Browse entries in the PDBbind-CN Database
HEADER 3GGU_COMPLEX COMPND 3GGU_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 99 PRO GLN ILE THR LEU TRP GLN ARG PRO ILE VAL THR VAL SEQRES 2 A 99 LYS ILE GLU GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 A 99 GLY ALA ASP ASP THR VAL PHE GLU GLU LEU THR LEU SER SEQRES 4 A 99 GLY ARG TRP LYS PRO ARG LEU ILE GLY GLY ILE GLY GLY SEQRES 5 A 99 PHE VAL ARG VAL ARG GLN TYR ASP GLN VAL PRO ILE GLU SEQRES 6 A 99 ILE CYS GLY HIS LYS VAL ILE ASP THR VAL LEU VAL GLY SEQRES 7 A 99 PRO THR PRO THR ASN VAL ILE GLY ARG ASN VAL MET THR SEQRES 8 A 99 GLN LEU GLY CYS THR LEU ASN PHE SEQRES 1 B 99 PRO GLN ILE THR LEU TRP GLN ARG PRO ILE VAL THR VAL SEQRES 2 B 99 LYS ILE GLU GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 B 99 GLY ALA ASP ASP THR VAL PHE GLU GLU LEU THR LEU SER SEQRES 4 B 99 GLY ARG TRP LYS PRO ARG LEU ILE GLY GLY ILE GLY GLY SEQRES 5 B 99 PHE VAL ARG VAL ARG GLN TYR ASP GLN VAL PRO ILE GLU SEQRES 6 B 99 ILE CYS GLY HIS LYS VAL ILE ASP THR VAL LEU VAL GLY SEQRES 7 B 99 PRO THR PRO THR ASN VAL ILE GLY ARG ASN VAL MET THR SEQRES 8 B 99 GLN LEU GLY CYS THR LEU ASN PHE HET UNN A 341 75 ATOM 1 N PRO A 1 -27.584 31.780 23.513 1.00 31.99 N ATOM 2 CA PRO A 1 -27.602 31.090 24.793 1.00 31.59 C ATOM 3 C PRO A 1 -26.334 31.325 25.594 1.00 31.14 C ATOM 4 O PRO A 1 -25.256 31.509 25.025 1.00 31.23 O ATOM 5 CB PRO A 1 -27.663 29.611 24.396 1.00 31.87 C ATOM 6 CG PRO A 1 -28.319 29.605 23.085 1.00 31.91 C ATOM 7 CD PRO A 1 -27.904 30.877 22.396 1.00 32.52 C ATOM 8 HA PRO A 1 -28.427 31.433 25.418 1.00 0.00 H ATOM 9 HD3 PRO A 1 -27.031 30.712 21.765 1.00 0.00 H ATOM 10 HD2 PRO A 1 -28.718 31.277 21.791 1.00 0.00 H ATOM 11 HG3 PRO A 1 -29.402 29.577 23.205 1.00 0.00 H ATOM 12 HG2 PRO A 1 -27.997 28.740 22.506 1.00 0.00 H ATOM 13 HB2 PRO A 1 -26.660 29.190 24.326 1.00 0.00 H ATOM 14 HB3 PRO A 1 -28.246 29.042 25.120 1.00 0.00 H ATOM 15 N GLN A 2 -26.489 31.316 26.910 1.00 30.05 N ATOM 16 CA GLN A 2 -25.380 31.326 27.843 1.00 29.74 C ATOM 17 C GLN A 2 -25.389 29.969 28.555 1.00 29.05 C ATOM 18 O GLN A 2 -26.444 29.513 29.008 1.00 29.13 O ATOM 19 CB GLN A 2 -25.576 32.466 28.835 1.00 29.71 C ATOM 20 CG GLN A 2 -24.360 32.832 29.661 1.00 30.60 C ATOM 21 CD GLN A 2 -24.613 34.058 30.529 1.00 31.28 C ATOM 22 OE1 GLN A 2 -25.634 34.733 30.394 1.00 33.43 O ATOM 23 NE2 GLN A 2 -23.683 34.348 31.428 1.00 31.88 N ATOM 24 HA GLN A 2 -24.424 31.479 27.342 1.00 0.00 H ATOM 25 HB2 GLN A 2 -25.879 33.350 28.274 1.00 0.00 H ATOM 26 HB3 GLN A 2 -26.374 32.181 29.521 1.00 0.00 H ATOM 27 HG2 GLN A 2 -24.104 31.990 30.305 1.00 0.00 H ATOM 28 HG3 GLN A 2 -23.527 33.041 28.990 1.00 0.00 H ATOM 29 HE22 GLN A 2 -22.835 33.752 31.510 1.00 0.00 H ATOM 30 HE21 GLN A 2 -23.802 35.172 32.052 1.00 0.00 H ATOM 31 H GLN A 2 -27.456 31.301 27.293 1.00 0.00 H ATOM 32 N ILE A 3 -24.228 29.316 28.626 1.00 28.35 N ATOM 33 CA ILE A 3 -24.095 28.029 29.310 1.00 28.34 C ATOM 34 C ILE A 3 -23.091 28.192 30.454 1.00 27.57 C ATOM 35 O ILE A 3 -21.916 28.463 30.224 1.00 27.23 O ATOM 36 CB ILE A 3 -23.702 26.875 28.299 1.00 28.49 C ATOM 37 CG1 ILE A 3 -24.849 26.673 27.290 1.00 29.40 C ATOM 38 CG2 ILE A 3 -23.346 25.562 29.033 1.00 28.89 C ATOM 39 CD1 ILE A 3 -24.601 25.680 26.163 1.00 29.75 C ATOM 40 HA ILE A 3 -25.053 27.726 29.732 1.00 0.00 H ATOM 41 HB ILE A 3 -22.803 27.172 27.758 1.00 0.00 H ATOM 42 HG12 ILE A 3 -25.722 26.331 27.846 1.00 0.00 H ATOM 43 HG13 ILE A 3 -25.065 27.640 26.837 1.00 0.00 H ATOM 44 HD11 ILE A 3 -23.743 26.006 25.575 1.00 0.00 H ATOM 45 HD12 ILE A 3 -24.401 24.695 26.586 1.00 0.00 H ATOM 46 HD13 ILE A 3 -25.483 25.630 25.524 1.00 0.00 H ATOM 47 HG21 ILE A 3 -22.500 25.737 29.698 1.00 0.00 H ATOM 48 HG22 ILE A 3 -24.205 25.229 29.615 1.00 0.00 H ATOM 49 HG23 ILE A 3 -23.083 24.798 28.301 1.00 0.00 H ATOM 50 H ILE A 3 -23.388 29.736 28.180 1.00 0.00 H ATOM 51 N THR A 4 -23.567 28.069 31.695 1.00 27.09 N ATOM 52 CA THR A 4 -22.681 28.121 32.861 1.00 26.32 C ATOM 53 C THR A 4 -21.947 26.782 32.965 1.00 26.04 C ATOM 54 O THR A 4 -22.305 25.826 32.272 1.00 27.08 O ATOM 55 CB THR A 4 -23.461 28.405 34.155 1.00 26.94 C ATOM 56 OG1 THR A 4 -24.594 27.531 34.218 1.00 28.03 O ATOM 57 CG2 THR A 4 -23.929 29.865 34.192 1.00 26.71 C ATOM 58 HA THR A 4 -21.970 28.937 32.733 1.00 0.00 H ATOM 59 HB THR A 4 -22.809 28.231 35.011 1.00 0.00 H ATOM 60 HG1 THR A 4 -24.285 26.591 34.214 1.00 0.00 H ATOM 61 HG23 THR A 4 -23.062 30.524 34.144 1.00 0.00 H ATOM 62 HG21 THR A 4 -24.582 30.058 33.340 1.00 0.00 H ATOM 63 HG22 THR A 4 -24.474 30.047 35.118 1.00 0.00 H ATOM 64 H THR A 4 -24.588 27.933 31.837 1.00 0.00 H ATOM 65 N LEU A 5 -20.952 26.697 33.844 1.00 24.19 N ATOM 66 CA LEU A 5 -20.060 25.540 33.861 1.00 22.53 C ATOM 67 C LEU A 5 -20.102 24.742 35.164 1.00 22.37 C ATOM 68 O LEU A 5 -19.198 23.967 35.444 1.00 21.78 O ATOM 69 CB LEU A 5 -18.620 25.974 33.487 1.00 22.39 C ATOM 70 CG LEU A 5 -18.504 26.567 32.076 1.00 21.87 C ATOM 71 CD1 LEU A 5 -17.150 27.193 31.881 1.00 21.89 C ATOM 72 CD2 LEU A 5 -18.769 25.527 30.972 1.00 23.43 C ATOM 73 HA LEU A 5 -20.427 24.846 33.105 1.00 0.00 H ATOM 74 HB2 LEU A 5 -18.288 26.724 34.205 1.00 0.00 H ATOM 75 HB3 LEU A 5 -17.970 25.101 33.549 1.00 0.00 H ATOM 76 HG LEU A 5 -19.276 27.331 31.990 1.00 0.00 H ATOM 77 HD21 LEU A 5 -18.044 24.717 31.056 1.00 0.00 H ATOM 78 HD22 LEU A 5 -19.777 25.127 31.086 1.00 0.00 H ATOM 79 HD23 LEU A 5 -18.673 26.003 29.996 1.00 0.00 H ATOM 80 HD11 LEU A 5 -17.010 27.988 32.614 1.00 0.00 H ATOM 81 HD12 LEU A 5 -16.378 26.435 32.013 1.00 0.00 H ATOM 82 HD13 LEU A 5 -17.085 27.609 30.875 1.00 0.00 H ATOM 83 H LEU A 5 -20.807 27.466 34.529 1.00 0.00 H ATOM 84 N TRP A 6 -21.175 24.914 35.945 1.00 21.94 N ATOM 85 CA TRP A 6 -21.350 24.153 37.182 1.00 22.17 C ATOM 86 C TRP A 6 -21.446 22.651 36.895 1.00 22.89 C ATOM 87 O TRP A 6 -21.016 21.797 37.709 1.00 24.03 O ATOM 88 CB TRP A 6 -22.553 24.692 37.960 1.00 22.13 C ATOM 89 CG TRP A 6 -22.228 26.065 38.434 1.00 20.84 C ATOM 90 CD1 TRP A 6 -22.578 27.242 37.841 1.00 20.79 C ATOM 91 CD2 TRP A 6 -21.396 26.404 39.540 1.00 22.58 C ATOM 92 NE1 TRP A 6 -22.047 28.299 38.533 1.00 21.55 N ATOM 93 CE2 TRP A 6 -21.319 27.815 39.587 1.00 21.79 C ATOM 94 CE3 TRP A 6 -20.744 25.656 40.530 1.00 24.42 C ATOM 95 CZ2 TRP A 6 -20.590 28.493 40.563 1.00 22.96 C ATOM 96 CZ3 TRP A 6 -20.020 26.324 41.496 1.00 24.53 C ATOM 97 CH2 TRP A 6 -19.950 27.733 41.508 1.00 25.09 C ATOM 98 HA TRP A 6 -20.472 24.283 37.814 1.00 0.00 H ATOM 99 HB2 TRP A 6 -23.428 24.724 37.311 1.00 0.00 H ATOM 100 HB3 TRP A 6 -22.759 24.046 38.814 1.00 0.00 H ATOM 101 HE1 TRP A 6 -22.176 29.304 38.297 1.00 0.00 H ATOM 102 HD1 TRP A 6 -23.192 27.330 36.945 1.00 0.00 H ATOM 103 HZ2 TRP A 6 -20.531 29.581 40.574 1.00 0.00 H ATOM 104 HH2 TRP A 6 -19.373 28.230 42.288 1.00 0.00 H ATOM 105 HZ3 TRP A 6 -19.494 25.754 42.262 1.00 0.00 H ATOM 106 HE3 TRP A 6 -20.808 24.568 40.537 1.00 0.00 H ATOM 107 H TRP A 6 -21.901 25.604 35.666 1.00 0.00 H ATOM 108 N GLN A 7 -21.987 22.342 35.724 1.00 21.99 N ATOM 109 CA GLN A 7 -22.104 20.974 35.254 1.00 22.47 C ATOM 110 C GLN A 7 -21.430 20.875 33.894 1.00 22.37 C ATOM 111 O GLN A 7 -21.178 21.888 33.261 1.00 23.57 O ATOM 112 CB GLN A 7 -23.587 20.581 35.168 1.00 22.67 C ATOM 113 CG GLN A 7 -24.422 21.457 34.224 1.00 24.06 C ATOM 114 CD GLN A 7 -25.867 21.648 34.702 1.00 25.94 C ATOM 115 OE1 GLN A 7 -26.432 20.804 35.404 1.00 28.06 O ATOM 116 NE2 GLN A 7 -26.464 22.768 34.319 1.00 24.51 N ATOM 117 HA GLN A 7 -21.616 20.287 35.946 1.00 0.00 H ATOM 118 HB2 GLN A 7 -23.647 19.550 34.819 1.00 0.00 H ATOM 119 HB3 GLN A 7 -24.017 20.651 36.167 1.00 0.00 H ATOM 120 HG2 GLN A 7 -23.949 22.436 34.149 1.00 0.00 H ATOM 121 HG3 GLN A 7 -24.441 20.988 33.240 1.00 0.00 H ATOM 122 HE22 GLN A 7 -25.953 23.454 33.727 1.00 0.00 H ATOM 123 HE21 GLN A 7 -27.444 22.961 34.610 1.00 0.00 H ATOM 124 H GLN A 7 -22.341 23.110 35.119 1.00 0.00 H ATOM 125 N ARG A 8 -21.133 19.658 33.463 1.00 22.26 N ATOM 126 CA ARG A 8 -20.545 19.452 32.148 1.00 22.50 C ATOM 127 C ARG A 8 -21.493 20.060 31.121 1.00 22.27 C ATOM 128 O ARG A 8 -22.707 19.840 31.195 1.00 21.73 O ATOM 129 CB ARG A 8 -20.377 17.958 31.871 1.00 22.71 C ATOM 130 CG ARG A 8 -19.530 17.240 32.899 1.00 23.99 C ATOM 131 CD ARG A 8 -18.821 16.049 32.281 1.00 27.47 C ATOM 132 NE ARG A 8 -18.249 15.171 33.299 1.00 27.26 N ATOM 133 CZ ARG A 8 -17.301 14.262 33.075 1.00 29.02 C ATOM 134 NH1 ARG A 8 -16.776 14.109 31.860 1.00 29.08 N ATOM 135 NH2 ARG A 8 -16.861 13.513 34.080 1.00 27.66 N ATOM 136 HA ARG A 8 -19.562 19.921 32.096 1.00 0.00 H ATOM 137 HB2 ARG A 8 -21.365 17.497 31.856 1.00 0.00 H ATOM 138 HB3 ARG A 8 -19.907 17.839 30.894 1.00 0.00 H ATOM 139 HG2 ARG A 8 -18.787 17.932 33.295 1.00 0.00 H ATOM 140 HG3 ARG A 8 -20.170 16.893 33.710 1.00 0.00 H ATOM 141 HD2 ARG A 8 -18.020 16.410 31.636 1.00 0.00 H ATOM 142 HD3 ARG A 8 -19.537 15.481 31.686 1.00 0.00 H ATOM 143 HE ARG A 8 -18.608 15.262 34.271 1.00 0.00 H ATOM 144 HH12 ARG A 8 -16.037 13.396 31.699 1.00 0.00 H ATOM 145 HH11 ARG A 8 -17.106 14.703 31.073 1.00 0.00 H ATOM 146 HH22 ARG A 8 -16.121 12.801 33.913 1.00 0.00 H ATOM 147 HH21 ARG A 8 -17.256 13.638 35.034 1.00 0.00 H ATOM 148 H ARG A 8 -21.323 18.838 34.074 1.00 0.00 H ATOM 149 N PRO A 9 -20.948 20.847 30.178 1.00 22.11 N ATOM 150 CA PRO A 9 -21.760 21.497 29.148 1.00 22.03 C ATOM 151 C PRO A 9 -22.128 20.560 27.990 1.00 21.62 C ATOM 152 O PRO A 9 -21.620 20.681 26.876 1.00 21.06 O ATOM 153 CB PRO A 9 -20.886 22.659 28.700 1.00 21.45 C ATOM 154 CG PRO A 9 -19.467 22.147 28.884 1.00 21.44 C ATOM 155 CD PRO A 9 -19.520 21.221 30.075 1.00 22.39 C ATOM 156 HA PRO A 9 -22.732 21.815 29.526 1.00 0.00 H ATOM 157 HD3 PRO A 9 -18.900 20.340 29.909 1.00 0.00 H ATOM 158 HD2 PRO A 9 -19.187 21.732 30.978 1.00 0.00 H ATOM 159 HG3 PRO A 9 -18.785 22.976 29.076 1.00 0.00 H ATOM 160 HG2 PRO A 9 -19.139 21.607 27.996 1.00 0.00 H ATOM 161 HB2 PRO A 9 -21.076 22.907 27.656 1.00 0.00 H ATOM 162 HB3 PRO A 9 -21.064 23.539 29.319 1.00 0.00 H ATOM 163 N ILE A 10 -23.048 19.657 28.294 1.00 22.05 N ATOM 164 CA ILE A 10 -23.524 18.666 27.332 1.00 22.69 C ATOM 165 C ILE A 10 -24.672 19.245 26.493 1.00 22.46 C ATOM 166 O ILE A 10 -25.587 19.921 27.013 1.00 22.93 O ATOM 167 CB ILE A 10 -24.040 17.350 28.041 1.00 22.97 C ATOM 168 CG1 ILE A 10 -22.983 16.757 29.007 1.00 25.92 C ATOM 169 CG2 ILE A 10 -24.539 16.339 27.004 1.00 25.04 C ATOM 170 CD1 ILE A 10 -21.883 15.937 28.386 1.00 33.05 C ATOM 171 HA ILE A 10 -22.675 18.413 26.696 1.00 0.00 H ATOM 172 HB ILE A 10 -24.892 17.613 28.668 1.00 0.00 H ATOM 173 HG12 ILE A 10 -22.517 17.588 29.537 1.00 0.00 H ATOM 174 HG13 ILE A 10 -23.507 16.121 29.720 1.00 0.00 H ATOM 175 HD11 ILE A 10 -22.318 15.085 27.863 1.00 0.00 H ATOM 176 HD12 ILE A 10 -21.327 16.553 27.680 1.00 0.00 H ATOM 177 HD13 ILE A 10 -21.211 15.581 29.167 1.00 0.00 H ATOM 178 HG21 ILE A 10 -25.358 16.779 26.435 1.00 0.00 H ATOM 179 HG22 ILE A 10 -23.723 16.080 26.329 1.00 0.00 H ATOM 180 HG23 ILE A 10 -24.889 15.441 27.513 1.00 0.00 H ATOM 181 H ILE A 10 -23.447 19.653 29.254 1.00 0.00 H ATOM 182 N VAL A 11 -24.666 18.906 25.207 1.00 21.74 N ATOM 183 CA VAL A 11 -25.684 19.383 24.266 1.00 21.74 C ATOM 184 C VAL A 11 -26.118 18.236 23.395 1.00 22.31 C ATOM 185 O VAL A 11 -25.377 17.258 23.205 1.00 23.39 O ATOM 186 CB VAL A 11 -25.124 20.539 23.356 1.00 21.47 C ATOM 187 CG1 VAL A 11 -24.822 21.769 24.197 1.00 21.51 C ATOM 188 CG2 VAL A 11 -23.903 20.083 22.549 1.00 23.85 C ATOM 189 HA VAL A 11 -26.527 19.774 24.836 1.00 0.00 H ATOM 190 HB VAL A 11 -25.892 20.806 22.630 1.00 0.00 H ATOM 191 HG11 VAL A 11 -25.736 22.108 24.684 1.00 0.00 H ATOM 192 HG12 VAL A 11 -24.078 21.517 24.953 1.00 0.00 H ATOM 193 HG13 VAL A 11 -24.435 22.561 23.555 1.00 0.00 H ATOM 194 HG21 VAL A 11 -23.114 19.770 23.232 1.00 0.00 H ATOM 195 HG22 VAL A 11 -24.184 19.247 21.909 1.00 0.00 H ATOM 196 HG23 VAL A 11 -23.546 20.909 21.934 1.00 0.00 H ATOM 197 H VAL A 11 -23.913 18.281 24.857 1.00 0.00 H ATOM 198 N THR A 12 -27.307 18.374 22.826 1.00 22.86 N ATOM 199 CA THR A 12 -27.858 17.344 21.964 1.00 23.51 C ATOM 200 C THR A 12 -27.519 17.697 20.530 1.00 23.57 C ATOM 201 O THR A 12 -27.674 18.855 20.106 1.00 24.83 O ATOM 202 CB THR A 12 -29.381 17.255 22.164 1.00 23.14 C ATOM 203 OG1 THR A 12 -29.645 16.849 23.519 1.00 23.81 O ATOM 204 CG2 THR A 12 -30.007 16.256 21.177 1.00 24.43 C ATOM 205 HA THR A 12 -27.433 16.371 22.209 1.00 0.00 H ATOM 206 HB THR A 12 -29.827 18.231 21.974 1.00 0.00 H ATOM 207 HG1 THR A 12 -29.262 17.516 24.143 1.00 0.00 H ATOM 208 HG23 THR A 12 -29.799 16.577 20.156 1.00 0.00 H ATOM 209 HG21 THR A 12 -29.580 15.267 21.343 1.00 0.00 H ATOM 210 HG22 THR A 12 -31.085 16.218 21.335 1.00 0.00 H ATOM 211 H THR A 12 -27.857 19.239 23.001 1.00 0.00 H ATOM 212 N VAL A 13 -27.058 16.712 19.777 1.00 24.49 N ATOM 213 CA VAL A 13 -26.752 16.953 18.370 1.00 24.60 C ATOM 214 C VAL A 13 -27.461 15.966 17.451 1.00 24.57 C ATOM 215 O VAL A 13 -27.803 14.833 17.859 1.00 26.18 O ATOM 216 CB VAL A 13 -25.238 16.936 18.094 1.00 24.81 C ATOM 217 CG1 VAL A 13 -24.494 17.898 19.076 1.00 26.24 C ATOM 218 CG2 VAL A 13 -24.716 15.548 18.213 1.00 24.99 C ATOM 219 HA VAL A 13 -27.127 17.953 18.150 1.00 0.00 H ATOM 220 HB VAL A 13 -25.058 17.287 17.078 1.00 0.00 H ATOM 221 HG11 VAL A 13 -24.868 18.913 18.942 1.00 0.00 H ATOM 222 HG12 VAL A 13 -24.672 17.576 20.102 1.00 0.00 H ATOM 223 HG13 VAL A 13 -23.425 17.873 18.866 1.00 0.00 H ATOM 224 HG21 VAL A 13 -24.902 15.176 19.221 1.00 0.00 H ATOM 225 HG22 VAL A 13 -25.221 14.908 17.489 1.00 0.00 H ATOM 226 HG23 VAL A 13 -23.644 15.546 18.016 1.00 0.00 H ATOM 227 H VAL A 13 -26.914 15.767 20.187 1.00 0.00 H ATOM 228 N LYS A 14 -27.690 16.390 16.217 1.00 23.20 N ATOM 229 CA LYS A 14 -28.154 15.471 15.181 1.00 23.11 C ATOM 230 C LYS A 14 -27.111 15.448 14.074 1.00 23.57 C ATOM 231 O LYS A 14 -26.818 16.476 13.466 1.00 23.50 O ATOM 232 CB LYS A 14 -29.510 15.893 14.618 1.00 22.31 C ATOM 233 CG LYS A 14 -30.007 14.928 13.556 1.00 21.77 C ATOM 234 CD LYS A 14 -31.358 15.340 12.999 1.00 20.16 C ATOM 235 CE LYS A 14 -31.816 14.407 11.915 1.00 24.32 C ATOM 236 NZ LYS A 14 -33.077 14.928 11.306 1.00 21.35 N ATOM 237 HA LYS A 14 -28.283 14.478 15.612 1.00 0.00 H ATOM 238 HB2 LYS A 14 -30.235 15.926 15.431 1.00 0.00 H ATOM 239 HB3 LYS A 14 -29.415 16.885 14.177 1.00 0.00 H ATOM 240 HG2 LYS A 14 -29.284 14.899 12.741 1.00 0.00 H ATOM 241 HG3 LYS A 14 -30.096 13.935 13.997 1.00 0.00 H ATOM 242 HD2 LYS A 14 -32.091 15.333 13.806 1.00 0.00 H ATOM 243 HD3 LYS A 14 -31.280 16.347 12.590 1.00 0.00 H ATOM 244 HE2 LYS A 14 -31.998 13.419 12.339 1.00 0.00 H ATOM 245 HE3 LYS A 14 -31.045 14.335 11.148 1.00 0.00 H ATOM 246 HZ1 LYS A 14 -33.812 14.995 12.038 1.00 0.00 H ATOM 247 HZ2 LYS A 14 -32.902 15.870 10.901 1.00 0.00 H ATOM 248 HZ3 LYS A 14 -33.392 14.280 10.556 1.00 0.00 H ATOM 249 H LYS A 14 -27.537 17.392 15.983 1.00 0.00 H ATOM 250 N ILE A 15 -26.536 14.277 13.814 1.00 24.33 N ATOM 251 CA ILE A 15 -25.555 14.165 12.745 1.00 25.82 C ATOM 252 C ILE A 15 -25.847 12.978 11.841 1.00 25.81 C ATOM 253 O ILE A 15 -25.924 11.848 12.315 1.00 26.19 O ATOM 254 CB ILE A 15 -24.140 14.010 13.312 1.00 26.13 C ATOM 255 CG1 ILE A 15 -23.781 15.206 14.203 1.00 27.08 C ATOM 256 CG2 ILE A 15 -23.118 13.836 12.153 1.00 26.45 C ATOM 257 CD1 ILE A 15 -22.516 15.028 14.951 1.00 29.27 C ATOM 258 HA ILE A 15 -25.620 15.084 12.163 1.00 0.00 H ATOM 259 HB ILE A 15 -24.103 13.116 13.934 1.00 0.00 H ATOM 260 HG12 ILE A 15 -23.688 16.090 13.573 1.00 0.00 H ATOM 261 HG13 ILE A 15 -24.588 15.356 14.920 1.00 0.00 H ATOM 262 HD11 ILE A 15 -22.597 14.153 15.596 1.00 0.00 H ATOM 263 HD12 ILE A 15 -21.696 14.888 14.247 1.00 0.00 H ATOM 264 HD13 ILE A 15 -22.327 15.913 15.559 1.00 0.00 H ATOM 265 HG21 ILE A 15 -23.373 12.947 11.576 1.00 0.00 H ATOM 266 HG22 ILE A 15 -23.151 14.713 11.506 1.00 0.00 H ATOM 267 HG23 ILE A 15 -22.116 13.727 12.567 1.00 0.00 H ATOM 268 H ILE A 15 -26.788 13.439 14.376 1.00 0.00 H ATOM 269 N GLU A 16 -25.985 13.247 10.540 1.00 26.53 N ATOM 270 CA GLU A 16 -26.346 12.242 9.545 1.00 27.59 C ATOM 271 C GLU A 16 -27.446 11.308 10.043 1.00 26.99 C ATOM 272 O GLU A 16 -27.294 10.082 10.078 1.00 27.11 O ATOM 273 CB GLU A 16 -25.108 11.516 8.999 1.00 28.38 C ATOM 274 CG GLU A 16 -24.196 12.478 8.236 1.00 30.58 C ATOM 275 CD GLU A 16 -23.025 11.811 7.554 1.00 32.76 C ATOM 276 OE1 GLU A 16 -22.964 10.563 7.531 1.00 34.93 O ATOM 277 OE2 GLU A 16 -22.169 12.550 7.027 1.00 32.39 O ATOM 278 HA GLU A 16 -26.782 12.760 8.691 1.00 0.00 H ATOM 279 HB2 GLU A 16 -24.553 11.084 9.831 1.00 0.00 H ATOM 280 HB3 GLU A 16 -25.429 10.721 8.326 1.00 0.00 H ATOM 281 HG2 GLU A 16 -24.792 12.984 7.476 1.00 0.00 H ATOM 282 HG3 GLU A 16 -23.808 13.213 8.941 1.00 0.00 H ATOM 283 H GLU A 16 -25.827 14.224 10.219 1.00 0.00 H ATOM 284 N GLY A 17 -28.548 11.932 10.453 1.00 25.54 N ATOM 285 CA GLY A 17 -29.756 11.247 10.869 1.00 24.07 C ATOM 286 C GLY A 17 -29.739 10.649 12.257 1.00 22.97 C ATOM 287 O GLY A 17 -30.742 10.057 12.670 1.00 22.95 O ATOM 288 HA3 GLY A 17 -29.942 10.439 10.161 1.00 0.00 H ATOM 289 HA2 GLY A 17 -30.577 11.963 10.825 1.00 0.00 H ATOM 290 H GLY A 17 -28.542 12.972 10.476 1.00 0.00 H ATOM 291 N GLN A 18 -28.615 10.807 12.967 1.00 22.31 N ATOM 292 CA GLN A 18 -28.394 10.153 14.258 1.00 22.68 C ATOM 293 C GLN A 18 -28.405 11.155 15.391 1.00 21.75 C ATOM 294 O GLN A 18 -27.828 12.230 15.272 1.00 22.71 O ATOM 295 CB GLN A 18 -27.074 9.380 14.267 1.00 22.64 C ATOM 296 CG GLN A 18 -27.061 8.238 13.264 1.00 23.99 C ATOM 297 CD GLN A 18 -25.686 7.891 12.769 1.00 26.89 C ATOM 298 OE1 GLN A 18 -24.927 7.193 13.440 1.00 27.72 O ATOM 299 NE2 GLN A 18 -25.363 8.352 11.568 1.00 28.67 N ATOM 300 HA GLN A 18 -29.214 9.450 14.406 1.00 0.00 H ATOM 301 HB2 GLN A 18 -26.264 10.068 14.024 1.00 0.00 H ATOM 302 HB3 GLN A 18 -26.915 8.971 15.265 1.00 0.00 H ATOM 303 HG2 GLN A 18 -27.490 7.356 13.740 1.00 0.00 H ATOM 304 HG3 GLN A 18 -27.674 8.522 12.409 1.00 0.00 H ATOM 305 HE22 GLN A 18 -26.038 8.939 11.037 1.00 0.00 H ATOM 306 HE21 GLN A 18 -24.435 8.126 11.157 1.00 0.00 H ATOM 307 H GLN A 18 -27.867 11.420 12.585 1.00 0.00 H ATOM 308 N LEU A 19 -29.033 10.788 16.498 1.00 21.03 N ATOM 309 CA LEU A 19 -29.149 11.693 17.634 1.00 21.38 C ATOM 310 C LEU A 19 -28.090 11.281 18.652 1.00 21.85 C ATOM 311 O LEU A 19 -27.986 10.088 18.968 1.00 21.29 O ATOM 312 CB LEU A 19 -30.543 11.559 18.230 1.00 20.92 C ATOM 313 CG LEU A 19 -31.698 11.875 17.262 1.00 23.53 C ATOM 314 CD1 LEU A 19 -33.026 11.864 18.025 1.00 23.22 C ATOM 315 CD2 LEU A 19 -31.451 13.210 16.573 1.00 23.71 C ATOM 316 HA LEU A 19 -28.998 12.731 17.338 1.00 0.00 H ATOM 317 HB2 LEU A 19 -30.665 10.534 18.579 1.00 0.00 H ATOM 318 HB3 LEU A 19 -30.616 12.241 19.077 1.00 0.00 H ATOM 319 HG LEU A 19 -31.750 11.111 16.487 1.00 0.00 H ATOM 320 HD21 LEU A 19 -31.386 13.998 17.323 1.00 0.00 H ATOM 321 HD22 LEU A 19 -30.517 13.161 16.013 1.00 0.00 H ATOM 322 HD23 LEU A 19 -32.274 13.423 15.891 1.00 0.00 H ATOM 323 HD11 LEU A 19 -33.182 10.880 18.466 1.00 0.00 H ATOM 324 HD12 LEU A 19 -32.997 12.617 18.813 1.00 0.00 H ATOM 325 HD13 LEU A 19 -33.841 12.088 17.337 1.00 0.00 H ATOM 326 H LEU A 19 -29.451 9.837 16.557 1.00 0.00 H ATOM 327 N LYS A 20 -27.303 12.244 19.131 1.00 21.67 N ATOM 328 CA LYS A 20 -26.220 11.940 20.078 1.00 23.08 C ATOM 329 C LYS A 20 -26.137 13.089 21.064 1.00 23.28 C ATOM 330 O LYS A 20 -26.781 14.139 20.865 1.00 23.98 O ATOM 331 CB LYS A 20 -24.878 11.827 19.346 1.00 22.75 C ATOM 332 CG LYS A 20 -24.795 10.754 18.239 1.00 22.76 C ATOM 333 CD LYS A 20 -24.704 9.375 18.795 1.00 25.25 C ATOM 334 CE LYS A 20 -25.068 8.328 17.735 1.00 27.32 C ATOM 335 NZ LYS A 20 -24.864 6.956 18.260 1.00 29.11 N ATOM 336 HA LYS A 20 -26.426 10.994 20.579 1.00 0.00 H ATOM 337 HB2 LYS A 20 -24.665 12.794 18.890 1.00 0.00 H ATOM 338 HB3 LYS A 20 -24.112 11.600 20.088 1.00 0.00 H ATOM 339 HG2 LYS A 20 -25.687 10.823 17.616 1.00 0.00 H ATOM 340 HG3 LYS A 20 -23.912 10.946 17.630 1.00 0.00 H ATOM 341 HD2 LYS A 20 -23.685 9.196 19.138 1.00 0.00 H ATOM 342 HD3 LYS A 20 -25.391 9.284 19.637 1.00 0.00 H ATOM 343 HE2 LYS A 20 -24.438 8.473 16.858 1.00 0.00 H ATOM 344 HE3 LYS A 20 -26.114 8.452 17.454 1.00 0.00 H ATOM 345 HZ1 LYS A 20 -23.866 6.833 18.526 1.00 0.00 H ATOM 346 HZ2 LYS A 20 -25.467 6.813 19.095 1.00 0.00 H ATOM 347 HZ3 LYS A 20 -25.117 6.264 17.526 1.00 0.00 H ATOM 348 H LYS A 20 -27.458 13.227 18.830 1.00 0.00 H ATOM 349 N GLU A 21 -25.365 12.899 22.139 1.00 22.57 N ATOM 350 CA GLU A 21 -25.065 14.000 23.048 1.00 22.64 C ATOM 351 C GLU A 21 -23.546 14.165 23.065 1.00 23.20 C ATOM 352 O GLU A 21 -22.822 13.184 22.861 1.00 22.76 O ATOM 353 CB GLU A 21 -25.572 13.723 24.462 1.00 23.12 C ATOM 354 CG GLU A 21 -27.073 13.538 24.572 1.00 22.50 C ATOM 355 CD GLU A 21 -27.559 13.399 26.009 1.00 23.52 C ATOM 356 OE1 GLU A 21 -27.534 14.395 26.764 1.00 24.63 O ATOM 357 OE2 GLU A 21 -28.001 12.292 26.382 1.00 28.37 O ATOM 358 HA GLU A 21 -25.565 14.906 22.705 1.00 0.00 H ATOM 359 HB2 GLU A 21 -25.090 12.815 24.824 1.00 0.00 H ATOM 360 HB3 GLU A 21 -25.286 14.562 25.096 1.00 0.00 H ATOM 361 HG2 GLU A 21 -27.562 14.402 24.123 1.00 0.00 H ATOM 362 HG3 GLU A 21 -27.352 12.638 24.023 1.00 0.00 H ATOM 363 H GLU A 21 -24.973 11.955 22.330 1.00 0.00 H ATOM 364 N ALA A 22 -23.079 15.390 23.306 1.00 22.73 N ATOM 365 CA ALA A 22 -21.660 15.678 23.269 1.00 23.20 C ATOM 366 C ALA A 22 -21.351 16.863 24.173 1.00 23.81 C ATOM 367 O ALA A 22 -22.236 17.670 24.490 1.00 23.71 O ATOM 368 CB ALA A 22 -21.202 15.951 21.818 1.00 23.81 C ATOM 369 HA ALA A 22 -21.109 14.811 23.635 1.00 0.00 H ATOM 370 HB1 ALA A 22 -21.402 15.073 21.204 1.00 0.00 H ATOM 371 HB2 ALA A 22 -21.748 16.806 21.421 1.00 0.00 H ATOM 372 HB3 ALA A 22 -20.133 16.165 21.810 1.00 0.00 H ATOM 373 H ALA A 22 -23.748 16.155 23.525 1.00 0.00 H ATOM 374 N LEU A 23 -20.087 16.953 24.568 1.00 23.93 N ATOM 375 CA LEU A 23 -19.623 17.947 25.481 1.00 25.47 C ATOM 376 C LEU A 23 -19.045 19.123 24.660 1.00 26.15 C ATOM 377 O LEU A 23 -18.168 18.911 23.798 1.00 26.48 O ATOM 378 CB LEU A 23 -18.558 17.275 26.359 1.00 26.28 C ATOM 379 CG LEU A 23 -17.794 17.952 27.491 1.00 30.55 C ATOM 380 CD1 LEU A 23 -18.719 18.141 28.649 1.00 31.52 C ATOM 381 CD2 LEU A 23 -16.700 17.007 27.961 1.00 31.32 C ATOM 382 HA LEU A 23 -20.413 18.345 26.118 1.00 0.00 H ATOM 383 HB2 LEU A 23 -19.057 16.421 26.817 1.00 0.00 H ATOM 384 HB3 LEU A 23 -17.795 16.919 25.667 1.00 0.00 H ATOM 385 HG LEU A 23 -17.388 18.903 27.145 1.00 0.00 H ATOM 386 HD21 LEU A 23 -17.150 16.080 28.315 1.00 0.00 H ATOM 387 HD22 LEU A 23 -16.027 16.792 27.131 1.00 0.00 H ATOM 388 HD23 LEU A 23 -16.142 17.474 28.772 1.00 0.00 H ATOM 389 HD11 LEU A 23 -19.559 18.765 28.344 1.00 0.00 H ATOM 390 HD12 LEU A 23 -19.088 17.170 28.980 1.00 0.00 H ATOM 391 HD13 LEU A 23 -18.183 18.625 29.465 1.00 0.00 H ATOM 392 H LEU A 23 -19.402 16.266 24.194 1.00 0.00 H ATOM 393 N LEU A 24 -19.536 20.343 24.905 1.00 24.56 N ATOM 394 CA LEU A 24 -18.906 21.538 24.328 1.00 24.37 C ATOM 395 C LEU A 24 -17.533 21.724 24.971 1.00 24.71 C ATOM 396 O LEU A 24 -17.422 22.037 26.160 1.00 25.04 O ATOM 397 CB LEU A 24 -19.746 22.783 24.556 1.00 25.80 C ATOM 398 CG LEU A 24 -21.097 22.863 23.847 1.00 25.47 C ATOM 399 CD1 LEU A 24 -21.807 24.101 24.377 1.00 26.76 C ATOM 400 CD2 LEU A 24 -20.963 22.883 22.300 1.00 27.19 C ATOM 401 HA LEU A 24 -18.813 21.395 23.251 1.00 0.00 H ATOM 402 HB2 LEU A 24 -19.934 22.858 25.627 1.00 0.00 H ATOM 403 HB3 LEU A 24 -19.155 23.640 24.231 1.00 0.00 H ATOM 404 HG LEU A 24 -21.681 21.967 24.060 1.00 0.00 H ATOM 405 HD21 LEU A 24 -20.376 23.750 21.999 1.00 0.00 H ATOM 406 HD22 LEU A 24 -20.465 21.972 21.968 1.00 0.00 H ATOM 407 HD23 LEU A 24 -21.955 22.940 21.851 1.00 0.00 H ATOM 408 HD11 LEU A 24 -21.942 24.007 25.454 1.00 0.00 H ATOM 409 HD12 LEU A 24 -21.206 24.984 24.161 1.00 0.00 H ATOM 410 HD13 LEU A 24 -22.780 24.195 23.894 1.00 0.00 H ATOM 411 H LEU A 24 -20.374 