Browse entries in the PDBbind-CN Database
HEADER 4U6Y_COMPLEX COMPND 4U6Y_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 274 GLY SER HIS SER MET ARG TYR PHE PHE THR SER VAL SER SEQRES 2 A 274 ARG PRO GLY ARG GLY GLU PRO ARG PHE ILE ALA VAL GLY SEQRES 3 A 274 TYR VAL ASP ASP THR GLN PHE VAL ARG PHE ASP SER ASP SEQRES 4 A 274 ALA ALA SER GLN ARG MET GLU PRO ARG ALA PRO TRP ILE SEQRES 5 A 274 GLU GLN GLU GLY PRO GLU TYR TRP ASP GLY GLU THR ARG SEQRES 6 A 274 LYS VAL LYS ALA HIS SER GLN THR HIS ARG VAL ASP LEU SEQRES 7 A 274 GLY THR LEU ARG GLY TYR TYR ASN GLN SER GLU ALA GLY SEQRES 8 A 274 SER HIS THR VAL GLN ARG MET TYR GLY CYS ASP VAL GLY SEQRES 9 A 274 SER ASP TRP ARG PHE LEU ARG GLY TYR HIS GLN TYR ALA SEQRES 10 A 274 TYR ASP GLY LYS ASP TYR ILE ALA LEU LYS GLU ASP LEU SEQRES 11 A 274 ARG SER TRP THR ALA ALA ASP MET ALA ALA GLN THR THR SEQRES 12 A 274 LYS HIS LYS TRP GLU ALA ALA HIS VAL ALA GLU GLN LEU SEQRES 13 A 274 ARG ALA TYR LEU GLU GLY THR CYS VAL GLU TRP LEU ARG SEQRES 14 A 274 ARG TYR LEU GLU ASN GLY LYS GLU THR LEU GLN ARG THR SEQRES 15 A 274 ASP ALA PRO LYS THR HIS MET THR HIS HIS ALA VAL SER SEQRES 16 A 274 ASP HIS GLU ALA THR LEU ARG CYS TRP ALA LEU SER PHE SEQRES 17 A 274 TYR PRO ALA GLU ILE THR LEU THR TRP GLN ARG ASP GLY SEQRES 18 A 274 GLU ASP GLN THR GLN ASP THR GLU LEU VAL GLU THR ARG SEQRES 19 A 274 PRO ALA GLY ASP GLY THR PHE GLN LYS TRP ALA ALA VAL SEQRES 20 A 274 VAL VAL PRO SER GLY GLN GLU GLN ARG TYR THR CYS HIS SEQRES 21 A 274 VAL GLN HIS GLU GLY LEU PRO LYS PRO LEU THR LEU ARG SEQRES 22 A 274 TRP SEQRES 1 B 97 GLN ARG THR PRO LYS ILE GLN VAL TYR SER ARG HIS PRO SEQRES 2 B 97 ALA GLU ASN GLY LYS SER ASN PHE LEU ASN CYS TYR VAL SEQRES 3 B 97 SER GLY PHE HIS PRO SER ASP ILE GLU VAL ASP LEU LEU SEQRES 4 B 97 LYS ASN GLY GLU ARG ILE GLU LYS VAL GLU HIS SER ASP SEQRES 5 B 97 LEU SER PHE SER LYS ASP TRP SER PHE TYR LEU LEU TYR SEQRES 6 B 97 TYR THR GLU PHE THR PRO THR GLU LYS ASP GLU TYR ALA SEQRES 7 B 97 CYS ARG VAL ASN HIS VAL THR LEU SER GLN PRO LYS ILE SEQRES 8 B 97 VAL LYS TRP ASP ARG ASP HET PHE A 895 243 SSBOND 1 CYS A 101 CYS A 164 SSBOND 2 CYS A 203 CYS A 259 SSBOND 3 CYS B 25 CYS B 80 ATOM 1 N GLY A 1 -9.121 -15.832 18.107 1.00 27.44 N ATOM 2 CA GLY A 1 -8.376 -14.727 18.669 1.00 24.09 C ATOM 3 C GLY A 1 -9.179 -13.485 18.369 1.00 21.82 C ATOM 4 O GLY A 1 -10.197 -13.567 17.701 1.00 21.27 O ATOM 5 HN3 GLY A 1 -9.226 -15.692 17.082 1.00 0.00 H ATOM 6 HN2 GLY A 1 -10.061 -15.876 18.551 1.00 0.00 H ATOM 7 HN1 GLY A 1 -8.610 -16.720 18.286 1.00 0.00 H ATOM 8 N SER A 2 -8.708 -12.365 18.881 1.00 19.39 N ATOM 9 CA SER A 2 -9.402 -11.122 18.626 1.00 18.64 C ATOM 10 C SER A 2 -9.075 -10.630 17.214 1.00 16.23 C ATOM 11 O SER A 2 -8.146 -11.121 16.574 1.00 16.33 O ATOM 12 CB SER A 2 -8.995 -10.077 19.673 1.00 20.94 C ATOM 13 OG SER A 2 -7.613 -9.744 19.613 1.00 22.57 O ATOM 14 HG SER A 2 -7.402 -9.375 18.719 1.00 0.00 H ATOM 15 H SER A 2 -7.846 -12.375 19.463 1.00 0.00 H ATOM 16 N HIS A 3 -9.850 -9.662 16.749 1.00 13.44 N ATOM 17 CA HIS A 3 -9.539 -8.958 15.498 1.00 11.68 C ATOM 18 C HIS A 3 -9.723 -7.490 15.689 1.00 12.20 C ATOM 19 O HIS A 3 -10.456 -7.039 16.562 1.00 13.72 O ATOM 20 CB HIS A 3 -10.472 -9.402 14.344 1.00 12.24 C ATOM 21 CG HIS A 3 -10.316 -10.843 13.963 1.00 13.60 C ATOM 22 ND1 HIS A 3 -9.307 -11.280 13.135 1.00 14.70 N ATOM 23 CD2 HIS A 3 -11.007 -11.939 14.347 1.00 15.03 C ATOM 24 CE1 HIS A 3 -9.425 -12.590 12.989 1.00 15.07 C ATOM 25 NE2 HIS A 3 -10.441 -13.015 13.717 1.00 16.38 N ATOM 26 H HIS A 3 -10.701 -9.393 17.283 1.00 0.00 H ATOM 27 N SER A 4 -9.076 -6.713 14.827 1.00 11.67 N ATOM 28 CA SER A 4 -9.083 -5.263 14.950 1.00 10.88 C ATOM 29 C SER A 4 -9.385 -4.576 13.644 1.00 9.53 C ATOM 30 O SER A 4 -8.961 -5.027 12.566 1.00 9.79 O ATOM 31 CB SER A 4 -7.732 -4.750 15.468 1.00 12.01 C ATOM 32 OG SER A 4 -6.687 -4.995 14.539 1.00 12.39 O ATOM 33 HG SER A 4 -6.890 -4.534 13.687 1.00 0.00 H ATOM 34 H SER A 4 -8.551 -7.152 14.044 1.00 0.00 H ATOM 35 N MET A 5 -10.101 -3.448 13.738 1.00 9.74 N ATOM 36 CA MET A 5 -10.208 -2.489 12.643 1.00 9.32 C ATOM 37 C MET A 5 -9.485 -1.240 13.123 1.00 10.06 C ATOM 38 O MET A 5 -9.662 -0.827 14.266 1.00 11.35 O ATOM 39 CB MET A 5 -11.640 -2.154 12.325 1.00 9.82 C ATOM 40 CG MET A 5 -11.664 -1.255 11.070 1.00 10.81 C ATOM 41 SD MET A 5 -13.221 -1.285 10.230 1.00 14.03 S ATOM 42 CE MET A 5 -14.355 -0.546 11.386 1.00 13.56 C ATOM 43 H MET A 5 -10.601 -3.247 14.628 1.00 0.00 H ATOM 44 N ARG A 6 -8.665 -0.646 12.266 1.00 10.44 N ATOM 45 CA ARG A 6 -7.980 0.591 12.650 1.00 10.54 C ATOM 46 C ARG A 6 -7.879 1.479 11.454 1.00 10.05 C ATOM 47 O ARG A 6 -7.567 1.055 10.336 1.00 10.90 O ATOM 48 CB ARG A 6 -6.563 0.305 13.097 1.00 12.90 C ATOM 49 CG ARG A 6 -6.461 -0.450 14.355 1.00 16.82 C ATOM 50 CD ARG A 6 -6.677 0.444 15.601 1.00 18.17 C ATOM 51 NE ARG A 6 -6.269 -0.383 16.703 1.00 18.30 N ATOM 52 CZ ARG A 6 -7.036 -1.334 17.238 1.00 18.13 C ATOM 53 NH1 ARG A 6 -8.301 -1.464 16.833 1.00 17.24 N ATOM 54 NH2 ARG A 6 -6.561 -2.092 18.209 1.00 20.84 N ATOM 55 HE ARG A 6 -5.322 -0.231 17.106 1.00 0.00 H ATOM 56 HH12 ARG A 6 -8.906 -2.203 17.245 1.00 0.00 H ATOM 57 HH11 ARG A 6 -8.682 -0.826 16.105 1.00 0.00 H ATOM 58 HH22 ARG A 6 -7.157 -2.834 18.628 1.00 0.00 H ATOM 59 HH21 ARG A 6 -5.591 -1.947 18.555 1.00 0.00 H ATOM 60 H ARG A 6 -8.509 -1.057 11.324 1.00 0.00 H ATOM 61 N TYR A 7 -8.069 2.775 11.692 1.00 8.82 N ATOM 62 CA TYR A 7 -7.734 3.787 10.720 1.00 9.28 C ATOM 63 C TYR A 7 -6.617 4.663 11.250 1.00 9.09 C ATOM 64 O TYR A 7 -6.611 5.030 12.445 1.00 10.49 O ATOM 65 CB TYR A 7 -8.949 4.693 10.409 1.00 10.69 C ATOM 66 CG TYR A 7 -9.966 4.008 9.540 1.00 10.58 C ATOM 67 CD1 TYR A 7 -9.836 4.045 8.168 1.00 11.38 C ATOM 68 CD2 TYR A 7 -11.062 3.389 10.107 1.00 11.55 C ATOM 69 CE1 TYR A 7 -10.806 3.476 7.335 1.00 11.36 C ATOM 70 CE2 TYR A 7 -12.046 2.792 9.302 1.00 11.77 C ATOM 71 CZ TYR A 7 -11.864 2.818 7.922 1.00 11.40 C ATOM 72 OH TYR A 7 -12.838 2.234 7.112 1.00 12.94 O ATOM 73 HH TYR A 7 -12.575 2.328 6.162 1.00 0.00 H ATOM 74 H TYR A 7 -8.471 3.067 12.606 1.00 0.00 H ATOM 75 N PHE A 8 -5.700 5.002 10.350 1.00 8.66 N ATOM 76 CA PHE A 8 -4.520 5.819 10.655 1.00 8.65 C ATOM 77 C PHE A 8 -4.500 7.007 9.721 1.00 8.59 C ATOM 78 O PHE A 8 -4.523 6.848 8.483 1.00 10.74 O ATOM 79 CB PHE A 8 -3.232 4.979 10.417 1.00 9.65 C ATOM 80 CG PHE A 8 -3.136 3.735 11.263 1.00 11.13 C ATOM 81 CD1 PHE A 8 -2.654 3.757 12.521 1.00 13.51 C ATOM 82 CD2 PHE A 8 -3.572 2.543 10.770 1.00 13.43 C ATOM 83 CE1 PHE A 8 -2.610 2.599 13.300 1.00 14.47 C ATOM 84 CE2 PHE A 8 -3.544 1.374 11.552 1.00 14.36 C ATOM 85 CZ PHE A 8 -3.062 1.408 12.784 1.00 13.29 C ATOM 86 H PHE A 8 -5.826 4.669 9.373 1.00 0.00 H ATOM 87 N PHE A 9 -4.491 8.210 10.310 1.00 9.36 N ATOM 88 CA PHE A 9 -4.567 9.439 9.545 1.00 9.58 C ATOM 89 C PHE A 9 -3.362 10.288 9.807 1.00 9.36 C ATOM 90 O PHE A 9 -2.986 10.474 10.960 1.00 10.38 O ATOM 91 CB PHE A 9 -5.788 10.257 9.988 1.00 10.67 C ATOM 92 CG PHE A 9 -7.092 9.490 9.953 1.00 11.01 C ATOM 93 CD1 PHE A 9 -7.873 9.453 8.804 1.00 12.87 C ATOM 94 CD2 PHE A 9 -7.532 8.785 11.070 1.00 11.66 C ATOM 95 CE1 PHE A 9 -9.078 8.721 8.789 1.00 12.68 C ATOM 96 CE2 PHE A 9 -8.747 8.093 11.063 1.00 12.13 C ATOM 97 CZ PHE A 9 -9.528 8.054 9.913 1.00 12.57 C ATOM 98 H PHE A 9 -4.428 8.264 11.347 1.00 0.00 H ATOM 99 N THR A 10 -2.795 10.859 8.738 1.00 9.00 N ATOM 100 CA THR A 10 -1.628 11.748 8.871 1.00 9.01 C ATOM 101 C THR A 10 -1.893 13.005 8.048 1.00 9.22 C ATOM 102 O THR A 10 -2.161 12.946 6.848 1.00 9.97 O ATOM 103 CB THR A 10 -0.343 11.101 8.309 1.00 9.91 C ATOM 104 OG1 THR A 10 -0.129 9.853 8.999 1.00 11.29 O ATOM 105 CG2 THR A 10 0.895 11.970 8.556 1.00 11.09 C ATOM 106 HG1 THR A 10 -0.905 9.257 8.849 1.00 0.00 H ATOM 107 H THR A 10 -3.187 10.671 7.793 1.00 0.00 H ATOM 108 N SER A 11 -1.815 14.174 8.688 1.00 8.98 N ATOM 109 CA SER A 11 -1.945 15.444 7.990 1.00 9.86 C ATOM 110 C SER A 11 -0.737 16.291 8.300 1.00 9.87 C ATOM 111 O SER A 11 -0.397 16.486 9.471 1.00 9.89 O ATOM 112 CB SER A 11 -3.196 16.108 8.548 1.00 11.04 C ATOM 113 OG SER A 11 -3.419 17.373 7.968 1.00 12.87 O ATOM 114 HG SER A 11 -3.530 17.271 6.990 1.00 0.00 H ATOM 115 H SER A 11 -1.657 14.177 9.716 1.00 0.00 H ATOM 116 N VAL A 12 -0.086 16.812 7.249 1.00 10.35 N ATOM 117 CA VAL A 12 1.161 17.562 7.383 1.00 11.57 C ATOM 118 C VAL A 12 1.022 18.890 6.727 1.00 11.85 C ATOM 119 O VAL A 12 0.703 18.955 5.505 1.00 12.24 O ATOM 120 CB VAL A 12 2.294 16.790 6.679 1.00 13.58 C ATOM 121 CG1 VAL A 12 3.639 17.536 6.808 1.00 13.75 C ATOM 122 CG2 VAL A 12 2.366 15.366 7.224 1.00 15.15 C ATOM 123 H VAL A 12 -0.486 16.676 6.299 1.00 0.00 H ATOM 124 N SER A 13 1.252 19.955 7.493 1.00 11.00 N ATOM 125 CA SER A 13 1.086 21.308 6.909 1.00 11.49 C ATOM 126 C SER A 13 2.199 21.661 5.938 1.00 13.05 C ATOM 127 O SER A 13 3.291 21.122 6.009 1.00 14.00 O ATOM 128 CB SER A 13 0.907 22.344 8.004 1.00 12.93 C ATOM 129 OG SER A 13 2.097 22.461 8.801 1.00 13.76 O ATOM 130 HG SER A 13 1.955 23.141 9.506 1.00 0.00 H ATOM 131 H SER A 13 1.543 19.840 8.485 1.00 0.00 H ATOM 132 N ARG A 14 1.865 22.525 4.989 1.00 15.28 N ATOM 133 CA ARG A 14 2.789 22.938 3.928 1.00 17.52 C ATOM 134 C ARG A 14 2.845 24.437 3.967 1.00 18.42 C ATOM 135 O ARG A 14 2.117 25.115 3.260 1.00 19.13 O ATOM 136 CB ARG A 14 2.279 22.503 2.564 1.00 20.99 C ATOM 137 CG ARG A 14 1.971 21.066 2.461 1.00 26.53 C ATOM 138 CD ARG A 14 2.783 20.496 1.325 1.00 31.99 C ATOM 139 NE ARG A 14 2.297 19.201 0.871 1.00 35.96 N ATOM 140 CZ ARG A 14 1.540 19.022 -0.211 1.00 39.27 C ATOM 141 NH1 ARG A 14 1.172 20.053 -0.966 1.00 40.31 N ATOM 142 NH2 ARG A 14 1.155 17.802 -0.541 1.00 39.92 N ATOM 143 HE ARG A 14 2.557 18.361 1.427 1.00 0.00 H ATOM 144 HH12 ARG A 14 0.581 19.897 -1.807 1.00 0.00 H ATOM 145 HH11 ARG A 14 1.475 21.016 -0.715 1.00 0.00 H ATOM 146 HH22 ARG A 14 0.564 17.653 -1.384 1.00 0.00 H ATOM 147 HH21 ARG A 14 1.443 16.990 0.042 1.00 0.00 H ATOM 148 H ARG A 14 0.906 22.927 4.998 1.00 0.00 H ATOM 149 N PRO A 15 3.734 24.969 4.802 1.00 19.15 N ATOM 150 CA PRO A 15 3.747 26.396 5.085 1.00 20.00 C ATOM 151 C PRO A 15 4.121 27.262 3.886 1.00 20.10 C ATOM 152 O PRO A 15 3.772 28.436 3.890 1.00 22.44 O ATOM 153 CB PRO A 15 4.807 26.506 6.205 1.00 20.66 C ATOM 154 CG PRO A 15 5.680 25.323 6.062 1.00 20.77 C ATOM 155 CD PRO A 15 4.749 24.227 5.580 1.00 19.89 C ATOM 156 N GLY A 16 4.821 26.705 2.908 1.00 18.39 N ATOM 157 CA GLY A 16 5.253 27.492 1.761 1.00 17.52 C ATOM 158 C GLY A 16 4.104 27.781 0.788 1.00 16.46 C ATOM 159 O GLY A 16 4.054 28.858 0.226 1.00 18.13 O ATOM 160 H GLY A 16 5.064 25.695 2.960 1.00 0.00 H ATOM 161 N ARG A 17 3.194 26.822 0.625 1.00 16.31 N ATOM 162 CA ARG A 17 2.055 27.010 -0.252 1.00 14.26 C ATOM 163 C ARG A 17 1.038 25.929 -0.062 1.00 12.98 C ATOM 164 O ARG A 17 1.402 24.755 -0.062 1.00 13.62 O ATOM 165 CB ARG A 17 2.495 26.963 -1.703 1.00 15.30 C ATOM 166 CG ARG A 17 1.280 27.131 -2.663 1.00 15.05 C ATOM 167 CD ARG A 17 1.727 27.318 -4.109 1.00 14.42 C ATOM 168 NE ARG A 17 2.223 26.058 -4.654 1.00 15.09 N ATOM 169 CZ ARG A 17 3.369 25.909 -5.314 1.00 15.14 C ATOM 170 NH1 ARG A 17 4.230 26.878 -5.504 1.00 15.07 N ATOM 171 NH2 ARG A 17 3.658 24.709 -5.786 1.00 16.59 N ATOM 172 HE ARG A 17 1.635 25.211 -4.516 1.00 0.00 H ATOM 173 HH12 ARG A 17 5.109 26.697 -6.029 1.00 0.00 H ATOM 174 HH11 ARG A 17 4.034 27.828 -5.130 1.00 0.00 H ATOM 175 HH22 ARG A 17 4.545 24.555 -6.307 1.00 0.00 H ATOM 176 HH21 ARG A 17 2.999 23.919 -5.637 1.00 0.00 H ATOM 177 H ARG A 17 3.302 25.923 1.136 1.00 0.00 H ATOM 178 N GLY A 18 -0.251 26.275 0.057 1.00 12.66 N ATOM 179 CA GLY A 18 -1.334 25.304 -0.063 1.00 12.26 C ATOM 180 C GLY A 18 -1.755 24.667 1.246 1.00 12.49 C ATOM 181 O GLY A 18 -1.282 25.070 2.329 1.00 13.63 O ATOM 182 H GLY A 18 -0.488 27.271 0.241 1.00 0.00 H ATOM 183 N GLU A 19 -2.637 23.690 1.152 1.00 13.23 N ATOM 184 CA GLU A 19 -3.233 23.106 2.341 1.00 13.72 C ATOM 185 C GLU A 19 -2.494 21.826 2.700 1.00 12.59 C ATOM 186 O GLU A 19 -1.623 21.345 1.963 1.00 11.98 O ATOM 187 CB GLU A 19 -4.737 22.893 2.118 1.00 16.88 C ATOM 188 CG GLU A 19 -5.014 21.877 1.067 1.00 19.57 C ATOM 189 CD GLU A 19 -6.353 22.042 0.370 1.00 22.26 C ATOM 190 OE1 GLU A 19 -6.976 23.130 0.410 1.00 22.42 O ATOM 191 OE2 GLU A 19 -6.769 21.037 -0.244 1.00 24.39 O ATOM 192 H GLU A 19 -2.909 23.333 0.214 1.00 0.00 H ATOM 193 N PRO A 20 -2.790 21.273 3.867 1.00 12.05 N ATOM 194 CA PRO A 20 -1.992 20.139 4.296 1.00 11.84 C ATOM 195 C PRO A 20 -2.143 18.900 3.406 1.00 12.49 C ATOM 196 O PRO A 20 -3.189 18.732 2.756 1.00 14.54 O ATOM 197 CB PRO A 20 -2.533 19.855 5.714 1.00 12.88 C ATOM 198 CG PRO A 20 -3.092 21.204 6.170 1.00 13.11 C ATOM 199 CD PRO A 20 -3.681 21.793 4.919 1.00 13.39 C ATOM 200 N ARG A 21 -1.094 18.104 3.346 1.00 12.17 N ATOM 201 CA ARG A 21 -1.119 16.768 2.689 1.00 13.81 C ATOM 202 C ARG A 21 -1.794 15.823 3.683 1.00 12.03 C ATOM 203 O ARG A 21 -1.372 15.718 4.838 1.00 13.07 O ATOM 204 CB ARG A 21 0.318 16.290 2.451 1.00 17.25 C ATOM 205 CG ARG A 21 0.491 14.795 2.013 1.00 20.97 C ATOM 206 CD ARG A 21 0.277 14.657 0.549 1.00 23.47 C ATOM 207 NE ARG A 21 0.387 13.282 0.027 1.00 24.18 N ATOM 208 CZ ARG A 21 1.508 12.727 -0.421 1.00 26.17 C ATOM 209 NH1 ARG A 21 2.655 13.401 -0.372 1.00 27.47 N ATOM 210 NH2 ARG A 21 1.476 11.492 -0.922 1.00 26.98 N ATOM 211 HE ARG A 21 -0.477 12.704 0.008 1.00 0.00 H ATOM 212 HH12 ARG A 21 3.531 12.964 -0.724 1.00 0.00 H ATOM 213 HH11 ARG A 21 2.675 14.365 0.018 1.00 0.00 H ATOM 214 HH22 ARG A 21 2.349 11.051 -1.275 1.00 0.00 H ATOM 215 HH21 ARG A 21 0.578 10.969 -0.960 1.00 0.00 H ATOM 216 H ARG A 21 -0.205 18.425 3.779 1.00 0.00 H ATOM 217 N PHE A 22 -2.826 15.123 3.254 1.00 10.82 N ATOM 218 CA PHE A 22 -3.570 14.208 4.104 1.00 10.84 C ATOM 219 C PHE A 22 -3.556 12.798 3.520 1.00 10.55 C ATOM 220 O PHE A 22 -3.887 12.608 2.380 1.00 12.58 O ATOM 221 CB PHE A 22 -5.028 14.693 4.220 1.00 11.79 C ATOM 222 CG PHE A 22 -5.898 13.849 5.114 1.00 12.76 C ATOM 223 CD1 PHE A 22 -5.790 13.905 6.470 1.00 14.59 C ATOM 224 CD2 PHE A 22 -6.887 13.050 4.542 1.00 15.83 C ATOM 225 CE1 PHE A 22 -6.627 13.124 7.294 1.00 16.62 C ATOM 226 CE2 PHE A 22 -7.737 12.329 5.362 1.00 16.30 C ATOM 227 CZ PHE A 22 -7.600 12.383 6.707 1.00 17.08 C ATOM 228 H PHE A 22 -3.121 15.230 2.263 1.00 0.00 H ATOM 229 N ILE A 23 -3.171 11.821 4.349 1.00 10.20 N ATOM 230 CA ILE A 23 -3.164 10.401 3.967 1.00 10.22 C ATOM 231 C ILE A 23 -3.935 9.651 5.025 1.00 10.50 C ATOM 232 O ILE A 23 -3.679 9.814 6.230 1.00 12.75 O ATOM 233 CB ILE A 23 -1.768 9.881 3.859 1.00 13.49 C ATOM 234 CG1 ILE A 23 -1.045 10.540 2.702 1.00 15.78 C ATOM 235 CG2 ILE A 23 -1.819 8.323 3.612 1.00 13.95 C ATOM 236 CD1 ILE A 23 0.498 10.283 2.676 1.00 17.46 C ATOM 237 H ILE A 23 -2.862 12.078 5.308 1.00 0.00 H ATOM 238 N ALA A 24 -4.898 8.804 4.607 1.00 9.92 N ATOM 239 CA ALA A 24 -5.672 7.952 5.506 1.00 9.08 C ATOM 240 C ALA A 24 -5.518 6.520 5.012 1.00 8.28 C ATOM 241 O ALA A 24 -5.613 6.284 3.813 1.00 9.57 O ATOM 242 CB ALA A 24 -7.185 8.314 5.549 1.00 11.14 C ATOM 243 H ALA A 24 -5.101 8.755 3.588 1.00 0.00 H ATOM 244 N VAL A 25 -5.283 5.620 5.933 1.00 9.02 N ATOM 245 CA VAL A 25 -5.265 4.180 5.610 1.00 9.87 C ATOM 246 C VAL A 25 -6.104 3.398 6.609 1.00 9.62 C ATOM 247 O VAL A 25 -6.194 3.745 7.798 1.00 10.46 O ATOM 248 CB VAL A 25 -3.846 3.595 5.519 1.00 10.33 C ATOM 249 CG1 VAL A 25 -3.062 4.229 4.360 1.00 10.75 C ATOM 250 CG2 VAL A 25 -3.099 3.691 6.853 1.00 11.37 C ATOM 251 H VAL A 25 -5.106 5.926 6.911 1.00 0.00 H ATOM 252 N GLY A 26 -6.798 2.381 6.120 1.00 9.37 N ATOM 253 CA GLY A 26 -7.615 1.523 6.969 1.00 9.74 C ATOM 254 C GLY A 26 -7.038 0.116 6.992 1.00 9.38 C ATOM 255 O GLY A 26 -6.647 -0.377 5.914 1.00 10.17 O ATOM 256 H GLY A 26 -6.759 2.189 5.099 1.00 0.00 H ATOM 257 N TYR A 27 -7.039 -0.531 8.170 1.00 8.86 N ATOM 258 CA TYR A 27 -6.595 -1.903 8.327 1.00 9.52 C ATOM 259 C TYR A 27 -7.607 -2.750 9.034 1.00 9.41 C ATOM 260 O TYR A 27 -8.316 -2.284 9.907 1.00 10.81 O ATOM 261 CB TYR A 27 -5.310 -1.926 9.204 1.00 9.64 C ATOM 262 CG TYR A 27 -4.032 -1.530 8.508 1.00 10.70 C ATOM 263 CD1 TYR A 27 -3.744 -0.202 8.209 1.00 13.50 C ATOM 264 CD2 TYR A 27 -3.106 -2.493 8.158 1.00 13.13 C ATOM 265 CE1 TYR A 27 -2.573 0.132 7.553 1.00 15.21 C ATOM 266 CE2 TYR A 27 -1.944 -2.153 7.538 1.00 14.36 C ATOM 267 CZ TYR A 27 -1.684 -0.845 7.245 1.00 16.25 C ATOM 268 OH TYR A 27 -0.509 -0.538 6.582 1.00 18.70 O ATOM 269 HH TYR A 27 -0.458 0.440 6.439 1.00 0.00 H ATOM 270 H TYR A 27 -7.375 -0.022 9.012 1.00 0.00 H ATOM 271 N VAL A 28 -7.669 -4.028 8.644 1.00 10.28 N ATOM 272 CA VAL A 28 -8.237 -5.076 9.484 1.00 10.13 C ATOM 273 C VAL A 28 -7.060 -5.933 9.880 1.00 10.25 C ATOM 274 O VAL A 28 -6.314 -6.447 9.040 1.00 11.83 O ATOM 275 CB VAL A 28 -9.360 -5.893 8.798 1.00 10.68 C ATOM 276 CG1 VAL A 28 -9.751 -7.128 9.699 1.00 12.29 C ATOM 277 CG2 VAL A 28 -10.606 -5.048 8.534 1.00 11.87 C ATOM 278 H VAL A 28 -7.298 -4.284 7.707 1.00 0.00 H ATOM 279 N ASP A 29 -6.790 -6.022 11.180 1.00 10.88 N ATOM 280 CA ASP A 29 -5.605 -6.733 11.653 1.00 11.75 C ATOM 281 C ASP A 29 -4.349 -6.169 10.961 1.00 10.76 C ATOM 282 O ASP A 29 -4.177 -4.947 10.927 1.00 12.05 O ATOM 283 CB ASP A 29 -5.742 -8.268 11.527 1.00 14.25 C ATOM 284 CG ASP A 29 -6.910 -8.801 12.280 1.00 15.94 C ATOM 285 OD1 ASP A 29 -7.206 -8.256 13.370 1.00 15.98 O ATOM 286 OD2 ASP A 29 -7.530 -9.762 11.775 1.00 18.93 O ATOM 287 H ASP A 29 -7.431 -5.579 11.869 1.00 0.00 H ATOM 288 N ASP A 30 -3.528 -7.008 10.327 1.00 11.74 N ATOM 289 CA ASP A 30 -2.349 -6.532 9.623 1.00 11.75 C ATOM 290 C ASP A 30 -2.538 -6.395 8.119 1.00 12.35 C ATOM 291 O ASP A 30 -1.564 -6.332 7.355 1.00 14.23 O ATOM 292 CB ASP A 30 -1.170 -7.493 9.901 1.00 13.16 C ATOM 293 CG ASP A 30 -0.712 -7.439 11.333 1.00 15.05 C ATOM 294 OD1 ASP A 30 -0.669 -6.308 11.889 1.00 17.47 O ATOM 295 OD2 ASP A 30 -0.409 -8.470 11.915 1.00 15.34 O ATOM 296 H ASP A 30 -3.737 -8.027 10.337 1.00 0.00 H ATOM 297 N THR A 31 -3.789 -6.286 7.699 1.00 10.51 N ATOM 298 CA THR A 31 -4.114 -6.135 6.276 1.00 10.97 C ATOM 299 C THR A 31 -4.675 -4.762 5.956 1.00 11.12 C ATOM 300 O THR A 31 -5.777 -4.413 6.434 1.00 11.33 O ATOM 301 CB THR A 31 -5.165 -7.182 5.881 1.00 12.31 C ATOM 302 OG1 THR A 31 -4.639 -8.506 6.121 1.00 13.77 O ATOM 303 CG2 THR A 31 -5.523 -7.068 4.388 1.00 12.98 C ATOM 304 HG1 THR A 31 -4.420 -8.604 7.081 1.00 0.00 H ATOM 305 H THR A 31 -4.561 -6.308 8.395 1.00 0.00 H ATOM 306 N GLN A 32 -3.950 -3.993 5.144 1.00 11.32 N ATOM 307 CA GLN A 32 -4.509 -2.696 4.687 1.00 10.76 C ATOM 308 C GLN A 32 -5.660 -2.960 3.698 1.00 10.95 C ATOM 309 O GLN A 32 -5.547 -3.843 2.816 1.00 13.53 O ATOM 310 CB GLN A 32 -3.432 -1.870 4.010 1.00 13.33 C ATOM 311 CG GLN A 32 -3.849 -0.397 3.873 1.00 15.14 C ATOM 312 CD GLN A 32 -3.029 0.331 2.874 1.00 17.37 C ATOM 313 OE1 GLN A 32 -1.903 -0.029 2.584 1.00 20.64 O ATOM 314 NE2 GLN A 32 -3.608 1.383 2.315 1.00 14.71 N ATOM 315 HE22 GLN A 32 -4.573 1.655 2.593 1.00 0.00 H ATOM 316 HE21 GLN A 32 -3.098 1.937 1.598 1.00 0.00 H ATOM 317 H GLN A 32 -3.005 -4.298 4.835 1.00 0.00 H ATOM 318 N PHE A 33 -6.761 -2.219 3.820 1.00 9.75 N ATOM 319 CA PHE A 33 -7.875 -2.437 2.928 1.00 9.44 C ATOM 320 C PHE A 33 -8.386 -1.216 2.176 1.00 9.09 C ATOM 321 O PHE A 33 -9.058 -1.394 1.130 1.00 10.16 O ATOM 322 CB PHE A 33 -9.036 -3.235 3.618 1.00 10.02 C ATOM 323 CG PHE A 33 -9.835 -2.433 4.602 1.00 10.18 C ATOM 324 CD1 PHE A 33 -9.380 -2.243 5.914 1.00 10.28 C ATOM 325 CD2 PHE A 33 -11.074 -1.890 4.237 1.00 10.31 C ATOM 326 CE1 PHE A 33 -10.127 -1.479 6.830 1.00 10.51 C ATOM 327 CE2 PHE A 33 -11.810 -1.159 5.141 1.00 11.23 C ATOM 328 CZ PHE A 33 -11.348 -0.931 6.448 1.00 10.63 C ATOM 329 H PHE A 33 -6.817 -1.486 4.556 1.00 0.00 H ATOM 330 N VAL A 34 -8.070 -0.016 2.666 1.00 9.39 N ATOM 331 CA VAL A 34 -8.447 1.195 1.932 1.00 9.59 C ATOM 332 C VAL A 34 -7.381 2.245 2.142 1.00 9.36 C ATOM 333 O VAL A 34 -6.569 2.191 3.097 1.00 9.81 O ATOM 334 CB VAL A 34 -9.832 1.819 2.409 1.00 9.80 C ATOM 335 CG1 VAL A 34 -11.045 0.992 1.977 1.00 11.30 C ATOM 336 CG2 VAL A 34 -9.874 2.041 3.965 1.00 10.75 C ATOM 337 H VAL A 34 -7.557 0.060 3.567 1.00 0.00 H ATOM 338 N ARG A 35 -7.393 3.230 1.258 1.00 9.17 N ATOM 339 CA ARG A 35 -6.543 4.419 1.373 1.00 9.77 C ATOM 340 C ARG A 35 -7.249 5.641 0.804 1.00 9.28 C ATOM 341 O ARG A 35 -8.174 5.579 -0.067 1.00 9.38 O ATOM 342 CB ARG A 35 -5.209 4.258 0.612 1.00 10.96 C ATOM 343 CG ARG A 35 -5.393 4.213 -0.931 1.00 12.62 C ATOM 344 CD ARG A 35 -4.091 4.393 -1.672 1.00 13.84 C ATOM 345 NE ARG A 35 -4.289 4.322 -3.113 1.00 14.52 N ATOM 346 CZ ARG A 35 -3.350 3.916 -3.942 1.00 15.04 C ATOM 347 NH1 ARG A 35 -2.156 3.605 -3.465 1.00 15.26 N ATOM 348 NH2 ARG A 35 -3.597 3.886 -5.249 1.00 16.18 N ATOM 349 HE ARG A 35 -5.211 4.604 -3.504 1.00 0.00 H ATOM 350 HH12 ARG A 35 -1.406 3.283 -4.110 1.00 0.00 H ATOM 351 HH11 ARG A 35 -1.967 3.682 -2.445 1.00 0.00 H ATOM 352 HH22 ARG A 35 -2.861 3.567 -5.910 1.00 0.00 H ATOM 353 HH21 ARG A 35 -4.527 4.182 -5.609 1.00 0.00 H ATOM 354 H ARG A 35 -8.036 3.157 0.444 1.00 0.00 H ATOM 355 N PHE A 36 -6.763 6.778 1.264 1.00 9.39 N ATOM 356 CA PHE A 36 -7.047 8.065 0.624 1.00 9.34 C ATOM 357 C PHE A 36 -5.790 8.890 0.673 1.00 9.98 C ATOM 358 O PHE A 36 -5.108 8.934 1.701 1.00 10.92 O ATOM 359 CB PHE A 36 -8.180 8.823 1.373 1.00 10.66 C ATOM 360 CG PHE A 36 -8.477 10.164 0.789 1.00 10.64 C ATOM 361 CD1 PHE A 36 -9.349 10.278 -0.254 1.00 12.00 C ATOM 362 CD2 PHE A 36 -7.916 11.314 1.314 1.00 12.86 C ATOM 363 CE1 PHE A 36 -9.661 11.533 -0.785 1.00 12.84 C ATOM 364 CE2 PHE A 36 -8.214 12.593 0.790 1.00 13.36 C ATOM 365 CZ PHE A 36 -9.086 12.685 -0.271 1.00 13.45 C ATOM 366 H PHE A 36 -6.158 6.760 2.110 1.00 0.00 H ATOM 367 N ASP A 37 -5.465 9.590 -0.407 1.00 10.92 N ATOM 368 CA ASP A 37 -4.287 10.478 -0.400 1.00 13.07 C ATOM 369 C ASP A 37 -4.749 11.732 -1.096 1.00 13.51 C ATOM 370 O ASP A 37 -5.151 11.719 -2.271 1.00 14.28 O ATOM 371 CB ASP A 37 -3.147 9.827 -1.177 1.00 15.81 C ATOM 372 CG ASP A 37 -1.877 10.699 -1.251 1.00 19.68 C ATOM 373 OD1 ASP A 37 -1.911 11.897 -0.922 1.00 19.15 O ATOM 374 OD2 ASP A 37 -0.841 10.152 -1.652 1.00 24.13 O ATOM 375 H ASP A 37 -6.046 9.512 -1.266 1.00 0.00 H ATOM 376 N SER A 38 -4.654 12.839 -0.387 1.00 13.64 N ATOM 377 CA SER A 38 -5.087 14.105 -0.945 1.00 15.72 C ATOM 378 C SER A 38 -4.274 14.519 -2.169 1.00 16.84 C ATOM 379 O SER A 38 -4.757 15.327 -2.982 1.00 17.12 O ATOM 380 CB SER A 38 -5.099 15.208 0.131 1.00 17.18 C ATOM 381 OG SER A 38 -3.786 15.506 0.531 1.00 18.20 O ATOM 382 HG SER A 38 -3.267 15.820 -0.251 1.00 0.00 H ATOM 383 H SER A 38 -4.267 12.804 0.577 1.00 0.00 H ATOM 384 N ASP A 39 -3.102 13.931 -2.350 1.00 17.45 N ATOM 385 CA ASP A 39 -2.269 14.293 -3.508 1.00 21.26 C ATOM 386 C ASP A 39 -2.586 13.470 -4.744 1.00 19.53 C ATOM 387 O ASP A 39 -2.056 13.727 -5.834 1.00 21.38 O ATOM 388 CB ASP A 39 -0.783 14.172 -3.168 1.00 26.49 C ATOM 389 CG ASP A 39 -0.174 15.511 -2.726 1.00 32.13 C ATOM 390 OD1 ASP A 39 -0.937 16.436 -2.367 1.00 34.43 O ATOM 391 OD2 ASP A 39 1.069 15.648 -2.748 1.00 34.66 O ATOM 392 H ASP A 39 -2.770 13.214 -1.674 1.00 0.00 H ATOM 393 N ALA A 40 -3.429 12.467 -4.589 1.00 18.18 N ATOM 394 CA ALA A 40 -3.760 11.605 -5.730 1.00 17.67 C ATOM 395 C ALA A 40 -4.869 12.239 -6.563 1.00 17.68 C ATOM 396 O ALA A 40 -5.594 13.109 -6.093 1.00 17.66 O ATOM 397 CB ALA A 40 -4.159 10.184 -5.238 1.00 17.98 C ATOM 398 H ALA A 40 -3.859 12.287 -3.659 1.00 0.00 H ATOM 399 N ALA A 41 -5.033 11.800 -7.807 1.00 17.92 N ATOM 400 CA ALA A 41 -6.021 12.408 -8.705 1.00 17.97 C ATOM 401 C ALA A 41 -7.469 12.043 -8.420 1.00 17.15 C ATOM 402 O ALA A 41 -8.371 12.856 -8.696 1.00 17.68 O ATOM 403 CB ALA A 41 -5.685 12.029 -10.155 1.00 18.47 C ATOM 404 H ALA A 41 -4.450 11.010 -8.150 1.00 0.00 H ATOM 405 N SER A 42 -7.725 10.847 -7.911 1.00 16.99 N ATOM 406 CA SER A 42 -9.104 10.413 -7.832 1.00 15.97 C ATOM 407 C SER A 42 -9.931 11.185 -6.829 1.00 14.53 C ATOM 408 O SER A 42 -11.145 11.356 -7.060 1.00 15.13 O ATOM 409 CB SER A 42 -9.188 8.941 -7.458 1.00 16.57 C ATOM 410 OG SER A 42 -8.755 8.721 -6.133 1.00 17.20 O ATOM 411 HG SER A 42 -8.822 7.756 -5.921 1.00 0.00 H ATOM 412 H SER A 42 -6.954 10.235 -7.576 1.00 0.00 H ATOM 413 N GLN A 43 -9.290 11.667 -5.751 1.00 14.04 N ATOM 414 CA GLN A 43 -9.997 12.297 -4.640 1.00 13.20 C ATOM 415 C GLN A 43 -11.037 11.366 -4.063 1.00 12.29 C ATOM 416 O GLN A 43 -12.072 11.811 -3.588 1.00 13.16 O ATOM 417 CB GLN A 43 -10.575 13.663 -5.068 1.00 13.72 C ATOM 418 CG GLN A 43 -9.471 14.646 -5.493 1.00 14.51 C ATOM 419 CD GLN A 43 -8.637 15.077 -4.314 1.00 15.35 C ATOM 420 OE1 GLN A 43 -9.155 15.627 -3.328 1.00 17.25 O ATOM 421 NE2 GLN A 43 -7.333 14.824 -4.384 1.00 15.64 N ATOM 422 HE22 GLN A 43 -6.938 14.362 -5.227 1.00 0.00 H ATOM 423 HE21 GLN A 43 -6.709 15.089 -3.595 1.00 0.00 H ATOM 424 H GLN A 43 -8.254 11.589 -5.707 1.00 0.00 H ATOM 425 N ARG A 44 -10.761 10.072 -4.140 1.00 12.74 N ATOM 426 CA ARG A 44 -11.664 9.045 -3.630 1.00 13.23 C ATOM 427 C ARG A 44 -10.963 8.126 -2.625 1.00 12.81 C ATOM 428 O ARG A 44 -9.823 7.897 -2.707 1.00 13.50 O ATOM 429 CB ARG A 44 -12.189 8.191 -4.778 1.00 16.51 C ATOM 430 CG ARG A 44 -12.923 8.970 -5.845 1.00 21.76 C ATOM 431 CD ARG A 44 -14.372 9.058 -5.577 1.00 24.59 C ATOM 432 NE ARG A 44 -14.993 7.753 -5.743 1.00 26.39 N ATOM 433 CZ ARG A 44 -16.256 7.521 -5.465 1.00 28.27 C ATOM 434 NH1 ARG A 44 -16.981 8.491 -5.022 1.00 28.23 N ATOM 435 NH2 ARG A 44 -16.750 6.314 -5.573 1.00 28.18 N ATOM 436 HE ARG A 44 -14.411 6.968 -6.098 1.00 0.00 H ATOM 437 HH12 ARG A 44 -17.983 8.330 -4.796 1.00 0.00 H ATOM 438 HH11 ARG A 44 -16.564 9.435 -4.891 1.00 0.00 H ATOM 439 HH22 ARG A 44 -17.751 6.140 -5.351 1.00 0.00 H ATOM 440 HH21 ARG A 44 -16.142 5.529 -5.881 1.00 0.00 H ATOM 441 H ARG A 44 -9.866 9.777 -4.581 1.00 0.00 H ATOM 442 N MET A 45 -11.737 7.587 -1.711 1.00 11.47 N ATOM 443 CA MET A 45 -11.308 6.417 -1.000 1.00 10.95 C ATOM 444 C MET A 45 -11.220 5.268 -1.998 1.00 11.63 C ATOM 445 O MET A 45 -12.089 5.142 -2.751 1.00 12.22 O ATOM 446 CB MET A 45 -12.295 6.070 0.114 1.00 11.79 C ATOM 447 CG MET A 45 -11.776 5.003 1.069 1.00 12.23 C ATOM 448 SD MET A 45 -10.472 5.625 2.176 1.00 13.49 S ATOM 449 CE MET A 45 -11.440 5.927 3.699 1.00 14.43 C ATOM 450 H MET A 45 -12.664 8.010 -1.502 1.00 0.00 H ATOM 451 N GLU A 46 -10.079 4.595 -1.962 1.00 10.26 N ATOM 452 CA GLU A 46 -9.819 3.524 -2.934 1.00 10.48 C ATOM 453 C GLU A 46 -9.490 2.193 -2.242 1.00 10.58 C ATOM 454 O GLU A 46 -8.840 2.173 -1.205 1.00 10.14 O ATOM 455 CB GLU A 46 -8.651 3.892 -3.834 1.00 10.90 C ATOM 456 CG GLU A 46 -8.871 5.141 -4.664 1.00 11.85 C ATOM 457 CD GLU A 46 -7.618 5.582 -5.385 1.00 14.70 C ATOM 458 OE1 GLU A 46 -6.495 5.264 -4.907 1.00 16.98 O ATOM 459 OE2 GLU A 46 -7.758 6.288 -6.409 1.00 15.82 O ATOM 460 H GLU A 46 -9.364 4.826 -1.243 1.00 0.00 H