.059 1.00 12.16 C ATOM 3080 OD1 ASN B 98 14.785 -14.406 82.562 1.00 18.52 O ATOM 3081 ND2 ASN B 98 13.925 -12.380 82.304 1.00 16.65 N ATOM 3082 HA ASN B 98 12.524 -12.201 84.953 1.00 0.00 H ATOM 3083 HB2 ASN B 98 15.517 -12.694 84.682 1.00 0.00 H ATOM 3084 HB3 ASN B 98 14.339 -13.972 85.060 1.00 0.00 H ATOM 3085 HD22 ASN B 98 13.541 -11.499 82.701 1.00 0.00 H ATOM 3086 HD21 ASN B 98 13.995 -12.499 81.273 1.00 0.00 H ATOM 3087 H ASN B 98 14.815 -10.261 84.878 1.00 0.00 H ATOM 3088 N PHE B 99 12.810 -12.549 87.421 1.00 11.05 N ATOM 3089 CA PHE B 99 12.977 -12.828 88.861 1.00 11.41 C ATOM 3090 C PHE B 99 11.943 -13.845 89.299 1.00 12.81 C ATOM 3091 O PHE B 99 11.161 -14.322 88.460 1.00 14.27 O ATOM 3092 CB PHE B 99 12.900 -11.567 89.695 1.00 11.88 C ATOM 3093 CG PHE B 99 11.674 -10.721 89.579 1.00 11.54 C ATOM 3094 CD1 PHE B 99 11.490 -9.850 88.547 1.00 13.67 C ATOM 3095 CD2 PHE B 99 10.675 -10.816 90.558 1.00 13.77 C ATOM 3096 CE1 PHE B 99 10.361 -9.054 88.427 1.00 15.87 C ATOM 3097 CE2 PHE B 99 9.534 -10.037 90.474 1.00 16.56 C ATOM 3098 CZ PHE B 99 9.390 -9.162 89.410 1.00 16.99 C ATOM 3099 HA PHE B 99 13.973 -13.241 89.020 1.00 0.00 H ATOM 3100 OXT PHE B 99 11.954 -14.165 90.501 1.00 15.57 O ATOM 3101 HB2 PHE B 99 12.991 -11.863 90.740 1.00 0.00 H ATOM 3102 HB3 PHE B 99 13.751 -10.944 89.420 1.00 0.00 H ATOM 3103 HD2 PHE B 99 10.798 -11.508 91.391 1.00 0.00 H ATOM 3104 HE2 PHE B 99 8.758 -10.111 91.236 1.00 0.00 H ATOM 3105 HZ PHE B 99 8.494 -8.545 89.344 1.00 0.00 H ATOM 3106 HE1 PHE B 99 10.241 -8.367 87.589 1.00 0.00 H ATOM 3107 HD1 PHE B 99 12.264 -9.776 87.783 1.00 0.00 H ATOM 3108 H PHE B 99 11.897 -12.758 86.968 1.00 0.00 H TER 3109 PHE B 99 HETATM 3110 O HOH 1 21.779 1.700 86.708 1.00 9.58 O HETATM 3111 O HOH 2 -0.039 -0.891 85.691 1.00 10.56 O HETATM 3112 O HOH 3 2.657 -0.583 81.409 1.00 10.00 O HETATM 3113 O HOH 4 20.577 -8.515 90.230 1.00 13.26 O HETATM 3114 O HOH 5 18.885 -0.249 99.819 1.00 14.01 O HETATM 3115 O HOH 6 7.698 -13.281 78.791 1.00 15.34 O HETATM 3116 O HOH 7 5.750 -5.954 77.564 1.00 14.58 O HETATM 3117 O HOH 8 6.684 -4.375 80.594 1.00 13.95 O HETATM 3118 O HOH 9 23.898 6.995 92.992 1.00 13.55 O HETATM 3119 O HOH 10 22.090 4.373 86.866 1.00 10.42 O HETATM 3120 O HOH 11 5.837 -9.571 80.117 1.00 16.95 O HETATM 3121 O HOH 12 18.190 0.349 103.988 1.00 16.89 O HETATM 3122 O HOH 13 17.017 -13.593 87.606 1.00 14.49 O HETATM 3123 O HOH 14 22.538 11.111 95.140 1.00 18.30 O HETATM 3124 O HOH 15 4.555 -5.281 81.953 1.00 16.53 O HETATM 3125 O HOH 16 3.070 -3.879 83.711 1.00 18.07 O HETATM 3126 O HOH 17 21.843 8.432 95.894 1.00 17.77 O HETATM 3127 O HOH 18 0.627 3.803 86.560 1.00 18.89 O HETATM 3128 O HOH 19 17.734 20.913 89.114 1.00 16.31 O HETATM 3129 O HOH 20 13.157 19.132 94.406 1.00 20.07 O HETATM 3130 O HOH 21 1.055 4.042 92.641 1.00 17.08 O HETATM 3131 O HOH 22 -2.394 1.165 91.163 1.00 21.72 O HETATM 3132 O HOH 23 8.888 -0.419 106.552 1.00 18.06 O HETATM 3133 O HOH 24 14.251 19.651 88.959 1.00 25.37 O HETATM 3134 O HOH 25 5.578 -5.488 84.606 1.00 20.20 O HETATM 3135 O HOH 26 5.255 -11.453 82.349 1.00 24.71 O HETATM 3136 O HOH 27 18.950 -14.852 89.325 1.00 35.11 O HETATM 3137 O HOH 28 16.001 -7.531 101.035 1.00 16.86 O HETATM 3138 O HOH 29 22.310 0.669 93.855 1.00 26.92 O HETATM 3139 O HOH 30 6.282 -14.136 83.202 1.00 24.49 O HETATM 3140 O HOH 31 6.189 11.929 93.863 1.00 23.34 O HETATM 3141 O HOH 32 18.202 7.837 106.384 1.00 30.81 O HETATM 3142 O HOH 33 23.132 5.364 95.052 1.00 19.00 O HETATM 3143 O HOH 34 15.916 6.077 107.906 1.00 24.28 O HETATM 3144 O HOH 35 3.283 5.095 86.710 1.00 19.60 O HETATM 3145 O HOH 36 4.170 4.841 89.463 1.00 20.28 O HETATM 3146 O HOH 37 3.586 -6.569 95.603 1.00 27.93 O HETATM 3147 O HOH 38 19.738 -2.814 98.930 1.00 20.45 O HETATM 3148 O HOH 39 20.000 16.185 81.819 1.00 26.66 O HETATM 3149 O HOH 40 10.335 4.698 108.088 1.00 28.98 O HETATM 3150 O HOH 41 -0.367 5.262 88.859 1.00 18.65 O HETATM 3151 O HOH 42 1.808 5.564 90.573 1.00 21.79 O HETATM 3152 O HOH 43 21.225 15.125 86.087 1.00 27.50 O HETATM 3153 O HOH 44 21.912 -3.570 95.580 1.00 20.85 O HETATM 3154 O HOH 45 26.508 4.748 90.669 1.00 24.33 O HETATM 3155 O HOH 46 18.838 -3.813 101.368 1.00 23.27 O HETATM 3156 O HOH 47 10.764 -0.185 108.412 1.00 25.25 O HETATM 3157 O HOH 48 9.461 -7.049 103.234 1.00 23.37 O HETATM 3158 O HOH 49 9.131 10.253 108.590 1.00 26.52 O HETATM 3159 O HOH 50 0.026 7.887 88.159 1.00 26.66 O HETATM 3160 O HOH 51 16.015 23.076 88.276 1.00 26.82 O HETATM 3161 O HOH 52 19.693 -1.967 103.398 1.00 31.64 O HETATM 3162 O HOH 53 4.525 4.961 84.133 1.00 34.50 O HETATM 3163 O HOH 54 23.066 15.324 98.386 1.00 27.15 O HETATM 3164 O HOH 55 2.701 7.862 87.225 1.00 26.08 O HETATM 3165 O HOH 56 24.620 0.096 92.932 1.00 38.08 O HETATM 