20.447 25.512 1.00 0.00 H ATOM 412 N ASP A 25 -16.478 21.532 24.181 1.00 23.64 N ATOM 413 CA ASP A 25 -15.142 21.349 24.766 1.00 22.57 C ATOM 414 C ASP A 25 -14.113 22.311 24.158 1.00 22.70 C ATOM 415 O ASP A 25 -13.563 22.026 23.093 1.00 22.56 O ATOM 416 CB ASP A 25 -14.703 19.911 24.502 1.00 21.77 C ATOM 417 CG ASP A 25 -13.420 19.555 25.208 1.00 25.97 C ATOM 418 OD1 ASP A 25 -12.793 20.457 25.809 1.00 25.28 O ATOM 419 OD2 ASP A 25 -13.028 18.379 25.142 1.00 26.83 O ATOM 420 HA ASP A 25 -15.197 21.559 25.834 1.00 0.00 H ATOM 421 HB2 ASP A 25 -15.489 19.238 24.845 1.00 0.00 H ATOM 422 HB3 ASP A 25 -14.558 19.782 23.429 1.00 0.00 H ATOM 423 H ASP A 25 -16.600 21.512 23.148 1.00 0.00 H ATOM 424 N THR A 26 -13.830 23.413 24.856 1.00 20.82 N ATOM 425 CA THR A 26 -12.888 24.428 24.364 1.00 20.07 C ATOM 426 C THR A 26 -11.454 23.907 24.304 1.00 19.66 C ATOM 427 O THR A 26 -10.609 24.493 23.630 1.00 18.56 O ATOM 428 CB THR A 26 -12.938 25.710 25.185 1.00 19.94 C ATOM 429 OG1 THR A 26 -12.698 25.399 26.557 1.00 19.17 O ATOM 430 CG2 THR A 26 -14.327 26.368 25.088 1.00 18.78 C ATOM 431 HA THR A 26 -13.211 24.659 23.349 1.00 0.00 H ATOM 432 HB THR A 26 -12.182 26.392 24.797 1.00 0.00 H ATOM 433 HG1 THR A 26 -11.806 24.980 26.648 1.00 0.00 H ATOM 434 HG23 THR A 26 -14.538 26.617 24.048 1.00 0.00 H ATOM 435 HG21 THR A 26 -15.083 25.675 25.457 1.00 0.00 H ATOM 436 HG22 THR A 26 -14.340 27.276 25.690 1.00 0.00 H ATOM 437 H THR A 26 -14.291 23.558 25.777 1.00 0.00 H ATOM 438 N GLY A 27 -11.199 22.798 25.002 1.00 19.52 N ATOM 439 CA GLY A 27 -9.861 22.180 24.995 1.00 21.35 C ATOM 440 C GLY A 27 -9.671 21.208 23.841 1.00 22.24 C ATOM 441 O GLY A 27 -8.581 20.676 23.655 1.00 23.17 O ATOM 442 HA3 GLY A 27 -9.720 21.641 25.932 1.00 0.00 H ATOM 443 HA2 GLY A 27 -9.113 22.968 24.914 1.00 0.00 H ATOM 444 H GLY A 27 -11.959 22.362 25.562 1.00 0.00 H ATOM 445 N ALA A 28 -10.718 20.985 23.051 1.00 22.80 N ATOM 446 CA ALA A 28 -10.637 20.086 21.884 1.00 22.92 C ATOM 447 C ALA A 28 -10.481 20.868 20.585 1.00 22.21 C ATOM 448 O ALA A 28 -11.308 21.721 20.278 1.00 21.75 O ATOM 449 CB ALA A 28 -11.885 19.175 21.829 1.00 22.27 C ATOM 450 HA ALA A 28 -9.750 19.463 21.997 1.00 0.00 H ATOM 451 HB1 ALA A 28 -11.938 18.578 22.739 1.00 0.00 H ATOM 452 HB2 ALA A 28 -12.780 19.792 21.745 1.00 0.00 H ATOM 453 HB3 ALA A 28 -11.814 18.516 20.964 1.00 0.00 H ATOM 454 H ALA A 28 -11.620 21.458 23.262 1.00 0.00 H ATOM 455 N ASP A 29 -9.411 20.600 19.830 1.00 21.10 N ATOM 456 CA ASP A 29 -9.223 21.233 18.533 1.00 22.06 C ATOM 457 C ASP A 29 -10.272 20.747 17.548 1.00 23.07 C ATOM 458 O ASP A 29 -10.753 21.537 16.718 1.00 23.59 O ATOM 459 CB ASP A 29 -7.855 20.885 17.957 1.00 20.76 C ATOM 460 CG ASP A 29 -6.699 21.403 18.802 1.00 22.30 C ATOM 461 OD1 ASP A 29 -6.896 22.297 19.642 1.00 22.62 O ATOM 462 OD2 ASP A 29 -5.574 20.933 18.555 1.00 23.87 O ATOM 463 HA ASP A 29 -9.308 22.310 18.681 1.00 0.00 H ATOM 464 HB2 ASP A 29 -7.774 19.800 17.887 1.00 0.00 H ATOM 465 HB3 ASP A 29 -7.778 21.319 16.960 1.00 0.00 H ATOM 466 H ASP A 29 -8.699 19.926 20.176 1.00 0.00 H ATOM 467 N ASP A 30 -10.590 19.453 17.672 1.00 24.29 N ATOM 468 CA ASP A 30 -11.421 18.671 16.740 1.00 25.31 C ATOM 469 C ASP A 30 -12.677 18.091 17.404 1.00 24.53 C ATOM 470 O ASP A 30 -12.726 17.891 18.616 1.00 25.81 O ATOM 471 CB ASP A 30 -10.622 17.469 16.212 1.00 26.57 C ATOM 472 CG ASP A 30 -9.227 17.836 15.720 1.00 29.42 C ATOM 473 OD1 ASP A 30 -9.129 18.672 14.796 1.00 31.23 O ATOM 474 OD2 ASP A 30 -8.224 17.257 16.232 1.00 33.10 O ATOM 475 HA ASP A 30 -11.712 19.361 15.948 1.00 0.00 H ATOM 476 HB2 ASP A 30 -10.524 16.739 17.016 1.00 0.00 H ATOM 477 HB3 ASP A 30 -11.174 17.024 15.384 1.00 0.00 H ATOM 478 H ASP A 30 -10.216 18.953 18.504 1.00 0.00 H ATOM 479 N THR A 31 -13.698 17.813 16.596 1.00 23.85 N ATOM 480 CA THR A 31 -14.933 17.233 17.095 1.00 22.93 C ATOM 481 C THR A 31 -14.777 15.711 17.031 1.00 23.01 C ATOM 482 O THR A 31 -14.378 15.174 16.010 1.00 22.64 O ATOM 483 CB THR A 31 -16.130 17.738 16.256 1.00 22.89 C ATOM 484 OG1 THR A 31 -16.350 19.128 16.564 1.00 22.59 O ATOM 485 CG2 THR A 31 -17.398 16.954 16.546 1.00 23.02 C ATOM 486 HA THR A 31 -15.131 17.531 18.125 1.00 0.00 H ATOM 487 HB THR A 31 -15.892 17.602 15.201 1.00 0.00 H ATOM 488 HG1 THR A 31 -15.537 19.647 16.340 1.00 0.00 H ATOM 489 HG23 THR A 31 -17.234 15.902 16.314 1.00 0.00 H ATOM 490 HG21 THR A 31 -17.656 17.059 17.600 1.00 0.00 H ATOM 491 HG22 THR A 31 -18.211 17.341 15.932 1.00 0.00 H ATOM 492 H THR A 31 -13.609 18.017 15.580 1.00 0.00 H ATOM 493 N VAL A 32 -15.099 15.012 18.113 1.00 22.66 N ATOM 494 CA VAL A 32 -14.820 13.578 18.180 1.00 22.17 C ATOM 495 C VAL A 32 -16.003 12.804 18.743 1.00 22.71 C ATOM 496 O VAL A 32 -16.536 13.185 19.789 1.00 23.66 O ATOM 497 CB VAL A 32 -13.585 13.266 19.064 1.00 22.49 C ATOM 498 CG1 VAL A 32 -13.204 11.806 18.908 1.00 21.69 C ATOM 499 CG2 VAL A 32 -12.416 14.172 18.706 1.00 23.18 C ATOM 500 HA VAL A 32 -14.623 13.267 17.154 1.00 0.00 H ATOM 501 HB VAL A 32 -13.841 13.456 20.106 1.00 0.00 H ATOM 502 HG11 VAL A 32 -14.040 11.179 19.218 1.00 0.00 H ATOM 503 HG12 VAL A 32 -12.964 11.604 17.864 1.00 0.00 H ATOM 504 HG13 VAL A 32 -12.336 11.590 19.531 1.00 0.00 H ATOM 505 HG21 VAL A 32 -12.146 14.019 17.661 1.00 0.00 H ATOM 506 HG22 VAL A 32 -12.704 15.212 18.860 1.00 0.00 H ATOM 507 HG23 VAL A 32 -11.564 13.931 19.341 1.00 0.00 H ATOM 508 H VAL A 32 -15.553 15.488 18.919 1.00 0.00 H ATOM 509 N PHE A 33 -16.409 11.728 18.050 1.00 20.64 N ATOM 510 CA PHE A 33 -17.501 10.850 18.499 1.00 21.22 C ATOM 511 C PHE A 33 -17.076 9.394 18.490 1.00 21.68 C ATOM 512 O PHE A 33 -16.342 8.972 17.604 1.00 21.51 O ATOM 513 CB PHE A 33 -18.723 10.972 17.583 1.00 20.47 C ATOM 514 CG PHE A 33 -19.550 12.189 17.841 1.00 19.27 C ATOM 515 CD1 PHE A 33 -20.742 12.098 18.556 1.00 18.98 C ATOM 516 CD2 PHE A 33 -19.164 13.425 17.332 1.00 19.11 C ATOM 517 CE1 PHE A 33 -21.510 13.241 18.810 1.00 19.37 C ATOM 518 CE2 PHE A 33 -19.943 14.583 17.570 1.00 19.73 C ATOM 519 CZ PHE A 33 -21.108 14.484 18.307 1.00 19.12 C ATOM 520 HA PHE A 33 -17.751 11.166 19.512 1.00 0.00 H ATOM 521 HB2 PHE A 33 -18.377 11.004 16.550 1.00 0.00 H ATOM 522 HB3 PHE A 33 -19.351 10.093 17.728 1.00 0.00 H ATOM 523 HD2 PHE A 33 -18.250 13.503 16.743 1.00 0.00 H ATOM 524 HE2 PHE A 33 -19.626 15.548 17.174 1.00 0.00 H ATOM 525 HZ PHE A 33 -21.712 15.371 18.496 1.00 0.00 H ATOM 526 HE1 PHE A 33 -22.423 13.163 19.401 1.00 0.00 H ATOM 527 HD1 PHE A 33 -21.080 11.128 18.921 1.00 0.00 H ATOM 528 H PHE A 33 -15.929 11.505 17.155 1.00 0.00 H ATOM 529 N GLU A 34 -17.590 8.626 19.445 1.00 23.19 N ATOM 530 CA GLU A 34 -17.234 7.213 19.600 1.00 25.65 C ATOM 531 C GLU A 34 -18.041 6.274 18.710 1.00 26.93 C ATOM 532 O GLU A 34 -17.486 5.385 18.046 1.00 28.02 O ATOM 533 CB GLU A 34 -17.467 6.815 21.043 1.00 25.89 C ATOM 534 CG GLU A 34 -16.778 5.553 21.480 1.00 29.63 C ATOM 535 CD GLU A 34 -17.190 5.166 22.882 1.00 33.54 C ATOM 536 OE1 GLU A 34 -18.289 5.593 23.319 1.00 35.74 O ATOM 537 OE2 GLU A 34 -16.426 4.435 23.541 1.00 36.53 O ATOM 538 HA GLU A 34 -16.190 7.116 19.303 1.00 0.00 H ATOM 539 HB2 GLU A 34 -17.115 7.628 21.678 1.00 0.00 H ATOM 540 HB3 GLU A 34 -18.539 6.681 21.187 1.00 0.00 H ATOM 541 HG2 GLU A 34 -17.043 4.747 20.795 1.00 0.00 H ATOM 542 HG3 GLU A 34 -15.700 5.709 21.456 1.00 0.00 H ATOM 543 H GLU A 34 -18.272 9.045 20.109 1.00 0.00 H ATOM 544 N GLU A 35 -19.356 6.433 18.755 1.00 27.56 N ATOM 545 CA GLU A 35 -20.270 5.548 18.035 1.00 28.68 C ATOM 546 C GLU A 35 -21.079 6.452 17.160 1.00 28.78 C ATOM 547 O GLU A 35 -22.082 7.027 17.586 1.00 29.88 O ATOM 548 CB GLU A 35 -21.176 4.794 19.000 1.00 28.84 C ATOM 549 CG GLU A 35 -20.421 3.669 19.787 1.00 31.17 C ATOM 550 CD GLU A 35 -21.354 3.152 20.925 1.00 32.37 C ATOM 551 OE1 GLU A 35 -22.613 3.504 20.968 1.00 33.29 O ATOM 552 OE2 GLU A 35 -20.821 2.389 21.778 1.00 32.52 O ATOM 553 HA GLU A 35 -19.731 4.793 17.463 1.00 0.00 H ATOM 554 HB2 GLU A 35 -21.589 5.504 19.717 1.00 0.00 H ATOM 555 HB3 GLU A 35 -21.987 4.338 18.433 1.00 0.00 H ATOM 556 HG2 GLU A 35 -20.174 2.849 19.112 1.00 0.00 H ATOM 557 HG3 GLU A 35 -19.504 4.072 20.217 1.00 0.00 H ATOM 558 H GLU A 35 -19.750 7.212 19.320 1.00 0.00 H ATOM 559 N LEU A 36 -20.601 6.626 15.943 1.00 28.64 N ATOM 560 CA LEU A 36 -21.295 7.440 14.979 1.00 28.67 C ATOM 561 C LEU A 36 -20.957 6.876 13.627 1.00 28.59 C ATOM 562 O LEU A 36 -19.779 6.762 13.267 1.00 29.57 O ATOM 563 CB LEU A 36 -20.825 8.895 15.102 1.00 28.18 C ATOM 564 CG LEU A 36 -21.517 9.930 14.224 1.00 28.40 C ATOM 565 CD1 LEU A 36 -22.983 10.110 14.606 1.00 25.22 C ATOM 566 CD2 LEU A 36 -20.756 11.252 14.301 1.00 27.39 C ATOM 567 HA LEU A 36 -22.373 7.431 15.138 1.00 0.00 H ATOM 568 HB2 LEU A 36 -20.966 9.198 16.139 1.00 0.00 H ATOM 569 HB3 LEU A 36 -19.763 8.918 14.860 1.00 0.00 H ATOM 570 HG LEU A 36 -21.507 9.573 13.194 1.00 0.00 H ATOM 571 HD21 LEU A 36 -20.741 11.602 15.333 1.00 0.00 H ATOM 572 HD22 LEU A 36 -19.734 11.103 13.952 1.00 0.00 H ATOM 573 HD23 LEU A 36 -21.252 11.992 13.673 1.00 0.00 H ATOM 574 HD11 LEU A 36 -23.506 9.160 14.493 1.00 0.00 H ATOM 575 HD12 LEU A 36 -23.049 10.441 15.642 1.00 0.00 H ATOM 576 HD13 LEU A 36 -23.438 10.857 13.955 1.00 0.00 H ATOM 577 H LEU A 36 -19.707 6.167 15.675 1.00 0.00 H ATOM 578 N THR A 37 -21.989 6.471 12.895 1.00 27.94 N ATOM 579 CA THR A 37 -21.804 6.022 11.549 1.00 27.46 C ATOM 580 C THR A 37 -21.922 7.181 10.581 1.00 26.87 C ATOM 581 O THR A 37 -22.955 7.844 10.489 1.00 27.16 O ATOM 582 CB THR A 37 -22.793 4.906 11.212 1.00 27.22 C ATOM 583 OG1 THR A 37 -22.446 3.763 11.997 1.00 27.24 O ATOM 584 CG2 THR A 37 -22.740 4.551 9.745 1.00 28.17 C ATOM 585 HA THR A 37 -20.799 5.611 11.454 1.00 0.00 H ATOM 586 HB THR A 37 -23.807 5.240 11.433 1.00 0.00 H ATOM 587 HG1 THR A 37 -23.073 3.024 11.797 1.00 0.00 H ATOM 588 HG23 THR A 37 -23.005 5.426 9.151 1.00 0.00 H ATOM 589 HG21 THR A 37 -21.732 4.227 9.487 1.00 0.00 H ATOM 590 HG22 THR A 37 -23.445 3.745 9.542 1.00 0.00 H ATOM 591 H THR A 37 -22.944 6.480 13.306 1.00 0.00 H ATOM 592 N LEU A 38 -20.841 7.403 9.852 1.00 26.12 N ATOM 593 CA LEU A 38 -20.785 8.486 8.905 1.00 25.69 C ATOM 594 C LEU A 38 -20.554 7.899 7.540 1.00 25.81 C ATOM 595 O LEU A 38 -19.938 6.839 7.408 1.00 26.01 O ATOM 596 CB LEU A 38 -19.680 9.476 9.295 1.00 25.40 C ATOM 597 CG LEU A 38 -19.910 10.237 10.605 1.00 23.80 C ATOM 598 CD1 LEU A 38 -18.809 11.278 10.832 1.00 23.25 C ATOM 599 CD2 LEU A 38 -21.302 10.878 10.674 1.00 21.71 C ATOM 600 HA LEU A 38 -21.722 9.044 8.900 1.00 0.00 H ATOM 601 HB2 LEU A 38 -18.747 8.919 9.389 1.00 0.00 H ATOM 602 HB3 LEU A 38 -19.586 10.208 8.493 1.00 0.00 H ATOM 603 HG LEU A 38 -19.863 9.505 11.411 1.00 0.00 H ATOM 604 HD21 LEU A 38 -21.417 11.583 9.851 1.00 0.00 H ATOM 605 HD22 LEU A 38 -22.063 10.101 10.598 1.00 0.00 H ATOM 606 HD23 LEU A 38 -21.412 11.404 11.622 1.00 0.00 H ATOM 607 HD11 LEU A 38 -17.842 10.777 10.882 1.00 0.00 H ATOM 608 HD12 LEU A 38 -18.809 11.991 10.007 1.00 0.00 H ATOM 609 HD13 LEU A 38 -18.996 11.804 11.768 1.00 0.00 H ATOM 610 H LEU A 38 -20.014 6.782 9.965 1.00 0.00 H ATOM 611 N SER A 39 -21.069 8.584 6.528 1.00 25.85 N ATOM 612 CA SER A 39 -21.009 8.067 5.170 1.00 26.36 C ATOM 613 C SER A 39 -19.836 8.699 4.439 1.00 26.20 C ATOM 614 O SER A 39 -19.374 9.795 4.812 1.00 26.77 O ATOM 615 CB SER A 39 -22.309 8.389 4.440 1.00 26.26 C ATOM 616 OG SER A 39 -22.510 9.790 4.371 1.00 26.93 O ATOM 617 HA SER A 39 -20.875 6.986 5.198 1.00 0.00 H ATOM 618 HB2 SER A 39 -23.142 7.933 4.975 1.00 0.00 H ATOM 619 HB3 SER A 39 -22.262 7.984 3.429 1.00 0.00 H ATOM 620 HG SER A 39 -22.556 10.161 5.288 1.00 0.00 H ATOM 621 H SER A 39 -21.522 9.503 6.708 1.00 0.00 H ATOM 622 N GLY A 40 -19.358 7.993 3.421 1.00 26.05 N ATOM 623 CA GLY A 40 -18.335 8.498 2.519 1.00 25.62 C ATOM 624 C GLY A 40 -16.915 7.922 2.808 1.00 25.16 C ATOM 625 O GLY A 40 -16.659 7.013 3.606 1.00 25.89 O ATOM 626 HA3 GLY A 40 -18.294 9.583 2.615 1.00 0.00 H ATOM 627 HA2 GLY A 40 -18.614 8.235 1.498 1.00 0.00 H ATOM 628 H GLY A 40 -19.732 7.036 3.262 1.00 0.00 H ATOM 629 N ARG A 41 -15.981 8.878 2.248 1.00 24.93 N ATOM 630 CA ARG A 41 -14.589 8.514 2.405 1.00 25.11 C ATOM 631 C ARG A 41 -14.102 9.086 3.718 1.00 25.01 C ATOM 632 O ARG A 41 -14.710 10.010 4.273 1.00 25.00 O ATOM 633 CB ARG A 41 -13.765 9.039 1.236 1.00 25.22 C ATOM 634 CG ARG A 41 -13.866 8.153 0.001 1.00 26.73 C ATOM 635 CD ARG A 41 -12.946 8.624 -1.106 1.00 30.19 C ATOM 636 NE ARG A 41 -13.591 9.622 -1.960 1.00 32.29 N ATOM 637 CZ ARG A 41 -13.003 10.242 -2.981 1.00 33.08 C ATOM 638 NH1 ARG A 41 -11.739 9.981 -3.292 1.00 33.69 N ATOM 639 NH2 ARG A 41 -13.683 11.133 -3.694 1.00 33.60 N ATOM 640 HA ARG A 41 -14.479 7.430 2.414 1.00 0.00 H ATOM 641 HB2 ARG A 41 -14.120 10.037 0.979 1.00 0.00 H ATOM 642 HB3 ARG A 41 -12.720 9.094 1.542 1.00 0.00 H ATOM 643 HG2 ARG A 41 -13.596 7.133 0.275 1.00 0.00 H ATOM 644 HG3 ARG A 41 -14.893 8.170 -0.363 1.00 0.00 H ATOM 645 HD2 ARG A 41 -12.661 7.767 -1.717 1.00 0.00 H ATOM 646 HD3 ARG A 41 -12.054 9.064 -0.661 1.00 0.00 H ATOM 647 HE ARG A 41 -14.581 9.865 -1.754 1.00 0.00 H ATOM 648 HH12 ARG A 41 -11.288 10.470 -4.091 1.00 0.00 H ATOM 649 HH11 ARG A 41 -11.199 9.287 -2.736 1.00 0.00 H ATOM 650 HH22 ARG A 41 -13.226 11.619 -4.492 1.00 0.00 H ATOM 651 HH21 ARG A 41 -14.673 11.345 -3.454 1.00 0.00 H ATOM 652 H ARG A 41 -16.285 9.752 1.773 1.00 0.00 H ATOM 653 N TRP A 42 -13.026 8.505 4.222 1.00 24.73 N ATOM 654 CA TRP A 42 -12.400 8.968 5.444 1.00 25.01 C ATOM 655 C TRP A 42 -10.902 8.691 5.365 1.00 25.09 C ATOM 656 O TRP A 42 -10.466 7.831 4.605 1.00 24.08 O ATOM 657 CB TRP A 42 -13.020 8.268 6.655 1.00 25.12 C ATOM 658 CG TRP A 42 -12.927 6.770 6.601 1.00 26.47 C ATOM 659 CD1 TRP A 42 -13.861 5.905 6.106 1.00 26.78 C ATOM 660 CD2 TRP A 42 -11.833 5.963 7.057 1.00 27.25 C ATOM 661 NE1 TRP A 42 -13.414 4.608 6.229 1.00 26.62 N ATOM 662 CE2 TRP A 42 -12.177 4.617 6.815 1.00 27.12 C ATOM 663 CE3 TRP A 42 -10.602 6.249 7.661 1.00 28.76 C ATOM 664 CZ2 TRP A 42 -11.332 3.555 7.149 1.00 28.45 C ATOM 665 CZ3 TRP A 42 -9.759 5.191 7.991 1.00 29.00 C ATOM 666 CH2 TRP A 42 -10.128 3.861 7.729 1.00 28.85 C ATOM 667 HA TRP A 42 -12.562 10.040 5.560 1.00 0.00 H ATOM 668 HB2 TRP A 42 -12.506 8.613 7.552 1.00 0.00 H ATOM 669 HB3 TRP A 42 -14.073 8.546 6.712 1.00 0.00 H ATOM 670 HE1 TRP A 42 -13.933 3.759 5.926 1.00 0.00 H ATOM 671 HD1 TRP A 42 -14.819 6.198 5.677 1.00 0.00 H ATOM 672 HZ2 TRP A 42 -11.620 2.522 6.955 1.00 0.00 H ATOM 673 HH2 TRP A 42 -9.443 3.055 7.992 1.00 0.00 H ATOM 674 HZ3 TRP A 42 -8.797 5.398 8.460 1.00 0.00 H ATOM 675 HE3 TRP A 42 -10.310 7.278 7.868 1.00 0.00 H ATOM 676 H TRP A 42 -12.616 7.689 3.725 1.00 0.00 H ATOM 677 N LYS A 43 -10.118 9.431 6.146 1.00 25.07 N ATOM 678 CA LYS A 43 -8.684 9.188 6.235 1.00 25.68 C ATOM 679 C LYS A 43 -8.345 8.751 7.660 1.00 25.89 C ATOM 680 O LYS A 43 -8.948 9.251 8.621 1.00 25.60 O ATOM 681 CB LYS A 43 -7.894 10.437 5.821 1.00 25.58 C ATOM 682 CG LYS A 43 -8.299 10.991 4.447 1.00 26.92 C ATOM 683 CD LYS A 43 -7.207 11.847 3.820 1.00 28.32 C ATOM 684 CE LYS A 43 -7.515 12.181 2.362 1.00 30.37 C ATOM 685 NZ LYS A 43 -8.522 13.276 2.234 1.00 31.16 N ATOM 686 HA LYS A 43 -8.400 8.392 5.546 1.00 0.00 H ATOM 687 HB2 LYS A 43 -8.059 11.213 6.568 1.00 0.00 H ATOM 688 HB3 LYS A 43 -6.835 10.182 5.792 1.00 0.00 H ATOM 689 HG2 LYS A 43 -8.514 10.155 3.782 1.00 0.00 H ATOM 690 HG3 LYS A 43 -9.196 11.599 4.565 1.00 0.00 H ATOM 691 HD2 LYS A 43 -7.119 12.776 4.384 1.00 0.00 H ATOM 692 HD3 LYS A 43 -6.263 11.304 3.866 1.00 0.00 H ATOM 693 HE2 LYS A 43 -7.903 11.288 1.872 1.00 0.00 H ATOM 694 HE3 LYS A 43 -6.593 12.492 1.871 1.00 0.00 H ATOM 695 HZ1 LYS A 43 -9.409 12.985 2.693 1.00 0.00 H ATOM 696 HZ2 LYS A 43 -8.158 14.135 2.693 1.00 0.00 H ATOM 697 HZ3 LYS A 43 -8.698 13.467 1.227 1.00 0.00 H ATOM 698 H LYS A 43 -10.539 10.200 6.705 1.00 0.00 H ATOM 699 N PRO A 44 -7.414 7.794 7.805 1.00 26.26 N ATOM 700 CA PRO A 44 -6.938 7.395 9.126 1.00 26.85 C ATOM 701 C PRO A 44 -6.174 8.540 9.774 1.00 27.75 C ATOM 702 O PRO A 44 -5.403 9.238 9.104 1.00 28.09 O ATOM 703 CB PRO A 44 -5.962 6.239 8.829 1.00 26.58 C ATOM 704 CG PRO A 44 -6.246 5.821 7.447 1.00 26.41 C ATOM 705 CD PRO A 44 -6.744 7.029 6.733 1.00 26.31 C ATOM 706 HA PRO A 44 -7.749 7.118 9.799 1.00 0.00 H ATOM 707 HD3 PRO A 44 -5.920 7.597 6.302 1.00 0.00 H ATOM 708 HD2 PRO A 44 -7.448 6.757 5.946 1.00 0.00 H ATOM 709 HG3 PRO A 44 -7.005 5.039 7.438 1.00 0.00 H ATOM 710 HG2 PRO A 44 -5.338 5.450 6.972 1.00 0.00 H ATOM 711 HB2 PRO A 44 -4.931 6.580 8.919 1.00 0.00 H ATOM 712 HB3 PRO A 44 -6.131 5.412 9.519 1.00 0.00 H ATOM 713 N ARG A 45 -6.378 8.715 11.073 1.00 28.13 N ATOM 714 CA ARG A 45 -5.762 9.801 11.807 1.00 28.90 C ATOM 715 C ARG A 45 -5.479 9.329 13.230 1.00 28.42 C ATOM 716 O ARG A 45 -6.184 8.470 13.759 1.00 28.46 O ATOM 717 CB ARG A 45 -6.703 11.010 11.796 1.00 29.57 C ATOM 718 CG ARG A 45 -6.073 12.331 12.226 1.00 32.87 C ATOM 719 CD ARG A 45 -7.058 13.482 12.048 1.00 38.35 C ATOM 720 NE ARG A 45 -6.687 14.648 12.851 1.00 41.66 N ATOM 721 CZ ARG A 45 -7.441 15.737 12.992 1.00 43.41 C ATOM 722 NH1 ARG A 45 -8.618 15.834 12.380 1.00 44.41 N ATOM 723 NH2 ARG A 45 -7.013 16.739 13.750 1.00 45.08 N ATOM 724 HA ARG A 45 -4.821 10.099 11.345 1.00 0.00 H ATOM 725 HB2 ARG A 45 -7.083 11.132 10.782 1.00 0.00 H ATOM 726 HB3 ARG A 45 -7.533 10.797 12.470 1.00 0.00 H ATOM 727 HG2 ARG A 45 -5.785 12.265 13.275 1.00 0.00 H ATOM 728 HG3 ARG A 45 -5.188 12.520 11.619 1.00 0.00 H ATOM 729 HD2 ARG A 45 -8.050 13.147 12.350 1.00 0.00 H ATOM 730 HD3 ARG A 45 -7.078 13.770 10.997 1.00 0.00 H ATOM 731 HE ARG A 45 -5.772 14.625 13.345 1.00 0.00 H ATOM 732 HH12 ARG A 45 -9.197 16.690 12.499 1.00 0.00 H ATOM 733 HH11 ARG A 45 -8.959 15.054 11.783 1.00 0.00 H ATOM 734 HH22 ARG A 45 -7.598 17.592 13.864 1.00 0.00 H ATOM 735 HH21 ARG A 45 -6.093 16.672 14.230 1.00 0.00 H ATOM 736 H ARG A 45 -6.999 8.052 11.580 1.00 0.00 H ATOM 737 N LEU A 46 -4.432 9.867 13.843 1.00 28.18 N ATOM 738 CA LEU A 46 -4.171 9.597 15.248 1.00 27.82 C ATOM 739 C LEU A 46 -4.233 10.914 15.994 1.00 27.70 C ATOM 740 O LEU A 46 -3.539 11.872 15.627 1.00 27.89 O ATOM 741 CB LEU A 46 -2.791 8.941 15.465 1.00 27.96 C ATOM 742 CG LEU A 46 -2.295 7.782 14.591 1.00 28.20 C ATOM 743 CD1 LEU A 46 -0.925 7.338 15.048 1.00 28.86 C ATOM 744 CD2 LEU A 46 -3.238 6.605 14.606 1.00 28.54 C ATOM 745 HA LEU A 46 -4.920 8.897 15.618 1.00 0.00 H ATOM 746 HB2 LEU A 46 -2.055 9.738 15.362 1.00 0.00 H ATOM 747 HB3 LEU A 46 -2.786 8.574 16.491 1.00 0.00 H ATOM 748 HG LEU A 46 -2.246 8.152 13.567 1.00 0.00 H ATOM 749 HD21 LEU A 46 -3.341 6.237 15.627 1.00 0.00 H ATOM 750 HD22 LEU A 46 -4.213 6.917 14.230 1.00 0.00 H ATOM 751 HD23 LEU A 46 -2.839 5.813 13.972 1.00 0.00 H ATOM 752 HD11 LEU A 46 -0.228 8.172 14.967 1.00 0.00 H ATOM 753 HD12 LEU A 46 -0.979 7.008 16.085 1.00 0.00 H ATOM 754 HD13 LEU A 46 -0.583 6.515 14.420 1.00 0.00 H ATOM 755 H LEU A 46 -3.790 10.490 13.312 1.00 0.00 H ATOM 756 N ILE A 47 -5.044 10.956 17.047 1.00 26.77 N ATOM 757 CA ILE A 47 -5.089 12.114 17.933 1.00 26.72 C ATOM 758 C ILE A 47 -4.593 11.781 19.345 1.00 26.73 C ATOM 759 O ILE A 47 -4.703 10.637 19.802 1.00 26.77 O ATOM 760 CB ILE A 47 -6.496 12.775 17.951 1.00 26.26 C ATOM 761 CG1 ILE A 47 -7.556 11.760 18.374 1.00 25.45 C ATOM 762 CG2 ILE A 47 -6.787 13.374 16.562 1.00 25.63 C ATOM 763 CD1 ILE A 47 -8.887 12.349 18.776 1.00 27.73 C ATOM 764 HA ILE A 47 -4.397 12.850 17.524 1.00 0.00 H ATOM 765 HB ILE A 47 -6.521 13.582 18.684 1.00 0.00 H ATOM 766 HG12 ILE A 47 -7.726 11.082 17.538 1.00 0.00 H ATOM 767 HG13 ILE A 47 -7.166 11.198 19.223 1.00 0.00 H ATOM 768 HD11 ILE A 47 -8.745 13.021 19.623 1.00 0.00 H ATOM 769 HD12 ILE A 47 -9.306 12.904 17.936 1.00 0.00 H ATOM 770 HD13 ILE A 47 -9.568 11.546 19.058 1.00 0.00 H ATOM 771 HG21 ILE A 47 -6.031 14.123 16.325 1.00 0.00 H ATOM 772 HG22 ILE A 47 -6.762 12.582 15.814 1.00 0.00 H ATOM 773 HG23 ILE A 47 -7.773 13.839 16.568 1.00 0.00 H ATOM 774 H ILE A 47 -5.662 10.143 17.244 1.00 0.00 H ATOM 775 N GLY A 48 -4.052 12.779 20.027 1.00 27.10 N ATOM 776 CA GLY A 48 -3.443 12.566 21.331 1.00 27.94 C ATOM 777 C GLY A 48 -4.163 13.353 22.399 1.00 28.86 C ATOM 778 O GLY A 48 -4.449 14.538 22.221 1.00 29.86 O ATOM 779 HA3 GLY A 48 -2.401 12.884 21.295 1.00 0.00 H ATOM 780 HA2 GLY A 48 -3.489 11.505 21.577 1.00 0.00 H ATOM 781 H GLY A 48 -4.063 13.737 19.621 1.00 0.00 H ATOM 782 N GLY A 49 -4.453 12.702 23.517 1.00 28.62 N ATOM 783 CA GLY A 49 -5.039 13.398 24.659 1.00 27.47 C ATOM 784 C GLY A 49 -4.301 13.040 25.923 1.00 26.78 C ATOM 785 O GLY A 49 -3.153 12.585 25.881 1.00 26.67 O ATOM 786 HA3 GLY A 49 -6.085 13.109 24.759 1.00 0.00 H ATOM 787 HA2 GLY A 49 -4.974 14.474 24.497 1.00 0.00 H ATOM 788 H GLY A 49 -4.261 11.682 23.581 1.00 0.00 H ATOM 789 N ILE A 50 -4.972 13.223 27.056 1.00 26.36 N ATOM 790 CA ILE A 50 -4.371 12.991 28.368 1.00 25.87 C ATOM 791 C ILE A 50 -3.753 11.606 28.585 1.00 25.75 C ATOM 792 O ILE A 50 -2.636 11.511 29.069 1.00 25.73 O ATOM 793 CB ILE A 50 -5.333 13.394 29.529 1.00 25.90 C ATOM 794 CG1 ILE A 50 -4.701 14.537 30.348 1.00 25.72 C ATOM 795 CG2 ILE A 50 -5.616 12.212 30.475 1.00 26.19 C ATOM 796 CD1 ILE A 50 -5.715 15.462 31.045 1.00 26.48 C ATOM 797 HA ILE A 50 -3.512 13.661 28.385 1.00 0.00 H ATOM 798 HB ILE A 50 -6.274 13.712 29.080 1.00 0.00 H ATOM 799 HG12 ILE A 50 -4.062 14.095 31.112 1.00 0.00 H ATOM 800 HG13 ILE A 50 -4.094 15.143 29.675 1.00 0.00 H ATOM 801 HD11 ILE A 50 -6.356 15.926 30.296 1.00 0.00 H ATOM 802 HD12 ILE A 50 -6.324 14.877 31.734 1.00 0.00 H ATOM 803 HD13 ILE A 50 -5.180 16.235 31.597 1.00 0.00 H ATOM 804 HG21 ILE A 50 -6.079 11.401 29.913 1.00 0.00 H ATOM 805 HG22 ILE A 50 -4.679 11.865 30.911 1.00 0.00 H ATOM 806 HG23 ILE A 50 -6.290 12.536 31.268 1.00 0.00 H ATOM 807 H ILE A 50 -5.960 13.543 27.007 1.00 0.00 H ATOM 808 N GLY A 51 -4.454 10.539 28.216 1.00 25.76 N ATOM 809 CA GLY A 51 -3.990 9.191 28.579 1.00 25.36 C ATOM 810 C GLY A 51 -3.203 8.431 27.525 1.00 25.37 C ATOM 811 O GLY A 51 -2.896 7.243 27.696 1.00 25.21 O ATOM 812 HA3 GLY A 51 -4.868 8.596 28.828 1.00 0.00 H ATOM 813 HA2 GLY A 51 -3.355 9.286 29.460 1.00 0.00 H ATOM 814 H GLY A 51 -5.331 10.657 27.670 1.00 0.00 H ATOM 815 N GLY A 52 -2.861 9.135 26.450 1.00 25.07 N ATOM 816 CA GLY A 52 -2.202 8.559 25.275 1.00 25.40 C ATOM 817 C GLY A 52 -2.888 8.908 23.965 1.00 25.37 C ATOM 818 O GLY A 52 -3.549 9.947 23.868 1.00 25.50 O ATOM 819 HA3 GLY A 52 -2.192 7.474 25.382 1.00 0.00 H ATOM 820 HA2 GLY A 52 -1.177 8.929 25.238 1.00 0.00 H ATOM 821 H GLY A 52 -3.074 10.153 26.443 1.00 0.00 H ATOM 822 N PHE A 53 -2.742 8.039 22.964 1.00 25.25 N ATOM 823 CA PHE A 53 -3.232 8.300 21.607 1.00 25.64 C ATOM 824 C PHE A 53 -4.314 7.308 21.174 1.00 25.99 C ATOM 825 O PHE A 53 -4.263 6.125 21.549 1.00 26.13 O ATOM 826 CB PHE A 53 -2.076 8.218 20.602 1.00 25.57 C ATOM 827 CG PHE A 53 -1.125 9.386 20.652 1.00 25.35 C ATOM 828 CD1 PHE A 53 -1.040 10.271 19.584 1.00 25.30 C ATOM 829 CD2 PHE A 53 -0.305 9.594 21.755 1.00 25.06 C ATOM 830 CE1 PHE A 53 -0.162 11.349 19.620 1.00 24.23 C ATOM 831 CE2 PHE A 53 0.572 10.668 21.798 1.00 24.90 C ATOM 832 CZ PHE A 53 0.640 11.547 20.728 1.00 24.50 C ATOM 833 HA PHE A 53 -3.665 9.300 21.621 1.00 0.00 H ATOM 834 HB2 PHE A 53 -1.511 7.309 20.805 1.00 0.00 H ATOM 835 HB3 PHE A 53 -2.499 8.165 19.599 1.00 0.00 H ATOM 836 HD2 PHE A 53 -0.352 8.904 22.597 1.00 0.00 H ATOM 837 HE2 PHE A 53 1.206 10.820 22.671 1.00 0.00 H ATOM 838 HZ PHE A 53 1.326 12.394 20.761 1.00 0.00 H ATOM 839 HE1 PHE A 53 -0.107 12.036 18.776 1.00 0.00 H ATOM 840 HD1 PHE A 53 -1.669 10.118 18.707 1.00 0.00 H ATOM 841 H PHE A 53 -2.260 7.137 23.154 1.00 0.00 H ATOM 842 N VAL A 54 -5.246 7.778 20.351 1.00 26.35 N ATOM 843 CA VAL A 54 -6.229 6.905 19.706 1.00 27.38 C ATOM 844 C VAL A 54 -6.252 7.115 18.193 1.00 26.80 C ATOM 845 O VAL A 54 -6.063 8.234 17.697 1.00 26.39 O ATOM 846 CB VAL A 54 -7.675 7.052 20.285 1.00 28.07 