ATOM 461 N PRO A 47 -9.891 1.083 -2.858 1.00 11.68 N ATOM 462 CA PRO A 47 -9.663 -0.249 -2.287 1.00 11.87 C ATOM 463 C PRO A 47 -8.219 -0.670 -2.381 1.00 11.98 C ATOM 464 O PRO A 47 -7.517 -0.330 -3.346 1.00 12.76 O ATOM 465 CB PRO A 47 -10.530 -1.186 -3.167 1.00 12.51 C ATOM 466 CG PRO A 47 -10.564 -0.444 -4.526 1.00 12.76 C ATOM 467 CD PRO A 47 -10.595 1.036 -4.153 1.00 12.60 C ATOM 468 N ARG A 48 -7.782 -1.416 -1.351 1.00 11.74 N ATOM 469 CA ARG A 48 -6.426 -1.946 -1.346 1.00 12.45 C ATOM 470 C ARG A 48 -6.403 -3.449 -0.994 1.00 13.95 C ATOM 471 O ARG A 48 -5.345 -4.024 -0.889 1.00 15.56 O ATOM 472 CB ARG A 48 -5.546 -1.134 -0.373 1.00 13.80 C ATOM 473 CG ARG A 48 -5.320 0.325 -0.767 1.00 15.90 C ATOM 474 CD ARG A 48 -4.549 0.485 -2.072 1.00 19.05 C ATOM 475 NE ARG A 48 -3.132 0.672 -1.819 1.00 20.90 N ATOM 476 CZ ARG A 48 -2.147 0.500 -2.706 1.00 22.54 C ATOM 477 NH1 ARG A 48 -0.873 0.670 -2.330 1.00 22.19 N ATOM 478 NH2 ARG A 48 -2.407 0.149 -3.974 1.00 24.16 N ATOM 479 HE ARG A 48 -2.858 0.967 -0.860 1.00 0.00 H ATOM 480 HH12 ARG A 48 -0.105 0.537 -3.019 1.00 0.00 H ATOM 481 HH11 ARG A 48 -0.651 0.935 -1.349 1.00 0.00 H ATOM 482 HH22 ARG A 48 -1.626 0.020 -4.649 1.00 0.00 H ATOM 483 HH21 ARG A 48 -3.390 0.006 -4.283 1.00 0.00 H ATOM 484 H ARG A 48 -8.417 -1.616 -0.552 1.00 0.00 H ATOM 485 N ALA A 49 -7.574 -4.059 -0.832 1.00 13.83 N ATOM 486 CA ALA A 49 -7.686 -5.532 -0.651 1.00 13.78 C ATOM 487 C ALA A 49 -8.887 -5.986 -1.467 1.00 15.74 C ATOM 488 O ALA A 49 -9.871 -5.255 -1.619 1.00 16.01 O ATOM 489 CB ALA A 49 -7.893 -5.855 0.822 1.00 14.68 C ATOM 490 H ALA A 49 -8.442 -3.486 -0.832 1.00 0.00 H ATOM 491 N PRO A 50 -8.856 -7.214 -1.987 1.00 17.40 N ATOM 492 CA PRO A 50 -9.914 -7.566 -2.933 1.00 17.71 C ATOM 493 C PRO A 50 -11.285 -7.640 -2.264 1.00 16.36 C ATOM 494 O PRO A 50 -12.296 -7.361 -2.911 1.00 16.30 O ATOM 495 CB PRO A 50 -9.477 -8.947 -3.440 1.00 19.42 C ATOM 496 CG PRO A 50 -7.941 -8.907 -3.266 1.00 21.28 C ATOM 497 CD PRO A 50 -7.745 -8.173 -1.962 1.00 19.20 C ATOM 498 N TRP A 51 -11.346 -8.036 -1.008 1.00 14.67 N ATOM 499 CA TRP A 51 -12.621 -8.298 -0.364 1.00 14.88 C ATOM 500 C TRP A 51 -13.443 -7.048 -0.087 1.00 15.25 C ATOM 501 O TRP A 51 -14.667 -7.138 0.077 1.00 15.54 O ATOM 502 CB TRP A 51 -12.483 -9.162 0.937 1.00 14.95 C ATOM 503 CG TRP A 51 -11.416 -8.673 1.850 1.00 14.33 C ATOM 504 CD1 TRP A 51 -10.132 -9.135 1.918 1.00 14.06 C ATOM 505 CD2 TRP A 51 -11.503 -7.583 2.774 1.00 13.55 C ATOM 506 NE1 TRP A 51 -9.411 -8.422 2.845 1.00 13.37 N ATOM 507 CE2 TRP A 51 -10.224 -7.456 3.391 1.00 13.02 C ATOM 508 CE3 TRP A 51 -12.546 -6.742 3.195 1.00 14.33 C ATOM 509 CZ2 TRP A 51 -9.968 -6.502 4.381 1.00 13.58 C ATOM 510 CZ3 TRP A 51 -12.260 -5.785 4.178 1.00 14.58 C ATOM 511 CH2 TRP A 51 -11.004 -5.683 4.750 1.00 13.88 C ATOM 512 HE1 TRP A 51 -8.414 -8.586 3.093 1.00 0.00 H ATOM 513 H TRP A 51 -10.466 -8.163 -0.469 1.00 0.00 H ATOM 514 N ILE A 52 -12.800 -5.886 -0.083 1.00 13.76 N ATOM 515 CA ILE A 52 -13.551 -4.676 0.119 1.00 12.47 C ATOM 516 C ILE A 52 -14.239 -4.259 -1.180 1.00 14.07 C ATOM 517 O ILE A 52 -15.205 -3.500 -1.157 1.00 14.83 O ATOM 518 CB ILE A 52 -12.659 -3.557 0.714 1.00 11.82 C ATOM 519 CG1 ILE A 52 -13.519 -2.430 1.309 1.00 12.11 C ATOM 520 CG2 ILE A 52 -11.773 -2.972 -0.358 1.00 12.06 C ATOM 521 CD1 ILE A 52 -14.336 -2.889 2.520 1.00 12.91 C ATOM 522 H ILE A 52 -11.770 -5.851 -0.224 1.00 0.00 H ATOM 523 N GLU A 53 -13.809 -4.828 -2.304 1.00 15.15 N ATOM 524 CA GLU A 53 -14.499 -4.507 -3.563 1.00 16.44 C ATOM 525 C GLU A 53 -15.889 -5.138 -3.657 1.00 17.60 C ATOM 526 O GLU A 53 -16.639 -4.876 -4.611 1.00 20.81 O ATOM 527 CB GLU A 53 -13.588 -4.861 -4.742 1.00 19.24 C ATOM 528 CG GLU A 53 -12.225 -4.185 -4.636 1.00 24.05 C ATOM 529 CD GLU A 53 -11.315 -4.583 -5.761 1.00 30.31 C ATOM 530 OE1 GLU A 53 -11.841 -5.013 -6.805 1.00 32.59 O ATOM 531 OE2 GLU A 53 -10.082 -4.483 -5.610 1.00 33.05 O ATOM 532 H GLU A 53 -13.003 -5.485 -2.292 1.00 0.00 H ATOM 533 N GLN A 54 -16.230 -5.984 -2.691 1.00 17.54 N ATOM 534 CA GLN A 54 -17.587 -6.540 -2.577 1.00 17.48 C ATOM 535 C GLN A 54 -18.592 -5.445 -2.219 1.00 18.08 C ATOM 536 O GLN A 54 -19.801 -5.624 -2.426 1.00 20.23 O ATOM 537 CB GLN A 54 -17.634 -7.642 -1.482 1.00 17.69 C ATOM 538 CG GLN A 54 -16.915 -8.960 -1.914 1.00 19.16 C ATOM 539 CD GLN A 54 -16.804 -9.950 -0.791 1.00 19.81 C ATOM 540 OE1 GLN A 54 -17.756 -10.133 -0.023 1.00 21.19 O ATOM 541 NE2 GLN A 54 -15.662 -10.662 -0.717 1.00 19.87 N ATOM 542 HE22 GLN A 54 -14.887 -10.473 -1.385 1.00 0.00 H ATOM 543 HE21 GLN A 54 -15.556 -11.400 0.008 1.00 0.00 H ATOM 544 H GLN A 54 -15.513 -6.263 -1.991 1.00 0.00 H ATOM 545 N GLU A 55 -18.126 -4.313 -1.716 1.00 17.06 N ATOM 546 CA GLU A 55 -19.054 -3.259 -1.316 1.00 17.30 C ATOM 547 C GLU A 55 -19.546 -2.477 -2.533 1.00 19.59 C ATOM 548 O GLU A 55 -18.790 -2.286 -3.495 1.00 22.76 O ATOM 549 CB GLU A 55 -18.343 -2.274 -0.404 1.00 17.10 C ATOM 550 CG GLU A 55 -17.887 -2.867 0.916 1.00 18.54 C ATOM 551 CD GLU A 55 -19.022 -3.514 1.679 1.00 22.14 C ATOM 552 OE1 GLU A 55 -20.165 -3.007 1.592 1.00 23.34 O ATOM 553 OE2 GLU A 55 -18.775 -4.546 2.301 1.00 24.99 O ATOM 554 H GLU A 55 -17.101 -4.174 -1.606 1.00 0.00 H ATOM 555 N GLY A 56 -20.778 -1.959 -2.457 1.00 18.27 N ATOM 556 CA GLY A 56 -21.391 -1.296 -3.606 1.00 18.27 C ATOM 557 C GLY A 56 -20.938 0.147 -3.796 1.00 17.35 C ATOM 558 O GLY A 56 -20.118 0.689 -3.019 1.00 17.19 O ATOM 559 H GLY A 56 -21.308 -2.030 -1.565 1.00 0.00 H ATOM 560 N PRO A 57 -21.475 0.814 -4.824 1.00 17.79 N ATOM 561 CA PRO A 57 -21.009 2.159 -5.116 1.00 17.55 C ATOM 562 C PRO A 57 -21.310 3.135 -3.990 1.00 17.26 C ATOM 563 O PRO A 57 -20.575 4.112 -3.813 1.00 17.87 O ATOM 564 CB PRO A 57 -21.791 2.541 -6.400 1.00 18.10 C ATOM 565 CG PRO A 57 -22.888 1.573 -6.497 1.00 18.25 C ATOM 566 CD PRO A 57 -22.430 0.319 -5.836 1.00 18.00 C ATOM 567 N GLU A 58 -22.365 2.867 -3.226 1.00 16.67 N ATOM 568 CA GLU A 58 -22.726 3.750 -2.109 1.00 16.69 C ATOM 569 C GLU A 58 -21.638 3.725 -1.036 1.00 15.73 C ATOM 570 O GLU A 58 -21.443 4.698 -0.326 1.00 15.97 O ATOM 571 CB GLU A 58 -24.089 3.359 -1.530 1.00 18.99 C ATOM 572 CG GLU A 58 -24.133 2.024 -0.741 1.00 20.74 C ATOM 573 CD GLU A 58 -23.830 0.766 -1.565 1.00 22.43 C ATOM 574 OE1 GLU A 58 -24.255 0.700 -2.755 1.00 22.45 O ATOM 575 OE2 GLU A 58 -23.188 -0.155 -1.008 1.00 22.76 O ATOM 576 H GLU A 58 -22.941 2.023 -3.421 1.00 0.00 H ATOM 577 N TYR A 59 -20.953 2.606 -0.903 1.00 14.30 N ATOM 578 CA TYR A 59 -19.918 2.516 0.106 1.00 13.12 C ATOM 579 C TYR A 59 -18.784 3.469 -0.248 1.00 12.80 C ATOM 580 O TYR A 59 -18.333 4.250 0.590 1.00 13.36 O ATOM 581 CB TYR A 59 -19.415 1.058 0.198 1.00 11.52 C ATOM 582 CG TYR A 59 -18.251 0.912 1.156 1.00 9.98 C ATOM 583 CD1 TYR A 59 -18.501 0.683 2.481 1.00 10.81 C ATOM 584 CD2 TYR A 59 -16.912 0.997 0.727 1.00 10.99 C ATOM 585 CE1 TYR A 59 -17.431 0.531 3.416 1.00 11.16 C ATOM 586 CE2 TYR A 59 -15.853 0.859 1.612 1.00 10.76 C ATOM 587 CZ TYR A 59 -16.114 0.618 2.960 1.00 10.06 C ATOM 588 OH TYR A 59 -15.083 0.431 3.823 1.00 11.03 O ATOM 589 HH TYR A 59 -15.440 0.273 4.733 1.00 0.00 H ATOM 590 H TYR A 59 -21.155 1.793 -1.519 1.00 0.00 H ATOM 591 N TRP A 60 -18.331 3.456 -1.492 1.00 12.72 N ATOM 592 CA TRP A 60 -17.231 4.289 -1.911 1.00 12.64 C ATOM 593 C TRP A 60 -17.616 5.762 -1.841 1.00 12.33 C ATOM 594 O TRP A 60 -16.804 6.590 -1.433 1.00 13.50 O ATOM 595 CB TRP A 60 -16.706 3.862 -3.295 1.00 13.88 C ATOM 596 CG TRP A 60 -16.246 2.447 -3.189 1.00 13.42 C ATOM 597 CD1 TRP A 60 -16.878 1.330 -3.659 1.00 13.28 C ATOM 598 CD2 TRP A 60 -15.104 1.992 -2.467 1.00 12.41 C ATOM 599 NE1 TRP A 60 -16.187 0.204 -3.271 1.00 13.75 N ATOM 600 CE2 TRP A 60 -15.094 0.589 -2.524 1.00 12.08 C ATOM 601 CE3 TRP A 60 -14.086 2.654 -1.774 1.00 12.77 C ATOM 602 CZ2 TRP A 60 -14.081 -0.171 -1.933 1.00 12.54 C ATOM 603 CZ3 TRP A 60 -13.081 1.917 -1.169 1.00 12.91 C ATOM 604 CH2 TRP A 60 -13.087 0.511 -1.253 1.00 12.85 C ATOM 605 HE1 TRP A 60 -16.447 -0.776 -3.503 1.00 0.00 H ATOM 606 H TRP A 60 -18.781 2.827 -2.187 1.00 0.00 H ATOM 607 N ASP A 61 -18.842 6.109 -2.231 1.00 12.02 N ATOM 608 CA ASP A 61 -19.252 7.517 -2.131 1.00 12.31 C ATOM 609 C ASP A 61 -19.245 7.939 -0.648 1.00 12.08 C ATOM 610 O ASP A 61 -18.791 9.038 -0.328 1.00 13.04 O ATOM 611 CB ASP A 61 -20.644 7.690 -2.713 1.00 15.08 C ATOM 612 CG ASP A 61 -20.679 7.571 -4.209 1.00 18.58 C ATOM 613 OD1 ASP A 61 -19.621 7.588 -4.852 1.00 21.68 O ATOM 614 OD2 ASP A 61 -21.808 7.448 -4.743 1.00 20.83 O ATOM 615 H ASP A 61 -19.500 5.393 -2.601 1.00 0.00 H ATOM 616 N GLY A 62 -19.782 7.092 0.249 1.00 11.52 N ATOM 617 CA GLY A 62 -19.868 7.464 1.653 1.00 11.55 C ATOM 618 C GLY A 62 -18.521 7.584 2.332 1.00 11.11 C ATOM 619 O GLY A 62 -18.271 8.513 3.106 1.00 12.29 O ATOM 620 H GLY A 62 -20.138 6.166 -0.063 1.00 0.00 H ATOM 621 N GLU A 63 -17.657 6.619 2.059 1.00 9.94 N ATOM 622 CA GLU A 63 -16.323 6.680 2.682 1.00 9.52 C ATOM 623 C GLU A 63 -15.511 7.835 2.126 1.00 10.42 C ATOM 624 O GLU A 63 -14.722 8.430 2.864 1.00 11.08 O ATOM 625 CB GLU A 63 -15.574 5.361 2.401 1.00 9.54 C ATOM 626 CG GLU A 63 -16.246 4.101 3.069 1.00 10.58 C ATOM 627 CD GLU A 63 -16.551 4.301 4.547 1.00 10.99 C ATOM 628 OE1 GLU A 63 -15.572 4.474 5.304 1.00 11.82 O ATOM 629 OE2 GLU A 63 -17.742 4.273 4.936 1.00 11.87 O ATOM 630 H GLU A 63 -17.913 5.838 1.421 1.00 0.00 H ATOM 631 N THR A 64 -15.714 8.188 0.858 1.00 9.89 N ATOM 632 CA THR A 64 -15.033 9.368 0.317 1.00 10.22 C ATOM 633 C THR A 64 -15.536 10.635 0.995 1.00 10.21 C ATOM 634 O THR A 64 -14.725 11.485 1.365 1.00 11.59 O ATOM 635 CB THR A 64 -15.259 9.439 -1.195 1.00 11.42 C ATOM 636 OG1 THR A 64 -14.648 8.301 -1.834 1.00 11.70 O ATOM 637 CG2 THR A 64 -14.681 10.718 -1.831 1.00 12.61 C ATOM 638 HG1 THR A 64 -15.052 7.469 -1.481 1.00 0.00 H ATOM 639 H THR A 64 -16.352 7.630 0.255 1.00 0.00 H ATOM 640 N ARG A 65 -16.849 10.749 1.179 1.00 10.21 N ATOM 641 CA ARG A 65 -17.382 11.942 1.843 1.00 10.52 C ATOM 642 C ARG A 65 -16.805 12.027 3.243 1.00 10.24 C ATOM 643 O ARG A 65 -16.328 13.096 3.670 1.00 11.50 O ATOM 644 CB ARG A 65 -18.919 11.928 1.893 1.00 12.38 C ATOM 645 CG ARG A 65 -19.519 13.151 2.607 1.00 14.24 C ATOM 646 CD ARG A 65 -21.051 13.080 2.746 1.00 16.84 C ATOM 647 NE ARG A 65 -21.463 11.739 3.169 1.00 19.93 N ATOM 648 CZ ARG A 65 -21.461 11.290 4.424 1.00 20.65 C ATOM 649 NH1 ARG A 65 -21.855 10.050 4.648 1.00 21.32 N ATOM 650 NH2 ARG A 65 -21.075 12.042 5.443 1.00 21.09 N ATOM 651 HE ARG A 65 -21.784 11.083 2.428 1.00 0.00 H ATOM 652 HH12 ARG A 65 -21.863 9.674 5.618 1.00 0.00 H ATOM 653 HH11 ARG A 65 -22.157 9.449 3.855 1.00 0.00 H ATOM 654 HH22 ARG A 65 -21.088 11.656 6.408 1.00 0.00 H ATOM 655 HH21 ARG A 65 -20.759 13.019 5.278 1.00 0.00 H ATOM 656 H ARG A 65 -17.491 9.998 0.855 1.00 0.00 H ATOM 657 N LYS A 66 -16.824 10.909 3.973 1.00 10.46 N ATOM 658 CA LYS A 66 -16.331 10.963 5.334 1.00 10.09 C ATOM 659 C LYS A 66 -14.818 11.239 5.406 1.00 10.54 C ATOM 660 O LYS A 66 -14.365 12.003 6.284 1.00 11.02 O ATOM 661 CB LYS A 66 -16.696 9.671 6.069 1.00 10.06 C ATOM 662 CG LYS A 66 -18.185 9.595 6.362 1.00 10.87 C ATOM 663 CD LYS A 66 -18.520 8.299 7.129 1.00 11.32 C ATOM 664 CE LYS A 66 -18.294 7.110 6.228 1.00 10.95 C ATOM 665 NZ LYS A 66 -18.778 5.845 6.917 1.00 11.87 N ATOM 666 HZ1 LYS A 66 -18.251 5.711 7.804 1.00 0.00 H ATOM 667 HZ2 LYS A 66 -19.793 5.932 7.125 1.00 0.00 H ATOM 668 HZ3 LYS A 66 -18.620 5.029 6.292 1.00 0.00 H ATOM 669 H LYS A 66 -17.185 10.019 3.573 1.00 0.00 H ATOM 670 N VAL A 67 -14.027 10.674 4.491 1.00 9.89 N ATOM 671 CA VAL A 67 -12.580 10.834 4.611 1.00 9.39 C ATOM 672 C VAL A 67 -12.216 12.274 4.238 1.00 9.75 C ATOM 673 O VAL A 67 -11.291 12.823 4.825 1.00 10.51 O ATOM 674 CB VAL A 67 -11.818 9.710 3.809 1.00 10.04 C ATOM 675 CG1 VAL A 67 -11.678 10.074 2.316 1.00 10.39 C ATOM 676 CG2 VAL A 67 -10.425 9.534 4.440 1.00 10.78 C ATOM 677 H VAL A 67 -14.435 10.128 3.705 1.00 0.00 H ATOM 678 N LYS A 68 -12.901 12.849 3.264 1.00 9.49 N ATOM 679 CA LYS A 68 -12.629 14.241 2.900 1.00 10.33 C ATOM 680 C LYS A 68 -13.030 15.145 4.077 1.00 11.75 C ATOM 681 O LYS A 68 -12.324 16.140 4.377 1.00 12.13 O ATOM 682 CB LYS A 68 -13.388 14.600 1.623 1.00 11.39 C ATOM 683 CG LYS A 68 -12.782 14.017 0.353 1.00 13.23 C ATOM 684 CD LYS A 68 -13.526 14.448 -0.957 1.00 15.77 C ATOM 685 CE LYS A 68 -13.537 15.941 -1.092 1.00 18.26 C ATOM 686 NZ LYS A 68 -14.053 16.331 -2.476 1.00 19.35 N ATOM 687 HZ1 LYS A 68 -13.432 15.924 -3.204 1.00 0.00 H ATOM 688 HZ2 LYS A 68 -15.019 15.967 -2.600 1.00 0.00 H ATOM 689 HZ3 LYS A 68 -14.058 17.367 -2.563 1.00 0.00 H ATOM 690 H LYS A 68 -13.633 12.312 2.756 1.00 0.00 H ATOM 691 N ALA A 69 -14.105 14.830 4.808 1.00 11.80 N ATOM 692 CA ALA A 69 -14.459 15.614 6.001 1.00 11.98 C ATOM 693 C ALA A 69 -13.384 15.475 7.049 1.00 11.49 C ATOM 694 O ALA A 69 -13.004 16.463 7.690 1.00 13.13 O ATOM 695 CB ALA A 69 -15.833 15.195 6.554 1.00 12.04 C ATOM 696 H ALA A 69 -14.697 14.022 4.530 1.00 0.00 H ATOM 697 N HIS A 70 -12.867 14.272 7.263 1.00 11.26 N ATOM 698 CA HIS A 70 -11.760 14.095 8.196 1.00 11.60 C ATOM 699 C HIS A 70 -10.544 14.923 7.775 1.00 11.79 C ATOM 700 O HIS A 70 -9.848 15.449 8.638 1.00 12.31 O ATOM 701 CB HIS A 70 -11.330 12.622 8.255 1.00 11.65 C ATOM 702 CG HIS A 70 -12.180 11.728 9.099 1.00 12.83 C ATOM 703 ND1 HIS A 70 -12.991 12.157 10.125 1.00 14.02 N ATOM 704 CD2 HIS A 70 -12.233 10.369 9.116 1.00 13.56 C ATOM 705 CE1 HIS A 70 -13.550 11.104 10.706 1.00 14.07 C ATOM 706 NE2 HIS A 70 -13.113 10.010 10.100 1.00 13.27 N ATOM 707 H HIS A 70 -13.255 13.448 6.761 1.00 0.00 H ATOM 708 N SER A 71 -10.265 15.026 6.479 1.00 11.19 N ATOM 709 CA SER A 71 -9.127 15.863 6.039 1.00 10.68 C ATOM 710 C SER A 71 -9.322 17.329 6.465 1.00 11.09 C ATOM 711 O SER A 71 -8.359 17.962 6.967 1.00 10.81 O ATOM 712 CB SER A 71 -8.884 15.732 4.532 1.00 10.62 C ATOM 713 OG SER A 71 -9.771 16.552 3.768 1.00 11.71 O ATOM 714 HG SER A 71 -10.706 16.286 3.953 1.00 0.00 H ATOM 715 H SER A 71 -10.844 14.521 5.778 1.00 0.00 H ATOM 716 N GLN A 72 -10.545 17.849 6.341 1.00 11.09 N ATOM 717 CA GLN A 72 -10.796 19.223 6.750 1.00 10.61 C ATOM 718 C GLN A 72 -10.635 19.350 8.248 1.00 10.65 C ATOM 719 O GLN A 72 -10.075 20.356 8.683 1.00 10.49 O ATOM 720 CB GLN A 72 -12.208 19.622 6.363 1.00 11.88 C ATOM 721 CG GLN A 72 -12.492 19.713 4.864 1.00 13.91 C ATOM 722 CD GLN A 72 -11.597 20.701 4.141 1.00 16.83 C ATOM 723 OE1 GLN A 72 -11.157 21.694 4.720 1.00 17.33 O ATOM 724 NE2 GLN A 72 -11.370 20.472 2.849 1.00 19.44 N ATOM 725 HE22 GLN A 72 -11.759 19.621 2.396 1.00 0.00 H ATOM 726 HE21 GLN A 72 -10.803 21.144 2.293 1.00 0.00 H ATOM 727 H GLN A 72 -11.318 17.272 5.952 1.00 0.00 H ATOM 728 N THR A 73 -11.123 18.382 9.034 1.00 10.83 N ATOM 729 CA THR A 73 -10.926 18.476 10.471 1.00 10.62 C ATOM 730 C THR A 73 -9.446 18.495 10.849 1.00 10.52 C ATOM 731 O THR A 73 -9.038 19.288 11.732 1.00 10.72 O ATOM 732 CB THR A 73 -11.587 17.289 11.137 1.00 12.00 C ATOM 733 OG1 THR A 73 -12.991 17.364 10.827 1.00 14.90 O ATOM 734 CG2 THR A 73 -11.368 17.312 12.659 1.00 13.44 C ATOM 735 HG1 THR A 73 -13.113 17.329 9.845 1.00 0.00 H ATOM 736 H THR A 73 -11.635 17.576 8.623 1.00 0.00 H ATOM 737 N HIS A 74 -8.620 17.707 10.165 1.00 10.68 N ATOM 738 CA HIS A 74 -7.185 17.733 10.488 1.00 10.87 C ATOM 739 C HIS A 74 -6.566 19.069 10.085 1.00 10.20 C ATOM 740 O HIS A 74 -5.702 19.560 10.798 1.00 10.51 O ATOM 741 CB HIS A 74 -6.451 16.580 9.763 1.00 12.84 C ATOM 742 CG HIS A 74 -6.496 15.246 10.459 1.00 15.91 C ATOM 743 ND1 HIS A 74 -7.639 14.461 10.513 1.00 17.96 N ATOM 744 CD2 HIS A 74 -5.519 14.528 11.051 1.00 17.47 C ATOM 745 CE1 HIS A 74 -7.371 13.342 11.169 1.00 17.53 C ATOM 746 NE2 HIS A 74 -6.098 13.362 11.517 1.00 18.32 N ATOM 747 H HIS A 74 -8.983 17.084 9.415 1.00 0.00 H ATOM 748 N ARG A 75 -7.008 19.686 8.969 1.00 9.99 N ATOM 749 CA ARG A 75 -6.506 20.984 8.575 1.00 10.52 C ATOM 750 C ARG A 75 -6.838 22.030 9.636 1.00 11.31 C ATOM 751 O ARG A 75 -5.981 22.851 10.025 1.00 11.28 O ATOM 752 CB ARG A 75 -7.103 21.327 7.206 1.00 11.34 C ATOM 753 CG ARG A 75 -6.623 22.674 6.662 1.00 13.82 C ATOM 754 CD ARG A 75 -7.650 23.746 6.623 1.00 16.21 C ATOM 755 NE ARG A 75 -9.049 23.380 6.355 1.00 14.53 N ATOM 756 CZ ARG A 75 -10.017 24.081 6.932 1.00 15.05 C ATOM 757 NH1 ARG A 75 -9.662 25.123 7.701 1.00 16.64 N ATOM 758 NH2 ARG A 75 -11.281 23.805 6.751 1.00 14.98 N ATOM 759 HE ARG A 75 -9.276 22.585 5.724 1.00 0.00 H ATOM 760 HH12 ARG A 75 -10.392 25.696 8.170 1.00 0.00 H ATOM 761 HH11 ARG A 75 -8.657 25.357 7.828 1.00 0.00 H ATOM 762 HH22 ARG A 75 -12.011 24.378 7.221 1.00 0.00 H ATOM 763 HH21 ARG A 75 -11.557 23.012 6.137 1.00 0.00 H ATOM 764 H ARG A 75 -7.725 19.218 8.379 1.00 0.00 H ATOM 765 N VAL A 76 -8.075 22.010 10.131 1.00 10.53 N ATOM 766 CA VAL A 76 -8.473 22.899 11.223 1.00 10.74 C ATOM 767 C VAL A 76 -7.625 22.669 12.458 1.00 11.31 C ATOM 768 O VAL A 76 -7.118 23.628 13.075 1.00 12.62 O ATOM 769 CB VAL A 76 -9.964 22.646 11.597 1.00 11.64 C ATOM 770 CG1 VAL A 76 -10.365 23.457 12.801 1.00 12.40 C ATOM 771 CG2 VAL A 76 -10.890 23.024 10.411 1.00 11.80 C ATOM 772 H VAL A 76 -8.772 21.349 9.733 1.00 0.00 H ATOM 773 N ASP A 77 -7.450 21.400 12.825 1.00 10.84 N ATOM 774 CA ASP A 77 -6.663 21.093 14.034 1.00 11.37 C ATOM 775 C ASP A 77 -5.209 21.538 13.912 1.00 12.14 C ATOM 776 O ASP A 77 -4.659 22.048 14.881 1.00 11.21 O ATOM 777 CB ASP A 77 -6.752 19.604 14.381 1.00 12.73 C ATOM 778 CG ASP A 77 -8.172 19.188 14.849 1.00 14.15 C ATOM 779 OD1 ASP A 77 -8.929 20.079 15.301 1.00 14.99 O ATOM 780 OD2 ASP A 77 -8.446 17.982 14.767 1.00 15.49 O ATOM 781 H ASP A 77 -7.866 20.631 12.262 1.00 0.00 H ATOM 782 N LEU A 78 -4.604 21.422 12.728 1.00 10.70 N ATOM 783 CA LEU A 78 -3.242 21.933 12.562 1.00 10.35 C ATOM 784 C LEU A 78 -3.203 23.439 12.858 1.00 11.92 C ATOM 785 O LEU A 78 -2.279 23.941 13.484 1.00 12.51 O ATOM 786 CB LEU A 78 -2.732 21.669 11.144 1.00 10.13 C ATOM 787 CG LEU A 78 -2.190 20.255 10.944 1.00 9.41 C ATOM 788 CD1 LEU A 78 -2.114 19.955 9.434 1.00 11.36 C ATOM 789 CD2 LEU A 78 -0.784 20.149 11.531 1.00 10.18 C ATOM 790 H LEU A 78 -5.096 20.972 11.930 1.00 0.00 H ATOM 791 N GLY A 79 -4.211 24.172 12.411 1.00 11.67 N ATOM 792 CA GLY A 79 -4.246 25.605 12.665 1.00 11.96 C ATOM 793 C GLY A 79 -4.435 25.901 14.149 1.00 13.01 C ATOM 794 O GLY A 79 -3.808 26.802 14.722 1.00 13.95 O ATOM 795 H GLY A 79 -4.981 23.722 11.876 1.00 0.00 H ATOM 796 N THR A 80 -5.333 25.165 14.777 1.00 12.64 N ATOM 797 CA THR A 80 -5.658 25.413 16.156 1.00 13.17 C ATOM 798 C THR A 80 -4.446 25.135 17.019 1.00 12.63 C ATOM 799 O THR A 80 -4.130 25.915 17.892 1.00 14.22 O ATOM 800 CB THR A 80 -6.814 24.527 16.590 1.00 13.98 C ATOM 801 OG1 THR A 80 -7.953 24.856 15.772 1.00 15.18 O ATOM 802 CG2 THR A 80 -7.175 24.801 18.050 1.00 15.89 C ATOM 803 HG1 THR A 80 -8.722 24.291 16.036 1.00 0.00 H ATOM 804 H THR A 80 -5.812 24.395 14.268 1.00 0.00 H ATOM 805 N LEU A 81 -3.792 23.997 16.799 1.00 12.50 N ATOM 806 CA LEU A 81 -2.647 23.629 17.631 1.00 12.79 C ATOM 807 C LEU A 81 -1.444 24.519 17.401 1.00 12.65 C ATOM 808 O LEU A 81 -0.686 24.769 18.332 1.00 13.18 O ATOM 809 CB LEU A 81 -2.303 22.143 17.473 1.00 12.89 C ATOM 810 CG LEU A 81 -3.066 21.219 18.430 1.00 13.75 C ATOM 811 CD1 LEU A 81 -4.598 21.444 18.383 1.00 13.87 C ATOM 812 CD2 LEU A 81 -2.720 19.753 18.233 1.00 13.28 C ATOM 813 H LEU A 81 -4.097 23.366 16.031 1.00 0.00 H ATOM 814 N ARG A 82 -1.264 25.052 16.198 1.00 13.76 N ATOM 815 CA ARG A 82 -0.216 26.029 15.975 1.00 13.77 C ATOM 816 C ARG A 82 -0.452 27.193 16.953 1.00 14.75 C ATOM 817 O ARG A 82 0.484 27.696 17.582 1.00 15.40 O ATOM 818 CB ARG A 82 -0.266 26.549 14.525 1.00 14.93 C ATOM 819 CG ARG A 82 0.868 27.502 14.224 1.00 17.62 C ATOM 820 CD ARG A 82 0.812 27.987 12.767 1.00 20.56 C ATOM 821 NE ARG A 82 -0.305 28.889 12.508 1.00 25.07 N ATOM 822 CZ ARG A 82 -0.369 30.147 12.931 1.00 28.15 C ATOM 823 NH1 ARG A 82 0.623 30.655 13.672 1.00 28.17 N ATOM 824 NH2 ARG A 82 -1.433 30.897 12.609 1.00 28.61 N ATOM 825 HE ARG A 82 -1.106 28.522 11.955 1.00 0.00 H ATOM 826 HH12 ARG A 82 0.573 31.640 14.003 1.00 0.00 H ATOM 827 HH11 ARG A 82 1.444 30.065 13.917 1.00 0.00 H ATOM 828 HH22 ARG A 82 -1.492 31.883 12.935 1.00 0.00 H ATOM 829 HH21 ARG A 82 -2.199 30.493 12.033 1.00 0.00 H ATOM 830 H ARG A 82 -1.879 24.766 15.410 1.00 0.00 H ATOM 831 N GLY A 83 -1.711 27.606 17.128 1.00 14.26 N ATOM 832 CA GLY A 83 -2.042 28.665 18.059 1.00 15.72 C ATOM 833 C GLY A 83 -1.828 28.254 19.503 1.00 15.01 C ATOM 834 O GLY A 83 -1.239 29.013 20.270 1.00 17.54 O ATOM 835 H GLY A 83 -2.473 27.155 16.582 1.00 0.00 H ATOM 836 N TYR A 84 -2.275 27.065 19.890 1.00 14.52 N ATOM 837 CA TYR A 84 -2.132 26.608 21.276 1.00 14.13 C ATOM 838 C TYR A 84 -0.665 26.537 21.680 1.00 14.86 C ATOM 839 O TYR A 84 -0.327 26.848 22.841 1.00 17.08 O ATOM 840 CB TYR A 84 -2.689 25.200 21.436 1.00 14.47 C ATOM 841 CG TYR A 84 -4.205 25.045 21.412 1.00 14.30 C ATOM 842 CD1 TYR A 84 -5.065 26.121 21.369 1.00 14.82 C ATOM 843 CD2 TYR A 84 -4.739 23.791 21.448 1.00 14.21 C ATOM 844 CE1 TYR A 84 -6.457 25.938 21.365 1.00 15.48 C ATOM 845 CE2 TYR A 84 -6.083 23.581 21.424 1.00 15.08 C ATOM 846 CZ TYR A 84 -6.943 24.649 21.391 1.00 16.58 C ATOM 847 OH TYR A 84 -8.312 24.430 21.348 1.00 18.48 O ATOM 848 HH TYR A 84 -8.784 25.300 21.328 1.00 0.00 H ATOM 849 H TYR A 84 -2.737 26.444 19.195 1.00 0.00 H ATOM 850 N TYR A 85 0.199 26.166 20.728 1.00 13.73 N ATOM 851 CA TYR A 85 1.643 26.060 21.001 1.00 14.91 C ATOM 852 C TYR A 85 2.421 27.328 20.696 1.00 16.35 C ATOM 853 O TYR A 85 3.653 27.328 20.832 1.00 17.68 O ATOM 854 CB TYR A 85 2.226 24.838 20.283 1.00 13.53 C ATOM 855 CG TYR A 85 1.787 23.518 20.906 1.00 14.41 C ATOM 856 CD1 TYR A 85 2.358 23.078 22.090 1.00 15.06 C ATOM 857 CD2 TYR A 85 0.748 22.760 20.365 1.00 14.36 C ATOM 858 CE1 TYR A 85 1.957 21.869 22.678 1.00 15.85 C ATOM 859 CE2 TYR A 85 0.355 21.564 20.961 1.00 14.37 C ATOM 860 CZ TYR A 85 0.971 21.140 22.112 1.00 14.89 C ATOM 861 OH TYR A 85 0.565 19.960 22.707 1.00 15.78 O ATOM 862 HH TYR A 85 1.105 19.799 23.521 1.00 0.00 H ATOM 863 H TYR A 85 -0.156 25.948 19.775 1.00 0.00 H ATOM 864 N ASN A 86 1.712 28.393 20.303 1.00 17.60 N ATOM 865 CA ASN A 86 2.349 29.690 19.980 1.00 19.17 C ATOM 866 C ASN A 86 3.469 29.484 18.978 1.00 18.31 C ATOM 867 O ASN A 86 4.602 29.979 19.160 1.00 19.27 O ATOM 868 CB ASN A 86 2.888 30.374 21.255 1.00 22.18 C ATOM 869 CG ASN A 86 3.326 31.791 21.013 1.00 26.19 C ATOM 870 OD1 ASN A 86 2.693 32.526 20.253 1.00 28.69 O ATOM 871 ND2 ASN A 86 4.416 32.194 21.666 1.00 28.05 N ATOM 872 HD22 ASN A 86 4.917 31.537 22.297 1.00 0.00 H ATOM 873 HD21 ASN A 86 4.766 33.166 21.544 1.00 0.00 H ATOM 874 H ASN A 86 0.679 28.307 20.222 1.00 0.00 H ATOM 875 N GLN A 87 3.179 28.754 17.916 1.00 17.07 N ATOM 876 CA GLN A 87 4.155 28.527 16.903 1.00 17.14 C ATOM 877 C GLN A 87 3.962 29.455 15.712 1.00 18.61 C ATOM 878 O GLN A 87 2.879 29.927 15.431 1.00 19.67 O ATOM 879 CB GLN A 87 4.068 27.065 16.457 1.00 16.05 C ATOM 880 CG GLN A 87 4.618 26.118 17.517 1.00 15.24 C ATOM 881 CD GLN A 87 4.194 24.687 17.318 1.00 16.52 C ATOM 882 OE1 GLN A 87 3.200 24.429 16.672 1.00 16.91 O ATOM 883 NE2 GLN A 87 4.943 23.754 17.880 1.00 18.47 N ATOM 884 HE22 GLN A 87 5.787 24.023 18.425 1.00 0.00 H ATOM 885 HE21 GLN A 87 4.688 22.751 17.777 1.00 0.00 H ATOM 886 H GLN A 87 2.229 28.341 17.818 1.00 0.00 H ATOM 887 N SER A 88 5.037 29.678 14.986 1.00 19.99 N ATOM 888 CA SER A 88 4.903 30.553 13.843 1.00 22.14 C ATOM 889 C SER A 88 4.294 29.832 12.646 1.00 21.45 C ATOM 890 O SER A 88 4.122 28.620 12.646 1.00 18.95 O ATOM 891 CB SER A 88 6.241 31.136 13.464 1.00 24.34 C ATOM 892 OG SER A 88 6.973 30.160 12.787 1.00 25.14 O ATOM 893 HG SER A 88 7.855 30.529 12.531 1.00 0.00 H ATOM 894 H SER A 88 5.950 29.241 15.226 1.00 0.00 H ATOM 895 N GLU A 89 3.951 30.594 11.619 1.00 23.89 N ATOM 896 CA GLU A 89 3.435 30.032 10.392 1.00 26.80 C ATOM 897 C GLU A 89 4.505 29.440 9.474 1.00 25.02 C ATOM 898 O GLU A 89 4.173 28.853 8.447 1.00 26.57 O ATOM 899 CB GLU A 89 2.645 31.111 9.636 1.00 32.76 C ATOM 900 CG GLU A 89 1.326 31.493 10.317 1.00 38.62 C ATOM 901 CD GLU A 89 0.396 32.333 9.417 1.00 43.62 C ATOM 902 OE1 GLU A 89 0.490 32.226 8.172 1.00 45.51 O ATOM 903 OE2 GLU A 89 -0.429 33.103 9.958 1.00 45.40 O ATOM 904 H GLU A 89 4.056 31.626 11.698 1.00 0.00 H ATOM 905 N ALA A 90 5.764 29.549 9.845 1.00 22.88 N ATOM 906 CA ALA A 90 6.848 29.171 8.963 1.00 23.56 C ATOM 907 C ALA A 90 7.151 27.666 8.950 1.00 22.39 C ATOM 908 O ALA A 90 7.736 27.165 7.987 1.00 23.72 O ATOM 909 CB ALA A 90 8.119 29.953 9.322 1.00 24.35 C ATOM 910 H ALA A 90 5.984 29.915 10.793 1.00 0.00 H ATOM 911 N GLY A 91 6.804 26.957 10.019 1.00 20.05 N ATOM 912 CA GLY A 91 7.213 25.566 10.123 1.00 18.58 C ATOM 913 C GLY A 91 6.158 24.583 9.677 1.00 16.82 C ATOM 914 O GLY A 91 4.943 24.878 9.712 1.00 18.14 O ATOM 915 H GLY A 91 6.243 27.395 10.777 1.00 0.00 H ATOM 916 N SER A 92 6.590 23.402 9.243 1.00 15.25 N ATOM 917 CA SER A 92 5.624 22.320 8.976 1.00 14.73 C ATOM 918 C SER A 92 5.357 21.532 10.263 1.00 13.41 C ATOM 919 O SER A 92 6.267 21.270 11.040 1.00 15.75 O ATOM 920 CB SER A 92 6.213 21.380 7.940 1.00 15.92 C ATOM 921 OG SER A 92 5.362 20.287 7.675 1.00 18.14 O ATOM 922 HG SER A 92 4.495 20.621 7.333 1.00 0.00 H ATOM 923 H SER A 92 7.607 23.242 9.092 1.00 0.00 H ATOM 924 N HIS A 93 4.100 21.163 10.468 1.00 10.60 N ATOM 925 CA HIS A 93 3.704 20.349 11.620 1.00 10.57 C ATOM 926 C HIS A 93 2.770 19.233 11.189 1.00 10.37 C ATOM 927 O HIS A 93 2.296 19.205 10.059 1.00 10.69 O ATOM 928 CB HIS A 93 2.995 21.252 12.632 1.00 10.91 C ATOM 929 CG HIS A 93 3.860 22.350 13.114 1.00 11.97 C ATOM 930 ND1 HIS A 93 4.739 22.207 14.162 1.00 13.30 N ATOM 931 CD2 HIS A 93 4.019 23.617 12.658 1.00 13.09 C ATOM 932 CE1 HIS A 93 5.402 23.340 14.338 1.00 14.53 C ATOM 933 NE2 HIS A 93 5.003 24.206 13.420 1.00 14.69 N ATOM 934 H HIS A 93 3.371 21.461 9.789 1.00 0.00 H ATOM 935 N THR A 94 2.600 18.268 12.092 1.00 11.06 N ATOM 936 CA THR A 94 1.886 17.032 11.773 1.00 11.23 C ATOM 937 C THR A 94 0.818 16.741 12.802 1.00 10.96 C ATOM 938 O THR A 94 1.098 16.760 14.009 1.00 12.47 O ATOM 939 CB THR A 94 2.883 15.870 11.789 1.00 12.38 C ATOM 940 OG1 THR A 94 3.943 16.099 10.855 1.00 14.90 O ATOM 941 CG2 THR A 94 2.179 14.550 11.395 1.00 13.32 C ATOM 942 HG1 THR A 94 4.419 16.933 11.096 1.00 0.00 H ATOM 943 H THR A 94 2.985 18.397 13.049 1.00 0.00 H ATOM 944 N VAL A 95 -0.380 16.418 12.368 1.00 10.60 N ATOM 945 CA VAL A 95 -1.388 15.884 13.272 1.00 10.88 C ATOM 946 C VAL A 95 -1.631 14.466 12.802 1.00 10.82 C ATOM 947 O VAL A 95 -1.919 14.234 11.608 1.00 13.34 O ATOM 948 CB VAL A 95 -2.716 16.707 13.272 1.00 12.54 C ATOM 949 CG1 VAL A 95 -3.757 15.953 14.077 1.00 14.63 C ATOM 950 CG2 VAL A 95 -2.526 18.106 13.918 1.00 13.12 C ATOM 951 H VAL A 