3166 O HOH 57 21.357 16.796 84.517 1.00 37.53 O HETATM 3167 O HOH 58 9.246 -12.958 99.374 1.00 31.85 O HETATM 3168 O HOH 59 1.564 -6.223 82.922 1.00 46.94 O HETATM 3169 O HOH 60 5.929 -2.311 104.754 1.00 30.28 O HETATM 3170 O HOH 61 18.363 -12.940 95.136 1.00 45.75 O HETATM 3171 O HOH 62 2.639 -4.025 103.646 1.00 33.30 O HETATM 3172 O HOH 63 13.190 7.169 113.349 1.00 40.88 O HETATM 3173 O HOH 64 21.154 0.803 100.665 1.00 25.60 O HETATM 3174 O HOH 65 16.199 -14.604 90.822 1.00 32.10 O HETATM 3175 O HOH 66 13.077 -12.680 95.897 1.00 29.34 O HETATM 3176 O HOH 67 22.495 1.133 96.662 1.00 37.43 O HETATM 3177 O HOH 68 24.378 3.196 94.661 1.00 44.12 O HETATM 3178 O HOH 69 1.970 -6.686 85.392 1.00 32.41 O HETATM 3179 O HOH 70 3.884 0.419 74.406 1.00 21.66 O HETATM 3180 O HOH 71 8.043 14.120 101.455 1.00 22.78 O HETATM 3181 O HOH 72 23.937 18.274 102.784 1.00 33.39 O HETATM 3182 O HOH 73 24.398 6.538 103.729 1.00 50.13 O HETATM 3183 O HOH 74 3.420 12.147 94.287 1.00 22.49 O HETATM 3184 O HOH 75 22.278 -2.544 97.930 1.00 37.78 O HETATM 3185 O HOH 76 20.475 6.310 99.220 1.00 35.18 O HETATM 3186 O HOH 77 8.430 -0.561 73.168 1.00 40.40 O HETATM 3187 O HOH 78 4.378 -7.690 85.288 1.00 33.18 O HETATM 3188 O HOH 79 22.236 -6.977 99.466 1.00 44.80 O HETATM 3189 O HOH 80 -3.818 0.706 99.524 1.00 26.69 O HETATM 3190 O HOH 81 4.360 -9.787 84.364 1.00 41.30 O HETATM 3191 O HOH 82 19.786 -6.397 102.711 1.00 37.39 O HETATM 3192 O HOH 83 7.373 9.355 103.595 1.00 39.06 O HETATM 3193 O HOH 84 5.004 8.956 91.803 1.00 30.05 O HETATM 3194 O HOH 85 11.439 19.415 92.368 1.00 33.83 O HETATM 3195 O HOH 86 14.782 16.860 101.208 1.00 38.73 O HETATM 3196 O HOH 87 20.229 -10.098 92.437 1.00 21.97 O HETATM 3197 O HOH 88 10.516 14.193 100.524 1.00 20.93 O HETATM 3198 O HOH 89 7.278 6.046 82.963 1.00 29.95 O HETATM 3199 O HOH 90 6.508 -16.027 81.407 1.00 26.16 O HETATM 3200 O HOH 91 22.974 14.430 101.799 1.00 34.87 O HETATM 3201 O HOH 92 11.428 17.067 97.992 1.00 32.93 O HETATM 3202 O HOH 93 16.883 4.058 97.295 1.00 12.94 O HETATM 3203 O HOH 94 19.645 3.574 97.197 1.00 27.16 O HETATM 3204 O HOH 95 5.086 -4.450 102.656 1.00 41.74 O HETATM 3205 O HOH 96 14.893 -9.806 99.611 1.00 28.74 O HETATM 3206 O HOH 97 6.125 -15.372 79.078 1.00 27.46 O HETATM 3207 O HOH 98 13.384 4.010 108.300 1.00 40.17 O HETATM 3208 O HOH 99 -3.470 2.450 101.203 1.00 36.51 O HETATM 3209 O HOH 100 -3.711 -2.123 105.187 1.00 37.29 O HETATM 3210 O HOH 101 11.639 16.675 100.458 1.00 25.74 O HETATM 3211 O HOH 102 20.883 1.738 98.707 1.00 18.13 O HETATM 3212 O HOH 103 15.022 13.094 110.370 1.00 31.23 O HETATM 3213 O HOH 104 10.346 15.947 89.088 1.00 24.57 O HETATM 3214 O HOH 105 21.202 17.880 100.980 1.00 37.17 O HETATM 3215 O HOH 106 4.308 -14.525 85.036 1.00 30.29 O HETATM 3216 O HOH 107 15.374 20.851 86.602 1.00 28.84 O HETATM 3217 O HOH 108 11.228 -7.114 75.631 1.00 10.76 O HETATM 3218 O HOH 109 9.676 2.101 80.828 1.00 9.92 O HETATM 3219 O HOH 110 24.779 -4.645 85.747 1.00 13.07 O HETATM 3220 O HOH 111 30.225 -1.808 83.458 1.00 10.92 O HETATM 3221 O HOH 112 15.067 -12.573 77.382 1.00 14.06 O HETATM 3222 O HOH 113 15.169 -3.929 65.095 1.00 14.27 O HETATM 3223 O HOH 114 12.148 2.959 67.798 1.00 13.86 O HETATM 3224 O HOH 115 25.996 -6.719 88.819 1.00 15.47 O HETATM 3225 O HOH 116 9.578 -1.267 71.266 1.00 20.54 O HETATM 3226 O HOH 117 24.664 3.195 63.029 1.00 17.62 O HETATM 3227 O HOH 118 12.625 26.873 74.212 1.00 15.04 O HETATM 3228 O HOH 119 9.225 4.789 81.237 1.00 11.83 O HETATM 3229 O HOH 120 18.248 -8.409 67.759 1.00 16.91 O HETATM 3230 O HOH 121 22.298 13.832 59.600 1.00 16.62 O HETATM 3231 O HOH 122 12.236 18.647 61.735 1.00 21.01 O HETATM 3232 O HOH 123 27.003 -5.311 84.493 1.00 19.91 O HETATM 3233 O HOH 124 22.443 15.559 61.749 1.00 16.01 O HETATM 3234 O HOH 125 27.935 4.976 84.475 1.00 23.98 O HETATM 3235 O HOH 126 19.363 -11.289 72.086 1.00 17.63 O HETATM 3236 O HOH 127 28.553 -6.561 89.754 1.00 19.38 O HETATM 3237 O HOH 128 17.939 20.792 76.748 1.00 20.56 O HETATM 3238 O HOH 129 26.153 -9.835 85.447 1.00 21.74 O HETATM 3239 O HOH 130 8.435 16.739 71.963 1.00 24.34 O HETATM 3240 O HOH 131 30.571 5.583 75.357 1.00 16.94 O HETATM 3241 O HOH 132 33.778 2.273 76.288 1.00 16.58 O HETATM 3242 O HOH 133 31.016 4.181 81.623 1.00 28.48 O HETATM 3243 O HOH 134 20.048 16.227 59.023 1.00 17.76 O HETATM 3244 O HOH 135 19.662 20.085 73.793 1.00 16.82 O HETATM 3245 O HOH 136 21.230 -9.581 65.620 1.00 23.26 O HETATM 3246 O HOH 137 9.348 17.974 65.984 1.00 27.59 O HETATM 3247 O HOH 138 12.718 4.753 64.050 1.00 21.87 O HETATM 3248 O HOH 139 21.317 19.273 69.473 1.00 16.53 O HETATM 3249 O HOH 140 13.388 17.409 59.742 1.00 18.95 O HETATM 3250 O HOH 141 13.704 -14.004 92.421 1.00 24.24 O HETATM 3251 O HOH 142 9.820 