C ATOM 847 CG1 VAL A 54 -7.698 6.734 21.777 1.00 29.19 C ATOM 848 CG2 VAL A 54 -8.270 8.435 20.025 1.00 29.15 C ATOM 849 HA VAL A 54 -5.900 5.890 19.927 1.00 0.00 H ATOM 850 HB VAL A 54 -8.299 6.329 19.760 1.00 0.00 H ATOM 851 HG11 VAL A 54 -7.359 5.710 21.934 1.00 0.00 H ATOM 852 HG12 VAL A 54 -7.037 7.422 22.304 1.00 0.00 H ATOM 853 HG13 VAL A 54 -8.714 6.844 22.155 1.00 0.00 H ATOM 854 HG21 VAL A 54 -7.641 9.193 20.492 1.00 0.00 H ATOM 855 HG22 VAL A 54 -8.318 8.612 18.951 1.00 0.00 H ATOM 856 HG23 VAL A 54 -9.274 8.483 20.447 1.00 0.00 H ATOM 857 H VAL A 54 -5.278 8.800 20.159 1.00 0.00 H ATOM 858 N ARG A 55 -6.475 6.018 17.478 1.00 26.59 N ATOM 859 CA ARG A 55 -6.647 6.035 16.034 1.00 26.17 C ATOM 860 C ARG A 55 -8.101 6.376 15.732 1.00 25.32 C ATOM 861 O ARG A 55 -9.013 5.789 16.316 1.00 25.46 O ATOM 862 CB ARG A 55 -6.283 4.674 15.454 1.00 26.65 C ATOM 863 CG ARG A 55 -5.085 3.996 16.151 1.00 28.46 C ATOM 864 CD ARG A 55 -4.707 2.688 15.493 1.00 31.80 C ATOM 865 NE ARG A 55 -5.868 1.995 14.932 1.00 34.71 N ATOM 866 CZ ARG A 55 -5.923 0.687 14.705 1.00 35.21 C ATOM 867 NH1 ARG A 55 -4.885 -0.090 15.004 1.00 36.67 N ATOM 868 NH2 ARG A 55 -7.024 0.153 14.187 1.00 36.45 N ATOM 869 HA ARG A 55 -5.994 6.781 15.581 1.00 0.00 H ATOM 870 HB2 ARG A 55 -7.149 4.019 15.546 1.00 0.00 H ATOM 871 HB3 ARG A 55 -6.038 4.804 14.400 1.00 0.00 H ATOM 872 HG2 ARG A 55 -4.229 4.669 16.112 1.00 0.00 H ATOM 873 HG3 ARG A 55 -5.347 3.803 17.191 1.00 0.00 H ATOM 874 HD2 ARG A 55 -4.239 2.043 16.237 1.00 0.00 H ATOM 875 HD3 ARG A 55 -3.997 2.891 14.691 1.00 0.00 H ATOM 876 HE ARG A 55 -6.706 2.564 14.695 1.00 0.00 H ATOM 877 HH12 ARG A 55 -4.933 -1.113 14.825 1.00 0.00 H ATOM 878 HH11 ARG A 55 -4.026 0.326 15.417 1.00 0.00 H ATOM 879 HH22 ARG A 55 -7.071 -0.870 14.008 1.00 0.00 H ATOM 880 HH21 ARG A 55 -7.839 0.758 13.961 1.00 0.00 H ATOM 881 H ARG A 55 -6.529 5.105 17.973 1.00 0.00 H ATOM 882 N VAL A 56 -8.316 7.351 14.853 1.00 24.36 N ATOM 883 CA VAL A 56 -9.676 7.782 14.493 1.00 23.24 C ATOM 884 C VAL A 56 -9.847 7.804 12.978 1.00 23.11 C ATOM 885 O VAL A 56 -8.863 7.759 12.233 1.00 23.05 O ATOM 886 CB VAL A 56 -10.025 9.189 15.051 1.00 23.36 C ATOM 887 CG1 VAL A 56 -10.096 9.197 16.610 1.00 22.28 C ATOM 888 CG2 VAL A 56 -9.031 10.228 14.538 1.00 22.64 C ATOM 889 HA VAL A 56 -10.355 7.057 14.943 1.00 0.00 H ATOM 890 HB VAL A 56 -11.018 9.452 14.688 1.00 0.00 H ATOM 891 HG11 VAL A 56 -10.864 8.498 16.941 1.00 0.00 H ATOM 892 HG12 VAL A 56 -9.131 8.898 17.018 1.00 0.00 H ATOM 893 HG13 VAL A 56 -10.343 10.201 16.956 1.00 0.00 H ATOM 894 HG21 VAL A 56 -8.026 9.957 14.861 1.00 0.00 H ATOM 895 HG22 VAL A 56 -9.069 10.258 13.449 1.00 0.00 H ATOM 896 HG23 VAL A 56 -9.291 11.207 14.939 1.00 0.00 H ATOM 897 H VAL A 56 -7.502 7.821 14.409 1.00 0.00 H ATOM 898 N ARG A 57 -11.097 7.854 12.524 1.00 22.79 N ATOM 899 CA ARG A 57 -11.381 8.062 11.112 1.00 22.57 C ATOM 900 C ARG A 57 -11.732 9.522 10.964 1.00 22.46 C ATOM 901 O ARG A 57 -12.582 10.021 11.687 1.00 22.27 O ATOM 902 CB ARG A 57 -12.578 7.220 10.649 1.00 22.74 C ATOM 903 CG ARG A 57 -12.341 5.727 10.659 1.00 24.18 C ATOM 904 CD ARG A 57 -13.606 5.012 10.258 1.00 26.41 C ATOM 905 NE ARG A 57 -13.372 3.594 9.998 1.00 28.74 N ATOM 906 CZ ARG A 57 -14.270 2.786 9.440 1.00 29.51 C ATOM 907 NH1 ARG A 57 -15.456 3.257 9.082 1.00 30.38 N ATOM 908 NH2 ARG A 57 -13.983 1.508 9.236 1.00 30.34 N ATOM 909 HA ARG A 57 -10.520 7.771 10.511 1.00 0.00 H ATOM 910 HB2 ARG A 57 -13.420 7.435 11.307 1.00 0.00 H ATOM 911 HB3 ARG A 57 -12.829 7.517 9.631 1.00 0.00 H ATOM 912 HG2 ARG A 57 -11.546 5.481 9.955 1.00 0.00 H ATOM 913 HG3 ARG A 57 -12.048 5.412 11.661 1.00 0.00 H ATOM 914 HD2 ARG A 57 -14.002 5.476 9.354 1.00 0.00 H ATOM 915 HD3 ARG A 57 -14.335 5.107 11.063 1.00 0.00 H ATOM 916 HE ARG A 57 -12.450 3.193 10.264 1.00 0.00 H ATOM 917 HH12 ARG A 57 -16.157 2.624 8.646 1.00 0.00 H ATOM 918 HH11 ARG A 57 -15.686 4.259 9.237 1.00 0.00 H ATOM 919 HH22 ARG A 57 -14.688 0.880 8.800 1.00 0.00 H ATOM 920 HH21 ARG A 57 -13.053 1.133 9.512 1.00 0.00 H ATOM 921 H ARG A 57 -11.887 7.742 13.192 1.00 0.00 H ATOM 922 N GLN A 58 -11.088 10.209 10.033 1.00 22.16 N ATOM 923 CA GLN A 58 -11.481 11.577 9.741 1.00 21.96 C ATOM 924 C GLN A 58 -12.493 11.662 8.601 1.00 21.67 C ATOM 925 O GLN A 58 -12.186 11.288 7.465 1.00 21.12 O ATOM 926 CB GLN A 58 -10.268 12.424 9.399 1.00 22.38 C ATOM 927 CG GLN A 58 -10.654 13.847 9.037 1.00 22.72 C ATOM 928 CD GLN A 58 -9.473 14.684 8.657 1.00 21.89 C ATOM 929 OE1 GLN A 58 -8.419 14.595 9.276 1.00 24.49 O ATOM 930 NE2 GLN A 58 -9.637 15.507 7.632 1.00 22.73 N ATOM 931 HA GLN A 58 -11.957 11.961 10.643 1.00 0.00 H ATOM 932 HB2 GLN A 58 -9.601 12.448 10.260 1.00 0.00 H ATOM 933 HB3 GLN A 58 -9.750 11.973 8.552 1.00 0.00 H ATOM 934 HG2 GLN A 58 -11.347 13.818 8.196 1.00 0.00 H ATOM 935 HG3 GLN A 58 -11.145 14.305 9.895 1.00 0.00 H ATOM 936 HE22 GLN A 58 -10.551 15.547 7.138 1.00 0.00 H ATOM 937 HE21 GLN A 58 -8.851 16.113 7.321 1.00 0.00 H ATOM 938 H GLN A 58 -10.302 9.770 9.512 1.00 0.00 H ATOM 939 N TYR A 59 -13.679 12.179 8.911 1.00 21.34 N ATOM 940 CA TYR A 59 -14.699 12.449 7.899 1.00 21.89 C ATOM 941 C TYR A 59 -14.827 13.949 7.714 1.00 22.40 C ATOM 942 O TYR A 59 -14.933 14.693 8.684 1.00 22.25 O ATOM 943 CB TYR A 59 -16.044 11.878 8.323 1.00 21.66 C ATOM 944 CG TYR A 59 -16.125 10.376 8.255 1.00 21.17 C ATOM 945 CD1 TYR A 59 -16.583 9.734 7.100 1.00 19.64 C ATOM 946 CD2 TYR A 59 -15.778 9.595 9.356 1.00 20.41 C ATOM 947 CE1 TYR A 59 -16.678 8.350 7.043 1.00 21.19 C ATOM 948 CE2 TYR A 59 -15.869 8.215 9.309 1.00 18.09 C ATOM 949 CZ TYR A 59 -16.324 7.604 8.155 1.00 21.81 C ATOM 950 OH TYR A 59 -16.407 6.242 8.115 1.00 22.01 O ATOM 951 HA TYR A 59 -14.401 11.976 6.963 1.00 0.00 H ATOM 952 HB3 TYR A 59 -16.813 12.292 7.671 1.00 0.00 H ATOM 953 HB2 TYR A 59 -16.238 12.185 9.351 1.00 0.00 H ATOM 954 HD2 TYR A 59 -15.429 10.079 10.268 1.00 0.00 H ATOM 955 HE2 TYR A 59 -15.585 7.615 10.174 1.00 0.00 H ATOM 956 HE1 TYR A 59 -17.026 7.857 6.135 1.00 0.00 H ATOM 957 HD1 TYR A 59 -16.869 10.328 6.232 1.00 0.00 H ATOM 958 HH TYR A 59 -16.747 5.959 7.229 1.00 0.00 H ATOM 959 H TYR A 59 -13.887 12.398 9.906 1.00 0.00 H ATOM 960 N ASP A 60 -14.812 14.402 6.469 1.00 22.68 N ATOM 961 CA ASP A 60 -14.928 15.830 6.213 1.00 23.59 C ATOM 962 C ASP A 60 -16.334 16.230 5.778 1.00 23.83 C ATOM 963 O ASP A 60 -17.123 15.390 5.309 1.00 24.31 O ATOM 964 CB ASP A 60 -13.881 16.276 5.187 1.00 24.13 C ATOM 965 CG ASP A 60 -12.460 16.148 5.711 1.00 25.21 C ATOM 966 OD1 ASP A 60 -12.282 16.063 6.945 1.00 28.57 O ATOM 967 OD2 ASP A 60 -11.522 16.136 4.886 1.00 27.76 O ATOM 968 HA ASP A 60 -14.736 16.347 7.153 1.00 0.00 H ATOM 969 HB2 ASP A 60 -13.981 15.659 4.294 1.00 0.00 H ATOM 970 HB3 ASP A 60 -14.066 17.319 4.929 1.00 0.00 H ATOM 971 H ASP A 60 -14.717 13.737 5.675 1.00 0.00 H ATOM 972 N GLN A 61 -16.623 17.522 5.921 1.00 24.26 N ATOM 973 CA GLN A 61 -17.889 18.118 5.506 1.00 24.74 C ATOM 974 C GLN A 61 -19.109 17.343 6.009 1.00 24.92 C ATOM 975 O GLN A 61 -20.013 17.000 5.239 1.00 24.78 O ATOM 976 CB GLN A 61 -17.917 18.334 3.982 1.00 25.16 C ATOM 977 CG GLN A 61 -17.429 19.733 3.597 1.00 26.47 C ATOM 978 CD GLN A 61 -16.680 19.758 2.273 1.00 27.59 C ATOM 979 OE1 GLN A 61 -17.081 19.116 1.292 1.00 28.27 O ATOM 980 NE2 GLN A 61 -15.582 20.518 2.235 1.00 28.35 N ATOM 981 HA GLN A 61 -17.955 19.096 5.982 1.00 0.00 H ATOM 982 HB2 GLN A 61 -17.273 17.593 3.508 1.00 0.00 H ATOM 983 HB3 GLN A 61 -18.939 18.206 3.626 1.00 0.00 H ATOM 984 HG2 GLN A 61 -18.293 20.394 3.520 1.00 0.00 H ATOM 985 HG3 GLN A 61 -16.763 20.097 4.380 1.00 0.00 H ATOM 986 HE22 GLN A 61 -15.282 21.040 3.083 1.00 0.00 H ATOM 987 HE21 GLN A 61 -15.028 20.587 1.358 1.00 0.00 H ATOM 988 H GLN A 61 -15.907 18.141 6.352 1.00 0.00 H ATOM 989 N VAL A 62 -19.106 17.077 7.313 1.00 24.76 N ATOM 990 CA VAL A 62 -20.200 16.398 7.987 1.00 25.14 C ATOM 991 C VAL A 62 -21.199 17.432 8.517 1.00 25.64 C ATOM 992 O VAL A 62 -20.809 18.363 9.254 1.00 25.92 O ATOM 993 CB VAL A 62 -19.705 15.551 9.186 1.00 24.51 C ATOM 994 CG1 VAL A 62 -20.843 14.771 9.795 1.00 23.63 C ATOM 995 CG2 VAL A 62 -18.556 14.619 8.787 1.00 24.55 C ATOM 996 HA VAL A 62 -20.667 15.736 7.258 1.00 0.00 H ATOM 997 HB VAL A 62 -19.319 16.240 9.937 1.00 0.00 H ATOM 998 HG11 VAL A 62 -21.610 15.462 10.145 1.00 0.00 H ATOM 999 HG12 VAL A 62 -21.268 14.105 9.044 1.00 0.00 H ATOM 1000 HG13 VAL A 62 -20.471 14.184 10.635 1.00 0.00 H ATOM 1001 HG21 VAL A 62 -18.895 13.941 8.004 1.00 0.00 H ATOM 1002 HG22 VAL A 62 -17.720 15.213 8.418 1.00 0.00 H ATOM 1003 HG23 VAL A 62 -18.238 14.043 9.656 1.00 0.00 H ATOM 1004 H VAL A 62 -18.282 17.369 7.876 1.00 0.00 H ATOM 1005 N PRO A 63 -22.490 17.252 8.177 1.00 26.40 N ATOM 1006 CA PRO A 63 -23.527 18.124 8.735 1.00 26.53 C ATOM 1007 C PRO A 63 -23.792 17.869 10.201 1.00 26.07 C ATOM 1008 O PRO A 63 -23.959 16.709 10.610 1.00 26.11 O ATOM 1009 CB PRO A 63 -24.774 17.795 7.901 1.00 27.04 C ATOM 1010 CG PRO A 63 -24.525 16.382 7.366 1.00 28.98 C ATOM 1011 CD PRO A 63 -23.024 16.223 7.262 1.00 26.75 C ATOM 1012 HA PRO A 63 -23.228 19.171 8.686 1.00 0.00 H ATOM 1013 HD3 PRO A 63 -22.717 15.226 7.578 1.00 0.00 H ATOM 1014 HD2 PRO A 63 -22.685 16.399 6.241 1.00 0.00 H ATOM 1015 HG3 PRO A 63 -24.986 16.263 6.385 1.00 0.00 H ATOM 1016 HG2 PRO A 63 -24.936 15.641 8.052 1.00 0.00 H ATOM 1017 HB2 PRO A 63 -25.669 17.818 8.522 1.00 0.00 H ATOM 1018 HB3 PRO A 63 -24.885 18.503 7.080 1.00 0.00 H ATOM 1019 N ILE A 64 -23.834 18.946 10.986 1.00 25.72 N ATOM 1020 CA ILE A 64 -24.125 18.853 12.413 1.00 25.24 C ATOM 1021 C ILE A 64 -25.176 19.886 12.799 1.00 25.20 C ATOM 1022 O ILE A 64 -25.030 21.068 12.501 1.00 24.81 O ATOM 1023 CB ILE A 64 -22.855 19.101 13.276 1.00 25.56 C ATOM 1024 CG1 ILE A 64 -21.724 18.172 12.830 1.00 26.72 C ATOM 1025 CG2 ILE A 64 -23.176 18.929 14.758 1.00 24.95 C ATOM 1026 CD1 ILE A 64 -20.364 18.535 13.412 1.00 29.08 C ATOM 1027 HA ILE A 64 -24.490 17.844 12.603 1.00 0.00 H ATOM 1028 HB ILE A 64 -22.519 20.128 13.130 1.00 0.00 H ATOM 1029 HG12 ILE A 64 -21.971 17.157 13.140 1.00 0.00 H ATOM 1030 HG13 ILE A 64 -21.655 18.212 11.743 1.00 0.00 H ATOM 1031 HD11 ILE A 64 -20.095 19.545 13.102 1.00 0.00 H ATOM 1032 HD12 ILE A 64 -20.412 18.488 14.500 1.00 0.00 H ATOM 1033 HD13 ILE A 64 -19.615 17.831 13.049 1.00 0.00 H ATOM 1034 HG21 ILE A 64 -23.947 19.643 15.047 1.00 0.00 H ATOM 1035 HG22 ILE A 64 -23.534 17.915 14.936 1.00 0.00 H ATOM 1036 HG23 ILE A 64 -22.276 19.106 15.346 1.00 0.00 H ATOM 1037 H ILE A 64 -23.654 19.881 10.568 1.00 0.00 H ATOM 1038 N GLU A 65 -26.227 19.422 13.468 1.00 25.06 N ATOM 1039 CA GLU A 65 -27.256 20.304 14.029 1.00 25.35 C ATOM 1040 C GLU A 65 -27.041 20.393 15.520 1.00 25.78 C ATOM 1041 O GLU A 65 -27.052 19.378 16.226 1.00 25.89 O ATOM 1042 CB GLU A 65 -28.668 19.772 13.727 1.00 24.45 C ATOM 1043 CG GLU A 65 -28.997 19.736 12.260 1.00 24.85 C ATOM 1044 CD GLU A 65 -30.366 19.155 11.942 1.00 21.90 C ATOM 1045 OE1 GLU A 65 -31.190 18.952 12.858 1.00 20.04 O ATOM 1046 OE2 GLU A 65 -30.612 18.917 10.749 1.00 21.17 O ATOM 1047 HA GLU A 65 -27.174 21.291 13.574 1.00 0.00 H ATOM 1048 HB2 GLU A 65 -28.747 18.760 14.123 1.00 0.00 H ATOM 1049 HB3 GLU A 65 -29.393 20.414 14.227 1.00 0.00 H ATOM 1050 HG2 GLU A 65 -28.960 20.756 11.876 1.00 0.00 H ATOM 1051 HG3 GLU A 65 -28.243 19.132 11.755 1.00 0.00 H ATOM 1052 H GLU A 65 -26.323 18.395 13.599 1.00 0.00 H ATOM 1053 N ILE A 66 -26.860 21.623 16.004 1.00 27.13 N ATOM 1054 CA ILE A 66 -26.427 21.877 17.364 1.00 28.78 C ATOM 1055 C ILE A 66 -26.860 23.304 17.731 1.00 30.11 C ATOM 1056 O ILE A 66 -26.599 24.258 16.991 1.00 29.56 O ATOM 1057 CB ILE A 66 -24.885 21.677 17.494 1.00 29.65 C ATOM 1058 CG1 ILE A 66 -24.378 22.100 18.868 1.00 29.69 C ATOM 1059 CG2 ILE A 66 -24.133 22.410 16.341 1.00 30.17 C ATOM 1060 CD1 ILE A 66 -22.941 21.630 19.154 1.00 31.97 C ATOM 1061 HA ILE A 66 -26.886 21.172 18.057 1.00 0.00 H ATOM 1062 HB ILE A 66 -24.674 20.612 17.398 1.00 0.00 H ATOM 1063 HG12 ILE A 66 -24.406 23.188 18.928 1.00 0.00 H ATOM 1064 HG13 ILE A 66 -25.038 21.679 19.626 1.00 0.00 H ATOM 1065 HD11 ILE A 66 -22.900 20.542 19.108 1.00 0.00 H ATOM 1066 HD12 ILE A 66 -22.267 22.052 18.409 1.00 0.00 H ATOM 1067 HD13 ILE A 66 -22.642 21.964 20.147 1.00 0.00 H ATOM 1068 HG21 ILE A 66 -24.461 22.008 15.382 1.00 0.00 H ATOM 1069 HG22 ILE A 66 -24.355 23.476 16.385 1.00 0.00 H ATOM 1070 HG23 ILE A 66 -23.060 22.256 16.453 1.00 0.00 H ATOM 1071 H ILE A 66 -27.037 22.435 15.379 1.00 0.00 H ATOM 1072 N CYS A 67 -27.573 23.423 18.839 1.00 31.75 N ATOM 1073 CA CYS A 67 -27.821 24.731 19.468 1.00 33.98 C ATOM 1074 C CYS A 67 -28.622 25.640 18.537 1.00 34.56 C ATOM 1075 O CYS A 67 -28.310 26.835 18.399 1.00 35.57 O ATOM 1076 CB CYS A 67 -26.499 25.413 19.878 1.00 34.26 C ATOM 1077 SG CYS A 67 -25.467 24.575 21.145 1.00 39.03 S ATOM 1078 HA CYS A 67 -28.407 24.557 20.370 1.00 0.00 H ATOM 1079 HB2 CYS A 67 -26.748 26.402 20.262 1.00 0.00 H ATOM 1080 HB3 CYS A 67 -25.892 25.516 18.978 1.00 0.00 H ATOM 1081 HG CYS A 67 -26.189 24.448 22.314 1.00 0.00 H ATOM 1082 H CYS A 67 -27.970 22.568 19.278 1.00 0.00 H ATOM 1083 N GLY A 68 -29.666 25.079 17.925 1.00 34.28 N ATOM 1084 CA GLY A 68 -30.515 25.821 16.984 1.00 34.98 C ATOM 1085 C GLY A 68 -29.801 26.219 15.702 1.00 34.90 C ATOM 1086 O GLY A 68 -30.287 27.067 14.945 1.00 35.37 O ATOM 1087 HA3 GLY A 68 -30.867 26.727 17.478 1.00 0.00 H ATOM 1088 HA2 GLY A 68 -31.369 25.196 16.723 1.00 0.00 H ATOM 1089 H GLY A 68 -29.886 24.082 18.121 1.00 0.00 H ATOM 1090 N HIS A 69 -28.647 25.604 15.454 1.00 34.68 N ATOM 1091 CA HIS A 69 -27.827 25.954 14.306 1.00 34.31 C ATOM 1092 C HIS A 69 -27.411 24.710 13.545 1.00 33.11 C ATOM 1093 O HIS A 69 -27.188 23.671 14.128 1.00 33.41 O ATOM 1094 CB HIS A 69 -26.601 26.766 14.744 1.00 34.75 C ATOM 1095 CG HIS A 69 -26.942 28.096 15.351 1.00 36.62 C ATOM 1096 ND1 HIS A 69 -27.568 29.100 14.642 1.00 38.85 N ATOM 1097 CD2 HIS A 69 -26.740 28.586 16.599 1.00 37.56 C ATOM 1098 CE1 HIS A 69 -27.741 30.151 15.428 1.00 39.22 C ATOM 1099 NE2 HIS A 69 -27.245 29.864 16.621 1.00 39.96 N ATOM 1100 HA HIS A 69 -28.422 26.575 13.636 1.00 0.00 H ATOM 1101 HB2 HIS A 69 -26.047 26.183 15.480 1.00 0.00 H ATOM 1102 HB3 HIS A 69 -25.972 26.937 13.871 1.00 0.00 H ATOM 1103 HD2 HIS A 69 -26.266 28.064 17.430 1.00 0.00 H ATOM 1104 HE1 HIS A 69 -28.211 31.092 15.142 1.00 0.00 H ATOM 1105 H HIS A 69 -28.324 24.854 16.098 1.00 0.00 H ATOM 1106 N LYS A 70 -27.340 24.824 12.232 1.00 33.02 N ATOM 1107 CA LYS A 70 -26.825 23.749 11.399 1.00 32.52 C ATOM 1108 C LYS A 70 -25.455 24.199 10.966 1.00 31.85 C ATOM 1109 O LYS A 70 -25.283 25.331 10.520 1.00 31.55 O ATOM 1110 CB LYS A 70 -27.726 23.500 10.181 1.00 32.45 C ATOM 1111 CG LYS A 70 -29.114 22.989 10.531 1.00 34.51 C ATOM 1112 CD LYS A 70 -30.010 22.917 9.301 1.00 37.08 C ATOM 1113 CE LYS A 70 -31.497 22.858 9.676 1.00 39.96 C ATOM 1114 NZ LYS A 70 -32.085 21.473 9.672 1.00 40.85 N ATOM 1115 HA LYS A 70 -26.792 22.807 11.946 1.00 0.00 H ATOM 1116 HB2 LYS A 70 -27.833 24.438 9.637 1.00 0.00 H ATOM 1117 HB3 LYS A 70 -27.241 22.763 9.541 1.00 0.00 H ATOM 1118 HG2 LYS A 70 -29.026 21.993 10.964 1.00 0.00 H ATOM 1119 HG3 LYS A 70 -29.566 23.662 11.260 1.00 0.00 H ATOM 1120 HD2 LYS A 70 -29.836 23.800 8.687 1.00 0.00 H ATOM 1121 HD3 LYS A 70 -29.755 22.024 8.731 1.00 0.00 H ATOM 1122 HE2 LYS A 70 -32.053 23.467 8.963 1.00 0.00 H ATOM 1123 HE3 LYS A 70 -31.613 23.275 10.676 1.00 0.00 H ATOM 1124 HZ1 LYS A 70 -31.995 21.062 8.721 1.00 0.00 H ATOM 1125 HZ2 LYS A 70 -31.575 20.879 10.357 1.00 0.00 H ATOM 1126 HZ3 LYS A 70 -33.090 21.524 9.936 1.00 0.00 H ATOM 1127 H LYS A 70 -27.660 25.705 11.782 1.00 0.00 H ATOM 1128 N VAL A 71 -24.473 23.326 11.152 1.00 31.34 N ATOM 1129 CA VAL A 71 -23.106 23.596 10.737 1.00 31.53 C ATOM 1130 C VAL A 71 -22.581 22.357 9.995 1.00 31.42 C ATOM 1131 O VAL A 71 -23.144 21.265 10.085 1.00 31.66 O ATOM 1132 CB VAL A 71 -22.167 23.968 11.934 1.00 31.64 C ATOM 1133 CG1 VAL A 71 -22.708 25.148 12.736 1.00 31.97 C ATOM 1134 CG2 VAL A 71 -21.944 22.774 12.844 1.00 31.75 C ATOM 1135 HA VAL A 71 -23.107 24.467 10.082 1.00 0.00 H ATOM 1136 HB VAL A 71 -21.210 24.266 11.506 1.00 0.00 H ATOM 1137 HG11 VAL A 71 -22.794 26.019 12.086 1.00 0.00 H ATOM 1138 HG12 VAL A 71 -23.689 24.894 13.137 1.00 0.00 H ATOM 1139 HG13 VAL A 71 -22.026 25.372 13.556 1.00 0.00 H ATOM 1140 HG21 VAL A 71 -22.902 22.438 13.242 1.00 0.00 H ATOM 1141 HG22 VAL A 71 -21.482 21.967 12.275 1.00 0.00 H ATOM 1142 HG23 VAL A 71 -21.288 23.062 13.666 1.00 0.00 H ATOM 1143 H VAL A 71 -24.689 22.418 11.610 1.00 0.00 H ATOM 1144 N ILE A 72 -21.508 22.542 9.247 1.00 31.56 N ATOM 1145 CA ILE A 72 -20.905 21.463 8.478 1.00 31.59 C ATOM 1146 C ILE A 72 -19.421 21.502 8.813 1.00 31.39 C ATOM 1147 O ILE A 72 -18.779 22.549 8.677 1.00 32.05 O ATOM 1148 CB ILE A 72 -21.120 21.680 6.954 1.00 31.40 C ATOM 1149 CG1 ILE A 72 -22.620 21.664 6.595 1.00 32.09 C ATOM 1150 CG2 ILE A 72 -20.321 20.691 6.126 1.00 31.41 C ATOM 1151 CD1 ILE A 72 -23.176 20.337 6.118 1.00 34.01 C ATOM 1152 HA ILE A 72 -21.354 20.501 8.724 1.00 0.00 H ATOM 1153 HB ILE A 72 -20.740 22.671 6.704 1.00 0.00 H ATOM 1154 HG12 ILE A 72 -23.179 21.960 7.483 1.00 0.00 H ATOM 1155 HG13 ILE A 72 -22.782 22.397 5.805 1.00 0.00 H ATOM 1156 HD11 ILE A 72 -22.646 20.025 5.218 1.00 0.00 H ATOM 1157 HD12 ILE A 72 -23.043 19.587 6.898 1.00 0.00 H ATOM 1158 HD13 ILE A 72 -24.237 20.448 5.896 1.00 0.00 H ATOM 1159 HG21 ILE A 72 -19.260 20.811 6.343 1.00 0.00 H ATOM 1160 HG22 ILE A 72 -20.631 19.676 6.375 1.00 0.00 H ATOM 1161 HG23 ILE A 72 -20.500 20.878 5.067 1.00 0.00 H ATOM 1162 H ILE A 72 -21.080 23.489 9.206 1.00 0.00 H ATOM 1163 N ASP A 73 -18.876 20.376 9.264 1.00 30.94 N ATOM 1164 CA ASP A 73 -17.466 20.339 9.653 1.00 30.15 C ATOM 1165 C ASP A 73 -16.859 18.940 9.680 1.00 29.00 C ATOM 1166 O ASP A 73 -17.517 17.957 9.377 1.00 28.98 O ATOM 1167 CB ASP A 73 -17.291 20.972 11.023 1.00 30.53 C ATOM 1168 CG ASP A 73 -16.013 21.791 11.134 1.00 30.53 C ATOM 1169 OD1 ASP A 73 -15.044 21.525 10.394 1.00 28.50 O ATOM 1170 OD2 ASP A 73 -15.978 22.700 11.987 1.00 31.09 O ATOM 1171 HA ASP A 73 -16.935 20.899 8.883 1.00 0.00 H ATOM 1172 HB2 ASP A 73 -18.142 21.625 11.217 1.00 0.00 H ATOM 1173 HB3 ASP A 73 -17.264 20.181 11.772 1.00 0.00 H ATOM 1174 H ASP A 73 -19.456 19.516 9.341 1.00 0.00 H ATOM 1175 N THR A 74 -15.600 18.873 10.086 1.00 28.30 N ATOM 1176 CA THR A 74 -14.869 17.615 10.174 1.00 27.06 C ATOM 1177 C THR A 74 -15.144 16.930 11.506 1.00 25.67 C ATOM 1178 O THR A 74 -15.077 17.551 12.569 1.00 25.06 O ATOM 1179 CB THR A 74 -13.362 17.843 9.987 1.00 27.29 C ATOM 1180 OG1 THR A 74 -13.126 18.282 8.645 1.00 28.39 O ATOM 1181 CG2 THR A 74 -12.563 16.564 10.230 1.00 28.11 C ATOM 1182 HA THR A 74 -15.216 16.964 9.371 1.00 0.00 H ATOM 1183 HB THR A 74 -13.039 18.591 10.711 1.00 0.00 H ATOM 1184 HG1 THR A 74 -13.443 17.590 8.012 1.00 0.00 H ATOM 1185 HG23 THR A 74 -12.734 16.219 11.250 1.00 0.00 H ATOM 1186 HG21 THR A 74 -12.885 15.797 9.526 1.00 0.00 H ATOM 1187 HG22 THR A 74 -11.502 16.767 10.087 1.00 0.00 H ATOM 1188 H THR A 74 -15.114 19.753 10.353 1.00 0.00 H ATOM 1189 N VAL A 75 -15.496 15.655 11.418 1.00 23.93 N ATOM 1190 CA VAL A 75 -15.766 14.846 12.593 1.00 22.68 C ATOM 1191 C VAL A 75 -14.824 13.664 12.577 1.00 22.40 C ATOM 1192 O VAL A 75 -14.668 12.994 11.546 1.00 21.74 O ATOM 1193 CB VAL A 75 -17.244 14.341 12.589 1.00 22.58 C ATOM 1194 CG1 VAL A 75 -17.504 13.467 13.797 1.00 21.18 C ATOM 1195 CG2 VAL A 75 -18.221 15.541 12.571 1.00 23.23 C ATOM 1196 HA VAL A 75 -15.616 15.445 13.491 1.00 0.00 H ATOM 1197 HB VAL A 75 -17.407 13.747 11.690 1.00 0.00 H ATOM 1198 HG11 VAL A 75 -16.834 12.608 13.773 1.00 0.00 H ATOM 1199 HG12 VAL A 75 -17.327 14.043 14.705 1.00 0.00 H ATOM 1200 HG13 VAL A 75 -18.538 13.123 13.779 1.00 0.00 H ATOM 1201 HG21 VAL A 75 -18.056 16.155 13.456 1.00 0.00 H ATOM 1202 HG22 VAL A 75 -18.045 16.137 11.676 1.00 0.00 H ATOM 1203 HG23 VAL A 75 -19.247 15.173 12.568 1.00 0.00 H ATOM 1204 H VAL A 75 -15.582 15.220 10.477 1.00 0.00 H ATOM 1205 N LEU A 76 -14.178 13.437 13.714 1.00 22.03 N ATOM 1206 CA LEU A 76 -13.338 12.269 13.913 1.00 22.03 C ATOM 1207 C LEU A 76 -14.148 11.208 14.639 1.00 22.13 C ATOM 1208 O LEU A 76 -14.858 11.509 15.606 1.00 22.76 O ATOM 1209 CB LEU A 76 -12.105 12.639 14.748 1.00 21.37 C ATOM 1210 CG LEU A 76 -11.285 13.833 14.259 1.00 21.51 C ATOM 1211 CD1 LEU A 76 -10.110 14.093 15.189 1.00 21.96 C ATOM 1212 CD2 LEU A 76 -10.786 13.619 12.829 1.00 22.34 C ATOM 1213 HA LEU A 76 -13.002 11.890 12.948 1.00 0.00 H ATOM 1214 HB2 LEU A 76 -12.444 12.862 15.760 1.00 0.00 H ATOM 1215 HB3 LEU A 76 -11.446 11.771 14.770 1.00 0.00 H ATOM 1216 HG LEU A 76 -11.939 14.705 14.263 1.00 0.00 H ATOM 1217 HD21 LEU A 76 -10.157 12.729 12.794 1.00 0.00 H ATOM 1218 HD22 LEU A 76 -11.639 13.489 12.163 1.00 0.00 H ATOM 1219 HD23 LEU A 76 -10.207 14.487 12.514 1.00 0.00 H ATOM 1220 HD11 LEU A 76 -10.482 14.306 16.191 1.00 0.00 H ATOM 1221 HD12 LEU A 76 -9.469 13.212 15.218 1.00 0.00 H ATOM 1222 HD13 LEU A 76 -9.540 14.947 14.822 1.00 0.00 H ATOM 1223 H LEU A 76 -14.277 14.121 14.491 1.00 0.00 H ATOM 1224 N VAL A 77 -14.048 9.976 14.159 1.00 22.61 N ATOM 1225 CA VAL A 77 -14.761 8.867 14.755 1.00 22.96 C ATOM 1226 C VAL A 77 -13.766 7.835 15.269 1.00 23.04 C ATOM 1227 O VAL A 77 -12.939 7.306 14.523 1.00 22.94 O ATOM 1228 CB VAL A 77 -15.745 8.224 13.766 1.00 22.80 C ATOM 1229 CG1 VAL A 77 -16.536 7.136 14.461 1.00 25.25 C ATOM 1230 CG2 VAL A 77 -16.685 9.265 13.189 1.00 23.10 C ATOM 1231 HA VAL A 77 -15.348 9.250 15.589 1.00 0.00 H ATOM 1232 HB VAL A 77 -15.176 7.786 12.946 1.00 0.00 H ATOM 1233 HG11 VAL A 77 -15.852 6.374 14.836 1.00 0.00 H ATOM 1234 HG12 VAL A 77 -17.092 7.568 15.293 1.00 0.00 H ATOM 1235 HG13 VAL A 77 -17.231 6.685 13.753 1.00 0.00 H ATOM 1236 HG21 VAL A 77 -17.251 9.730 13.997 1.00 0.00 H ATOM 1237 HG22 VAL A 77 -16.106 10.025 12.665 1.00 0.00 H ATOM 1238 HG23 VAL A 77 -17.372 8.786 12.492 1.00 0.00 H ATOM 1239 H VAL A 77 -13.441 9.802 13.332 1.00 0.00 H ATOM 1240 N GLY A 78 -13.865 7.534 16.549 1.00 23.93 N ATOM 1241 CA GLY A 78 -12.885 6.667 17.184 1.00 26.48 C ATOM 1242 C GLY A 78 -13.198 6.547 18.654 1.00 28.29 C ATOM 1243 O GLY A 78 -14.113 7.234 19.158 1.00 28.90 O ATOM 1244 HA3 GLY A 78 -11.889 7.091 17.058 1.00 0.00 H ATOM 1245 HA2 GLY A 78 -12.920 5.680 16.723 1.00 0.00 H ATOM 1246 H GLY A 78 -14.651 7.920 17.110 1.00 0.00 H ATOM 1247 N PRO A 79 -12.462 5.671 19.347 1.00 29.61 N ATOM 1248 CA PRO A 79 -12.637 5.499 20.777 1.00 30.71 C ATOM 1249 C PRO A 79 -12.398 6.792 21.555 1.00 31.06 C ATOM 1250 O PRO A 79 -11.329 7.383 21.489 1.00 32.33 O ATOM 1251 CB PRO A 79 -11.589 4.441 21.137 1.00 30.89 C ATOM 1252 CG PRO A 79 -10.627 4.424 19.998 1.00 30.41 C ATOM 1253 CD PRO A 79 -11.429 4.764 18.805 1.00 29.62 C ATOM 1254 HA PRO A 79 -13.656 5.208 21.033 1.00 0.00 H ATOM 1255 HD3 PRO A 79 -10.820 5.267 18.054 1.00 0.00 H ATOM 1256 HD2 PRO A 79 -11.880 3.873 18.368 1.00 0.00 H ATOM 1257 HG3 PRO A 79 -10.181 3.435 19.889 1.00 0.00 H ATOM 1258 HG2 PRO A 79 -9.840 5.162 20.152 1.00 0.00 H ATOM 1259 HB2 PRO A 79 -11.079 4.710 22.062 1.00 0.00 H ATOM 1260 HB3 PRO A 79 -12.059 3.464 21.253 1.00 0.00 H ATOM 1261 N THR A 80 -13.426 7.240 22.251 1.00 31.08 N ATOM 1262 CA THR A 80 -13.306 8.311 23.225 1.00 30.58 C ATOM 1263 C THR A 80 -14.351 8.020 24.290 1.00 30.98 C ATOM 1264 O THR A 80 -15.446 7.554 23.973 1.00 31.57 O ATOM 1265 CB THR A 80 -13.542 9.724 22.609 1.00 30.57 C ATOM 1266 OG1 THR A 80 -13.632 10.684 23.662 1.00 27.93 O ATOM 1267 CG2 THR A 80 -14.841 9.787 21.801 1.00 30.64 C ATOM 1268 HA THR A 80 -12.293 8.336 23.626 1.00 0.00 H ATOM 1269 HB THR A 80 -12.705 9.936 21.943 1.00 0.00 H ATOM 1270 HG1 THR A 80 -14.387 10.449 24.257 1.00 0.00 H ATOM 1271 HG23 THR A 80 -14.798 9.062 20.989 1.00 0.00 H ATOM 1272 HG21 THR A 80 -15.684 9.555 22.452 1.00 0.00 H ATOM 1273 HG22 THR A 80 -14.963 10.789 