95 -0.611 16.546 11.362 1.00 0.00 H ATOM 952 N GLN A 96 -1.510 13.522 13.723 1.00 10.06 N ATOM 953 CA GLN A 96 -1.883 12.116 13.473 1.00 10.60 C ATOM 954 C GLN A 96 -3.054 11.729 14.339 1.00 10.20 C ATOM 955 O GLN A 96 -3.213 12.202 15.480 1.00 10.75 O ATOM 956 CB GLN A 96 -0.719 11.181 13.744 1.00 10.32 C ATOM 957 CG GLN A 96 0.399 11.288 12.723 1.00 10.36 C ATOM 958 CD GLN A 96 1.681 10.774 13.286 1.00 11.42 C ATOM 959 OE1 GLN A 96 2.445 11.509 13.927 1.00 13.54 O ATOM 960 NE2 GLN A 96 1.947 9.490 13.117 1.00 11.46 N ATOM 961 HE22 GLN A 96 1.292 8.890 12.575 1.00 0.00 H ATOM 962 HE21 GLN A 96 2.811 9.080 13.526 1.00 0.00 H ATOM 963 H GLN A 96 -1.138 13.781 14.659 1.00 0.00 H ATOM 964 N ARG A 97 -3.930 10.896 13.777 1.00 9.22 N ATOM 965 CA ARG A 97 -5.046 10.336 14.529 1.00 9.77 C ATOM 966 C ARG A 97 -5.075 8.836 14.247 1.00 9.56 C ATOM 967 O ARG A 97 -4.748 8.399 13.155 1.00 9.37 O ATOM 968 CB ARG A 97 -6.390 10.967 14.130 1.00 10.65 C ATOM 969 CG ARG A 97 -7.554 10.693 15.136 1.00 12.03 C ATOM 970 CD ARG A 97 -8.944 10.946 14.517 1.00 14.11 C ATOM 971 NE ARG A 97 -9.070 12.246 13.883 1.00 15.48 N ATOM 972 CZ ARG A 97 -10.225 12.761 13.481 1.00 17.26 C ATOM 973 NH1 ARG A 97 -10.258 13.970 12.935 1.00 18.37 N ATOM 974 NH2 ARG A 97 -11.351 12.078 13.628 1.00 18.35 N ATOM 975 HE ARG A 97 -8.206 12.805 13.736 1.00 0.00 H ATOM 976 HH12 ARG A 97 -11.163 14.374 12.620 1.00 0.00 H ATOM 977 HH11 ARG A 97 -9.379 14.514 12.822 1.00 0.00 H ATOM 978 HH22 ARG A 97 -12.253 12.488 13.311 1.00 0.00 H ATOM 979 HH21 ARG A 97 -11.333 11.132 14.061 1.00 0.00 H ATOM 980 H ARG A 97 -3.814 10.639 12.776 1.00 0.00 H ATOM 981 N MET A 98 -5.446 8.058 15.238 1.00 10.33 N ATOM 982 CA MET A 98 -5.764 6.656 15.022 1.00 10.98 C ATOM 983 C MET A 98 -7.060 6.373 15.745 1.00 11.42 C ATOM 984 O MET A 98 -7.285 6.861 16.865 1.00 13.21 O ATOM 985 CB MET A 98 -4.640 5.804 15.596 1.00 13.24 C ATOM 986 CG MET A 98 -4.823 4.288 15.440 1.00 18.92 C ATOM 987 SD MET A 98 -5.853 3.530 16.738 1.00 23.45 S ATOM 988 CE MET A 98 -4.692 3.085 17.955 1.00 21.77 C ATOM 989 H MET A 98 -5.514 8.453 16.198 1.00 0.00 H ATOM 990 N TYR A 99 -7.952 5.596 15.182 1.00 11.05 N ATOM 991 CA TYR A 99 -9.118 5.143 15.907 1.00 11.18 C ATOM 992 C TYR A 99 -9.545 3.787 15.409 1.00 11.63 C ATOM 993 O TYR A 99 -9.111 3.363 14.413 1.00 12.03 O ATOM 994 CB TYR A 99 -10.265 6.160 15.872 1.00 11.65 C ATOM 995 CG TYR A 99 -11.023 6.471 14.601 1.00 11.53 C ATOM 996 CD1 TYR A 99 -11.860 5.576 14.016 1.00 12.73 C ATOM 997 CD2 TYR A 99 -10.958 7.689 14.058 1.00 12.23 C ATOM 998 CE1 TYR A 99 -12.587 5.902 12.915 1.00 12.98 C ATOM 999 CE2 TYR A 99 -11.667 8.031 12.962 1.00 13.77 C ATOM 1000 CZ TYR A 99 -12.465 7.131 12.379 1.00 12.36 C ATOM 1001 OH TYR A 99 -13.169 7.518 11.329 1.00 14.01 O ATOM 1002 HH TYR A 99 -12.554 7.821 10.614 1.00 0.00 H ATOM 1003 H TYR A 99 -7.819 5.299 14.194 1.00 0.00 H ATOM 1004 N GLY A 100 -10.366 3.109 16.202 1.00 11.46 N ATOM 1005 CA GLY A 100 -10.874 1.808 15.738 1.00 12.06 C ATOM 1006 C GLY A 100 -11.273 0.956 16.909 1.00 12.32 C ATOM 1007 O GLY A 100 -11.350 1.381 18.064 1.00 13.67 O ATOM 1008 H GLY A 100 -10.644 3.488 17.130 1.00 0.00 H ATOM 1009 N CYS A 101 -11.553 -0.307 16.599 1.00 11.11 N ATOM 1010 CA CYS A 101 -12.138 -1.192 17.576 1.00 11.27 C ATOM 1011 C CYS A 101 -11.601 -2.591 17.446 1.00 11.83 C ATOM 1012 O CYS A 101 -11.165 -2.984 16.375 1.00 12.69 O ATOM 1013 CB CYS A 101 -13.665 -1.249 17.445 1.00 12.83 C ATOM 1014 SG CYS A 101 -14.269 -1.667 15.752 1.00 15.37 S ATOM 1015 H CYS A 101 -11.348 -0.660 15.642 1.00 0.00 H ATOM 1016 N ASP A 102 -11.700 -3.357 18.522 1.00 12.91 N ATOM 1017 CA ASP A 102 -11.384 -4.774 18.454 1.00 14.03 C ATOM 1018 C ASP A 102 -12.621 -5.551 18.822 1.00 13.55 C ATOM 1019 O ASP A 102 -13.432 -5.080 19.646 1.00 14.69 O ATOM 1020 CB ASP A 102 -10.376 -5.139 19.535 1.00 15.91 C ATOM 1021 CG ASP A 102 -9.026 -4.475 19.364 1.00 18.20 C ATOM 1022 OD1 ASP A 102 -8.783 -3.828 18.320 1.00 18.23 O ATOM 1023 OD2 ASP A 102 -8.195 -4.569 20.318 1.00 21.20 O ATOM 1024 H ASP A 102 -12.007 -2.940 19.424 1.00 0.00 H ATOM 1025 N VAL A 103 -12.770 -6.737 18.210 1.00 13.67 N ATOM 1026 CA VAL A 103 -13.737 -7.750 18.667 1.00 15.73 C ATOM 1027 C VAL A 103 -12.962 -8.901 19.253 1.00 15.93 C ATOM 1028 O VAL A 103 -11.804 -9.151 18.892 1.00 15.61 O ATOM 1029 CB VAL A 103 -14.665 -8.254 17.581 1.00 17.97 C ATOM 1030 CG1 VAL A 103 -15.664 -7.157 17.222 1.00 19.87 C ATOM 1031 CG2 VAL A 103 -13.870 -8.827 16.356 1.00 17.52 C ATOM 1032 H VAL A 103 -12.179 -6.949 17.381 1.00 0.00 H ATOM 1033 N GLY A 104 -13.577 -9.539 20.234 1.00 15.76 N ATOM 1034 CA GLY A 104 -12.976 -10.703 20.842 1.00 16.29 C ATOM 1035 C GLY A 104 -13.196 -11.980 20.057 1.00 15.83 C ATOM 1036 O GLY A 104 -13.834 -12.026 18.990 1.00 16.35 O ATOM 1037 H GLY A 104 -14.501 -9.200 20.571 1.00 0.00 H ATOM 1038 N SER A 105 -12.668 -13.061 20.611 1.00 17.30 N ATOM 1039 CA SER A 105 -12.936 -14.390 20.111 1.00 17.26 C ATOM 1040 C SER A 105 -14.424 -14.687 20.199 1.00 17.92 C ATOM 1041 O SER A 105 -14.901 -15.554 19.488 1.00 19.20 O ATOM 1042 CB SER A 105 -12.180 -15.451 20.936 1.00 19.15 C ATOM 1043 OG SER A 105 -10.790 -15.385 20.694 1.00 21.12 O ATOM 1044 HG SER A 105 -10.455 -14.488 20.946 1.00 0.00 H ATOM 1045 H SER A 105 -12.040 -12.950 21.433 1.00 0.00 H ATOM 1046 N ASP A 106 -15.148 -13.977 21.062 1.00 17.19 N ATOM 1047 CA ASP A 106 -16.594 -14.147 21.195 1.00 17.96 C ATOM 1048 C ASP A 106 -17.420 -13.383 20.172 1.00 18.59 C ATOM 1049 O ASP A 106 -18.647 -13.430 20.211 1.00 19.94 O ATOM 1050 CB ASP A 106 -17.082 -13.824 22.619 1.00 18.13 C ATOM 1051 CG ASP A 106 -16.810 -12.417 23.018 1.00 20.44 C ATOM 1052 OD1 ASP A 106 -16.318 -11.619 22.185 1.00 18.70 O ATOM 1053 OD2 ASP A 106 -17.134 -12.100 24.198 1.00 24.17 O ATOM 1054 H ASP A 106 -14.668 -13.277 21.663 1.00 0.00 H ATOM 1055 N TRP A 107 -16.725 -12.661 19.304 1.00 19.61 N ATOM 1056 CA TRP A 107 -17.352 -11.872 18.222 1.00 20.20 C ATOM 1057 C TRP A 107 -18.056 -10.620 18.767 1.00 19.36 C ATOM 1058 O TRP A 107 -18.863 -10.024 18.077 1.00 20.77 O ATOM 1059 CB TRP A 107 -18.367 -12.786 17.528 1.00 23.83 C ATOM 1060 CG TRP A 107 -18.645 -12.537 16.087 1.00 26.11 C ATOM 1061 CD1 TRP A 107 -19.870 -12.216 15.533 1.00 26.46 C ATOM 1062 CD2 TRP A 107 -17.721 -12.649 14.980 1.00 27.21 C ATOM 1063 NE1 TRP A 107 -19.741 -12.086 14.153 1.00 26.69 N ATOM 1064 CE2 TRP A 107 -18.436 -12.339 13.799 1.00 26.64 C ATOM 1065 CE3 TRP A 107 -16.365 -12.940 14.880 1.00 28.90 C ATOM 1066 CZ2 TRP A 107 -17.835 -12.333 12.535 1.00 27.59 C ATOM 1067 CZ3 TRP A 107 -15.775 -12.932 13.637 1.00 29.70 C ATOM 1068 CH2 TRP A 107 -16.511 -12.629 12.473 1.00 28.99 C ATOM 1069 HE1 TRP A 107 -20.508 -11.838 13.496 1.00 0.00 H ATOM 1070 H TRP A 107 -15.688 -12.649 19.388 1.00 0.00 H ATOM 1071 N ARG A 108 -17.781 -10.251 20.015 1.00 16.79 N ATOM 1072 CA ARG A 108 -18.369 -9.065 20.608 1.00 16.46 C ATOM 1073 C ARG A 108 -17.302 -7.992 20.796 1.00 15.71 C ATOM 1074 O ARG A 108 -16.110 -8.260 20.772 1.00 15.96 O ATOM 1075 CB ARG A 108 -18.964 -9.424 21.970 1.00 18.60 C ATOM 1076 CG ARG A 108 -19.998 -10.540 21.900 1.00 22.13 C ATOM 1077 CD ARG A 108 -20.260 -11.081 23.323 1.00 25.93 C ATOM 1078 NE ARG A 108 -20.640 -12.509 23.407 1.00 29.86 N ATOM 1079 CZ ARG A 108 -20.510 -13.271 24.509 1.00 31.37 C ATOM 1080 NH1 ARG A 108 -19.981 -12.759 25.625 1.00 32.97 N ATOM 1081 NH2 ARG A 108 -20.889 -14.553 24.514 1.00 28.76 N ATOM 1082 HE ARG A 108 -21.035 -12.955 22.555 1.00 0.00 H ATOM 1083 HH12 ARG A 108 -19.883 -13.352 26.474 1.00 0.00 H ATOM 1084 HH11 ARG A 108 -19.668 -11.768 25.645 1.00 0.00 H ATOM 1085 HH22 ARG A 108 -20.780 -15.124 25.376 1.00 0.00 H ATOM 1086 HH21 ARG A 108 -21.293 -14.979 23.656 1.00 0.00 H ATOM 1087 H ARG A 108 -17.127 -10.828 20.581 1.00 0.00 H ATOM 1088 N PHE A 109 -17.741 -6.750 20.930 1.00 14.28 N ATOM 1089 CA PHE A 109 -16.850 -5.628 21.266 1.00 13.66 C ATOM 1090 C PHE A 109 -15.895 -6.012 22.379 1.00 13.42 C ATOM 1091 O PHE A 109 -16.316 -6.634 23.372 1.00 14.14 O ATOM 1092 CB PHE A 109 -17.697 -4.423 21.718 1.00 14.52 C ATOM 1093 CG PHE A 109 -16.876 -3.298 22.247 1.00 14.90 C ATOM 1094 CD1 PHE A 109 -16.177 -2.473 21.378 1.00 15.86 C ATOM 1095 CD2 PHE A 109 -16.714 -3.129 23.629 1.00 15.50 C ATOM 1096 CE1 PHE A 109 -15.388 -1.417 21.913 1.00 16.18 C ATOM 1097 CE2 PHE A 109 -15.920 -2.089 24.136 1.00 16.39 C ATOM 1098 CZ PHE A 109 -15.258 -1.272 23.270 1.00 16.51 C ATOM 1099 H PHE A 109 -18.754 -6.560 20.793 1.00 0.00 H ATOM 1100 N LEU A 110 -14.627 -5.662 22.185 1.00 13.30 N ATOM 1101 CA LEU A 110 -13.620 -5.910 23.203 1.00 13.95 C ATOM 1102 C LEU A 110 -13.013 -4.610 23.690 1.00 15.08 C ATOM 1103 O LEU A 110 -12.912 -4.387 24.908 1.00 16.96 O ATOM 1104 CB LEU A 110 -12.551 -6.848 22.620 1.00 16.18 C ATOM 1105 CG LEU A 110 -11.359 -7.173 23.485 1.00 17.58 C ATOM 1106 CD1 LEU A 110 -11.813 -7.872 24.738 1.00 19.57 C ATOM 1107 CD2 LEU A 110 -10.442 -8.083 22.687 1.00 16.96 C ATOM 1108 H LEU A 110 -14.352 -5.204 21.292 1.00 0.00 H ATOM 1109 N ARG A 111 -12.643 -3.744 22.757 1.00 15.88 N ATOM 1110 CA ARG A 111 -12.072 -2.450 23.123 1.00 16.71 C ATOM 1111 C ARG A 111 -12.120 -1.436 21.981 1.00 15.23 C ATOM 1112 O ARG A 111 -12.285 -1.794 20.836 1.00 15.36 O ATOM 1113 CB ARG A 111 -10.653 -2.622 23.633 1.00 22.49 C ATOM 1114 CG ARG A 111 -9.689 -3.183 22.659 1.00 27.18 C ATOM 1115 CD ARG A 111 -8.315 -3.235 23.308 1.00 31.81 C ATOM 1116 NE ARG A 111 -8.170 -4.336 24.237 1.00 34.93 N ATOM 1117 CZ ARG A 111 -7.892 -5.588 23.886 1.00 36.44 C ATOM 1118 NH1 ARG A 111 -7.796 -6.520 24.823 1.00 38.07 N ATOM 1119 NH2 ARG A 111 -7.725 -5.916 22.613 1.00 35.74 N ATOM 1120 HE ARG A 111 -8.292 -4.133 25.250 1.00 0.00 H ATOM 1121 HH12 ARG A 111 -7.579 -7.502 24.559 1.00 0.00 H ATOM 1122 HH11 ARG A 111 -7.938 -6.269 25.822 1.00 0.00 H ATOM 1123 HH22 ARG A 111 -7.508 -6.899 22.354 1.00 0.00 H ATOM 1124 HH21 ARG A 111 -7.811 -5.190 21.873 1.00 0.00 H ATOM 1125 H ARG A 111 -12.761 -3.989 21.753 1.00 0.00 H ATOM 1126 N GLY A 112 -12.067 -0.173 22.342 1.00 14.57 N ATOM 1127 CA GLY A 112 -12.029 0.903 21.368 1.00 15.09 C ATOM 1128 C GLY A 112 -10.908 1.882 21.631 1.00 16.04 C ATOM 1129 O GLY A 112 -10.397 1.972 22.751 1.00 17.87 O ATOM 1130 H GLY A 112 -12.052 0.062 23.355 1.00 0.00 H ATOM 1131 N TYR A 113 -10.500 2.567 20.570 1.00 15.88 N ATOM 1132 CA TYR A 113 -9.457 3.599 20.627 1.00 16.79 C ATOM 1133 C TYR A 113 -9.789 4.807 19.795 1.00 14.82 C ATOM 1134 O TYR A 113 -10.428 4.698 18.747 1.00 14.26 O ATOM 1135 CB TYR A 113 -8.148 3.058 20.073 1.00 21.24 C ATOM 1136 CG TYR A 113 -7.781 1.668 20.517 1.00 25.00 C ATOM 1137 CD1 TYR A 113 -8.384 0.571 19.958 1.00 26.70 C ATOM 1138 CD2 TYR A 113 -6.818 1.473 21.479 1.00 27.59 C ATOM 1139 CE1 TYR A 113 -8.057 -0.718 20.342 1.00 28.04 C ATOM 1140 CE2 TYR A 113 -6.459 0.180 21.880 1.00 28.89 C ATOM 1141 CZ TYR A 113 -7.083 -0.892 21.306 1.00 29.80 C ATOM 1142 OH TYR A 113 -6.730 -2.156 21.688 1.00 31.49 O ATOM 1143 HH TYR A 113 -7.270 -2.815 21.183 1.00 0.00 H ATOM 1144 H TYR A 113 -10.942 2.362 19.651 1.00 0.00 H ATOM 1145 N HIS A 114 -9.320 5.975 20.263 1.00 14.56 N ATOM 1146 CA HIS A 114 -9.457 7.205 19.487 1.00 15.10 C ATOM 1147 C HIS A 114 -8.435 8.151 20.048 1.00 14.77 C ATOM 1148 O HIS A 114 -8.633 8.692 21.143 1.00 16.66 O ATOM 1149 CB HIS A 114 -10.877 7.787 19.636 1.00 16.41 C ATOM 1150 CG HIS A 114 -11.166 8.967 18.755 1.00 18.72 C ATOM 1151 ND1 HIS A 114 -10.767 10.251 19.055 1.00 22.09 N ATOM 1152 CD2 HIS A 114 -11.863 9.045 17.597 1.00 20.25 C ATOM 1153 CE1 HIS A 114 -11.180 11.066 18.096 1.00 22.35 C ATOM 1154 NE2 HIS A 114 -11.851 10.364 17.207 1.00 23.04 N ATOM 1155 H HIS A 114 -8.852 6.004 21.191 1.00 0.00 H ATOM 1156 N GLN A 115 -7.319 8.333 19.363 1.00 13.15 N ATOM 1157 CA GLN A 115 -6.262 9.171 19.928 1.00 13.52 C ATOM 1158 C GLN A 115 -5.473 9.920 18.897 1.00 10.84 C ATOM 1159 O GLN A 115 -5.505 9.631 17.709 1.00 10.68 O ATOM 1160 CB GLN A 115 -5.322 8.323 20.745 1.00 15.98 C ATOM 1161 CG GLN A 115 -4.770 7.144 19.996 1.00 18.38 C ATOM 1162 CD GLN A 115 -4.388 5.956 20.902 1.00 20.91 C ATOM 1163 OE1 GLN A 115 -5.075 5.653 21.888 1.00 22.88 O ATOM 1164 NE2 GLN A 115 -3.294 5.273 20.544 1.00 21.31 N ATOM 1165 HE22 GLN A 115 -2.749 5.565 19.708 1.00 0.00 H ATOM 1166 HE21 GLN A 115 -2.989 4.450 21.102 1.00 0.00 H ATOM 1167 H GLN A 115 -7.194 7.885 18.433 1.00 0.00 H ATOM 1168 N TYR A 116 -4.786 10.953 19.401 1.00 10.66 N ATOM 1169 CA TYR A 116 -4.116 11.912 18.544 1.00 11.05 C ATOM 1170 C TYR A 116 -2.687 12.215 18.991 1.00 10.61 C ATOM 1171 O TYR A 116 -2.384 12.154 20.181 1.00 11.41 O ATOM 1172 CB TYR A 116 -4.797 13.286 18.633 1.00 13.18 C ATOM 1173 CG TYR A 116 -6.158 13.382 18.008 1.00 14.53 C ATOM 1174 CD1 TYR A 116 -7.267 13.070 18.766 1.00 15.92 C ATOM 1175 CD2 TYR A 116 -6.338 13.854 16.718 1.00 15.78 C ATOM 1176 CE1 TYR A 116 -8.526 13.208 18.255 1.00 19.05 C ATOM 1177 CE2 TYR A 116 -7.641 14.032 16.191 1.00 17.63 C ATOM 1178 CZ TYR A 116 -8.701 13.702 17.014 1.00 19.03 C ATOM 1179 OH TYR A 116 -10.008 13.776 16.631 1.00 22.90 O ATOM 1180 HH TYR A 116 -10.225 14.709 16.380 1.00 0.00 H ATOM 1181 H TYR A 116 -4.732 11.070 20.433 1.00 0.00 H ATOM 1182 N ALA A 117 -1.837 12.539 18.027 1.00 10.49 N ATOM 1183 CA ALA A 117 -0.510 13.112 18.285 1.00 10.75 C ATOM 1184 C ALA A 117 -0.293 14.372 17.517 1.00 10.81 C ATOM 1185 O ALA A 117 -0.835 14.527 16.415 1.00 11.24 O ATOM 1186 CB ALA A 117 0.569 12.072 17.897 1.00 12.13 C ATOM 1187 H ALA A 117 -2.124 12.380 17.040 1.00 0.00 H ATOM 1188 N TYR A 118 0.514 15.264 18.090 1.00 10.88 N ATOM 1189 CA TYR A 118 0.985 16.459 17.407 1.00 10.83 C ATOM 1190 C TYR A 118 2.493 16.436 17.360 1.00 11.17 C ATOM 1191 O TYR A 118 3.127 16.259 18.377 1.00 11.66 O ATOM 1192 CB TYR A 118 0.462 17.694 18.155 1.00 10.56 C ATOM 1193 CG TYR A 118 0.791 19.003 17.451 1.00 10.84 C ATOM 1194 CD1 TYR A 118 0.353 19.263 16.164 1.00 11.47 C ATOM 1195 CD2 TYR A 118 1.563 19.954 18.091 1.00 11.75 C ATOM 1196 CE1 TYR A 118 0.656 20.460 15.506 1.00 12.30 C ATOM 1197 CE2 TYR A 118 1.874 21.201 17.449 1.00 11.34 C ATOM 1198 CZ TYR A 118 1.410 21.419 16.160 1.00 11.54 C ATOM 1199 OH TYR A 118 1.694 22.597 15.544 1.00 12.39 O ATOM 1200 HH TYR A 118 1.296 22.598 14.637 1.00 0.00 H ATOM 1201 H TYR A 118 0.821 15.098 19.070 1.00 0.00 H ATOM 1202 N ASP A 119 3.055 16.600 16.153 1.00 11.24 N ATOM 1203 CA ASP A 119 4.494 16.495 15.955 1.00 11.94 C ATOM 1204 C ASP A 119 5.092 15.236 16.561 1.00 13.50 C ATOM 1205 O ASP A 119 6.207 15.269 17.143 1.00 14.13 O ATOM 1206 CB ASP A 119 5.181 17.791 16.387 1.00 13.38 C ATOM 1207 CG ASP A 119 4.849 18.929 15.460 1.00 14.06 C ATOM 1208 OD1 ASP A 119 4.484 18.694 14.292 1.00 14.17 O ATOM 1209 OD2 ASP A 119 5.009 20.082 15.888 1.00 15.99 O ATOM 1210 H ASP A 119 2.446 16.808 15.336 1.00 0.00 H ATOM 1211 N GLY A 120 4.342 14.145 16.427 1.00 12.16 N ATOM 1212 CA GLY A 120 4.840 12.831 16.810 1.00 12.72 C ATOM 1213 C GLY A 120 4.839 12.515 18.307 1.00 12.82 C ATOM 1214 O GLY A 120 5.399 11.500 18.706 1.00 15.53 O ATOM 1215 H GLY A 120 3.380 14.232 16.041 1.00 0.00 H ATOM 1216 N LYS A 121 4.167 13.350 19.091 1.00 11.51 N ATOM 1217 CA LYS A 121 4.015 13.158 20.529 1.00 12.35 C ATOM 1218 C LYS A 121 2.551 13.085 20.892 1.00 11.62 C ATOM 1219 O LYS A 121 1.734 13.799 20.329 1.00 11.12 O ATOM 1220 CB LYS A 121 4.682 14.316 21.286 1.00 14.94 C ATOM 1221 CG LYS A 121 6.205 14.418 21.020 1.00 17.29 C ATOM 1222 CD LYS A 121 6.827 15.687 21.606 1.00 19.03 C ATOM 1223 CE LYS A 121 6.503 16.915 20.716 1.00 20.47 C ATOM 1224 NZ LYS A 121 7.390 18.116 21.015 1.00 21.34 N ATOM 1225 HZ1 LYS A 121 7.263 18.401 22.007 1.00 0.00 H ATOM 1226 HZ2 LYS A 121 8.385 17.860 20.852 1.00 0.00 H ATOM 1227 HZ3 LYS A 121 7.127 18.904 20.390 1.00 0.00 H ATOM 1228 H LYS A 121 3.726 14.185 18.657 1.00 0.00 H ATOM 1229 N ASP A 122 2.243 12.249 21.886 1.00 11.45 N ATOM 1230 CA ASP A 122 0.872 12.116 22.366 1.00 11.77 C ATOM 1231 C ASP A 122 0.299 13.494 22.642 1.00 11.04 C ATOM 1232 O ASP A 122 0.960 14.372 23.265 1.00 11.85 O ATOM 1233 CB ASP A 122 0.783 11.347 23.688 1.00 14.13 C ATOM 1234 CG ASP A 122 1.208 9.889 23.570 1.00 15.56 C ATOM 1235 OD1 ASP A 122 1.226 9.286 22.479 1.00 17.74 O ATOM 1236 OD2 ASP A 122 1.489 9.302 24.608 1.00 17.22 O ATOM 1237 H ASP A 122 2.995 11.682 22.327 1.00 0.00 H ATOM 1238 N TYR A 123 -0.952 13.678 22.214 1.00 10.75 N ATOM 1239 CA TYR A 123 -1.676 14.915 22.483 1.00 10.81 C ATOM 1240 C TYR A 123 -2.915 14.651 23.330 1.00 10.69 C ATOM 1241 O TYR A 123 -2.967 15.078 24.498 1.00 12.51 O ATOM 1242 CB TYR A 123 -2.020 15.642 21.148 1.00 11.46 C ATOM 1243 CG TYR A 123 -2.760 16.929 21.367 1.00 11.51 C ATOM 1244 CD1 TYR A 123 -2.102 18.085 21.769 1.00 12.64 C ATOM 1245 CD2 TYR A 123 -4.142 17.008 21.178 1.00 11.04 C ATOM 1246 CE1 TYR A 123 -2.777 19.262 22.006 1.00 13.16 C ATOM 1247 CE2 TYR A 123 -4.850 18.219 21.424 1.00 11.55 C ATOM 1248 CZ TYR A 123 -4.148 19.333 21.847 1.00 12.13 C ATOM 1249 OH TYR A 123 -4.772 20.524 22.113 1.00 13.17 O ATOM 1250 HH TYR A 123 -5.437 20.393 22.834 1.00 0.00 H ATOM 1251 H TYR A 123 -1.421 12.922 21.676 1.00 0.00 H ATOM 1252 N ILE A 124 -3.907 13.930 22.804 1.00 11.54 N ATOM 1253 CA ILE A 124 -5.089 13.567 23.612 1.00 12.01 C ATOM 1254 C ILE A 124 -5.553 12.183 23.187 1.00 12.31 C ATOM 1255 O ILE A 124 -5.468 11.855 22.000 1.00 12.79 O ATOM 1256 CB ILE A 124 -6.219 14.640 23.521 1.00 13.55 C ATOM 1257 CG1 ILE A 124 -7.225 14.473 24.686 1.00 15.02 C ATOM 1258 CG2 ILE A 124 -6.956 14.601 22.146 1.00 13.54 C ATOM 1259 CD1 ILE A 124 -8.237 15.628 24.769 1.00 15.57 C ATOM 1260 H ILE A 124 -3.847 13.620 21.813 1.00 0.00 H ATOM 1261 N ALA A 125 -6.044 11.392 24.136 1.00 13.43 N ATOM 1262 CA ALA A 125 -6.499 10.037 23.867 1.00 13.20 C ATOM 1263 C ALA A 125 -7.779 9.745 24.661 1.00 13.88 C ATOM 1264 O ALA A 125 -7.907 10.151 25.820 1.00 14.73 O ATOM 1265 CB ALA A 125 -5.412 9.035 24.206 1.00 13.98 C ATOM 1266 H ALA A 125 -6.105 11.756 25.108 1.00 0.00 H ATOM 1267 N LEU A 126 -8.692 9.006 24.047 1.00 14.98 N ATOM 1268 CA LEU A 126 -9.867 8.547 24.732 1.00 14.95 C ATOM 1269 C LEU A 126 -9.405 7.407 25.622 1.00 16.63 C ATOM 1270 O LEU A 126 -8.691 6.517 25.157 1.00 18.26 O ATOM 1271 CB LEU A 126 -10.896 8.073 23.668 1.00 16.34 C ATOM 1272 CG LEU A 126 -12.241 7.633 24.219 1.00 17.20 C ATOM 1273 CD1 LEU A 126 -12.956 8.835 24.866 1.00 18.05 C ATOM 1274 CD2 LEU A 126 -13.020 7.044 23.028 1.00 17.43 C ATOM 1275 H LEU A 126 -8.554 8.753 23.048 1.00 0.00 H ATOM 1276 N LYS A 127 -9.810 7.402 26.900 1.00 17.77 N ATOM 1277 CA LYS A 127 -9.424 6.306 27.787 1.00 19.90 C ATOM 1278 C LYS A 127 -10.208 5.028 27.508 1.00 20.97 C ATOM 1279 O LYS A 127 -11.179 5.020 26.753 1.00 20.61 O ATOM 1280 CB LYS A 127 -9.558 6.698 29.267 1.00 21.55 C ATOM 1281 CG LYS A 127 -8.576 7.805 29.714 1.00 24.32 C ATOM 1282 CD LYS A 127 -8.427 7.742 31.216 1.00 27.29 C ATOM 1283 CE LYS A 127 -8.213 9.086 31.817 1.00 30.04 C ATOM 1284 NZ LYS A 127 -8.176 8.805 33.264 1.00 30.55 N ATOM 1285 HZ1 LYS A 127 -9.078 8.377 33.556 1.00 0.00 H ATOM 1286 HZ2 LYS A 127 -7.396 8.148 33.468 1.00 0.00 H ATOM 1287 HZ3 LYS A 127 -8.028 9.693 33.785 1.00 0.00 H ATOM 1288 H LYS A 127 -10.400 8.179 27.261 1.00 0.00 H ATOM 1289 N GLU A 128 -9.785 3.952 28.126 1.00 23.70 N ATOM 1290 CA GLU A 128 -10.383 2.649 27.818 1.00 25.68 C ATOM 1291 C GLU A 128 -11.888 2.563 28.115 1.00 23.97 C ATOM 1292 O GLU A 128 -12.621 1.851 27.430 1.00 23.97 O ATOM 1293 CB GLU A 128 -9.594 1.542 28.507 1.00 30.93 C ATOM 1294 CG GLU A 128 -10.025 0.151 28.067 1.00 35.94 C ATOM 1295 CD GLU A 128 -9.291 -0.946 28.780 1.00 40.74 C ATOM 1296 OE1 GLU A 128 -8.420 -0.627 29.621 1.00 42.56 O ATOM 1297 OE2 GLU A 128 -9.591 -2.131 28.499 1.00 42.58 O ATOM 1298 H GLU A 128 -9.026 4.022 28.834 1.00 0.00 H ATOM 1299 N ASP A 129 -12.360 3.297 29.123 1.00 22.61 N ATOM 1300 CA ASP A 129 -13.803 3.359 29.425 1.00 23.36 C ATOM 1301 C ASP A 129 -14.648 4.072 28.374 1.00 22.46 C ATOM 1302 O ASP A 129 -15.891 4.067 28.461 1.00 23.72 O ATOM 1303 CB ASP A 129 -14.079 3.899 30.857 1.00 24.80 C ATOM 1304 CG ASP A 129 -13.733 5.397 31.062 1.00 26.15 C ATOM 1305 OD1 ASP A 129 -13.423 6.151 30.129 1.00 24.87 O ATOM 1306 OD2 ASP A 129 -13.804 5.860 32.233 1.00 28.58 O ATOM 1307 H ASP A 129 -11.695 3.839 29.711 1.00 0.00 H ATOM 1308 N LEU A 130 -13.964 4.674 27.403 1.00 20.75 N ATOM 1309 CA LEU A 130 -14.589 5.445 26.309 1.00 20.60 C ATOM 1310 C LEU A 130 -15.472 6.594 26.822 1.00 20.73 C ATOM 1311 O LEU A 130 -16.433 7.030 26.151 1.00 21.27 O ATOM 1312 CB LEU A 130 -15.405 4.514 25.398 1.00 20.92 C ATOM 1313 CG LEU A 130 -14.647 3.266 24.957 1.00 21.06 C ATOM 1314 CD1 LEU A 130 -15.571 2.472 24.016 1.00 21.60 C ATOM 1315 CD2 LEU A 130 -13.335 3.542 24.300 1.00 20.59 C ATOM 1316 H LEU A 130 -12.927 4.597 27.416 1.00 0.00 H ATOM 1317 N ARG A 131 -15.166 7.061 28.031 1.00 22.45 N ATOM 1318 CA ARG A 131 -16.035 8.044 28.690 1.00 24.16 C ATOM 1319 C ARG A 131 -15.219 9.243 29.164 1.00 23.68 C ATOM 1320 O ARG A 131 -15.802 10.204 29.652 1.00 25.12 O ATOM 1321 CB ARG A 131 -16.796 7.404 29.864 1.00 26.26 C ATOM 1322 CG ARG A 131 -17.893 6.444 29.420 1.00 28.36 C ATOM 1323 CD ARG A 131 -18.431 5.548 30.551 1.00 30.40 C ATOM 1324 NE ARG A 131 -19.637 4.816 30.125 1.00 32.13 N ATOM 1325 CZ ARG A 131 -19.623 3.685 29.418 1.00 33.73 C ATOM 1326 NH1 ARG A 131 -18.470 3.127 29.059 1.00 34.26 N ATOM 1327 NH2 ARG A 131 -20.771 3.099 29.082 1.00 34.57 N ATOM 1328 HE ARG A 131 -20.562 5.208 30.394 1.00 0.00 H ATOM 1329 HH12 ARG A 131 -18.468 2.245 28.508 1.00 0.00 H ATOM 1330 HH11 ARG A 131 -17.570 3.573 29.330 1.00 0.00 H ATOM 1331 HH22 ARG A 131 -20.763 2.217 28.531 1.00 0.00 H ATOM 1332 HH21 ARG A 131 -21.675 3.523 29.371 1.00 0.00 H ATOM 1333 H ARG A 131 -14.306 6.727 28.511 1.00 0.00 H ATOM 1334 N SER A 132 -13.890 9.180 29.017 1.00 21.40 N ATOM 1335 CA SER A 132 -13.016 10.228 29.581 1.00 21.04 C ATOM 1336 C SER A 132 -11.770 10.331 28.749 1.00 19.05 C ATOM 1337 O SER A 132 -11.471 9.440 27.924 1.00 18.46 O ATOM 1338 CB SER A 132 -12.633 9.893 31.025 1.00 22.48 C ATOM 1339 OG SER A 132 -12.120 8.576 31.085 1.00 23.75 O ATOM 1340 HG SER A 132 -12.810 7.940 30.770 1.00 0.00 H ATOM 1341 H SER A 132 -13.468 8.383 28.499 1.00 0.00 H ATOM 1342 N TRP A 133 -11.043 11.430 28.940 1.00 18.91 N ATOM 1343 CA TRP A 133 -9.898 11.748 28.123 1.00 18.04 C ATOM 1344 C TRP A 133 -8.589 11.866 28.883 1.00 18.34 C ATOM 1345 O TRP A 133 -8.595 12.303 30.065 1.00 19.87 O ATOM 1346 CB TRP A 133 -10.152 13.087 27.454 1.00 18.10 C ATOM 1347 CG TRP A 133 -11.354 13.061 26.590 1.00 17.96 C ATOM 1348 CD1 TRP A 133 -12.616 13.431 26.945 1.00 17.87 C ATOM 1349 CD2 TRP A 133 -11.420 12.616 25.250 1.00 17.28 C ATOM 1350 NE1 TRP A 133 -13.456 13.290 25.883 1.00 18.57 N ATOM 1351 CE2 TRP A 133 -12.746 12.783 24.824 1.00 17.20 C ATOM 1352 CE3 TRP A 133 -10.472 12.140 24.348 1.00 16.78 C ATOM 1353 CZ2 TRP A 133 -13.166 12.449 23.528 1.00 17.07 C ATOM 1354 CZ3 TRP A 133 -10.892 11.818 23.049 1.00 17.08 C ATOM 1355 CH2 TRP A 133 -12.217 11.991 22.656 1.00 17.21 C ATOM 1356 HE1 TRP A 133 -14.469 13.527 25.876 1.00 0.00 H ATOM 1357 H TRP A 133 -11.310 12.082 29.705 1.00 0.00 H ATOM 1358 N THR A 134 -7.484 11.517 28.218 1.00 18.38 N ATOM 1359 CA THR A 134 -6.126 11.740 28.753 1.00 18.70 C ATOM 1360 C THR A 134 -5.395 12.766 27.896 1.00 17.49 C ATOM 1361 O THR A 134 -5.161 12.552 26.679 1.00 16.60 O ATOM 1362 CB THR A 134 -5.286 10.479 28.675 1.00 21.64 C ATOM 1363 OG1 THR A 134 -5.823 9.489 29.569 1.00 24.86 O ATOM 1364 CG2 THR A 134 -3.849 10.778 29.131 1.00 22.09 C ATOM 1365 HG1 THR A 134 -5.274 8.667 29.517 1.00 0.00 H ATOM 1366 H THR A 134 -7.585 11.070 27.285 1.00 0.00 H ATOM 1367 N ALA A 135 -5.063 13.892 28.539 1.00 16.63 N ATOM 1368 CA ALA A 135 -4.329 15.002 27.914 1.00 15.08 C ATOM 1369 C ALA A 135 -2.875 14.916 28.315 1.00 14.26 C ATOM 1370 O ALA A 135 -2.552 14.862 29.511 1.00 15.12 O ATOM 1371 CB ALA A 135 -4.925 16.344 28.343 1.00 16.33 C ATOM 1372 H ALA A 135 -5.340 13.987 29.537 1.00 0.00 H ATOM 1373 N ALA A 136 -1.990 14.900 27.325 1.00 14.22 N ATOM 1374 CA ALA A 136 -0.554 14.731 27.616 1.00 13.66 C ATOM 1375 C ALA A 136 0.141 15.960 28.197 1.00 13.85 C ATOM 1376 O ALA A 136 1.154 15.831 28.899 1.00 14.71 O ATOM 1377 CB ALA A 136 0.195 14.300 26.341 1.00 14.94 C ATOM 1378 H ALA A 136 -2.311 15.007 26.341 1.00 0.00 H ATOM 1379 N ASP A 137 -0.373 17.166 27.889 1.00 12.51 N ATOM 1380 CA ASP A 137 0.241 18.424 28.268 1.00 12.99 C ATOM 1381 C ASP A 137 -0.835 19.482 28.528 1.00 12.73 C ATOM 1382 O ASP A 137 -2.013 19.190 28.383 1.00 12.72 O ATOM 1383 CB ASP A 137 1.292 18.900 27.241 1.00 12.72 C ATOM 1384 CG ASP A 137 0.721 19.228 25.916 1.00 14.92 C ATOM 1385 OD1 ASP A 137 -0.513 19.284 25.760 1.00 15.68 O ATOM 1386 OD2 ASP A 137 1.529 19.367 24.972 1.00 16.02 O ATOM 1387 H ASP A 137 -1.261 17.197 27.348 1.00 0.00 H ATOM 1388 N MET A 138 -0.434 20.699 28.867 1.00 13.05 N ATOM 1389 CA MET A 138 -1.400 21.728 29.193 1.00 13.64 C ATOM 1390 C MET A 138 -2.144 22.246 27.966 1.00 13.85 C ATOM 1391 O MET A 138 -3.322 22.610 28.094 1.00 14.98 O ATOM 1392 CB MET A 138 -0.753 22.853 29.960 1.00 15.70 C ATOM 1393 CG MET A 138 -0.166 22.409 31.291 1.00 17.23 C ATOM 1394 SD MET A 138 -1.325 21.674 32.404 1.00 17.27 S ATOM 1395 CE MET A 138 -2.404 23.052 32.721 1.00 18.75 C ATOM 1396 H MET A 138 0.582 20.917 28.899 1.00 0.00 H ATOM 1397 N ALA A 139 -1.510 22.249 26.805 1.00 14.41 N ATOM 1398 CA ALA A 139 -2.266 22.562 25.582 1.00 14.08 C ATOM 1399 C ALA A 139 -3.440 21.637 25.397 1.00 14.20 C ATOM 1400 O ALA A 139 -4.578 22.081 25.116 1.00 14.93 O ATOM 1401 CB ALA A 139 -1.382 22.526 24.338 1.00 15.16 C ATOM 1402 H ALA A 139 -0.494 22.034 26.757 1.00 0.00 H ATOM 1403 N ALA A 140 -3.199 20.349 25.569 1.00 13.58 N ATOM 1404 CA ALA A 140 -4.278 19.393 25.355 1.00 14.42 C ATOM 1405 C ALA A 140 -5.369 19.540 26.406 1.00 14.74 C ATOM 1406 O ALA A 140 -6.486 19.048 26.190 1.00 16.00 O ATOM 1407 CB ALA A 140 -3.723 18.021 25.355 1.00 14.42 C ATOM 1408 H ALA A 140 -2.253 20.022 25.853 1.00 0.00 H ATOM 1409 N GLN A 141 -5.099 20.145 27.560 1.00 15.65 N ATOM 1410 CA GLN A 141 -6.176 20.429 28.512 1.00 16.93 C ATOM 1411 C GLN A 141 -7.257 21.284 27.903 1.00 16.87 C ATOM 1412 O GLN A 141 -8.432 21.130 28.267 1.00 16.10 O ATOM 1413 CB GLN A 141 -5.670 21.112 29.770 1.00 17.76 C ATOM 1414 CG GLN A 141 -4.736 20.239 30.579 1.00 19.47 C ATOM 1415 CD GLN A 141 -5.421 19.218 31.469 1.00 21.90 C ATOM 1416 OE1 GLN A 141 -5.891 18.183 30.995 1.00 22.18 O ATOM 1417 NE2 GLN A 141 -5.392 19.451 32.761 1.00 24.66 N ATOM 1418 HE22 GLN A 141 -4.986 20.338 33.120 1.00 0.00 H ATOM 1419 HE21 GLN A 141 -5.775 18.748 33.425 1.00 0.00 H ATOM 1420 H GLN A 141 -4.121 20.417 27.787 1.00 0.00 H ATOM 1421 N THR A 142 -6.885 22.193 27.004 1.00 16.77 N ATOM 1422 CA THR A 142 -7.881 23.022 26.335 1.00 17.37 C