20.072 69.611 1.00 29.66 O HETATM 3252 O HOH 143 7.510 8.505 75.618 1.00 26.17 O HETATM 3253 O HOH 144 22.087 3.841 61.051 1.00 25.59 O HETATM 3254 O HOH 145 16.322 10.213 60.645 1.00 27.48 O HETATM 3255 O HOH 146 28.439 -3.750 82.870 1.00 17.21 O HETATM 3256 O HOH 147 25.616 14.667 77.478 1.00 19.26 O HETATM 3257 O HOH 148 6.840 1.308 74.129 1.00 28.17 O HETATM 3258 O HOH 149 11.793 20.987 82.657 1.00 28.47 O HETATM 3259 O HOH 150 26.857 9.270 72.183 1.00 21.44 O HETATM 3260 O HOH 151 27.787 -4.458 69.969 1.00 23.08 O HETATM 3261 O HOH 152 27.588 7.903 78.442 1.00 25.96 O HETATM 3262 O HOH 153 33.197 4.644 75.388 1.00 23.14 O HETATM 3263 O HOH 154 11.589 0.244 68.179 1.00 23.97 O HETATM 3264 O HOH 155 9.898 18.147 61.725 1.00 30.68 O HETATM 3265 O HOH 156 23.874 14.771 57.531 1.00 27.79 O HETATM 3266 O HOH 157 29.200 -5.704 71.502 1.00 35.14 O HETATM 3267 O HOH 158 25.929 15.497 74.894 1.00 25.01 O HETATM 3268 O HOH 159 25.094 17.766 74.242 1.00 39.60 O HETATM 3269 O HOH 160 16.183 11.110 56.700 1.00 26.32 O HETATM 3270 O HOH 161 20.152 15.711 56.355 1.00 28.81 O HETATM 3271 O HOH 162 25.225 -13.438 85.550 1.00 47.65 O HETATM 3272 O HOH 163 30.056 11.131 66.204 1.00 30.56 O HETATM 3273 O HOH 164 8.902 2.989 73.393 1.00 34.04 O HETATM 3274 O HOH 165 27.510 16.133 66.604 1.00 32.19 O HETATM 3275 O HOH 166 19.302 20.741 79.123 1.00 29.15 O HETATM 3276 O HOH 167 29.794 6.328 77.962 1.00 31.76 O HETATM 3277 O HOH 168 25.981 5.887 60.423 1.00 30.63 O HETATM 3278 O HOH 169 26.097 -5.269 81.748 1.00 31.73 O HETATM 3279 O HOH 170 26.868 -10.797 89.724 1.00 34.79 O HETATM 3280 O HOH 171 24.868 14.450 62.565 1.00 26.42 O HETATM 3281 O HOH 172 26.640 16.086 63.656 1.00 30.67 O HETATM 3282 O HOH 173 24.169 -4.914 62.454 1.00 32.55 O HETATM 3283 O HOH 174 22.701 11.947 56.263 1.00 34.03 O HETATM 3284 O HOH 175 11.982 15.866 58.096 1.00 34.43 O HETATM 3285 O HOH 176 30.171 14.724 68.189 1.00 56.38 O HETATM 3286 O HOH 177 23.699 5.380 61.956 1.00 24.10 O HETATM 3287 O HOH 178 20.472 17.719 71.484 1.00 24.67 O HETATM 3288 O HOH 179 19.724 -10.774 67.754 1.00 32.84 O HETATM 3289 O HOH 180 35.221 2.546 67.787 1.00 37.47 O HETATM 3290 O HOH 181 13.355 11.845 62.817 1.00 32.76 O HETATM 3291 O HOH 182 16.246 20.531 82.181 1.00 46.84 O HETATM 3292 O HOH 183 22.602 -2.242 93.448 1.00 28.24 O HETATM 3293 O HOH 184 31.923 -6.723 74.389 1.00 39.71 O HETATM 3294 O HOH 185 9.443 17.568 58.987 1.00 30.18 O HETATM 3295 O HOH 186 20.131 5.148 59.441 1.00 40.79 O HETATM 3296 O HOH 187 29.052 8.834 64.911 1.00 35.82 O HETATM 3297 O HOH 188 28.746 7.997 81.234 1.00 37.66 O HETATM 3298 O HOH 189 12.395 23.528 81.288 1.00 44.16 O HETATM 3299 O HOH 190 29.541 -4.633 67.981 1.00 32.53 O HETATM 3300 O HOH 191 10.160 -16.226 90.853 1.00 35.35 O HETATM 3301 O HOH 192 25.300 -14.729 81.571 1.00 37.22 O HETATM 3302 O HOH 193 29.638 13.501 73.229 1.00 31.74 O HETATM 3303 O HOH 194 14.488 6.663 70.972 1.00 20.54 O HETATM 3304 O HOH 195 30.794 7.627 62.362 1.00 44.37 O HETATM 3305 O HOH 196 29.448 8.060 73.980 1.00 28.01 O HETATM 3306 O HOH 197 8.973 12.513 77.931 1.00 32.45 O HETATM 3307 O HOH 198 28.276 -2.038 92.162 1.00 28.86 O HETATM 3308 O HOH 199 9.369 -4.654 66.871 1.00 24.56 O HETATM 3309 O HOH 200 27.073 -7.176 86.126 1.00 41.27 O HETATM 3310 O HOH 201 23.759 17.151 71.977 1.00 33.47 O HETATM 3311 O HOH 202 26.038 13.630 60.355 1.00 37.56 O HETATM 3312 O HOH 203 26.679 8.232 61.535 1.00 34.75 O HETATM 3313 O HOH 204 10.023 4.667 69.659 1.00 35.61 O HETATM 3314 O HOH 205 12.211 -0.508 65.798 1.00 35.09 O HETATM 3315 O HOH 206 28.560 5.593 81.417 1.00 36.42 O HETATM 3316 O HOH 207 16.133 22.867 77.275 1.00 30.44 O HETATM 3317 O HOH 208 10.849 22.302 80.105 1.00 29.35 O HETATM 3318 O HOH 209 26.629 -11.286 82.829 1.00 24.28 O HETATM 3319 O HOH 210 28.810 -5.483 76.528 1.00 24.98 O HETATM 3320 O HOH 211 13.695 17.746 52.736 1.00 21.43 O HETATM 3321 O HOH 212 8.136 8.599 79.833 1.00 25.04 O HETATM 3322 O HOH 213 8.678 11.109 80.236 1.00 24.13 O HETATM 3323 O HOH 214 33.002 6.243 69.943 1.00 26.44 O HETATM 3324 O HOH 215 17.220 -8.074 63.367 1.00 24.05 O HETATM 3325 O HOH 216 23.924 -11.942 92.285 1.00 25.50 O HETATM 3326 O HOH 217 18.458 8.166 59.742 1.00 25.15 O HETATM 3327 O HOH 218 19.420 13.385 55.013 1.00 32.03 O HETATM 3328 O HOH 219 7.678 12.048 65.347 1.00 33.21 O HETATM 3329 O HOH 220 16.854 26.372 74.726 1.00 30.95 O HETATM 3330 O HOH 221 28.468 15.998 74.831 1.00 27.09 O HETATM 3331 O HOH 222 6.995 17.909 67.851 1.00 24.34 O HETATM 3332 O HOH 223 15.666 10.614 84.476 1.00 13.92 O HETATM 3333 O HOH 224 10.711 7.268 79.661 1.00 14.52 O HETATM 3334 O HOH 225 27.097 9.051 86.316 1.00 19.24 O HETATM 3335 O HOH 226 22.921 13.449 91.432 1.00 30.51 O HETATM 3336 O HOH 227 