21.389 1.00 0.00 H ATOM 1274 H THR A 80 -14.360 6.809 22.096 1.00 0.00 H ATOM 1275 N PRO A 81 -14.017 8.268 25.557 1.00 30.76 N ATOM 1276 CA PRO A 81 -15.011 8.005 26.582 1.00 30.51 C ATOM 1277 C PRO A 81 -16.195 8.953 26.553 1.00 29.89 C ATOM 1278 O PRO A 81 -17.254 8.607 27.078 1.00 29.35 O ATOM 1279 CB PRO A 81 -14.238 8.193 27.887 1.00 30.19 C ATOM 1280 CG PRO A 81 -12.824 8.311 27.512 1.00 30.93 C ATOM 1281 CD PRO A 81 -12.749 8.755 26.119 1.00 31.01 C ATOM 1282 HA PRO A 81 -15.448 7.016 26.445 1.00 0.00 H ATOM 1283 HD3 PRO A 81 -12.682 9.841 26.055 1.00 0.00 H ATOM 1284 HD2 PRO A 81 -11.895 8.309 25.609 1.00 0.00 H ATOM 1285 HG3 PRO A 81 -12.333 7.343 27.617 1.00 0.00 H ATOM 1286 HG2 PRO A 81 -12.332 9.038 28.157 1.00 0.00 H ATOM 1287 HB2 PRO A 81 -14.571 9.097 28.397 1.00 0.00 H ATOM 1288 HB3 PRO A 81 -14.385 7.334 28.541 1.00 0.00 H ATOM 1289 N THR A 82 -16.008 10.131 25.945 1.00 29.09 N ATOM 1290 CA THR A 82 -17.021 11.176 25.901 1.00 28.32 C ATOM 1291 C THR A 82 -16.980 11.807 24.503 1.00 26.92 C ATOM 1292 O THR A 82 -15.881 12.152 24.020 1.00 26.20 O ATOM 1293 CB THR A 82 -16.676 12.282 26.940 1.00 29.38 C ATOM 1294 OG1 THR A 82 -16.782 11.761 28.288 1.00 30.29 O ATOM 1295 CG2 THR A 82 -17.589 13.471 26.797 1.00 30.44 C ATOM 1296 HA THR A 82 -18.002 10.756 26.123 1.00 0.00 H ATOM 1297 HB THR A 82 -15.651 12.601 26.749 1.00 0.00 H ATOM 1298 HG1 THR A 82 -16.560 12.476 28.935 1.00 0.00 H ATOM 1299 HG23 THR A 82 -17.513 13.866 25.784 1.00 0.00 H ATOM 1300 HG21 THR A 82 -18.617 13.164 26.992 1.00 0.00 H ATOM 1301 HG22 THR A 82 -17.296 14.240 27.512 1.00 0.00 H ATOM 1302 H THR A 82 -15.094 10.308 25.481 1.00 0.00 H ATOM 1303 N ASN A 83 -18.148 11.980 23.874 1.00 25.34 N ATOM 1304 CA ASN A 83 -18.193 12.711 22.597 1.00 23.50 C ATOM 1305 C ASN A 83 -17.910 14.173 22.848 1.00 23.40 C ATOM 1306 O ASN A 83 -18.433 14.739 23.820 1.00 23.08 O ATOM 1307 CB ASN A 83 -19.575 12.593 21.950 1.00 22.88 C ATOM 1308 CG ASN A 83 -19.980 11.153 21.698 1.00 24.00 C ATOM 1309 OD1 ASN A 83 -19.137 10.314 21.393 1.00 24.43 O ATOM 1310 ND2 ASN A 83 -21.284 10.879 21.770 1.00 22.77 N ATOM 1311 HA ASN A 83 -17.446 12.281 21.930 1.00 0.00 H ATOM 1312 HB2 ASN A 83 -20.310 13.052 22.611 1.00 0.00 H ATOM 1313 HB3 ASN A 83 -19.562 13.124 20.998 1.00 0.00 H ATOM 1314 HD22 ASN A 83 -21.958 11.626 22.033 1.00 0.00 H ATOM 1315 HD21 ASN A 83 -21.626 9.919 21.563 1.00 0.00 H ATOM 1316 H ASN A 83 -19.023 11.599 24.287 1.00 0.00 H ATOM 1317 N VAL A 84 -17.128 14.815 21.969 1.00 23.23 N ATOM 1318 CA VAL A 84 -16.731 16.212 22.246 1.00 23.28 C ATOM 1319 C VAL A 84 -16.926 17.065 21.003 1.00 23.54 C ATOM 1320 O VAL A 84 -16.654 16.615 19.880 1.00 23.44 O ATOM 1321 CB VAL A 84 -15.288 16.381 22.774 1.00 23.80 C ATOM 1322 CG1 VAL A 84 -15.079 15.683 24.168 1.00 25.95 C ATOM 1323 CG2 VAL A 84 -14.225 15.999 21.697 1.00 22.79 C ATOM 1324 HA VAL A 84 -17.384 16.546 23.053 1.00 0.00 H ATOM 1325 HB VAL A 84 -15.129 17.442 22.967 1.00 0.00 H ATOM 1326 HG11 VAL A 84 -15.760 16.120 24.898 1.00 0.00 H ATOM 1327 HG12 VAL A 84 -15.282 14.616 24.073 1.00 0.00 H ATOM 1328 HG13 VAL A 84 -14.050 15.830 24.496 1.00 0.00 H ATOM 1329 HG21 VAL A 84 -14.363 14.958 21.406 1.00 0.00 H ATOM 1330 HG22 VAL A 84 -14.347 16.641 20.824 1.00 0.00 H ATOM 1331 HG23 VAL A 84 -13.226 16.133 22.111 1.00 0.00 H ATOM 1332 H VAL A 84 -16.805 14.337 21.104 1.00 0.00 H ATOM 1333 N ILE A 85 -17.500 18.248 21.218 1.00 23.63 N ATOM 1334 CA ILE A 85 -17.670 19.230 20.149 1.00 22.51 C ATOM 1335 C ILE A 85 -16.479 20.171 20.278 1.00 22.71 C ATOM 1336 O ILE A 85 -16.294 20.800 21.319 1.00 23.97 O ATOM 1337 CB ILE A 85 -18.948 20.044 20.352 1.00 22.68 C ATOM 1338 CG1 ILE A 85 -20.173 19.111 20.388 1.00 23.97 C ATOM 1339 CG2 ILE A 85 -19.069 21.129 19.274 1.00 22.06 C ATOM 1340 CD1 ILE A 85 -20.317 18.210 19.182 1.00 22.90 C ATOM 1341 HA ILE A 85 -17.734 18.740 19.177 1.00 0.00 H ATOM 1342 HB ILE A 85 -18.903 20.555 21.314 1.00 0.00 H ATOM 1343 HG12 ILE A 85 -20.095 18.482 21.275 1.00 0.00 H ATOM 1344 HG13 ILE A 85 -21.068 19.728 20.460 1.00 0.00 H ATOM 1345 HD11 ILE A 85 -20.411 18.820 18.284 1.00 0.00 H ATOM 1346 HD12 ILE A 85 -19.437 17.572 19.099 1.00 0.00 H ATOM 1347 HD13 ILE A 85 -21.207 17.591 19.297 1.00 0.00 H ATOM 1348 HG21 ILE A 85 -18.209 21.796 19.334 1.00 0.00 H ATOM 1349 HG22 ILE A 85 -19.099 20.660 18.290 1.00 0.00 H ATOM 1350 HG23 ILE A 85 -19.985 21.698 19.434 1.00 0.00 H ATOM 1351 H ILE A 85 -17.837 18.479 22.174 1.00 0.00 H ATOM 1352 N GLY A 86 -15.670 20.237 19.228 1.00 22.04 N ATOM 1353 CA GLY A 86 -14.409 20.986 19.288 1.00 21.65 C ATOM 1354 C GLY A 86 -14.518 22.428 18.830 1.00 21.54 C ATOM 1355 O GLY A 86 -15.587 22.895 18.422 1.00 21.30 O ATOM 1356 HA3 GLY A 86 -13.681 20.480 18.654 1.00 0.00 H ATOM 1357 HA2 GLY A 86 -14.057 20.981 20.320 1.00 0.00 H ATOM 1358 H GLY A 86 -15.934 19.750 18.348 1.00 0.00 H ATOM 1359 N ARG A 87 -13.384 23.124 18.870 1.00 22.79 N ATOM 1360 CA ARG A 87 -13.361 24.535 18.515 1.00 23.19 C ATOM 1361 C ARG A 87 -13.783 24.731 17.078 1.00 24.38 C ATOM 1362 O ARG A 87 -14.325 25.773 16.756 1.00 24.97 O ATOM 1363 CB ARG A 87 -11.986 25.131 18.746 1.00 23.55 C ATOM 1364 CG ARG A 87 -11.569 25.180 20.216 1.00 22.89 C ATOM 1365 CD ARG A 87 -10.268 26.003 20.439 1.00 24.12 C ATOM 1366 NE ARG A 87 -9.118 25.319 19.844 1.00 23.64 N ATOM 1367 CZ ARG A 87 -8.571 25.615 18.665 1.00 25.93 C ATOM 1368 NH1 ARG A 87 -9.036 26.620 17.917 1.00 26.80 N ATOM 1369 NH2 ARG A 87 -7.545 24.904 18.226 1.00 25.72 N ATOM 1370 HA ARG A 87 -14.071 25.054 19.159 1.00 0.00 H ATOM 1371 HB2 ARG A 87 -11.256 24.531 18.202 1.00 0.00 H ATOM 1372 HB3 ARG A 87 -11.983 26.148 18.354 1.00 0.00 H ATOM 1373 HG2 ARG A 87 -12.374 25.635 20.793 1.00 0.00 H ATOM 1374 HG3 ARG A 87 -11.403 24.161 20.567 1.00 0.00 H ATOM 1375 HD2 ARG A 87 -10.099 26.124 21.509 1.00 0.00 H ATOM 1376 HD3 ARG A 87 -10.380 26.984 19.977 1.00 0.00 H ATOM 1377 HE ARG A 87 -8.694 24.539 20.385 1.00 0.00 H ATOM 1378 HH12 ARG A 87 -8.594 26.834 17.000 1.00 0.00 H ATOM 1379 HH11 ARG A 87 -9.840 27.189 18.252 1.00 0.00 H ATOM 1380 HH22 ARG A 87 -7.112 25.128 17.307 1.00 0.00 H ATOM 1381 HH21 ARG A 87 -7.171 24.121 18.800 1.00 0.00 H ATOM 1382 H ARG A 87 -12.503 22.653 19.159 1.00 0.00 H ATOM 1383 N ASN A 88 -13.536 23.733 16.230 1.00 25.27 N ATOM 1384 CA ASN A 88 -13.890 23.822 14.807 1.00 26.12 C ATOM 1385 C ASN A 88 -15.384 24.113 14.616 1.00 25.46 C ATOM 1386 O ASN A 88 -15.768 24.931 13.787 1.00 26.13 O ATOM 1387 CB ASN A 88 -13.387 22.601 14.001 1.00 26.69 C ATOM 1388 CG ASN A 88 -14.091 21.286 14.361 1.00 29.10 C ATOM 1389 OD1 ASN A 88 -14.273 20.950 15.540 1.00 33.50 O ATOM 1390 ND2 ASN A 88 -14.475 20.521 13.327 1.00 29.20 N ATOM 1391 HA ASN A 88 -13.361 24.678 14.388 1.00 0.00 H ATOM 1392 HB2 ASN A 88 -13.549 22.798 12.941 1.00 0.00 H ATOM 1393 HB3 ASN A 88 -12.320 22.482 14.188 1.00 0.00 H ATOM 1394 HD22 ASN A 88 -14.303 20.840 12.352 1.00 0.00 H ATOM 1395 HD21 ASN A 88 -14.944 19.609 13.501 1.00 0.00 H ATOM 1396 H ASN A 88 -13.080 22.868 16.585 1.00 0.00 H ATOM 1397 N VAL A 89 -16.204 23.468 15.427 1.00 24.38 N ATOM 1398 CA VAL A 89 -17.652 23.674 15.428 1.00 23.17 C ATOM 1399 C VAL A 89 -18.034 24.910 16.233 1.00 22.61 C ATOM 1400 O VAL A 89 -18.890 25.672 15.794 1.00 22.92 O ATOM 1401 CB VAL A 89 -18.401 22.433 15.955 1.00 22.47 C ATOM 1402 CG1 VAL A 89 -19.861 22.756 16.281 1.00 22.04 C ATOM 1403 CG2 VAL A 89 -18.350 21.312 14.926 1.00 22.48 C ATOM 1404 HA VAL A 89 -17.954 23.834 14.393 1.00 0.00 H ATOM 1405 HB VAL A 89 -17.905 22.115 16.872 1.00 0.00 H ATOM 1406 HG11 VAL A 89 -19.898 23.533 17.045 1.00 0.00 H ATOM 1407 HG12 VAL A 89 -20.364 23.107 15.380 1.00 0.00 H ATOM 1408 HG13 VAL A 89 -20.357 21.858 16.649 1.00 0.00 H ATOM 1409 HG21 VAL A 89 -18.820 21.647 14.002 1.00 0.00 H ATOM 1410 HG22 VAL A 89 -17.311 21.046 14.731 1.00 0.00 H ATOM 1411 HG23 VAL A 89 -18.883 20.442 15.311 1.00 0.00 H ATOM 1412 H VAL A 89 -15.801 22.782 16.096 1.00 0.00 H ATOM 1413 N MET A 90 -17.393 25.117 17.390 1.00 22.81 N ATOM 1414 CA MET A 90 -17.752 26.253 18.238 1.00 23.10 C ATOM 1415 C MET A 90 -17.532 27.618 17.586 1.00 22.75 C ATOM 1416 O MET A 90 -18.373 28.506 17.736 1.00 22.77 O ATOM 1417 CB MET A 90 -17.121 26.158 19.623 1.00 23.04 C ATOM 1418 CG MET A 90 -17.899 25.186 20.518 1.00 24.68 C ATOM 1419 SD MET A 90 -17.201 25.040 22.191 1.00 28.79 S ATOM 1420 CE MET A 90 -15.717 24.186 21.795 1.00 26.94 C ATOM 1421 HA MET A 90 -18.832 26.181 18.370 1.00 0.00 H ATOM 1422 HB2 MET A 90 -16.094 25.807 19.523 1.00 0.00 H ATOM 1423 HB3 MET A 90 -17.123 27.146 20.084 1.00 0.00 H ATOM 1424 HG2 MET A 90 -17.890 24.201 20.051 1.00 0.00 H ATOM 1425 HG3 MET A 90 -18.927 25.538 20.601 1.00 0.00 H ATOM 1426 HE1 MET A 90 -15.962 23.234 21.323 1.00 0.00 H ATOM 1427 HE2 MET A 90 -15.123 24.791 21.109 1.00 0.00 H ATOM 1428 HE3 MET A 90 -15.149 24.005 22.707 1.00 0.00 H ATOM 1429 H MET A 90 -16.637 24.467 17.687 1.00 0.00 H ATOM 1430 N THR A 91 -16.439 27.791 16.840 1.00 23.44 N ATOM 1431 CA THR A 91 -16.228 29.068 16.155 1.00 23.97 C ATOM 1432 C THR A 91 -17.388 29.341 15.194 1.00 24.40 C ATOM 1433 O THR A 91 -17.853 30.477 15.047 1.00 24.46 O ATOM 1434 CB THR A 91 -14.891 29.122 15.391 1.00 24.62 C ATOM 1435 OG1 THR A 91 -14.790 28.012 14.488 1.00 24.92 O ATOM 1436 CG2 THR A 91 -13.761 29.071 16.359 1.00 24.50 C ATOM 1437 HA THR A 91 -16.188 29.840 16.924 1.00 0.00 H ATOM 1438 HB THR A 91 -14.849 30.051 14.822 1.00 0.00 H ATOM 1439 HG1 THR A 91 -14.837 27.166 15.000 1.00 0.00 H ATOM 1440 HG23 THR A 91 -13.835 29.913 17.047 1.00 0.00 H ATOM 1441 HG21 THR A 91 -13.807 28.137 16.920 1.00 0.00 H ATOM 1442 HG22 THR A 91 -12.817 29.125 15.817 1.00 0.00 H ATOM 1443 H THR A 91 -15.742 27.025 16.746 1.00 0.00 H ATOM 1444 N GLN A 92 -17.861 28.281 14.558 1.00 24.46 N ATOM 1445 CA GLN A 92 -19.056 28.372 13.714 1.00 25.30 C ATOM 1446 C GLN A 92 -20.334 28.658 14.527 1.00 25.34 C ATOM 1447 O GLN A 92 -21.245 29.323 14.037 1.00 25.80 O ATOM 1448 CB GLN A 92 -19.229 27.083 12.940 1.00 25.40 C ATOM 1449 CG GLN A 92 -18.065 26.760 12.062 1.00 27.52 C ATOM 1450 CD GLN A 92 -18.355 25.583 11.171 1.00 32.13 C ATOM 1451 OE1 GLN A 92 -19.130 25.682 10.217 1.00 34.25 O ATOM 1452 NE2 GLN A 92 -17.741 24.449 11.483 1.00 34.73 N ATOM 1453 HA GLN A 92 -18.909 29.210 13.033 1.00 0.00 H ATOM 1454 HB2 GLN A 92 -19.363 26.268 13.651 1.00 0.00 H ATOM 1455 HB3 GLN A 92 -20.119 27.170 12.317 1.00 0.00 H ATOM 1456 HG2 GLN A 92 -17.838 27.627 11.441 1.00 0.00 H ATOM 1457 HG3 GLN A 92 -17.203 26.527 12.688 1.00 0.00 H ATOM 1458 HE22 GLN A 92 -17.095 24.414 12.298 1.00 0.00 H ATOM 1459 HE21 GLN A 92 -17.905 23.595 10.913 1.00 0.00 H ATOM 1460 H GLN A 92 -17.376 27.367 14.659 1.00 0.00 H ATOM 1461 N LEU A 93 -20.413 28.159 15.767 1.00 25.89 N ATOM 1462 CA LEU A 93 -21.579 28.491 16.584 1.00 26.05 C ATOM 1463 C LEU A 93 -21.517 29.955 17.036 1.00 26.76 C ATOM 1464 O LEU A 93 -22.504 30.490 17.542 1.00 26.91 O ATOM 1465 CB LEU A 93 -21.741 27.527 17.764 1.00 26.71 C ATOM 1466 CG LEU A 93 -22.155 26.104 17.398 1.00 26.19 C ATOM 1467 CD1 LEU A 93 -22.198 25.252 18.664 1.00 24.47 C ATOM 1468 CD2 LEU A 93 -23.500 26.101 16.676 1.00 26.75 C ATOM 1469 HA LEU A 93 -22.470 28.371 15.968 1.00 0.00 H ATOM 1470 HB2 LEU A 93 -20.787 27.475 18.289 1.00 0.00 H ATOM 1471 HB3 LEU A 93 -22.500 27.937 18.431 1.00 0.00 H ATOM 1472 HG LEU A 93 -21.422 25.677 16.713 1.00 0.00 H ATOM 1473 HD21 LEU A 93 -24.261 26.533 17.326 1.00 0.00 H ATOM 1474 HD22 LEU A 93 -23.422 26.691 15.763 1.00 0.00 H ATOM 1475 HD23 LEU A 93 -23.774 25.076 16.425 1.00 0.00 H ATOM 1476 HD11 LEU A 93 -21.211 25.239 19.125 1.00 0.00 H ATOM 1477 HD12 LEU A 93 -22.921 25.676 19.361 1.00 0.00 H ATOM 1478 HD13 LEU A 93 -22.493 24.235 18.406 1.00 0.00 H ATOM 1479 H LEU A 93 -19.660 27.547 16.141 1.00 0.00 H ATOM 1480 N GLY A 94 -20.368 30.616 16.785 1.00 26.89 N ATOM 1481 CA GLY A 94 -20.132 31.994 17.231 1.00 27.12 C ATOM 1482 C GLY A 94 -19.959 31.976 18.739 1.00 26.93 C ATOM 1483 O GLY A 94 -20.171 32.975 19.427 1.00 26.87 O ATOM 1484 HA3 GLY A 94 -20.983 32.621 16.963 1.00 0.00 H ATOM 1485 HA2 GLY A 94 -19.231 32.386 16.760 1.00 0.00 H ATOM 1486 H GLY A 94 -19.619 30.129 16.253 1.00 0.00 H ATOM 1487 N CYS A 95 -19.562 30.806 19.231 1.00 27.14 N ATOM 1488 CA CYS A 95 -19.453 30.495 20.637 1.00 27.96 C ATOM 1489 C CYS A 95 -18.168 31.109 21.216 1.00 27.22 C ATOM 1490 O CYS A 95 -17.084 30.985 20.624 1.00 27.81 O ATOM 1491 CB CYS A 95 -19.472 28.965 20.759 1.00 27.87 C ATOM 1492 SG CYS A 95 -19.908 28.314 22.297 1.00 33.29 S ATOM 1493 HA CYS A 95 -20.279 30.917 21.209 1.00 0.00 H ATOM 1494 HB2 CYS A 95 -18.473 28.602 20.518 1.00 0.00 H ATOM 1495 HB3 CYS A 95 -20.183 28.584 20.026 1.00 0.00 H ATOM 1496 HG CYS A 95 -19.876 26.936 22.237 1.00 0.00 H ATOM 1497 H CYS A 95 -19.311 30.059 18.552 1.00 0.00 H ATOM 1498 N THR A 96 -18.293 31.813 22.341 1.00 26.02 N ATOM 1499 CA THR A 96 -17.147 32.476 22.985 1.00 25.28 C ATOM 1500 C THR A 96 -17.102 32.147 24.479 1.00 25.21 C ATOM 1501 O THR A 96 -18.120 31.786 25.057 1.00 24.27 O ATOM 1502 CB THR A 96 -17.207 34.019 22.851 1.00 25.40 C ATOM 1503 OG1 THR A 96 -18.405 34.513 23.463 1.00 26.23 O ATOM 1504 CG2 THR A 96 -17.172 34.459 21.395 1.00 24.89 C ATOM 1505 HA THR A 96 -16.259 32.104 22.475 1.00 0.00 H ATOM 1506 HB THR A 96 -16.330 34.428 23.353 1.00 0.00 H ATOM 1507 HG1 THR A 96 -18.410 34.267 24.422 1.00 0.00 H ATOM 1508 HG23 THR A 96 -16.262 34.085 20.926 1.00 0.00 H ATOM 1509 HG21 THR A 96 -18.042 34.058 20.875 1.00 0.00 H ATOM 1510 HG22 THR A 96 -17.187 35.548 21.345 1.00 0.00 H ATOM 1511 H THR A 96 -19.233 31.897 22.779 1.00 0.00 H ATOM 1512 N LEU A 97 -15.932 32.295 25.093 1.00 25.38 N ATOM 1513 CA LEU A 97 -15.812 32.244 26.557 1.00 25.55 C ATOM 1514 C LEU A 97 -15.912 33.651 27.120 1.00 25.86 C ATOM 1515 O LEU A 97 -15.082 34.514 26.816 1.00 25.48 O ATOM 1516 CB LEU A 97 -14.495 31.611 26.997 1.00 25.08 C ATOM 1517 CG LEU A 97 -14.468 30.082 26.944 1.00 25.48 C ATOM 1518 CD1 LEU A 97 -13.041 29.572 27.079 1.00 25.43 C ATOM 1519 CD2 LEU A 97 -15.410 29.455 27.997 1.00 24.83 C ATOM 1520 HA LEU A 97 -16.623 31.625 26.939 1.00 0.00 H ATOM 1521 HB2 LEU A 97 -13.704 31.987 26.348 1.00 0.00 H ATOM 1522 HB3 LEU A 97 -14.297 31.918 28.024 1.00 0.00 H ATOM 1523 HG LEU A 97 -14.844 29.769 25.970 1.00 0.00 H ATOM 1524 HD21 LEU A 97 -15.099 29.769 28.993 1.00 0.00 H ATOM 1525 HD22 LEU A 97 -16.432 29.787 27.812 1.00 0.00 H ATOM 1526 HD23 LEU A 97 -15.361 28.368 27.926 1.00 0.00 H ATOM 1527 HD11 LEU A 97 -12.437 29.967 26.262 1.00 0.00 H ATOM 1528 HD12 LEU A 97 -12.627 29.902 28.032 1.00 0.00 H ATOM 1529 HD13 LEU A 97 -13.041 28.483 27.039 1.00 0.00 H ATOM 1530 H LEU A 97 -15.078 32.451 24.521 1.00 0.00 H ATOM 1531 N ASN A 98 -16.930 33.869 27.949 1.00 26.82 N ATOM 1532 CA ASN A 98 -17.191 35.182 28.535 1.00 27.87 C ATOM 1533 C ASN A 98 -17.146 35.168 30.049 1.00 28.69 C ATOM 1534 O ASN A 98 -17.696 34.268 30.682 1.00 28.70 O ATOM 1535 CB ASN A 98 -18.553 35.702 28.092 1.00 28.26 C ATOM 1536 CG ASN A 98 -18.643 35.898 26.600 1.00 28.76 C ATOM 1537 OD1 ASN A 98 -18.643 34.938 25.833 1.00 31.02 O ATOM 1538 ND2 ASN A 98 -18.730 37.140 26.179 1.00 29.75 N ATOM 1539 HA ASN A 98 -16.397 35.838 28.179 1.00 0.00 H ATOM 1540 HB2 ASN A 98 -19.316 34.986 28.397 1.00 0.00 H ATOM 1541 HB3 ASN A 98 -18.738 36.658 28.582 1.00 0.00 H ATOM 1542 HD22 ASN A 98 -18.726 37.923 26.864 1.00 0.00 H ATOM 1543 HD21 ASN A 98 -18.803 37.340 25.161 1.00 0.00 H ATOM 1544 H ASN A 98 -17.561 33.078 28.188 1.00 0.00 H ATOM 1545 N PHE A 99 -16.491 36.176 30.619 1.00 29.98 N ATOM 1546 CA PHE A 99 -16.451 36.373 32.073 1.00 31.00 C ATOM 1547 C PHE A 99 -16.107 37.816 32.437 1.00 31.03 C ATOM 1548 O PHE A 99 -15.842 38.128 33.596 1.00 31.43 O ATOM 1549 CB PHE A 99 -15.472 35.391 32.739 1.00 31.30 C ATOM 1550 CG PHE A 99 -14.070 35.475 32.210 1.00 32.63 C ATOM 1551 CD1 PHE A 99 -13.730 34.869 31.004 1.00 33.56 C ATOM 1552 CD2 PHE A 99 -13.088 36.134 32.926 1.00 33.99 C ATOM 1553 CE1 PHE A 99 -12.435 34.939 30.511 1.00 34.96 C ATOM 1554 CE2 PHE A 99 -11.802 36.212 32.441 1.00 35.48 C ATOM 1555 CZ PHE A 99 -11.470 35.611 31.230 1.00 35.23 C ATOM 1556 HA PHE A 99 -17.451 36.167 32.456 1.00 0.00 H ATOM 1557 OXT PHE A 99 -16.086 38.713 31.588 1.00 31.15 O ATOM 1558 HB2 PHE A 99 -15.449 35.602 33.808 1.00 0.00 H ATOM 1559 HB3 PHE A 99 -15.840 34.378 32.578 1.00 0.00 H ATOM 1560 HD2 PHE A 99 -13.334 36.596 33.882 1.00 0.00 H ATOM 1561 HE2 PHE A 99 -11.040 36.747 33.008 1.00 0.00 H ATOM 1562 HZ PHE A 99 -10.450 35.672 30.851 1.00 0.00 H ATOM 1563 HE1 PHE A 99 -12.183 34.466 29.562 1.00 0.00 H ATOM 1564 HD1 PHE A 99 -14.492 34.332 30.439 1.00 0.00 H ATOM 1565 H PHE A 99 -15.987 36.852 30.010 1.00 0.00 H TER 1566 PHE A 99 ATOM 1567 N PRO B 1 -13.844 39.889 30.207 1.00 31.72 N ATOM 1568 CA PRO B 1 -13.226 39.575 28.923 1.00 31.38 C ATOM 1569 C PRO B 1 -14.007 38.533 28.142 1.00 30.91 C ATOM 1570 O PRO B 1 -14.724 37.715 28.728 1.00 31.18 O ATOM 1571 CB PRO B 1 -11.863 38.974 29.309 1.00 31.60 C ATOM 1572 CG PRO B 1 -11.703 39.204 30.758 1.00 31.62 C ATOM 1573 CD PRO B 1 -13.079 39.324 31.328 1.00 32.15 C ATOM 1574 HA PRO B 1 -13.172 40.460 28.290 1.00 0.00 H ATOM 1575 HD3 PRO B 1 -13.470 38.350 31.620 1.00 0.00 H ATOM 1576 HD2 PRO B 1 -13.091 39.992 32.189 1.00 0.00 H ATOM 1577 HG3 PRO B 1 -11.142 40.122 30.933 1.00 0.00 H ATOM 1578 HG2 PRO B 1 -11.178 38.366 31.216 1.00 0.00 H ATOM 1579 HB2 PRO B 1 -11.846 37.906 29.092 1.00 0.00 H ATOM 1580 HB3 PRO B 1 -11.063 39.468 28.758 1.00 0.00 H ATOM 1581 N GLN B 2 -13.841 38.574 26.826 1.00 29.96 N ATOM 1582 CA GLN B 2 -14.413 37.598 25.913 1.00 29.57 C ATOM 1583 C GLN B 2 -13.260 36.934 25.156 1.00 28.92 C ATOM 1584 O GLN B 2 -12.377 37.623 24.647 1.00 28.97 O ATOM 1585 CB GLN B 2 -15.357 38.316 24.951 1.00 29.62 C ATOM 1586 CG GLN B 2 -16.273 37.430 24.129 1.00 30.42 C ATOM 1587 CD GLN B 2 -17.091 38.232 23.121 1.00 31.21 C ATOM 1588 OE1 GLN B 2 -16.765 39.378 22.811 1.00 32.73 O ATOM 1589 NE2 GLN B 2 -18.149 37.625 22.598 1.00 31.74 N ATOM 1590 HA GLN B 2 -14.982 36.837 26.447 1.00 0.00 H ATOM 1591 HB2 GLN B 2 -15.983 38.989 25.538 1.00 0.00 H ATOM 1592 HB3 GLN B 2 -14.748 38.899 24.260 1.00 0.00 H ATOM 1593 HG2 GLN B 2 -15.668 36.701 23.591 1.00 0.00 H ATOM 1594 HG3 GLN B 2 -16.955 36.909 24.801 1.00 0.00 H ATOM 1595 HE22 GLN B 2 -18.389 36.656 22.888 1.00 0.00 H ATOM 1596 HE21 GLN B 2 -18.738 38.119 21.898 1.00 0.00 H ATOM 1597 H GLN B 2 -13.271 39.346 26.426 1.00 0.00 H ATOM 1598 N ILE B 3 -13.255 35.601 25.105 1.00 28.19 N ATOM 1599 CA ILE B 3 -12.220 34.834 24.403 1.00 28.32 C ATOM 1600 C ILE B 3 -12.886 34.091 23.237 1.00 27.53 C ATOM 1601 O ILE B 3 -13.733 33.231 23.449 1.00 26.94 O ATOM 1602 CB ILE B 3 -11.513 33.788 25.359 1.00 28.50 C ATOM 1603 CG1 ILE B 3 -10.957 34.449 26.632 1.00 29.76 C ATOM 1604 CG2 ILE B 3 -10.427 32.980 24.627 1.00 29.32 C ATOM 1605 CD1 ILE B 3 -9.566 35.074 26.501 1.00 31.16 C ATOM 1606 HA ILE B 3 -11.453 35.522 24.046 1.00 0.00 H ATOM 1607 HB ILE B 3 -12.285 33.085 25.672 1.00 0.00 H ATOM 1608 HG12 ILE B 3 -11.651 35.234 26.932 1.00 0.00 H ATOM 1609 HG13 ILE B 3 -10.911 33.689 27.412 1.00 0.00 H ATOM 1610 HD11 ILE B 3 -8.848 34.304 26.217 1.00 0.00 H ATOM 1611 HD12 ILE B 3 -9.589 35.851 25.737 1.00 0.00 H ATOM 1612 HD13 ILE B 3 -9.274 35.510 27.456 1.00 0.00 H ATOM 1613 HG21 ILE B 3 -10.879 32.434 23.799 1.00 0.00 H ATOM 1614 HG22 ILE B 3 -9.666 33.660 24.244 1.00 0.00 H ATOM 1615 HG23 ILE B 3 -9.970 32.276 25.322 1.00 0.00 H ATOM 1616 H ILE B 3 -14.019 35.082 25.584 1.00 0.00 H ATOM 1617 N THR B 4 -12.526 34.439 22.002 1.00 26.87 N ATOM 1618 CA THR B 4 -13.013 33.695 20.836 1.00 25.97 C ATOM 1619 C THR B 4 -12.213 32.396 20.724 1.00 26.05 C ATOM 1620 O THR B 4 -11.221 32.212 21.436 1.00 26.95 O ATOM 1621 CB THR B 4 -12.878 34.524 19.559 1.00 26.83 C ATOM 1622 OG1 THR B 4 -11.611 35.179 19.578 1.00 26.62 O ATOM 1623 CG2 THR B 4 -13.987 35.568 19.487 1.00 26.35 C ATOM 1624 HA THR B 4 -14.072 33.470 20.963 1.00 0.00 H ATOM 1625 HB THR B 4 -12.957 33.871 18.689 1.00 0.00 H ATOM 1626 HG1 THR B 4 -11.509 35.721 18.756 1.00 0.00 H ATOM 1627 HG23 THR B 4 -14.955 35.067 19.472 1.00 0.00 H ATOM 1628 HG21 THR B 4 -13.927 36.221 20.358 1.00 0.00 H ATOM 1629 HG22 THR B 4 -13.869 36.160 18.579 1.00 0.00 H ATOM 1630 H THR B 4 -11.890 35.250 21.863 1.00 0.00 H ATOM 1631 N LEU B 5 -12.628 31.494 19.839 1.00 24.29 N ATOM 1632 CA LEU B 5 -12.079 30.143 19.841 1.00 22.61 C ATOM 1633 C LEU B 5 -11.382 29.774 18.535 1.00 22.41 C ATOM 1634 O LEU B 5 -11.161 28.605 18.253 1.00 21.94 O ATOM 1635 CB LEU B 5 -13.174 29.127 20.218 1.00 22.40 C ATOM 1636 CG LEU B 5 -13.718 29.340 21.637 1.00 22.29 C ATOM 1637 CD1 LEU B 5 -15.007 28.562 21.834 1.00 22.94 C ATOM 1638 CD2 LEU B 5 -12.690 28.971 22.704 1.00 24.06 C ATOM 1639 HA LEU B 5 -11.298 30.112 20.600 1.00 0.00 H ATOM 1640 HB2 LEU B 5 -13.998 29.223 19.511 1.00 0.00 H ATOM 1641 HB3 LEU B 5 -12.756 28.123 20.152 1.00 0.00 H ATOM 1642 HG LEU B 5 -13.931 30.403 21.751 1.00 0.00 H ATOM 1643 HD21 LEU B 5 -12.418 27.921 22.597 1.00 0.00 H ATOM 1644 HD22 LEU B 5 -11.803 29.592 22.582 1.00 0.00 H ATOM 1645 HD23 LEU B 5 -13.118 29.138 23.692 1.00 0.00 H ATOM 1646 HD11 LEU B 5 -15.750 28.904 21.114 1.00 0.00 H ATOM 1647 HD12 LEU B 5 -14.815 27.500 21.683 1.00 0.00 H ATOM 1648 HD13 LEU B 5 -15.378 28.726 22.846 1.00 0.00 H ATOM 1649 H LEU B 5 -13.351 31.755 19.139 1.00 0.00 H ATOM 1650 N TRP B 6 -10.993 30.791 17.761 1.00 21.79 N ATOM 1651 CA TRP B 6 -10.265 30.557 16.523 1.00 21.95 C ATOM 1652 C TRP B 6 -8.901 29.914 16.814 1.00 22.65 C ATOM 1653 O TRP B 6 -8.359 29.136 15.988 1.00 24.14 O ATOM 1654 CB TRP B 6 -10.140 31.876 15.764 1.00 22.17 C ATOM 1655 CG TRP B 6 -11.503 32.287 15.306 1.00 21.59 C ATOM 1656 CD1 TRP B 6 -12.343 33.177 15.913 1.00 21.95 C ATOM 1657 CD2 TRP B 6 -12.222 31.756 14.191 1.00 22.97 C ATOM 1658 NE1 TRP B 6 -13.526 33.261 15.224 1.00 22.44 N ATOM 1659 CE2 TRP B 6 -13.481 32.399 14.162 1.00 21.83 C ATOM 1660 CE3 TRP B 6 -11.915 30.820 13.196 1.00 25.04 C ATOM 1661 CZ2 TRP B 6 -14.442 32.121 13.192 1.00 23.26 C ATOM 1662 CZ3 TRP B 6 -12.868 30.550 12.222 1.00 25.87 C ATOM 1663 CH2 TRP B 6 -14.118 31.199 12.230 1.00 25.33 C ATOM 1664 HA TRP B 6 -10.810 29.854 15.893 1.00 0.00 H ATOM 1665 HB2 TRP B 6 -9.725 32.641 16.420 1.00 0.00 H ATOM 1666 HB3 TRP B 6 -9.486 31.745 14.902 1.00 0.00 H ATOM 1667 HE1 TRP B 6 -14.326 33.879 15.469 1.00 0.00 H ATOM 1668 HD1 TRP B 6 -12.107 33.740 16.816 1.00 0.00 H ATOM 1669 HZ2 TRP B 6 -15.413 32.617 13.198 1.00 0.00 H ATOM 1670 HH2 TRP B 6 -14.845 30.963 11.453 1.00 0.00 H ATOM 1671 HZ3 TRP B 6 -12.645 29.825 11.440 1.00 0.00 H ATOM 1672 HE3 TRP B 6 -10.949 30.314 13.186 1.00 0.00 H ATOM 1673 H TRP B 6 -11.214 31.766 18.048 1.00 0.00 H ATOM 1674 N GLN B 7 -8.365 30.250 17.974 1.00 20.43 N ATOM 1675 CA GLN B 7 -7.134 29.644 18.447 1.00 20.57 C ATOM 1676 C GLN B 7 -7.385 29.016 19.799 1.00 20.35 C ATOM 1677 O GLN B 7 -8.386 29.293 20.422 1.00 19.28 O ATOM 1678 CB GLN B 7 -6.034 30.692 18.574 1.00 20.64 C ATOM 1679 CG GLN B 7 -5.794 31.470 17.310 1.00 20.46 C ATOM 1680 CD GLN B 7 -4.997 30.702 16.260 1.00 21.48 C ATOM 1681 OE1 GLN B 7 -4.255 29.768 16.577 1.00 22.15 O ATOM 1682 NE2 GLN B 7 -5.152 31.097 14.997 1.00 19.12 N ATOM 1683 HA GLN B 7 -6.813 28.887 17.732 1.00 0.00 H ATOM 1684 HB2 GLN B 7 -6.314 31.392 19.362 1.00 0.00 H ATOM 1685 HB3 GLN B 7 -5.108 30.188 18.850 1.00 0.00 H ATOM 1686 HG2 GLN B 7 -6.760 31.738 16.882 1.00 0.00 H ATOM 1687 HG3 GLN B 7 -5.246 32.378 17.563 1.00 0.00 H ATOM 1688 HE22 GLN B 7 -5.788 31.889 14.774 1.00 0.00 H ATOM 1689 HE21 GLN B 7 -4.637 30.613 14.234 1.00 0.00 H ATOM 1690 H GLN B 7 -8.837 30.966 18.562 1.00 0.00 H ATOM 1691 N ARG B 8 -6.470 28.149 20.229 1.00 21.35 N ATOM 1692 CA ARG B 8 -6.569 27.527 21.565 1.00 22.33 C ATOM 1693 C ARG B 8 -6.624 28.650 22.583 1.00 22.51 C ATOM 1694 O ARG B 8 -5.832 29.598 22.485 1.00 21.15 O ATOM 1695 CB ARG B 8 -5.336 26.664 21.839 1.00 22.93 C ATOM 1696 CG