ATOM 1423 C THR A 142 -8.849 22.136 25.568 1.00 16.43 C ATOM 1424 O THR A 142 -10.066 22.331 25.627 1.00 16.99 O ATOM 1425 CB THR A 142 -7.206 24.031 25.400 1.00 17.21 C ATOM 1426 OG1 THR A 142 -6.288 24.811 26.209 1.00 19.46 O ATOM 1427 CG2 THR A 142 -8.229 25.020 24.809 1.00 18.04 C ATOM 1428 HG1 THR A 142 -5.830 25.477 25.637 1.00 0.00 H ATOM 1429 H THR A 142 -5.877 22.313 26.777 1.00 0.00 H ATOM 1430 N THR A 143 -8.311 21.181 24.805 1.00 14.81 N ATOM 1431 CA THR A 143 -9.138 20.299 24.004 1.00 13.30 C ATOM 1432 C THR A 143 -9.966 19.405 24.915 1.00 13.87 C ATOM 1433 O THR A 143 -11.151 19.177 24.673 1.00 13.35 O ATOM 1434 CB THR A 143 -8.250 19.453 23.109 1.00 12.78 C ATOM 1435 OG1 THR A 143 -7.520 20.306 22.222 1.00 13.71 O ATOM 1436 CG2 THR A 143 -9.118 18.492 22.280 1.00 12.94 C ATOM 1437 HG1 THR A 143 -8.155 20.823 21.666 1.00 0.00 H ATOM 1438 H THR A 143 -7.277 21.067 24.785 1.00 0.00 H ATOM 1439 N LYS A 144 -9.346 18.895 25.967 1.00 14.35 N ATOM 1440 CA LYS A 144 -10.045 18.042 26.912 1.00 14.49 C ATOM 1441 C LYS A 144 -11.236 18.786 27.525 1.00 15.50 C ATOM 1442 O LYS A 144 -12.337 18.240 27.615 1.00 16.28 O ATOM 1443 CB LYS A 144 -9.091 17.525 28.012 1.00 14.50 C ATOM 1444 CG LYS A 144 -9.796 16.717 29.099 1.00 15.26 C ATOM 1445 CD LYS A 144 -8.759 16.101 30.068 1.00 16.19 C ATOM 1446 CE LYS A 144 -9.466 15.340 31.158 1.00 17.40 C ATOM 1447 NZ LYS A 144 -8.572 14.584 32.099 1.00 18.17 N ATOM 1448 HZ1 LYS A 144 -8.018 13.886 31.563 1.00 0.00 H ATOM 1449 HZ2 LYS A 144 -7.928 15.249 32.573 1.00 0.00 H ATOM 1450 HZ3 LYS A 144 -9.153 14.096 32.810 1.00 0.00 H ATOM 1451 H LYS A 144 -8.340 19.109 26.120 1.00 0.00 H ATOM 1452 N HIS A 145 -11.059 20.052 27.894 1.00 16.33 N ATOM 1453 CA HIS A 145 -12.199 20.769 28.436 1.00 16.96 C ATOM 1454 C HIS A 145 -13.293 20.930 27.404 1.00 17.62 C ATOM 1455 O HIS A 145 -14.460 20.738 27.698 1.00 17.89 O ATOM 1456 CB HIS A 145 -11.806 22.152 28.945 1.00 18.74 C ATOM 1457 CG HIS A 145 -12.987 22.979 29.331 1.00 20.52 C ATOM 1458 ND1 HIS A 145 -13.453 24.026 28.564 1.00 21.60 N ATOM 1459 CD2 HIS A 145 -13.824 22.879 30.386 1.00 20.94 C ATOM 1460 CE1 HIS A 145 -14.528 24.534 29.135 1.00 21.81 C ATOM 1461 NE2 HIS A 145 -14.771 23.862 30.244 1.00 21.70 N ATOM 1462 H HIS A 145 -10.132 20.514 27.797 1.00 0.00 H ATOM 1463 N LYS A 146 -12.904 21.309 26.196 1.00 16.49 N ATOM 1464 CA LYS A 146 -13.873 21.569 25.110 1.00 17.13 C ATOM 1465 C LYS A 146 -14.671 20.303 24.846 1.00 16.82 C ATOM 1466 O LYS A 146 -15.894 20.345 24.695 1.00 17.44 O ATOM 1467 CB LYS A 146 -13.098 22.049 23.867 1.00 20.23 C ATOM 1468 CG LYS A 146 -13.902 22.545 22.678 1.00 23.13 C ATOM 1469 CD LYS A 146 -12.936 23.051 21.556 1.00 25.07 C ATOM 1470 CE LYS A 146 -13.650 23.122 20.212 1.00 27.55 C ATOM 1471 NZ LYS A 146 -12.799 23.796 19.160 1.00 28.29 N ATOM 1472 HZ1 LYS A 146 -12.577 24.765 19.464 1.00 0.00 H ATOM 1473 HZ2 LYS A 146 -11.917 23.260 19.034 1.00 0.00 H ATOM 1474 HZ3 LYS A 146 -13.320 23.825 18.260 1.00 0.00 H ATOM 1475 H LYS A 146 -11.888 21.427 26.006 1.00 0.00 H ATOM 1476 N TRP A 147 -13.985 19.168 24.830 1.00 16.05 N ATOM 1477 CA TRP A 147 -14.654 17.903 24.518 1.00 14.58 C ATOM 1478 C TRP A 147 -15.493 17.372 25.657 1.00 14.68 C ATOM 1479 O TRP A 147 -16.541 16.764 25.426 1.00 16.06 O ATOM 1480 CB TRP A 147 -13.623 16.895 24.010 1.00 14.42 C ATOM 1481 CG TRP A 147 -13.121 17.270 22.612 1.00 15.16 C ATOM 1482 CD1 TRP A 147 -13.478 18.358 21.879 1.00 16.79 C ATOM 1483 CD2 TRP A 147 -12.146 16.578 21.855 1.00 15.05 C ATOM 1484 NE1 TRP A 147 -12.799 18.371 20.673 1.00 17.72 N ATOM 1485 CE2 TRP A 147 -11.972 17.283 20.640 1.00 16.97 C ATOM 1486 CE3 TRP A 147 -11.409 15.396 22.068 1.00 14.33 C ATOM 1487 CZ2 TRP A 147 -11.098 16.855 19.647 1.00 18.03 C ATOM 1488 CZ3 TRP A 147 -10.509 15.000 21.089 1.00 15.19 C ATOM 1489 CH2 TRP A 147 -10.387 15.707 19.876 1.00 17.67 C ATOM 1490 HE1 TRP A 147 -12.900 19.084 19.923 1.00 0.00 H ATOM 1491 H TRP A 147 -12.966 19.176 25.040 1.00 0.00 H ATOM 1492 N GLU A 148 -15.079 17.622 26.885 1.00 16.22 N ATOM 1493 CA GLU A 148 -15.952 17.301 28.014 1.00 17.73 C ATOM 1494 C GLU A 148 -17.209 18.142 27.998 1.00 18.98 C ATOM 1495 O GLU A 148 -18.286 17.631 28.273 1.00 19.37 O ATOM 1496 CB GLU A 148 -15.215 17.504 29.329 1.00 18.64 C ATOM 1497 CG GLU A 148 -14.187 16.418 29.608 1.00 19.80 C ATOM 1498 CD GLU A 148 -13.295 16.764 30.801 1.00 22.35 C ATOM 1499 OE1 GLU A 148 -13.369 17.912 31.347 1.00 24.67 O ATOM 1500 OE2 GLU A 148 -12.484 15.914 31.186 1.00 22.88 O ATOM 1501 H GLU A 148 -14.142 18.043 27.048 1.00 0.00 H ATOM 1502 N ALA A 149 -17.083 19.426 27.694 1.00 19.83 N ATOM 1503 CA ALA A 149 -18.239 20.331 27.713 1.00 20.37 C ATOM 1504 C ALA A 149 -19.196 20.030 26.589 1.00 21.44 C ATOM 1505 O ALA A 149 -20.413 20.279 26.725 1.00 22.43 O ATOM 1506 CB ALA A 149 -17.769 21.801 27.621 1.00 21.01 C ATOM 1507 H ALA A 149 -16.147 19.800 27.437 1.00 0.00 H ATOM 1508 N ALA A 150 -18.666 19.498 25.490 1.00 20.63 N ATOM 1509 CA ALA A 150 -19.482 19.187 24.338 1.00 20.15 C ATOM 1510 C ALA A 150 -20.047 17.753 24.443 1.00 20.91 C ATOM 1511 O ALA A 150 -20.903 17.374 23.650 1.00 21.93 O ATOM 1512 CB ALA A 150 -18.694 19.373 23.051 1.00 20.80 C ATOM 1513 H ALA A 150 -17.645 19.302 25.460 1.00 0.00 H ATOM 1514 N HIS A 151 -19.589 16.981 25.439 1.00 20.72 N ATOM 1515 CA HIS A 151 -20.024 15.578 25.624 1.00 22.49 C ATOM 1516 C HIS A 151 -19.842 14.758 24.374 1.00 23.01 C ATOM 1517 O HIS A 151 -20.748 14.004 23.977 1.00 24.86 O ATOM 1518 CB HIS A 151 -21.462 15.508 26.162 1.00 23.88 C ATOM 1519 CG HIS A 151 -21.639 16.291 27.411 1.00 26.94 C ATOM 1520 ND1 HIS A 151 -21.310 15.789 28.652 1.00 28.20 N ATOM 1521 CD2 HIS A 151 -22.013 17.579 27.613 1.00 28.76 C ATOM 1522 CE1 HIS A 151 -21.507 16.720 29.568 1.00 29.12 C ATOM 1523 NE2 HIS A 151 -21.939 17.813 28.965 1.00 29.68 N ATOM 1524 H HIS A 151 -18.901 17.383 26.108 1.00 0.00 H ATOM 1525 N VAL A 152 -18.683 14.899 23.750 1.00 21.90 N ATOM 1526 CA VAL A 152 -18.431 14.178 22.514 1.00 21.89 C ATOM 1527 C VAL A 152 -17.987 12.732 22.732 1.00 21.41 C ATOM 1528 O VAL A 152 -18.160 11.920 21.831 1.00 20.89 O ATOM 1529 CB VAL A 152 -17.463 14.894 21.592 1.00 22.59 C ATOM 1530 CG1 VAL A 152 -18.056 16.246 21.189 1.00 24.59 C ATOM 1531 CG2 VAL A 152 -16.137 15.117 22.281 1.00 22.05 C ATOM 1532 H VAL A 152 -17.953 15.526 24.144 1.00 0.00 H ATOM 1533 N ALA A 153 -17.475 12.371 23.908 1.00 21.98 N ATOM 1534 CA ALA A 153 -17.161 10.942 24.140 1.00 21.09 C ATOM 1535 C ALA A 153 -18.348 10.002 23.874 1.00 21.35 C ATOM 1536 O ALA A 153 -18.153 8.916 23.342 1.00 19.98 O ATOM 1537 CB ALA A 153 -16.591 10.711 25.559 1.00 20.86 C ATOM 1538 H ALA A 153 -17.299 13.079 24.649 1.00 0.00 H ATOM 1539 N GLU A 154 -19.575 10.412 24.191 1.00 23.38 N ATOM 1540 CA GLU A 154 -20.743 9.533 23.980 1.00 25.95 C ATOM 1541 C GLU A 154 -20.914 9.088 22.536 1.00 22.89 C ATOM 1542 O GLU A 154 -21.180 7.941 22.243 1.00 21.64 O ATOM 1543 CB GLU A 154 -22.037 10.230 24.431 1.00 33.33 C ATOM 1544 CG GLU A 154 -22.337 10.114 25.915 1.00 41.24 C ATOM 1545 CD GLU A 154 -23.769 10.537 26.264 1.00 48.64 C ATOM 1546 OE1 GLU A 154 -24.682 10.333 25.418 1.00 49.71 O ATOM 1547 OE2 GLU A 154 -23.972 11.077 27.387 1.00 53.14 O ATOM 1548 H GLU A 154 -19.712 11.362 24.592 1.00 0.00 H ATOM 1549 N GLN A 155 -20.790 10.008 21.595 1.00 20.52 N ATOM 1550 CA GLN A 155 -20.980 9.621 20.215 1.00 20.36 C ATOM 1551 C GLN A 155 -19.794 8.779 19.745 1.00 18.22 C ATOM 1552 O GLN A 155 -19.970 7.926 18.909 1.00 18.47 O ATOM 1553 CB GLN A 155 -21.256 10.833 19.304 1.00 22.41 C ATOM 1554 CG GLN A 155 -20.078 11.770 19.128 1.00 24.00 C ATOM 1555 CD GLN A 155 -20.462 13.071 18.443 1.00 25.94 C ATOM 1556 OE1 GLN A 155 -20.221 13.254 17.245 1.00 27.19 O ATOM 1557 NE2 GLN A 155 -21.088 13.964 19.201 1.00 26.33 N ATOM 1558 HE22 GLN A 155 -21.266 13.760 20.205 1.00 0.00 H ATOM 1559 HE21 GLN A 155 -21.400 14.867 18.790 1.00 0.00 H ATOM 1560 H GLN A 155 -20.560 10.992 21.843 1.00 0.00 H ATOM 1561 N LEU A 156 -18.597 8.995 20.289 1.00 16.74 N ATOM 1562 CA LEU A 156 -17.469 8.164 19.905 1.00 16.14 C ATOM 1563 C LEU A 156 -17.690 6.767 20.427 1.00 15.25 C ATOM 1564 O LEU A 156 -17.465 5.789 19.704 1.00 15.78 O ATOM 1565 CB LEU A 156 -16.090 8.716 20.366 1.00 16.96 C ATOM 1566 CG LEU A 156 -15.584 10.005 19.756 1.00 19.53 C ATOM 1567 CD1 LEU A 156 -14.267 10.347 20.454 1.00 20.45 C ATOM 1568 CD2 LEU A 156 -15.362 9.894 18.263 1.00 20.08 C ATOM 1569 H LEU A 156 -18.471 9.756 20.986 1.00 0.00 H ATOM 1570 N ARG A 157 -18.107 6.647 21.672 1.00 14.98 N ATOM 1571 CA ARG A 157 -18.379 5.325 22.246 1.00 16.56 C ATOM 1572 C ARG A 157 -19.437 4.604 21.411 1.00 16.22 C ATOM 1573 O ARG A 157 -19.332 3.386 21.178 1.00 15.67 O ATOM 1574 CB ARG A 157 -18.849 5.482 23.690 1.00 18.35 C ATOM 1575 CG ARG A 157 -19.116 4.105 24.364 1.00 19.66 C ATOM 1576 CD ARG A 157 -19.279 4.266 25.872 1.00 23.10 C ATOM 1577 NE ARG A 157 -20.416 5.089 26.271 1.00 26.85 N ATOM 1578 CZ ARG A 157 -21.671 4.641 26.351 1.00 30.37 C ATOM 1579 NH1 ARG A 157 -22.645 5.457 26.763 1.00 31.30 N ATOM 1580 NH2 ARG A 157 -21.948 3.378 26.007 1.00 31.32 N ATOM 1581 HE ARG A 157 -20.238 6.086 26.508 1.00 0.00 H ATOM 1582 HH12 ARG A 157 -23.623 5.109 26.826 1.00 0.00 H ATOM 1583 HH11 ARG A 157 -22.425 6.440 27.021 1.00 0.00 H ATOM 1584 HH22 ARG A 157 -22.924 3.025 26.068 1.00 0.00 H ATOM 1585 HH21 ARG A 157 -21.187 2.750 25.679 1.00 0.00 H ATOM 1586 H ARG A 157 -18.244 7.499 22.253 1.00 0.00 H ATOM 1587 N ALA A 158 -20.471 5.323 20.982 1.00 16.43 N ATOM 1588 CA ALA A 158 -21.519 4.718 20.152 1.00 15.86 C ATOM 1589 C ALA A 158 -20.980 4.113 18.879 1.00 15.04 C ATOM 1590 O ALA A 158 -21.344 2.974 18.514 1.00 15.88 O ATOM 1591 CB ALA A 158 -22.629 5.727 19.823 1.00 16.69 C ATOM 1592 H ALA A 158 -20.537 6.329 21.239 1.00 0.00 H ATOM 1593 N TYR A 159 -20.137 4.855 18.168 1.00 13.87 N ATOM 1594 CA TYR A 159 -19.459 4.326 17.006 1.00 13.52 C ATOM 1595 C TYR A 159 -18.569 3.169 17.382 1.00 12.73 C ATOM 1596 O TYR A 159 -18.681 2.095 16.772 1.00 12.93 O ATOM 1597 CB TYR A 159 -18.645 5.432 16.324 1.00 13.41 C ATOM 1598 CG TYR A 159 -17.693 4.885 15.291 1.00 12.77 C ATOM 1599 CD1 TYR A 159 -18.136 4.565 14.004 1.00 11.96 C ATOM 1600 CD2 TYR A 159 -16.350 4.702 15.600 1.00 13.19 C ATOM 1601 CE1 TYR A 159 -17.248 4.060 13.046 1.00 12.72 C ATOM 1602 CE2 TYR A 159 -15.456 4.203 14.627 1.00 12.60 C ATOM 1603 CZ TYR A 159 -15.948 3.863 13.366 1.00 12.70 C ATOM 1604 OH TYR A 159 -15.058 3.389 12.436 1.00 12.86 O ATOM 1605 HH TYR A 159 -15.538 3.189 11.594 1.00 0.00 H ATOM 1606 H TYR A 159 -19.961 5.839 18.454 1.00 0.00 H ATOM 1607 N LEU A 160 -17.704 3.312 18.381 1.00 12.35 N ATOM 1608 CA LEU A 160 -16.716 2.253 18.660 1.00 13.57 C ATOM 1609 C LEU A 160 -17.326 0.931 19.116 1.00 14.34 C ATOM 1610 O LEU A 160 -16.814 -0.132 18.747 1.00 16.19 O ATOM 1611 CB LEU A 160 -15.704 2.725 19.714 1.00 13.49 C ATOM 1612 CG LEU A 160 -14.884 3.949 19.258 1.00 14.57 C ATOM 1613 CD1 LEU A 160 -14.094 4.592 20.455 1.00 15.24 C ATOM 1614 CD2 LEU A 160 -13.858 3.633 18.108 1.00 15.47 C ATOM 1615 H LEU A 160 -17.724 4.171 18.966 1.00 0.00 H ATOM 1616 N GLU A 161 -18.422 0.961 19.883 1.00 14.87 N ATOM 1617 CA GLU A 161 -19.043 -0.256 20.400 1.00 16.81 C ATOM 1618 C GLU A 161 -20.081 -0.766 19.459 1.00 17.27 C ATOM 1619 O GLU A 161 -20.527 -1.904 19.605 1.00 20.83 O ATOM 1620 CB GLU A 161 -19.734 0.030 21.725 1.00 18.97 C ATOM 1621 CG GLU A 161 -18.803 0.287 22.851 1.00 21.20 C ATOM 1622 CD GLU A 161 -19.520 0.604 24.181 1.00 25.47 C ATOM 1623 OE1 GLU A 161 -20.743 0.907 24.183 1.00 27.05 O ATOM 1624 OE2 GLU A 161 -18.839 0.588 25.235 1.00 27.03 O ATOM 1625 H GLU A 161 -18.846 1.881 20.119 1.00 0.00 H ATOM 1626 N GLY A 162 -20.496 0.044 18.505 1.00 15.67 N ATOM 1627 CA GLY A 162 -21.635 -0.295 17.670 1.00 16.35 C ATOM 1628 C GLY A 162 -21.193 -0.425 16.232 1.00 14.79 C ATOM 1629 O GLY A 162 -20.752 -1.502 15.810 1.00 15.01 O ATOM 1630 H GLY A 162 -19.998 0.943 18.347 1.00 0.00 H ATOM 1631 N THR A 163 -21.317 0.650 15.475 1.00 15.10 N ATOM 1632 CA THR A 163 -21.016 0.679 14.062 1.00 15.89 C ATOM 1633 C THR A 163 -19.668 0.060 13.720 1.00 12.85 C ATOM 1634 O THR A 163 -19.560 -0.752 12.793 1.00 12.33 O ATOM 1635 CB THR A 163 -21.046 2.152 13.611 1.00 19.74 C ATOM 1636 OG1 THR A 163 -22.356 2.664 13.895 1.00 24.21 O ATOM 1637 CG2 THR A 163 -20.771 2.287 12.155 1.00 20.11 C ATOM 1638 HG1 THR A 163 -22.532 2.596 14.867 1.00 0.00 H ATOM 1639 H THR A 163 -21.651 1.528 15.922 1.00 0.00 H ATOM 1640 N CYS A 164 -18.625 0.420 14.448 1.00 12.42 N ATOM 1641 CA CYS A 164 -17.300 -0.072 14.149 1.00 12.49 C ATOM 1642 C CYS A 164 -17.282 -1.600 14.229 1.00 12.48 C ATOM 1643 O CYS A 164 -16.715 -2.242 13.356 1.00 12.79 O ATOM 1644 CB CYS A 164 -16.315 0.551 15.158 1.00 12.78 C ATOM 1645 SG CYS A 164 -14.572 0.196 14.850 1.00 15.14 S ATOM 1646 H CYS A 164 -18.761 1.068 15.250 1.00 0.00 H ATOM 1647 N VAL A 165 -17.822 -2.160 15.298 1.00 12.95 N ATOM 1648 CA VAL A 165 -17.842 -3.626 15.465 1.00 14.40 C ATOM 1649 C VAL A 165 -18.682 -4.278 14.376 1.00 13.46 C ATOM 1650 O VAL A 165 -18.328 -5.340 13.849 1.00 12.76 O ATOM 1651 CB VAL A 165 -18.322 -3.999 16.860 1.00 16.60 C ATOM 1652 CG1 VAL A 165 -18.716 -5.508 16.981 1.00 18.80 C ATOM 1653 CG2 VAL A 165 -17.180 -3.627 17.857 1.00 18.21 C ATOM 1654 H VAL A 165 -18.240 -1.556 16.034 1.00 0.00 H ATOM 1655 N GLU A 166 -19.821 -3.684 14.062 1.00 12.10 N ATOM 1656 CA GLU A 166 -20.687 -4.256 13.027 1.00 13.04 C ATOM 1657 C GLU A 166 -19.948 -4.354 11.695 1.00 11.64 C ATOM 1658 O GLU A 166 -20.052 -5.398 10.996 1.00 12.03 O ATOM 1659 CB GLU A 166 -21.946 -3.407 12.897 1.00 16.70 C ATOM 1660 CG GLU A 166 -22.770 -3.516 14.150 1.00 21.67 C ATOM 1661 CD GLU A 166 -23.827 -2.443 14.211 1.00 28.17 C ATOM 1662 OE1 GLU A 166 -24.080 -1.842 13.149 1.00 29.58 O ATOM 1663 OE2 GLU A 166 -24.376 -2.205 15.315 1.00 31.92 O ATOM 1664 H GLU A 166 -20.103 -2.810 14.550 1.00 0.00 H ATOM 1665 N TRP A 167 -19.243 -3.299 11.299 1.00 10.97 N ATOM 1666 CA TRP A 167 -18.528 -3.334 10.014 1.00 10.53 C ATOM 1667 C TRP A 167 -17.314 -4.209 10.059 1.00 9.51 C ATOM 1668 O TRP A 167 -17.026 -4.910 9.079 1.00 10.56 O ATOM 1669 CB TRP A 167 -18.246 -1.902 9.552 1.00 10.80 C ATOM 1670 CG TRP A 167 -19.473 -1.259 8.949 1.00 11.14 C ATOM 1671 CD1 TRP A 167 -20.466 -0.565 9.615 1.00 12.07 C ATOM 1672 CD2 TRP A 167 -19.880 -1.302 7.581 1.00 12.00 C ATOM 1673 NE1 TRP A 167 -21.448 -0.182 8.732 1.00 12.86 N ATOM 1674 CE2 TRP A 167 -21.101 -0.596 7.474 1.00 12.88 C ATOM 1675 CE3 TRP A 167 -19.292 -1.800 6.420 1.00 13.66 C ATOM 1676 CZ2 TRP A 167 -21.767 -0.437 6.260 1.00 13.94 C ATOM 1677 CZ3 TRP A 167 -19.956 -1.627 5.212 1.00 14.13 C ATOM 1678 CH2 TRP A 167 -21.183 -0.952 5.156 1.00 14.20 C ATOM 1679 HE1 TRP A 167 -22.314 0.338 8.980 1.00 0.00 H ATOM 1680 H TRP A 167 -19.197 -2.450 11.897 1.00 0.00 H ATOM 1681 N LEU A 168 -16.637 -4.280 11.205 1.00 10.39 N ATOM 1682 CA LEU A 168 -15.515 -5.217 11.342 1.00 11.02 C ATOM 1683 C LEU A 168 -15.999 -6.645 11.133 1.00 10.88 C ATOM 1684 O LEU A 168 -15.369 -7.412 10.387 1.00 10.88 O ATOM 1685 CB LEU A 168 -14.859 -5.032 12.709 1.00 10.37 C ATOM 1686 CG LEU A 168 -13.752 -6.033 13.017 1.00 10.18 C ATOM 1687 CD1 LEU A 168 -12.640 -6.143 11.936 1.00 10.76 C ATOM 1688 CD2 LEU A 168 -13.115 -5.686 14.362 1.00 10.82 C ATOM 1689 H LEU A 168 -16.904 -3.670 12.004 1.00 0.00 H ATOM 1690 N ARG A 169 -17.129 -6.985 11.735 1.00 11.37 N ATOM 1691 CA ARG A 169 -17.690 -8.339 11.560 1.00 12.09 C ATOM 1692 C ARG A 169 -18.018 -8.573 10.098 1.00 11.63 C ATOM 1693 O ARG A 169 -17.811 -9.696 9.594 1.00 12.46 O ATOM 1694 CB ARG A 169 -18.928 -8.542 12.445 1.00 13.31 C ATOM 1695 CG ARG A 169 -18.532 -8.632 13.935 1.00 16.54 C ATOM 1696 CD ARG A 169 -19.597 -9.181 14.774 1.00 22.70 C ATOM 1697 NE ARG A 169 -20.635 -8.221 14.916 1.00 26.28 N ATOM 1698 CZ ARG A 169 -21.008 -7.693 16.076 1.00 30.41 C ATOM 1699 NH1 ARG A 169 -20.433 -8.067 17.206 1.00 33.15 N ATOM 1700 NH2 ARG A 169 -21.967 -6.780 16.100 1.00 31.37 N ATOM 1701 HE ARG A 169 -21.134 -7.912 14.057 1.00 0.00 H ATOM 1702 HH12 ARG A 169 -20.735 -7.645 18.107 1.00 0.00 H ATOM 1703 HH11 ARG A 169 -19.679 -8.783 17.194 1.00 0.00 H ATOM 1704 HH22 ARG A 169 -22.264 -6.362 17.005 1.00 0.00 H ATOM 1705 HH21 ARG A 169 -22.423 -6.481 15.214 1.00 0.00 H ATOM 1706 H ARG A 169 -17.624 -6.294 12.334 1.00 0.00 H ATOM 1707 N ARG A 170 -18.585 -7.603 9.394 1.00 11.63 N ATOM 1708 CA ARG A 170 -18.906 -7.754 7.999 1.00 11.25 C ATOM 1709 C ARG A 170 -17.651 -8.004 7.188 1.00 12.02 C ATOM 1710 O ARG A 170 -17.620 -8.889 6.330 1.00 12.90 O ATOM 1711 CB ARG A 170 -19.594 -6.456 7.520 1.00 12.28 C ATOM 1712 CG ARG A 170 -19.978 -6.454 6.053 1.00 14.26 C ATOM 1713 CD ARG A 170 -20.400 -5.041 5.700 1.00 16.14 C ATOM 1714 NE ARG A 170 -20.918 -4.834 4.356 1.00 19.05 N ATOM 1715 CZ ARG A 170 -22.190 -4.957 4.014 1.00 23.57 C ATOM 1716 NH1 ARG A 170 -23.082 -5.404 4.897 1.00 25.53 N ATOM 1717 NH2 ARG A 170 -22.565 -4.676 2.761 1.00 24.96 N ATOM 1718 HE ARG A 170 -20.241 -4.571 3.612 1.00 0.00 H ATOM 1719 HH12 ARG A 170 -24.081 -5.499 4.624 1.00 0.00 H ATOM 1720 HH11 ARG A 170 -22.779 -5.658 5.859 1.00 0.00 H ATOM 1721 HH22 ARG A 170 -23.563 -4.770 2.483 1.00 0.00 H ATOM 1722 HH21 ARG A 170 -21.859 -4.364 2.064 1.00 0.00 H ATOM 1723 H ARG A 170 -18.805 -6.703 9.866 1.00 0.00 H ATOM 1724 N TYR A 171 -16.599 -7.219 7.464 1.00 11.57 N ATOM 1725 CA TYR A 171 -15.372 -7.362 6.696 1.00 11.85 C ATOM 1726 C TYR A 171 -14.739 -8.731 6.926 1.00 11.69 C ATOM 1727 O TYR A 171 -14.271 -9.368 5.982 1.00 12.07 O ATOM 1728 CB TYR A 171 -14.368 -6.250 7.034 1.00 12.12 C ATOM 1729 CG TYR A 171 -14.787 -4.835 6.721 1.00 11.62 C ATOM 1730 CD1 TYR A 171 -15.634 -4.510 5.673 1.00 12.16 C ATOM 1731 CD2 TYR A 171 -14.297 -3.830 7.509 1.00 11.36 C ATOM 1732 CE1 TYR A 171 -15.974 -3.183 5.399 1.00 11.88 C ATOM 1733 CE2 TYR A 171 -14.614 -2.497 7.254 1.00 10.74 C ATOM 1734 CZ TYR A 171 -15.432 -2.196 6.202 1.00 10.93 C ATOM 1735 OH TYR A 171 -15.767 -0.875 6.023 1.00 12.14 O ATOM 1736 HH TYR A 171 -14.944 -0.344 5.879 1.00 0.00 H ATOM 1737 H TYR A 171 -16.660 -6.511 8.224 1.00 0.00 H ATOM 1738 N LEU A 172 -14.733 -9.181 8.179 1.00 11.31 N ATOM 1739 CA LEU A 172 -14.159 -10.476 8.508 1.00 11.92 C ATOM 1740 C LEU A 172 -14.855 -11.590 7.757 1.00 12.54 C ATOM 1741 O LEU A 172 -14.174 -12.480 7.265 1.00 13.56 O ATOM 1742 CB LEU A 172 -14.231 -10.714 10.023 1.00 11.88 C ATOM 1743 CG LEU A 172 -13.204 -9.884 10.858 1.00 12.88 C ATOM 1744 CD1 LEU A 172 -13.618 -9.958 12.332 1.00 13.72 C ATOM 1745 CD2 LEU A 172 -11.770 -10.396 10.593 1.00 14.23 C ATOM 1746 H LEU A 172 -15.145 -8.597 8.934 1.00 0.00 H ATOM 1747 N GLU A 173 -16.174 -11.537 7.684 1.00 12.07 N ATOM 1748 CA GLU A 173 -16.909 -12.558 6.926 1.00 13.77 C ATOM 1749 C GLU A 173 -16.630 -12.429 5.415 1.00 13.65 C ATOM 1750 O GLU A 173 -16.306 -13.429 4.751 1.00 14.75 O ATOM 1751 CB GLU A 173 -18.397 -12.434 7.195 1.00 15.81 C ATOM 1752 CG GLU A 173 -19.206 -13.482 6.387 1.00 17.39 C ATOM 1753 CD GLU A 173 -20.671 -13.465 6.725 1.00 20.76 C ATOM 1754 OE1 GLU A 173 -21.095 -12.737 7.644 1.00 22.71 O ATOM 1755 OE2 GLU A 173 -21.438 -14.170 6.038 1.00 22.66 O ATOM 1756 H GLU A 173 -16.691 -10.772 8.163 1.00 0.00 H ATOM 1757 N ASN A 174 -16.696 -11.221 4.887 1.00 12.78 N ATOM 1758 CA ASN A 174 -16.509 -11.047 3.442 1.00 14.40 C ATOM 1759 C ASN A 174 -15.119 -11.443 2.988 1.00 13.95 C ATOM 1760 O ASN A 174 -14.895 -12.010 1.902 1.00 14.29 O ATOM 1761 CB ASN A 174 -16.804 -9.606 3.052 1.00 15.97 C ATOM 1762 CG ASN A 174 -18.317 -9.267 3.162 1.00 18.10 C ATOM 1763 OD1 ASN A 174 -19.171 -10.158 3.368 1.00 20.13 O ATOM 1764 ND2 ASN A 174 -18.647 -7.998 3.017 1.00 19.00 N ATOM 1765 HD22 ASN A 174 -17.909 -7.285 2.847 1.00 0.00 H ATOM 1766 HD21 ASN A 174 -19.645 -7.711 3.073 1.00 0.00 H ATOM 1767 H ASN A 174 -16.880 -10.396 5.493 1.00 0.00 H ATOM 1768 N GLY A 175 -14.172 -11.169 3.864 1.00 13.66 N ATOM 1769 CA GLY A 175 -12.782 -11.435 3.585 1.00 15.16 C ATOM 1770 C GLY A 175 -12.294 -12.699 4.239 1.00 15.32 C ATOM 1771 O GLY A 175 -11.074 -12.829 4.371 1.00 15.90 O ATOM 1772 H GLY A 175 -14.434 -10.750 4.779 1.00 0.00 H ATOM 1773 N LYS A 176 -13.182 -13.618 4.627 1.00 15.10 N ATOM 1774 CA LYS A 176 -12.749 -14.726 5.466 1.00 16.18 C ATOM 1775 C LYS A 176 -11.610 -15.566 4.890 1.00 17.64 C ATOM 1776 O LYS A 176 -10.770 -16.039 5.668 1.00 18.50 O ATOM 1777 CB LYS A 176 -13.934 -15.612 5.915 1.00 16.19 C ATOM 1778 CG LYS A 176 -14.660 -16.422 4.813 1.00 18.37 C ATOM 1779 CD LYS A 176 -15.968 -16.965 5.368 1.00 22.77 C ATOM 1780 CE LYS A 176 -16.788 -17.692 4.308 1.00 26.31 C ATOM 1781 NZ LYS A 176 -16.202 -19.017 4.046 1.00 29.72 N ATOM 1782 HZ1 LYS A 176 -15.226 -18.902 3.707 1.00 0.00 H ATOM 1783 HZ2 LYS A 176 -16.202 -19.575 4.924 1.00 0.00 H ATOM 1784 HZ3 LYS A 176 -16.766 -19.507 3.323 1.00 0.00 H ATOM 1785 H LYS A 176 -14.176 -13.543 4.332 1.00 0.00 H ATOM 1786 N GLU A 177 -11.572 -15.727 3.562 1.00 17.91 N ATOM 1787 CA GLU A 177 -10.566 -16.597 2.951 1.00 21.24 C ATOM 1788 C GLU A 177 -9.155 -16.130 3.225 1.00 20.42 C ATOM 1789 O GLU A 177 -8.231 -16.937 3.255 1.00 22.53 O ATOM 1790 CB GLU A 177 -10.802 -16.768 1.447 1.00 25.74 C ATOM 1791 CG GLU A 177 -12.156 -17.375 1.145 1.00 31.72 C ATOM 1792 CD GLU A 177 -12.291 -18.826 1.632 1.00 37.15 C ATOM 1793 OE1 GLU A 177 -11.354 -19.636 1.414 1.00 39.10 O ATOM 1794 OE2 GLU A 177 -13.337 -19.157 2.236 1.00 38.91 O ATOM 1795 H GLU A 177 -12.261 -15.231 2.961 1.00 0.00 H ATOM 1796 N THR A 178 -8.962 -14.825 3.450 1.00 18.74 N ATOM 1797 CA THR A 178 -7.654 -14.355 3.912 1.00 18.80 C ATOM 1798 C THR A 178 -7.655 -13.834 5.356 1.00 18.22 C ATOM 1799 O THR A 178 -6.788 -14.180 6.164 1.00 18.03 O ATOM 1800 CB THR A 178 -7.112 -13.259 2.998 1.00 19.28 C ATOM 1801 OG1 THR A 178 -8.120 -12.272 2.824 1.00 18.91 O ATOM 1802 CG2 THR A 178 -6.819 -13.822 1.642 1.00 20.89 C ATOM 1803 HG1 THR A 178 -7.780 -11.555 2.232 1.00 0.00 H ATOM 1804 H THR A 178 -9.737 -14.148 3.298 1.00 0.00 H ATOM 1805 N LEU A 179 -8.585 -12.932 5.677 1.00 17.57 N ATOM 1806 CA LEU A 179 -8.571 -12.324 7.005 1.00 16.59 C ATOM 1807 C LEU A 179 -8.630 -13.304 8.192 1.00 18.41 C ATOM 1808 O LEU A 179 -8.055 -13.038 9.269 1.00 19.75 O ATOM 1809 CB LEU A 179 -9.745 -11.334 7.145 1.00 15.73 C ATOM 1810 CG LEU A 179 -9.636 -10.127 6.244 1.00 14.38 C ATOM 1811 CD1 LEU A 179 -10.864 -9.271 6.515 1.00 14.69 C ATOM 1812 CD2 LEU A 179 -8.352 -9.342 6.482 1.00 14.89 C ATOM 1813 H LEU A 179 -9.315 -12.664 4.986 1.00 0.00 H ATOM 1814 N GLN A 180 -9.289 -14.439 7.988 1.00 19.35 N ATOM 1815 CA GLN A 180 -9.472 -15.410 9.052 1.00 20.77 C ATOM 1816 C GLN A 180 -8.659 -16.659 8.777 1.00 20.89 C ATOM 1817 O GLN A 180 -8.932 -17.743 9.316 1.00 20.79 O ATOM 1818 CB GLN A 180 -10.944 -15.725 9.171 1.00 22.26 C ATOM 1819 CG GLN A 180 -11.729 -14.434 9.267 1.00 24.02 C ATOM 1820 CD GLN A 180 -12.997 -14.631 9.989 1.00 25.05 C ATOM 1821 OE1 GLN A 180 -12.995 -14.936 11.186 1.00 25.87 O ATOM 1822 NE2 GLN A 180 -14.109 -14.495 9.277 1.00 24.67 N ATOM 1823 HE22 GLN A 180 -14.054 -14.236 8.271 1.00 0.00 H ATOM 1824 HE21 GLN A 180 -15.035 -14.647 9.725 1.00 0.00 H ATOM 1825 H GLN A 180 -9.682 -14.637 7.046 1.00 0.00 H ATOM 1826 N ARG A 181 -7.669 -16.496 7.908 1.00 20.66 N ATOM 1827 CA ARG A 181 -6.664 -17.553 7.653 1.00 20.40 C ATOM 1828 C ARG A 181 -5.378 -17.162 8.355 1.00 19.56 C ATOM 1829 O ARG A 181 -4.941 -16.018 8.228 1.00 20.40 O ATOM 1830 CB ARG A 181 -6.387 -17.669 6.123 1.00 21.33 C ATOM 1831 CG ARG A 181 -5.470 -18.836 5.618 1.00 23.08 C ATOM 1832 CD ARG A 181 -5.240 -18.772 4.095 1.00 25.34 C ATOM 1833 NE ARG A 181 -4.090 -17.959 3.691 1.00 26.86 N ATOM 1834 CZ ARG A 181 -3.948 -17.386 2.493 1.00 27.35 C ATOM 1835 NH1 ARG A 181 -2.859 -16.664 2.209 1.00 27.50 N ATOM 1836 NH2 ARG A 181 -4.903 -17.522 1.573 1.00 28.10 N ATOM 1837 HE ARG A 181 -3.330 -17.818 4.387 1.00 0.00 H ATOM 1838 HH12 ARG A 181 -2.758 -16.222 1.273 1.00 0.00 H ATOM 1839 HH11 ARG A 181 -2.113 -16.545 2.924 1.00 0.00 H ATOM 1840 HH22 ARG A 181 -4.793 -17.076 0.640 1.00 0.00 H ATOM 1841 HH21 ARG A 181 -5.758 -18.074 1.788 1.00 0.00 H ATOM 1842 H ARG A 181 -7.597 -15.597 7.390 1.00 0.00 H ATOM 1843 N THR A 182 -4.750 -18.069 9.092 1.00 18.98 N ATOM 1844 CA THR A 182 -3.400 -17.786 9.585 1.00 18.45 C ATOM 1845 C THR A 182 -2.437 -18.468 8.625 1.00 17.30 C ATOM 1846 O THR A 182 -2.707 -19.542 8.116 1.00 18.49 O ATOM 1847 CB THR A 182 -3.152 -18.280 11.040 1.00 20.89 C ATOM 1848 OG1 THR A 182 -3.442 -19.684 11.120 1.00 23.09 O ATOM 1849 CG2 THR A 182 -4.081 -17.575 12.004 1.00 22.51 C ATOM 1850 HG1 THR A 182 -2.852 -20.178 10.497 1.00 0.00 H ATOM 1851 H THR A 182 -5.212 -18.973 9.318 1.00 0.00 H ATOM 1852 N ASP A 183 -1.320 -17.799 8.340 1.00 15.51 N ATOM 1853 CA ASP A 183 -0.242 -18.375 7.558 1.00 14.73 C ATOM 1854 C ASP A 183 0.941 -18.648 8.493 1.00 14.00 C ATOM 1855 O ASP A 183 1.627 -17.741 8.935 1.00 13.71 O ATOM 1856 CB ASP A 183 0.170 -17.415 6.432 1.00 16.21 C ATOM 1857 CG ASP A 183 -0.952 -17.146 5.430 1.00 18.22 C ATOM 1858 OD1 ASP A 183 -1.985 -17.814 5.481 1.00 20.73 O ATOM 1859 OD2 ASP A 183 -0.793 -16.246 4.575 1.00 17.35 O ATOM 1860 H ASP A 183 -1.217 -16.826 8.692 1.00 0.00 H ATOM 1861 N ALA A 184 1.151 -19.921 8.826 1.00 14.39 N ATOM 1862 CA ALA A 184 2.263 -20.277 9.692 1.00 14.02 C ATOM 1863 C ALA A 184 3.574 -19.969 8.996 1.00 14.44 C ATOM 1864 O ALA A 184 3.694 -20.105 7.781 1.00 14.37 O ATOM 1865 CB ALA A 184 2.198 -21.764 10.031 1.00 15.03 C ATOM 1866 H ALA A 184 0.517 -20.662 8.465 1.00 0.00 H ATOM 1867 N PRO A 185 4.580 -19.545 9.757 1.00 12.39 N ATOM 1868 CA PRO A 185 5.846 -19.267 9.070 1.00 12.91 C ATOM 1869 C PRO A 185 6.476 -20.513 8.456 1.00 13.41 C ATOM 1870 O PRO A 185 6.469 -21.621 9.045 1.00 14.62 O ATOM 1871 CB PRO A 185 6.735 -18.760 10.181 1.00 13.85 C ATOM 1872 CG PRO A 185 6.159 -19.332 11.432 1.00 15.03 C ATOM 1873 CD PRO A 185 4.665 -19.371 11.206 1.00 14.18 C ATOM 1874 N LYS A 186 7.043 -20.321 7.274 1.00 12.05 N ATOM 1875 CA LYS A 186 7.860 -21.352 6.621 1.00 13.39 C ATOM 1876 C LYS A 186 9.264 -21.141 7.195 1.00 13.55 C ATOM 1877 O LYS A 186 9.832 -20.038 7.065 1.00 13.80 O ATOM 1878 CB LYS A 186 7.815 -21.165 5.102 1.00 15.99 C ATOM 1879 CG LYS A 186 6.376 -21.246 4.544 1.00 18.90 C ATOM 1880 CD LYS A 186 6.266 -20.979 3.058 1.00 22.50 C ATOM 1881 CE LYS A 186 4.801 -20.797 2.659 1.00 24.07 C ATOM 1882 NZ LYS A 186 3.890 -21.738 3.385 1.00 24.42 N ATOM 1883 HZ1 LYS A 186 4.163 -22.718 3.169 1.00 0.00 H ATOM 1884 HZ2 LYS A 186 3.967 -21.573 4.409 1.00 0.00 H ATOM 1885 HZ3 LYS A 186 2.910 -21.574 3.079 1.00 0.00 H ATOM 1886 H LYS A 186 6.905 -19.410 6.792 1.00 0.00 H ATOM 1887 N THR A 187 9.794 -22.131 7.899 1.00 13.54 N ATOM 1888 CA THR A 187 11.030 -21.938 8.651 1.00 13.99 C ATOM 1889 C THR A 187 12.151 -22.786 8.107 1.00 14.48 