22.661 13.311 87.116 1.00 34.37 O HETATM 3337 O HOH 228 11.391 -8.500 73.176 1.00 10.74 O HETATM 3338 O HOH 229 12.295 -7.957 68.650 1.00 14.39 O HETATM 3339 O HOH 230 5.480 -11.533 78.067 1.00 33.38 O HETATM 3340 O HOH 231 3.139 -6.095 76.889 1.00 29.32 O HETATM 3341 O HOH 232 6.876 -3.805 67.216 1.00 34.13 O HETATM 3342 O HOH 233 5.783 -12.322 69.264 1.00 20.65 O HETATM 3343 O1 KI A 2 13.088 8.704 80.517 1.00 -0.25 O HETATM 3344 C8 KI A 2 13.599 8.660 81.781 1.00 0.32 C HETATM 3345 O9 KI A 2 14.373 9.530 82.222 1.00 -0.38 O HETATM 3346 N10 KI A 2 12.971 7.705 82.570 1.00 -0.25 N HETATM 3347 C11 KI A 2 13.583 7.308 83.831 1.00 0.10 C HETATM 3348 C12 KI A 2 12.541 6.813 84.801 1.00 0.01 C HETATM 3349 C13 KI A 2 11.535 7.920 84.966 1.00 -0.04 C HETATM 3350 C14 KI A 2 11.706 8.910 85.924 1.00 -0.06 C HETATM 3351 C15 KI A 2 10.779 9.953 86.097 1.00 -0.07 C HETATM 3352 C16 KI A 2 9.659 9.986 85.269 1.00 -0.07 C HETATM 3353 C17 KI A 2 9.488 9.021 84.284 1.00 -0.07 C HETATM 3354 C18 KI A 2 10.381 7.957 84.170 1.00 -0.06 C HETATM 3355 H14 KI A 2 10.183 7.157 83.465 1.00 0.06 H HETATM 3356 H13 KI A 2 8.652 9.096 83.598 1.00 0.06 H HETATM 3357 H12 KI A 2 8.918 10.768 85.394 1.00 0.06 H HETATM 3358 H11 KI A 2 10.932 10.712 86.855 1.00 0.06 H HETATM 3359 H10 KI A 2 12.583 8.878 86.560 1.00 0.06 H HETATM 3360 H8 KI A 2 13.007 6.578 85.769 1.00 0.05 H HETATM 3361 H9 KI A 2 12.050 5.913 84.402 1.00 0.05 H HETATM 3362 C21 KI A 2 14.719 6.269 83.586 1.00 0.17 C HETATM 3363 O22 KI A 2 15.138 6.321 82.244 1.00 -0.37 O HETATM 3364 H18 KI A 2 15.830 5.685 82.105 1.00 0.21 H HETATM 3365 C KI A 2 15.890 6.477 84.493 1.00 0.21 C HETATM 3366 O KI A 2 15.906 6.099 85.698 1.00 -0.39 O HETATM 3367 N KI A 2 16.863 7.191 83.951 1.00 -0.26 N HETATM 3368 CA KI A 2 18.134 7.312 84.620 1.00 0.14 C HETATM 3369 C KI A 2 17.998 8.090 85.924 1.00 0.21 C HETATM 3370 O KI A 2 17.336 9.134 85.979 1.00 -0.39 O HETATM 3371 N KI A 2 18.661 7.599 86.959 1.00 -0.26 N HETATM 3372 CA KI A 2 18.693 8.303 88.235 1.00 0.13 C HETATM 3373 C KI A 2 20.031 7.940 88.908 1.00 0.20 C HETATM 3374 O KI A 2 20.484 6.774 88.894 1.00 -0.39 O HETATM 3375 N KI A 2 20.551 8.915 89.661 1.00 -0.26 N HETATM 3376 CA KI A 2 21.727 8.736 90.497 1.00 0.13 C HETATM 3377 C KI A 2 21.742 9.779 91.605 1.00 0.20 C HETATM 3378 O KI A 2 21.170 10.850 91.433 1.00 -0.39 O HETATM 3379 N KI A 2 22.423 9.488 92.671 1.00 -0.30 N HETATM 3380 H40 KI A 2 22.466 10.138 93.430 1.00 0.18 H HETATM 3381 H41 KI A 2 22.904 8.614 92.734 1.00 0.18 H HETATM 3382 CB KI A 2 23.014 8.858 89.668 1.00 -0.00 C HETATM 3383 CG KI A 2 23.202 10.255 89.097 1.00 0.00 C HETATM 3384 CD KI A 2 24.419 10.434 88.213 1.00 0.04 C HETATM 3385 OE1 KI A 2 24.440 11.461 87.452 1.00 -0.57 O HETATM 3386 OE2 KI A 2 25.321 9.524 88.200 1.00 -0.57 O HETATM 3387 H38 KI A 2 23.287 10.958 89.939 1.00 0.04 H HETATM 3388 H39 KI A 2 22.310 10.502 88.502 1.00 0.04 H HETATM 3389 H36 KI A 2 22.969 8.139 88.837 1.00 0.03 H HETATM 3390 H37 KI A 2 23.874 8.620 90.312 1.00 0.03 H HETATM 3391 H35 KI A 2 21.689 7.734 90.949 1.00 0.08 H HETATM 3392 H34 KI A 2 20.109 9.812 89.648 1.00 0.19 H HETATM 3393 CB KI A 2 17.490 7.945 89.096 1.00 -0.00 C HETATM 3394 CG KI A 2 17.486 8.557 90.465 1.00 0.00 C HETATM 3395 CD KI A 2 18.267 7.791 91.508 1.00 0.04 C HETATM 3396 OE1 KI A 2 18.696 8.433 92.525 1.00 -0.57 O HETATM 3397 OE2 KI A 2 18.613 6.615 91.274 1.00 -0.57 O HETATM 3398 H32 KI A 2 16.442 8.628 90.804 1.00 0.04 H HETATM 3399 H33 KI A 2 17.917 9.566 90.389 1.00 0.04 H HETATM 3400 H30 KI A 2 17.466 6.851 89.211 1.00 0.03 H HETATM 3401 H31 KI A 2 16.583 8.278 88.571 1.00 0.03 H HETATM 3402 H29 KI A 2 18.669 9.387 88.050 1.00 0.08 H HETATM 3403 H28 KI A 2 19.148 6.731 86.864 1.00 0.19 H HETATM 3404 CB KI A 2 19.151 8.048 83.695 1.00 0.02 C HETATM 3405 CG KI A 2 20.478 8.260 84.357 1.00 -0.04 C HETATM 3406 CD1 KI A 2 20.933 9.523 84.739 1.00 -0.06 C HETATM 3407 CE1 KI A 2 22.136 9.669 85.339 1.00 -0.07 C HETATM 3408 CZ KI A 2 22.972 8.584 85.607 1.00 -0.07 C HETATM 3409 CE2 KI A 2 22.534 7.340 85.233 1.00 -0.07 C HETATM 3410 CD2 KI A 2 21.301 7.203 84.617 1.00 -0.06 C HETATM 3411 H24 KI A 2 20.975 6.210 84.328 1.00 0.06 H HETATM 3412 H26 KI A 2 23.150 6.467 85.418 1.00 0.06 H HETATM 3413 H27 KI A 2 23.932 8.720 86.093 1.00 0.06 H HETATM 3414 H25 KI A 2 22.462 10.663 85.622 1.00 0.06 H HETATM 3415 H23 KI A 2 20.316 10.395 84.553 1.00 0.06 H HETATM 3416 H21 KI A 2 18.733 9.028 83.420 1.00 0.05 H HETATM 3417 H22 KI A 2 19.302 7.446 82.787 1.00 0.05 H HETATM 3418 H20 KI A 2 18.513 6.304 84.844 1.00 0.08 H HETATM 3419 H19 KI A 2 16.716 7.648 83.074 1.00 0.19 H HETATM 3420 H17 KI A 2 14.310 5.267 83.784 1.00 0.09 H HETATM 3421 H7 KI A 2 14.046 8.202 84.275 1.00 0.06 H HETATM 3422 H6 