ARG B 8 -5.384 25.366 21.071 1.00 25.07 C ATOM 1697 CD ARG B 8 -4.173 24.463 21.364 1.00 30.41 C ATOM 1698 NE ARG B 8 -4.177 23.346 20.410 1.00 34.01 N ATOM 1699 CZ ARG B 8 -3.124 22.594 20.082 1.00 36.32 C ATOM 1700 NH1 ARG B 8 -1.930 22.805 20.630 1.00 37.55 N ATOM 1701 NH2 ARG B 8 -3.266 21.619 19.188 1.00 35.34 N ATOM 1702 HA ARG B 8 -7.455 26.895 21.622 1.00 0.00 H ATOM 1703 HB2 ARG B 8 -4.444 27.217 21.544 1.00 0.00 H ATOM 1704 HB3 ARG B 8 -5.289 26.443 22.905 1.00 0.00 H ATOM 1705 HG2 ARG B 8 -6.294 24.831 21.344 1.00 0.00 H ATOM 1706 HG3 ARG B 8 -5.403 25.591 20.005 1.00 0.00 H ATOM 1707 HD2 ARG B 8 -4.240 24.077 22.381 1.00 0.00 H ATOM 1708 HD3 ARG B 8 -3.252 25.036 21.254 1.00 0.00 H ATOM 1709 HE ARG B 8 -5.081 23.121 19.949 1.00 0.00 H ATOM 1710 HH12 ARG B 8 -1.122 22.208 20.361 1.00 0.00 H ATOM 1711 HH11 ARG B 8 -1.805 23.567 21.327 1.00 0.00 H ATOM 1712 HH22 ARG B 8 -2.450 21.029 18.928 1.00 0.00 H ATOM 1713 HH21 ARG B 8 -4.193 21.447 18.749 1.00 0.00 H ATOM 1714 H ARG B 8 -5.670 27.905 19.612 1.00 0.00 H ATOM 1715 N PRO B 9 -7.574 28.575 23.529 1.00 21.91 N ATOM 1716 CA PRO B 9 -7.718 29.603 24.550 1.00 22.31 C ATOM 1717 C PRO B 9 -6.732 29.455 25.710 1.00 21.69 C ATOM 1718 O PRO B 9 -7.104 29.076 26.823 1.00 21.83 O ATOM 1719 CB PRO B 9 -9.161 29.452 24.999 1.00 21.61 C ATOM 1720 CG PRO B 9 -9.422 27.976 24.864 1.00 21.51 C ATOM 1721 CD PRO B 9 -8.611 27.532 23.640 1.00 22.84 C ATOM 1722 HA PRO B 9 -7.491 30.596 24.162 1.00 0.00 H ATOM 1723 HD3 PRO B 9 -8.164 26.551 23.801 1.00 0.00 H ATOM 1724 HD2 PRO B 9 -9.235 27.503 22.746 1.00 0.00 H ATOM 1725 HG3 PRO B 9 -10.484 27.789 24.707 1.00 0.00 H ATOM 1726 HG2 PRO B 9 -9.089 27.446 25.756 1.00 0.00 H ATOM 1727 HB2 PRO B 9 -9.283 29.776 26.033 1.00 0.00 H ATOM 1728 HB3 PRO B 9 -9.830 30.026 24.358 1.00 0.00 H ATOM 1729 N ILE B 10 -5.487 29.795 25.409 1.00 23.06 N ATOM 1730 CA ILE B 10 -4.389 29.692 26.353 1.00 23.53 C ATOM 1731 C ILE B 10 -4.312 30.969 27.197 1.00 23.73 C ATOM 1732 O ILE B 10 -4.419 32.096 26.666 1.00 24.18 O ATOM 1733 CB ILE B 10 -3.010 29.497 25.604 1.00 23.98 C ATOM 1734 CG1 ILE B 10 -3.018 28.227 24.727 1.00 26.45 C ATOM 1735 CG2 ILE B 10 -1.861 29.473 26.600 1.00 26.62 C ATOM 1736 CD1 ILE B 10 -2.899 26.926 25.476 1.00 32.53 C ATOM 1737 HA ILE B 10 -4.573 28.826 26.989 1.00 0.00 H ATOM 1738 HB ILE B 10 -2.865 30.347 24.938 1.00 0.00 H ATOM 1739 HG12 ILE B 10 -3.954 28.210 24.168 1.00 0.00 H ATOM 1740 HG13 ILE B 10 -2.182 28.293 24.031 1.00 0.00 H ATOM 1741 HD11 ILE B 10 -1.961 26.913 26.032 1.00 0.00 H ATOM 1742 HD12 ILE B 10 -3.735 26.829 26.169 1.00 0.00 H ATOM 1743 HD13 ILE B 10 -2.915 26.098 24.768 1.00 0.00 H ATOM 1744 HG21 ILE B 10 -1.837 30.415 27.148 1.00 0.00 H ATOM 1745 HG22 ILE B 10 -2.005 28.649 27.299 1.00 0.00 H ATOM 1746 HG23 ILE B 10 -0.921 29.338 26.065 1.00 0.00 H ATOM 1747 H ILE B 10 -5.287 30.152 24.453 1.00 0.00 H ATOM 1748 N VAL B 11 -4.046 30.797 28.491 1.00 22.76 N ATOM 1749 CA VAL B 11 -3.925 31.923 29.426 1.00 23.08 C ATOM 1750 C VAL B 11 -2.716 31.716 30.305 1.00 23.47 C ATOM 1751 O VAL B 11 -2.237 30.579 30.494 1.00 23.82 O ATOM 1752 CB VAL B 11 -5.222 32.072 30.318 1.00 23.40 C ATOM 1753 CG1 VAL B 11 -6.419 32.460 29.461 1.00 23.14 C ATOM 1754 CG2 VAL B 11 -5.508 30.785 31.106 1.00 24.47 C ATOM 1755 HA VAL B 11 -3.810 32.840 28.848 1.00 0.00 H ATOM 1756 HB VAL B 11 -5.043 32.869 31.040 1.00 0.00 H ATOM 1757 HG11 VAL B 11 -6.218 33.411 28.967 1.00 0.00 H ATOM 1758 HG12 VAL B 11 -6.592 31.689 28.710 1.00 0.00 H ATOM 1759 HG13 VAL B 11 -7.301 32.557 30.094 1.00 0.00 H ATOM 1760 HG21 VAL B 11 -5.658 29.960 30.410 1.00 0.00 H ATOM 1761 HG22 VAL B 11 -4.662 30.563 31.757 1.00 0.00 H ATOM 1762 HG23 VAL B 11 -6.406 30.921 31.709 1.00 0.00 H ATOM 1763 H VAL B 11 -3.919 29.830 28.852 1.00 0.00 H ATOM 1764 N THR B 12 -2.236 32.815 30.870 1.00 24.00 N ATOM 1765 CA THR B 12 -1.076 32.784 31.738 1.00 24.62 C ATOM 1766 C THR B 12 -1.571 32.682 33.179 1.00 24.59 C ATOM 1767 O THR B 12 -2.504 33.392 33.584 1.00 25.69 O ATOM 1768 CB THR B 12 -0.227 34.053 31.535 1.00 24.01 C ATOM 1769 OG1 THR B 12 0.241 34.089 30.174 1.00 25.32 O ATOM 1770 CG2 THR B 12 0.965 34.065 32.492 1.00 25.06 C ATOM 1771 HA THR B 12 -0.445 31.927 31.504 1.00 0.00 H ATOM 1772 HB THR B 12 -0.841 34.930 31.743 1.00 0.00 H ATOM 1773 HG1 THR B 12 -0.535 34.103 29.560 1.00 0.00 H ATOM 1774 HG23 THR B 12 0.604 34.038 33.520 1.00 0.00 H ATOM 1775 HG21 THR B 12 1.591 33.193 32.302 1.00 0.00 H ATOM 1776 HG22 THR B 12 1.547 34.973 32.334 1.00 0.00 H ATOM 1777 H THR B 12 -2.705 33.725 30.685 1.00 0.00 H ATOM 1778 N VAL B 13 -0.955 31.799 33.948 1.00 24.95 N ATOM 1779 CA VAL B 13 -1.316 31.672 35.359 1.00 24.80 C ATOM 1780 C VAL B 13 -0.108 31.768 36.280 1.00 24.53 C ATOM 1781 O VAL B 13 1.035 31.467 35.888 1.00 25.70 O ATOM 1782 CB VAL B 13 -2.040 30.359 35.648 1.00 25.40 C ATOM 1783 CG1 VAL B 13 -3.241 30.190 34.696 1.00 26.93 C ATOM 1784 CG2 VAL B 13 -1.078 29.211 35.509 1.00 26.11 C ATOM 1785 HA VAL B 13 -1.984 32.509 35.560 1.00 0.00 H ATOM 1786 HB VAL B 13 -2.420 30.374 36.669 1.00 0.00 H ATOM 1787 HG11 VAL B 13 -3.935 31.019 34.838 1.00 0.00 H ATOM 1788 HG12 VAL B 13 -2.888 30.183 33.665 1.00 0.00 H ATOM 1789 HG13 VAL B 13 -3.747 29.249 34.915 1.00 0.00 H ATOM 1790 HG21 VAL B 13 -0.682 29.191 34.494 1.00 0.00 H ATOM 1791 HG22 VAL B 13 -0.259 29.337 36.217 1.00 0.00 H ATOM 1792 HG23 VAL B 13 -1.598 28.276 35.716 1.00 0.00 H ATOM 1793 H VAL B 13 -0.211 31.193 33.547 1.00 0.00 H ATOM 1794 N LYS B 14 -0.359 32.191 37.503 1.00 23.71 N ATOM 1795 CA LYS B 14 0.663 32.136 38.535 1.00 23.34 C ATOM 1796 C LYS B 14 0.166 31.215 39.633 1.00 23.78 C ATOM 1797 O LYS B 14 -0.862 31.476 40.258 1.00 23.34 O ATOM 1798 CB LYS B 14 0.976 33.518 39.105 1.00 22.56 C ATOM 1799 CG LYS B 14 2.079 33.472 40.151 1.00 21.49 C ATOM 1800 CD LYS B 14 2.365 34.863 40.720 1.00 19.98 C ATOM 1801 CE LYS B 14 3.523 34.850 41.681 1.00 22.05 C ATOM 1802 NZ LYS B 14 3.740 36.245 42.191 1.00 19.35 N ATOM 1803 HA LYS B 14 1.589 31.760 38.101 1.00 0.00 H ATOM 1804 HB2 LYS B 14 1.291 34.171 38.291 1.00 0.00 H ATOM 1805 HB3 LYS B 14 0.073 33.921 39.564 1.00 0.00 H ATOM 1806 HG2 LYS B 14 1.772 32.813 40.963 1.00 0.00 H ATOM 1807 HG3 LYS B 14 2.988 33.082 39.692 1.00 0.00 H ATOM 1808 HD2 LYS B 14 2.597 35.539 39.897 1.00 0.00 H ATOM 1809 HD3 LYS B 14 1.477 35.220 41.242 1.00 0.00 H ATOM 1810 HE2 LYS B 14 4.421 34.502 41.170 1.00 0.00 H ATOM 1811 HE3 LYS B 14 3.301 34.185 42.515 1.00 0.00 H ATOM 1812 HZ1 LYS B 14 3.950 36.876 41.392 1.00 0.00 H ATOM 1813 HZ2 LYS B 14 2.881 36.573 42.676 1.00 0.00 H ATOM 1814 HZ3 LYS B 14 4.539 36.249 42.857 1.00 0.00 H ATOM 1815 H LYS B 14 -1.300 32.569 37.732 1.00 0.00 H ATOM 1816 N ILE B 15 0.897 30.131 39.874 1.00 24.65 N ATOM 1817 CA ILE B 15 0.505 29.205 40.933 1.00 25.97 C ATOM 1818 C ILE B 15 1.655 28.886 41.861 1.00 26.46 C ATOM 1819 O ILE B 15 2.697 28.391 41.421 1.00 27.26 O ATOM 1820 CB ILE B 15 -0.051 27.883 40.353 1.00 26.12 C ATOM 1821 CG1 ILE B 15 -1.199 28.160 39.378 1.00 27.37 C ATOM 1822 CG2 ILE B 15 -0.516 26.942 41.493 1.00 25.35 C ATOM 1823 CD1 ILE B 15 -1.648 26.944 38.665 1.00 29.19 C ATOM 1824 HA ILE B 15 -0.277 29.709 41.501 1.00 0.00 H ATOM 1825 HB ILE B 15 0.749 27.387 39.804 1.00 0.00 H ATOM 1826 HG12 ILE B 15 -2.041 28.568 39.937 1.00 0.00 H ATOM 1827 HG13 ILE B 15 -0.864 28.892 38.643 1.00 0.00 H ATOM 1828 HD11 ILE B 15 -0.816 26.531 38.094 1.00 0.00 H ATOM 1829 HD12 ILE B 15 -1.995 26.207 39.389 1.00 0.00 H ATOM 1830 HD13 ILE B 15 -2.463 27.201 37.988 1.00 0.00 H ATOM 1831 HG21 ILE B 15 0.329 26.716 42.143 1.00 0.00 H ATOM 1832 HG22 ILE B 15 -1.299 27.433 42.071 1.00 0.00 H ATOM 1833 HG23 ILE B 15 -0.904 26.018 41.064 1.00 0.00 H ATOM 1834 H ILE B 15 1.749 29.942 39.308 1.00 0.00 H ATOM 1835 N GLU B 16 1.450 29.158 43.152 1.00 26.89 N ATOM 1836 CA GLU B 16 2.454 28.925 44.170 1.00 27.45 C ATOM 1837 C GLU B 16 3.835 29.375 43.703 1.00 26.60 C ATOM 1838 O GLU B 16 4.807 28.614 43.720 1.00 26.29 O ATOM 1839 CB GLU B 16 2.421 27.472 44.650 1.00 28.61 C ATOM 1840 CG GLU B 16 1.549 27.293 45.880 1.00 30.90 C ATOM 1841 CD GLU B 16 1.312 25.846 46.236 1.00 33.24 C ATOM 1842 OE1 GLU B 16 2.281 25.055 46.194 1.00 33.49 O ATOM 1843 OE2 GLU B 16 0.157 25.514 46.575 1.00 32.30 O ATOM 1844 HA GLU B 16 2.216 29.541 45.037 1.00 0.00 H ATOM 1845 HB2 GLU B 16 2.030 26.846 43.848 1.00 0.00 H ATOM 1846 HB3 GLU B 16 3.437 27.159 44.891 1.00 0.00 H ATOM 1847 HG2 GLU B 16 2.035 27.782 46.724 1.00 0.00 H ATOM 1848 HG3 GLU B 16 0.585 27.766 45.693 1.00 0.00 H ATOM 1849 H GLU B 16 0.532 29.553 43.439 1.00 0.00 H ATOM 1850 N GLY B 17 3.877 30.628 43.251 1.00 24.93 N ATOM 1851 CA GLY B 17 5.102 31.309 42.875 1.00 24.21 C ATOM 1852 C GLY B 17 5.622 31.041 41.480 1.00 23.30 C ATOM 1853 O GLY B 17 6.626 31.641 41.090 1.00 24.00 O ATOM 1854 HA3 GLY B 17 5.877 31.011 43.581 1.00 0.00 H ATOM 1855 HA2 GLY B 17 4.926 32.381 42.963 1.00 0.00 H ATOM 1856 H GLY B 17 2.980 31.148 43.163 1.00 0.00 H ATOM 1857 N GLN B 18 4.955 30.147 40.746 1.00 22.86 N ATOM 1858 CA GLN B 18 5.439 29.662 39.449 1.00 22.76 C ATOM 1859 C GLN B 18 4.572 30.172 38.331 1.00 21.74 C ATOM 1860 O GLN B 18 3.350 30.234 38.480 1.00 23.08 O ATOM 1861 CB GLN B 18 5.487 28.134 39.411 1.00 22.47 C ATOM 1862 CG GLN B 18 6.378 27.571 40.502 1.00 24.27 C ATOM 1863 CD GLN B 18 6.008 26.177 40.917 1.00 26.79 C ATOM 1864 OE1 GLN B 18 6.250 25.222 40.191 1.00 27.84 O ATOM 1865 NE2 GLN B 18 5.457 26.045 42.115 1.00 27.83 N ATOM 1866 HA GLN B 18 6.451 30.043 39.315 1.00 0.00 H ATOM 1867 HB2 GLN B 18 4.477 27.746 39.544 1.00 0.00 H ATOM 1868 HB3 GLN B 18 5.872 27.817 38.442 1.00 0.00 H ATOM 1869 HG2 GLN B 18 7.405 27.562 40.138 1.00 0.00 H ATOM 1870 HG3 GLN B 18 6.309 28.221 41.374 1.00 0.00 H ATOM 1871 HE22 GLN B 18 5.270 26.886 42.697 1.00 0.00 H ATOM 1872 HE21 GLN B 18 5.212 25.100 42.473 1.00 0.00 H ATOM 1873 H GLN B 18 4.053 29.778 41.110 1.00 0.00 H ATOM 1874 N LEU B 19 5.194 30.519 37.211 1.00 21.11 N ATOM 1875 CA LEU B 19 4.466 31.095 36.070 1.00 21.21 C ATOM 1876 C LEU B 19 4.300 29.995 35.025 1.00 21.73 C ATOM 1877 O LEU B 19 5.284 29.313 34.705 1.00 21.32 O ATOM 1878 CB LEU B 19 5.277 32.234 35.482 1.00 21.33 C ATOM 1879 CG LEU B 19 5.614 33.379 36.460 1.00 23.24 C ATOM 1880 CD1 LEU B 19 6.335 34.499 35.721 1.00 23.82 C ATOM 1881 CD2 LEU B 19 4.323 33.872 37.113 1.00 24.28 C ATOM 1882 HA LEU B 19 3.494 31.476 36.383 1.00 0.00 H ATOM 1883 HB2 LEU B 19 6.215 31.822 35.109 1.00 0.00 H ATOM 1884 HB3 LEU B 19 4.712 32.656 34.651 1.00 0.00 H ATOM 1885 HG LEU B 19 6.282 33.021 37.244 1.00 0.00 H ATOM 1886 HD21 LEU B 19 3.643 34.234 36.342 1.00 0.00 H ATOM 1887 HD22 LEU B 19 3.855 33.050 37.655 1.00 0.00 H ATOM 1888 HD23 LEU B 19 4.554 34.681 37.806 1.00 0.00 H ATOM 1889 HD11 LEU B 19 7.258 34.112 35.289 1.00 0.00 H ATOM 1890 HD12 LEU B 19 5.693 34.881 34.928 1.00 0.00 H ATOM 1891 HD13 LEU B 19 6.568 35.302 36.420 1.00 0.00 H ATOM 1892 H LEU B 19 6.222 30.380 37.138 1.00 0.00 H ATOM 1893 N LYS B 20 3.078 29.799 34.534 1.00 21.70 N ATOM 1894 CA LYS B 20 2.809 28.705 33.584 1.00 23.03 C ATOM 1895 C LYS B 20 1.774 29.196 32.592 1.00 23.11 C ATOM 1896 O LYS B 20 1.186 30.275 32.770 1.00 23.94 O ATOM 1897 CB LYS B 20 2.264 27.461 34.303 1.00 22.83 C ATOM 1898 CG LYS B 20 3.125 26.882 35.427 1.00 23.20 C ATOM 1899 CD LYS B 20 4.213 25.971 34.930 1.00 25.63 C ATOM 1900 CE LYS B 20 5.313 25.789 35.992 1.00 26.68 C ATOM 1901 NZ LYS B 20 6.499 25.095 35.426 1.00 29.11 N ATOM 1902 HA LYS B 20 3.738 28.426 33.087 1.00 0.00 H ATOM 1903 HB2 LYS B 20 1.296 27.724 34.730 1.00 0.00 H ATOM 1904 HB3 LYS B 20 2.129 26.680 33.555 1.00 0.00 H ATOM 1905 HG2 LYS B 20 3.585 27.707 35.971 1.00 0.00 H ATOM 1906 HG3 LYS B 20 2.481 26.317 36.101 1.00 0.00 H ATOM 1907 HD2 LYS B 20 3.782 24.998 34.693 1.00 0.00 H ATOM 1908 HD3 LYS B 20 4.654 26.401 34.030 1.00 0.00 H ATOM 1909 HE2 LYS B 20 4.916 25.198 36.818 1.00 0.00 H ATOM 1910 HE3 LYS B 20 5.617 26.769 36.361 1.00 0.00 H ATOM 1911 HZ1 LYS B 20 6.216 24.157 35.077 1.00 0.00 H ATOM 1912 HZ2 LYS B 20 6.886 25.657 34.641 1.00 0.00 H ATOM 1913 HZ3 LYS B 20 7.222 24.988 36.166 1.00 0.00 H ATOM 1914 H LYS B 20 2.302 30.427 34.825 1.00 0.00 H ATOM 1915 N GLU B 21 1.558 28.429 31.522 1.00 22.75 N ATOM 1916 CA GLU B 21 0.427 28.704 30.627 1.00 22.65 C ATOM 1917 C GLU B 21 -0.471 27.474 30.612 1.00 23.33 C ATOM 1918 O GLU B 21 0.006 26.356 30.866 1.00 22.89 O ATOM 1919 CB GLU B 21 0.891 29.042 29.207 1.00 22.67 C ATOM 1920 CG GLU B 21 1.789 30.257 29.117 1.00 21.56 C ATOM 1921 CD GLU B 21 2.173 30.588 27.705 1.00 17.81 C ATOM 1922 OE1 GLU B 21 1.333 31.140 26.973 1.00 15.73 O ATOM 1923 OE2 GLU B 21 3.325 30.304 27.332 1.00 20.95 O ATOM 1924 HA GLU B 21 -0.117 29.574 30.995 1.00 0.00 H ATOM 1925 HB2 GLU B 21 1.436 28.184 28.813 1.00 0.00 H ATOM 1926 HB3 GLU B 21 0.009 29.223 28.593 1.00 0.00 H ATOM 1927 HG2 GLU B 21 1.265 31.111 29.546 1.00 0.00 H ATOM 1928 HG3 GLU B 21 2.696 30.064 29.690 1.00 0.00 H ATOM 1929 H GLU B 21 2.195 27.632 31.321 1.00 0.00 H ATOM 1930 N ALA B 22 -1.767 27.679 30.357 1.00 22.80 N ATOM 1931 CA ALA B 22 -2.741 26.599 30.414 1.00 23.38 C ATOM 1932 C ALA B 22 -3.911 26.915 29.497 1.00 24.23 C ATOM 1933 O ALA B 22 -4.185 28.081 29.191 1.00 24.53 O ATOM 1934 CB ALA B 22 -3.238 26.371 31.861 1.00 23.29 C ATOM 1935 HA ALA B 22 -2.258 25.681 30.079 1.00 0.00 H ATOM 1936 HB1 ALA B 22 -2.392 26.112 32.498 1.00 0.00 H ATOM 1937 HB2 ALA B 22 -3.707 27.283 32.231 1.00 0.00 H ATOM 1938 HB3 ALA B 22 -3.964 25.558 31.871 1.00 0.00 H ATOM 1939 H ALA B 22 -2.088 28.637 30.111 1.00 0.00 H ATOM 1940 N LEU B 23 -4.607 25.862 29.096 1.00 24.19 N ATOM 1941 CA LEU B 23 -5.718 25.970 28.207 1.00 25.92 C ATOM 1942 C LEU B 23 -7.014 26.073 29.046 1.00 26.49 C ATOM 1943 O LEU B 23 -7.265 25.215 29.918 1.00 26.79 O ATOM 1944 CB LEU B 23 -5.687 24.712 27.335 1.00 26.75 C ATOM 1945 CG LEU B 23 -6.667 24.396 26.216 1.00 30.37 C ATOM 1946 CD1 LEU B 23 -6.480 25.393 25.128 1.00 31.28 C ATOM 1947 CD2 LEU B 23 -6.334 23.015 25.657 1.00 31.23 C ATOM 1948 HA LEU B 23 -5.677 26.855 27.572 1.00 0.00 H ATOM 1949 HB2 LEU B 23 -4.702 24.708 26.868 1.00 0.00 H ATOM 1950 HB3 LEU B 23 -5.761 23.876 28.030 1.00 0.00 H ATOM 1951 HG LEU B 23 -7.690 24.424 26.591 1.00 0.00 H ATOM 1952 HD21 LEU B 23 -5.315 23.017 25.271 1.00 0.00 H ATOM 1953 HD22 LEU B 23 -6.422 22.273 26.450 1.00 0.00 H ATOM 1954 HD23 LEU B 23 -7.029 22.773 24.853 1.00 0.00 H ATOM 1955 HD11 LEU B 23 -6.669 26.393 25.517 1.00 0.00 H ATOM 1956 HD12 LEU B 23 -5.457 25.334 24.755 1.00 0.00 H ATOM 1957 HD13 LEU B 23 -7.177 25.179 24.317 1.00 0.00 H ATOM 1958 H LEU B 23 -4.333 24.920 29.442 1.00 0.00 H ATOM 1959 N LEU B 24 -7.837 27.097 28.778 1.00 24.72 N ATOM 1960 CA LEU B 24 -9.188 27.169 29.368 1.00 24.80 C ATOM 1961 C LEU B 24 -10.043 26.069 28.739 1.00 24.51 C ATOM 1962 O LEU B 24 -10.396 26.131 27.549 1.00 24.70 O ATOM 1963 CB LEU B 24 -9.843 28.521 29.136 1.00 25.98 C ATOM 1964 CG LEU B 24 -9.262 29.738 29.859 1.00 26.31 C ATOM 1965 CD1 LEU B 24 -10.031 30.968 29.354 1.00 27.63 C ATOM 1966 CD2 LEU B 24 -9.363 29.546 31.392 1.00 27.06 C ATOM 1967 HA LEU B 24 -9.104 27.034 30.446 1.00 0.00 H ATOM 1968 HB2 LEU B 24 -9.793 28.726 28.067 1.00 0.00 H ATOM 1969 HB3 LEU B 24 -10.886 28.432 29.439 1.00 0.00 H ATOM 1970 HG LEU B 24 -8.201 29.871 29.647 1.00 0.00 H ATOM 1971 HD21 LEU B 24 -10.409 29.428 31.674 1.00 0.00 H ATOM 1972 HD22 LEU B 24 -8.804 28.656 31.683 1.00 0.00 H ATOM 1973 HD23 LEU B 24 -8.946 30.419 31.894 1.00 0.00 H ATOM 1974 HD11 LEU B 24 -9.899 31.060 28.276 1.00 0.00 H ATOM 1975 HD12 LEU B 24 -11.090 30.852 29.583 1.00 0.00 H ATOM 1976 HD13 LEU B 24 -9.647 31.862 29.846 1.00 0.00 H ATOM 1977 H LEU B 24 -7.517 27.855 28.142 1.00 0.00 H ATOM 1978 N ASP B 25 -10.382 25.057 29.535 1.00 23.35 N ATOM 1979 CA ASP B 25 -10.886 23.809 28.963 1.00 22.52 C ATOM 1980 C ASP B 25 -12.249 23.405 29.559 1.00 22.29 C ATOM 1981 O ASP B 25 -12.298 22.791 30.625 1.00 21.79 O ATOM 1982 CB ASP B 25 -9.855 22.704 29.216 1.00 21.94 C ATOM 1983 CG ASP B 25 -10.199 21.402 28.507 1.00 25.16 C ATOM 1984 OD1 ASP B 25 -11.299 21.293 27.915 1.00 24.89 O ATOM 1985 OD2 ASP B 25 -9.376 20.473 28.557 1.00 25.82 O ATOM 1986 HA ASP B 25 -11.037 23.956 27.894 1.00 0.00 H ATOM 1987 HB2 ASP B 25 -8.883 23.047 28.862 1.00 0.00 H ATOM 1988 HB3 ASP B 25 -9.804 22.514 30.288 1.00 0.00 H ATOM 1989 H ASP B 25 -10.288 25.154 30.566 1.00 0.00 H ATOM 1990 N THR B 26 -13.335 23.698 28.843 1.00 20.66 N ATOM 1991 CA THR B 26 -14.700 23.385 29.326 1.00 19.66 C ATOM 1992 C THR B 26 -14.970 21.883 29.381 1.00 19.43 C ATOM 1993 O THR B 26 -15.891 21.446 30.058 1.00 18.28 O ATOM 1994 CB THR B 26 -15.780 24.090 28.511 1.00 19.98 C ATOM 1995 OG1 THR B 26 -15.628 23.733 27.137 1.00 19.02 O ATOM 1996 CG2 THR B 26 -15.606 25.610 28.622 1.00 19.05 C ATOM 1997 HA THR B 26 -14.745 23.769 30.345 1.00 0.00 H ATOM 1998 HB THR B 26 -16.760 23.796 28.887 1.00 0.00 H ATOM 1999 HG1 THR B 26 -15.721 22.752 27.040 1.00 0.00 H ATOM 2000 HG23 THR B 26 -15.717 25.912 29.663 1.00 0.00 H ATOM 2001 HG21 THR B 26 -14.614 25.888 28.266 1.00 0.00 H ATOM 2002 HG22 THR B 26 -16.363 26.106 28.015 1.00 0.00 H ATOM 2003 H THR B 26 -13.220 24.160 27.918 1.00 0.00 H ATOM 2004 N GLY B 27 -14.133 21.103 28.692 1.00 19.06 N ATOM 2005 CA GLY B 27 -14.275 19.633 28.686 1.00 20.68 C ATOM 2006 C GLY B 27 -13.517 18.972 29.829 1.00 21.74 C ATOM 2007 O GLY B 27 -13.598 17.756 30.009 1.00 22.41 O ATOM 2008 HA3 GLY B 27 -13.891 19.248 27.742 1.00 0.00 H ATOM 2009 HA2 GLY B 27 -15.332 19.383 28.776 1.00 0.00 H ATOM 2010 H GLY B 27 -13.363 21.541 28.147 1.00 0.00 H ATOM 2011 N ALA B 28 -12.806 19.766 30.625 1.00 22.73 N ATOM 2012 CA ALA B 28 -12.073 19.262 31.792 1.00 22.82 C ATOM 2013 C ALA B 28 -12.831 19.526 33.102 1.00 22.01 C ATOM 2014 O ALA B 28 -13.158 20.669 33.403 1.00 21.71 O ATOM 2015 CB ALA B 28 -10.664 19.885 31.833 1.00 22.66 C ATOM 2016 HA ALA B 28 -11.980 18.180 31.693 1.00 0.00 H ATOM 2017 HB1 ALA B 28 -10.124 19.618 30.925 1.00 0.00 H ATOM 2018 HB2 ALA B 28 -10.749 20.969 31.901 1.00 0.00 H ATOM 2019 HB3 ALA B 28 -10.126 19.506 32.702 1.00 0.00 H ATOM 2020 H ALA B 28 -12.768 20.783 30.412 1.00 0.00 H ATOM 2021 N ASP B 29 -13.153 18.467 33.856 1.00 21.36 N ATOM 2022 CA ASP B 29 -13.788 18.618 35.170 1.00 22.19 C ATOM 2023 C ASP B 29 -12.841 19.288 36.149 1.00 23.38 C ATOM 2024 O ASP B 29 -13.262 20.114 36.975 1.00 23.92 O ATOM 2025 CB ASP B 29 -14.178 17.253 35.747 1.00 21.22 C ATOM 2026 CG ASP B 29 -15.244 16.535 34.931 1.00 22.47 C ATOM 2027 OD1 ASP B 29 -15.884 17.150 34.060 1.00 23.06 O ATOM 2028 OD2 ASP B 29 -15.469 15.346 35.242 1.00 24.50 O ATOM 2029 HA ASP B 29 -14.678 19.231 35.030 1.00 0.00 H ATOM 2030 HB2 ASP B 29 -13.288 16.625 35.782 1.00 0.00 H ATOM 2031 HB3 ASP B 29 -14.557 17.400 36.758 1.00 0.00 H ATOM 2032 H ASP B 29 -12.947 17.512 33.500 1.00 0.00 H ATOM 2033 N ASP B 30 -11.567 18.908 36.026 1.00 24.47 N ATOM 2034 CA ASP B 30 -10.483 19.276 36.948 1.00 25.63 C ATOM 2035 C ASP B 30 -9.344 20.050 36.268 1.00 24.66 C ATOM 2036 O ASP B 30 -9.137 19.985 35.053 1.00 25.72 O ATOM 2037 CB ASP B 30 -9.858 18.018 37.572 1.00 26.37 C ATOM 2038 CG ASP B 30 -10.888 16.959 37.978 1.00 29.98 C ATOM 2039 OD1 ASP B 30 -11.750 17.263 38.834 1.00 31.53 O ATOM 2040 OD2 ASP B 30 -10.811 15.803 37.470 1.00 33.45 O ATOM 2041 HA ASP B 30 -10.948 19.915 37.699 1.00 0.00 H ATOM 2042 HB2 ASP B 30 -9.176 17.575 36.846 1.00 0.00 H ATOM 2043 HB3 ASP B 30 -9.300 18.314 38.460 1.00 0.00 H ATOM 2044 H ASP B 30 -11.323 18.305 35.215 1.00 0.00 H ATOM 2045 N THR B 31 -8.591 20.780 37.076 1.00 23.90 N ATOM 2046 CA THR B 31 -7.447 21.541 36.584 1.00 23.55 C ATOM 2047 C THR B 31 -6.217 20.637 36.675 1.00 23.27 C ATOM 2048 O THR B 31 -5.973 20.025 37.704 1.00 22.43 O ATOM 2049 CB THR B 31 -7.286 22.831 37.415 1.00 23.39 C ATOM 2050 OG1 THR B 31 -8.371 23.725 37.100 1.00 23.55 O ATOM 2051 CG2 THR B 31 -5.975 23.522 37.122 1.00 24.01 C ATOM 2052 HA THR B 31 -7.585 21.848 35.547 1.00 0.00 H ATOM 2053 HB THR B 31 -7.298 22.562 38.471 1.00 0.00 H ATOM 2054 HG1 THR B 31 -9.232 23.288 37.321 1.00 0.00 H ATOM 2055 HG23 THR B 31 -5.150 22.850 37.359 1.00 0.00 H ATOM 2056 HG21 THR B 31 -5.935 23.790 36.066 1.00 0.00 H ATOM 2057 HG22 THR B 31 -5.897 24.423 37.730 1.00 0.00 H ATOM 2058 H THR B 31 -8.821 20.812 38.090 1.00 0.00 H ATOM 2059 N VAL B 32 -5.442 20.544 35.599 1.00 23.04 N ATOM 2060 CA VAL B 32 -4.331 19.599 35.565 1.00 22.39 C ATOM 2061 C VAL B 32 -3.090 20.264 34.986 1.00 23.10 C ATOM 2062 O VAL B 32 -3.176 20.904 33.940 1.00 23.58 O ATOM 2063 CB VAL B 32 -4.650 18.335 34.717 1.00 22.99 C ATOM 2064 CG1 VAL B 32 -3.564 17.259 34.942 1.00 22.25 C ATOM 2065 CG2 VAL B 32 -6.025 17.771 35.070 1.00 23.56 C ATOM 2066 HA VAL B 32 -4.158 19.289 36.595 1.00 0.00 H ATOM 2067 HB VAL B 32 -4.659 18.623 33.666 1.00 0.00 H ATOM 2068 HG11 VAL B 32 -2.594 17.656 34.644 1.00 0.00 H ATOM 2069 HG12 VAL B 32 -3.538 16.986 35.997 1.00 0.00 H ATOM 2070 HG13 VAL B 32 -3.797 16.378 34.343 1.00 0.00 H ATOM 2071 HG21 VAL B 32 -6.045 17.499 36.125 1.00 0.00 H ATOM 2072 HG22 VAL B 32 -6.787 18.525 34.874 1.00 0.00 H ATOM 2073 HG23 VAL B 32 -6.221 16.888 34.462 1.00 0.00 H ATOM 2074 H VAL B 32 -5.629 21.150 34.775 1.00 0.00 H ATOM 2075 N PHE B 33 -1.946 20.083 35.661 1.00 20.57 N ATOM 2076 CA PHE B 33 -0.655 20.593 35.202 1.00 21.27 C ATOM 2077 C PHE B 33 0.397 19.495 35.200 1.00 21.60 C ATOM 2078 O PHE B 33 0.386 18.633 36.075 1.00 21.14 O ATOM 2079 CB PHE B 33 -0.165 21.705 36.131 1.00 20.28 C ATOM 2080 CG PHE B 33 -0.802 23.042 35.856 1.00 18.57 C ATOM 2081 CD1 PHE B 33 -0.117 24.010 35.136 1.00 18.28 C ATOM 2082 CD2 PHE B 33 -2.071 23.329 36.335 1.00 17.67 C ATOM 2083 CE1 PHE B 33 -0.704 25.255 34.870 1.00 18.65 C ATOM 2084 CE2 PHE B 33 -2.673 24.583 36.095 1.00 20.35 C ATOM 2085 CZ PHE B 33 -1.990 25.534 35.343 1.00 19.25 C ATOM 2086 HA PHE B 33 -0.797 20.971 34.190 1.00 0.00 H ATOM 2087 HB2 PHE B 33 -0.390 21.420 37.159 1.00 0.00 H ATOM 2088 HB3 PHE B 33 0.914 21.805 36.011 1.00 0.00 H ATOM 2089 HD2 PHE B 33 -2.612 22.575 36.906 1.00 0.00 H ATOM 2090 HE2 PHE B 33 -3.663 24.804 36.495 1.00 0.00 H ATOM 2091 HZ PHE B 33 -2.456 26.494 35.123 1.00 0.00 H ATOM 2092 HE1 PHE B 33 -0.159 26.004 34.296 1.00 0.00 H ATOM 2093 HD1 PHE B 33 0.889 23.800 34.773 1.00 0.00 H ATOM 2094 H PHE B 33 -1.978 19.554 36.556 1.00 0.00 H ATOM 2095 N GLU B 34 1.333 19.574 34.253 1.00 23.14 N ATOM 2096 CA GLU B 34 2.416 18.590 34.125 1.00 25.41 C ATOM 2097 C GLU B 34 3.623 18.830 35.038 1.00 26.73 C ATOM 2098 O GLU B 34 4.071 17.913 35.742 1.00 27.81 O ATOM 2099 CB GLU B 34 2.888 18.528 32.673 1.00 25.47 C ATOM 2100 CG GLU B 34 3.745 17.320 32.337 1.00 28.37 C ATOM 2101 CD GLU B 34 4.000 17.193 30.851 1.00 31.07 C ATOM 2102 OE1 GLU B 34 4.364 18.210 30.216 1.00 32.68 O ATOM 2103 OE2 GLU B 34 3.833 16.076 30.320 1.00 32.46 O ATOM 2104 HA GLU B 34 1.983 17.643 34.447 1.00 0.00 H ATOM 2105 HB2 GLU B 34 2.008 18.510 32.030 1.00 0.00 H ATOM 2106 HB3 GLU B 34 3.470 19.426 32.466 1.00 0.00 H ATOM 2107 HG2 GLU B 34 4.702 17.415 32.850 1.00 0.00 H ATOM 2108 HG3 GLU B 34 3.236 16.421 32.684 1.00 0.00 H ATOM 2109 H GLU B 34 1.294 20.364 33.578 1.00 0.00 H ATOM 2110 N GLU B 35 4.176 20.041 34.990 1.00 27.45 N ATOM 2111 CA GLU B 35 5.492 20.324 35.613 1.00 28.20 C ATOM 2112 C GLU B 35 5.405 21.392 36.690 1.00 28.22 C ATOM 2113 O GLU B 35 6.255 22.293 36.770 1.00 29.38 O ATOM 2114 CB GLU B 35 6.509 20.768 34.563 1.00 28.59 C ATOM 2115 CG GLU B 35 6.701 19.835 33.369 1.00 30.75 C ATOM 2116 CD GLU B 35 7.791 20.342 32.436 1.00 33.17 C ATOM 2117 OE1 GLU B 35 8.352 21.432 32.714 1.00 34.43 O ATOM 2118 OE2 GLU B 35 8.095 19.655 31.432 1.00 33.75 O ATOM 2119 HA GLU B 35 5.816 19.392 36.076 1.00 0.00 H ATOM 2120 HB2 GLU B 35 6.189 21.737 34.180 1.00 0.00 H ATOM 2121 HB3 GLU B 35 7.474 20.875 35.059 1.00 0.00 H ATOM 2122 HG2 GLU B 35 6.978 18.845 33.733 1.00 0.00 H ATOM 2123 HG3 GLU B 35 5.764 19.769 32.816 1.00 0.00 H ATOM 2124 H GLU B 35 3.671 20.809 34.503 1.00 0.00 