C ATOM 1890 O THR A 187 11.914 -23.906 7.668 1.00 15.12 O ATOM 1891 CB THR A 187 10.854 -22.261 10.137 1.00 14.32 C ATOM 1892 OG1 THR A 187 10.437 -23.640 10.296 1.00 15.57 O ATOM 1893 CG2 THR A 187 9.830 -21.308 10.758 1.00 13.96 C ATOM 1894 HG1 THR A 187 11.125 -24.238 9.910 1.00 0.00 H ATOM 1895 H THR A 187 9.323 -23.058 7.916 1.00 0.00 H ATOM 1896 N HIS A 188 13.361 -22.231 8.126 1.00 13.87 N ATOM 1897 CA HIS A 188 14.576 -22.965 7.765 1.00 14.30 C ATOM 1898 C HIS A 188 15.789 -22.300 8.370 1.00 14.51 C ATOM 1899 O HIS A 188 15.730 -21.137 8.776 1.00 14.41 O ATOM 1900 CB HIS A 188 14.707 -23.097 6.231 1.00 15.39 C ATOM 1901 CG HIS A 188 15.150 -21.848 5.526 1.00 16.62 C ATOM 1902 ND1 HIS A 188 14.299 -20.809 5.195 1.00 16.63 N ATOM 1903 CD2 HIS A 188 16.376 -21.472 5.095 1.00 17.53 C ATOM 1904 CE1 HIS A 188 14.977 -19.866 4.569 1.00 17.34 C ATOM 1905 NE2 HIS A 188 16.244 -20.232 4.516 1.00 17.80 N ATOM 1906 H HIS A 188 13.447 -21.234 8.409 1.00 0.00 H ATOM 1907 N MET A 189 16.896 -23.029 8.401 1.00 16.35 N ATOM 1908 CA MET A 189 18.149 -22.541 8.934 1.00 17.27 C ATOM 1909 C MET A 189 19.184 -22.497 7.844 1.00 19.22 C ATOM 1910 O MET A 189 19.256 -23.438 7.044 1.00 20.87 O ATOM 1911 CB MET A 189 18.627 -23.463 10.036 1.00 18.73 C ATOM 1912 CG MET A 189 19.742 -22.839 10.856 1.00 20.61 C ATOM 1913 SD MET A 189 20.201 -23.902 12.233 1.00 22.66 S ATOM 1914 CE MET A 189 18.651 -24.074 13.135 1.00 22.16 C ATOM 1915 H MET A 189 16.862 -23.998 8.024 1.00 0.00 H ATOM 1916 N THR A 190 19.959 -21.415 7.792 1.00 19.93 N ATOM 1917 CA THR A 190 21.123 -21.355 6.887 1.00 21.36 C ATOM 1918 C THR A 190 22.398 -21.316 7.722 1.00 22.38 C ATOM 1919 O THR A 190 22.376 -20.969 8.908 1.00 22.26 O ATOM 1920 CB THR A 190 21.101 -20.124 5.969 1.00 21.32 C ATOM 1921 OG1 THR A 190 21.128 -18.918 6.750 1.00 22.75 O ATOM 1922 CG2 THR A 190 19.839 -20.099 5.066 1.00 20.09 C ATOM 1923 HG1 THR A 190 21.113 -18.134 6.145 1.00 0.00 H ATOM 1924 H THR A 190 19.740 -20.599 8.399 1.00 0.00 H ATOM 1925 N HIS A 191 23.516 -21.674 7.089 1.00 23.86 N ATOM 1926 CA HIS A 191 24.781 -21.903 7.807 1.00 25.59 C ATOM 1927 C HIS A 191 25.835 -21.293 6.906 1.00 27.45 C ATOM 1928 O HIS A 191 25.884 -21.610 5.707 1.00 27.72 O ATOM 1929 CB HIS A 191 25.035 -23.395 7.974 1.00 25.69 C ATOM 1930 CG HIS A 191 26.348 -23.726 8.633 1.00 25.18 C ATOM 1931 ND1 HIS A 191 27.527 -23.826 7.934 1.00 26.00 N ATOM 1932 CD2 HIS A 191 26.657 -23.995 9.929 1.00 25.37 C ATOM 1933 CE1 HIS A 191 28.514 -24.128 8.768 1.00 25.59 C ATOM 1934 NE2 HIS A 191 28.011 -24.237 9.985 1.00 25.91 N ATOM 1935 H HIS A 191 23.494 -21.795 6.056 1.00 0.00 H ATOM 1936 N HIS A 192 26.617 -20.373 7.463 1.00 29.05 N ATOM 1937 CA HIS A 192 27.620 -19.609 6.712 1.00 31.26 C ATOM 1938 C HIS A 192 28.920 -19.679 7.506 1.00 30.08 C ATOM 1939 O HIS A 192 28.934 -19.210 8.617 1.00 30.60 O ATOM 1940 CB HIS A 192 27.257 -18.111 6.680 1.00 33.99 C ATOM 1941 CG HIS A 192 25.851 -17.806 6.254 1.00 36.94 C ATOM 1942 ND1 HIS A 192 25.487 -17.680 4.928 1.00 38.64 N ATOM 1943 CD2 HIS A 192 24.733 -17.538 6.974 1.00 38.57 C ATOM 1944 CE1 HIS A 192 24.202 -17.384 4.847 1.00 39.27 C ATOM 1945 NE2 HIS A 192 23.719 -17.292 6.075 1.00 39.57 N ATOM 1946 H HIS A 192 26.513 -20.186 8.481 1.00 0.00 H ATOM 1947 N ALA A 193 30.017 -20.179 6.959 1.00 29.21 N ATOM 1948 CA ALA A 193 31.291 -20.043 7.701 1.00 28.58 C ATOM 1949 C ALA A 193 31.742 -18.557 7.718 1.00 28.27 C ATOM 1950 O ALA A 193 31.633 -17.831 6.711 1.00 29.00 O ATOM 1951 CB ALA A 193 32.353 -20.937 7.115 1.00 29.27 C ATOM 1952 H ALA A 193 29.985 -20.654 6.034 1.00 0.00 H ATOM 1953 N VAL A 194 32.218 -18.077 8.855 1.00 27.54 N ATOM 1954 CA VAL A 194 32.839 -16.761 8.893 1.00 27.25 C ATOM 1955 C VAL A 194 34.348 -16.875 9.072 1.00 25.19 C ATOM 1956 O VAL A 194 35.082 -15.884 9.007 1.00 26.15 O ATOM 1957 CB VAL A 194 32.206 -15.835 9.956 1.00 28.54 C ATOM 1958 CG1 VAL A 194 30.688 -15.745 9.747 1.00 28.74 C ATOM 1959 CG2 VAL A 194 32.572 -16.281 11.381 1.00 28.36 C ATOM 1960 H VAL A 194 32.148 -18.642 9.725 1.00 0.00 H ATOM 1961 N SER A 195 34.817 -18.104 9.289 1.00 21.88 N ATOM 1962 CA SER A 195 36.220 -18.415 9.400 1.00 21.97 C ATOM 1963 C SER A 195 36.292 -19.930 9.365 1.00 23.40 C ATOM 1964 O SER A 195 35.250 -20.564 9.201 1.00 24.35 O ATOM 1965 CB SER A 195 36.753 -17.887 10.721 1.00 20.86 C ATOM 1966 OG SER A 195 36.352 -18.738 11.793 1.00 20.52 O ATOM 1967 HG SER A 195 36.706 -18.382 12.646 1.00 0.00 H ATOM 1968 H SER A 195 34.133 -18.881 9.383 1.00 0.00 H ATOM 1969 N ASP A 196 37.480 -20.507 9.550 1.00 24.91 N ATOM 1970 CA ASP A 196 37.609 -21.949 9.670 1.00 26.98 C ATOM 1971 C ASP A 196 37.137 -22.456 11.026 1.00 26.44 C ATOM 1972 O ASP A 196 37.128 -23.674 11.258 1.00 28.19 O ATOM 1973 CB ASP A 196 39.072 -22.383 9.520 1.00 29.46 C ATOM 1974 CG ASP A 196 39.600 -22.229 8.098 1.00 32.86 C ATOM 1975 OD1 ASP A 196 38.790 -22.220 7.147 1.00 34.22 O ATOM 1976 OD2 ASP A 196 40.847 -22.142 7.954 1.00 33.92 O ATOM 1977 H ASP A 196 38.331 -19.913 9.610 1.00 0.00 H ATOM 1978 N HIS A 197 36.794 -21.545 11.939 1.00 24.13 N ATOM 1979 CA HIS A 197 36.541 -21.957 13.327 1.00 23.46 C ATOM 1980 C HIS A 197 35.204 -21.497 13.871 1.00 22.39 C ATOM 1981 O HIS A 197 34.822 -21.909 14.962 1.00 22.08 O ATOM 1982 CB HIS A 197 37.647 -21.449 14.240 1.00 25.48 C ATOM 1983 CG HIS A 197 39.014 -21.909 13.837 1.00 28.88 C ATOM 1984 ND1 HIS A 197 39.449 -23.202 14.027 1.00 30.91 N ATOM 1985 CD2 HIS A 197 40.030 -21.256 13.222 1.00 30.55 C ATOM 1986 CE1 HIS A 197 40.686 -23.319 13.574 1.00 31.31 C ATOM 1987 NE2 HIS A 197 41.060 -22.153 13.077 1.00 31.94 N ATOM 1988 H HIS A 197 36.706 -20.545 11.669 1.00 0.00 H ATOM 1989 N GLU A 198 34.529 -20.603 13.148 1.00 21.26 N ATOM 1990 CA GLU A 198 33.237 -20.077 13.589 1.00 22.72 C ATOM 1991 C GLU A 198 32.296 -20.036 12.412 1.00 23.09 C ATOM 1992 O GLU A 198 32.742 -19.871 11.263 1.00 23.71 O ATOM 1993 CB GLU A 198 33.371 -18.636 14.046 1.00 26.04 C ATOM 1994 CG GLU A 198 33.937 -18.467 15.363 1.00 28.20 C ATOM 1995 CD GLU A 198 35.426 -18.163 15.350 1.00 29.08 C ATOM 1996 OE1 GLU A 198 36.028 -17.696 14.334 1.00 28.41 O ATOM 1997 OE2 GLU A 198 36.003 -18.397 16.408 1.00 30.28 O ATOM 1998 H GLU A 198 34.931 -20.271 12.248 1.00 0.00 H ATOM 1999 N ALA A 199 31.001 -20.124 12.704 1.00 22.77 N ATOM 2000 CA ALA A 199 29.994 -20.024 11.654 1.00 23.32 C ATOM 2001 C ALA A 199 28.778 -19.283 12.160 1.00 22.33 C ATOM 2002 O ALA A 199 28.506 -19.242 13.363 1.00 21.98 O ATOM 2003 CB ALA A 199 29.610 -21.385 11.169 1.00 24.25 C ATOM 2004 H ALA A 199 30.704 -20.265 13.691 1.00 0.00 H ATOM 2005 N THR A 200 28.016 -18.715 11.235 1.00 22.02 N ATOM 2006 CA THR A 200 26.762 -18.085 11.613 1.00 21.89 C ATOM 2007 C THR A 200 25.664 -19.046 11.271 1.00 19.52 C ATOM 2008 O THR A 200 25.648 -19.593 10.146 1.00 20.10 O ATOM 2009 CB THR A 200 26.521 -16.802 10.796 1.00 23.98 C ATOM 2010 OG1 THR A 200 27.551 -15.855 11.101 1.00 25.87 O ATOM 2011 CG2 THR A 200 25.168 -16.172 11.149 1.00 23.56 C ATOM 2012 HG1 THR A 200 27.402 -15.027 10.579 1.00 0.00 H ATOM 2013 H THR A 200 28.316 -18.720 10.239 1.00 0.00 H ATOM 2014 N LEU A 201 24.754 -19.278 12.232 1.00 17.42 N ATOM 2015 CA LEU A 201 23.484 -19.963 11.954 1.00 15.89 C ATOM 2016 C LEU A 201 22.393 -18.918 11.935 1.00 15.71 C ATOM 2017 O LEU A 201 22.239 -18.107 12.857 1.00 17.28 O ATOM 2018 CB LEU A 201 23.175 -20.999 13.058 1.00 16.83 C ATOM 2019 CG LEU A 201 24.221 -22.094 13.294 1.00 17.66 C ATOM 2020 CD1 LEU A 201 23.894 -22.859 14.571 1.00 17.39 C ATOM 2021 CD2 LEU A 201 24.229 -23.068 12.116 1.00 19.25 C ATOM 2022 H LEU A 201 24.955 -18.963 13.203 1.00 0.00 H ATOM 2023 N ARG A 202 21.609 -18.920 10.864 1.00 14.83 N ATOM 2024 CA ARG A 202 20.523 -17.950 10.754 1.00 14.65 C ATOM 2025 C ARG A 202 19.214 -18.717 10.592 1.00 14.60 C ATOM 2026 O ARG A 202 19.043 -19.528 9.670 1.00 15.62 O ATOM 2027 CB ARG A 202 20.733 -16.966 9.574 1.00 15.27 C ATOM 2028 CG ARG A 202 19.606 -15.906 9.407 1.00 16.26 C ATOM 2029 CD ARG A 202 20.026 -14.768 8.405 1.00 18.61 C ATOM 2030 NE ARG A 202 20.998 -13.869 9.043 1.00 21.19 N ATOM 2031 CZ ARG A 202 22.280 -13.781 8.687 1.00 24.12 C ATOM 2032 NH1 ARG A 202 22.717 -14.502 7.675 1.00 25.36 N ATOM 2033 NH2 ARG A 202 23.113 -12.975 9.345 1.00 25.44 N ATOM 2034 HE ARG A 202 20.665 -13.264 9.821 1.00 0.00 H ATOM 2035 HH12 ARG A 202 23.715 -14.443 7.387 1.00 0.00 H ATOM 2036 HH11 ARG A 202 22.065 -15.130 7.164 1.00 0.00 H ATOM 2037 HH22 ARG A 202 24.111 -12.914 9.059 1.00 0.00 H ATOM 2038 HH21 ARG A 202 22.765 -12.408 10.144 1.00 0.00 H ATOM 2039 H ARG A 202 21.768 -19.612 10.104 1.00 0.00 H ATOM 2040 N CYS A 203 18.294 -18.429 11.513 1.00 13.16 N ATOM 2041 CA CYS A 203 16.977 -19.050 11.506 1.00 13.20 C ATOM 2042 C CYS A 203 16.003 -18.097 10.855 1.00 12.49 C ATOM 2043 O CYS A 203 15.798 -16.983 11.340 1.00 12.47 O ATOM 2044 CB CYS A 203 16.572 -19.235 12.963 1.00 15.14 C ATOM 2045 SG CYS A 203 15.057 -20.212 13.132 1.00 19.00 S ATOM 2046 H CYS A 203 18.524 -17.741 12.258 1.00 0.00 H ATOM 2047 N TRP A 204 15.353 -18.562 9.791 1.00 12.80 N ATOM 2048 CA TRP A 204 14.413 -17.724 9.019 1.00 11.97 C ATOM 2049 C TRP A 204 12.989 -18.092 9.269 1.00 12.05 C ATOM 2050 O TRP A 204 12.655 -19.290 9.291 1.00 12.23 O ATOM 2051 CB TRP A 204 14.691 -17.988 7.547 1.00 14.64 C ATOM 2052 CG TRP A 204 15.934 -17.385 7.029 1.00 14.58 C ATOM 2053 CD1 TRP A 204 17.220 -17.905 7.038 1.00 16.07 C ATOM 2054 CD2 TRP A 204 16.026 -16.109 6.398 1.00 15.40 C ATOM 2055 NE1 TRP A 204 18.093 -17.002 6.437 1.00 16.78 N ATOM 2056 CE2 TRP A 204 17.376 -15.889 6.055 1.00 17.00 C ATOM 2057 CE3 TRP A 204 15.077 -15.099 6.111 1.00 16.73 C ATOM 2058 CZ2 TRP A 204 17.803 -14.720 5.376 1.00 18.29 C ATOM 2059 CZ3 TRP A 204 15.515 -13.936 5.438 1.00 17.52 C ATOM 2060 CH2 TRP A 204 16.862 -13.769 5.112 1.00 19.16 C ATOM 2061 HE1 TRP A 204 19.114 -17.144 6.300 1.00 0.00 H ATOM 2062 H TRP A 204 15.512 -19.546 9.494 1.00 0.00 H ATOM 2063 N ALA A 205 12.117 -17.089 9.334 1.00 11.80 N ATOM 2064 CA ALA A 205 10.678 -17.325 9.385 1.00 11.14 C ATOM 2065 C ALA A 205 10.114 -16.494 8.247 1.00 11.05 C ATOM 2066 O ALA A 205 10.271 -15.252 8.216 1.00 11.83 O ATOM 2067 CB ALA A 205 10.069 -16.872 10.726 1.00 11.96 C ATOM 2068 H ALA A 205 12.470 -16.111 9.349 1.00 0.00 H ATOM 2069 N LEU A 206 9.471 -17.149 7.302 1.00 12.05 N ATOM 2070 CA LEU A 206 9.132 -16.505 6.077 1.00 12.21 C ATOM 2071 C LEU A 206 7.590 -16.607 5.737 1.00 12.95 C ATOM 2072 O LEU A 206 6.986 -17.566 6.143 1.00 12.98 O ATOM 2073 CB LEU A 206 9.899 -17.030 4.898 1.00 13.38 C ATOM 2074 CG LEU A 206 11.320 -16.556 4.908 1.00 14.23 C ATOM 2075 CD1 LEU A 206 12.119 -17.208 3.826 1.00 15.69 C ATOM 2076 CD2 LEU A 206 11.420 -15.070 4.733 1.00 15.53 C ATOM 2077 H LEU A 206 9.209 -18.144 7.451 1.00 0.00 H ATOM 2078 N SER A 207 6.939 -15.687 5.093 1.00 11.80 N ATOM 2079 CA SER A 207 5.596 -15.861 4.549 1.00 13.57 C ATOM 2080 C SER A 207 4.526 -16.035 5.615 1.00 13.36 C ATOM 2081 O SER A 207 3.562 -16.775 5.412 1.00 14.06 O ATOM 2082 CB SER A 207 5.574 -17.066 3.609 1.00 15.68 C ATOM 2083 OG SER A 207 6.490 -16.894 2.543 1.00 18.59 O ATOM 2084 HG SER A 207 6.247 -16.084 2.028 1.00 0.00 H ATOM 2085 H SER A 207 7.404 -14.767 4.956 1.00 0.00 H ATOM 2086 N PHE A 208 4.684 -15.374 6.757 1.00 12.06 N ATOM 2087 CA PHE A 208 3.727 -15.588 7.841 1.00 11.57 C ATOM 2088 C PHE A 208 2.733 -14.452 8.003 1.00 10.94 C ATOM 2089 O PHE A 208 2.976 -13.316 7.557 1.00 11.09 O ATOM 2090 CB PHE A 208 4.423 -15.961 9.162 1.00 10.73 C ATOM 2091 CG PHE A 208 5.418 -14.911 9.681 1.00 10.54 C ATOM 2092 CD1 PHE A 208 4.984 -13.864 10.483 1.00 10.40 C ATOM 2093 CD2 PHE A 208 6.778 -14.976 9.324 1.00 11.59 C ATOM 2094 CE1 PHE A 208 5.906 -12.908 10.988 1.00 11.30 C ATOM 2095 CE2 PHE A 208 7.712 -14.022 9.816 1.00 11.27 C ATOM 2096 CZ PHE A 208 7.270 -13.002 10.634 1.00 10.85 C ATOM 2097 H PHE A 208 5.478 -14.713 6.878 1.00 0.00 H ATOM 2098 N TYR A 209 1.592 -14.763 8.613 1.00 11.64 N ATOM 2099 CA TYR A 209 0.556 -13.744 8.862 1.00 11.37 C ATOM 2100 C TYR A 209 -0.281 -14.320 10.004 1.00 12.45 C ATOM 2101 O TYR A 209 -0.639 -15.511 9.952 1.00 11.96 O ATOM 2102 CB TYR A 209 -0.359 -13.626 7.594 1.00 10.91 C ATOM 2103 CG TYR A 209 -1.471 -12.581 7.835 1.00 10.91 C ATOM 2104 CD1 TYR A 209 -2.638 -12.919 8.508 1.00 11.98 C ATOM 2105 CD2 TYR A 209 -1.285 -11.233 7.445 1.00 10.58 C ATOM 2106 CE1 TYR A 209 -3.612 -11.955 8.777 1.00 12.47 C ATOM 2107 CE2 TYR A 209 -2.269 -10.297 7.731 1.00 11.86 C ATOM 2108 CZ TYR A 209 -3.417 -10.683 8.367 1.00 12.67 C ATOM 2109 OH TYR A 209 -4.400 -9.735 8.630 1.00 13.38 O ATOM 2110 HH TYR A 209 -5.161 -10.169 9.091 1.00 0.00 H ATOM 2111 H TYR A 209 1.428 -15.743 8.920 1.00 0.00 H ATOM 2112 N PRO A 210 -0.592 -13.520 11.035 1.00 11.99 N ATOM 2113 CA PRO A 210 -0.300 -12.101 11.141 1.00 12.19 C ATOM 2114 C PRO A 210 1.171 -11.877 11.510 1.00 11.76 C ATOM 2115 O PRO A 210 1.971 -12.818 11.575 1.00 11.42 O ATOM 2116 CB PRO A 210 -1.269 -11.659 12.254 1.00 11.91 C ATOM 2117 CG PRO A 210 -1.349 -12.848 13.148 1.00 11.75 C ATOM 2118 CD PRO A 210 -1.350 -14.022 12.199 1.00 12.20 C ATOM 2119 N ALA A 211 1.536 -10.625 11.738 1.00 11.17 N ATOM 2120 CA ALA A 211 2.926 -10.261 11.890 1.00 11.59 C ATOM 2121 C ALA A 211 3.532 -10.685 13.224 1.00 12.34 C ATOM 2122 O ALA A 211 4.758 -10.852 13.329 1.00 12.30 O ATOM 2123 CB ALA A 211 3.052 -8.750 11.754 1.00 11.99 C ATOM 2124 H ALA A 211 0.806 -9.887 11.809 1.00 0.00 H ATOM 2125 N GLU A 212 2.717 -10.789 14.272 1.00 13.06 N ATOM 2126 CA GLU A 212 3.277 -11.135 15.597 1.00 12.87 C ATOM 2127 C GLU A 212 3.985 -12.485 15.522 1.00 13.00 C ATOM 2128 O GLU A 212 3.429 -13.464 15.057 1.00 13.70 O ATOM 2129 CB GLU A 212 2.124 -11.230 16.600 1.00 16.09 C ATOM 2130 CG GLU A 212 2.513 -11.656 18.046 1.00 19.85 C ATOM 2131 CD GLU A 212 3.550 -10.743 18.693 1.00 26.33 C ATOM 2132 OE1 GLU A 212 3.496 -9.503 18.500 1.00 28.70 O ATOM 2133 OE2 GLU A 212 4.431 -11.279 19.404 1.00 28.68 O ATOM 2134 H GLU A 212 1.696 -10.628 14.160 1.00 0.00 H ATOM 2135 N ILE A 213 5.212 -12.534 16.040 1.00 12.92 N ATOM 2136 CA ILE A 213 5.960 -13.796 16.010 1.00 13.48 C ATOM 2137 C ILE A 213 7.066 -13.667 17.064 1.00 14.84 C ATOM 2138 O ILE A 213 7.461 -12.536 17.406 1.00 16.28 O ATOM 2139 CB ILE A 213 6.593 -14.072 14.603 1.00 13.90 C ATOM 2140 CG1 ILE A 213 7.110 -15.491 14.507 1.00 13.37 C ATOM 2141 CG2 ILE A 213 7.747 -13.079 14.297 1.00 14.93 C ATOM 2142 CD1 ILE A 213 7.360 -15.876 13.000 1.00 12.54 C ATOM 2143 H ILE A 213 5.636 -11.684 16.463 1.00 0.00 H ATOM 2144 N THR A 214 7.591 -14.802 17.534 1.00 15.23 N ATOM 2145 CA THR A 214 8.780 -14.752 18.379 1.00 16.02 C ATOM 2146 C THR A 214 9.762 -15.813 17.886 1.00 15.00 C ATOM 2147 O THR A 214 9.386 -16.999 17.688 1.00 15.79 O ATOM 2148 CB THR A 214 8.440 -15.050 19.857 1.00 18.53 C ATOM 2149 OG1 THR A 214 7.369 -14.170 20.289 1.00 20.60 O ATOM 2150 CG2 THR A 214 9.668 -14.817 20.782 1.00 19.38 C ATOM 2151 HG1 THR A 214 6.569 -14.325 19.726 1.00 0.00 H ATOM 2152 H THR A 214 7.155 -15.716 17.299 1.00 0.00 H ATOM 2153 N LEU A 215 11.025 -15.394 17.745 1.00 14.26 N ATOM 2154 CA LEU A 215 12.144 -16.273 17.352 1.00 15.69 C ATOM 2155 C LEU A 215 13.169 -16.170 18.436 1.00 15.96 C ATOM 2156 O LEU A 215 13.561 -15.064 18.850 1.00 17.38 O ATOM 2157 CB LEU A 215 12.834 -15.768 16.085 1.00 17.42 C ATOM 2158 CG LEU A 215 12.082 -15.687 14.810 1.00 19.40 C ATOM 2159 CD1 LEU A 215 13.102 -15.371 13.693 1.00 18.31 C ATOM 2160 CD2 LEU A 215 11.433 -16.996 14.580 1.00 21.05 C ATOM 2161 H LEU A 215 11.230 -14.390 17.923 1.00 0.00 H ATOM 2162 N THR A 216 13.631 -17.315 18.929 1.00 15.49 N ATOM 2163 CA THR A 216 14.614 -17.309 19.994 1.00 16.38 C ATOM 2164 C THR A 216 15.598 -18.450 19.812 1.00 16.46 C ATOM 2165 O THR A 216 15.244 -19.529 19.355 1.00 17.89 O ATOM 2166 CB THR A 216 13.979 -17.513 21.376 1.00 17.24 C ATOM 2167 OG1 THR A 216 13.315 -18.765 21.402 1.00 19.84 O ATOM 2168 CG2 THR A 216 12.983 -16.447 21.702 1.00 16.18 C ATOM 2169 HG1 THR A 216 12.904 -18.901 22.292 1.00 0.00 H ATOM 2170 H THR A 216 13.285 -18.219 18.549 1.00 0.00 H ATOM 2171 N TRP A 217 16.843 -18.214 20.202 1.00 16.72 N ATOM 2172 CA TRP A 217 17.856 -19.271 20.148 1.00 16.27 C ATOM 2173 C TRP A 217 18.103 -19.828 21.542 1.00 16.25 C ATOM 2174 O TRP A 217 18.066 -19.115 22.548 1.00 16.96 O ATOM 2175 CB TRP A 217 19.180 -18.695 19.613 1.00 16.25 C ATOM 2176 CG TRP A 217 19.259 -18.628 18.123 1.00 16.31 C ATOM 2177 CD1 TRP A 217 19.028 -17.513 17.324 1.00 18.04 C ATOM 2178 CD2 TRP A 217 19.572 -19.697 17.219 1.00 16.83 C ATOM 2179 NE1 TRP A 217 19.208 -17.836 16.019 1.00 18.67 N ATOM 2180 CE2 TRP A 217 19.518 -19.167 15.905 1.00 17.68 C ATOM 2181 CE3 TRP A 217 19.868 -21.057 17.390 1.00 17.81 C ATOM 2182 CZ2 TRP A 217 19.772 -19.939 14.789 1.00 17.38 C ATOM 2183 CZ3 TRP A 217 20.134 -21.827 16.263 1.00 17.80 C ATOM 2184 CH2 TRP A 217 20.070 -21.258 14.965 1.00 17.84 C ATOM 2185 HE1 TRP A 217 19.123 -17.172 15.223 1.00 0.00 H ATOM 2186 H TRP A 217 17.103 -17.269 20.550 1.00 0.00 H ATOM 2187 N GLN A 218 18.345 -21.140 21.598 1.00 15.17 N ATOM 2188 CA GLN A 218 18.818 -21.811 22.792 1.00 15.99 C ATOM 2189 C GLN A 218 20.124 -22.526 22.528 1.00 15.96 C ATOM 2190 O GLN A 218 20.413 -22.923 21.402 1.00 15.66 O ATOM 2191 CB GLN A 218 17.770 -22.844 23.252 1.00 18.27 C ATOM 2192 CG GLN A 218 16.531 -22.202 23.839 1.00 19.94 C ATOM 2193 CD GLN A 218 15.455 -23.241 24.269 1.00 23.33 C ATOM 2194 OE1 GLN A 218 15.750 -24.413 24.509 1.00 23.81 O ATOM 2195 NE2 GLN A 218 14.194 -22.810 24.286 1.00 25.30 N ATOM 2196 HE22 GLN A 218 13.982 -21.813 24.078 1.00 0.00 H ATOM 2197 HE21 GLN A 218 13.422 -23.470 24.507 1.00 0.00 H ATOM 2198 H GLN A 218 18.186 -21.709 20.742 1.00 0.00 H ATOM 2199 N ARG A 219 20.904 -22.667 23.594 1.00 16.22 N ATOM 2200 CA ARG A 219 22.144 -23.441 23.605 1.00 16.70 C ATOM 2201 C ARG A 219 22.017 -24.491 24.699 1.00 18.21 C ATOM 2202 O ARG A 219 21.813 -24.155 25.874 1.00 18.45 O ATOM 2203 CB ARG A 219 23.344 -22.525 23.875 1.00 16.10 C ATOM 2204 CG ARG A 219 24.663 -23.250 24.176 1.00 15.35 C ATOM 2205 CD ARG A 219 25.818 -22.284 24.489 1.00 13.64 C ATOM 2206 NE ARG A 219 25.559 -21.304 25.562 1.00 12.89 N ATOM 2207 CZ ARG A 219 25.881 -21.507 26.841 1.00 14.03 C ATOM 2208 NH1 ARG A 219 26.437 -22.650 27.212 1.00 14.26 N ATOM 2209 NH2 ARG A 219 25.616 -20.576 27.747 1.00 14.54 N ATOM 2210 HE ARG A 219 25.100 -20.406 25.307 1.00 0.00 H ATOM 2211 HH12 ARG A 219 26.687 -22.807 28.209 1.00 0.00 H ATOM 2212 HH11 ARG A 219 26.623 -23.391 26.506 1.00 0.00 H ATOM 2213 HH22 ARG A 219 25.867 -20.734 28.744 1.00 0.00 H ATOM 2214 HH21 ARG A 219 25.157 -19.688 27.461 1.00 0.00 H ATOM 2215 H ARG A 219 20.614 -22.197 24.476 1.00 0.00 H ATOM 2216 N ASP A 220 22.120 -25.766 24.320 1.00 18.96 N ATOM 2217 CA ASP A 220 21.924 -26.861 25.269 1.00 20.33 C ATOM 2218 C ASP A 220 20.605 -26.695 26.071 1.00 22.70 C ATOM 2219 O ASP A 220 20.532 -26.984 27.272 1.00 24.61 O ATOM 2220 CB ASP A 220 23.206 -27.102 26.106 1.00 21.82 C ATOM 2221 CG ASP A 220 24.390 -27.579 25.236 1.00 24.16 C ATOM 2222 OD1 ASP A 220 24.177 -28.133 24.153 1.00 26.47 O ATOM 2223 OD2 ASP A 220 25.550 -27.430 25.621 1.00 27.27 O ATOM 2224 H ASP A 220 22.344 -25.986 23.329 1.00 0.00 H ATOM 2225 N GLY A 221 19.556 -26.241 25.374 1.00 24.34 N ATOM 2226 CA GLY A 221 18.233 -26.173 25.969 1.00 25.37 C ATOM 2227 C GLY A 221 17.972 -25.055 26.963 1.00 27.13 C ATOM 2228 O GLY A 221 16.977 -25.095 27.710 1.00 27.75 O ATOM 2229 H GLY A 221 19.691 -25.932 24.390 1.00 0.00 H ATOM 2230 N GLU A 222 18.843 -24.046 26.966 1.00 27.16 N ATOM 2231 CA GLU A 222 18.627 -22.874 27.812 1.00 29.94 C ATOM 2232 C GLU A 222 18.789 -21.647 26.924 1.00 30.81 C ATOM 2233 O GLU A 222 19.435 -21.725 25.881 1.00 29.54 O ATOM 2234 CB GLU A 222 19.614 -22.882 28.988 1.00 32.69 C ATOM 2235 CG GLU A 222 19.433 -24.134 29.886 1.00 35.73 C ATOM 2236 CD GLU A 222 20.331 -24.148 31.129 1.00 38.67 C ATOM 2237 OE1 GLU A 222 20.754 -23.056 31.582 1.00 39.74 O ATOM 2238 OE2 GLU A 222 20.598 -25.262 31.653 1.00 40.06 O ATOM 2239 H GLU A 222 19.686 -24.093 26.359 1.00 0.00 H ATOM 2240 N ASP A 223 18.167 -20.526 27.273 1.00 33.28 N ATOM 2241 CA ASP A 223 18.182 -19.402 26.338 1.00 35.57 C ATOM 2242 C ASP A 223 19.598 -18.887 26.079 1.00 34.59 C ATOM 2243 O ASP A 223 20.514 -19.045 26.904 1.00 34.40 O ATOM 2244 CB ASP A 223 17.243 -18.274 26.779 1.00 38.96 C ATOM 2245 CG ASP A 223 15.771 -18.665 26.666 1.00 41.68 C ATOM 2246 OD1 ASP A 223 15.349 -19.104 25.572 1.00 42.36 O ATOM 2247 OD2 ASP A 223 15.040 -18.543 27.671 1.00 43.13 O ATOM 2248 H ASP A 223 17.681 -20.450 28.189 1.00 0.00 H ATOM 2249 N GLN A 224 19.757 -18.333 24.884 1.00 34.65 N ATOM 2250 CA GLN A 224 21.028 -17.837 24.361 1.00 36.24 C ATOM 2251 C GLN A 224 20.661 -16.439 23.867 1.00 40.52 C ATOM 2252 O GLN A 224 20.617 -16.163 22.669 1.00 40.34 O ATOM 2253 CB GLN A 224 21.469 -18.758 23.216 1.00 34.77 C ATOM 2254 CG GLN A 224 22.767 -18.408 22.509 1.00 34.34 C ATOM 2255 CD GLN A 224 24.007 -18.659 23.344 1.00 34.68 C ATOM 2256 OE1 GLN A 224 23.938 -19.130 24.488 1.00 34.59 O ATOM 2257 NE2 GLN A 224 25.151 -18.355 22.769 1.00 35.24 N ATOM 2258 HE22 GLN A 224 25.161 -17.962 21.806 1.00 0.00 H ATOM 2259 HE21 GLN A 224 26.045 -18.508 23.277 1.00 0.00 H ATOM 2260 H GLN A 224 18.917 -18.246 24.276 1.00 0.00 H ATOM 2261 N THR A 225 20.325 -15.572 24.818 1.00 46.09 N ATOM 2262 CA THR A 225 19.607 -14.329 24.523 1.00 51.56 C ATOM 2263 C THR A 225 20.553 -13.242 24.083 1.00 56.07 C ATOM 2264 O THR A 225 20.348 -12.592 23.057 1.00 55.96 O ATOM 2265 CB THR A 225 18.835 -13.802 25.755 1.00 52.17 C ATOM 2266 OG1 THR A 225 17.828 -14.750 26.146 1.00 52.58 O ATOM 2267 CG2 THR A 225 18.178 -12.460 25.443 1.00 52.29 C ATOM 2268 HG1 THR A 225 17.339 -14.404 26.935 1.00 0.00 H ATOM 2269 H THR A 225 20.580 -15.783 25.804 1.00 0.00 H ATOM 2270 N GLN A 226 21.707 -13.050 24.869 1.00 60.73 N ATOM 2271 CA GLN A 226 22.669 -11.982 24.634 1.00 64.93 C ATOM 2272 C GLN A 226 23.435 -12.120 23.321 1.00 64.04 C ATOM 2273 O GLN A 226 23.839 -11.117 22.733 1.00 64.85 O ATOM 2274 CB GLN A 226 23.654 -11.889 25.803 1.00 69.44 C ATOM 2275 CG GLN A 226 23.024 -11.435 27.110 1.00 73.39 C ATOM 2276 CD GLN A 226 24.013 -11.425 28.260 1.00 76.56 C ATOM 2277 OE1 GLN A 226 25.007 -12.150 28.246 1.00 77.81 O ATOM 2278 NE2 GLN A 226 23.742 -10.599 29.264 1.00 77.57 N ATOM 2279 HE22 GLN A 226 22.889 -10.004 29.233 1.00 0.00 H ATOM 2280 HE21 GLN A 226 24.382 -10.547 30.082 1.00 0.00 H ATOM 2281 H GLN A 226 21.881 -13.705 25.658 1.00 0.00 H ATOM 2282 N ASP A 227 23.528 -13.354 22.862 1.00 61.93 N ATOM 2283 CA ASP A 227 24.331 -13.618 21.665 1.00 59.42 C ATOM 2284 C ASP A 227 23.512 -13.744 20.377 1.00 54.23 C ATOM 2285 O ASP A 227 24.027 -14.172 19.345 1.00 54.02 O ATOM 2286 CB ASP A 227 25.184 -14.874 21.864 1.00 61.77 C ATOM 2287 CG ASP A 227 26.611 -14.691 21.387 1.00 63.97 C ATOM 2288 OD1 ASP A 227 26.821 -13.946 20.407 1.00 64.58 O ATOM 2289 OD2 ASP A 227 27.523 -15.293 21.992 1.00 64.23 O ATOM 2290 H ASP A 227 23.036 -14.132 23.346 1.00 0.00 H ATOM 2291 N THR A 228 22.241 -13.366 20.446 1.00 48.88 N ATOM 2292 CA THR A 228 21.355 -13.396 19.301 1.00 43.19 C ATOM 2293 C THR A 228 21.235 -12.041 18.611 1.00 39.51 C ATOM 2294 O THR A 228 21.002 -11.016 19.280 1.00 39.87 O ATOM 2295 CB THR A 228 19.960 -13.844 19.754 1.00 42.80 C ATOM 2296 OG1 THR A 228 19.980 -15.247 20.073 1.00 42.38 O ATOM 2297 CG2 THR A 228 18.910 -13.587 18.674 1.00 43.01 C ATOM 2298 HG1 THR A 228 19.078 -15.531 20.365 1.00 0.00 H ATOM 2299 H THR A 228 21.867 -13.035 21.358 1.00 0.00 H ATOM 2300 N GLU A 229 21.377 -12.034 17.279 1.00 33.23 N ATOM 2301 CA GLU A 229 21.038 -10.853 16.477 1.00 31.14 C ATOM 2302 C GLU A 229 19.688 -11.099 15.821 1.00 28.72 C ATOM 2303 O GLU A 229 19.528 -12.114 15.157 1.00 27.23 O ATOM 2304 CB GLU A 229 22.045 -10.617 15.364 1.00 31.76 C ATOM 2305 CG GLU A 229 21.693 -9.310 14.654 1.00 34.59 C ATOM 2306 CD GLU A 229 22.596 -9.000 13.480 1.00 37.80 C ATOM 2307 OE1 GLU A 229 23.366 -9.891 13.063 1.00 39.04 O ATOM 2308 OE2 GLU A 229 22.526 -7.860 12.987 1.00 39.05 O ATOM 2309 H GLU A 229 21.736 -12.886 16.802 1.00 0.00 H ATOM 2310 N LEU A 230 18.738 -10.182 16.016 1.00 27.75 N ATOM 2311 CA LEU A 230 17.330 -10.359 15.608 1.00 27.54 C ATOM 2312 C LEU A 230 16.903 -9.126 14.828 1.00 27.19 C ATOM 2313 O LEU A 230 16.952 -8.020 15.403 1.00 28.48 O ATOM 2314 CB LEU A 230 16.504 -10.458 16.908 1.00 29.72 C ATOM 2315 CG LEU A 230 15.007 -10.817 16.930 1.00 31.54 C ATOM 2316 CD1 LEU A 230 14.666 -12.222 16.350 1.00 32.18 C ATOM 2317 CD2 LEU A 230 14.417 -10.662 18.339 1.00 32.30 C ATOM 2318 H LEU A 230 19.005 -9.291 16.482 1.00 0.00 H ATOM 2319 N VAL A 231 16.505 -9.286 13.546 1.00 23.68 N ATOM 2320 CA VAL A 231 15.990 -8.160 12.753 1.00 21.91 C ATOM 2321 C VAL A 231 14.532 -7.954 13.060 1.00 18.80 C ATOM 2322 O VAL A 231 13.808 -8.873 13.441 1.00 18.94 O ATOM 2323 CB VAL A 231 16.124 -8.246 11.197 1.00 22.50 C ATOM 2324 CG1 VAL A 231 17.571 -8.169 10.723 1.00 23.26 C ATOM 2325 CG2 VAL A 231 15.331 -9.473 10.599 1.00 22.66 C ATOM 2326 H VAL A 231 16.565 -10.228 13.110 1.00 0.00 H ATOM 2327 N GLU A 232 14.093 -6.719 12.946 1.00 17.92 N ATOM 2328 CA GLU A 232 12.722 -6.381 13.120 1.00 17.08 C ATOM 2329 C GLU A 232 11.853 -7.037 12.027 1.00 15.00 C ATOM 2330 O GLU A 232 12.262 -7.166 10.925 1.00 14.57 O ATOM 2331 CB GLU A 232 12.543 -4.874 13.089 1.00 18.98 C ATOM 2332 CG GLU A 232 13.241 -4.165 14.203 1.00 21.89 C ATOM 2333 CD GLU A 232 12.930 -4.748 15.545 1.00 25.29 C ATOM 2334 OE1 GLU A 232 11.759 -4.727 15.935 1.00 26.31 O ATOM 2335 OE2 GLU A 232 13.872 -5.204 16.214 1.00 27.22 O ATOM 2336 H GLU A 232 14.772 -5.964 12.721 1.00 0.00 H ATOM 2337 N THR A 233 10.656 -7.398 12.417 1.00 13.12 N ATOM 2338 CA THR A 233 9.725 -8.011 11.498 1.00 12.20 C ATOM 2339 C THR A 233 9.465 -7.083 10.339 1.00 12.26 C ATOM 2340 O THR A 233 9.273 -5.868 10.510 1.00 13.95 O ATOM 2341 CB THR A 233 8.454 -8.384 12.238 1.00 11.94 C ATOM 2342 OG1 THR A 233 8.815 -9.329 13.248 1.00 12.91 O ATOM 2343 CG2 THR A 233 7.431 -9.016 11.314 1.00 12.22 C ATOM 2344 HG1 THR A 233 8.006 -9.596 13.753 1.00 0.00 H ATOM 2345 H THR A 233 10.371 -7.241 13.405 1.00 0.00 H ATOM 2346 N ARG A 234 9.475 -7.620 9.121 1.00 11.07 N ATOM 2347 CA ARG A 234 9.460 -6.743 7.940 1.00 10.56 C ATOM 2348 C ARG A 234 8.435 -7.294 6.951 1.00 10.28 C ATOM 2349 O ARG A 234 8.231 -8.518 6.856 1.00 11.09 O ATOM 2350 CB ARG A 234 10.808 -6.638 7.260 1.00 11.25 C ATOM 2351 CG ARG A 234 11.316 -8.016 6.751 1.00 11.30 C ATOM 2352 CD ARG A 234 12.804 -7.948 6.592 1.00 12.75 C ATOM 2353 NE ARG A 234 13.281 -9.091 5.796 1.00 13.39 N ATOM 2354 CZ ARG A 234 14.574 -9.364 5.616 1.00 14.57 C ATOM 2355 NH1 ARG A 234 15.531 -8.629 6.226 1.00 15.09 N ATOM 2356 NH2 ARG A 234 14.914 -10.388 4.824 1.00 15.77 N ATOM 2357 