KI A 2 12.108 7.294 82.276 1.00 0.19 H HETATM 3423 C19 KI A 2 13.656 9.734 79.707 1.00 0.11 C HETATM 3424 C5 KI A 2 13.042 9.544 78.322 1.00 -0.01 C HETATM 3425 C4 KI A 2 13.740 8.930 77.324 1.00 -0.06 C HETATM 3426 C3 KI A 2 13.210 8.757 76.040 1.00 -0.07 C HETATM 3427 C2 KI A 2 11.908 9.209 75.816 1.00 -0.07 C HETATM 3428 C7 KI A 2 11.151 9.834 76.803 1.00 -0.07 C HETATM 3429 C6 KI A 2 11.739 10.003 78.082 1.00 -0.06 C HETATM 3430 H4 KI A 2 11.181 10.487 78.875 1.00 0.06 H HETATM 3431 H5 KI A 2 10.144 10.180 76.600 1.00 0.06 H HETATM 3432 H1 KI A 2 11.469 9.068 74.835 1.00 0.06 H HETATM 3433 H2 KI A 2 13.788 8.290 75.250 1.00 0.06 H HETATM 3434 H3 KI A 2 14.739 8.564 77.532 1.00 0.06 H HETATM 3435 H15 KI A 2 14.750 9.629 79.661 1.00 0.08 H HETATM 3436 H16 KI A 2 13.400 10.725 80.109 1.00 0.08 H CONECT 3343 3344 3423 CONECT 3344 3343 3345 3346 CONECT 3345 3344 CONECT 3346 3344 3347 3422 CONECT 3347 3346 3348 3362 3421 CONECT 3348 3347 3349 3360 3361 CONECT 3349 3348 3350 3354 CONECT 3350 3349 3351 3359 CONECT 3351 3350 3352 3358 CONECT 3352 3351 3353 3357 CONECT 3353 3352 3354 3356 CONECT 3354 3349 3353 3355 CONECT 3355 3354 CONECT 3356 3353 CONECT 3357 3352 CONECT 3358 3351 CONECT 3359 3350 CONECT 3360 3348 CONECT 3361 3348 CONECT 3362 3347 3363 3365 3420 CONECT 3363 3362 3364 CONECT 3364 3363 CONECT 3365 3362 3366 3367 CONECT 3366 3365 CONECT 3367 3365 3368 3419 CONECT 3368 3367 3369 3404 3418 CONECT 3369 3368 3370 3371 CONECT 3370 3369 CONECT 3371 3369 3372 3403 CONECT 3372 3371 3373 3393 3402 CONECT 3373 3372 3374 3375 CONECT 3374 3373 CONECT 3375 3373 3376 3392 CONECT 3376 3375 3377 3382 3391 CONECT 3377 3376 3378 3379 CONECT 3378 3377 CONECT 3379 3377 3380 3381 CONECT 3380 3379 CONECT 3381 3379 CONECT 3382 3376 3383 3389 3390 CONECT 3383 3382 3384 3387 3388 CONECT 3384 3383 3385 3386 CONECT 3385 3384 CONECT 3386 3384 CONECT 3387 3383 CONECT 3388 3383 CONECT 3389 3382 CONECT 3390 3382 CONECT 3391 3376 CONECT 3392 3375 CONECT 3393 3372 3394 3400 3401 CONECT 3394 3393 3395 3398 3399 CONECT 3395 3394 3396 3397 CONECT 3396 3395 CONECT 3397 3395 CONECT 3398 3394 CONECT 3399 3394 CONECT 3400 3393 CONECT 3401 3393 CONECT 3402 3372 CONECT 3403 3371 CONECT 3404 3368 3405 3416 3417 CONECT 3405 3404 3406 3410 CONECT 3406 3405 3407 3415 CONECT 3407 3406 3408 3414 CONECT 3408 3407 3409 3413 CONECT 3409 3408 3410 3412 CONECT 3410 3405 3409 3411 CONECT 3411 3410 CONECT 3412 3409 CONECT 3413 3408 CONECT 3414 3407 CONECT 3415 3406 CONECT 3416 3404 CONECT 3417 3404 CONECT 3418 3368 CONECT 3419 3367 CONECT 3420 3362 CONECT 3421 3347 CONECT 3422 3346 CONECT 3423 3343 3424 3435 3436 CONECT 3424 3423 3425 3429 CONECT 3425 3424 3426 3434 CONECT 3426 3425 3427 3433 CONECT 3427 3426 3428 3432 CONECT 3428 3427 3429 3431 CONECT 3429 3424 3428 3430 CONECT 3430 3429 CONECT 3431 3428 CONECT 3432 3427 CONECT 3433 3426 CONECT 3434 3425 CONECT 3435 3423 CONECT 3436 3423 MASTER 0 0 0 0 0 0 0 0 3434 2 94 16 END
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Related entries of code: 1nh0
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1a30
RCSB PDB
PDBbind
99aa, >1A30_1|Chains... at 96%
1a9m
RCSB PDB
PDBbind
99aa, >1A9M_1|Chains... at 98%
1aaq
RCSB PDB
PDBbind
99aa, >1AAQ_1|Chains... at 98%
1ajv
RCSB PDB
PDBbind
99aa, >1AJV_1|Chains... at 100%
1ajx
RCSB PDB
PDBbind
99aa, >1AJX_1|Chains... at 100%
1bdl
RCSB PDB
PDBbind
99aa, >1BDL_1|Chains... at 92%
1bdq
RCSB PDB
PDBbind
99aa, >1BDQ_1|Chains... at 90%
1bdr
RCSB PDB
PDBbind
99aa, >1BDR_1|Chains... at 93%
1bv7
RCSB PDB
PDBbind
99aa, >1BV7_1|Chains... at 97%
1bv9
RCSB PDB
PDBbind
99aa, >1BV9_1|Chains... at 97%
1bwa
RCSB PDB
PDBbind
99aa, >1BWA_1|Chains... at 96%
1bwb
RCSB PDB
PDBbind
99aa, >1BWB_1|Chains... at 96%
1c70
RCSB PDB
PDBbind
99aa, >1C70_1|Chains... at 100%
1d4h
RCSB PDB
PDBbind
99aa, >1D4H_1|Chains... at 100%
1d4i
RCSB PDB
PDBbind
99aa, >1D4I_1|Chains... at 100%
1d4j
RCSB PDB
PDBbind
99aa, >1D4J_1|Chains... at 100%
1d4y
RCSB PDB
PDBbind
99aa, >1D4Y_1|Chains... at 96%
1dif
RCSB PDB
PDBbind
99aa, >1DIF_1|Chains... at 100%
1dmp
RCSB PDB
PDBbind
99aa, >1DMP_1|Chains... at 97%
1ebw
RCSB PDB
PDBbind
99aa, >1EBW_1|Chains... at 100%
1ebz
RCSB PDB
PDBbind
99aa, >1EBZ_1|Chains... at 100%
1ec0
RCSB PDB
PDBbind
99aa, >1EC0_1|Chains... at 100%
1ec1
RCSB PDB
PDBbind
99aa, >1EC1_1|Chains... at 100%
1ec2
RCSB PDB
PDBbind
99aa, >1EC2_1|Chains... at 100%
1ec3
RCSB PDB
PDBbind
99aa, >1EC3_1|Chains... at 100%
1g2k
RCSB PDB
PDBbind
99aa, >1G2K_1|Chains... at 100%
1g35
RCSB PDB
PDBbind
99aa, >1G35_1|Chains... at 100%
1gnm
RCSB PDB
PDBbind
99aa, >1GNM_1|Chains... at 98%
1gnn
RCSB PDB
PDBbind
99aa, >1GNN_1|Chains... at 98%
1gno
RCSB PDB
PDBbind
99aa, >1GNO_1|Chains... at 100%
1hbv
RCSB PDB
PDBbind
99aa, >1HBV_1|Chains... at 100%