H ATOM 2125 N LEU B 36 4.399 21.273 37.537 1.00 27.92 N ATOM 2126 CA LEU B 36 4.153 22.236 38.590 1.00 28.04 C ATOM 2127 C LEU B 36 4.509 21.624 39.932 1.00 27.89 C ATOM 2128 O LEU B 36 4.031 20.537 40.265 1.00 29.11 O ATOM 2129 CB LEU B 36 2.676 22.623 38.553 1.00 27.68 C ATOM 2130 CG LEU B 36 2.151 23.652 39.541 1.00 27.54 C ATOM 2131 CD1 LEU B 36 2.694 25.051 39.240 1.00 24.78 C ATOM 2132 CD2 LEU B 36 0.622 23.631 39.515 1.00 26.29 C ATOM 2133 HA LEU B 36 4.767 23.125 38.445 1.00 0.00 H ATOM 2134 HB2 LEU B 36 2.473 23.009 37.554 1.00 0.00 H ATOM 2135 HB3 LEU B 36 2.104 21.709 38.711 1.00 0.00 H ATOM 2136 HG LEU B 36 2.498 23.393 40.541 1.00 0.00 H ATOM 2137 HD21 LEU B 36 0.274 23.873 38.511 1.00 0.00 H ATOM 2138 HD22 LEU B 36 0.269 22.638 39.794 1.00 0.00 H ATOM 2139 HD23 LEU B 36 0.238 24.367 40.221 1.00 0.00 H ATOM 2140 HD11 LEU B 36 3.782 25.038 39.302 1.00 0.00 H ATOM 2141 HD12 LEU B 36 2.389 25.350 38.237 1.00 0.00 H ATOM 2142 HD13 LEU B 36 2.296 25.758 39.968 1.00 0.00 H ATOM 2143 H LEU B 36 3.760 20.458 37.444 1.00 0.00 H ATOM 2144 N THR B 37 5.362 22.308 40.695 1.00 27.62 N ATOM 2145 CA THR B 37 5.700 21.880 42.032 1.00 26.77 C ATOM 2146 C THR B 37 4.795 22.545 43.058 1.00 26.32 C ATOM 2147 O THR B 37 4.752 23.770 43.173 1.00 26.66 O ATOM 2148 CB THR B 37 7.188 22.164 42.341 1.00 26.91 C ATOM 2149 OG1 THR B 37 7.995 21.304 41.531 1.00 26.55 O ATOM 2150 CG2 THR B 37 7.508 21.933 43.807 1.00 27.32 C ATOM 2151 HA THR B 37 5.543 20.803 42.093 1.00 0.00 H ATOM 2152 HB THR B 37 7.397 23.210 42.118 1.00 0.00 H ATOM 2153 HG1 THR B 37 7.809 21.482 40.575 1.00 0.00 H ATOM 2154 HG23 THR B 37 6.891 22.590 44.420 1.00 0.00 H ATOM 2155 HG21 THR B 37 7.301 20.894 44.063 1.00 0.00 H ATOM 2156 HG22 THR B 37 8.561 22.150 43.986 1.00 0.00 H ATOM 2157 H THR B 37 5.796 23.174 40.317 1.00 0.00 H ATOM 2158 N LEU B 38 4.091 21.724 43.825 1.00 25.36 N ATOM 2159 CA LEU B 38 3.128 22.230 44.785 1.00 24.65 C ATOM 2160 C LEU B 38 3.498 21.778 46.170 1.00 25.26 C ATOM 2161 O LEU B 38 4.088 20.713 46.343 1.00 25.22 O ATOM 2162 CB LEU B 38 1.709 21.778 44.419 1.00 24.64 C ATOM 2163 CG LEU B 38 1.166 22.346 43.105 1.00 22.81 C ATOM 2164 CD1 LEU B 38 -0.280 21.928 42.914 1.00 23.21 C ATOM 2165 CD2 LEU B 38 1.304 23.864 43.049 1.00 20.21 C ATOM 2166 HA LEU B 38 3.146 23.320 44.761 1.00 0.00 H ATOM 2167 HB2 LEU B 38 1.710 20.691 44.343 1.00 0.00 H ATOM 2168 HB3 LEU B 38 1.039 22.084 45.222 1.00 0.00 H ATOM 2169 HG LEU B 38 1.762 21.937 42.289 1.00 0.00 H ATOM 2170 HD21 LEU B 38 0.746 24.309 43.873 1.00 0.00 H ATOM 2171 HD22 LEU B 38 2.356 24.135 43.133 1.00 0.00 H ATOM 2172 HD23 LEU B 38 0.908 24.229 42.101 1.00 0.00 H ATOM 2173 HD11 LEU B 38 -0.342 20.840 42.887 1.00 0.00 H ATOM 2174 HD12 LEU B 38 -0.879 22.307 43.742 1.00 0.00 H ATOM 2175 HD13 LEU B 38 -0.655 22.338 41.976 1.00 0.00 H ATOM 2176 H LEU B 38 4.232 20.697 43.737 1.00 0.00 H ATOM 2177 N SER B 39 3.149 22.600 47.155 1.00 25.26 N ATOM 2178 CA SER B 39 3.563 22.332 48.521 1.00 26.08 C ATOM 2179 C SER B 39 2.488 21.552 49.256 1.00 25.96 C ATOM 2180 O SER B 39 1.296 21.648 48.921 1.00 26.67 O ATOM 2181 CB SER B 39 3.856 23.645 49.243 1.00 25.81 C ATOM 2182 OG SER B 39 2.660 24.467 49.262 1.00 26.82 O ATOM 2183 HA SER B 39 4.472 21.730 48.502 1.00 0.00 H ATOM 2184 HB2 SER B 39 4.653 24.176 48.722 1.00 0.00 H ATOM 2185 HB3 SER B 39 4.169 23.435 50.266 1.00 0.00 H ATOM 2186 HG SER B 39 2.377 24.658 48.333 1.00 0.00 H ATOM 2187 H SER B 39 2.575 23.442 46.946 1.00 0.00 H ATOM 2188 N GLY B 40 2.928 20.766 50.234 1.00 25.91 N ATOM 2189 CA GLY B 40 2.039 20.063 51.140 1.00 25.26 C ATOM 2190 C GLY B 40 1.742 18.614 50.714 1.00 25.02 C ATOM 2191 O GLY B 40 2.545 17.867 49.865 1.00 25.17 O ATOM 2192 HA3 GLY B 40 1.096 20.608 51.189 1.00 0.00 H ATOM 2193 HA2 GLY B 40 2.499 20.044 52.128 1.00 0.00 H ATOM 2194 H GLY B 40 3.954 20.650 50.355 1.00 0.00 H ATOM 2195 N ARG B 41 0.514 18.223 51.295 1.00 24.95 N ATOM 2196 CA ARG B 41 0.082 16.863 51.117 1.00 24.95 C ATOM 2197 C ARG B 41 -0.729 16.758 49.851 1.00 24.86 C ATOM 2198 O ARG B 41 -1.191 17.766 49.301 1.00 24.71 O ATOM 2199 CB ARG B 41 -0.761 16.416 52.293 1.00 25.17 C ATOM 2200 CG ARG B 41 0.040 16.161 53.557 1.00 26.86 C ATOM 2201 CD ARG B 41 -0.718 15.221 54.473 1.00 30.61 C ATOM 2202 NE ARG B 41 -2.058 15.743 54.787 1.00 32.56 N ATOM 2203 CZ ARG B 41 -2.339 16.521 55.836 1.00 33.56 C ATOM 2204 NH1 ARG B 41 -1.378 16.881 56.684 1.00 33.14 N ATOM 2205 NH2 ARG B 41 -3.587 16.946 56.033 1.00 34.54 N ATOM 2206 HA ARG B 41 0.960 16.221 51.050 1.00 0.00 H ATOM 2207 HB2 ARG B 41 -1.498 17.191 52.503 1.00 0.00 H ATOM 2208 HB3 ARG B 41 -1.274 15.494 52.018 1.00 0.00 H ATOM 2209 HG2 ARG B 41 0.998 15.713 53.293 1.00 0.00 H ATOM 2210 HG3 ARG B 41 0.212 17.106 54.072 1.00 0.00 H ATOM 2211 HD2 ARG B 41 -0.158 15.100 55.400 1.00 0.00 H ATOM 2212 HD3 ARG B 41 -0.820 14.253 53.983 1.00 0.00 H ATOM 2213 HE ARG B 41 -2.839 15.489 54.149 1.00 0.00 H ATOM 2214 HH12 ARG B 41 -1.603 17.487 57.499 1.00 0.00 H ATOM 2215 HH11 ARG B 41 -0.402 16.556 56.532 1.00 0.00 H ATOM 2216 HH22 ARG B 41 -3.807 17.552 56.849 1.00 0.00 H ATOM 2217 HH21 ARG B 41 -4.340 16.672 55.371 1.00 0.00 H ATOM 2218 H ARG B 41 -0.061 18.900 51.836 1.00 0.00 H ATOM 2219 N TRP B 42 -0.898 15.523 49.404 1.00 24.39 N ATOM 2220 CA TRP B 42 -1.674 15.217 48.219 1.00 24.66 C ATOM 2221 C TRP B 42 -2.239 13.810 48.375 1.00 24.72 C ATOM 2222 O TRP B 42 -1.793 13.057 49.238 1.00 23.61 O ATOM 2223 CB TRP B 42 -0.796 15.315 46.972 1.00 24.64 C ATOM 2224 CG TRP B 42 0.484 14.549 47.064 1.00 25.91 C ATOM 2225 CD1 TRP B 42 1.671 14.990 47.586 1.00 26.75 C ATOM 2226 CD2 TRP B 42 0.714 13.205 46.623 1.00 27.02 C ATOM 2227 NE1 TRP B 42 2.623 13.999 47.495 1.00 26.96 N ATOM 2228 CE2 TRP B 42 2.065 12.897 46.904 1.00 27.22 C ATOM 2229 CE3 TRP B 42 -0.088 12.232 46.013 1.00 28.11 C ATOM 2230 CZ2 TRP B 42 2.631 11.655 46.596 1.00 28.32 C ATOM 2231 CZ3 TRP B 42 0.476 10.999 45.703 1.00 28.31 C ATOM 2232 CH2 TRP B 42 1.822 10.720 45.999 1.00 28.51 C ATOM 2233 HA TRP B 42 -2.489 15.931 48.104 1.00 0.00 H ATOM 2234 HB2 TRP B 42 -1.363 14.933 46.123 1.00 0.00 H ATOM 2235 HB3 TRP B 42 -0.555 16.365 46.804 1.00 0.00 H ATOM 2236 HE1 TRP B 42 3.607 14.075 47.822 1.00 0.00 H ATOM 2237 HD1 TRP B 42 1.838 15.980 48.011 1.00 0.00 H ATOM 2238 HZ2 TRP B 42 3.675 11.438 46.822 1.00 0.00 H ATOM 2239 HH2 TRP B 42 2.232 9.741 45.749 1.00 0.00 H ATOM 2240 HZ3 TRP B 42 -0.136 10.236 45.222 1.00 0.00 H ATOM 2241 HE3 TRP B 42 -1.134 12.437 45.786 1.00 0.00 H ATOM 2242 H TRP B 42 -0.455 14.740 49.925 1.00 0.00 H ATOM 2243 N LYS B 43 -3.238 13.475 47.560 1.00 24.88 N ATOM 2244 CA LYS B 43 -3.730 12.104 47.466 1.00 25.62 C ATOM 2245 C LYS B 43 -3.435 11.611 46.053 1.00 25.91 C ATOM 2246 O LYS B 43 -3.454 12.410 45.102 1.00 25.23 O ATOM 2247 CB LYS B 43 -5.242 12.021 47.737 1.00 25.82 C ATOM 2248 CG LYS B 43 -5.798 13.023 48.758 1.00 27.62 C ATOM 2249 CD LYS B 43 -5.555 12.609 50.197 1.00 28.79 C ATOM 2250 CE LYS B 43 -6.619 11.638 50.700 1.00 30.15 C ATOM 2251 NZ LYS B 43 -6.394 11.236 52.120 1.00 29.99 N ATOM 2252 HA LYS B 43 -3.235 11.489 48.217 1.00 0.00 H ATOM 2253 HB2 LYS B 43 -5.760 12.185 46.792 1.00 0.00 H ATOM 2254 HB3 LYS B 43 -5.461 11.017 48.101 1.00 0.00 H ATOM 2255 HG2 LYS B 43 -5.322 13.989 48.590 1.00 0.00 H ATOM 2256 HG3 LYS B 43 -6.873 13.117 48.601 1.00 0.00 H ATOM 2257 HD2 LYS B 43 -4.579 12.128 50.265 1.00 0.00 H ATOM 2258 HD3 LYS B 43 -5.565 13.499 50.826 1.00 0.00 H ATOM 2259 HE2 LYS B 43 -6.602 10.745 50.076 1.00 0.00 H ATOM 2260 HE3 LYS B 43 -7.595 12.116 50.621 1.00 0.00 H ATOM 2261 HZ1 LYS B 43 -5.467 10.771 52.205 1.00 0.00 H ATOM 2262 HZ2 LYS B 43 -6.416 12.081 52.726 1.00 0.00 H ATOM 2263 HZ3 LYS B 43 -7.142 10.577 52.415 1.00 0.00 H ATOM 2264 H LYS B 43 -3.680 14.212 46.974 1.00 0.00 H ATOM 2265 N PRO B 44 -3.145 10.307 45.905 1.00 26.11 N ATOM 2266 CA PRO B 44 -3.008 9.702 44.587 1.00 26.70 C ATOM 2267 C PRO B 44 -4.369 9.590 43.921 1.00 27.49 C ATOM 2268 O PRO B 44 -5.358 9.256 44.585 1.00 27.60 O ATOM 2269 CB PRO B 44 -2.475 8.285 44.891 1.00 26.55 C ATOM 2270 CG PRO B 44 -2.043 8.316 46.312 1.00 26.43 C ATOM 2271 CD PRO B 44 -2.918 9.317 46.977 1.00 26.24 C ATOM 2272 HA PRO B 44 -2.363 10.278 43.923 1.00 0.00 H ATOM 2273 HD3 PRO B 44 -3.856 8.866 47.302 1.00 0.00 H ATOM 2274 HD2 PRO B 44 -2.418 9.771 47.833 1.00 0.00 H ATOM 2275 HG3 PRO B 44 -0.998 8.616 46.385 1.00 0.00 H ATOM 2276 HG2 PRO B 44 -2.171 7.335 46.770 1.00 0.00 H ATOM 2277 HB2 PRO B 44 -3.261 7.544 44.748 1.00 0.00 H ATOM 2278 HB3 PRO B 44 -1.632 8.048 44.242 1.00 0.00 H ATOM 2279 N ARG B 45 -4.415 9.867 42.622 1.00 27.73 N ATOM 2280 CA ARG B 45 -5.663 9.858 41.872 1.00 28.50 C ATOM 2281 C ARG B 45 -5.400 9.380 40.443 1.00 27.88 C ATOM 2282 O ARG B 45 -4.300 9.536 39.921 1.00 27.73 O ATOM 2283 CB ARG B 45 -6.271 11.267 41.898 1.00 29.21 C ATOM 2284 CG ARG B 45 -7.632 11.444 41.215 1.00 32.54 C ATOM 2285 CD ARG B 45 -8.270 12.759 41.673 1.00 38.42 C ATOM 2286 NE ARG B 45 -9.239 13.297 40.711 1.00 41.90 N ATOM 2287 CZ ARG B 45 -10.113 14.267 40.985 1.00 43.72 C ATOM 2288 NH1 ARG B 45 -10.165 14.820 42.200 1.00 44.04 N ATOM 2289 NH2 ARG B 45 -10.950 14.681 40.038 1.00 44.86 N ATOM 2290 HA ARG B 45 -6.376 9.169 42.325 1.00 0.00 H ATOM 2291 HB2 ARG B 45 -6.385 11.558 42.942 1.00 0.00 H ATOM 2292 HB3 ARG B 45 -5.566 11.940 41.409 1.00 0.00 H ATOM 2293 HG2 ARG B 45 -7.496 11.464 40.134 1.00 0.00 H ATOM 2294 HG3 ARG B 45 -8.283 10.612 41.483 1.00 0.00 H ATOM 2295 HD2 ARG B 45 -7.480 13.496 41.818 1.00 0.00 H ATOM 2296 HD3 ARG B 45 -8.781 12.585 42.620 1.00 0.00 H ATOM 2297 HE ARG B 45 -9.245 12.895 39.752 1.00 0.00 H ATOM 2298 HH12 ARG B 45 -10.852 15.575 42.399 1.00 0.00 H ATOM 2299 HH11 ARG B 45 -9.519 14.495 42.947 1.00 0.00 H ATOM 2300 HH22 ARG B 45 -11.635 15.437 40.243 1.00 0.00 H ATOM 2301 HH21 ARG B 45 -10.920 14.249 39.092 1.00 0.00 H ATOM 2302 H ARG B 45 -3.531 10.098 42.125 1.00 0.00 H ATOM 2303 N LEU B 46 -6.398 8.758 39.826 1.00 27.62 N ATOM 2304 CA LEU B 46 -6.304 8.406 38.419 1.00 27.35 C ATOM 2305 C LEU B 46 -7.407 9.128 37.678 1.00 27.11 C ATOM 2306 O LEU B 46 -8.583 9.044 38.063 1.00 27.39 O ATOM 2307 CB LEU B 46 -6.438 6.886 38.186 1.00 27.26 C ATOM 2308 CG LEU B 46 -5.602 5.834 38.931 1.00 27.95 C ATOM 2309 CD1 LEU B 46 -5.919 4.466 38.369 1.00 27.92 C ATOM 2310 CD2 LEU B 46 -4.114 6.081 38.827 1.00 27.82 C ATOM 2311 HA LEU B 46 -5.321 8.702 38.054 1.00 0.00 H ATOM 2312 HB2 LEU B 46 -7.479 6.643 38.398 1.00 0.00 H ATOM 2313 HB3 LEU B 46 -6.238 6.729 37.126 1.00 0.00 H ATOM 2314 HG LEU B 46 -5.865 5.898 39.987 1.00 0.00 H ATOM 2315 HD21 LEU B 46 -3.816 6.060 37.779 1.00 0.00 H ATOM 2316 HD22 LEU B 46 -3.878 7.056 39.254 1.00 0.00 H ATOM 2317 HD23 LEU B 46 -3.579 5.304 39.374 1.00 0.00 H ATOM 2318 HD11 LEU B 46 -6.980 4.256 38.504 1.00 0.00 H ATOM 2319 HD12 LEU B 46 -5.675 4.446 37.307 1.00 0.00 H ATOM 2320 HD13 LEU B 46 -5.329 3.714 38.893 1.00 0.00 H ATOM 2321 H LEU B 46 -7.260 8.519 40.357 1.00 0.00 H ATOM 2322 N ILE B 47 -7.029 9.836 36.621 1.00 26.23 N ATOM 2323 CA ILE B 47 -7.996 10.461 35.724 1.00 26.34 C ATOM 2324 C ILE B 47 -7.928 9.845 34.326 1.00 26.21 C ATOM 2325 O ILE B 47 -6.870 9.390 33.889 1.00 26.01 O ATOM 2326 CB ILE B 47 -7.851 12.025 35.688 1.00 25.83 C ATOM 2327 CG1 ILE B 47 -6.449 12.434 35.238 1.00 25.45 C ATOM 2328 CG2 ILE B 47 -8.228 12.607 37.075 1.00 25.98 C ATOM 2329 CD1 ILE B 47 -6.213 13.937 35.141 1.00 26.88 C ATOM 2330 HA ILE B 47 -8.989 10.257 36.125 1.00 0.00 H ATOM 2331 HB ILE B 47 -8.539 12.442 34.952 1.00 0.00 H ATOM 2332 HG12 ILE B 47 -5.733 12.025 35.950 1.00 0.00 H ATOM 2333 HG13 ILE B 47 -6.270 12.000 34.254 1.00 0.00 H ATOM 2334 HD11 ILE B 47 -6.909 14.367 34.421 1.00 0.00 H ATOM 2335 HD12 ILE B 47 -6.372 14.392 36.119 1.00 0.00 H ATOM 2336 HD13 ILE B 47 -5.190 14.122 34.814 1.00 0.00 H ATOM 2337 HG21 ILE B 47 -9.258 12.341 37.311 1.00 0.00 H ATOM 2338 HG22 ILE B 47 -7.562 12.196 37.833 1.00 0.00 H ATOM 2339 HG23 ILE B 47 -8.128 13.692 37.052 1.00 0.00 H ATOM 2340 H ILE B 47 -6.014 9.949 36.426 1.00 0.00 H ATOM 2341 N GLY B 48 -9.066 9.834 33.640 1.00 26.76 N ATOM 2342 CA GLY B 48 -9.169 9.241 32.311 1.00 27.37 C ATOM 2343 C GLY B 48 -9.518 10.268 31.250 1.00 28.36 C ATOM 2344 O GLY B 48 -10.454 11.063 31.409 1.00 28.76 O ATOM 2345 HA3 GLY B 48 -9.945 8.475 32.327 1.00 0.00 H ATOM 2346 HA2 GLY B 48 -8.213 8.783 32.056 1.00 0.00 H ATOM 2347 H GLY B 48 -9.913 10.263 34.065 1.00 0.00 H ATOM 2348 N GLY B 49 -8.765 10.252 30.160 1.00 28.07 N ATOM 2349 CA GLY B 49 -9.049 11.118 29.036 1.00 27.12 C ATOM 2350 C GLY B 49 -9.124 10.275 27.798 1.00 26.63 C ATOM 2351 O GLY B 49 -9.334 9.058 27.877 1.00 26.91 O ATOM 2352 HA3 GLY B 49 -8.255 11.858 28.931 1.00 0.00 H ATOM 2353 HA2 GLY B 49 -10.000 11.627 29.194 1.00 0.00 H ATOM 2354 H GLY B 49 -7.953 9.604 30.111 1.00 0.00 H ATOM 2355 N ILE B 50 -8.976 10.919 26.641 1.00 26.28 N ATOM 2356 CA ILE B 50 -8.817 10.214 25.371 1.00 25.70 C ATOM 2357 C ILE B 50 -7.474 9.490 25.384 1.00 25.62 C ATOM 2358 O ILE B 50 -6.463 10.045 25.809 1.00 25.18 O ATOM 2359 CB ILE B 50 -8.889 11.176 24.151 1.00 25.80 C ATOM 2360 CG1 ILE B 50 -10.320 11.231 23.604 1.00 25.21 C ATOM 2361 CG2 ILE B 50 -7.952 10.709 23.018 1.00 25.96 C ATOM 2362 CD1 ILE B 50 -10.562 12.320 22.548 1.00 26.19 C ATOM 2363 HA ILE B 50 -9.638 9.505 25.265 1.00 0.00 H ATOM 2364 HB ILE B 50 -8.577 12.163 24.493 1.00 0.00 H ATOM 2365 HG12 ILE B 50 -10.549 10.265 23.155 1.00 0.00 H ATOM 2366 HG13 ILE B 50 -10.996 11.411 24.439 1.00 0.00 H ATOM 2367 HD11 ILE B 50 -10.352 13.298 22.981 1.00 0.00 H ATOM 2368 HD12 ILE B 50 -9.904 12.150 21.695 1.00 0.00 H ATOM 2369 HD13 ILE B 50 -11.601 12.282 22.220 1.00 0.00 H ATOM 2370 HG21 ILE B 50 -6.925 10.686 23.384 1.00 0.00 H ATOM 2371 HG22 ILE B 50 -8.246 9.711 22.693 1.00 0.00 H ATOM 2372 HG23 ILE B 50 -8.025 11.402 22.179 1.00 0.00 H ATOM 2373 H ILE B 50 -8.974 11.959 26.642 1.00 0.00 H ATOM 2374 N GLY B 51 -7.467 8.248 24.920 1.00 25.53 N ATOM 2375 CA GLY B 51 -6.235 7.480 24.880 1.00 25.48 C ATOM 2376 C GLY B 51 -5.991 6.587 26.084 1.00 25.58 C ATOM 2377 O GLY B 51 -5.331 5.554 25.956 1.00 25.21 O ATOM 2378 HA3 GLY B 51 -5.403 8.180 24.805 1.00 0.00 H ATOM 2379 HA2 GLY B 51 -6.259 6.849 23.991 1.00 0.00 H ATOM 2380 H GLY B 51 -8.352 7.820 24.581 1.00 0.00 H ATOM 2381 N GLY B 52 -6.507 6.967 27.253 1.00 25.48 N ATOM 2382 CA GLY B 52 -6.264 6.152 28.449 1.00 25.65 C ATOM 2383 C GLY B 52 -6.261 6.932 29.752 1.00 25.32 C ATOM 2384 O GLY B 52 -6.852 8.008 29.829 1.00 25.56 O ATOM 2385 HA3 GLY B 52 -5.294 5.667 28.340 1.00 0.00 H ATOM 2386 HA2 GLY B 52 -7.044 5.393 28.508 1.00 0.00 H ATOM 2387 H GLY B 52 -7.077 7.834 27.317 1.00 0.00 H ATOM 2388 N PHE B 53 -5.604 6.387 30.776 1.00 25.33 N ATOM 2389 CA PHE B 53 -5.589 7.058 32.071 1.00 25.45 C ATOM 2390 C PHE B 53 -4.190 7.407 32.550 1.00 25.80 C ATOM 2391 O PHE B 53 -3.193 6.757 32.181 1.00 25.61 O ATOM 2392 CB PHE B 53 -6.345 6.255 33.137 1.00 25.41 C ATOM 2393 CG PHE B 53 -5.654 4.992 33.562 1.00 24.99 C ATOM 2394 CD1 PHE B 53 -5.820 3.815 32.842 1.00 24.98 C ATOM 2395 CD2 PHE B 53 -4.849 4.975 34.695 1.00 24.96 C ATOM 2396 CE1 PHE B 53 -5.187 2.637 33.241 1.00 24.68 C ATOM 2397 CE2 PHE B 53 -4.209 3.806 35.099 1.00 25.42 C ATOM 2398 CZ PHE B 53 -4.382 2.634 34.369 1.00 24.52 C ATOM 2399 HA PHE B 53 -6.112 8.002 31.918 1.00 0.00 H ATOM 2400 HB2 PHE B 53 -6.472 6.888 34.016 1.00 0.00 H ATOM 2401 HB3 PHE B 53 -7.324 5.991 32.736 1.00 0.00 H ATOM 2402 HD2 PHE B 53 -4.717 5.889 35.275 1.00 0.00 H ATOM 2403 HE2 PHE B 53 -3.574 3.809 35.985 1.00 0.00 H ATOM 2404 HZ PHE B 53 -3.886 1.716 34.684 1.00 0.00 H ATOM 2405 HE1 PHE B 53 -5.325 1.721 32.667 1.00 0.00 H ATOM 2406 HD1 PHE B 53 -6.453 3.812 31.954 1.00 0.00 H ATOM 2407 H PHE B 53 -5.103 5.484 30.652 1.00 0.00 H ATOM 2408 N VAL B 54 -4.127 8.452 33.371 1.00 25.86 N ATOM 2409 CA VAL B 54 -2.878 8.851 34.009 1.00 26.90 C ATOM 2410 C VAL B 54 -3.029 8.964 35.531 1.00 26.32 C ATOM 2411 O VAL B 54 -4.106 9.293 36.048 1.00 25.36 O ATOM 2412 CB VAL B 54 -2.292 10.172 33.421 1.00 27.45 C ATOM 2413 CG1 VAL B 54 -2.008 10.008 31.929 1.00 28.30 C ATOM 2414 CG2 VAL B 54 -3.215 11.358 33.667 1.00 28.33 C ATOM 2415 HA VAL B 54 -2.165 8.056 33.790 1.00 0.00 H ATOM 2416 HB VAL B 54 -1.355 10.378 33.937 1.00 0.00 H ATOM 2417 HG11 VAL B 54 -1.288 9.203 31.784 1.00 0.00 H ATOM 2418 HG12 VAL B 54 -2.935 9.766 31.408 1.00 0.00 H ATOM 2419 HG13 VAL B 54 -1.600 10.938 31.534 1.00 0.00 H ATOM 2420 HG21 VAL B 54 -4.179 11.170 33.195 1.00 0.00 H ATOM 2421 HG22 VAL B 54 -3.354 11.492 34.740 1.00 0.00 H ATOM 2422 HG23 VAL B 54 -2.770 12.258 33.242 1.00 0.00 H ATOM 2423 H VAL B 54 -4.991 8.998 33.563 1.00 0.00 H ATOM 2424 N ARG B 55 -1.935 8.656 36.224 1.00 26.11 N ATOM 2425 CA ARG B 55 -1.831 8.795 37.666 1.00 25.85 C ATOM 2426 C ARG B 55 -1.457 10.238 37.954 1.00 24.96 C ATOM 2427 O ARG B 55 -0.517 10.766 37.356 1.00 25.25 O ATOM 2428 CB ARG B 55 -0.742 7.875 38.200 1.00 26.13 C ATOM 2429 CG ARG B 55 -1.091 7.171 39.511 1.00 29.06 C ATOM 2430 CD ARG B 55 0.145 6.818 40.348 1.00 31.60 C ATOM 2431 NE ARG B 55 0.889 8.019 40.744 1.00 33.87 N ATOM 2432 CZ ARG B 55 0.405 9.001 41.508 1.00 35.26 C ATOM 2433 NH1 ARG B 55 -0.836 8.943 41.979 1.00 35.74 N ATOM 2434 NH2 ARG B 55 1.160 10.055 41.795 1.00 35.48 N ATOM 2435 HA ARG B 55 -2.774 8.530 38.145 1.00 0.00 H ATOM 2436 HB2 ARG B 55 -0.541 7.113 37.447 1.00 0.00 H ATOM 2437 HB3 ARG B 55 0.157 8.470 38.362 1.00 0.00 H ATOM 2438 HG2 ARG B 55 -1.733 7.828 40.098 1.00 0.00 H ATOM 2439 HG3 ARG B 55 -1.629 6.251 39.280 1.00 0.00 H ATOM 2440 HD2 ARG B 55 0.799 6.174 39.760 1.00 0.00 H ATOM 2441 HD3 ARG B 55 -0.174 6.287 41.245 1.00 0.00 H ATOM 2442 HE ARG B 55 1.867 8.112 40.404 1.00 0.00 H ATOM 2443 HH12 ARG B 55 -1.203 9.713 42.573 1.00 0.00 H ATOM 2444 HH11 ARG B 55 -1.440 8.127 41.753 1.00 0.00 H ATOM 2445 HH22 ARG B 55 0.781 10.819 42.390 1.00 0.00 H ATOM 2446 HH21 ARG B 55 2.130 10.116 41.424 1.00 0.00 H ATOM 2447 H ARG B 55 -1.109 8.296 35.704 1.00 0.00 H ATOM 2448 N VAL B 56 -2.202 10.883 38.846 1.00 23.90 N ATOM 2449 CA VAL B 56 -1.913 12.273 39.218 1.00 22.88 C ATOM 2450 C VAL B 56 -1.864 12.429 40.739 1.00 22.70 C ATOM 2451 O VAL B 56 -2.359 11.573 41.482 1.00 22.30 O ATOM 2452 CB VAL B 56 -2.938 13.278 38.619 1.00 22.87 C ATOM 2453 CG1 VAL B 56 -2.904 13.269 37.072 1.00 21.89 C ATOM 2454 CG2 VAL B 56 -4.344 12.981 39.120 1.00 22.97 C ATOM 2455 HA VAL B 56 -0.936 12.509 38.796 1.00 0.00 H ATOM 2456 HB VAL B 56 -2.652 14.275 38.955 1.00 0.00 H ATOM 2457 HG11 VAL B 56 -1.907 13.547 36.730 1.00 0.00 H ATOM 2458 HG12 VAL B 56 -3.148 12.270 36.710 1.00 0.00 H ATOM 2459 HG13 VAL B 56 -3.633 13.983 36.690 1.00 0.00 H ATOM 2460 HG21 VAL B 56 -4.628 11.971 38.824 1.00 0.00 H ATOM 2461 HG22 VAL B 56 -4.366 13.062 40.207 1.00 0.00 H ATOM 2462 HG23 VAL B 56 -5.042 13.698 38.687 1.00 0.00 H ATOM 2463 H VAL B 56 -3.005 10.393 39.289 1.00 0.00 H ATOM 2464 N ARG B 57 -1.247 13.515 41.195 1.00 22.25 N ATOM 2465 CA ARG B 57 -1.290 13.885 42.602 1.00 21.79 C ATOM 2466 C ARG B 57 -2.386 14.921 42.751 1.00 21.83 C ATOM 2467 O ARG B 57 -2.423 15.905 42.005 1.00 21.17 O ATOM 2468 CB ARG B 57 0.042 14.499 43.056 1.00 22.32 C ATOM 2469 CG ARG B 57 1.225 13.555 43.033 1.00 23.26 C ATOM 2470 CD ARG B 57 2.483 14.325 43.364 1.00 26.16 C ATOM 2471 NE ARG B 57 3.599 13.438 43.686 1.00 28.95 N ATOM 2472 CZ ARG B 57 4.712 13.837 44.298 1.00 29.60 C ATOM 2473 NH1 ARG B 57 4.862 15.108 44.662 1.00 30.32 N ATOM 2474 NH2 ARG B 57 5.676 12.966 44.551 1.00 30.53 N ATOM 2475 HA ARG B 57 -1.475 13.001 43.212 1.00 0.00 H ATOM 2476 HB2 ARG B 57 0.268 15.340 42.400 1.00 0.00 H ATOM 2477 HB3 ARG B 57 -0.083 14.860 44.077 1.00 0.00 H ATOM 2478 HG2 ARG B 57 1.076 12.766 43.770 1.00 0.00 H ATOM 2479 HG3 ARG B 57 1.319 13.112 42.042 1.00 0.00 H ATOM 2480 HD2 ARG B 57 2.286 14.969 44.221 1.00 0.00 H ATOM 2481 HD3 ARG B 57 2.757 14.938 42.505 1.00 0.00 H ATOM 2482 HE ARG B 57 3.519 12.435 43.421 1.00 0.00 H ATOM 2483 HH12 ARG B 57 5.734 15.413 45.140 1.00 0.00 H ATOM 2484 HH11 ARG B 57 4.107 15.797 44.469 1.00 0.00 H ATOM 2485 HH22 ARG B 57 6.546 13.277 45.029 1.00 0.00 H ATOM 2486 HH21 ARG B 57 5.564 11.970 44.272 1.00 0.00 H ATOM 2487 H ARG B 57 -0.720 14.116 40.529 1.00 0.00 H ATOM 2488 N GLN B 58 -3.281 14.713 43.707 1.00 21.14 N ATOM 2489 CA GLN B 58 -4.302 15.707 43.969 1.00 21.13 C ATOM 2490 C GLN B 58 -3.891 16.636 45.107 1.00 21.03 C ATOM 2491 O GLN B 58 -3.707 16.194 46.252 1.00 20.05 O ATOM 2492 CB GLN B 58 -5.635 15.056 44.288 1.00 21.41 C ATOM 2493 CG GLN B 58 -6.708 16.065 44.653 1.00 22.00 C ATOM 2494 CD GLN B 58 -8.010 15.419 45.054 1.00 22.29 C ATOM 2495 OE1 GLN B 58 -8.508 14.521 44.372 1.00 24.49 O ATOM 2496 NE2 GLN B 58 -8.578 15.879 46.159 1.00 23.09 N ATOM 2497 HA GLN B 58 -4.414 16.300 43.061 1.00 0.00 H ATOM 2498 HB2 GLN B 58 -5.967 14.494 43.415 1.00 0.00 H ATOM 2499 HB3 GLN B 58 -5.498 14.374 45.127 1.00 0.00 H ATOM 2500 HG2 GLN B 58 -6.348 16.669 45.486 1.00 0.00 H ATOM 2501 HG3 GLN B 58 -6.889 16.707 43.791 1.00 0.00 H ATOM 2502 HE22 GLN B 58 -8.120 16.639 46.702 1.00 0.00 H ATOM 2503 HE21 GLN B 58 -9.482 15.481 46.484 1.00 0.00 H ATOM 2504 H GLN B 58 -3.250 13.838 44.268 1.00 0.00 H ATOM 2505 N TYR B 59 -3.765 17.920 44.788 1.00 20.93 N ATOM 2506 CA TYR B 59 -3.510 18.941 45.797 1.00 21.59 C ATOM 2507 C TYR B 59 -4.747 19.799 45.980 1.00 22.17 C ATOM 2508 O TYR B 59 -5.331 20.257 45.006 1.00 22.20 O ATOM 2509 CB TYR B 59 -2.353 19.831 45.374 1.00 21.35 C ATOM 2510 CG TYR B 59 -1.000 19.175 45.424 1.00 21.00 C ATOM 2511 CD1 TYR B 59 -0.215 19.244 46.578 1.00 19.92 C ATOM 2512 CD2 TYR B 59 -0.487 18.517 44.309 1.00 20.33 C ATOM 2513 CE1 TYR B 59 1.036 18.663 46.621 1.00 20.71 C ATOM 2514 CE2 TYR B 59 0.765 17.932 44.348 1.00 18.99 C ATOM 2515 CZ TYR B 59 1.519 18.027 45.504 1.00 21.05 C ATOM 2516 OH TYR B 59 2.751 17.458 45.541 1.00 22.97 O ATOM 2517 HA TYR B 59 -3.257 18.444 46.734 1.00 0.00 H ATOM 2518 HB3 TYR B 59 -2.334 20.699 46.033 1.00 0.00 H ATOM 2519 HB2 TYR B 59 -2.534 20.158 44.350 1.00 0.00 H ATOM 2520 HD2 TYR B 59 -1.079 18.463 43.395 1.00 0.00 H ATOM 2521 HE2 TYR B 59 1.153 17.402 43.478 1.00 0.00 H ATOM 2522 HE1 TYR B 59 1.634 18.708 47.531 1.00 0.00 H ATOM 2523 HD1 TYR B 59 -0.596 19.764 47.457 1.00 0.00 H ATOM 2524 HH TYR B 59 3.321 17.863 44.840 1.00 0.00 H ATOM 2525 H TYR B 59 -3.851 18.204 43.791 1.00 0.00 H ATOM 2526 N ASP B 60 -5.144 20.017 47.228 1.00 22.52 N ATOM 2527 CA ASP B 60 -6.300 20.863 47.516 1.00 23.34 C ATOM 2528 C ASP B 60 -5.910 22.286 47.919 1.00 23.61 C ATOM 2529 O ASP B 60 -4.781 22.542 48.369 1.00 24.02 O ATOM 2530 CB ASP B 60 -7.180 20.222 48.598 1.00 23.70 C ATOM 2531 CG ASP B 60 -7.808 18.918 48.143 1.00 24.67 C ATOM 2532 OD1 ASP B 60 -8.100 18.777 46.939 1.00 27.62 O ATOM 2533 OD2 ASP B 60 -8.015 18.031 48.997 1.00 27.10 O ATOM 2534 HA ASP B 60 -6.868 20.943 46.589 1.00 0.00 H ATOM 2535 HB2 ASP B 60 -6.566 20.026 49.477 1.00 0.00 H ATOM 2536 HB3 ASP B 60 -7.975 20.920 48.860 1.00 0.00 H ATOM 2537 H ASP B 60 -4.623 19.578 48.014 1.00 0.00 H ATOM 2538 N GLN B 61 -6.873 23.196 47.772 1.00 23.84 N ATOM 2539 CA GLN B 61 -6.736 24.596 48.163 1.00 24.13 C ATOM 2540 C GLN B 61 -5.441 25.246 47.662 1.00 24.03 C ATOM 2541 O GLN B 61 -4.694 25.864 48.427 1.00 23.66 O ATOM 2542 CB GLN B 61 -6.913 24.753 49.680 1.00 24.62 C ATOM 2543 CG GLN B 61 -8.336 24.468 50.145 1.00 26.27 C ATOM 2544 CD GLN B 61 -8.473 24.387 51.657 1.00 27.78 C ATOM 2545 OE1 GLN B 61 -9.357 23.701 52.165 1.00 29.15 O ATOM 2546 NE2 GLN B 61 -7.603 25.088 52.383 1.00 28.88 N ATOM 2547 HA GLN B 61 -7.538 25.142 47.666 1.00 0.00 H ATOM 2548 HB2 GLN B 61 -6.238 24.061 50.183 1.00 0.00 H ATOM 2549 HB3 GLN B 61 -6.655 25.775 49.956 1.00 0.00 H ATOM 2550 HG2 GLN B 61 -8.985 25.265 49.781 1.00 0.00 H ATOM 2551 HG3 GLN B 61 -8.656 23.518 49.718 1.00 0.00 H ATOM 2552 HE22 GLN B 61 -6.870 25.656 51.911 1.00 0.00 H ATOM 2553 HE21 GLN B 61 -7.657 25.068 53.421 1.00 0.00 H ATOM 2554 H GLN B 61 -7.775 22.891 47.354 1.00 0.00 