HE ARG A 234 12.577 -9.715 5.353 1.00 0.00 H ATOM 2358 HH12 ARG A 234 16.535 -8.855 6.075 1.00 0.00 H ATOM 2359 HH11 ARG A 234 15.263 -7.838 6.846 1.00 0.00 H ATOM 2360 HH22 ARG A 234 15.917 -10.617 4.671 1.00 0.00 H ATOM 2361 HH21 ARG A 234 14.175 -10.955 4.361 1.00 0.00 H ATOM 2362 H ARG A 234 9.493 -8.653 9.005 1.00 0.00 H ATOM 2363 N PRO A 235 7.795 -6.455 6.155 1.00 9.78 N ATOM 2364 CA PRO A 235 6.804 -6.950 5.189 1.00 10.17 C ATOM 2365 C PRO A 235 7.496 -7.590 3.976 1.00 11.03 C ATOM 2366 O PRO A 235 8.511 -7.118 3.458 1.00 11.85 O ATOM 2367 CB PRO A 235 6.075 -5.664 4.758 1.00 10.77 C ATOM 2368 CG PRO A 235 7.123 -4.558 4.974 1.00 10.89 C ATOM 2369 CD PRO A 235 7.897 -4.965 6.202 1.00 10.82 C ATOM 2370 N ALA A 236 6.962 -8.725 3.541 1.00 10.67 N ATOM 2371 CA ALA A 236 7.431 -9.301 2.296 1.00 11.28 C ATOM 2372 C ALA A 236 7.024 -8.488 1.044 1.00 11.13 C ATOM 2373 O ALA A 236 7.700 -8.542 0.010 1.00 11.61 O ATOM 2374 CB ALA A 236 6.905 -10.732 2.183 1.00 12.46 C ATOM 2375 H ALA A 236 6.214 -9.197 4.088 1.00 0.00 H ATOM 2376 N GLY A 237 5.894 -7.774 1.152 1.00 11.77 N ATOM 2377 CA GLY A 237 5.318 -7.045 0.026 1.00 12.56 C ATOM 2378 C GLY A 237 4.110 -7.689 -0.600 1.00 12.55 C ATOM 2379 O GLY A 237 3.458 -7.083 -1.436 1.00 13.20 O ATOM 2380 H GLY A 237 5.410 -7.738 2.072 1.00 0.00 H ATOM 2381 N ASP A 238 3.835 -8.938 -0.218 1.00 12.18 N ATOM 2382 CA ASP A 238 2.684 -9.684 -0.743 1.00 11.71 C ATOM 2383 C ASP A 238 1.653 -9.891 0.372 1.00 11.61 C ATOM 2384 O ASP A 238 0.768 -10.774 0.213 1.00 12.12 O ATOM 2385 CB ASP A 238 3.174 -11.027 -1.334 1.00 11.78 C ATOM 2386 CG ASP A 238 3.835 -11.927 -0.280 1.00 12.62 C ATOM 2387 OD1 ASP A 238 3.791 -11.591 0.912 1.00 11.95 O ATOM 2388 OD2 ASP A 238 4.385 -12.978 -0.668 1.00 14.01 O ATOM 2389 H ASP A 238 4.458 -9.399 0.476 1.00 0.00 H ATOM 2390 N GLY A 239 1.760 -9.133 1.466 1.00 10.06 N ATOM 2391 CA GLY A 239 0.798 -9.218 2.543 1.00 10.31 C ATOM 2392 C GLY A 239 1.263 -10.085 3.704 1.00 10.89 C ATOM 2393 O GLY A 239 0.651 -10.051 4.764 1.00 11.54 O ATOM 2394 H GLY A 239 2.554 -8.466 1.546 1.00 0.00 H ATOM 2395 N THR A 240 2.368 -10.796 3.518 1.00 10.54 N ATOM 2396 CA THR A 240 2.953 -11.599 4.615 1.00 10.23 C ATOM 2397 C THR A 240 4.206 -10.931 5.142 1.00 9.81 C ATOM 2398 O THR A 240 4.665 -9.886 4.624 1.00 10.69 O ATOM 2399 CB THR A 240 3.359 -13.029 4.123 1.00 11.07 C ATOM 2400 OG1 THR A 240 4.441 -12.945 3.162 1.00 11.45 O ATOM 2401 CG2 THR A 240 2.167 -13.794 3.489 1.00 11.70 C ATOM 2402 HG1 THR A 240 4.149 -12.407 2.384 1.00 0.00 H ATOM 2403 H THR A 240 2.830 -10.789 2.586 1.00 0.00 H ATOM 2404 N PHE A 241 4.772 -11.511 6.196 1.00 9.32 N ATOM 2405 CA PHE A 241 5.878 -10.940 6.928 1.00 10.08 C ATOM 2406 C PHE A 241 7.069 -11.897 6.994 1.00 10.16 C ATOM 2407 O PHE A 241 6.943 -13.094 6.708 1.00 10.31 O ATOM 2408 CB PHE A 241 5.398 -10.506 8.318 1.00 10.06 C ATOM 2409 CG PHE A 241 4.319 -9.457 8.224 1.00 10.66 C ATOM 2410 CD1 PHE A 241 4.686 -8.131 8.152 1.00 11.31 C ATOM 2411 CD2 PHE A 241 2.968 -9.811 8.153 1.00 11.35 C ATOM 2412 CE1 PHE A 241 3.715 -7.140 7.984 1.00 12.69 C ATOM 2413 CE2 PHE A 241 1.987 -8.814 8.031 1.00 12.97 C ATOM 2414 CZ PHE A 241 2.376 -7.486 7.906 1.00 13.20 C ATOM 2415 H PHE A 241 4.397 -12.428 6.511 1.00 0.00 H ATOM 2416 N GLN A 242 8.215 -11.353 7.378 1.00 10.26 N ATOM 2417 CA GLN A 242 9.477 -12.071 7.443 1.00 10.73 C ATOM 2418 C GLN A 242 10.246 -11.656 8.670 1.00 10.17 C ATOM 2419 O GLN A 242 10.145 -10.500 9.141 1.00 10.91 O ATOM 2420 CB GLN A 242 10.363 -11.673 6.266 1.00 11.32 C ATOM 2421 CG GLN A 242 9.666 -11.667 4.931 1.00 13.00 C ATOM 2422 CD GLN A 242 10.651 -11.447 3.786 1.00 14.49 C ATOM 2423 OE1 GLN A 242 11.713 -10.881 3.945 1.00 15.59 O ATOM 2424 NE2 GLN A 242 10.284 -11.999 2.599 1.00 15.54 N ATOM 2425 HE22 GLN A 242 9.363 -12.475 2.509 1.00 0.00 H ATOM 2426 HE21 GLN A 242 10.924 -11.946 1.781 1.00 0.00 H ATOM 2427 H GLN A 242 8.211 -10.349 7.650 1.00 0.00 H ATOM 2428 N LYS A 243 11.044 -12.567 9.215 1.00 10.51 N ATOM 2429 CA LYS A 243 11.938 -12.243 10.334 1.00 9.92 C ATOM 2430 C LYS A 243 13.067 -13.268 10.319 1.00 11.02 C ATOM 2431 O LYS A 243 12.882 -14.405 9.851 1.00 10.81 O ATOM 2432 CB LYS A 243 11.190 -12.302 11.684 1.00 11.02 C ATOM 2433 CG LYS A 243 11.906 -11.526 12.825 1.00 12.59 C ATOM 2434 CD LYS A 243 11.100 -11.714 14.117 1.00 13.24 C ATOM 2435 CE LYS A 243 11.571 -10.785 15.246 1.00 15.20 C ATOM 2436 NZ LYS A 243 11.310 -9.353 14.874 1.00 16.41 N ATOM 2437 HZ1 LYS A 243 11.828 -9.123 14.002 1.00 0.00 H ATOM 2438 HZ2 LYS A 243 10.291 -9.216 14.720 1.00 0.00 H ATOM 2439 HZ3 LYS A 243 11.632 -8.732 15.644 1.00 0.00 H ATOM 2440 H LYS A 243 11.036 -13.537 8.839 1.00 0.00 H ATOM 2441 N TRP A 244 14.226 -12.897 10.841 1.00 11.20 N ATOM 2442 CA TRP A 244 15.286 -13.871 11.087 1.00 12.04 C ATOM 2443 C TRP A 244 16.019 -13.578 12.363 1.00 12.44 C ATOM 2444 O TRP A 244 15.968 -12.458 12.882 1.00 12.54 O ATOM 2445 CB TRP A 244 16.243 -14.043 9.902 1.00 13.60 C ATOM 2446 CG TRP A 244 17.027 -12.880 9.413 1.00 14.00 C ATOM 2447 CD1 TRP A 244 16.841 -12.203 8.234 1.00 15.84 C ATOM 2448 CD2 TRP A 244 18.197 -12.298 10.019 1.00 14.86 C ATOM 2449 NE1 TRP A 244 17.788 -11.233 8.091 1.00 16.46 N ATOM 2450 CE2 TRP A 244 18.633 -11.262 9.163 1.00 16.94 C ATOM 2451 CE3 TRP A 244 18.928 -12.557 11.198 1.00 15.60 C ATOM 2452 CZ2 TRP A 244 19.750 -10.495 9.428 1.00 17.19 C ATOM 2453 CZ3 TRP A 244 20.041 -11.758 11.469 1.00 18.15 C ATOM 2454 CH2 TRP A 244 20.419 -10.731 10.591 1.00 18.34 C ATOM 2455 HE1 TRP A 244 17.856 -10.573 7.290 1.00 0.00 H ATOM 2456 H TRP A 244 14.384 -11.897 11.079 1.00 0.00 H ATOM 2457 N ALA A 245 16.712 -14.587 12.872 1.00 13.42 N ATOM 2458 CA ALA A 245 17.536 -14.436 14.069 1.00 15.26 C ATOM 2459 C ALA A 245 18.771 -15.242 13.826 1.00 14.73 C ATOM 2460 O ALA A 245 18.710 -16.369 13.317 1.00 15.33 O ATOM 2461 CB ALA A 245 16.801 -14.890 15.321 1.00 20.00 C ATOM 2462 H ALA A 245 16.668 -15.515 12.405 1.00 0.00 H ATOM 2463 N ALA A 246 19.914 -14.709 14.220 1.00 15.25 N ATOM 2464 CA ALA A 246 21.177 -15.398 13.982 1.00 15.30 C ATOM 2465 C ALA A 246 22.055 -15.498 15.237 1.00 16.40 C ATOM 2466 O ALA A 246 22.015 -14.639 16.144 1.00 17.78 O ATOM 2467 CB ALA A 246 21.961 -14.684 12.855 1.00 17.21 C ATOM 2468 H ALA A 246 19.913 -13.789 14.705 1.00 0.00 H ATOM 2469 N VAL A 247 22.914 -16.507 15.236 1.00 16.24 N ATOM 2470 CA VAL A 247 23.885 -16.668 16.307 1.00 16.61 C ATOM 2471 C VAL A 247 25.200 -17.147 15.692 1.00 16.58 C ATOM 2472 O VAL A 247 25.202 -17.981 14.769 1.00 17.37 O ATOM 2473 CB VAL A 247 23.388 -17.672 17.369 1.00 16.80 C ATOM 2474 CG1 VAL A 247 23.227 -19.034 16.765 1.00 17.26 C ATOM 2475 CG2 VAL A 247 24.345 -17.720 18.551 1.00 16.06 C ATOM 2476 H VAL A 247 22.894 -17.195 14.457 1.00 0.00 H ATOM 2477 N VAL A 248 26.330 -16.630 16.190 1.00 16.12 N ATOM 2478 CA VAL A 248 27.654 -17.081 15.738 1.00 16.02 C ATOM 2479 C VAL A 248 28.106 -18.139 16.742 1.00 16.42 C ATOM 2480 O VAL A 248 27.952 -17.971 17.953 1.00 16.53 O ATOM 2481 CB VAL A 248 28.671 -15.940 15.724 1.00 17.78 C ATOM 2482 CG1 VAL A 248 30.060 -16.439 15.310 1.00 19.21 C ATOM 2483 CG2 VAL A 248 28.208 -14.869 14.752 1.00 19.71 C ATOM 2484 H VAL A 248 26.269 -15.889 16.917 1.00 0.00 H ATOM 2485 N VAL A 249 28.641 -19.233 16.225 1.00 15.47 N ATOM 2486 CA VAL A 249 28.954 -20.401 17.053 1.00 15.53 C ATOM 2487 C VAL A 249 30.269 -21.019 16.598 1.00 15.47 C ATOM 2488 O VAL A 249 30.692 -20.847 15.437 1.00 16.46 O ATOM 2489 CB VAL A 249 27.832 -21.493 16.967 1.00 17.45 C ATOM 2490 CG1 VAL A 249 26.439 -20.886 17.263 1.00 18.18 C ATOM 2491 CG2 VAL A 249 27.812 -22.235 15.614 1.00 18.39 C ATOM 2492 H VAL A 249 28.845 -19.265 15.206 1.00 0.00 H ATOM 2493 N PRO A 250 30.945 -21.742 17.511 1.00 14.40 N ATOM 2494 CA PRO A 250 32.158 -22.446 17.091 1.00 14.40 C ATOM 2495 C PRO A 250 31.836 -23.544 16.104 1.00 16.13 C ATOM 2496 O PRO A 250 30.898 -24.310 16.295 1.00 15.23 O ATOM 2497 CB PRO A 250 32.672 -23.064 18.387 1.00 14.75 C ATOM 2498 CG PRO A 250 32.129 -22.099 19.477 1.00 14.79 C ATOM 2499 CD PRO A 250 30.725 -21.822 18.969 1.00 14.18 C ATOM 2500 N SER A 251 32.619 -23.611 15.039 1.00 17.90 N ATOM 2501 CA SER A 251 32.448 -24.653 14.041 1.00 19.40 C ATOM 2502 C SER A 251 32.530 -26.013 14.726 1.00 19.64 C ATOM 2503 O SER A 251 33.387 -26.215 15.570 1.00 19.88 O ATOM 2504 CB SER A 251 33.533 -24.526 12.980 1.00 20.91 C ATOM 2505 OG SER A 251 33.373 -23.299 12.291 1.00 22.08 O ATOM 2506 HG SER A 251 34.078 -23.215 11.601 1.00 0.00 H ATOM 2507 H SER A 251 33.371 -22.904 14.914 1.00 0.00 H ATOM 2508 N GLY A 252 31.594 -26.904 14.400 1.00 19.64 N ATOM 2509 CA GLY A 252 31.598 -28.237 14.962 1.00 19.03 C ATOM 2510 C GLY A 252 30.643 -28.362 16.130 1.00 18.93 C ATOM 2511 O GLY A 252 30.347 -29.481 16.561 1.00 20.86 O ATOM 2512 H GLY A 252 30.846 -26.636 13.729 1.00 0.00 H ATOM 2513 N GLN A 253 30.181 -27.220 16.652 1.00 16.97 N ATOM 2514 CA GLN A 253 29.269 -27.207 17.810 1.00 16.73 C ATOM 2515 C GLN A 253 27.841 -26.824 17.439 1.00 16.38 C ATOM 2516 O GLN A 253 27.019 -26.594 18.330 1.00 15.71 O ATOM 2517 CB GLN A 253 29.799 -26.255 18.911 1.00 17.66 C ATOM 2518 CG GLN A 253 31.207 -26.627 19.359 1.00 20.11 C ATOM 2519 CD GLN A 253 31.238 -28.058 19.896 1.00 21.77 C ATOM 2520 OE1 GLN A 253 30.428 -28.401 20.759 1.00 23.24 O ATOM 2521 NE2 GLN A 253 32.124 -28.896 19.360 1.00 22.96 N ATOM 2522 HE22 GLN A 253 32.787 -28.557 18.634 1.00 0.00 H ATOM 2523 HE21 GLN A 253 32.153 -29.889 19.668 1.00 0.00 H ATOM 2524 H GLN A 253 30.474 -26.316 16.229 1.00 0.00 H ATOM 2525 N GLU A 254 27.533 -26.819 16.140 1.00 16.82 N ATOM 2526 CA GLU A 254 26.211 -26.380 15.661 1.00 17.95 C ATOM 2527 C GLU A 254 25.053 -27.151 16.286 1.00 18.01 C ATOM 2528 O GLU A 254 23.979 -26.585 16.526 1.00 17.70 O ATOM 2529 CB GLU A 254 26.145 -26.524 14.150 1.00 18.20 C ATOM 2530 CG GLU A 254 27.003 -25.511 13.393 1.00 20.12 C ATOM 2531 CD GLU A 254 28.432 -25.977 13.138 1.00 21.64 C ATOM 2532 OE1 GLU A 254 28.850 -27.009 13.717 1.00 22.07 O ATOM 2533 OE2 GLU A 254 29.130 -25.325 12.321 1.00 22.98 O ATOM 2534 H GLU A 254 28.244 -27.133 15.449 1.00 0.00 H ATOM 2535 N GLN A 255 25.276 -28.406 16.578 1.00 17.70 N ATOM 2536 CA GLN A 255 24.221 -29.207 17.112 1.00 20.61 C ATOM 2537 C GLN A 255 23.716 -28.823 18.505 1.00 19.69 C ATOM 2538 O GLN A 255 22.657 -29.223 18.883 1.00 19.38 O ATOM 2539 CB GLN A 255 24.577 -30.718 17.040 1.00 24.88 C ATOM 2540 CG GLN A 255 25.867 -31.116 17.740 1.00 30.16 C ATOM 2541 CD GLN A 255 27.147 -30.382 17.287 1.00 33.32 C ATOM 2542 OE1 GLN A 255 27.428 -30.157 16.127 1.00 34.04 O ATOM 2543 NE2 GLN A 255 27.916 -30.018 18.254 1.00 35.41 N ATOM 2544 HE22 GLN A 255 27.648 -30.225 19.237 1.00 0.00 H ATOM 2545 HE21 GLN A 255 28.805 -29.517 18.051 1.00 0.00 H ATOM 2546 H GLN A 255 26.218 -28.819 16.422 1.00 0.00 H ATOM 2547 N ARG A 256 24.477 -28.008 19.207 1.00 18.07 N ATOM 2548 CA ARG A 256 24.045 -27.524 20.533 1.00 16.71 C ATOM 2549 C ARG A 256 22.934 -26.486 20.456 1.00 16.28 C ATOM 2550 O ARG A 256 22.242 -26.242 21.448 1.00 16.43 O ATOM 2551 CB ARG A 256 25.225 -26.839 21.275 1.00 17.29 C ATOM 2552 CG ARG A 256 26.379 -27.716 21.539 1.00 17.80 C ATOM 2553 CD ARG A 256 27.377 -26.988 22.446 1.00 17.29 C ATOM 2554 NE ARG A 256 28.549 -27.780 22.585 1.00 19.36 N ATOM 2555 CZ ARG A 256 28.717 -28.697 23.540 1.00 19.55 C ATOM 2556 NH1 ARG A 256 29.842 -29.389 23.581 1.00 20.95 N ATOM 2557 NH2 ARG A 256 27.742 -28.847 24.437 1.00 20.05 N ATOM 2558 HE ARG A 256 29.321 -27.637 21.903 1.00 0.00 H ATOM 2559 HH12 ARG A 256 29.985 -30.106 24.320 1.00 0.00 H ATOM 2560 HH11 ARG A 256 30.585 -29.216 22.874 1.00 0.00 H ATOM 2561 HH22 ARG A 256 27.837 -29.552 25.196 1.00 0.00 H ATOM 2562 HH21 ARG A 256 26.886 -28.259 24.378 1.00 0.00 H ATOM 2563 H ARG A 256 25.393 -27.702 18.822 1.00 0.00 H ATOM 2564 N TYR A 257 22.781 -25.860 19.292 1.00 16.06 N ATOM 2565 CA TYR A 257 21.946 -24.666 19.147 1.00 15.08 C ATOM 2566 C TYR A 257 20.626 -24.992 18.495 1.00 15.37 C ATOM 2567 O TYR A 257 20.580 -25.717 17.486 1.00 17.30 O ATOM 2568 CB TYR A 257 22.737 -23.577 18.357 1.00 14.47 C ATOM 2569 CG TYR A 257 24.018 -23.179 19.073 1.00 15.26 C ATOM 2570 CD1 TYR A 257 25.199 -23.926 18.960 1.00 14.48 C ATOM 2571 CD2 TYR A 257 24.017 -22.086 19.927 1.00 16.93 C ATOM 2572 CE1 TYR A 257 26.340 -23.566 19.668 1.00 15.79 C ATOM 2573 CE2 TYR A 257 25.162 -21.705 20.607 1.00 16.75 C ATOM 2574 CZ TYR A 257 26.313 -22.453 20.460 1.00 17.03 C ATOM 2575 OH TYR A 257 27.440 -22.101 21.188 1.00 18.32 O ATOM 2576 HH TYR A 257 27.710 -21.179 20.951 1.00 0.00 H ATOM 2577 H TYR A 257 23.272 -26.232 18.455 1.00 0.00 H ATOM 2578 N THR A 258 19.553 -24.491 19.091 1.00 15.12 N ATOM 2579 CA THR A 258 18.225 -24.673 18.492 1.00 15.67 C ATOM 2580 C THR A 258 17.510 -23.345 18.342 1.00 15.58 C ATOM 2581 O THR A 258 17.666 -22.467 19.166 1.00 16.24 O ATOM 2582 CB THR A 258 17.349 -25.636 19.353 1.00 17.45 C ATOM 2583 OG1 THR A 258 17.368 -25.241 20.743 1.00 18.50 O ATOM 2584 CG2 THR A 258 17.850 -27.068 19.245 1.00 18.86 C ATOM 2585 HG1 THR A 258 18.299 -25.268 21.080 1.00 0.00 H ATOM 2586 H THR A 258 19.652 -23.968 19.984 1.00 0.00 H ATOM 2587 N CYS A 259 16.725 -23.221 17.274 1.00 14.65 N ATOM 2588 CA CYS A 259 15.894 -22.044 17.071 1.00 16.39 C ATOM 2589 C CYS A 259 14.426 -22.427 17.345 1.00 16.20 C ATOM 2590 O CYS A 259 13.954 -23.524 16.979 1.00 18.26 O ATOM 2591 CB CYS A 259 16.094 -21.593 15.650 1.00 18.32 C ATOM 2592 SG CYS A 259 14.970 -20.237 15.197 1.00 20.93 S ATOM 2593 H CYS A 259 16.705 -23.984 16.568 1.00 0.00 H ATOM 2594 N HIS A 260 13.751 -21.536 18.064 1.00 14.78 N ATOM 2595 CA HIS A 260 12.393 -21.748 18.541 1.00 13.45 C ATOM 2596 C HIS A 260 11.485 -20.696 17.958 1.00 14.01 C ATOM 2597 O HIS A 260 11.758 -19.509 18.075 1.00 15.66 O ATOM 2598 CB HIS A 260 12.413 -21.706 20.051 1.00 15.24 C ATOM 2599 CG HIS A 260 13.316 -22.749 20.606 1.00 17.32 C ATOM 2600 ND1 HIS A 260 12.853 -23.984 21.010 1.00 18.44 N ATOM 2601 CD2 HIS A 260 14.668 -22.787 20.721 1.00 17.69 C ATOM 2602 CE1 HIS A 260 13.883 -24.730 21.385 1.00 19.05 C ATOM 2603 NE2 HIS A 260 14.995 -24.035 21.215 1.00 18.63 N ATOM 2604 H HIS A 260 14.219 -20.638 18.299 1.00 0.00 H ATOM 2605 N VAL A 261 10.423 -21.145 17.312 1.00 13.59 N ATOM 2606 CA VAL A 261 9.534 -20.244 16.593 1.00 14.03 C ATOM 2607 C VAL A 261 8.131 -20.361 17.128 1.00 14.32 C ATOM 2608 O VAL A 261 7.555 -21.448 17.145 1.00 16.57 O ATOM 2609 CB VAL A 261 9.537 -20.569 15.093 1.00 13.61 C ATOM 2610 CG1 VAL A 261 8.653 -19.562 14.338 1.00 14.28 C ATOM 2611 CG2 VAL A 261 10.985 -20.586 14.492 1.00 15.82 C ATOM 2612 H VAL A 261 10.218 -22.165 17.317 1.00 0.00 H ATOM 2613 N GLN A 262 7.587 -19.241 17.623 1.00 14.86 N ATOM 2614 CA GLN A 262 6.234 -19.218 18.163 1.00 15.88 C ATOM 2615 C GLN A 262 5.383 -18.308 17.286 1.00 15.00 C ATOM 2616 O GLN A 262 5.769 -17.157 17.002 1.00 14.71 O ATOM 2617 CB GLN A 262 6.233 -18.619 19.580 1.00 18.98 C ATOM 2618 CG GLN A 262 7.033 -19.442 20.623 1.00 24.01 C ATOM 2619 CD GLN A 262 7.265 -18.690 21.944 1.00 28.04 C ATOM 2620 OE1 GLN A 262 8.287 -17.999 22.126 1.00 28.88 O ATOM 2621 NE2 GLN A 262 6.322 -18.832 22.870 1.00 30.28 N ATOM 2622 HE22 GLN A 262 5.486 -19.418 22.675 1.00 0.00 H ATOM 2623 HE21 GLN A 262 6.421 -18.357 23.790 1.00 0.00 H ATOM 2624 H GLN A 262 8.146 -18.364 17.622 1.00 0.00 H ATOM 2625 N HIS A 263 4.234 -18.800 16.870 1.00 15.32 N ATOM 2626 CA HIS A 263 3.354 -18.018 16.002 1.00 14.98 C ATOM 2627 C HIS A 263 1.968 -18.595 16.117 1.00 16.67 C ATOM 2628 O HIS A 263 1.834 -19.803 16.297 1.00 17.00 O ATOM 2629 CB HIS A 263 3.840 -18.114 14.532 1.00 13.20 C ATOM 2630 CG HIS A 263 3.058 -17.242 13.581 1.00 12.54 C ATOM 2631 ND1 HIS A 263 1.913 -17.658 12.940 1.00 13.18 N ATOM 2632 CD2 HIS A 263 3.257 -15.955 13.206 1.00 12.64 C ATOM 2633 CE1 HIS A 263 1.427 -16.656 12.219 1.00 13.87 C ATOM 2634 NE2 HIS A 263 2.231 -15.628 12.353 1.00 13.08 N ATOM 2635 H HIS A 263 3.949 -19.756 17.162 1.00 0.00 H ATOM 2636 N GLU A 264 0.943 -17.759 16.004 1.00 18.51 N ATOM 2637 CA GLU A 264 -0.449 -18.172 16.166 1.00 21.93 C ATOM 2638 C GLU A 264 -0.871 -19.266 15.206 1.00 20.25 C ATOM 2639 O GLU A 264 -1.789 -20.026 15.490 1.00 21.59 O ATOM 2640 CB GLU A 264 -1.347 -16.927 16.027 1.00 26.66 C ATOM 2641 CG GLU A 264 -2.753 -17.104 15.465 1.00 32.20 C ATOM 2642 CD GLU A 264 -3.455 -15.749 15.216 1.00 36.10 C ATOM 2643 OE1 GLU A 264 -2.933 -14.705 15.672 1.00 36.87 O ATOM 2644 OE2 GLU A 264 -4.527 -15.729 14.568 1.00 39.02 O ATOM 2645 H GLU A 264 1.141 -16.761 15.790 1.00 0.00 H ATOM 2646 N GLY A 265 -0.200 -19.344 14.074 1.00 18.80 N ATOM 2647 CA GLY A 265 -0.511 -20.335 13.065 1.00 18.74 C ATOM 2648 C GLY A 265 0.099 -21.689 13.333 1.00 19.10 C ATOM 2649 O GLY A 265 -0.102 -22.615 12.552 1.00 20.25 O ATOM 2650 H GLY A 265 0.576 -18.674 13.900 1.00 0.00 H ATOM 2651 N LEU A 266 0.862 -21.798 14.427 1.00 18.77 N ATOM 2652 CA LEU A 266 1.519 -23.038 14.868 1.00 19.53 C ATOM 2653 C LEU A 266 0.869 -23.532 16.154 1.00 22.20 C ATOM 2654 O LEU A 266 0.995 -22.902 17.204 1.00 23.85 O ATOM 2655 CB LEU A 266 3.012 -22.794 15.133 1.00 18.66 C ATOM 2656 CG LEU A 266 3.864 -22.293 13.960 1.00 18.13 C ATOM 2657 CD1 LEU A 266 5.214 -21.860 14.553 1.00 19.12 C ATOM 2658 CD2 LEU A 266 4.034 -23.405 12.983 1.00 18.40 C ATOM 2659 H LEU A 266 1.000 -20.946 15.006 1.00 0.00 H ATOM 2660 N PRO A 267 0.209 -24.688 16.102 1.00 23.26 N ATOM 2661 CA PRO A 267 -0.425 -25.153 17.341 1.00 25.00 C ATOM 2662 C PRO A 267 0.581 -25.452 18.446 1.00 25.67 C ATOM 2663 O PRO A 267 0.212 -25.339 19.618 1.00 25.83 O ATOM 2664 CB PRO A 267 -1.159 -26.426 16.897 1.00 26.08 C ATOM 2665 CG PRO A 267 -0.406 -26.867 15.642 1.00 26.27 C ATOM 2666 CD PRO A 267 -0.111 -25.547 14.953 1.00 24.39 C ATOM 2667 N LYS A 268 1.798 -25.851 18.088 1.00 25.98 N ATOM 2668 CA LYS A 268 2.896 -25.862 19.035 1.00 27.60 C ATOM 2669 C LYS A 268 4.096 -25.168 18.402 1.00 23.61 C ATOM 2670 O LYS A 268 4.270 -25.229 17.180 1.00 22.70 O ATOM 2671 CB LYS A 268 3.280 -27.281 19.452 1.00 34.93 C ATOM 2672 CG LYS A 268 3.509 -28.235 18.305 1.00 41.72 C ATOM 2673 CD LYS A 268 3.721 -29.661 18.834 1.00 47.44 C ATOM 2674 CE LYS A 268 5.015 -29.779 19.647 1.00 52.11 C ATOM 2675 NZ LYS A 268 5.456 -31.202 19.817 1.00 54.53 N ATOM 2676 HZ1 LYS A 268 4.715 -31.737 20.313 1.00 0.00 H ATOM 2677 HZ2 LYS A 268 5.624 -31.626 18.882 1.00 0.00 H ATOM 2678 HZ3 LYS A 268 6.334 -31.227 20.373 1.00 0.00 H ATOM 2679 H LYS A 268 1.966 -26.161 17.110 1.00 0.00 H ATOM 2680 N PRO A 269 4.930 -24.522 19.217 1.00 22.14 N ATOM 2681 CA PRO A 269 6.085 -23.857 18.619 1.00 21.31 C ATOM 2682 C PRO A 269 6.996 -24.872 17.927 1.00 21.14 C ATOM 2683 O PRO A 269 7.052 -26.053 18.325 1.00 22.66 O ATOM 2684 CB PRO A 269 6.810 -23.206 19.812 1.00 22.06 C ATOM 2685 CG PRO A 269 6.126 -23.671 21.009 1.00 23.21 C ATOM 2686 CD PRO A 269 4.817 -24.301 20.669 1.00 22.59 C ATOM 2687 N LEU A 270 7.722 -24.404 16.920 1.00 19.68 N ATOM 2688 CA LEU A 270 8.647 -25.242 16.188 1.00 19.16 C ATOM 2689 C LEU A 270 10.041 -25.103 16.748 1.00 18.40 C ATOM 2690 O LEU A 270 10.438 -24.042 17.222 1.00 19.56 O ATOM 2691 CB LEU A 270 8.675 -24.825 14.725 1.00 20.93 C ATOM 2692 CG LEU A 270 7.385 -25.003 13.944 1.00 22.30 C ATOM 2693 CD1 LEU A 270 7.639 -24.468 12.523 1.00 23.15 C ATOM 2694 CD2 LEU A 270 6.893 -26.464 13.904 1.00 22.76 C ATOM 2695 H LEU A 270 7.623 -23.405 16.649 1.00 0.00 H ATOM 2696 N THR A 271 10.800 -26.193 16.688 1.00 18.06 N ATOM 2697 CA THR A 271 12.189 -26.184 17.124 1.00 18.79 C ATOM 2698 C THR A 271 12.995 -26.641 15.938 1.00 19.49 C ATOM 2699 O THR A 271 12.703 -27.716 15.379 1.00 22.18 O ATOM 2700 CB THR A 271 12.457 -27.204 18.238 1.00 19.81 C ATOM 2701 OG1 THR A 271 11.715 -26.834 19.419 1.00 21.65 O ATOM 2702 CG2 THR A 271 13.937 -27.281 18.575 1.00 20.66 C ATOM 2703 HG1 THR A 271 10.748 -26.821 19.209 1.00 0.00 H ATOM 2704 H THR A 271 10.391 -27.075 16.320 1.00 0.00 H ATOM 2705 N LEU A 272 13.985 -25.847 15.547 1.00 17.95 N ATOM 2706 CA LEU A 272 14.855 -26.186 14.426 1.00 18.59 C ATOM 2707 C LEU A 272 16.285 -26.371 14.916 1.00 20.28 C ATOM 2708 O LEU A 272 16.730 -25.693 15.812 1.00 20.00 O ATOM 2709 CB LEU A 272 14.855 -25.088 13.358 1.00 18.84 C ATOM 2710 CG LEU A 272 13.603 -24.849 12.516 1.00 19.85 C ATOM 2711 CD1 LEU A 272 12.583 -24.001 13.291 1.00 21.49 C ATOM 2712 CD2 LEU A 272 13.994 -24.110 11.243 1.00 20.03 C ATOM 2713 H LEU A 272 14.145 -24.955 16.056 1.00 0.00 H ATOM 2714 N ARG A 273 16.981 -27.334 14.315 1.00 23.17 N ATOM 2715 CA ARG A 273 18.373 -27.632 14.689 1.00 26.73 C ATOM 2716 C ARG A 273 19.121 -27.873 13.393 1.00 27.72 C ATOM 2717 O ARG A 273 18.560 -28.418 12.441 1.00 29.16 O ATOM 2718 CB ARG A 273 18.467 -28.871 15.601 1.00 28.97 C ATOM 2719 CG ARG A 273 19.785 -28.954 16.436 1.00 31.32 C ATOM 2720 CD ARG A 273 19.918 -30.293 17.195 1.00 32.74 C ATOM 2721 NE ARG A 273 18.765 -30.537 18.063 1.00 34.50 N ATOM 2722 CZ ARG A 273 18.707 -30.210 19.353 1.00 36.33 C ATOM 2723 NH1 ARG A 273 19.748 -29.636 19.948 1.00 37.13 N ATOM 2724 NH2 ARG A 273 17.608 -30.463 20.059 1.00 37.10 N ATOM 2725 HE ARG A 273 17.933 -30.998 17.643 1.00 0.00 H ATOM 2726 HH12 ARG A 273 19.697 -29.383 20.955 1.00 0.00 H ATOM 2727 HH11 ARG A 273 20.614 -29.440 19.406 1.00 0.00 H ATOM 2728 HH22 ARG A 273 17.566 -30.206 21.066 1.00 0.00 H ATOM 2729 HH21 ARG A 273 16.791 -30.917 19.604 1.00 0.00 H ATOM 2730 H ARG A 273 16.529 -27.890 13.561 1.00 0.00 H ATOM 2731 N TRP A 274 20.372 -27.451 13.343 1.00 27.68 N ATOM 2732 CA TRP A 274 21.156 -27.549 12.113 1.00 29.08 C ATOM 2733 C TRP A 274 21.401 -29.001 11.749 1.00 32.71 C ATOM 2734 O TRP A 274 21.825 -29.782 12.593 1.00 33.59 O ATOM 2735 CB TRP A 274 22.475 -26.765 12.249 1.00 28.23 C ATOM 2736 CG TRP A 274 23.336 -26.881 11.037 1.00 29.39 C ATOM 2737 CD1 TRP A 274 24.563 -27.459 10.960 1.00 30.38 C ATOM 2738 CD2 TRP A 274 23.004 -26.454 9.705 1.00 31.31 C ATOM 2739 NE1 TRP A 274 25.033 -27.404 9.672 1.00 31.19 N ATOM 2740 CE2 TRP A 274 24.089 -26.804 8.877 1.00 32.15 C ATOM 2741 CE3 TRP A 274 21.893 -25.811 9.131 1.00 32.41 C ATOM 2742 CZ2 TRP A 274 24.107 -26.522 7.508 1.00 33.26 C ATOM 2743 CZ3 TRP A 274 21.908 -25.538 7.775 1.00 32.99 C ATOM 2744 CH2 TRP A 274 23.010 -25.899 6.972 1.00 33.02 C ATOM 2745 HE1 TRP A 274 25.956 -27.760 9.350 1.00 0.00 H ATOM 2746 H TRP A 274 20.807 -27.042 14.194 1.00 0.00 H TER 2747 TRP A 274 ATOM 2748 N GLN B 2 12.059 14.800 16.148 1.00 36.10 N ATOM 2749 CA GLN B 2 12.598 14.084 14.989 1.00 35.37 C ATOM 2750 C GLN B 2 13.289 12.758 15.357 1.00 31.63 C ATOM 2751 O GLN B 2 14.028 12.671 16.336 1.00 32.81 O ATOM 2752 CB GLN B 2 13.521 14.986 14.166 1.00 38.45 C ATOM 2753 CG GLN B 2 12.811 16.219 13.617 1.00 40.64 C ATOM 2754 CD GLN B 2 13.697 17.087 12.750 1.00 42.49 C ATOM 2755 OE1 GLN B 2 14.927 16.952 12.750 1.00 43.87 O ATOM 2756 NE2 GLN B 2 13.074 17.997 12.004 1.00 43.26 N ATOM 2757 HE22 GLN B 2 12.037 18.075 12.036 1.00 0.00 H ATOM 2758 HE21 GLN B 2 13.624 18.630 11.389 1.00 0.00 H ATOM 2759 HN3 GLN B 2 12.832 15.022 16.807 1.00 0.00 H ATOM 2760 HN2 GLN B 2 11.355 14.202 16.627 1.00 0.00 H ATOM 2761 HN1 GLN B 2 11.608 15.682 15.830 1.00 0.00 H ATOM 2762 N ARG B 3 12.974 11.709 14.592 1.00 28.33 N ATOM 2763 CA ARG B 3 13.519 10.362 14.795 1.00 24.94 C ATOM 2764 C ARG B 3 14.020 9.828 13.465 1.00 20.69 C ATOM 2765 O ARG B 3 13.347 9.954 12.456 1.00 18.41 O ATOM 2766 CB ARG B 3 12.421 9.435 15.280 1.00 25.74 C ATOM 2767 CG ARG B 3 12.034 9.581 16.726 1.00 25.70 C ATOM 2768 CD ARG B 3 10.700 8.907 16.918 1.00 24.54 C ATOM 2769 NE ARG B 3 9.709 9.931 17.135 1.00 22.56 N ATOM 2770 CZ ARG B 3 8.421 9.720 17.342 1.00 21.44 C ATOM 2771 NH1 ARG B 3 7.646 10.769 17.579 1.00 20.13 N ATOM 2772 NH2 ARG B 3 7.926 8.485 17.349 1.00 21.15 N ATOM 2773 HE ARG B 3 10.035 10.919 17.128 1.00 0.00 H ATOM 2774 HH12 ARG B 3 6.628 10.636 17.746 1.00 0.00 H ATOM 2775 HH11 ARG B 3 8.056 11.725 17.598 1.00 0.00 H ATOM 2776 HH22 ARG B 3 6.910 8.333 17.513 1.00 0.00 H ATOM 2777 HH21 ARG B 3 8.555 7.672 17.190 1.00 0.00 H ATOM 2778 H ARG B 3 12.305 11.855 13.809 1.00 0.00 H ATOM 2779 N THR B 4 15.192 9.203 13.457 1.00 20.60 N ATOM 2780 CA THR B 4 15.806 8.816 12.185 1.00 19.34 C ATOM 2781 C THR B 4 15.293 7.486 11.603 1.00 17.71 C ATOM 2782 O THR B 4 14.958 6.560 12.354 1.00 18.87 O ATOM 2783 CB THR B 4 17.318 8.813 12.339 1.00 22.95 C ATOM 2784 OG1 THR B 4 17.936 8.867 11.048 1.00 26.83 O ATOM 2785 CG2 THR B 4 17.776 7.585 13.144 1.00 22.41 C ATOM 2786 HG1 THR B 4 17.655 9.695 10.583 1.00 0.00 H ATOM 2787 H THR B 4 15.673 8.989 14.354 1.00 0.00 H ATOM 2788 N PRO B 5 15.200 7.391 10.265 1.00 15.92 N ATOM 2789 CA PRO B 5 14.724 6.113 9.722 1.00 15.85 C ATOM 2790 C PRO B 5 15.665 4.933 9.910 1.00 16.31 C ATOM 2791 O PRO B 5 16.891 5.064 9.728 1.00 17.78 O ATOM 2792 CB PRO B 5 14.545 6.407 8.220 1.00 16.13 C ATOM 2793 CG PRO B 5 15.098 7.738 7.977 1.00 16.24 C ATOM 2794 CD PRO B 5 15.178 8.473 9.260 1.00 15.82 C ATOM 2795 N LYS B 6 15.079 3.797 10.299 1.00 16.13 N ATOM 2796 CA LYS B 6 15.759 2.520 10.316 1.00 16.73 C ATOM 2797 C LYS B 6 15.519 1.961 8.919 1.00 14.20 C ATOM 2798 O LYS B 6 14.454 2.201 8.300 1.00 15.07 O ATOM 2799 CB LYS B 6 15.122 1.575 11.349 1.00 20.04 C ATOM 2800 CG LYS B 6 15.279 1.903 12.813 1.00 24.53 C ATOM 2801 CD LYS B 6 14.336 0.991 13.626 1.00 29.11 C ATOM 2802 CE LYS B 6 12.861 1.219 13.234 1.00 32.18 C ATOM 2803 NZ LYS B 6 11.866 0.432 14.022 1.00 34.12 N ATOM 2804 HZ1 LYS B 6 12.053 -0.584 13.898 1.00 0.00 H ATOM 2805 HZ2 LYS B 6 11.948 0.681 15.028 1.00 0.00 H ATOM 2806 HZ3 LYS B 6 10.907 0.653 13.686 1.00 0.00 H ATOM 2807 H LYS B 6 14.086 3.832 10.605 1.00 0.00 H ATOM 2808 N ILE B 7 16.503 1.252 8.390 1.00 14.21 N ATOM 2809 CA ILE B 7 16.469 0.750 6.999 1.00 14.36 C ATOM 2810 C ILE B 7 16.757 -0.754 6.964 1.00 13.75 C ATOM 2811 O ILE B 7 17.713 -1.225 7.616 1.00 15.25 O ATOM 2812 CB ILE B 7 17.517 1.490 6.144 1.00 16.06 C ATOM 2813 CG1 ILE B 7 17.214 2.980 6.189 1.00 16.44 C ATOM 2814 CG2 ILE B 7 17.544 0.951 4.693 1.00 17.62 C ATOM 2815 CD1 ILE B 7 18.414 3.860 5.776 1.00 18.72 C ATOM 2816 H ILE B 7 17.335 1.039 8.977 1.00 0.00 H ATOM 2817 N GLN B 8 15.913 -1.490 6.227 1.00 11.71 N ATOM 2818 CA GLN B 8 16.248 -2.852 5.788 1.00 11.27 C ATOM 2819 C GLN B 8 16.128 -2.946 4.289 1.00 11.53 C ATOM 2820 O GLN B 8 15.128 -2.521 3.712 1.00 13.41 O ATOM 2821 CB GLN B 8 15.359 -3.919 6.448 1.00 12.18 C ATOM 2822 CG GLN B 8 15.474 -3.980 8.013 1.00 13.70 C ATOM 2823 CD GLN B 8 14.917 -5.316 8.541 1.00 14.65 C ATOM 2824 OE1 GLN B 8 15.417 -6.385 8.179 1.00 16.63 O ATOM 2825 NE2 GLN B 8 13.898 -5.259 9.389 1.00 16.06 N ATOM 2826 HE22 GLN B 8 13.505 -4.338 9.669 1.00 0.00 H ATOM 2827 HE21 GLN B 8 13.492 -6.136 9.774 1.00 0.00 H ATOM 2828 H GLN B 8 14.994 -1.085 5.958 1.00 0.00 H ATOM 2829 N VAL B 9 17.135 -3.579 3.657 1.00 12.48 N ATOM 2830 CA VAL