1hef
RCSB PDB
PDBbind
99aa, >1HEF_1|Chain... at 98%
1heg
RCSB PDB
PDBbind
99aa, >1HEG_1|Chain... at 98%
1hih
RCSB PDB
PDBbind
99aa, >1HIH_1|Chains... at 100%
1hiv
RCSB PDB
PDBbind
99aa, >1HIV_1|Chains... at 98%
1hos
RCSB PDB
PDBbind
99aa, >1HOS_1|Chains... at 100%
1hpo
RCSB PDB
PDBbind
99aa, >1HPO_1|Chains... at 96%
1hps
RCSB PDB
PDBbind
99aa, >1HPS_1|Chains... at 100%
1hpv
RCSB PDB
PDBbind
99aa, >1HPV_1|Chains... at 100%
1hpx
RCSB PDB
PDBbind
99aa, >1HPX_1|Chains... at 100%
1hsg
RCSB PDB
PDBbind
99aa, >1HSG_1|Chains... at 100%
1hte
RCSB PDB
PDBbind
99aa, >1HTE_1|Chains... at 100%
1htf
RCSB PDB
PDBbind
99aa, >1HTF_1|Chains... at 100%
1htg
RCSB PDB
PDBbind
99aa, >1HTG_1|Chains... at 100%
1hvh
RCSB PDB
PDBbind
99aa, >1HVH_1|Chains... at 97%
1hvi
RCSB PDB
PDBbind
99aa, >1HVI_1|Chains... at 100%
1hvj
RCSB PDB
PDBbind
99aa, >1HVJ_1|Chains... at 100%
1hvk
RCSB PDB
PDBbind
99aa, >1HVK_1|Chains... at 100%
1hvl
RCSB PDB
PDBbind
99aa, >1HVL_1|Chains... at 100%
1hvr
RCSB PDB
PDBbind
99aa, >1HVR_1|Chains... at 97%
1hvs
RCSB PDB
PDBbind
99aa, >1HVS_1|Chains... at 98%
1hwr
RCSB PDB
PDBbind
99aa, >1HWR_1|Chains... at 97%
1hxb
RCSB PDB
PDBbind
99aa, >1HXB_1|Chains... at 98%
1iiq
RCSB PDB
PDBbind
99aa, >1IIQ_1|Chains... at 100%
1izi
RCSB PDB
PDBbind
99aa, >1IZI_1|Chains... at 95%
1lzq
RCSB PDB
PDBbind
99aa, >1LZQ_1|Chains... at 96%
1m0b
RCSB PDB
PDBbind
99aa, >1M0B_1|Chains... at 100%
1mes
RCSB PDB
PDBbind
99aa, >1MES_1|Chains... at 97%
1met
RCSB PDB
PDBbind
99aa, >1MET_1|Chains... at 97%
1meu
RCSB PDB
PDBbind
99aa, >1MEU_1|Chains... at 96%
1mrw
RCSB PDB
PDBbind
99aa, >1MRW_1|Chains... at 96%
1mrx
RCSB PDB
PDBbind
99aa, >1MRX_1|Chains... at 94%
1msm
RCSB PDB
PDBbind
99aa, >1MSM_1|Chains... at 96%
1msn
RCSB PDB
PDBbind
99aa, >1MSN_1|Chains... at 94%
1mui
RCSB PDB
PDBbind
99aa, >1MUI_1|Chains... at 100%
1npa
RCSB PDB
PDBbind
99aa, >1NPA_1|Chains... at 100%
1npv
RCSB PDB
PDBbind
99aa, >1NPV_1|Chains... at 100%
1npw
RCSB PDB
PDBbind
99aa, >1NPW_1|Chains... at 100%
1ody
RCSB PDB
PDBbind
99aa, >1ODY_1|Chains... at 97%
1ohr
RCSB PDB
PDBbind
99aa, >1OHR_1|Chains... at 100%
1qbr
RCSB PDB
PDBbind
99aa, >1QBR_1|Chains... at 97%
1qbs
RCSB PDB
PDBbind
99aa, >1QBS_1|Chains... at 97%
1qbt
RCSB PDB
PDBbind
99aa, >1QBT_1|Chains... at 97%
1qbu
RCSB PDB
PDBbind
99aa, >1QBU_1|Chains... at 97%
1tcx
RCSB PDB
PDBbind
99aa, >1TCX_1|Chains... at 96%
1w5v
RCSB PDB
PDBbind
110aa, >1W5V_1|Chains... *
1w5w
RCSB PDB
PDBbind
110aa, >1W5W_1|Chains... at 100%
1w5x
RCSB PDB
PDBbind
110aa, >1W5X_1|Chains... at 100%
1w5y
RCSB PDB
PDBbind
110aa, >1W5Y_1|Chains... at 100%
1yt9
RCSB PDB
PDBbind
99aa, >1YT9_1|Chains... at 100%
1zsf
RCSB PDB
PDBbind
99aa, >1ZSF_1|Chains... at 100%
1zsr
RCSB PDB
PDBbind
99aa, >1ZSR_1|Chains... at 100%
2aqu
RCSB PDB
PDBbind
99aa, >2AQU_1|Chains... at 100%
2azb
RCSB PDB
PDBbind
99aa, >2AZB_1|Chain... at 94%
2azc
RCSB PDB
PDBbind
99aa, >2AZC_1|Chains... at 91%
2bbb
RCSB PDB
PDBbind
99aa, >2BBB_1|Chains... at 100%
2bpv
RCSB PDB
PDBbind
99aa, >2BPV_1|Chains... at 100%
2bpx
RCSB PDB
PDBbind
99aa, >2BPX_1|Chains... at 100%
2bpy
RCSB PDB
PDBbind
99aa, >2BPY_1|Chains... at 100%
2bqv
RCSB PDB
PDBbind
99aa, >2BQV_1|Chains... at 100%
2cej
RCSB PDB
PDBbind
99aa, >2CEJ_1|Chains... at 100%
2cem
RCSB PDB
PDBbind
99aa, >2CEM_1|Chains... at 100%
2cen
RCSB PDB
PDBbind
99aa, >2CEN_1|Chains... at 100%
2fde
RCSB PDB
PDBbind
100aa, >2FDE_1|Chains... at 99%
2fle
RCSB PDB
PDBbind
99aa, >2FLE_1|Chains... at 97%
2i4v
RCSB PDB
PDBbind
99aa, >2I4V_1|Chains... at 96%
2i4x
RCSB PDB
PDBbind
99aa, >2I4X_1|Chains... at 96%
2o4l
RCSB PDB
PDBbind
99aa, >2O4L_1|Chains... at 97%
2o4n
RCSB PDB
PDBbind
99aa, >2O4N_1|Chains... at 92%
2pk5
RCSB PDB
PDBbind
99aa, >2PK5_1|Chains... at 96%
2pk6
RCSB PDB
PDBbind
99aa, >2PK6_1|Chains... at 96%
2pqz
RCSB PDB
PDBbind
99aa, >2PQZ_1|Chains... at 100%
2pwc
RCSB PDB
PDBbind
99aa, >2PWC_1|Chains... at 100%
2pwr
RCSB PDB
PDBbind
99aa, >2PWR_1|Chains... at 100%
2pym
RCSB PDB
PDBbind
99aa, >2PYM_1|Chains... at 96%
2pyn
RCSB PDB
PDBbind
99aa, >2PYN_1|Chains... at 96%
2q63
RCSB PDB
PDBbind
99aa, >2Q63_1|Chains... at 96%
2q64
RCSB PDB
PDBbind
99aa, >2Q64_1|Chains... at 97%
2qhc
RCSB PDB
PDBbind
99aa, >2QHC_1|Chains... at 98%
2qnn
RCSB PDB
PDBbind
99aa, >2QNN_1|Chains... at 100%
2qnp
RCSB PDB
PDBbind
99aa, >2QNP_1|Chains... at 100%
2qnq
RCSB PDB
PDBbind
99aa, >2QNQ_1|Chains... at 100%
2r38
RCSB PDB
PDBbind
99aa, >2R38_1|Chains... at 98%
2r3t
RCSB PDB
PDBbind
99aa, >2R3T_1|Chains... at 98%
2r3w
RCSB PDB
PDBbind
99aa, >2R3W_1|Chains... at 98%
2r43
RCSB PDB
PDBbind
99aa, >2R43_1|Chains... at 98%
2upj
RCSB PDB
PDBbind
99aa, >2UPJ_1|Chains... at 100%
2uxz
RCSB PDB
PDBbind
99aa, >2UXZ_1|Chains... at 100%
2uy0
RCSB PDB
PDBbind
99aa, >2UY0_1|Chains... at 100%
2wkz
RCSB PDB