H ATOM 2555 N VAL B 62 -5.197 25.092 46.362 1.00 23.88 N ATOM 2556 CA VAL B 62 -4.079 25.732 45.702 1.00 24.04 C ATOM 2557 C VAL B 62 -4.571 27.087 45.192 1.00 24.47 C ATOM 2558 O VAL B 62 -5.556 27.154 44.441 1.00 24.16 O ATOM 2559 CB VAL B 62 -3.556 24.900 44.504 1.00 23.62 C ATOM 2560 CG1 VAL B 62 -2.327 25.542 43.915 1.00 22.97 C ATOM 2561 CG2 VAL B 62 -3.275 23.448 44.908 1.00 23.98 C ATOM 2562 HA VAL B 62 -3.256 25.833 46.410 1.00 0.00 H ATOM 2563 HB VAL B 62 -4.336 24.881 43.743 1.00 0.00 H ATOM 2564 HG11 VAL B 62 -2.573 26.546 43.570 1.00 0.00 H ATOM 2565 HG12 VAL B 62 -1.548 25.598 44.676 1.00 0.00 H ATOM 2566 HG13 VAL B 62 -1.974 24.944 43.075 1.00 0.00 H ATOM 2567 HG21 VAL B 62 -2.522 23.431 45.696 1.00 0.00 H ATOM 2568 HG22 VAL B 62 -4.194 22.989 45.272 1.00 0.00 H ATOM 2569 HG23 VAL B 62 -2.910 22.895 44.042 1.00 0.00 H ATOM 2570 H VAL B 62 -5.833 24.490 45.801 1.00 0.00 H ATOM 2571 N PRO B 63 -3.916 28.176 45.622 1.00 25.36 N ATOM 2572 CA PRO B 63 -4.257 29.451 44.987 1.00 25.53 C ATOM 2573 C PRO B 63 -3.740 29.570 43.559 1.00 25.56 C ATOM 2574 O PRO B 63 -2.615 29.127 43.247 1.00 25.89 O ATOM 2575 CB PRO B 63 -3.634 30.506 45.926 1.00 25.63 C ATOM 2576 CG PRO B 63 -3.272 29.739 47.201 1.00 25.97 C ATOM 2577 CD PRO B 63 -2.946 28.351 46.718 1.00 25.78 C ATOM 2578 HA PRO B 63 -5.334 29.571 44.872 1.00 0.00 H ATOM 2579 HD3 PRO B 63 -1.920 28.288 46.354 1.00 0.00 H ATOM 2580 HD2 PRO B 63 -3.098 27.611 47.504 1.00 0.00 H ATOM 2581 HG3 PRO B 63 -4.114 29.720 47.893 1.00 0.00 H ATOM 2582 HG2 PRO B 63 -2.410 30.190 47.692 1.00 0.00 H ATOM 2583 HB2 PRO B 63 -2.743 30.942 45.475 1.00 0.00 H ATOM 2584 HB3 PRO B 63 -4.352 31.296 46.145 1.00 0.00 H ATOM 2585 N ILE B 64 -4.578 30.135 42.689 1.00 25.00 N ATOM 2586 CA ILE B 64 -4.243 30.310 41.281 1.00 24.86 C ATOM 2587 C ILE B 64 -4.582 31.737 40.908 1.00 25.06 C ATOM 2588 O ILE B 64 -5.685 32.214 41.203 1.00 25.02 O ATOM 2589 CB ILE B 64 -5.085 29.360 40.372 1.00 25.08 C ATOM 2590 CG1 ILE B 64 -4.917 27.899 40.812 1.00 25.86 C ATOM 2591 CG2 ILE B 64 -4.730 29.558 38.904 1.00 23.86 C ATOM 2592 CD1 ILE B 64 -5.768 26.905 39.983 1.00 27.68 C ATOM 2593 HA ILE B 64 -3.187 30.082 41.135 1.00 0.00 H ATOM 2594 HB ILE B 64 -6.139 29.615 40.485 1.00 0.00 H ATOM 2595 HG12 ILE B 64 -3.867 27.625 40.709 1.00 0.00 H ATOM 2596 HG13 ILE B 64 -5.211 27.817 41.858 1.00 0.00 H ATOM 2597 HD11 ILE B 64 -6.823 27.159 40.085 1.00 0.00 H ATOM 2598 HD12 ILE B 64 -5.478 26.967 38.934 1.00 0.00 H ATOM 2599 HD13 ILE B 64 -5.600 25.892 40.348 1.00 0.00 H ATOM 2600 HG21 ILE B 64 -4.934 30.590 38.618 1.00 0.00 H ATOM 2601 HG22 ILE B 64 -3.672 29.341 38.755 1.00 0.00 H ATOM 2602 HG23 ILE B 64 -5.330 28.885 38.292 1.00 0.00 H ATOM 2603 H ILE B 64 -5.505 30.463 43.028 1.00 0.00 H ATOM 2604 N GLU B 65 -3.644 32.404 40.242 1.00 25.18 N ATOM 2605 CA GLU B 65 -3.902 33.735 39.663 1.00 25.69 C ATOM 2606 C GLU B 65 -4.100 33.599 38.184 1.00 25.95 C ATOM 2607 O GLU B 65 -3.232 33.082 37.472 1.00 26.04 O ATOM 2608 CB GLU B 65 -2.760 34.701 39.957 1.00 24.68 C ATOM 2609 CG GLU B 65 -2.618 34.999 41.434 1.00 24.86 C ATOM 2610 CD GLU B 65 -1.431 35.869 41.769 1.00 21.92 C ATOM 2611 OE1 GLU B 65 -0.806 36.431 40.849 1.00 20.07 O ATOM 2612 OE2 GLU B 65 -1.134 35.986 42.972 1.00 20.14 O ATOM 2613 HA GLU B 65 -4.803 34.144 40.120 1.00 0.00 H ATOM 2614 HB2 GLU B 65 -1.829 34.262 39.598 1.00 0.00 H ATOM 2615 HB3 GLU B 65 -2.947 35.635 39.428 1.00 0.00 H ATOM 2616 HG2 GLU B 65 -3.522 35.506 41.771 1.00 0.00 H ATOM 2617 HG3 GLU B 65 -2.513 34.054 41.967 1.00 0.00 H ATOM 2618 H GLU B 65 -2.704 31.975 40.127 1.00 0.00 H ATOM 2619 N ILE B 66 -5.263 34.057 37.718 1.00 27.57 N ATOM 2620 CA ILE B 66 -5.710 33.817 36.366 1.00 28.94 C ATOM 2621 C ILE B 66 -6.717 34.916 35.979 1.00 30.50 C ATOM 2622 O ILE B 66 -7.631 35.232 36.751 1.00 29.99 O ATOM 2623 CB ILE B 66 -6.346 32.392 36.233 1.00 29.69 C ATOM 2624 CG1 ILE B 66 -6.908 32.172 34.833 1.00 29.66 C ATOM 2625 CG2 ILE B 66 -7.418 32.165 37.327 1.00 30.16 C ATOM 2626 CD1 ILE B 66 -7.385 30.727 34.555 1.00 30.20 C ATOM 2627 HA ILE B 66 -4.859 33.851 35.686 1.00 0.00 H ATOM 2628 HB ILE B 66 -5.562 31.651 36.385 1.00 0.00 H ATOM 2629 HG12 ILE B 66 -7.756 32.843 34.696 1.00 0.00 H ATOM 2630 HG13 ILE B 66 -6.130 32.419 34.110 1.00 0.00 H ATOM 2631 HD11 ILE B 66 -6.547 30.040 34.673 1.00 0.00 H ATOM 2632 HD12 ILE B 66 -8.174 30.464 35.260 1.00 0.00 H ATOM 2633 HD13 ILE B 66 -7.769 30.662 33.537 1.00 0.00 H ATOM 2634 HG21 ILE B 66 -6.956 32.254 38.310 1.00 0.00 H ATOM 2635 HG22 ILE B 66 -8.204 32.913 37.224 1.00 0.00 H ATOM 2636 HG23 ILE B 66 -7.845 31.169 37.214 1.00 0.00 H ATOM 2637 H ILE B 66 -5.873 34.609 38.354 1.00 0.00 H ATOM 2638 N CYS B 67 -6.492 35.500 34.807 1.00 31.96 N ATOM 2639 CA CYS B 67 -7.439 36.445 34.202 1.00 32.61 C ATOM 2640 C CYS B 67 -7.860 37.576 35.160 1.00 33.78 C ATOM 2641 O CYS B 67 -9.068 37.888 35.249 1.00 34.38 O ATOM 2642 CB CYS B 67 -8.693 35.707 33.700 1.00 32.67 C ATOM 2643 SG CYS B 67 -8.503 34.368 32.452 1.00 30.78 S ATOM 2644 HA CYS B 67 -6.915 36.905 33.365 1.00 0.00 H ATOM 2645 HB2 CYS B 67 -9.353 36.458 33.265 1.00 0.00 H ATOM 2646 HB3 CYS B 67 -9.174 35.265 34.572 1.00 0.00 H ATOM 2647 HG CYS B 67 -7.925 34.884 31.310 1.00 0.00 H ATOM 2648 H CYS B 67 -5.612 35.279 34.299 1.00 0.00 H ATOM 2649 N GLY B 68 -6.892 38.170 35.859 1.00 33.75 N ATOM 2650 CA GLY B 68 -7.145 39.265 36.802 1.00 34.99 C ATOM 2651 C GLY B 68 -7.810 38.834 38.096 1.00 35.01 C ATOM 2652 O GLY B 68 -8.152 39.675 38.933 1.00 35.38 O ATOM 2653 HA3 GLY B 68 -7.790 39.995 36.313 1.00 0.00 H ATOM 2654 HA2 GLY B 68 -6.191 39.732 37.047 1.00 0.00 H ATOM 2655 H GLY B 68 -5.914 37.842 35.730 1.00 0.00 H ATOM 2656 N HIS B 69 -7.984 37.523 38.258 1.00 34.87 N ATOM 2657 CA HIS B 69 -8.691 36.961 39.398 1.00 34.49 C ATOM 2658 C HIS B 69 -7.729 36.096 40.191 1.00 33.21 C ATOM 2659 O HIS B 69 -6.889 35.431 39.625 1.00 33.46 O ATOM 2660 CB HIS B 69 -9.861 36.084 38.924 1.00 35.05 C ATOM 2661 CG HIS B 69 -10.965 36.827 38.227 1.00 37.25 C ATOM 2662 ND1 HIS B 69 -10.742 37.710 37.191 1.00 39.03 N ATOM 2663 CD2 HIS B 69 -12.311 36.766 38.383 1.00 38.82 C ATOM 2664 CE1 HIS B 69 -11.897 38.190 36.764 1.00 40.01 C ATOM 2665 NE2 HIS B 69 -12.867 37.632 37.469 1.00 40.62 N ATOM 2666 HA HIS B 69 -9.078 37.774 40.012 1.00 0.00 H ATOM 2667 HB2 HIS B 69 -9.467 35.337 38.235 1.00 0.00 H ATOM 2668 HB3 HIS B 69 -10.285 35.585 39.795 1.00 0.00 H ATOM 2669 HD2 HIS B 69 -12.852 36.147 39.099 1.00 0.00 H ATOM 2670 HE1 HIS B 69 -12.028 38.921 35.966 1.00 0.00 H ATOM 2671 H HIS B 69 -7.599 36.876 37.541 1.00 0.00 H ATOM 2672 N LYS B 70 -7.856 36.108 41.504 1.00 33.22 N ATOM 2673 CA LYS B 70 -7.183 35.118 42.332 1.00 32.68 C ATOM 2674 C LYS B 70 -8.271 34.163 42.761 1.00 32.18 C ATOM 2675 O LYS B 70 -9.333 34.587 43.223 1.00 31.72 O ATOM 2676 CB LYS B 70 -6.516 35.759 43.551 1.00 32.77 C ATOM 2677 CG LYS B 70 -5.339 36.656 43.225 1.00 34.31 C ATOM 2678 CD LYS B 70 -5.050 37.596 44.389 1.00 36.57 C ATOM 2679 CE LYS B 70 -4.162 38.767 43.975 1.00 39.38 C ATOM 2680 NZ LYS B 70 -2.703 38.489 44.165 1.00 40.42 N ATOM 2681 HA LYS B 70 -6.384 34.619 41.784 1.00 0.00 H ATOM 2682 HB2 LYS B 70 -7.264 36.355 44.074 1.00 0.00 H ATOM 2683 HB3 LYS B 70 -6.165 34.961 44.206 1.00 0.00 H ATOM 2684 HG2 LYS B 70 -4.460 36.040 43.033 1.00 0.00 H ATOM 2685 HG3 LYS B 70 -5.570 37.244 42.337 1.00 0.00 H ATOM 2686 HD2 LYS B 70 -5.994 37.987 44.768 1.00 0.00 H ATOM 2687 HD3 LYS B 70 -4.548 37.035 45.178 1.00 0.00 H ATOM 2688 HE2 LYS B 70 -4.431 39.637 44.574 1.00 0.00 H ATOM 2689 HE3 LYS B 70 -4.341 38.984 42.922 1.00 0.00 H ATOM 2690 HZ1 LYS B 70 -2.517 38.290 45.169 1.00 0.00 H ATOM 2691 HZ2 LYS B 70 -2.430 37.666 43.591 1.00 0.00 H ATOM 2692 HZ3 LYS B 70 -2.152 39.319 43.867 1.00 0.00 H ATOM 2693 H LYS B 70 -8.446 36.836 41.955 1.00 0.00 H ATOM 2694 N VAL B 71 -8.025 32.874 42.558 1.00 31.64 N ATOM 2695 CA VAL B 71 -8.969 31.838 42.939 1.00 31.78 C ATOM 2696 C VAL B 71 -8.184 30.768 43.703 1.00 31.93 C ATOM 2697 O VAL B 71 -6.956 30.758 43.688 1.00 32.13 O ATOM 2698 CB VAL B 71 -9.729 31.233 41.713 1.00 31.78 C ATOM 2699 CG1 VAL B 71 -10.493 32.310 40.939 1.00 32.06 C ATOM 2700 CG2 VAL B 71 -8.788 30.483 40.778 1.00 31.85 C ATOM 2701 HA VAL B 71 -9.748 32.267 43.569 1.00 0.00 H ATOM 2702 HB VAL B 71 -10.450 30.520 42.113 1.00 0.00 H ATOM 2703 HG11 VAL B 71 -11.221 32.782 41.598 1.00 0.00 H ATOM 2704 HG12 VAL B 71 -9.791 33.060 40.575 1.00 0.00 H ATOM 2705 HG13 VAL B 71 -11.008 31.852 40.095 1.00 0.00 H ATOM 2706 HG21 VAL B 71 -8.026 31.168 40.405 1.00 0.00 H ATOM 2707 HG22 VAL B 71 -8.311 29.668 41.322 1.00 0.00 H ATOM 2708 HG23 VAL B 71 -9.356 30.079 39.940 1.00 0.00 H ATOM 2709 H VAL B 71 -7.127 32.597 42.112 1.00 0.00 H ATOM 2710 N ILE B 72 -8.891 29.891 44.393 1.00 32.03 N ATOM 2711 CA ILE B 72 -8.244 28.810 45.125 1.00 32.16 C ATOM 2712 C ILE B 72 -8.966 27.514 44.780 1.00 32.19 C ATOM 2713 O ILE B 72 -10.185 27.422 44.938 1.00 32.83 O ATOM 2714 CB ILE B 72 -8.257 29.065 46.667 1.00 32.08 C ATOM 2715 CG1 ILE B 72 -7.418 28.023 47.391 1.00 31.97 C ATOM 2716 CG2 ILE B 72 -9.678 29.065 47.224 1.00 32.56 C ATOM 2717 CD1 ILE B 72 -6.869 28.480 48.709 1.00 33.18 C ATOM 2718 HA ILE B 72 -7.196 28.749 44.833 1.00 0.00 H ATOM 2719 HB ILE B 72 -7.825 30.051 46.836 1.00 0.00 H ATOM 2720 HG12 ILE B 72 -8.040 27.145 47.566 1.00 0.00 H ATOM 2721 HG13 ILE B 72 -6.581 27.751 46.748 1.00 0.00 H ATOM 2722 HD11 ILE B 72 -6.232 29.351 48.554 1.00 0.00 H ATOM 2723 HD12 ILE B 72 -7.693 28.744 49.372 1.00 0.00 H ATOM 2724 HD13 ILE B 72 -6.284 27.676 49.156 1.00 0.00 H ATOM 2725 HG21 ILE B 72 -10.257 29.851 46.740 1.00 0.00 H ATOM 2726 HG22 ILE B 72 -10.143 28.098 47.030 1.00 0.00 H ATOM 2727 HG23 ILE B 72 -9.646 29.245 48.298 1.00 0.00 H ATOM 2728 H ILE B 72 -9.927 29.974 44.414 1.00 0.00 H ATOM 2729 N ASP B 73 -8.233 26.516 44.295 1.00 31.97 N ATOM 2730 CA ASP B 73 -8.869 25.228 44.021 1.00 31.39 C ATOM 2731 C ASP B 73 -7.932 24.031 43.982 1.00 30.13 C ATOM 2732 O ASP B 73 -6.740 24.141 44.257 1.00 30.16 O ATOM 2733 CB ASP B 73 -9.679 25.279 42.731 1.00 31.91 C ATOM 2734 CG ASP B 73 -11.028 24.569 42.868 1.00 33.91 C ATOM 2735 OD1 ASP B 73 -11.061 23.351 43.185 1.00 32.66 O ATOM 2736 OD2 ASP B 73 -12.066 25.238 42.653 1.00 38.23 O ATOM 2737 HA ASP B 73 -9.521 25.069 44.880 1.00 0.00 H ATOM 2738 HB2 ASP B 73 -9.856 26.322 42.468 1.00 0.00 H ATOM 2739 HB3 ASP B 73 -9.107 24.797 41.938 1.00 0.00 H ATOM 2740 H ASP B 73 -7.218 26.650 44.112 1.00 0.00 H ATOM 2741 N THR B 74 -8.507 22.893 43.626 1.00 29.23 N ATOM 2742 CA THR B 74 -7.797 21.630 43.521 1.00 27.94 C ATOM 2743 C THR B 74 -7.077 21.555 42.184 1.00 26.68 C ATOM 2744 O THR B 74 -7.662 21.807 41.124 1.00 26.02 O ATOM 2745 CB THR B 74 -8.774 20.445 43.652 1.00 28.26 C ATOM 2746 OG1 THR B 74 -9.300 20.418 44.983 1.00 29.80 O ATOM 2747 CG2 THR B 74 -8.090 19.109 43.360 1.00 28.65 C ATOM 2748 HA THR B 74 -7.069 21.572 44.331 1.00 0.00 H ATOM 2749 HB THR B 74 -9.571 20.583 42.922 1.00 0.00 H ATOM 2750 HG1 THR B 74 -8.557 20.311 45.628 1.00 0.00 H ATOM 2751 HG23 THR B 74 -7.687 19.122 42.347 1.00 0.00 H ATOM 2752 HG21 THR B 74 -7.280 18.953 44.073 1.00 0.00 H ATOM 2753 HG22 THR B 74 -8.817 18.302 43.452 1.00 0.00 H ATOM 2754 H THR B 74 -9.524 22.904 43.409 1.00 0.00 H ATOM 2755 N VAL B 75 -5.797 21.227 42.262 1.00 24.81 N ATOM 2756 CA VAL B 75 -4.965 21.083 41.088 1.00 23.46 C ATOM 2757 C VAL B 75 -4.404 19.680 41.086 1.00 23.17 C ATOM 2758 O VAL B 75 -3.868 19.206 42.099 1.00 22.57 O ATOM 2759 CB VAL B 75 -3.807 22.129 41.109 1.00 23.44 C ATOM 2760 CG1 VAL B 75 -2.887 21.926 39.928 1.00 22.78 C ATOM 2761 CG2 VAL B 75 -4.387 23.555 41.111 1.00 23.37 C ATOM 2762 HA VAL B 75 -5.553 21.257 40.187 1.00 0.00 H ATOM 2763 HB VAL B 75 -3.223 21.990 42.019 1.00 0.00 H ATOM 2764 HG11 VAL B 75 -2.460 20.924 39.970 1.00 0.00 H ATOM 2765 HG12 VAL B 75 -3.453 22.043 39.004 1.00 0.00 H ATOM 2766 HG13 VAL B 75 -2.087 22.665 39.961 1.00 0.00 H ATOM 2767 HG21 VAL B 75 -4.989 23.702 40.214 1.00 0.00 H ATOM 2768 HG22 VAL B 75 -5.011 23.691 41.995 1.00 0.00 H ATOM 2769 HG23 VAL B 75 -3.571 24.278 41.126 1.00 0.00 H ATOM 2770 H VAL B 75 -5.375 21.067 43.199 1.00 0.00 H ATOM 2771 N LEU B 76 -4.570 19.000 39.957 1.00 22.38 N ATOM 2772 CA LEU B 76 -3.979 17.690 39.758 1.00 22.41 C ATOM 2773 C LEU B 76 -2.634 17.861 39.054 1.00 22.40 C ATOM 2774 O LEU B 76 -2.513 18.646 38.109 1.00 23.16 O ATOM 2775 CB LEU B 76 -4.926 16.837 38.905 1.00 21.49 C ATOM 2776 CG LEU B 76 -6.083 16.040 39.513 1.00 25.34 C ATOM 2777 CD1 LEU B 76 -6.582 16.401 40.958 1.00 24.12 C ATOM 2778 CD2 LEU B 76 -7.242 15.944 38.502 1.00 23.72 C ATOM 2779 HA LEU B 76 -3.822 17.191 40.714 1.00 0.00 H ATOM 2780 HB2 LEU B 76 -5.373 17.515 38.178 1.00 0.00 H ATOM 2781 HB3 LEU B 76 -4.298 16.113 38.386 1.00 0.00 H ATOM 2782 HG LEU B 76 -5.637 15.063 39.702 1.00 0.00 H ATOM 2783 HD21 LEU B 76 -7.588 16.947 38.251 1.00 0.00 H ATOM 2784 HD22 LEU B 76 -6.894 15.442 37.599 1.00 0.00 H ATOM 2785 HD23 LEU B 76 -8.061 15.375 38.943 1.00 0.00 H ATOM 2786 HD11 LEU B 76 -5.762 16.276 41.666 1.00 0.00 H ATOM 2787 HD12 LEU B 76 -6.924 17.436 40.975 1.00 0.00 H ATOM 2788 HD13 LEU B 76 -7.404 15.741 41.233 1.00 0.00 H ATOM 2789 H LEU B 76 -5.140 19.418 39.194 1.00 0.00 H ATOM 2790 N VAL B 77 -1.623 17.149 39.531 1.00 22.64 N ATOM 2791 CA VAL B 77 -0.313 17.230 38.933 1.00 23.16 C ATOM 2792 C VAL B 77 0.110 15.860 38.409 1.00 23.37 C ATOM 2793 O VAL B 77 0.182 14.873 39.150 1.00 23.62 O ATOM 2794 CB VAL B 77 0.726 17.780 39.916 1.00 23.08 C ATOM 2795 CG1 VAL B 77 2.092 17.843 39.249 1.00 25.04 C ATOM 2796 CG2 VAL B 77 0.304 19.148 40.431 1.00 22.82 C ATOM 2797 HA VAL B 77 -0.368 17.927 38.097 1.00 0.00 H ATOM 2798 HB VAL B 77 0.792 17.108 40.772 1.00 0.00 H ATOM 2799 HG11 VAL B 77 2.389 16.842 38.936 1.00 0.00 H ATOM 2800 HG12 VAL B 77 2.040 18.497 38.378 1.00 0.00 H ATOM 2801 HG13 VAL B 77 2.823 18.235 39.956 1.00 0.00 H ATOM 2802 HG21 VAL B 77 0.211 19.838 39.592 1.00 0.00 H ATOM 2803 HG22 VAL B 77 -0.655 19.063 40.941 1.00 0.00 H ATOM 2804 HG23 VAL B 77 1.055 19.520 41.127 1.00 0.00 H ATOM 2805 H VAL B 77 -1.776 16.523 40.348 1.00 0.00 H ATOM 2806 N GLY B 78 0.396 15.802 37.120 1.00 24.08 N ATOM 2807 CA GLY B 78 0.731 14.526 36.501 1.00 26.49 C ATOM 2808 C GLY B 78 0.963 14.718 35.024 1.00 28.13 C ATOM 2809 O GLY B 78 0.805 15.844 34.509 1.00 28.44 O ATOM 2810 HA3 GLY B 78 -0.090 13.825 36.650 1.00 0.00 H ATOM 2811 HA2 GLY B 78 1.635 14.127 36.961 1.00 0.00 H ATOM 2812 H GLY B 78 0.382 16.669 36.546 1.00 0.00 H ATOM 2813 N PRO B 79 1.323 13.627 34.334 1.00 29.38 N ATOM 2814 CA PRO B 79 1.593 13.693 32.908 1.00 30.40 C ATOM 2815 C PRO B 79 0.367 14.161 32.114 1.00 30.75 C ATOM 2816 O PRO B 79 -0.691 13.554 32.175 1.00 32.00 O ATOM 2817 CB PRO B 79 1.988 12.251 32.554 1.00 30.71 C ATOM 2818 CG PRO B 79 1.451 11.406 33.655 1.00 30.36 C ATOM 2819 CD PRO B 79 1.496 12.261 34.870 1.00 29.54 C ATOM 2820 HA PRO B 79 2.369 14.417 32.659 1.00 0.00 H ATOM 2821 HD3 PRO B 79 0.689 12.006 35.557 1.00 0.00 H ATOM 2822 HD2 PRO B 79 2.453 12.161 35.382 1.00 0.00 H ATOM 2823 HG3 PRO B 79 2.069 10.518 33.790 1.00 0.00 H ATOM 2824 HG2 PRO B 79 0.426 11.104 33.439 1.00 0.00 H ATOM 2825 HB2 PRO B 79 1.548 11.959 31.601 1.00 0.00 H ATOM 2826 HB3 PRO B 79 3.072 12.157 32.496 1.00 0.00 H ATOM 2827 N THR B 80 0.509 15.274 31.419 1.00 30.73 N ATOM 2828 CA THR B 80 -0.496 15.722 30.467 1.00 30.26 C ATOM 2829 C THR B 80 0.261 16.489 29.386 1.00 30.63 C ATOM 2830 O THR B 80 1.211 17.206 29.691 1.00 31.06 O ATOM 2831 CB THR B 80 -1.616 16.607 31.129 1.00 30.45 C ATOM 2832 OG1 THR B 80 -2.481 17.120 30.114 1.00 27.37 O ATOM 2833 CG2 THR B 80 -1.037 17.794 31.917 1.00 29.96 C ATOM 2834 HA THR B 80 -1.032 14.868 30.053 1.00 0.00 H ATOM 2835 HB THR B 80 -2.159 15.968 31.825 1.00 0.00 H ATOM 2836 HG1 THR B 80 -1.955 17.671 29.482 1.00 0.00 H ATOM 2837 HG23 THR B 80 -0.373 17.421 32.697 1.00 0.00 H ATOM 2838 HG21 THR B 80 -0.477 18.440 31.240 1.00 0.00 H ATOM 2839 HG22 THR B 80 -1.851 18.359 32.370 1.00 0.00 H ATOM 2840 H THR B 80 1.365 15.848 31.556 1.00 0.00 H ATOM 2841 N PRO B 81 -0.128 16.314 28.118 1.00 30.52 N ATOM 2842 CA PRO B 81 0.560 17.028 27.051 1.00 30.25 C ATOM 2843 C PRO B 81 0.339 18.524 27.094 1.00 29.48 C ATOM 2844 O PRO B 81 1.120 19.267 26.508 1.00 28.89 O ATOM 2845 CB PRO B 81 -0.100 16.484 25.782 1.00 29.96 C ATOM 2846 CG PRO B 81 -0.798 15.284 26.189 1.00 31.06 C ATOM 2847 CD PRO B 81 -1.202 15.462 27.589 1.00 30.74 C ATOM 2848 HA PRO B 81 1.638 16.881 27.121 1.00 0.00 H ATOM 2849 HD3 PRO B 81 -2.171 15.957 27.661 1.00 0.00 H ATOM 2850 HD2 PRO B 81 -1.243 14.507 28.113 1.00 0.00 H ATOM 2851 HG3 PRO B 81 -0.139 14.421 26.098 1.00 0.00 H ATOM 2852 HG2 PRO B 81 -1.678 15.135 25.563 1.00 0.00 H ATOM 2853 HB2 PRO B 81 -0.801 17.213 25.375 1.00 0.00 H ATOM 2854 HB3 PRO B 81 0.655 16.249 25.031 1.00 0.00 H ATOM 2855 N THR B 82 -0.733 18.954 27.768 1.00 28.85 N ATOM 2856 CA THR B 82 -1.138 20.352 27.812 1.00 28.09 C ATOM 2857 C THR B 82 -1.714 20.633 29.200 1.00 26.73 C ATOM 2858 O THR B 82 -2.564 19.851 29.679 1.00 26.11 O ATOM 2859 CB THR B 82 -2.277 20.602 26.794 1.00 29.20 C ATOM 2860 OG1 THR B 82 -1.798 20.345 25.454 1.00 30.77 O ATOM 2861 CG2 THR B 82 -2.764 22.013 26.879 1.00 30.62 C ATOM 2862 HA THR B 82 -0.280 20.984 27.586 1.00 0.00 H ATOM 2863 HB THR B 82 -3.102 19.929 27.030 1.00 0.00 H ATOM 2864 HG1 THR B 82 -2.530 20.506 24.807 1.00 0.00 H ATOM 2865 HG23 THR B 82 -3.126 22.211 27.888 1.00 0.00 H ATOM 2866 HG21 THR B 82 -1.945 22.693 26.646 1.00 0.00 H ATOM 2867 HG22 THR B 82 -3.575 22.160 26.165 1.00 0.00 H ATOM 2868 H THR B 82 -1.305 18.256 28.286 1.00 0.00 H ATOM 2869 N ASN B 83 -1.301 21.748 29.816 1.00 25.05 N ATOM 2870 CA ASN B 83 -1.905 22.126 31.113 1.00 23.29 C ATOM 2871 C ASN B 83 -3.311 22.614 30.864 1.00 23.38 C ATOM 2872 O ASN B 83 -3.544 23.346 29.877 1.00 23.44 O ATOM 2873 CB ASN B 83 -1.106 23.244 31.793 1.00 22.75 C ATOM 2874 CG ASN B 83 0.327 22.869 32.037 1.00 23.34 C ATOM 2875 OD1 ASN B 83 0.636 21.712 32.333 1.00 24.42 O ATOM 2876 ND2 ASN B 83 1.220 23.850 31.916 1.00 22.22 N ATOM 2877 HA ASN B 83 -1.902 21.254 31.767 1.00 0.00 H ATOM 2878 HB2 ASN B 83 -1.131 24.128 31.156 1.00 0.00 H ATOM 2879 HB3 ASN B 83 -1.574 23.474 32.750 1.00 0.00 H ATOM 2880 HD22 ASN B 83 0.908 24.809 31.664 1.00 0.00 H ATOM 2881 HD21 ASN B 83 2.230 23.656 32.073 1.00 0.00 H ATOM 2882 H ASN B 83 -0.563 22.342 29.387 1.00 0.00 H ATOM 2883 N VAL B 84 -4.267 22.246 31.731 1.00 22.90 N ATOM 2884 CA VAL B 84 -5.668 22.631 31.440 1.00 23.02 C ATOM 2885 C VAL B 84 -6.301 23.216 32.678 1.00 23.17 C ATOM 2886 O VAL B 84 -6.053 22.733 33.798 1.00 23.62 O ATOM 2887 CB VAL B 84 -6.564 21.478 30.905 1.00 23.17 C ATOM 2888 CG1 VAL B 84 -6.034 20.936 29.538 1.00 25.66 C ATOM 2889 CG2 VAL B 84 -6.784 20.372 31.981 1.00 23.03 C ATOM 2890 HA VAL B 84 -5.608 23.364 30.636 1.00 0.00 H ATOM 2891 HB VAL B 84 -7.556 21.881 30.700 1.00 0.00 H ATOM 2892 HG11 VAL B 84 -6.031 21.743 28.805 1.00 0.00 H ATOM 2893 HG12 VAL B 84 -5.020 20.557 29.667 1.00 0.00 H ATOM 2894 HG13 VAL B 84 -6.682 20.131 29.192 1.00 0.00 H ATOM 2895 HG21 VAL B 84 -5.821 19.952 32.271 1.00 0.00 H ATOM 2896 HG22 VAL B 84 -7.270 20.808 32.854 1.00 0.00 H ATOM 2897 HG23 VAL B 84 -7.415 19.585 31.568 1.00 0.00 H ATOM 2898 H VAL B 84 -4.030 21.704 32.586 1.00 0.00 H ATOM 2899 N ILE B 85 -7.045 24.299 32.469 1.00 23.32 N ATOM 2900 CA ILE B 85 -7.815 24.936 33.528 1.00 22.42 C ATOM 2901 C ILE B 85 -9.227 24.378 33.380 1.00 22.81 C ATOM 2902 O ILE B 85 -9.862 24.579 32.338 1.00 23.85 O ATOM 2903 CB ILE B 85 -7.869 26.461 33.324 1.00 22.20 C ATOM 2904 CG1 ILE B 85 -6.451 27.063 33.332 1.00 23.95 C ATOM 2905 CG2 ILE B 85 -8.806 27.114 34.367 1.00 22.95 C ATOM 2906 CD1 ILE B 85 -5.599 26.643 34.536 1.00 24.39 C ATOM 2907 HA ILE B 85 -7.374 24.745 34.506 1.00 0.00 H ATOM 2908 HB ILE B 85 -8.292 26.676 32.343 1.00 0.00 H ATOM 2909 HG12 ILE B 85 -5.939 26.746 32.423 1.00 0.00 H ATOM 2910 HG13 ILE B 85 -6.540 28.149 33.338 1.00 0.00 H ATOM 2911 HD11 ILE B 85 -6.089 26.963 35.456 1.00 0.00 H ATOM 2912 HD12 ILE B 85 -5.488 25.559 34.540 1.00 0.00 H ATOM 2913 HD13 ILE B 85 -4.617 27.110 34.465 1.00 0.00 H ATOM 2914 HG21 ILE B 85 -9.811 26.706 34.257 1.00 0.00 H ATOM 2915 HG22 ILE B 85 -8.434 26.903 35.370 1.00 0.00 H ATOM 2916 HG23 ILE B 85 -8.831 28.192 34.207 1.00 0.00 H ATOM 2917 H ILE B 85 -7.078 24.706 31.513 1.00 0.00 H ATOM 2918 N GLY B 86 -9.705 23.696 34.419 1.00 22.10 N ATOM 2919 CA GLY B 86 -10.983 22.981 34.354 1.00 21.68 C ATOM 2920 C GLY B 86 -12.180 23.784 34.836 1.00 21.99 C ATOM 2921 O GLY B 86 -12.058 24.953 35.225 1.00 20.76 O ATOM 2922 HA3 GLY B 86 -10.904 22.085 34.969 1.00 0.00 H ATOM 2923 HA2 GLY B 86 -11.160 22.694 33.318 1.00 0.00 H ATOM 2924 H GLY B 86 -9.156 23.670 35.302 1.00 0.00 H ATOM 2925 N ARG B 87 -13.345 23.138 34.841 1.00 22.25 N ATOM 2926 CA ARG B 87 -14.562 23.843 35.202 1.00 22.94 C ATOM 2927 C ARG B 87 -14.515 24.272 36.652 1.00 23.97 C ATOM 2928 O ARG B 87 -15.175 25.233 37.006 1.00 24.26 O ATOM 2929 CB ARG B 87 -15.801 23.000 34.944 1.00 23.27 C ATOM 2930 CG ARG B 87 -16.055 22.693 33.465 1.00 21.25 C ATOM 2931 CD ARG B 87 -17.432 21.984 33.240 1.00 23.32 C ATOM 2932 NE ARG B 87 -17.423 20.626 33.809 1.00 22.95 N ATOM 2933 CZ ARG B 87 -17.931 20.284 34.991 1.00 24.78 C ATOM 2934 NH1 ARG B 87 -18.561 21.173 35.766 1.00 24.65 N ATOM 2935 NH2 ARG B 87 -17.813 19.037 35.410 1.00 25.79 N ATOM 2936 HA ARG B 87 -14.626 24.728 34.570 1.00 0.00 H ATOM 2937 HB2 ARG B 87 -15.688 22.055 35.475 1.00 0.00 H ATOM 2938 HB3 ARG B 87 -16.666 23.535 35.336 1.00 0.00 H ATOM 2939 HG2 ARG B 87 -16.045 23.628 32.905 1.00 0.00 H ATOM 2940 HG3 ARG B 87 -15.260 22.043 33.099 1.00 0.00 H ATOM 2941 HD2 ARG B 87 -17.631 21.922 32.170 1.00 0.00 H ATOM 2942 HD3 ARG B 87 -18.217 22.568 33.721 1.00 0.00 H ATOM 2943 HE ARG B 87 -16.984 19.873 33.241 1.00 0.00 H ATOM 2944 HH12 ARG B 87 -18.949 20.879 36.685 1.00 0.00 H ATOM 2945 HH11 ARG B 87 -18.663 22.158 35.450 1.00 0.00 H ATOM 2946 HH22 ARG B 87 -18.206 18.759 36.332 1.00 0.00 H ATOM 2947 HH21 ARG B 87 -17.327 18.333 34.818 1.00 0.00 H ATOM 2948 H ARG B 87 -13.383 22.130 34.587 1.00 0.00 H ATOM 2949 N ASN B 88 -13.734 23.561 37.473 1.00 24.79 N ATOM 2950 CA ASN B 88 -13.629 23.865 38.908 1.00 25.42 C ATOM 2951 C ASN B 88 -13.129 25.289 39.126 1.00 24.57 C ATOM 2952 O ASN B 88 -13.579 25.971 40.016 1.00 25.40 O ATOM 2953 CB ASN B 88 -12.796 22.811 39.674 1.00 25.88 C ATOM 2954 CG ASN B 88 -11.311 22.794 39.287 1.00 28.71 C ATOM 2955 OD1 ASN B 88 -10.952 22.768 38.102 1.00 32.29 O ATOM 2956 ND2 ASN B 88 -10.438 22.782 40.305 1.00 28.13 N ATOM 2957 HA ASN B 88 -14.631 23.808 39.333 1.00 0.00 H ATOM 2958 HB2 ASN B 88 -12.871 23.022 40.741 1.00 0.00 H ATOM 2959 HB3 ASN B 88 -13.216 21.826 39.470 1.00 0.00 H ATOM 2960 HD22 ASN B 88 -10.783 22.805 41.286 1.00 0.00 H ATOM 2961 HD21 ASN B 88 -9.416 22.750 40.113 1.00 0.00 H ATOM 2962 H ASN B 88 -13.184 22.769 37.084 1.00 0.00 H ATOM 2963 N VAL B 89 -12.249 25.736 38.248 1.00 23.44 N ATOM 2964 CA VAL B 89 -11.699 27.089 38.291 1.00 22.44 C ATOM 2965 C VAL B 89 -12.569 28.041 37.483 1.00 21.99 C ATOM 2966 O VAL B 89 -12.788 29.167 37.903 1.00 22.37 O ATOM 2967 CB VAL B 89 -10.251 27.107 37.764 1.00 21.56 C ATOM 2968 CG1 VAL B 89 -9.789 28.529 37.427 1.00 22.11 C ATOM 2969 CG2 VAL B 89 -9.317 26.476 38.791 1.00 21.91 C ATOM 2970 HA VAL B 89 -11.689 27.421 39.329 1.00 0.00 H ATOM 2971 HB VAL B 89 -10.221 26.525 36.843 1.00 0.00 H ATOM 2972 HG11 VAL B 89 -10.440 28.949 36.660 1.00 0.00 H ATOM 2973 HG12 VAL B 89 -9.837 29.147 38.324 1.00 0.00 H ATOM 2974 HG13 VAL B 89 -8.763 28.499 37.059 1.00 0.00 H ATOM 2975 HG21 VAL B 89 -9.368 27.040 39.722 1.00 0.00 H ATOM 2976 HG22 VAL B 89 -9.622 25.445 38.972 1.00 0.00 H ATOM 2977 HG23 VAL B 89 -8.296 26.493 38.410 1.00 0.00 H ATOM 2978 H VAL B 89 -11.933 25.096 37.492 1.00 0.00 H ATOM 2979 N MET B 90 -13.082 27.583 36.335 1.00 22.11 N ATOM 2980 CA MET B 90 -13.842 