B 9 17.124 -3.766 2.219 1.00 13.13 C ATOM 2831 C VAL B 9 17.192 -5.274 2.014 1.00 13.02 C ATOM 2832 O VAL B 9 18.089 -5.924 2.549 1.00 14.37 O ATOM 2833 CB VAL B 9 18.333 -3.092 1.557 1.00 14.39 C ATOM 2834 CG1 VAL B 9 18.180 -3.133 0.020 1.00 12.76 C ATOM 2835 CG2 VAL B 9 18.499 -1.694 2.084 1.00 16.35 C ATOM 2836 H VAL B 9 17.937 -3.941 4.212 1.00 0.00 H ATOM 2837 N TYR B 10 16.230 -5.828 1.282 1.00 11.29 N ATOM 2838 CA TYR B 10 16.157 -7.270 1.164 1.00 10.66 C ATOM 2839 C TYR B 10 15.331 -7.645 -0.038 1.00 11.93 C ATOM 2840 O TYR B 10 14.526 -6.879 -0.528 1.00 11.83 O ATOM 2841 CB TYR B 10 15.513 -7.893 2.460 1.00 10.90 C ATOM 2842 CG TYR B 10 14.208 -7.304 2.858 1.00 10.42 C ATOM 2843 CD1 TYR B 10 14.147 -6.022 3.397 1.00 11.46 C ATOM 2844 CD2 TYR B 10 13.021 -7.961 2.632 1.00 10.82 C ATOM 2845 CE1 TYR B 10 12.920 -5.458 3.788 1.00 12.06 C ATOM 2846 CE2 TYR B 10 11.767 -7.399 3.002 1.00 10.04 C ATOM 2847 CZ TYR B 10 11.743 -6.127 3.565 1.00 11.27 C ATOM 2848 OH TYR B 10 10.566 -5.550 3.939 1.00 12.28 O ATOM 2849 HH TYR B 10 10.125 -6.115 4.622 1.00 0.00 H ATOM 2850 H TYR B 10 15.533 -5.228 0.796 1.00 0.00 H ATOM 2851 N SER B 11 15.446 -8.877 -0.488 1.00 13.98 N ATOM 2852 CA SER B 11 14.538 -9.383 -1.518 1.00 14.54 C ATOM 2853 C SER B 11 13.356 -10.112 -0.905 1.00 13.91 C ATOM 2854 O SER B 11 13.429 -10.671 0.191 1.00 15.26 O ATOM 2855 CB SER B 11 15.300 -10.284 -2.513 1.00 14.80 C ATOM 2856 OG SER B 11 15.962 -11.365 -1.859 1.00 17.24 O ATOM 2857 HG SER B 11 15.294 -11.922 -1.387 1.00 0.00 H ATOM 2858 H SER B 11 16.190 -9.497 -0.108 1.00 0.00 H ATOM 2859 N ARG B 12 12.259 -10.168 -1.640 1.00 11.89 N ATOM 2860 CA ARG B 12 11.071 -10.830 -1.128 1.00 12.97 C ATOM 2861 C ARG B 12 11.323 -12.328 -1.010 1.00 14.39 C ATOM 2862 O ARG B 12 10.872 -12.956 -0.055 1.00 15.89 O ATOM 2863 CB ARG B 12 9.893 -10.563 -2.057 1.00 13.90 C ATOM 2864 CG ARG B 12 8.620 -11.355 -1.652 1.00 14.08 C ATOM 2865 CD ARG B 12 7.408 -11.099 -2.538 1.00 14.44 C ATOM 2866 NE ARG B 12 7.087 -9.668 -2.675 1.00 14.19 N ATOM 2867 CZ ARG B 12 6.180 -9.206 -3.552 1.00 15.78 C ATOM 2868 NH1 ARG B 12 5.566 -10.069 -4.376 1.00 17.31 N ATOM 2869 NH2 ARG B 12 5.930 -7.902 -3.652 1.00 15.99 N ATOM 2870 HE ARG B 12 7.584 -8.986 -2.067 1.00 0.00 H ATOM 2871 HH12 ARG B 12 4.862 -9.724 -5.059 1.00 0.00 H ATOM 2872 HH11 ARG B 12 5.794 -11.083 -4.331 1.00 0.00 H ATOM 2873 HH22 ARG B 12 5.225 -7.559 -4.335 1.00 0.00 H ATOM 2874 HH21 ARG B 12 6.440 -7.227 -3.047 1.00 0.00 H ATOM 2875 H ARG B 12 12.246 -9.737 -2.587 1.00 0.00 H ATOM 2876 N HIS B 13 12.015 -12.875 -2.007 1.00 14.72 N ATOM 2877 CA HIS B 13 12.308 -14.304 -2.090 1.00 15.52 C ATOM 2878 C HIS B 13 13.821 -14.492 -2.075 1.00 15.92 C ATOM 2879 O HIS B 13 14.554 -13.588 -2.379 1.00 14.95 O ATOM 2880 CB HIS B 13 11.732 -14.858 -3.408 1.00 16.40 C ATOM 2881 CG HIS B 13 10.273 -14.606 -3.576 1.00 18.32 C ATOM 2882 ND1 HIS B 13 9.321 -15.215 -2.785 1.00 20.67 N ATOM 2883 CD2 HIS B 13 9.608 -13.745 -4.375 1.00 18.93 C ATOM 2884 CE1 HIS B 13 8.127 -14.755 -3.120 1.00 20.13 C ATOM 2885 NE2 HIS B 13 8.269 -13.877 -4.095 1.00 20.09 N ATOM 2886 H HIS B 13 12.365 -12.254 -2.765 1.00 0.00 H ATOM 2887 N PRO B 14 14.315 -15.703 -1.728 1.00 18.44 N ATOM 2888 CA PRO B 14 15.775 -15.899 -1.787 1.00 20.24 C ATOM 2889 C PRO B 14 16.326 -15.573 -3.160 1.00 20.59 C ATOM 2890 O PRO B 14 15.671 -15.889 -4.161 1.00 22.10 O ATOM 2891 CB PRO B 14 15.941 -17.391 -1.500 1.00 21.71 C ATOM 2892 CG PRO B 14 14.598 -17.989 -1.707 1.00 22.32 C ATOM 2893 CD PRO B 14 13.602 -16.916 -1.316 1.00 21.24 C ATOM 2894 N ALA B 15 17.459 -14.902 -3.220 1.00 19.32 N ATOM 2895 CA ALA B 15 17.974 -14.451 -4.498 1.00 20.63 C ATOM 2896 C ALA B 15 18.580 -15.639 -5.213 1.00 19.69 C ATOM 2897 O ALA B 15 19.457 -16.336 -4.688 1.00 21.46 O ATOM 2898 CB ALA B 15 18.991 -13.360 -4.343 1.00 21.42 C ATOM 2899 H ALA B 15 17.985 -14.695 -2.347 1.00 0.00 H ATOM 2900 N GLU B 16 18.091 -15.862 -6.423 1.00 17.91 N ATOM 2901 CA GLU B 16 18.670 -16.876 -7.294 1.00 17.26 C ATOM 2902 C GLU B 16 18.924 -16.207 -8.640 1.00 17.33 C ATOM 2903 O GLU B 16 18.009 -15.666 -9.262 1.00 17.46 O ATOM 2904 CB GLU B 16 17.710 -18.071 -7.457 1.00 17.85 C ATOM 2905 CG GLU B 16 17.409 -18.869 -6.159 1.00 19.01 C ATOM 2906 CD GLU B 16 16.273 -19.880 -6.381 1.00 21.54 C ATOM 2907 OE1 GLU B 16 15.126 -19.438 -6.530 1.00 23.55 O ATOM 2908 OE2 GLU B 16 16.516 -21.079 -6.431 1.00 23.65 O ATOM 2909 H GLU B 16 17.280 -15.304 -6.757 1.00 0.00 H ATOM 2910 N ASN B 17 20.170 -16.222 -9.092 1.00 18.31 N ATOM 2911 CA ASN B 17 20.532 -15.466 -10.282 1.00 19.33 C ATOM 2912 C ASN B 17 19.710 -15.905 -11.467 1.00 18.26 C ATOM 2913 O ASN B 17 19.662 -17.101 -11.781 1.00 19.19 O ATOM 2914 CB ASN B 17 22.043 -15.643 -10.591 1.00 21.18 C ATOM 2915 CG ASN B 17 22.906 -14.821 -9.652 1.00 23.51 C ATOM 2916 OD1 ASN B 17 22.474 -13.764 -9.184 1.00 25.01 O ATOM 2917 ND2 ASN B 17 24.129 -15.277 -9.388 1.00 25.10 N ATOM 2918 HD22 ASN B 17 24.451 -16.174 -9.805 1.00 0.00 H ATOM 2919 HD21 ASN B 17 24.762 -14.736 -8.765 1.00 0.00 H ATOM 2920 H ASN B 17 20.894 -16.778 -8.593 1.00 0.00 H ATOM 2921 N GLY B 18 19.072 -14.963 -12.136 1.00 17.16 N ATOM 2922 CA GLY B 18 18.253 -15.273 -13.297 1.00 16.41 C ATOM 2923 C GLY B 18 16.787 -15.450 -12.996 1.00 16.53 C ATOM 2924 O GLY B 18 15.967 -15.541 -13.919 1.00 17.79 O ATOM 2925 H GLY B 18 19.157 -13.974 -11.825 1.00 0.00 H ATOM 2926 N LYS B 19 16.437 -15.484 -11.713 1.00 15.48 N ATOM 2927 CA LYS B 19 15.037 -15.696 -11.369 1.00 14.70 C ATOM 2928 C LYS B 19 14.438 -14.381 -10.892 1.00 14.34 C ATOM 2929 O LYS B 19 14.948 -13.745 -9.964 1.00 16.19 O ATOM 2930 CB LYS B 19 14.874 -16.797 -10.300 1.00 14.79 C ATOM 2931 CG LYS B 19 15.316 -18.143 -10.760 1.00 15.60 C ATOM 2932 CD LYS B 19 14.756 -19.212 -9.799 1.00 15.44 C ATOM 2933 CE LYS B 19 15.505 -20.480 -9.981 1.00 15.28 C ATOM 2934 NZ LYS B 19 14.989 -21.574 -9.010 1.00 15.46 N ATOM 2935 HZ1 LYS B 19 15.112 -21.251 -8.029 1.00 0.00 H ATOM 2936 HZ2 LYS B 19 13.981 -21.752 -9.194 1.00 0.00 H ATOM 2937 HZ3 LYS B 19 15.529 -22.450 -9.158 1.00 0.00 H ATOM 2938 H LYS B 19 17.151 -15.361 -10.967 1.00 0.00 H ATOM 2939 N SER B 20 13.331 -13.989 -11.523 1.00 13.32 N ATOM 2940 CA SER B 20 12.646 -12.745 -11.148 1.00 13.20 C ATOM 2941 C SER B 20 12.306 -12.705 -9.663 1.00 12.48 C ATOM 2942 O SER B 20 12.046 -13.761 -9.055 1.00 14.23 O ATOM 2943 CB SER B 20 11.377 -12.641 -12.001 1.00 14.35 C ATOM 2944 OG SER B 20 10.923 -11.279 -11.958 1.00 15.36 O ATOM 2945 HG SER B 20 10.727 -11.027 -11.021 1.00 0.00 H ATOM 2946 H SER B 20 12.946 -14.573 -12.293 1.00 0.00 H ATOM 2947 N ASN B 21 12.280 -11.514 -9.064 1.00 12.70 N ATOM 2948 CA ASN B 21 12.126 -11.364 -7.612 1.00 11.39 C ATOM 2949 C ASN B 21 11.652 -9.935 -7.392 1.00 11.31 C ATOM 2950 O ASN B 21 11.283 -9.252 -8.342 1.00 12.13 O ATOM 2951 CB ASN B 21 13.510 -11.620 -6.963 1.00 12.85 C ATOM 2952 CG ASN B 21 13.437 -12.126 -5.524 1.00 13.15 C ATOM 2953 OD1 ASN B 21 12.639 -11.662 -4.706 1.00 12.85 O ATOM 2954 ND2 ASN B 21 14.372 -13.034 -5.188 1.00 12.83 N ATOM 2955 HD22 ASN B 21 15.025 -13.399 -5.910 1.00 0.00 H ATOM 2956 HD21 ASN B 21 14.441 -13.370 -4.206 1.00 0.00 H ATOM 2957 H ASN B 21 12.372 -10.658 -9.648 1.00 0.00 H ATOM 2958 N PHE B 22 11.653 -9.511 -6.131 1.00 12.05 N ATOM 2959 CA PHE B 22 11.277 -8.124 -5.753 1.00 11.54 C ATOM 2960 C PHE B 22 12.307 -7.629 -4.797 1.00 11.77 C ATOM 2961 O PHE B 22 12.666 -8.323 -3.849 1.00 12.65 O ATOM 2962 CB PHE B 22 9.876 -8.065 -5.114 1.00 13.69 C ATOM 2963 CG PHE B 22 8.775 -8.496 -6.047 1.00 17.66 C ATOM 2964 CD1 PHE B 22 8.494 -9.835 -6.202 1.00 17.76 C ATOM 2965 CD2 PHE B 22 8.093 -7.575 -6.796 1.00 20.32 C ATOM 2966 CE1 PHE B 22 7.511 -10.259 -7.096 1.00 19.17 C ATOM 2967 CE2 PHE B 22 7.098 -8.006 -7.691 1.00 20.91 C ATOM 2968 CZ PHE B 22 6.830 -9.321 -7.818 1.00 20.31 C ATOM 2969 H PHE B 22 11.928 -10.176 -5.380 1.00 0.00 H ATOM 2970 N LEU B 23 12.834 -6.428 -5.070 1.00 11.34 N ATOM 2971 CA LEU B 23 13.762 -5.745 -4.169 1.00 10.92 C ATOM 2972 C LEU B 23 13.004 -4.778 -3.298 1.00 10.91 C ATOM 2973 O LEU B 23 12.262 -3.944 -3.834 1.00 11.65 O ATOM 2974 CB LEU B 23 14.822 -4.999 -4.988 1.00 12.25 C ATOM 2975 CG LEU B 23 15.867 -4.247 -4.148 1.00 12.84 C ATOM 2976 CD1 LEU B 23 16.746 -5.221 -3.352 1.00 14.69 C ATOM 2977 CD2 LEU B 23 16.743 -3.402 -5.124 1.00 14.70 C ATOM 2978 H LEU B 23 12.572 -5.961 -5.961 1.00 0.00 H ATOM 2979 N ASN B 24 13.168 -4.920 -1.988 1.00 11.47 N ATOM 2980 CA ASN B 24 12.449 -4.134 -0.961 1.00 11.45 C ATOM 2981 C ASN B 24 13.372 -3.267 -0.173 1.00 12.68 C ATOM 2982 O ASN B 24 14.466 -3.655 0.179 1.00 12.84 O ATOM 2983 CB ASN B 24 11.760 -5.091 0.038 1.00 11.56 C ATOM 2984 CG ASN B 24 10.576 -5.807 -0.544 1.00 12.87 C ATOM 2985 OD1 ASN B 24 9.948 -5.339 -1.488 1.00 14.42 O ATOM 2986 ND2 ASN B 24 10.247 -6.965 0.021 1.00 13.49 N ATOM 2987 HD22 ASN B 24 10.803 -7.330 0.820 1.00 0.00 H ATOM 2988 HD21 ASN B 24 9.433 -7.505 -0.336 1.00 0.00 H ATOM 2989 H ASN B 24 13.850 -5.634 -1.661 1.00 0.00 H ATOM 2990 N CYS B 25 12.917 -2.049 0.157 1.00 12.35 N ATOM 2991 CA CYS B 25 13.614 -1.256 1.159 1.00 11.97 C ATOM 2992 C CYS B 25 12.538 -0.785 2.098 1.00 11.42 C ATOM 2993 O CYS B 25 11.598 -0.062 1.713 1.00 11.87 O ATOM 2994 CB CYS B 25 14.248 -0.066 0.464 1.00 13.62 C ATOM 2995 SG CYS B 25 15.167 1.001 1.664 1.00 16.53 S ATOM 2996 H CYS B 25 12.065 -1.671 -0.304 1.00 0.00 H ATOM 2997 N TYR B 26 12.630 -1.248 3.325 1.00 11.19 N ATOM 2998 CA TYR B 26 11.635 -0.990 4.371 1.00 10.41 C ATOM 2999 C TYR B 26 12.235 0.028 5.301 1.00 11.06 C ATOM 3000 O TYR B 26 13.307 -0.179 5.902 1.00 11.67 O ATOM 3001 CB TYR B 26 11.344 -2.299 5.143 1.00 11.56 C ATOM 3002 CG TYR B 26 10.322 -2.149 6.255 1.00 12.83 C ATOM 3003 CD1 TYR B 26 9.074 -1.618 5.978 1.00 13.33 C ATOM 3004 CD2 TYR B 26 10.615 -2.516 7.566 1.00 13.77 C ATOM 3005 CE1 TYR B 26 8.137 -1.492 6.966 1.00 14.78 C ATOM 3006 CE2 TYR B 26 9.668 -2.401 8.562 1.00 14.74 C ATOM 3007 CZ TYR B 26 8.442 -1.859 8.236 1.00 16.38 C ATOM 3008 OH TYR B 26 7.486 -1.728 9.245 1.00 20.13 O ATOM 3009 HH TYR B 26 7.841 -1.143 9.961 1.00 0.00 H ATOM 3010 H TYR B 26 13.456 -1.831 3.568 1.00 0.00 H ATOM 3011 N VAL B 27 11.566 1.175 5.375 1.00 11.33 N ATOM 3012 CA VAL B 27 12.000 2.263 6.251 1.00 12.25 C ATOM 3013 C VAL B 27 10.980 2.440 7.362 1.00 11.37 C ATOM 3014 O VAL B 27 9.767 2.394 7.157 1.00 13.10 O ATOM 3015 CB VAL B 27 12.267 3.595 5.506 1.00 13.61 C ATOM 3016 CG1 VAL B 27 13.548 3.490 4.703 1.00 14.75 C ATOM 3017 CG2 VAL B 27 11.061 4.021 4.648 1.00 13.81 C ATOM 3018 H VAL B 27 10.712 1.302 4.795 1.00 0.00 H ATOM 3019 N SER B 28 11.453 2.591 8.582 1.00 11.34 N ATOM 3020 CA SER B 28 10.507 2.660 9.679 1.00 12.21 C ATOM 3021 C SER B 28 11.106 3.465 10.852 1.00 13.27 C ATOM 3022 O SER B 28 12.307 3.776 10.875 1.00 13.37 O ATOM 3023 CB SER B 28 10.194 1.211 10.137 1.00 13.54 C ATOM 3024 OG SER B 28 11.380 0.582 10.663 1.00 14.82 O ATOM 3025 HG SER B 28 11.163 -0.340 10.950 1.00 0.00 H ATOM 3026 H SER B 28 12.476 2.659 8.754 1.00 0.00 H ATOM 3027 N GLY B 29 10.276 3.764 11.843 1.00 13.19 N ATOM 3028 CA GLY B 29 10.709 4.427 13.065 1.00 14.22 C ATOM 3029 C GLY B 29 11.072 5.884 12.919 1.00 14.45 C ATOM 3030 O GLY B 29 11.717 6.446 13.830 1.00 17.19 O ATOM 3031 H GLY B 29 9.272 3.514 11.743 1.00 0.00 H ATOM 3032 N PHE B 30 10.661 6.520 11.812 1.00 14.31 N ATOM 3033 CA PHE B 30 11.035 7.920 11.532 1.00 13.66 C ATOM 3034 C PHE B 30 9.913 8.920 11.782 1.00 13.29 C ATOM 3035 O PHE B 30 8.743 8.575 11.773 1.00 13.75 O ATOM 3036 CB PHE B 30 11.612 8.097 10.095 1.00 12.82 C ATOM 3037 CG PHE B 30 10.655 7.709 8.980 1.00 11.80 C ATOM 3038 CD1 PHE B 30 10.554 6.359 8.583 1.00 11.96 C ATOM 3039 CD2 PHE B 30 9.909 8.651 8.314 1.00 12.10 C ATOM 3040 CE1 PHE B 30 9.704 5.995 7.575 1.00 12.42 C ATOM 3041 CE2 PHE B 30 9.046 8.290 7.287 1.00 13.07 C ATOM 3042 CZ PHE B 30 8.960 6.937 6.906 1.00 12.97 C ATOM 3043 H PHE B 30 10.061 6.012 11.131 1.00 0.00 H ATOM 3044 N HIS B 31 10.302 10.156 12.023 1.00 13.34 N ATOM 3045 CA HIS B 31 9.360 11.275 12.149 1.00 13.66 C ATOM 3046 C HIS B 31 10.175 12.522 11.859 1.00 14.04 C ATOM 3047 O HIS B 31 11.280 12.641 12.376 1.00 14.90 O ATOM 3048 CB HIS B 31 8.780 11.348 13.581 1.00 14.18 C ATOM 3049 CG HIS B 31 7.363 11.844 13.620 1.00 15.45 C ATOM 3050 ND1 HIS B 31 7.048 13.164 13.431 1.00 16.84 N ATOM 3051 CD2 HIS B 31 6.184 11.190 13.773 1.00 16.39 C ATOM 3052 CE1 HIS B 31 5.736 13.312 13.488 1.00 16.46 C ATOM 3053 NE2 HIS B 31 5.191 12.125 13.661 1.00 17.25 N ATOM 3054 H HIS B 31 11.319 10.347 12.128 1.00 0.00 H ATOM 3055 N PRO B 32 9.669 13.468 11.058 1.00 14.27 N ATOM 3056 CA PRO B 32 8.351 13.518 10.400 1.00 13.58 C ATOM 3057 C PRO B 32 8.282 12.587 9.174 1.00 14.12 C ATOM 3058 O PRO B 32 9.229 11.842 8.897 1.00 14.25 O ATOM 3059 CB PRO B 32 8.204 15.036 10.071 1.00 15.62 C ATOM 3060 CG PRO B 32 9.556 15.403 9.725 1.00 16.77 C ATOM 3061 CD PRO B 32 10.437 14.713 10.792 1.00 16.32 C ATOM 3062 N SER B 33 7.143 12.600 8.482 1.00 14.22 N ATOM 3063 CA SER B 33 6.895 11.594 7.453 1.00 14.53 C ATOM 3064 C SER B 33 7.571 11.875 6.112 1.00 15.30 C ATOM 3065 O SER B 33 7.774 10.947 5.338 1.00 15.70 O ATOM 3066 CB SER B 33 5.377 11.397 7.218 1.00 15.49 C ATOM 3067 OG SER B 33 4.820 12.639 6.859 1.00 16.58 O ATOM 3068 HG SER B 33 4.969 13.290 7.590 1.00 0.00 H ATOM 3069 H SER B 33 6.428 13.330 8.676 1.00 0.00 H ATOM 3070 N ASP B 34 7.914 13.119 5.812 1.00 15.78 N ATOM 3071 CA ASP B 34 8.536 13.427 4.513 1.00 17.16 C ATOM 3072 C ASP B 34 9.916 12.771 4.441 1.00 15.84 C ATOM 3073 O ASP B 34 10.749 12.948 5.330 1.00 15.48 O ATOM 3074 CB ASP B 34 8.632 14.949 4.290 1.00 19.99 C ATOM 3075 CG ASP B 34 7.275 15.610 4.039 1.00 23.29 C ATOM 3076 OD1 ASP B 34 6.313 14.922 3.651 1.00 25.86 O ATOM 3077 OD2 ASP B 34 7.178 16.846 4.207 1.00 24.28 O ATOM 3078 H ASP B 34 7.743 13.882 6.497 1.00 0.00 H ATOM 3079 N ILE B 35 10.135 11.975 3.390 1.00 15.27 N ATOM 3080 CA ILE B 35 11.298 11.119 3.272 1.00 14.17 C ATOM 3081 C ILE B 35 11.533 10.885 1.786 1.00 15.97 C ATOM 3082 O ILE B 35 10.585 10.895 0.991 1.00 17.24 O ATOM 3083 CB ILE B 35 11.078 9.792 4.047 1.00 14.50 C ATOM 3084 CG1 ILE B 35 12.407 9.050 4.309 1.00 14.87 C ATOM 3085 CG2 ILE B 35 9.974 8.893 3.386 1.00 14.96 C ATOM 3086 CD1 ILE B 35 12.319 7.888 5.312 1.00 14.92 C ATOM 3087 H ILE B 35 9.437 11.970 2.619 1.00 0.00 H ATOM 3088 N GLU B 36 12.788 10.734 1.401 1.00 16.38 N ATOM 3089 CA GLU B 36 13.128 10.377 0.011 1.00 19.35 C ATOM 3090 C GLU B 36 13.792 9.028 0.015 1.00 17.23 C ATOM 3091 O GLU B 36 14.783 8.839 0.704 1.00 17.86 O ATOM 3092 CB GLU B 36 14.115 11.398 -0.563 1.00 27.30 C ATOM 3093 CG GLU B 36 13.515 12.779 -0.741 1.00 35.85 C ATOM 3094 CD GLU B 36 14.494 13.757 -1.383 1.00 43.52 C ATOM 3095 OE1 GLU B 36 15.659 13.366 -1.657 1.00 45.29 O ATOM 3096 OE2 GLU B 36 14.089 14.916 -1.617 1.00 47.51 O ATOM 3097 H GLU B 36 13.552 10.870 2.093 1.00 0.00 H ATOM 3098 N VAL B 37 13.232 8.052 -0.711 1.00 16.10 N ATOM 3099 CA VAL B 37 13.823 6.723 -0.762 1.00 16.24 C ATOM 3100 C VAL B 37 13.959 6.317 -2.219 1.00 16.52 C ATOM 3101 O VAL B 37 13.003 6.462 -3.015 1.00 17.22 O ATOM 3102 CB VAL B 37 12.916 5.691 -0.060 1.00 15.52 C ATOM 3103 CG1 VAL B 37 13.537 4.291 -0.089 1.00 15.43 C ATOM 3104 CG2 VAL B 37 12.623 6.148 1.374 1.00 15.38 C ATOM 3105 H VAL B 37 12.362 8.247 -1.246 1.00 0.00 H ATOM 3106 N ASP B 38 15.168 5.864 -2.569 1.00 16.85 N ATOM 3107 CA ASP B 38 15.455 5.371 -3.904 1.00 17.58 C ATOM 3108 C ASP B 38 16.096 4.029 -3.813 1.00 16.59 C ATOM 3109 O ASP B 38 16.865 3.754 -2.894 1.00 17.27 O ATOM 3110 CB ASP B 38 16.359 6.314 -4.703 1.00 20.79 C ATOM 3111 CG ASP B 38 15.631 7.582 -5.116 1.00 26.00 C ATOM 3112 OD1 ASP B 38 14.725 7.515 -5.990 1.00 28.08 O ATOM 3113 OD2 ASP B 38 15.954 8.636 -4.557 1.00 28.49 O ATOM 3114 H ASP B 38 15.929 5.865 -1.860 1.00 0.00 H ATOM 3115 N LEU B 39 15.795 3.198 -4.788 1.00 15.41 N ATOM 3116 CA LEU B 39 16.519 1.943 -4.925 1.00 15.32 C ATOM 3117 C LEU B 39 17.548 2.159 -6.036 1.00 15.60 C ATOM 3118 O LEU B 39 17.235 2.758 -7.080 1.00 17.64 O ATOM 3119 CB LEU B 39 15.564 0.784 -5.279 1.00 16.10 C ATOM 3120 CG LEU B 39 14.566 0.454 -4.168 1.00 18.64 C ATOM 3121 CD1 LEU B 39 13.522 -0.548 -4.617 1.00 17.97 C ATOM 3122 CD2 LEU B 39 15.295 -0.114 -2.982 1.00 21.02 C ATOM 3123 H LEU B 39 15.039 3.438 -5.461 1.00 0.00 H ATOM 3124 N LEU B 40 18.782 1.682 -5.827 1.00 15.53 N ATOM 3125 CA LEU B 40 19.881 1.917 -6.775 1.00 15.94 C ATOM 3126 C LEU B 40 20.362 0.615 -7.348 1.00 17.32 C ATOM 3127 O LEU B 40 20.437 -0.398 -6.610 1.00 17.11 O ATOM 3128 CB LEU B 40 21.063 2.559 -6.071 1.00 16.38 C ATOM 3129 CG LEU B 40 20.764 3.798 -5.237 1.00 17.98 C ATOM 3130 CD1 LEU B 40 22.063 4.318 -4.649 1.00 18.67 C ATOM 3131 CD2 LEU B 40 20.075 4.858 -6.092 1.00 19.01 C ATOM 3132 H LEU B 40 18.969 1.128 -4.967 1.00 0.00 H ATOM 3133 N LYS B 41 20.654 0.606 -8.647 1.00 17.48 N ATOM 3134 CA LYS B 41 21.267 -0.550 -9.279 1.00 17.32 C ATOM 3135 C LYS B 41 22.624 -0.094 -9.836 1.00 17.71 C ATOM 3136 O LYS B 41 22.676 0.795 -10.688 1.00 19.09 O ATOM 3137 CB LYS B 41 20.385 -1.041 -10.414 1.00 16.95 C ATOM 3138 CG LYS B 41 21.001 -2.154 -11.237 1.00 17.83 C ATOM 3139 CD LYS B 41 20.083 -2.534 -12.415 1.00 19.00 C ATOM 3140 CE LYS B 41 20.601 -3.762 -13.096 1.00 21.23 C ATOM 3141 NZ LYS B 41 19.738 -4.175 -14.277 1.00 22.99 N ATOM 3142 HZ1 LYS B 41 18.772 -4.373 -13.946 1.00 0.00 H ATOM 3143 HZ2 LYS B 41 19.716 -3.404 -14.975 1.00 0.00 H ATOM 3144 HZ3 LYS B 41 20.138 -5.029 -14.715 1.00 0.00 H ATOM 3145 H LYS B 41 20.439 1.445 -9.222 1.00 0.00 H ATOM 3146 N ASN B 42 23.716 -0.707 -9.347 1.00 18.20 N ATOM 3147 CA ASN B 42 25.062 -0.291 -9.716 1.00 20.65 C ATOM 3148 C ASN B 42 25.223 1.219 -9.619 1.00 21.88 C ATOM 3149 O ASN B 42 25.825 1.861 -10.496 1.00 23.09 O ATOM 3150 CB ASN B 42 25.394 -0.781 -11.117 1.00 22.05 C ATOM 3151 CG ASN B 42 25.281 -2.276 -11.213 1.00 22.90 C ATOM 3152 OD1 ASN B 42 25.726 -2.986 -10.315 1.00 23.39 O ATOM 3153 ND2 ASN B 42 24.650 -2.767 -12.265 1.00 21.95 N ATOM 3154 HD22 ASN B 42 24.290 -2.127 -13.001 1.00 0.00 H ATOM 3155 HD21 ASN B 42 24.513 -3.794 -12.357 1.00 0.00 H ATOM 3156 H ASN B 42 23.596 -1.501 -8.686 1.00 0.00 H ATOM 3157 N GLY B 43 24.645 1.786 -8.560 1.00 21.92 N ATOM 3158 CA GLY B 43 24.783 3.201 -8.255 1.00 23.20 C ATOM 3159 C GLY B 43 23.736 4.108 -8.841 1.00 24.60 C ATOM 3160 O GLY B 43 23.665 5.286 -8.467 1.00 25.56 O ATOM 3161 H GLY B 43 24.072 1.192 -7.926 1.00 0.00 H ATOM 3162 N GLU B 44 22.917 3.599 -9.753 1.00 24.70 N ATOM 3163 CA GLU B 44 22.000 4.467 -10.515 1.00 27.58 C ATOM 3164 C GLU B 44 20.582 4.257 -10.033 1.00 23.68 C ATOM 3165 O GLU B 44 20.171 3.137 -9.772 1.00 21.82 O ATOM 3166 CB GLU B 44 22.056 4.117 -12.002 1.00 35.57 C ATOM 3167 CG GLU B 44 22.794 5.136 -12.845 1.00 43.95 C ATOM 3168 CD GLU B 44 22.998 4.669 -14.279 1.00 51.24 C ATOM 3169 OE1 GLU B 44 22.880 3.444 -14.534 1.00 52.38 O ATOM 3170 OE2 GLU B 44 23.282 5.532 -15.146 1.00 55.45 O ATOM 3171 H GLU B 44 22.922 2.575 -9.933 1.00 0.00 H ATOM 3172 N ARG B 45 19.840 5.331 -9.874 1.00 23.18 N ATOM 3173 CA ARG B 45 18.457 5.275 -9.423 1.00 23.70 C ATOM 3174 C ARG B 45 17.600 4.438 -10.351 1.00 22.49 C ATOM 3175 O ARG B 45 17.636 4.632 -11.579 1.00 23.59 O ATOM 3176 CB ARG B 45 17.921 6.703 -9.377 1.00 27.33 C ATOM 3177 CG ARG B 45 16.508 6.795 -8.895 1.00 30.69 C ATOM 3178 CD ARG B 45 16.009 8.239 -8.930 1.00 34.03 C ATOM 3179 NE ARG B 45 14.621 8.234 -8.498 1.00 37.20 N ATOM 3180 CZ ARG B 45 13.578 8.235 -9.323 1.00 39.51 C ATOM 3181 NH1 ARG B 45 13.756 8.278 -10.641 1.00 40.33 N ATOM 3182 NH2 ARG B 45 12.354 8.204 -8.817 1.00 40.35 N ATOM 3183 HE ARG B 45 14.431 8.229 -7.476 1.00 0.00 H ATOM 3184 HH12 ARG B 45 12.933 8.278 -11.277 1.00 0.00 H ATOM 3185 HH11 ARG B 45 14.718 8.311 -11.035 1.00 0.00 H ATOM 3186 HH22 ARG B 45 11.529 8.204 -9.451 1.00 0.00 H ATOM 3187 HH21 ARG B 45 12.218 8.179 -7.786 1.00 0.00 H ATOM 3188 H ARG B 45 20.259 6.260 -10.079 1.00 0.00 H ATOM 3189 N ILE B 46 16.823 3.536 -9.756 1.00 20.25 N ATOM 3190 CA ILE B 46 15.872 2.718 -10.499 1.00 19.51 C ATOM 3191 C ILE B 46 14.589 3.518 -10.659 1.00 20.81 C ATOM 3192 O ILE B 46 14.092 4.126 -9.707 1.00 19.80 O ATOM 3193 CB ILE B 46 15.544 1.428 -9.751 1.00 18.45 C ATOM 3194 CG1 ILE B 46 16.836 0.599 -9.659 1.00 17.87 C ATOM 3195 CG2 ILE B 46 14.509 0.653 -10.540 1.00 17.47 C ATOM 3196 CD1 ILE B 46 16.738 -0.700 -8.820 1.00 18.08 C ATOM 3197 H ILE B 46 16.897 3.410 -8.726 1.00 0.00 H ATOM 3198 N GLU B 47 14.063 3.557 -11.881 1.00 23.48 N ATOM 3199 CA GLU B 47 12.819 4.279 -12.122 1.00 27.59 C ATOM 3200 C GLU B 47 11.568 3.456 -11.801 1.00 27.72 C ATOM 3201 O GLU B 47 11.596 2.229 -11.796 1.00 27.66 O ATOM 3202 CB GLU B 47 12.772 4.737 -13.587 1.00 32.36 C ATOM 3203 CG GLU B 47 13.911 5.654 -13.985 1.00 36.87 C ATOM 3204 CD GLU B 47 13.723 6.195 -15.379 1.00 41.52 C ATOM 3205 OE1 GLU B 47 12.554 6.503 -15.713 1.00 42.98 O ATOM 3206 OE2 GLU B 47 14.727 6.302 -16.131 1.00 43.21 O ATOM 3207 H GLU B 47 14.541 3.071 -12.667 1.00 0.00 H ATOM 3208 N LYS B 48 10.465 4.149 -11.533 1.00 27.86 N ATOM 3209 CA LYS B 48 9.170 3.484 -11.369 1.00 27.75 C ATOM 3210 C LYS B 48 9.088 2.579 -10.145 1.00 25.95 C ATOM 3211 O LYS B 48 8.245 1.685 -10.082 1.00 27.17 O ATOM 3212 CB LYS B 48 8.789 2.693 -12.632 1.00 29.55 C ATOM 3213 CG LYS B 48 8.591 3.570 -13.873 1.00 30.96 C ATOM 3214 CD LYS B 48 7.690 2.904 -14.910 1.00 31.82 C ATOM 3215 CE LYS B 48 7.468 3.796 -16.124 1.00 32.64 C ATOM 3216 NZ LYS B 48 6.260 4.653 -15.970 1.00 33.41 N ATOM 3217 HZ1 LYS B 48 5.421 4.050 -15.851 1.00 0.00 H ATOM 3218 HZ2 LYS B 48 6.372 5.262 -15.134 1.00 0.00 H ATOM 3219 HZ3 LYS B 48 6.145 5.244 -16.818 1.00 0.00 H ATOM 3220 H LYS B 48 10.523 5.183 -11.438 1.00 0.00 H ATOM 3221 N VAL B 49 9.956 2.813 -9.172 1.00 22.43 N ATOM 3222 CA VAL B 49 9.822 2.152 -7.883 1.00 18.12 C ATOM 3223 C VAL B 49 8.524 2.598 -7.219 1.00 18.64 C ATOM 3224 O VAL B 49 8.159 3.780 -7.249 1.00 20.79 O ATOM 3225 CB VAL B 49 11.003 2.578 -6.981 1.00 16.66 C ATOM 3226 CG1 VAL B 49 10.795 2.109 -5.565 1.00 17.21 C ATOM 3227 CG2 VAL B 49 12.280 2.050 -7.532 1.00 16.62 C ATOM 3228 H VAL B 49 10.741 3.476 -9.331 1.00 0.00 H ATOM 3229 N GLU B 50 7.815 1.660 -6.619 1.00 17.14 N ATOM 3230 CA GLU B 50 6.536 1.943 -5.955 1.00 16.73 C ATOM 3231 C GLU B 50 6.708 1.899 -4.465 1.00 14.20 C ATOM 3232 O GLU B 50 7.739 1.424 -3.944 1.00 14.44 O ATOM 3233 CB GLU B 50 5.504 0.890 -6.354 1.00 19.93 C ATOM 3234 CG GLU B 50 5.056 0.950 -7.835 1.00 24.49 C ATOM 3235 CD GLU B 50 4.296 -0.305 -8.228 1.00 29.59 C ATOM 3236 OE1 GLU B 50 4.906 -1.231 -8.803 1.00 31.54 O ATOM 3237 OE2 GLU B 50 3.086 -0.378 -7.940 1.00 31.88 O ATOM 3238 H GLU B 50 8.175 0.684 -6.616 1.00 0.00 H ATOM 3239 N HIS B 51 5.696 2.382 -3.738 1.00 14.46 N ATOM 3240 CA HIS B 51 5.752 2.341 -2.295 1.00 14.14 C ATOM 3241 C HIS B 51 4.376 2.152 -1.720 1.00 13.12 C ATOM 3242 O HIS B 51 3.370 2.468 -2.328 1.00 13.85 O ATOM 3243 CB HIS B 51 6.462 3.587 -1.706 1.00 15.25 C ATOM 3244 CG HIS B 51 5.758 4.885 -1.979 1.00 17.33 C ATOM 3245 ND1 HIS B 51 4.691 5.328 -1.214 1.00 18.67 N ATOM 3246 CD2 HIS B 51 5.970 5.821 -2.925 1.00 19.20 C ATOM 3247 CE1 HIS B 51 4.276 6.492 -1.690 1.00 20.36 C ATOM 3248 NE2 HIS B 51 5.024 6.815 -2.733 1.00 20.59 N ATOM 3249 H HIS B 51 4.865 2.789 -4.213 1.00 0.00 H ATOM 3250 N SER B 52 4.375 1.618 -0.502 1.00 12.44 N ATOM 3251 CA SER B 52 3.143 1.447 0.248 1.00 12.15 C ATOM 3252 C SER B 52 2.577 2.758 0.707 1.00 12.95 C ATOM 3253 O SER B 52 3.239 3.796 0.648 1.00 14.65 O ATOM 3254 CB SER B 52 3.409 0.562 1.464 1.00 12.97 C ATOM 3255 OG SER B 52 4.376 1.198 2.313 1.00 13.97 O ATOM 3256 HG SER B 52 4.549 0.625 3.101 1.00 0.00 H ATOM 3257 H SER B 52 5.275 1.317 -0.078 1.00 0.00 H ATOM 3258 N ASP B 53 1.330 2.732 1.157 1.00 12.56 N ATOM 3259 CA ASP B 53 0.667 3.954 1.633 1.00 12.49 C ATOM 3260 C ASP B 53 1.147 4.238 3.063 1.00 12.17 C ATOM 3261 O ASP B 53 1.217 3.321 3.894 1.00 13.28 O ATOM 3262 CB ASP B 53 -0.854 3.766 1.657 1.00 12.80 C ATOM 3263 CG ASP B 53 -1.433 3.433 0.310 1.00 15.25 C ATOM 3264 OD1 ASP B 53 -0.989 4.044 -0.683 1.00 16.96 O ATOM 3265 OD2 ASP B 53 -2.295 2.545 0.220 1.00 16.29 O ATOM 3266 H ASP B 53 0.812 1.830 1.173 1.00 0.00 H ATOM 3267 N LEU B 54 1.484 5.498 3.360 1.00 11.38 N ATOM 3268 CA LEU B 54 2.038 5.879 4.661 1.00 11.44 C ATOM 3269 C LEU B 54 1.151 5.472 5.830 1.00 12.41 C ATOM 3270 O LEU B 54 -0.037 5.769 5.879 1.00 12.75 O ATOM 3271 CB LEU B 54 2.145 7.424 4.643 1.00 12.97 C ATOM 3272 CG LEU B 54 2.797 7.998 5.907 1.00 13.03 C ATOM 3273 CD1 LEU B 54 4.304 7.741 5.932 1.00 13.27 C ATOM 3274 CD2 LEU B 54 2.545 9.527 5.923 1.00 14.48 C ATOM 3275 H LEU B 54 1.347 6.235 2.639 1.00 0.00 H ATOM 3276 N SER B 55 1.755 4.766 6.781 1.00 11.25 N ATOM 3277 CA SER B 55 1.085 4.394 7.998 1.00 12.16 C ATOM 3278 C SER B 55 2.075 4.542 9.144 1.00 11.75 C ATOM 3279 O SER B 55 3.209 5.010 8.957 1.00 10.69 O ATOM 3280 CB SER B 55 0.588 2.937 7.920 1.00 14.74 C ATOM 3281 OG SER B 55 -0.322 2.734 8.990 1.00 17.82 O ATOM 3282 HG SER B 55 -0.658 1.803 8.964 1.00 0.00 H ATOM 3283 H SER B 55 2.743 4.474 6.640 1.00 0.00 H ATOM 3284 N PHE B 56 1.629 4.231 10.351 1.00 11.24 N ATOM 3285 CA PHE B 56 2.482 4.467 11.509 1.00 12.33 C ATOM 3286 C PHE B 56 2.187 3.475 12.589 1.00 14.80 C ATOM 3287 O PHE B 56 1.124 2.827 12.609 1.00 15.33 O ATOM 3288 CB PHE B 56 2.393 5.941 12.009 1.00 11.90 C ATOM 3289 CG PHE B 56 0.995 6.432 12.259 1.00 11.10 C ATOM 3290 CD1 PHE B 56 0.350 6.150 13.470 1.00 10.87 C ATOM 3291 CD2 PHE B 56 0.345 7.265 11.319 1.00 10.54 C ATOM 3292 CE1 PHE B 56 -0.942 6.623 13.736 1.00 11.28 C ATOM 3293 CE2 PHE B 56 -0.927 7.721 11.587 1.00 10.23 C ATOM 3294 CZ PHE B 56 -1.597 7.438 12.771 1.00 11.35 C ATOM 3295 H PHE B 56 0.680 3.823 10.472 1.00 0.00 H ATOM 3296 N SER B 57 3.156 3.368 13.492 1.00 15.37 N ATOM 3297 CA SER B 57 3.100 2.445 14.616 1.00 17.81 C ATOM 3298 C SER B 57 2.562 3.116 15.885 1.00 19.49 C ATOM 3299 O SER B 57 2.300 4.328 15.912 1.00 18.82 O ATOM 3300 CB SER B 57 4.503 1.894 14.882 1.00 18.27 C ATOM 3301 OG SER B 57 5.061 1.371 13.689 1.00 19.73 O ATOM 3302 HG SER B 57 5.119 2.090 13.010 1.00 0.00 H ATOM 3303 H SER B 57 3.996 3.973 13.391 1.00 0.00 H ATOM 3304 N LYS B 58 2.427 2.328 16.944 1.00 22.48 N ATOM 3305 CA LYS B 58 1.860 2.802 18.212 1.00 26.60 C ATOM 3306 C LYS B 58 2.519 4.058 18.762 1.00 25.05 C ATOM 3307 O LYS B 58 1.832 4.954 19.311 1.00 25.83 O ATOM 3308 CB LYS B 58 1.988 1.694 19.262 1.00 31.68 C ATOM 3309 CG LYS B 58 0.961 0.584 19.147 1.00 37.04 C ATOM 3310 CD LYS B 58 0.876 -0.030 17.742 1.00 40.66 C ATOM 3311 CE LYS B 58 2.185 -0.654 17.277 1.00 43.16 C ATOM 3312 NZ LYS B 58 2.011 -1.190 15.917 1.00 44.48 N ATOM 3313 HZ1 LYS B 58 1.263 -1.912 15.923 1.00 0.00 H ATOM 3314 HZ2 LYS B 58 1.744 -0.418 15.273 1.00 0.00 H ATOM 3315 HZ3 LYS B 58 2.904 -1.617 15.597 1.00 0.00 