PDBbind
99aa, >2WKZ_1|Chains... at 100%
2wl0
RCSB PDB
PDBbind
99aa, >2WL0_1|Chains... at 96%
2xye
RCSB PDB
PDBbind
99aa, >2XYE_1|Chains... at 96%
2xyf
RCSB PDB
PDBbind
99aa, >2XYF_1|Chains... at 96%
2zga
RCSB PDB
PDBbind
99aa, >2ZGA_1|Chain... at 100%
3bc4
RCSB PDB
PDBbind
99aa, >3BC4_1|Chain... at 98%
3bgb
RCSB PDB
PDBbind
99aa, >3BGB_1|Chains... at 100%
3bgc
RCSB PDB
PDBbind
99aa, >3BGC_1|Chains... at 100%
3ckt
RCSB PDB
PDBbind
99aa, >3CKT_1|Chains... at 100%
3ggv
RCSB PDB
PDBbind
99aa, >3GGV_1|Chains... at 100%
3kdb
RCSB PDB
PDBbind
99aa, >3KDB_1|Chains... at 96%
3kdc
RCSB PDB
PDBbind
99aa, >3KDC_1|Chains... at 96%
3kdd
RCSB PDB
PDBbind
99aa, >3KDD_1|Chains... at 96%
3lzs
RCSB PDB
PDBbind
99aa, >3LZS_1|Chains... at 91%
3lzu
RCSB PDB
PDBbind
99aa, >3LZU_1|Chains... at 90%
3s43
RCSB PDB
PDBbind
99aa, >3S43_2|Chain... at 91%
3s53
RCSB PDB
PDBbind
99aa, >3S53_1|Chains... at 91%
3s54
RCSB PDB
PDBbind
99aa, >3S54_1|Chains... at 91%
3s56
RCSB PDB
PDBbind
99aa, >3S56_1|Chains... at 91%
3th9
RCSB PDB
PDBbind
99aa, >3TH9_1|Chains... at 96%
3tkw
RCSB PDB
PDBbind
103aa, >3TKW_1|Chains... at 95%
3zps
RCSB PDB
PDBbind
99aa, >3ZPS_1|Chains... at 96%
3zpt
RCSB PDB
PDBbind
99aa, >3ZPT_1|Chains... at 96%
3zpu
RCSB PDB
PDBbind
99aa, >3ZPU_1|Chains... at 96%
4a4q
RCSB PDB
PDBbind
99aa, >4A4Q_1|Chains... at 96%
4a6b
RCSB PDB
PDBbind
99aa, >4A6B_1|Chains... at 96%
4a6c
RCSB PDB
PDBbind
99aa, >4A6C_1|Chains... at 96%
4cp7
RCSB PDB
PDBbind
99aa, >4CP7_1|Chains... at 96%
4cpq
RCSB PDB
PDBbind
99aa, >4CPQ_1|Chains... at 96%
4cpr
RCSB PDB
PDBbind
99aa, >4CPR_1|Chains... at 96%
4cps
RCSB PDB
PDBbind
99aa, >4CPS_1|Chains... at 96%
4cpt
RCSB PDB
PDBbind
99aa, >4CPT_1|Chains... at 96%
4cpu
RCSB PDB
PDBbind
99aa, >4CPU_1|Chains... at 96%
4cpw
RCSB PDB
PDBbind
99aa, >4CPW_1|Chains... at 96%
4cpx
RCSB PDB
PDBbind
99aa, >4CPX_1|Chains... at 96%
4fe6
RCSB PDB
PDBbind
99aa, >4FE6_1|Chain... at 100%
4hla
RCSB PDB
PDBbind
99aa, >4HLA_1|Chains... at 100%
4i8w
RCSB PDB
PDBbind
99aa, >4I8W_1|Chains... at 100%
4i8z
RCSB PDB
PDBbind
99aa, >4I8Z_1|Chains... at 100%
4mc1
RCSB PDB
PDBbind
99aa, >4MC1_1|Chains... at 96%
4mc2
RCSB PDB
PDBbind
99aa, >4MC2_1|Chains... at 96%
4mc6
RCSB PDB
PDBbind
99aa, >4MC6_1|Chains... at 96%
4mc9
RCSB PDB
PDBbind
99aa, >4MC9_1|Chains... at 96%
4qgi
RCSB PDB
PDBbind
99aa, >4QGI_1|Chains... at 97%
4u7q
RCSB PDB
PDBbind
99aa, >4U7Q_1|Chains... at 96%
4u7v
RCSB PDB
PDBbind
99aa, >4U7V_1|Chains... at 96%
5ivt
RCSB PDB
PDBbind
99aa, >5IVT_1|Chains... at 96%
5kqx
RCSB PDB
PDBbind
99aa, >5KQX_1|Chains... at 92%
5kqy
RCSB PDB
PDBbind
99aa, >5KQY_1|Chains... at 92%
5kr0
RCSB PDB
PDBbind
99aa, >5KR0_1|Chains... at 92%
5tyr
RCSB PDB
PDBbind
99aa, >5TYR_1|Chains... at 100%
5tys
RCSB PDB
PDBbind
99aa, >5TYS_1|Chains... at 100%
7upj
RCSB PDB
PDBbind
99aa, >7UPJ_1|Chains... at 100%
6otg
RCSB PDB
PDBbind
99aa, >6OTG_1|Chains... at 91%
6oot
RCSB PDB
PDBbind
99aa, >6OOT_1|Chains... at 95%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1apv
RCSB PDB
PDBbind
5-mer
1apw
RCSB PDB
PDBbind
5-mer
1b6j
RCSB PDB
PDBbind
5-mer
1bhf
RCSB PDB
PDBbind
5-mer
1cpi
RCSB PDB
PDBbind
5-mer
1f1j
RCSB PDB
PDBbind
5-mer
1f9e
RCSB PDB
PDBbind
5-mer
1fch
RCSB PDB
PDBbind
5-mer
1fiv
RCSB PDB
PDBbind
5-mer
1fyr
RCSB PDB
PDBbind
5-mer
1gny
RCSB PDB
PDBbind
5-mer
1gu3
RCSB PDB
PDBbind
5-mer
1h5v
RCSB PDB
PDBbind
5-mer
1h9l
RCSB PDB
PDBbind
5-mer
1hef
RCSB PDB
PDBbind
5-mer
1iau
RCSB PDB
PDBbind
5-mer
1jq8
RCSB PDB
PDBbind
5-mer
1jq9
RCSB PDB
PDBbind
5-mer
1k9q
RCSB PDB
PDBbind
5-mer
1m7i
RCSB PDB
PDBbind
5-mer
1mf4
RCSB PDB
PDBbind
5-mer
1mhw
RCSB PDB
PDBbind
5-mer
1ny2
RCSB PDB
PDBbind
5-mer
1o9d
RCSB PDB
PDBbind
5-mer
1p02
RCSB PDB
PDBbind
5-mer
1p03
RCSB PDB
PDBbind
5-mer
1p04
RCSB PDB
PDBbind
5-mer
1p05
RCSB PDB
PDBbind
5-mer
1p06
RCSB PDB
PDBbind
5-mer
1p10
RCSB PDB
PDBbind
5-mer
1pau
RCSB PDB
PDBbind
5-mer
1qm5
RCSB PDB
PDBbind
5-mer
1qtn
RCSB PDB
PDBbind
5-mer
1shd
RCSB PDB
PDBbind
5-mer
1t37
RCSB PDB
PDBbind
5-mer
1tmb
RCSB PDB
PDBbind
5-mer
1w9u
RCSB PDB
PDBbind
5-mer
1w9v
RCSB PDB
PDBbind
5-mer
1waw
RCSB PDB
PDBbind
5-mer
1wb0
RCSB PDB
PDBbind
5-mer
1ym4
RCSB PDB
PDBbind
5-mer
1zm6
RCSB PDB
PDBbind
5-mer
2bcd
RCSB PDB
PDBbind
5-mer
2ce9
RCSB PDB
PDBbind
5-mer
2fgu
RCSB PDB
PDBbind
5-mer
2fgv
RCSB PDB
PDBbind
5-mer
2h5d
RCSB PDB
PDBbind
5-mer
2h5i
RCSB PDB
PDBbind
5-mer
2h5j
RCSB PDB
PDBbind
5-mer
2j9a
RCSB PDB
PDBbind
5-mer
2k1q
RCSB PDB
PDBbind
5-mer
2l6j
RCSB PDB
PDBbind
5-mer
2lpr
RCSB PDB
PDBbind
5-mer
2m0u
RCSB PDB
PDBbind
5-mer
2m0v
RCSB PDB
PDBbind
5-mer
2pcu
RCSB PDB
PDBbind
5-mer
2ql5
RCSB PDB
PDBbind
5-mer
2ql7
RCSB PDB
PDBbind
5-mer
2ql9
RCSB PDB
PDBbind
5-mer
2qlb
RCSB PDB
PDBbind
5-mer
2qlf
RCSB PDB
PDBbind
5-mer
2qlj
RCSB PDB
PDBbind
5-mer
3atw
RCSB PDB
PDBbind