28.474 35.475 1.00 22.04 C ATOM 2981 C MET B 90 -15.127 28.984 36.112 1.00 21.81 C ATOM 2982 O MET B 90 -15.462 30.159 35.946 1.00 21.60 O ATOM 2983 CB MET B 90 -14.079 27.854 34.101 1.00 22.54 C ATOM 2984 CG MET B 90 -12.771 27.795 33.291 1.00 23.69 C ATOM 2985 SD MET B 90 -13.023 27.113 31.626 1.00 29.79 S ATOM 2986 CE MET B 90 -13.881 28.429 30.849 1.00 28.68 C ATOM 2987 HA MET B 90 -13.225 29.361 35.333 1.00 0.00 H ATOM 2988 HB2 MET B 90 -14.467 26.843 34.227 1.00 0.00 H ATOM 2989 HB3 MET B 90 -14.808 28.456 33.559 1.00 0.00 H ATOM 2990 HG2 MET B 90 -12.057 27.167 33.823 1.00 0.00 H ATOM 2991 HG3 MET B 90 -12.369 28.804 33.200 1.00 0.00 H ATOM 2992 HE1 MET B 90 -14.810 28.622 31.385 1.00 0.00 H ATOM 2993 HE2 MET B 90 -13.260 29.324 30.863 1.00 0.00 H ATOM 2994 HE3 MET B 90 -14.105 28.156 29.818 1.00 0.00 H ATOM 2995 H MET B 90 -12.937 26.591 36.059 1.00 0.00 H ATOM 2996 N THR B 91 -15.828 28.124 36.857 1.00 22.62 N ATOM 2997 CA THR B 91 -17.040 28.559 37.563 1.00 23.57 C ATOM 2998 C THR B 91 -16.730 29.724 38.513 1.00 23.71 C ATOM 2999 O THR B 91 -17.502 30.681 38.639 1.00 23.59 O ATOM 3000 CB THR B 91 -17.731 27.413 38.348 1.00 24.04 C ATOM 3001 OG1 THR B 91 -16.839 26.870 39.328 1.00 25.51 O ATOM 3002 CG2 THR B 91 -18.165 26.323 37.412 1.00 24.52 C ATOM 3003 HA THR B 91 -17.736 28.889 36.792 1.00 0.00 H ATOM 3004 HB THR B 91 -18.607 27.825 38.849 1.00 0.00 H ATOM 3005 HG1 THR B 91 -17.294 26.141 39.819 1.00 0.00 H ATOM 3006 HG23 THR B 91 -18.844 26.736 36.666 1.00 0.00 H ATOM 3007 HG21 THR B 91 -17.290 25.902 36.916 1.00 0.00 H ATOM 3008 HG22 THR B 91 -18.675 25.542 37.977 1.00 0.00 H ATOM 3009 H THR B 91 -15.512 27.136 36.938 1.00 0.00 H ATOM 3010 N GLN B 92 -15.583 29.640 39.164 1.00 23.86 N ATOM 3011 CA GLN B 92 -15.128 30.724 40.028 1.00 24.85 C ATOM 3012 C GLN B 92 -14.784 32.000 39.262 1.00 25.07 C ATOM 3013 O GLN B 92 -14.897 33.103 39.799 1.00 24.52 O ATOM 3014 CB GLN B 92 -13.926 30.283 40.833 1.00 25.30 C ATOM 3015 CG GLN B 92 -14.140 29.001 41.578 1.00 27.29 C ATOM 3016 CD GLN B 92 -12.974 28.715 42.480 1.00 32.29 C ATOM 3017 OE1 GLN B 92 -12.770 29.398 43.489 1.00 34.57 O ATOM 3018 NE2 GLN B 92 -12.180 27.714 42.111 1.00 35.20 N ATOM 3019 HA GLN B 92 -15.962 30.959 40.689 1.00 0.00 H ATOM 3020 HB2 GLN B 92 -13.085 30.150 40.152 1.00 0.00 H ATOM 3021 HB3 GLN B 92 -13.688 31.065 41.554 1.00 0.00 H ATOM 3022 HG2 GLN B 92 -15.046 29.082 42.178 1.00 0.00 H ATOM 3023 HG3 GLN B 92 -14.250 28.185 40.864 1.00 0.00 H ATOM 3024 HE22 GLN B 92 -12.396 27.169 41.252 1.00 0.00 H ATOM 3025 HE21 GLN B 92 -11.343 27.476 42.681 1.00 0.00 H ATOM 3026 H GLN B 92 -14.996 28.788 39.059 1.00 0.00 H ATOM 3027 N LEU B 93 -14.353 31.848 38.008 1.00 25.31 N ATOM 3028 CA LEU B 93 -14.050 33.012 37.182 1.00 25.89 C ATOM 3029 C LEU B 93 -15.324 33.695 36.700 1.00 26.56 C ATOM 3030 O LEU B 93 -15.278 34.807 36.170 1.00 26.89 O ATOM 3031 CB LEU B 93 -13.133 32.640 36.007 1.00 26.23 C ATOM 3032 CG LEU B 93 -11.715 32.219 36.402 1.00 26.01 C ATOM 3033 CD1 LEU B 93 -10.922 31.825 35.163 1.00 23.71 C ATOM 3034 CD2 LEU B 93 -11.007 33.316 37.175 1.00 26.51 C ATOM 3035 HA LEU B 93 -13.511 33.726 37.804 1.00 0.00 H ATOM 3036 HB2 LEU B 93 -13.594 31.813 35.467 1.00 0.00 H ATOM 3037 HB3 LEU B 93 -13.058 33.506 35.349 1.00 0.00 H ATOM 3038 HG LEU B 93 -11.787 31.353 37.060 1.00 0.00 H ATOM 3039 HD21 LEU B 93 -10.943 34.211 36.557 1.00 0.00 H ATOM 3040 HD22 LEU B 93 -11.568 33.539 38.083 1.00 0.00 H ATOM 3041 HD23 LEU B 93 -10.003 32.983 37.439 1.00 0.00 H ATOM 3042 HD11 LEU B 93 -11.418 30.991 34.666 1.00 0.00 H ATOM 3043 HD12 LEU B 93 -10.867 32.675 34.483 1.00 0.00 H ATOM 3044 HD13 LEU B 93 -9.915 31.528 35.457 1.00 0.00 H ATOM 3045 H LEU B 93 -14.232 30.892 37.616 1.00 0.00 H ATOM 3046 N GLY B 94 -16.467 33.043 36.934 1.00 26.75 N ATOM 3047 CA GLY B 94 -17.752 33.513 36.429 1.00 27.11 C ATOM 3048 C GLY B 94 -17.779 33.302 34.929 1.00 26.99 C ATOM 3049 O GLY B 94 -18.521 33.965 34.207 1.00 27.09 O ATOM 3050 HA3 GLY B 94 -17.872 34.573 36.655 1.00 0.00 H ATOM 3051 HA2 GLY B 94 -18.560 32.950 36.895 1.00 0.00 H ATOM 3052 H GLY B 94 -16.439 32.169 37.497 1.00 0.00 H ATOM 3053 N CYS B 95 -16.959 32.354 34.478 1.00 27.09 N ATOM 3054 CA CYS B 95 -16.687 32.121 33.077 1.00 27.97 C ATOM 3055 C CYS B 95 -17.788 31.239 32.466 1.00 27.11 C ATOM 3056 O CYS B 95 -18.142 30.185 33.018 1.00 28.02 O ATOM 3057 CB CYS B 95 -15.281 31.503 32.958 1.00 27.70 C ATOM 3058 SG CYS B 95 -14.629 31.383 31.355 1.00 32.39 S ATOM 3059 HA CYS B 95 -16.697 33.053 32.511 1.00 0.00 H ATOM 3060 HB2 CYS B 95 -15.323 30.497 33.376 1.00 0.00 H ATOM 3061 HB3 CYS B 95 -14.598 32.113 33.550 1.00 0.00 H ATOM 3062 HG CYS B 95 -13.373 30.813 31.412 1.00 0.00 H ATOM 3063 H CYS B 95 -16.486 31.745 35.176 1.00 0.00 H ATOM 3064 N THR B 96 -18.372 31.711 31.366 1.00 25.97 N ATOM 3065 CA THR B 96 -19.514 31.057 30.715 1.00 25.20 C ATOM 3066 C THR B 96 -19.245 30.902 29.216 1.00 25.35 C ATOM 3067 O THR B 96 -18.415 31.616 28.664 1.00 24.20 O ATOM 3068 CB THR B 96 -20.829 31.877 30.867 1.00 25.29 C ATOM 3069 OG1 THR B 96 -20.725 33.119 30.156 1.00 25.88 O ATOM 3070 CG2 THR B 96 -21.157 32.162 32.335 1.00 24.66 C ATOM 3071 HA THR B 96 -19.635 30.089 31.202 1.00 0.00 H ATOM 3072 HB THR B 96 -21.635 31.275 30.448 1.00 0.00 H ATOM 3073 HG1 THR B 96 -20.566 32.936 29.196 1.00 0.00 H ATOM 3074 HG23 THR B 96 -21.237 31.220 32.878 1.00 0.00 H ATOM 3075 HG21 THR B 96 -20.364 32.769 32.772 1.00 0.00 H ATOM 3076 HG22 THR B 96 -22.103 32.700 32.397 1.00 0.00 H ATOM 3077 H THR B 96 -18.000 32.587 30.947 1.00 0.00 H ATOM 3078 N LEU B 97 -19.964 29.980 28.578 1.00 25.57 N ATOM 3079 CA LEU B 97 -19.965 29.861 27.119 1.00 25.79 C ATOM 3080 C LEU B 97 -21.150 30.626 26.558 1.00 26.27 C ATOM 3081 O LEU B 97 -22.304 30.326 26.887 1.00 25.59 O ATOM 3082 CB LEU B 97 -20.066 28.402 26.689 1.00 25.52 C ATOM 3083 CG LEU B 97 -18.757 27.611 26.682 1.00 24.88 C ATOM 3084 CD1 LEU B 97 -19.077 26.122 26.710 1.00 25.64 C ATOM 3085 CD2 LEU B 97 -17.896 27.984 25.476 1.00 23.57 C ATOM 3086 HA LEU B 97 -19.030 30.272 26.738 1.00 0.00 H ATOM 3087 HB2 LEU B 97 -20.755 27.901 27.369 1.00 0.00 H ATOM 3088 HB3 LEU B 97 -20.474 28.380 25.679 1.00 0.00 H ATOM 3089 HG LEU B 97 -18.175 27.861 27.569 1.00 0.00 H ATOM 3090 HD21 LEU B 97 -18.442 27.764 24.559 1.00 0.00 H ATOM 3091 HD22 LEU B 97 -17.661 29.048 25.514 1.00 0.00 H ATOM 3092 HD23 LEU B 97 -16.972 27.406 25.498 1.00 0.00 H ATOM 3093 HD11 LEU B 97 -19.642 25.890 27.613 1.00 0.00 H ATOM 3094 HD12 LEU B 97 -19.669 25.862 25.832 1.00 0.00 H ATOM 3095 HD13 LEU B 97 -18.148 25.552 26.705 1.00 0.00 H ATOM 3096 H LEU B 97 -20.545 29.322 29.136 1.00 0.00 H ATOM 3097 N ASN B 98 -20.860 31.615 25.714 1.00 27.09 N ATOM 3098 CA ASN B 98 -21.898 32.456 25.121 1.00 28.23 C ATOM 3099 C ASN B 98 -21.923 32.365 23.607 1.00 29.14 C ATOM 3100 O ASN B 98 -20.873 32.378 22.965 1.00 29.12 O ATOM 3101 CB ASN B 98 -21.696 33.919 25.511 1.00 28.54 C ATOM 3102 CG ASN B 98 -21.745 34.136 27.001 1.00 28.91 C ATOM 3103 OD1 ASN B 98 -20.816 33.786 27.721 1.00 29.93 O ATOM 3104 ND2 ASN B 98 -22.829 34.720 27.472 1.00 29.71 N ATOM 3105 HA ASN B 98 -22.847 32.086 25.508 1.00 0.00 H ATOM 3106 HB2 ASN B 98 -20.724 34.247 25.142 1.00 0.00 H ATOM 3107 HB3 ASN B 98 -22.480 34.516 25.045 1.00 0.00 H ATOM 3108 HD22 ASN B 98 -23.592 35.000 26.824 1.00 0.00 H ATOM 3109 HD21 ASN B 98 -22.921 34.901 28.492 1.00 0.00 H ATOM 3110 H ASN B 98 -19.865 31.794 25.470 1.00 0.00 H ATOM 3111 N PHE B 99 -23.128 32.266 23.051 1.00 30.22 N ATOM 3112 CA PHE B 99 -23.350 32.379 21.602 1.00 31.25 C ATOM 3113 C PHE B 99 -24.762 32.877 21.280 1.00 31.26 C ATOM 3114 O PHE B 99 -25.125 33.053 20.117 1.00 31.63 O ATOM 3115 CB PHE B 99 -23.046 31.058 20.876 1.00 31.57 C ATOM 3116 CG PHE B 99 -23.829 29.881 21.383 1.00 32.68 C ATOM 3117 CD1 PHE B 99 -23.415 29.192 22.519 1.00 33.61 C ATOM 3118 CD2 PHE B 99 -24.956 29.442 20.706 1.00 34.18 C ATOM 3119 CE1 PHE B 99 -24.122 28.099 22.984 1.00 34.68 C ATOM 3120 CE2 PHE B 99 -25.673 28.351 21.169 1.00 35.66 C ATOM 3121 CZ PHE B 99 -25.253 27.680 22.314 1.00 35.38 C ATOM 3122 HA PHE B 99 -22.649 33.126 21.231 1.00 0.00 H ATOM 3123 OXT PHE B 99 -25.583 33.123 22.171 1.00 31.57 O ATOM 3124 HB2 PHE B 99 -23.273 31.189 19.818 1.00 0.00 H ATOM 3125 HB3 PHE B 99 -21.985 30.839 20.994 1.00 0.00 H ATOM 3126 HD2 PHE B 99 -25.280 29.959 19.803 1.00 0.00 H ATOM 3127 HE2 PHE B 99 -26.565 28.018 20.638 1.00 0.00 H ATOM 3128 HZ PHE B 99 -25.818 26.823 22.681 1.00 0.00 H ATOM 3129 HE1 PHE B 99 -23.787 27.570 23.876 1.00 0.00 H ATOM 3130 HD1 PHE B 99 -22.521 29.519 23.050 1.00 0.00 H ATOM 3131 H PHE B 99 -23.949 32.102 23.668 1.00 0.00 H TER 3132 PHE B 99 HETATM 3133 O HOH 1 -30.759 33.741 26.499 1.00 50.41 O HETATM 3134 O HOH 2 -22.297 8.147 21.538 1.00 26.35 O HETATM 3135 O HOH 3 -21.830 17.514 35.351 1.00 16.85 O HETATM 3136 O HOH 4 -28.195 8.321 21.015 1.00 22.16 O HETATM 3137 O HOH 5 -31.270 19.611 20.093 1.00 29.91 O HETATM 3138 O HOH 6 -25.173 22.548 30.856 1.00 27.24 O HETATM 3139 O HOH 7 -28.425 9.837 25.299 1.00 23.99 O HETATM 3140 O HOH 8 -20.824 11.859 25.145 1.00 20.06 O HETATM 3141 O HOH 9 -31.150 18.778 24.462 1.00 19.72 O HETATM 3142 O HOH 10 -20.915 8.464 19.509 1.00 39.69 O HETATM 3143 O HOH 11 -33.675 18.444 12.184 1.00 31.69 O HETATM 3144 O HOH 12 -24.339 18.175 32.378 1.00 19.88 O HETATM 3145 O HOH 13 -30.433 22.970 14.614 1.00 37.75 O HETATM 3146 O HOH 14 -28.903 20.530 23.966 1.00 15.39 O HETATM 3147 O HOH 15 -21.718 18.798 38.877 1.00 21.81 O HETATM 3148 O HOH 16 -12.771 18.811 2.153 1.00 40.41 O HETATM 3149 O HOH 17 -27.831 23.519 22.165 1.00 28.21 O HETATM 3150 O HOH 18 -18.264 5.707 10.402 1.00 38.21 O HETATM 3151 O HOH 19 -27.443 16.896 10.749 1.00 31.60 O HETATM 3152 O HOH 20 -24.508 10.184 22.650 1.00 17.44 O HETATM 3153 O HOH 21 -27.836 16.841 25.764 1.00 19.66 O HETATM 3154 O HOH 22 -28.510 21.422 20.453 1.00 34.20 O HETATM 3155 O HOH 23 -14.144 25.504 11.781 1.00 33.32 O HETATM 3156 O HOH 24 -8.369 24.035 22.180 1.00 12.83 O HETATM 3157 O HOH 25 -18.315 8.538 24.045 1.00 31.37 O HETATM 3158 O HOH 26 -19.806 12.436 5.667 1.00 34.61 O HETATM 3159 O HOH 27 -30.207 22.445 17.191 1.00 26.98 O HETATM 3160 O HOH 28 -1.047 12.937 23.784 1.00 41.73 O HETATM 3161 O HOH 29 -25.069 22.729 27.933 1.00 35.05 O HETATM 3162 O HOH 30 -6.977 19.997 14.456 1.00 29.63 O HETATM 3163 O HOH 31 -14.784 19.247 6.771 1.00 27.94 O HETATM 3164 O HOH 32 -22.796 4.397 24.752 1.00 43.93 O HETATM 3165 O HOH 33 -9.760 23.934 15.874 1.00 34.76 O HETATM 3166 O HOH 34 -6.445 21.833 22.441 1.00 15.71 O HETATM 3167 O HOH 35 -22.871 10.268 24.634 1.00 23.15 O HETATM 3168 O HOH 36 -13.004 4.734 14.135 1.00 38.09 O HETATM 3169 O HOH 37 -1.010 1.438 20.785 1.00 42.30 O HETATM 3170 O HOH 38 -17.119 0.896 7.137 1.00 38.14 O HETATM 3171 O HOH 39 -26.881 6.285 19.951 1.00 32.36 O HETATM 3172 O HOH 40 -20.472 22.176 40.466 1.00 30.70 O HETATM 3173 O HOH 41 -12.394 22.658 10.759 1.00 51.67 O HETATM 3174 O HOH 42 -15.657 11.801 30.752 1.00 49.95 O HETATM 3175 O HOH 43 -0.580 12.080 29.736 1.00 38.45 O HETATM 3176 O HOH 44 -12.622 5.507 2.661 1.00 43.83 O HETATM 3177 O HOH 45 -25.446 5.848 15.838 1.00 29.37 O HETATM 3178 O HOH 46 -33.417 13.972 8.570 1.00 32.45 O HETATM 3179 O HOH 47 -15.674 16.542 31.238 1.00 16.74 O HETATM 3180 O HOH 48 -10.058 4.334 4.182 1.00 46.88 O HETATM 3181 O HOH 49 -13.010 17.411 14.000 1.00 27.04 O HETATM 3182 O HOH 50 -28.097 6.328 16.365 1.00 35.93 O HETATM 3183 O HOH 51 -28.089 27.199 28.906 1.00 42.50 O HETATM 3184 O HOH 52 -2.006 5.555 24.038 1.00 35.15 O HETATM 3185 O HOH 53 -29.068 14.538 9.808 1.00 29.86 O HETATM 3186 O HOH 54 -15.239 31.594 18.676 1.00 27.50 O HETATM 3187 O HOH 55 -17.516 5.403 5.632 1.00 38.26 O HETATM 3188 O HOH 56 -21.593 16.961 3.285 1.00 40.57 O HETATM 3189 O HOH 57 -3.196 14.154 14.859 1.00 39.26 O HETATM 3190 O HOH 58 -3.897 15.238 18.818 1.00 25.89 O HETATM 3191 O HOH 59 -20.164 15.157 35.877 1.00 47.76 O HETATM 3192 O HOH 60 -21.422 13.564 31.247 1.00 35.84 O HETATM 3193 O HOH 61 -15.002 3.921 17.942 1.00 35.26 O HETATM 3194 O HOH 62 -24.091 34.237 34.020 1.00 52.13 O HETATM 3195 O HOH 63 -23.978 24.334 34.882 1.00 37.95 O HETATM 3196 O HOH 64 -30.337 32.940 23.657 1.00 38.40 O HETATM 3197 O HOH 65 -31.845 7.502 18.616 1.00 28.89 O HETATM 3198 O HOH 66 -30.293 8.162 16.536 1.00 19.77 O HETATM 3199 O HOH 67 -31.861 8.661 14.440 1.00 19.52 O HETATM 3200 O HOH 68 -7.417 25.966 15.609 1.00 37.81 O HETATM 3201 O HOH 69 -7.047 22.613 15.137 1.00 43.99 O HETATM 3202 O HOH 70 -26.494 16.888 30.923 1.00 39.24 O HETATM 3203 O HOH 71 -22.774 23.398 31.651 1.00 25.09 O HETATM 3204 O HOH 72 -29.781 19.430 17.612 1.00 28.65 O HETATM 3205 O HOH 73 -27.047 28.059 11.780 1.00 35.74 O HETATM 3206 O HOH 74 -7.255 3.342 19.232 1.00 33.36 O HETATM 3207 O HOH 75 -29.676 15.312 7.279 1.00 42.38 O HETATM 3208 O HOH 76 -28.568 17.433 6.395 1.00 43.84 O HETATM 3209 O HOH 77 -7.930 13.694 26.811 1.00 14.23 O HETATM 3210 O HOH 78 -19.505 28.978 35.202 1.00 25.13 O HETATM 3211 O HOH 79 -8.948 31.498 22.084 1.00 22.30 O HETATM 3212 O HOH 80 5.269 18.148 40.400 1.00 43.49 O HETATM 3213 O HOH 81 -4.242 27.644 18.338 1.00 15.94 O HETATM 3214 O HOH 82 -3.335 35.309 29.877 1.00 16.83 O HETATM 3215 O HOH 83 6.861 28.525 32.739 1.00 19.63 O HETATM 3216 O HOH 84 9.003 22.496 38.608 1.00 38.65 O HETATM 3217 O HOH 85 -0.949 20.471 49.825 1.00 26.80 O HETATM 3218 O HOH 86 4.037 23.289 32.268 1.00 25.26 O HETATM 3219 O HOH 87 -0.674 36.422 29.269 1.00 19.05 O HETATM 3220 O HOH 88 3.149 22.221 34.184 1.00 34.41 O HETATM 3221 O HOH 89 -4.321 35.334 33.278 1.00 31.82 O HETATM 3222 O HOH 90 -3.616 30.246 21.342 1.00 21.97 O HETATM 3223 O HOH 91 3.399 26.239 31.157 1.00 15.83 O HETATM 3224 O HOH 92 -0.791 23.178 47.943 1.00 38.56 O HETATM 3225 O HOH 93 1.512 29.320 24.610 1.00 29.70 O HETATM 3226 O HOH 94 -14.343 43.035 27.517 1.00 42.03 O HETATM 3227 O HOH 95 -13.214 16.119 32.659 1.00 13.39 O HETATM 3228 O HOH 96 -7.399 19.440 21.144 1.00 15.62 O HETATM 3229 O HOH 97 8.377 31.900 39.310 1.00 19.29 O HETATM 3230 O HOH 98 -5.534 28.054 14.739 1.00 36.69 O HETATM 3231 O HOH 99 -0.963 30.087 44.771 1.00 27.84 O HETATM 3232 O HOH 100 -6.137 36.028 31.328 1.00 31.29 O HETATM 3233 O HOH 101 -0.699 32.525 27.985 1.00 18.97 O HETATM 3234 O HOH 102 -8.539 19.877 39.641 1.00 27.15 O HETATM 3235 O HOH 103 -9.209 22.395 46.891 1.00 35.46 O HETATM 3236 O HOH 104 -16.685 19.228 31.512 1.00 11.41 O HETATM 3237 O HOH 105 -13.828 15.882 39.399 1.00 29.81 O HETATM 3238 O HOH 106 -11.259 11.264 35.062 1.00 28.81 O HETATM 3239 O HOH 107 -4.359 37.411 36.561 1.00 32.65 O HETATM 3240 O HOH 108 -0.907 32.384 42.767 1.00 29.07 O HETATM 3241 O HOH 109 -2.192 34.154 44.642 1.00 52.39 O HETATM 3242 O HOH 110 5.088 10.605 42.152 1.00 55.01 O HETATM 3243 O HOH 111 -14.873 14.177 37.428 1.00 46.69 O HETATM 3244 O HOH 112 -0.608 29.691 17.487 1.00 29.32 O HETATM 3245 O HOH 113 3.631 18.432 42.840 1.00 41.72 O HETATM 3246 O HOH 114 2.503 13.618 39.648 1.00 36.57 O HETATM 3247 O HOH 115 1.259 13.757 51.329 1.00 45.99 O HETATM 3248 O HOH 116 -4.390 35.236 27.463 1.00 31.81 O HETATM 3249 O HOH 117 1.722 32.429 43.943 1.00 27.99 O HETATM 3250 O HOH 118 0.911 38.211 41.554 1.00 37.51 O HETATM 3251 O HOH 119 -14.586 24.681 42.101 1.00 38.37 O HETATM 3252 O HOH 120 -6.841 33.080 25.643 1.00 32.68 O HETATM 3253 O HOH 121 -16.548 26.363 42.032 1.00 36.26 O HETATM 3254 O HOH 122 -1.633 29.214 15.305 1.00 27.93 O HETATM 3255 O HOH 123 -10.962 18.735 40.688 1.00 30.37 O HETATM 3256 O HOH 124 -3.889 4.471 29.759 1.00 38.68 O HETATM 3257 O HOH 125 4.510 35.638 45.157 1.00 35.28 O HETATM 3258 O HOH 126 -4.332 18.795 49.375 1.00 33.21 O HETATM 3259 O HOH 127 -3.828 21.564 23.123 1.00 30.31 O HETATM 3260 O HOH 128 -3.968 2.493 26.742 1.00 49.10 O HETATM 3261 O HOH 129 -3.760 27.207 50.489 1.00 46.03 O HETATM 3262 O HOH 130 -10.759 37.409 41.817 1.00 31.56 O HETATM 3263 O HOH 131 -6.996 33.066 23.013 1.00 31.84 O HETATM 3264 O HOH 132 0.161 23.857 28.492 1.00 19.23 O HETATM 3265 O HOH 133 -18.803 19.480 38.225 1.00 45.64 O HETATM 3266 O HOH 134 8.054 30.261 37.266 1.00 20.24 O HETATM 3267 O HOH 135 9.438 31.359 35.215 1.00 29.91 O HETATM 3268 O HOH 136 -9.315 28.769 13.199 1.00 32.50 O HETATM 3269 O HOH 137 7.693 24.839 37.870 1.00 30.65 O HETATM 3270 O HOH 138 -1.582 31.488 22.579 1.00 30.85 O HETATM 3271 O HOH 139 -4.482 37.862 39.072 1.00 34.79 O HETATM 3272 O HOH 140 -1.936 35.536 36.004 1.00 26.14 O HETATM 3273 O HOH 141 -15.773 20.464 37.932 1.00 36.78 O HETATM 3274 O HOH 142 8.325 15.635 45.685 1.00 42.25 O HETATM 3275 N1 UNN A 143 -9.363 16.816 18.736 1.00 -0.34 N HETATM 3276 C2 UNN A 143 -9.196 16.517 20.032 1.00 0.04 C HETATM 3277 C3 UNN A 143 -10.324 16.420 20.838 1.00 -0.04 C HETATM 3278 C4 UNN A 143 -10.184 16.113 22.182 1.00 -0.05 C HETATM 3279 C5 UNN A 143 -8.908 15.896 22.710 1.00 0.09 C HETATM 3280 C6 UNN A 143 -7.781 15.987 21.887 1.00 -0.05 C HETATM 3281 C7 UNN A 143 -7.920 16.305 20.539 1.00 -0.04 C HETATM 3282 H6 UNN A 143 -7.050 16.386 19.898 1.00 0.05 H HETATM 3283 H5 UNN A 143 -6.795 15.809 22.301 1.00 0.06 H HETATM 3284 S8 UNN A 143 -8.774 15.536 24.260 1.00 0.06 S HETATM 3285 O9 UNN A 143 -9.922 14.783 24.661 1.00 -0.15 O HETATM 3286 O10 UNN A 143 -7.599 14.762 24.466 1.00 -0.15 O HETATM 3287 N11 UNN A 143 -8.608 16.827 25.256 1.00 -0.23 N HETATM 3288 C12 UNN A 143 -7.476 17.703 24.868 1.00 0.03 C HETATM 3289 C13 UNN A 143 -6.937 18.436 26.108 1.00 -0.03 C HETATM 3290 C14 UNN A 143 -6.315 17.476 27.119 1.00 -0.06 C HETATM 3291 H10 UNN A 143 -5.945 18.045 27.985 1.00 0.02 H HETATM 3292 H11 UNN A 143 -5.478 16.939 26.648 1.00 0.02 H HETATM 3293 H12 UNN A 143 -7.074 16.752 27.452 1.00 0.02 H HETATM 3294 C15 UNN A 143 -5.948 19.524 25.712 1.00 -0.06 C HETATM 3295 H13 UNN A 143 -6.420 20.201 24.985 1.00 0.02 H HETATM 3296 H14 UNN A 143 -5.057 19.063 25.260 1.00 0.02 H HETATM 3297 H15 UNN A 143 -5.653 20.094 26.605 1.00 0.02 H HETATM 3298 H9 UNN A 143 -7.791 18.924 26.599 1.00 0.03 H HETATM 3299 H7 UNN A 143 -7.822 18.441 24.129 1.00 0.05 H HETATM 3300 H8 UNN A 143 -6.675 17.091 24.428 1.00 0.05 H HETATM 3301 C16 UNN A 143 -9.868 17.597 25.387 1.00 0.06 C HETATM 3302 C17 UNN A 143 -10.338 17.632 26.848 1.00 0.10 C HETATM 3303 O18 UNN A 143 -11.391 18.584 27.011 1.00 -0.39 O HETATM 3304 H19 UNN A 143 -12.123 18.343 26.456 1.00 0.21 H HETATM 3305 C19 UNN A 143 -10.800 16.266 27.362 1.00 0.08 C HETATM 3306 N20 UNN A 143 -10.856 16.408 28.807 1.00 -0.26 N HETATM 3307 C21 UNN A 143 -9.992 15.831 29.643 1.00 0.32 C HETATM 3308 O22 UNN A 143 -9.039 15.111 29.329 1.00 -0.38 O HETATM 3309 O23 UNN A 143 -10.239 16.119 31.032 1.00 -0.26 O HETATM 3310 C24 UNN A 143 -9.550 15.346 32.001 1.00 0.12 C HETATM 3311 C25 UNN A 143 -9.242 16.370 33.073 1.00 0.08 C HETATM 3312 O26 UNN A 143 -10.487 16.531 33.756 1.00 -0.35 O HETATM 3313 C27 UNN A 143 -11.174 15.272 33.760 1.00 0.16 C HETATM 3314 O28 UNN A 143 -12.536 15.497 33.417 1.00 -0.35 O HETATM 3315 C29 UNN A 143 -12.900 14.771 32.232 1.00 0.05 C HETATM 3316 C30 UNN A 143 -11.685 13.963 31.792 1.00 -0.02 C HETATM 3317 C31 UNN A 143 -10.539 14.415 32.679 1.00 0.04 C HETATM 3318 H30 UNN A 143 -10.017 13.541 33.095 1.00 0.04 H HETATM 3319 H28 UNN A 143 -11.454 14.165 30.736 1.00 0.03 H HETATM 3320 H29 UNN A 143 -11.872 12.887 31.927 1.00 0.03 H HETATM 3321 H26 UNN A 143 -13.191 15.473 31.437 1.00 0.06 H HETATM 3322 H27 UNN A 143 -13.740 14.095 32.450 1.00 0.06 H HETATM 3323 H25 UNN A 143 -11.097 14.785 34.743 1.00 0.09 H HETATM 3324 H23 UNN A 143 -8.915 17.320 32.625 1.00 0.06 H HETATM 3325 H24 UNN A 143 -8.464 16.000 33.757 1.00 0.06 H HETATM 3326 H22 UNN A 143 -8.669 14.825 31.599 1.00 0.07 H HETATM 3327 H21 UNN A 143 -11.585 16.971 29.197 1.00 0.19 H HETATM 3328 C32 UNN A 143 -12.220 15.886 26.926 1.00 0.01 C HETATM 3329 C38 UNN A 143 -12.523 14.530 27.454 1.00 -0.04 C HETATM 3330 C33 UNN A 143 -13.577 14.357 28.348 1.00 -0.06 C HETATM 3331 C34 UNN A 143 -13.827 13.095 28.847 1.00 -0.07 C HETATM 3332 C35 UNN A 143 -13.052 12.011 28.469 1.00 -0.07 C HETATM 3333 C36 UNN A 143 -11.996 12.187 27.585 1.00 -0.07 C HETATM 3334 C37 UNN A 143 -11.726 13.449 27.074 1.00 -0.06 C HETATM 3335 H37 UNN A 143 -10.902 13.594 26.385 1.00 0.06 H HETATM 3336 H36 UNN A 143 -11.384 11.341 27.295 1.00 0.06 H HETATM 3337 H35 UNN A 143 -13.270 11.025 28.863 1.00 0.06 H HETATM 3338 H34 UNN A 143 -14.643 12.950 29.546 1.00 0.06 H HETATM 3339 H33 UNN A 143 -14.190 15.199 28.647 1.00 0.06 H HETATM 3340 H31 UNN A 143 -12.283 15.880 25.828 1.00 0.04 H HETATM 3341 H32 UNN A 143 -12.940 16.612 27.331 1.00 0.04 H HETATM 3342 H20 UNN A 143 -10.090 15.485 27.054 1.00 0.06 H HETATM 3343 H18 UNN A 143 -9.485 17.952 27.464 1.00 0.06 H HETATM 3344 H16 UNN A 143 -10.646 17.123 24.770 1.00 0.05 H HETATM 3345 H17 UNN A 143 -9.699 18.626 25.038 1.00 0.05 H HETATM 3346 H4 UNN A 143 -11.058 16.042 22.820 1.00 0.06 H HETATM 3347 H3 UNN A 143 -11.309 16.584 20.417 1.00 0.05 H HETATM 3348 H1 UNN A 143 -10.310 16.973 18.361 1.00 0.17 H HETATM 3349 H2 UNN A 143 -8.545 16.889 18.115 1.00 0.17 H CONECT 3275 3276 3348 3349 CONECT 3276 3275 3277 3281 CONECT 3277 3276 3278 3347 CONECT 3278 3277 3279 3346 CONECT 3279 3278 3280 3284 CONECT 3280 3279 3281 3283 CONECT 3281 3276 3280 3282 CONECT 3282 3281 CONECT 3283 3280 CONECT 3284 3279 3285 3286 3287 CONECT 3285 3284 CONECT 3286 3284 CONECT 3287 3284 3288 3301 CONECT 3288 3287 3289 3299 3300 CONECT 3289 3288 3290 3294 3298 CONECT 3290 3289 3291 3292 3293 CONECT 3291 3290 CONECT 3292 3290 CONECT 3293 3290 CONECT 3294 3289 3295 3296 3297 CONECT 3295 3294 CONECT 3296 3294 CONECT 3297 3294 CONECT 3298 3289 CONECT 3299 3288 CONECT 3300 3288 CONECT 3301 3287 3302 3344 3345 CONECT 3302 3301 3303 3305 3343 CONECT 3303 3302 3304 CONECT 3304 3303 CONECT 3305 3302 3306 3328 3342 CONECT 3306 3305 3307 3327 CONECT 3307 3306 3308 3309 CONECT 3308 3307 CONECT 3309 3307 3310 CONECT 3310 3309 3311 3317 3326 CONECT 3311 3310 3312 3324 3325 CONECT 3312 3311 3313 CONECT 3313 3312 3314 3317 3323 CONECT 3314 3313 3315 CONECT 3315 3314 3316 3321 3322 CONECT 3316 3315 3317 3319 3320 CONECT 3317 3310 3313 3316 3318 CONECT 3318 3317 CONECT 3319 3316 CONECT 3320 3316 CONECT 3321 3315 CONECT 3322 3315 CONECT 3323 3313 CONECT 3324 3311 CONECT 3325 3311 CONECT 3326 3310 CONECT 3327 3306 CONECT 3328 3305 3329 3340 3341 CONECT 3329 3328 3330 3334 CONECT 3330 3329 3331 3339 CONECT 3331 3330 3332 3338 CONECT 3332 3331 3333 3337 CONECT 3333 3332 3334 3336 CONECT 3334 3329 3333 3335 CONECT 3335 3334 CONECT 3336 3333 CONECT 3337 3332 CONECT 3338 3331 CONECT 3339 3330 CONECT 3340 3328 CONECT 3341 3328 CONECT 3342 3305 CONECT 3343 3302 CONECT 3344 3301 CONECT 3345 3301 CONECT 3346 3278 CONECT 3347 3277 CONECT 3348 3275 CONECT 3349 3275 MASTER 0 0 0 0 0 0 0 0 3347 2 75 16 END
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Entry Information
PDB ID
3ggu
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Protease PRDRV5
Ligand Name
017
EC.Number
E.C.3.4.23.16
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
Ki=170pM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) J.Virol.
Ligand Properties
Formula
C
2
7
H
3
7
N
3
O
7
S
Molecular Weight
547.664
Exact Mass
547.235
No. of atoms
75
No. of bonds
78
Polar Surface Area
148.8
LOGP Value
2.94 (
Computed with XLOGP3
)
4.43 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 14
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 4
Canonical SMILES
CC(CN(S(=O)(=O)c1ccc(cc1)N)C[C@H]([C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@@H]2[C@H]1CCO2)O)C
InChI String
InChI=1S/C27H37N3O7S/c1-18(2)15-30(38(33,34)21-10-8-20(28)9-11-21)16-24(31)23(14-19-6-4-3-5-7-19)29-27(32)37-25-17-36-26-22(25)12-13-35-26/h3-11,18,22-26,31H,12-17,28H2,1-2H3,(H,29,32)/t22-,23-,24+,25-,26+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P03367
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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