5-mer
3ayc
RCSB PDB
PDBbind
5-mer
3c88
RCSB PDB
PDBbind
5-mer
3c89
RCSB PDB
PDBbind
5-mer
3c8a
RCSB PDB
PDBbind
5-mer
3c8b
RCSB PDB
PDBbind
5-mer
3chf
RCSB PDB
PDBbind
5-mer
3e7a
RCSB PDB
PDBbind
5-mer
3gjq
RCSB PDB
PDBbind
5-mer
3gjs
RCSB PDB
PDBbind
5-mer
3gjt
RCSB PDB
PDBbind
5-mer
3ibc
RCSB PDB
PDBbind
5-mer
3iqg
RCSB PDB
PDBbind
5-mer
3iqh
RCSB PDB
PDBbind
5-mer
3iqi
RCSB PDB
PDBbind
5-mer
3jzh
RCSB PDB
PDBbind
5-mer
3k05
RCSB PDB
PDBbind
5-mer
3k0h
RCSB PDB
PDBbind
5-mer
3k15
RCSB PDB
PDBbind
5-mer
3lpr
RCSB PDB
PDBbind
5-mer
3mp1
RCSB PDB
PDBbind
5-mer
3nin
RCSB PDB
PDBbind
5-mer
3nzw
RCSB PDB
PDBbind
5-mer
3nzx
RCSB PDB
PDBbind
5-mer
3ov1
RCSB PDB
PDBbind
5-mer
3ove
RCSB PDB
PDBbind
5-mer
3oyp
RCSB PDB
PDBbind
5-mer
3qw5
RCSB PDB
PDBbind
5-mer
3qw6
RCSB PDB
PDBbind
5-mer
3qw7
RCSB PDB
PDBbind
5-mer
3qw8
RCSB PDB
PDBbind
5-mer
3r7b
RCSB PDB
PDBbind
5-mer
3r7n
RCSB PDB
PDBbind
5-mer
3s8l
RCSB PDB
PDBbind
5-mer
3s8n
RCSB PDB
PDBbind
5-mer
3s8o
RCSB PDB
PDBbind
5-mer
3sxu
RCSB PDB
PDBbind
5-mer
3t6b
RCSB PDB
PDBbind
5-mer
3t6j
RCSB PDB
PDBbind
5-mer
3th0
RCSB PDB
PDBbind
5-mer
3u1i
RCSB PDB
PDBbind
5-mer
3u4w
RCSB PDB
PDBbind
5-mer
3vb4
RCSB PDB
PDBbind
5-mer
3vb5
RCSB PDB
PDBbind
5-mer
3vb7
RCSB PDB
PDBbind
5-mer
3wqv
RCSB PDB
PDBbind
5-mer
4czs
RCSB PDB
PDBbind
5-mer
4d8i
RCSB PDB
PDBbind
5-mer
4dkt
RCSB PDB
PDBbind
5-mer
4est
RCSB PDB
PDBbind
5-mer
4gm3
RCSB PDB
PDBbind
5-mer
4gm8
RCSB PDB
PDBbind
5-mer
4i9c
RCSB PDB
PDBbind
5-mer
4j78
RCSB PDB
PDBbind
5-mer
4j81
RCSB PDB
PDBbind
5-mer
4j82
RCSB PDB
PDBbind
5-mer
4j84
RCSB PDB
PDBbind
5-mer
4k3m
RCSB PDB
PDBbind
5-mer
4kvm
RCSB PDB
PDBbind
5-mer
4l6t
RCSB PDB
PDBbind
5-mer
4lte
RCSB PDB
PDBbind
5-mer
4omc
RCSB PDB
PDBbind
5-mer
4omd
RCSB PDB
PDBbind
5-mer
4pry
RCSB PDB
PDBbind
5-mer
4ps0
RCSB PDB
PDBbind
5-mer
4ps1
RCSB PDB
PDBbind
5-mer
4q6f
RCSB PDB
PDBbind
5-mer
4rcp
RCSB PDB
PDBbind
5-mer
4rsp
RCSB PDB
PDBbind
5-mer
4ryd
RCSB PDB
PDBbind
5-mer
4sga
RCSB PDB
PDBbind
5-mer
4whh
RCSB PDB
PDBbind
5-mer
4whl
RCSB PDB
PDBbind
5-mer
4wvs
RCSB PDB
PDBbind
5-mer
4wvu
RCSB PDB
PDBbind
5-mer
4x13
RCSB PDB
PDBbind
5-mer
4x9w
RCSB PDB
PDBbind
5-mer
4yec
RCSB PDB
PDBbind
5-mer
4yv8
RCSB PDB
PDBbind
5-mer
4z5w
RCSB PDB
PDBbind
5-mer
4z7q
RCSB PDB
PDBbind
5-mer
4zro
RCSB PDB
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5e8f
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5eld
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5-mer
5ele
RCSB PDB
PDBbind
5-mer
5elf
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5f5b
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5-mer
5h7h
RCSB PDB
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5-mer
5icv
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PDBbind
5-mer
5jr6
RCSB PDB
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5-mer
5lpr
RCSB PDB
PDBbind
5-mer
5n99
RCSB PDB
PDBbind
5-mer
5nwi
RCSB PDB
PDBbind
5-mer
5nwk
RCSB PDB
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5-mer
5ttw
RCSB PDB
PDBbind
5-mer
5x54
RCSB PDB
PDBbind
5-mer
5yc1
RCSB PDB
PDBbind
5-mer
5zob
RCSB PDB
PDBbind
5-mer
6ax4
RCSB PDB
PDBbind
5-mer
6b5q
RCSB PDB
PDBbind
5-mer
6eqv
RCSB PDB
PDBbind
5-mer
6eqw
RCSB PDB
PDBbind
5-mer
6lpr
RCSB PDB
PDBbind
5-mer
6mub
RCSB PDB
PDBbind
5-mer
7lpr
RCSB PDB
PDBbind
5-mer
8lpr
RCSB PDB
PDBbind
5-mer
9lpr
RCSB PDB
PDBbind
5-mer
6hzb
RCSB PDB
PDBbind
5-mer
6hza
RCSB PDB
PDBbind
5-mer
6hv2
RCSB PDB
PDBbind
5-mer
6dn6
RCSB PDB
PDBbind
5-mer
Entry Information
PDB ID
1nh0
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
retropepsin
Ligand Name
5-mer
EC.Number
E.C.3.4.23.16
Resolution
1.03(Å)
Affinity (Kd/Ki/IC50)
Ki=0.18nM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
J.Med.Chem. v47 pp. 2030-6, 2004
Ligand Properties
Formula
C
3
7
H
4
3
N
5
O
1
1
Molecular Weight
733.764
Exact Mass
733.296
No. of atoms
96
No. of bonds
98
Polar Surface Area
263.55
LOGP Value
4.45 (
Computed with XLOGP3
)
3.06 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 25
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 3
Canonical SMILES
O=C(N[C@H]([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCC(=O)O)CCC(=O)O)Cc1ccccc1)O)Cc1ccccc1)OCc1ccccc1
InChI String
InChI=1S/C37H43N5O11/c38-33(48)26(16-18-30(43)44)39-34(49)27(17-19-31(45)46)40-35(50)29(21-24-12-6-2-7-13-24)41-36(51)32(47)28(20-23-10-4-1-5-11-23)42-37(52)53-22-25-14-8-3-9-15-25/h1-15,26-29,32,47H,16-22H2,(H2,38,48)(H,39,49)(H,40,50)(H,41,51)(H,42,52)(H,43,44)(H,45,46)/t26-,27-,28-,29-,32+/m0/s1
Links to External Databases
RCSB PDB
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PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P03367
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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