H ATOM 3316 H LYS B 58 2.735 1.337 16.873 1.00 0.00 H ATOM 3317 N ASP B 59 3.838 4.132 18.598 1.00 22.09 N ATOM 3318 CA ASP B 59 4.604 5.308 19.027 1.00 20.67 C ATOM 3319 C ASP B 59 4.562 6.479 18.076 1.00 18.10 C ATOM 3320 O ASP B 59 5.260 7.472 18.290 1.00 19.27 O ATOM 3321 CB ASP B 59 6.075 4.929 19.328 1.00 21.99 C ATOM 3322 CG ASP B 59 6.853 4.500 18.098 1.00 23.88 C ATOM 3323 OD1 ASP B 59 6.333 4.580 16.975 1.00 23.50 O ATOM 3324 OD2 ASP B 59 8.022 4.087 18.254 1.00 25.68 O ATOM 3325 H ASP B 59 4.339 3.336 18.154 1.00 0.00 H ATOM 3326 N TRP B 60 3.716 6.362 17.049 1.00 15.13 N ATOM 3327 CA TRP B 60 3.479 7.411 16.054 1.00 13.98 C ATOM 3328 C TRP B 60 4.540 7.503 14.958 1.00 14.49 C ATOM 3329 O TRP B 60 4.396 8.318 14.044 1.00 13.76 O ATOM 3330 CB TRP B 60 3.263 8.776 16.700 1.00 13.78 C ATOM 3331 CG TRP B 60 2.155 8.832 17.750 1.00 12.30 C ATOM 3332 CD1 TRP B 60 2.337 8.966 19.107 1.00 13.28 C ATOM 3333 CD2 TRP B 60 0.738 8.790 17.534 1.00 11.72 C ATOM 3334 NE1 TRP B 60 1.129 9.015 19.739 1.00 13.26 N ATOM 3335 CE2 TRP B 60 0.127 8.894 18.809 1.00 11.72 C ATOM 3336 CE3 TRP B 60 -0.081 8.642 16.392 1.00 11.88 C ATOM 3337 CZ2 TRP B 60 -1.254 8.901 18.981 1.00 11.75 C ATOM 3338 CZ3 TRP B 60 -1.480 8.699 16.573 1.00 12.11 C ATOM 3339 CH2 TRP B 60 -2.047 8.787 17.848 1.00 12.40 C ATOM 3340 HE1 TRP B 60 0.989 9.126 20.764 1.00 0.00 H ATOM 3341 H TRP B 60 3.192 5.469 16.949 1.00 0.00 H ATOM 3342 N SER B 61 5.576 6.673 15.023 1.00 14.87 N ATOM 3343 CA SER B 61 6.603 6.721 13.987 1.00 15.07 C ATOM 3344 C SER B 61 6.105 6.052 12.728 1.00 13.84 C ATOM 3345 O SER B 61 5.358 5.083 12.767 1.00 14.33 O ATOM 3346 CB SER B 61 7.917 6.122 14.483 1.00 17.39 C ATOM 3347 OG SER B 61 7.793 4.736 14.703 1.00 18.20 O ATOM 3348 HG SER B 61 7.093 4.572 15.384 1.00 0.00 H ATOM 3349 H SER B 61 5.654 5.994 15.807 1.00 0.00 H ATOM 3350 N PHE B 62 6.552 6.568 11.603 1.00 12.30 N ATOM 3351 CA PHE B 62 6.069 6.133 10.292 1.00 11.71 C ATOM 3352 C PHE B 62 6.827 4.916 9.763 1.00 11.83 C ATOM 3353 O PHE B 62 7.968 4.614 10.150 1.00 12.82 O ATOM 3354 CB PHE B 62 6.160 7.266 9.290 1.00 11.28 C ATOM 3355 CG PHE B 62 5.332 8.449 9.684 1.00 10.74 C ATOM 3356 CD1 PHE B 62 3.967 8.424 9.490 1.00 10.38 C ATOM 3357 CD2 PHE B 62 5.918 9.577 10.294 1.00 10.68 C ATOM 3358 CE1 PHE B 62 3.156 9.557 9.853 1.00 10.02 C ATOM 3359 CE2 PHE B 62 5.128 10.711 10.665 1.00 10.85 C ATOM 3360 CZ PHE B 62 3.770 10.695 10.456 1.00 10.41 C ATOM 3361 H PHE B 62 7.276 7.313 11.647 1.00 0.00 H ATOM 3362 N TYR B 63 6.165 4.210 8.845 1.00 11.74 N ATOM 3363 CA TYR B 63 6.854 3.149 8.102 1.00 11.30 C ATOM 3364 C TYR B 63 6.310 3.121 6.674 1.00 11.08 C ATOM 3365 O TYR B 63 5.133 3.420 6.425 1.00 11.81 O ATOM 3366 CB TYR B 63 6.743 1.751 8.761 1.00 11.40 C ATOM 3367 CG TYR B 63 5.309 1.252 8.918 1.00 12.44 C ATOM 3368 CD1 TYR B 63 4.685 0.538 7.865 1.00 13.11 C ATOM 3369 CD2 TYR B 63 4.595 1.466 10.097 1.00 12.94 C ATOM 3370 CE1 TYR B 63 3.407 0.040 8.014 1.00 14.13 C ATOM 3371 CE2 TYR B 63 3.285 0.989 10.239 1.00 13.40 C ATOM 3372 CZ TYR B 63 2.719 0.263 9.204 1.00 14.58 C ATOM 3373 OH TYR B 63 1.414 -0.210 9.360 1.00 17.02 O ATOM 3374 HH TYR B 63 0.801 0.555 9.499 1.00 0.00 H ATOM 3375 H TYR B 63 5.162 4.411 8.656 1.00 0.00 H ATOM 3376 N LEU B 64 7.228 2.780 5.749 1.00 11.11 N ATOM 3377 CA LEU B 64 6.938 2.693 4.303 1.00 10.95 C ATOM 3378 C LEU B 64 7.756 1.546 3.740 1.00 10.64 C ATOM 3379 O LEU B 64 8.884 1.326 4.149 1.00 11.40 O ATOM 3380 CB LEU B 64 7.372 3.956 3.555 1.00 11.41 C ATOM 3381 CG LEU B 64 6.511 5.194 3.795 1.00 12.19 C ATOM 3382 CD1 LEU B 64 7.220 6.443 3.248 1.00 12.67 C ATOM 3383 CD2 LEU B 64 5.185 5.048 3.110 1.00 12.92 C ATOM 3384 H LEU B 64 8.194 2.566 6.070 1.00 0.00 H ATOM 3385 N LEU B 65 7.199 0.840 2.766 1.00 10.60 N ATOM 3386 CA LEU B 65 7.952 -0.145 1.988 1.00 10.88 C ATOM 3387 C LEU B 65 8.061 0.408 0.565 1.00 10.60 C ATOM 3388 O LEU B 65 7.055 0.724 -0.077 1.00 11.74 O ATOM 3389 CB LEU B 65 7.170 -1.452 1.911 1.00 10.24 C ATOM 3390 CG LEU B 65 7.850 -2.599 1.135 1.00 11.46 C ATOM 3391 CD1 LEU B 65 9.190 -3.045 1.767 1.00 12.92 C ATOM 3392 CD2 LEU B 65 6.948 -3.833 0.942 1.00 13.33 C ATOM 3393 H LEU B 65 6.194 0.991 2.547 1.00 0.00 H ATOM 3394 N TYR B 66 9.283 0.457 0.058 1.00 11.36 N ATOM 3395 CA TYR B 66 9.546 0.798 -1.346 1.00 11.58 C ATOM 3396 C TYR B 66 9.995 -0.481 -2.046 1.00 11.16 C ATOM 3397 O TYR B 66 10.743 -1.292 -1.466 1.00 11.71 O ATOM 3398 CB TYR B 66 10.659 1.892 -1.437 1.00 11.93 C ATOM 3399 CG TYR B 66 10.187 3.271 -1.118 1.00 13.05 C ATOM 3400 CD1 TYR B 66 9.931 3.634 0.198 1.00 14.28 C ATOM 3401 CD2 TYR B 66 9.992 4.193 -2.131 1.00 13.51 C ATOM 3402 CE1 TYR B 66 9.450 4.877 0.509 1.00 15.17 C ATOM 3403 CE2 TYR B 66 9.502 5.489 -1.819 1.00 15.78 C ATOM 3404 CZ TYR B 66 9.232 5.756 -0.505 1.00 16.59 C ATOM 3405 OH TYR B 66 8.776 7.068 -0.224 1.00 20.35 O ATOM 3406 HH TYR B 66 9.464 7.722 -0.504 1.00 0.00 H ATOM 3407 H TYR B 66 10.090 0.245 0.679 1.00 0.00 H ATOM 3408 N TYR B 67 9.578 -0.666 -3.290 1.00 11.10 N ATOM 3409 CA TYR B 67 9.826 -1.997 -3.894 1.00 10.97 C ATOM 3410 C TYR B 67 9.805 -1.916 -5.406 1.00 12.60 C ATOM 3411 O TYR B 67 9.150 -1.038 -6.023 1.00 13.58 O ATOM 3412 CB TYR B 67 8.785 -3.044 -3.419 1.00 12.11 C ATOM 3413 CG TYR B 67 7.350 -2.632 -3.660 1.00 12.26 C ATOM 3414 CD1 TYR B 67 6.668 -1.852 -2.722 1.00 13.01 C ATOM 3415 CD2 TYR B 67 6.690 -2.987 -4.824 1.00 13.17 C ATOM 3416 CE1 TYR B 67 5.343 -1.479 -2.908 1.00 13.78 C ATOM 3417 CE2 TYR B 67 5.336 -2.594 -5.034 1.00 14.70 C ATOM 3418 CZ TYR B 67 4.704 -1.840 -4.074 1.00 15.58 C ATOM 3419 OH TYR B 67 3.374 -1.483 -4.249 1.00 19.04 O ATOM 3420 HH TYR B 67 3.073 -0.946 -3.474 1.00 0.00 H ATOM 3421 H TYR B 67 9.098 0.089 -3.819 1.00 0.00 H ATOM 3422 N THR B 68 10.519 -2.842 -6.034 1.00 12.40 N ATOM 3423 CA THR B 68 10.497 -2.968 -7.472 1.00 13.75 C ATOM 3424 C THR B 68 10.763 -4.408 -7.865 1.00 14.68 C ATOM 3425 O THR B 68 11.433 -5.137 -7.154 1.00 13.81 O ATOM 3426 CB THR B 68 11.555 -1.982 -8.124 1.00 17.23 C ATOM 3427 OG1 THR B 68 11.434 -1.991 -9.558 1.00 19.72 O ATOM 3428 CG2 THR B 68 12.963 -2.422 -7.778 1.00 18.34 C ATOM 3429 HG1 THR B 68 11.596 -2.907 -9.896 1.00 0.00 H ATOM 3430 H THR B 68 11.109 -3.493 -5.477 1.00 0.00 H ATOM 3431 N GLU B 69 10.230 -4.805 -9.003 1.00 16.28 N ATOM 3432 CA GLU B 69 10.550 -6.111 -9.566 1.00 19.28 C ATOM 3433 C GLU B 69 11.960 -6.051 -10.106 1.00 18.69 C ATOM 3434 O GLU B 69 12.395 -5.056 -10.695 1.00 20.48 O ATOM 3435 CB GLU B 69 9.566 -6.438 -10.693 1.00 23.32 C ATOM 3436 CG GLU B 69 8.104 -6.390 -10.311 1.00 30.37 C ATOM 3437 CD GLU B 69 7.184 -6.843 -11.455 1.00 36.27 C ATOM 3438 OE1 GLU B 69 7.722 -7.312 -12.493 1.00 38.23 O ATOM 3439 OE2 GLU B 69 5.936 -6.758 -11.309 1.00 38.92 O ATOM 3440 H GLU B 69 9.571 -4.177 -9.507 1.00 0.00 H ATOM 3441 N PHE B 70 12.717 -7.106 -9.894 1.00 16.48 N ATOM 3442 CA PHE B 70 14.042 -7.213 -10.455 1.00 15.61 C ATOM 3443 C PHE B 70 14.461 -8.670 -10.632 1.00 16.08 C ATOM 3444 O PHE B 70 13.917 -9.525 -10.059 1.00 15.72 O ATOM 3445 CB PHE B 70 15.074 -6.445 -9.619 1.00 17.91 C ATOM 3446 CG PHE B 70 15.603 -7.168 -8.405 1.00 17.62 C ATOM 3447 CD1 PHE B 70 14.784 -7.768 -7.471 1.00 17.51 C ATOM 3448 CD2 PHE B 70 16.934 -7.245 -8.205 1.00 18.50 C ATOM 3449 CE1 PHE B 70 15.307 -8.391 -6.387 1.00 16.97 C ATOM 3450 CE2 PHE B 70 17.458 -7.871 -7.120 1.00 18.74 C ATOM 3451 CZ PHE B 70 16.643 -8.452 -6.206 1.00 18.90 C ATOM 3452 H PHE B 70 12.351 -7.883 -9.307 1.00 0.00 H ATOM 3453 N THR B 71 15.462 -8.882 -11.469 1.00 16.83 N ATOM 3454 CA THR B 71 16.063 -10.210 -11.681 1.00 16.57 C ATOM 3455 C THR B 71 17.528 -10.099 -11.282 1.00 17.47 C ATOM 3456 O THR B 71 18.335 -9.481 -11.999 1.00 18.65 O ATOM 3457 CB THR B 71 15.906 -10.653 -13.130 1.00 16.67 C ATOM 3458 OG1 THR B 71 14.495 -10.802 -13.420 1.00 17.78 O ATOM 3459 CG2 THR B 71 16.618 -12.028 -13.358 1.00 17.65 C ATOM 3460 HG1 THR B 71 14.381 -11.090 -14.360 1.00 0.00 H ATOM 3461 H THR B 71 15.843 -8.074 -12.002 1.00 0.00 H ATOM 3462 N PRO B 72 17.881 -10.657 -10.116 1.00 17.58 N ATOM 3463 CA PRO B 72 19.275 -10.597 -9.709 1.00 19.17 C ATOM 3464 C PRO B 72 20.185 -11.292 -10.705 1.00 20.59 C ATOM 3465 O PRO B 72 19.831 -12.329 -11.305 1.00 20.33 O ATOM 3466 CB PRO B 72 19.301 -11.339 -8.360 1.00 19.43 C ATOM 3467 CG PRO B 72 17.910 -11.829 -8.089 1.00 18.91 C ATOM 3468 CD PRO B 72 16.982 -11.203 -9.081 1.00 18.18 C ATOM 3469 N THR B 73 21.361 -10.716 -10.927 1.00 22.39 N ATOM 3470 CA THR B 73 22.393 -11.401 -11.694 1.00 25.63 C ATOM 3471 C THR B 73 23.665 -11.428 -10.836 1.00 28.41 C ATOM 3472 O THR B 73 23.747 -10.789 -9.791 1.00 29.40 O ATOM 3473 CB THR B 73 22.726 -10.681 -12.993 1.00 27.97 C ATOM 3474 OG1 THR B 73 23.261 -9.392 -12.677 1.00 29.80 O ATOM 3475 CG2 THR B 73 21.492 -10.502 -13.841 1.00 28.17 C ATOM 3476 HG1 THR B 73 22.590 -8.874 -12.166 1.00 0.00 H ATOM 3477 H THR B 73 21.547 -9.765 -10.549 1.00 0.00 H ATOM 3478 N GLU B 74 24.667 -12.152 -11.298 1.00 30.15 N ATOM 3479 CA GLU B 74 25.877 -12.310 -10.501 1.00 34.11 C ATOM 3480 C GLU B 74 26.591 -10.989 -10.231 1.00 35.21 C ATOM 3481 O GLU B 74 27.073 -10.748 -9.120 1.00 36.33 O ATOM 3482 CB GLU B 74 26.830 -13.280 -11.206 1.00 38.03 C ATOM 3483 CG GLU B 74 27.966 -13.754 -10.344 1.00 42.54 C ATOM 3484 CD GLU B 74 28.885 -14.743 -11.073 1.00 46.05 C ATOM 3485 OE1 GLU B 74 28.441 -15.389 -12.065 1.00 47.44 O ATOM 3486 OE2 GLU B 74 30.057 -14.873 -10.645 1.00 47.44 O ATOM 3487 H GLU B 74 24.593 -12.609 -12.229 1.00 0.00 H ATOM 3488 N LYS B 75 26.647 -10.134 -11.246 1.00 34.97 N ATOM 3489 CA LYS B 75 27.503 -8.950 -11.192 1.00 35.40 C ATOM 3490 C LYS B 75 26.805 -7.708 -10.640 1.00 31.75 C ATOM 3491 O LYS B 75 27.470 -6.814 -10.099 1.00 32.77 O ATOM 3492 CB LYS B 75 28.035 -8.642 -12.593 1.00 39.56 C ATOM 3493 CG LYS B 75 26.932 -8.154 -13.539 1.00 43.01 C ATOM 3494 CD LYS B 75 27.279 -8.342 -15.008 1.00 45.82 C ATOM 3495 CE LYS B 75 26.055 -8.065 -15.880 1.00 47.66 C ATOM 3496 NZ LYS B 75 24.791 -8.628 -15.285 1.00 48.74 N ATOM 3497 HZ1 LYS B 75 24.887 -9.658 -15.181 1.00 0.00 H ATOM 3498 HZ2 LYS B 75 24.627 -8.198 -14.352 1.00 0.00 H ATOM 3499 HZ3 LYS B 75 23.989 -8.415 -15.912 1.00 0.00 H ATOM 3500 H LYS B 75 26.072 -10.310 -12.094 1.00 0.00 H ATOM 3501 N ASP B 76 25.483 -7.627 -10.782 1.00 26.99 N ATOM 3502 CA ASP B 76 24.768 -6.415 -10.379 1.00 24.52 C ATOM 3503 C ASP B 76 24.729 -6.187 -8.871 1.00 23.43 C ATOM 3504 O ASP B 76 24.526 -7.127 -8.100 1.00 24.62 O ATOM 3505 CB ASP B 76 23.317 -6.460 -10.902 1.00 24.16 C ATOM 3506 CG ASP B 76 23.242 -6.339 -12.404 1.00 25.27 C ATOM 3507 OD1 ASP B 76 24.017 -5.547 -12.967 1.00 26.02 O ATOM 3508 OD2 ASP B 76 22.408 -7.042 -13.017 1.00 25.67 O ATOM 3509 H ASP B 76 24.956 -8.430 -11.182 1.00 0.00 H ATOM 3510 N GLU B 77 24.907 -4.933 -8.471 1.00 22.54 N ATOM 3511 CA GLU B 77 24.880 -4.547 -7.052 1.00 23.18 C ATOM 3512 C GLU B 77 23.674 -3.675 -6.836 1.00 20.49 C ATOM 3513 O GLU B 77 23.291 -2.928 -7.742 1.00 21.81 O ATOM 3514 CB GLU B 77 26.162 -3.774 -6.676 1.00 26.46 C ATOM 3515 CG GLU B 77 27.396 -4.686 -6.684 1.00 31.64 C ATOM 3516 CD GLU B 77 28.705 -3.946 -6.449 1.00 36.68 C ATOM 3517 OE1 GLU B 77 28.998 -2.988 -7.193 1.00 38.22 O ATOM 3518 OE2 GLU B 77 29.451 -4.337 -5.525 1.00 38.81 O ATOM 3519 H GLU B 77 25.071 -4.197 -9.187 1.00 0.00 H ATOM 3520 N TYR B 78 23.044 -3.765 -5.661 1.00 17.38 N ATOM 3521 CA TYR B 78 21.869 -2.918 -5.373 1.00 15.91 C ATOM 3522 C TYR B 78 22.021 -2.279 -4.023 1.00 15.43 C ATOM 3523 O TYR B 78 22.842 -2.716 -3.224 1.00 16.15 O ATOM 3524 CB TYR B 78 20.593 -3.746 -5.389 1.00 15.86 C ATOM 3525 CG TYR B 78 20.256 -4.260 -6.774 1.00 17.41 C ATOM 3526 CD1 TYR B 78 20.801 -5.438 -7.238 1.00 16.63 C ATOM 3527 CD2 TYR B 78 19.372 -3.554 -7.594 1.00 17.59 C ATOM 3528 CE1 TYR B 78 20.491 -5.913 -8.521 1.00 17.22 C ATOM 3529 CE2 TYR B 78 19.043 -4.029 -8.866 1.00 17.84 C ATOM 3530 CZ TYR B 78 19.595 -5.188 -9.303 1.00 18.36 C ATOM 3531 OH TYR B 78 19.284 -5.641 -10.581 1.00 20.16 O ATOM 3532 HH TYR B 78 19.760 -6.492 -10.753 1.00 0.00 H ATOM 3533 H TYR B 78 23.384 -4.437 -4.944 1.00 0.00 H ATOM 3534 N ALA B 79 21.253 -1.220 -3.788 1.00 15.60 N ATOM 3535 CA ALA B 79 21.306 -0.525 -2.515 1.00 15.20 C ATOM 3536 C ALA B 79 20.055 0.278 -2.393 1.00 14.98 C ATOM 3537 O ALA B 79 19.304 0.424 -3.343 1.00 14.53 O ATOM 3538 CB ALA B 79 22.519 0.426 -2.444 1.00 15.08 C ATOM 3539 H ALA B 79 20.604 -0.884 -4.528 1.00 0.00 H ATOM 3540 N CYS B 80 19.816 0.787 -1.193 1.00 16.27 N ATOM 3541 CA CYS B 80 18.693 1.669 -0.946 1.00 16.74 C ATOM 3542 C CYS B 80 19.250 2.958 -0.397 1.00 16.56 C ATOM 3543 O CYS B 80 20.064 2.942 0.511 1.00 16.87 O ATOM 3544 CB CYS B 80 17.757 1.061 0.074 1.00 17.71 C ATOM 3545 SG CYS B 80 16.349 2.110 0.487 1.00 19.03 S ATOM 3546 H CYS B 80 20.452 0.547 -0.406 1.00 0.00 H ATOM 3547 N ARG B 81 18.797 4.073 -0.957 1.00 16.23 N ATOM 3548 CA ARG B 81 19.257 5.404 -0.553 1.00 17.00 C ATOM 3549 C ARG B 81 18.125 6.182 0.112 1.00 15.82 C ATOM 3550 O ARG B 81 17.041 6.309 -0.435 1.00 16.87 O ATOM 3551 CB ARG B 81 19.765 6.202 -1.769 1.00 18.46 C ATOM 3552 CG ARG B 81 20.222 7.597 -1.402 1.00 20.08 C ATOM 3553 CD ARG B 81 20.783 8.300 -2.619 1.00 23.79 C ATOM 3554 NE ARG B 81 19.752 8.515 -3.633 1.00 27.19 N ATOM 3555 CZ ARG B 81 19.999 8.642 -4.940 1.00 29.40 C ATOM 3556 NH1 ARG B 81 21.241 8.541 -5.413 1.00 30.43 N ATOM 3557 NH2 ARG B 81 18.987 8.860 -5.771 1.00 30.40 N ATOM 3558 HE ARG B 81 18.763 8.573 -3.317 1.00 0.00 H ATOM 3559 HH12 ARG B 81 21.419 8.642 -6.433 1.00 0.00 H ATOM 3560 HH11 ARG B 81 22.032 8.361 -4.762 1.00 0.00 H ATOM 3561 HH22 ARG B 81 19.164 8.961 -6.791 1.00 0.00 H ATOM 3562 HH21 ARG B 81 18.017 8.930 -5.402 1.00 0.00 H ATOM 3563 H ARG B 81 18.087 3.999 -1.713 1.00 0.00 H ATOM 3564 N VAL B 82 18.388 6.712 1.294 1.00 14.75 N ATOM 3565 CA VAL B 82 17.334 7.348 2.079 1.00 14.94 C ATOM 3566 C VAL B 82 17.783 8.731 2.506 1.00 15.90 C ATOM 3567 O VAL B 82 18.870 8.921 3.067 1.00 16.80 O ATOM 3568 CB VAL B 82 17.016 6.495 3.347 1.00 15.29 C ATOM 3569 CG1 VAL B 82 16.003 7.247 4.209 1.00 15.71 C ATOM 3570 CG2 VAL B 82 16.498 5.083 2.937 1.00 16.02 C ATOM 3571 H VAL B 82 19.357 6.676 1.669 1.00 0.00 H ATOM 3572 N ASN B 83 16.947 9.742 2.278 1.00 16.48 N ATOM 3573 CA ASN B 83 17.242 11.038 2.837 1.00 17.74 C ATOM 3574 C ASN B 83 16.066 11.459 3.698 1.00 16.37 C ATOM 3575 O ASN B 83 14.905 11.153 3.387 1.00 16.63 O ATOM 3576 CB ASN B 83 17.554 12.079 1.770 1.00 21.40 C ATOM 3577 CG ASN B 83 18.390 13.233 2.319 1.00 25.82 C ATOM 3578 OD1 ASN B 83 18.880 13.208 3.477 1.00 27.01 O ATOM 3579 ND2 ASN B 83 18.593 14.242 1.480 1.00 28.29 N ATOM 3580 HD22 ASN B 83 18.169 14.222 0.531 1.00 0.00 H ATOM 3581 HD21 ASN B 83 19.176 15.052 1.772 1.00 0.00 H ATOM 3582 H ASN B 83 16.092 9.599 1.704 1.00 0.00 H ATOM 3583 N HIS B 84 16.388 12.162 4.780 1.00 15.78 N ATOM 3584 CA HIS B 84 15.397 12.532 5.776 1.00 16.95 C ATOM 3585 C HIS B 84 15.983 13.717 6.507 1.00 18.47 C ATOM 3586 O HIS B 84 17.217 13.880 6.581 1.00 19.23 O ATOM 3587 CB HIS B 84 15.147 11.381 6.753 1.00 15.82 C ATOM 3588 CG HIS B 84 14.011 11.621 7.707 1.00 14.62 C ATOM 3589 ND1 HIS B 84 14.205 11.932 9.034 1.00 15.26 N ATOM 3590 CD2 HIS B 84 12.659 11.558 7.524 1.00 14.66 C ATOM 3591 CE1 HIS B 84 13.021 12.084 9.623 1.00 14.50 C ATOM 3592 NE2 HIS B 84 12.069 11.840 8.734 1.00 14.39 N ATOM 3593 H HIS B 84 17.376 12.455 4.917 1.00 0.00 H ATOM 3594 N VAL B 85 15.109 14.570 7.029 1.00 19.46 N ATOM 3595 CA VAL B 85 15.575 15.761 7.707 1.00 21.25 C ATOM 3596 C VAL B 85 16.539 15.455 8.860 1.00 23.08 C ATOM 3597 O VAL B 85 17.383 16.306 9.231 1.00 24.22 O ATOM 3598 CB VAL B 85 14.385 16.618 8.210 1.00 21.85 C ATOM 3599 CG1 VAL B 85 13.578 15.904 9.254 1.00 22.08 C ATOM 3600 CG2 VAL B 85 14.881 17.940 8.753 1.00 23.26 C ATOM 3601 H VAL B 85 14.089 14.382 6.951 1.00 0.00 H ATOM 3602 N THR B 86 16.421 14.266 9.439 1.00 23.30 N ATOM 3603 CA THR B 86 17.277 13.901 10.563 1.00 24.11 C ATOM 3604 C THR B 86 18.666 13.468 10.130 1.00 25.62 C ATOM 3605 O THR B 86 19.525 13.223 10.982 1.00 27.20 O ATOM 3606 CB THR B 86 16.631 12.785 11.407 1.00 23.92 C ATOM 3607 OG1 THR B 86 16.431 11.615 10.577 1.00 23.63 O ATOM 3608 CG2 THR B 86 15.305 13.260 11.941 1.00 24.59 C ATOM 3609 HG1 THR B 86 15.836 11.846 9.820 1.00 0.00 H ATOM 3610 H THR B 86 15.713 13.590 9.089 1.00 0.00 H ATOM 3611 N LEU B 87 18.909 13.381 8.826 1.00 26.28 N ATOM 3612 CA LEU B 87 20.213 12.945 8.324 1.00 26.94 C ATOM 3613 C LEU B 87 21.011 14.048 7.633 1.00 29.12 C ATOM 3614 O LEU B 87 20.480 14.780 6.809 1.00 30.21 O ATOM 3615 CB LEU B 87 20.028 11.776 7.338 1.00 26.53 C ATOM 3616 CG LEU B 87 19.173 10.573 7.740 1.00 26.67 C ATOM 3617 CD1 LEU B 87 18.984 9.642 6.529 1.00 26.32 C ATOM 3618 CD2 LEU B 87 19.741 9.815 8.909 1.00 27.90 C ATOM 3619 H LEU B 87 18.158 13.627 8.150 1.00 0.00 H ATOM 3620 N SER B 88 22.309 14.119 7.922 1.00 30.43 N ATOM 3621 CA SER B 88 23.177 15.136 7.307 1.00 32.19 C ATOM 3622 C SER B 88 23.389 14.948 5.822 1.00 32.16 C ATOM 3623 O SER B 88 23.598 15.911 5.101 1.00 32.94 O ATOM 3624 CB SER B 88 24.534 15.187 7.999 1.00 34.09 C ATOM 3625 OG SER B 88 24.359 15.619 9.328 1.00 36.05 O ATOM 3626 HG SER B 88 25.239 15.653 9.781 1.00 0.00 H ATOM 3627 H SER B 88 22.718 13.441 8.597 1.00 0.00 H ATOM 3628 N GLN B 89 23.404 13.700 5.371 1.00 31.71 N ATOM 3629 CA GLN B 89 23.373 13.409 3.941 1.00 31.18 C ATOM 3630 C GLN B 89 22.730 12.053 3.797 1.00 29.14 C ATOM 3631 O GLN B 89 22.512 11.352 4.793 1.00 28.56 O ATOM 3632 CB GLN B 89 24.749 13.375 3.270 1.00 33.55 C ATOM 3633 CG GLN B 89 25.661 12.290 3.757 1.00 35.08 C ATOM 3634 CD GLN B 89 26.211 12.651 5.088 1.00 36.84 C ATOM 3635 OE1 GLN B 89 26.825 13.711 5.239 1.00 37.65 O ATOM 3636 NE2 GLN B 89 25.962 11.812 6.084 1.00 37.75 N ATOM 3637 HE22 GLN B 89 25.440 10.931 5.903 1.00 0.00 H ATOM 3638 HE21 GLN B 89 26.289 12.035 7.046 1.00 0.00 H ATOM 3639 H GLN B 89 23.439 12.913 6.050 1.00 0.00 H ATOM 3640 N PRO B 90 22.360 11.710 2.574 1.00 28.82 N ATOM 3641 CA PRO B 90 21.653 10.451 2.339 1.00 28.16 C ATOM 3642 C PRO B 90 22.380 9.216 2.910 1.00 27.04 C ATOM 3643 O PRO B 90 23.597 9.083 2.809 1.00 27.29 O ATOM 3644 CB PRO B 90 21.574 10.391 0.817 1.00 28.66 C ATOM 3645 CG PRO B 90 21.597 11.857 0.388 1.00 29.73 C ATOM 3646 CD PRO B 90 22.515 12.517 1.347 1.00 29.24 C ATOM 3647 N LYS B 91 21.614 8.352 3.554 1.00 24.64 N ATOM 3648 CA LYS B 91 22.117 7.067 4.049 1.00 24.85 C ATOM 3649 C LYS B 91 21.950 6.024 2.954 1.00 23.53 C ATOM 3650 O LYS B 91 20.856 5.880 2.382 1.00 23.95 O ATOM 3651 CB LYS B 91 21.296 6.650 5.268 1.00 28.41 C ATOM 3652 CG LYS B 91 21.798 5.402 5.986 1.00 31.85 C ATOM 3653 CD LYS B 91 21.165 5.315 7.378 1.00 34.59 C ATOM 3654 CE LYS B 91 21.679 6.416 8.304 1.00 36.59 C ATOM 3655 NZ LYS B 91 21.248 6.207 9.719 1.00 37.22 N ATOM 3656 HZ1 LYS B 91 20.209 6.202 9.767 1.00 0.00 H ATOM 3657 HZ2 LYS B 91 21.616 5.297 10.061 1.00 0.00 H ATOM 3658 HZ3 LYS B 91 21.619 6.977 10.311 1.00 0.00 H ATOM 3659 H LYS B 91 20.615 8.593 3.716 1.00 0.00 H ATOM 3660 N ILE B 92 23.026 5.308 2.649 1.00 22.46 N ATOM 3661 CA ILE B 92 22.921 4.296 1.605 1.00 22.15 C ATOM 3662 C ILE B 92 23.336 2.941 2.145 1.00 21.24 C ATOM 3663 O ILE B 92 24.442 2.791 2.668 1.00 22.25 O ATOM 3664 CB ILE B 92 23.727 4.665 0.353 1.00 23.50 C ATOM 3665 CG1 ILE B 92 23.399 6.097 -0.073 1.00 24.78 C ATOM 3666 CG2 ILE B 92 23.451 3.671 -0.737 1.00 23.75 C ATOM 3667 CD1 ILE B 92 24.039 6.519 -1.384 1.00 26.13 C ATOM 3668 H ILE B 92 23.926 5.466 3.145 1.00 0.00 H ATOM 3669 N VAL B 93 22.419 1.977 2.032 1.00 19.86 N ATOM 3670 CA VAL B 93 22.632 0.621 2.543 1.00 18.50 C ATOM 3671 C VAL B 93 22.647 -0.370 1.430 1.00 17.01 C ATOM 3672 O VAL B 93 21.678 -0.465 0.675 1.00 15.41 O ATOM 3673 CB VAL B 93 21.565 0.270 3.564 1.00 19.88 C ATOM 3674 CG1 VAL B 93 21.802 -1.094 4.080 1.00 21.77 C ATOM 3675 CG2 VAL B 93 21.591 1.344 4.716 1.00 20.65 C ATOM 3676 H VAL B 93 21.518 2.198 1.562 1.00 0.00 H ATOM 3677 N LYS B 94 23.758 -1.097 1.317 1.00 17.54 N ATOM 3678 CA LYS B 94 23.915 -2.093 0.279 1.00 16.86 C ATOM 3679 C LYS B 94 22.970 -3.287 0.518 1.00 16.78 C ATOM 3680 O LYS B 94 22.750 -3.700 1.656 1.00 18.71 O ATOM 3681 CB LYS B 94 25.363 -2.575 0.223 1.00 18.27 C ATOM 3682 CG LYS B 94 25.616 -3.568 -0.940 1.00 20.79 C ATOM 3683 CD LYS B 94 27.066 -3.926 -1.026 1.00 23.86 C ATOM 3684 CE LYS B 94 27.296 -4.781 -2.270 1.00 27.73 C ATOM 3685 NZ LYS B 94 28.660 -5.399 -2.235 1.00 30.32 N ATOM 3686 HZ1 LYS B 94 29.379 -4.648 -2.202 1.00 0.00 H ATOM 3687 HZ2 LYS B 94 28.746 -6.000 -1.390 1.00 0.00 H ATOM 3688 HZ3 LYS B 94 28.799 -5.977 -3.088 1.00 0.00 H ATOM 3689 H LYS B 94 24.533 -0.944 1.993 1.00 0.00 H ATOM 3690 N TRP B 95 22.391 -3.801 -0.563 1.00 15.06 N ATOM 3691 CA TRP B 95 21.702 -5.086 -0.497 1.00 14.39 C ATOM 3692 C TRP B 95 22.687 -6.253 -0.356 1.00 15.89 C ATOM 3693 O TRP B 95 23.474 -6.545 -1.251 1.00 16.50 O ATOM 3694 CB TRP B 95 20.866 -5.300 -1.762 1.00 13.38 C ATOM 3695 CG TRP B 95 20.148 -6.662 -1.754 1.00 14.38 C ATOM 3696 CD1 TRP B 95 19.395 -7.190 -0.745 1.00 15.01 C ATOM 3697 CD2 TRP B 95 20.133 -7.611 -2.812 1.00 15.29 C ATOM 3698 NE1 TRP B 95 18.929 -8.438 -1.109 1.00 15.79 N ATOM 3699 CE2 TRP B 95 19.372 -8.714 -2.372 1.00 15.45 C ATOM 3700 CE3 TRP B 95 20.710 -7.647 -4.083 1.00 17.06 C ATOM 3701 CZ2 TRP B 95 19.156 -9.843 -3.158 1.00 16.06 C ATOM 3702 CZ3 TRP B 95 20.517 -8.753 -4.861 1.00 17.19 C ATOM 3703 CH2 TRP B 95 19.742 -9.852 -4.391 1.00 16.37 C ATOM 3704 HE1 TRP B 95 18.340 -9.062 -0.521 1.00 0.00 H ATOM 3705 H TRP B 95 22.429 -3.283 -1.464 1.00 0.00 H ATOM 3706 N ASP B 96 22.641 -6.901 0.796 1.00 17.19 N ATOM 3707 CA ASP B 96 23.450 -8.081 1.021 1.00 19.36 C ATOM 3708 C ASP B 96 22.492 -9.263 0.857 1.00 21.65 C ATOM 3709 O ASP B 96 21.506 -9.401 1.593 1.00 21.55 O ATOM 3710 CB ASP B 96 24.091 -8.026 2.428 1.00 19.34 C ATOM 3711 CG ASP B 96 24.935 -6.722 2.684 1.00 20.11 C ATOM 3712 OD1 ASP B 96 25.658 -6.209 1.797 1.00 19.95 O ATOM 3713 OD2 ASP B 96 24.906 -6.206 3.816 1.00 21.25 O ATOM 3714 H ASP B 96 22.014 -6.558 1.552 1.00 0.00 H ATOM 3715 N ARG B 97 22.758 -10.102 -0.136 1.00 23.67 N ATOM 3716 CA ARG B 97 21.874 -11.201 -0.480 1.00 27.49 C ATOM 3717 C ARG B 97 21.482 -12.164 0.677 1.00 28.09 C ATOM 3718 O ARG B 97 20.382 -12.701 0.667 1.00 29.77 O ATOM 3719 CB ARG B 97 22.432 -11.904 -1.738 1.00 30.35 C ATOM 3720 CG ARG B 97 22.697 -10.853 -2.842 1.00 32.39 C ATOM 3721 CD ARG B 97 23.452 -11.342 -4.083 1.00 34.09 C ATOM 3722 NE ARG B 97 23.084 -12.684 -4.501 1.00 35.24 N ATOM 3723 CZ ARG B 97 22.780 -12.977 -5.759 1.00 35.40 C ATOM 3724 NH1 ARG B 97 22.804 -12.001 -6.673 1.00 34.57 N ATOM 3725 NH2 ARG B 97 22.429 -14.215 -6.090 1.00 35.69 N ATOM 3726 HE ARG B 97 23.058 -13.442 -3.789 1.00 0.00 H ATOM 3727 HH12 ARG B 97 22.569 -12.211 -7.664 1.00 0.00 H ATOM 3728 HH11 ARG B 97 23.058 -11.032 -6.393 1.00 0.00 H ATOM 3729 HH22 ARG B 97 22.191 -14.442 -7.077 1.00 0.00 H ATOM 3730 HH21 ARG B 97 22.392 -14.957 -5.362 1.00 0.00 H ATOM 3731 H ARG B 97 23.630 -9.968 -0.687 1.00 0.00 H ATOM 3732 N ASP B 98 22.327 -12.321 1.697 1.00 27.14 N ATOM 3733 CA ASP B 98 22.007 -13.242 2.814 1.00 31.19 C ATOM 3734 C ASP B 98 21.074 -12.662 3.901 1.00 45.28 C ATOM 3735 O ASP B 98 20.827 -13.402 4.876 1.00 35.09 O ATOM 3736 CB ASP B 98 23.279 -13.770 3.539 1.00 29.95 C ATOM 3737 CG ASP B 98 24.241 -14.523 2.642 1.00 56.96 C ATOM 3738 OD1 ASP B 98 23.805 -15.300 1.732 1.00 38.97 O ATOM 3739 OD2 ASP B 98 25.492 -14.367 2.896 1.00 54.06 O ATOM 3740 H ASP B 98 23.222 -11.791 1.709 1.00 0.00 H TER 3741 ASP B 98 HETATM 3742 O HOH 1 29.238 -22.873 28.278 1.00 28.41 O HETATM 3743 O HOH 2 -20.167 14.140 5.743 1.00 35.45 O HETATM 3744 O HOH 3 0.098 21.937 -0.171 1.00 36.78 O HETATM 3745 O HOH 4 -21.872 -2.237 0.229 1.00 40.59 O HETATM 3746 O HOH 5 37.315 -16.768 17.427 1.00 28.32 O HETATM 3747 O HOH 6 -11.189 -15.220 13.967 1.00 21.91 O HETATM 3748 O HOH 7 -8.639 21.390 -1.813 1.00 45.43 O HETATM 3749 O HOH 8 7.244 -21.262 -0.146 1.00 30.84 O HETATM 3750 O HOH 9 7.346 20.043 19.537 1.00 49.35 O HETATM 3751 O HOH 10 27.141 -13.447 11.506 1.00 32.95 O HETATM 3752 O HOH 11 -2.657 17.440 -0.872 1.00 30.65 O HETATM 3753 O HOH 12 -8.160 18.860 3.021 1.00 25.14 O HETATM 3754 O HOH 13 2.814 -17.675 1.179 1.00 29.54 O HETATM 3755 O HOH 14 -6.593 -10.766 9.674 1.00 17.77 O HETATM 3756 O HOH 15 -10.363 9.837 34.149 1.00 37.77 O HETATM 3757 O HOH 16 -10.966 -19.324 9.224 1.00 31.52 O HETATM 3758 O HOH 17 -9.855 14.202 34.307 1.00 37.20 O HETATM 3759 O HOH 18 -4.288 25.503 24.719 1.00 26.41 O HETATM 3760 O HOH 19 -8.723 16.863 -1.091 1.00 41.64 O HETATM 3761 O HOH 20 -0.084 -21.383 19.021 1.00 40.95 O HETATM 3762 O HOH 21 18.483 -24.525 4.808 1.00 37.47 O HETATM 3763 O HOH 22 2.663 6.974 24.814 1.00 44.70 O HETATM 3764 O HOH 23 35.717 -24.161 15.955 1.00 26.99 O HETATM 3765 O HOH 24 34.252 -27.722 17.532 1.00 30.23 O HETATM 3766 O HOH 25 5.841 -14.561 0.831 1.00 21.51 O HETATM 3767 O HOH 26 -6.955 -9.921 2.795 1.00 15.81 O HETATM 3768 O HOH 27 22.094 -26.342 33.519 1.00 29.03 O HETATM 3769 O HOH 28 30.338 -16.392 4.931 1.00 35.20 O HETATM 3770 O HOH 29 5.312 20.964 18.348 1.00 22.92 O HETATM 3771 O HOH 30 8.210 28.543 5.795 1.00 30.25 O HETATM 3772 O HOH 31 -16.961 15.679 2.734 1.00 16.49 O HETATM 3773 O HOH 32 -16.547 16.934 -1.853 1.00 41.32 O HETATM 3774 O HOH 33 -4.539 -10.381 4.253 1.00 17.67 O HETATM 3775 O HOH 34 0.379 27.126 3.193 1.00 21.01 O HETATM 3776 O HOH 35 -17.334 -14.635 2.614 1.00 35.31 O HETATM 3777 O HOH 36 -3.376 29.279 13.825 1.00 36.78 O HETATM 3778 O HOH 37 -2.007 -24.402 20.782 1.00 37.18 O HETATM 3779 O HOH 38 26.099 -28.962 27.748 1.00 15.35 O HETATM 3780 O HOH 39 -8.855 27.337 15.268 1.00 40.95 O HETATM 3781 O HOH 40 -5.545 -14.544 10.393 1.00 39.12 O HETATM 3782 O HOH 41 -20.695 -9.948 5.576 1.00 29.30 O HETATM 3783 O HOH 42 22.282 -21.793 27.141 1.00 23.03 O HETATM 3784 O HOH 43 -22.595 -0.436 1.626 1.00 27.57 O HETATM 3785 O HOH 44 5.277 -24.033 9.412 1.00 23.01 O HETATM 3786 O HOH 45 -6.981 27.156 27.397 1.00 25.44 O HETATM 3787 O HOH 46 11.572 -20.729 5.013 1.00 17.75 O HETATM 3788 O HOH 47 -8.137 15.575 -8.891 1.00 13.48 O HETATM 3789 O HOH 48 -6.055 15.893 32.484 1.00 26.50 O HETATM 3790 O HOH 49 -16.609 -2.196 -5.164 1.00 33.98 O HETATM 3791 O HOH 50 2.945 -19.429 5.084 1.00 20.50 O HETATM 3792 O HOH 51 -13.457 14.302 11.775 1.00 31.10 O HETATM 3793 O HOH 52 3.005 7.196 22.570 1.00 37.04 O HETATM 3794 O HOH 53 -11.745 16.660 -3.931 1.00 21.14 O HETATM 3795 O HOH 54 -8.475 21.529 4.066 1.00 31.12 O HETATM 3796 O HOH 55 -14.746 8.193 33.372 1.00 40.45 O HETATM 3797 O HOH 56 10.976 -26.313 9.823 1.00 26.40 O HETATM 3798 O HOH 57 13.428 -26.211 7.432 1.00 18.97 O HETATM 3799 O HOH 58 -25.898 2.216 -4.391 1.00 23.36 O HETATM 3800 O HOH 59 -14.216 12.972 -4.916 1.00 21.78 O HETATM 3801 O HOH 60 26.696 -17.642 20.408 1.00 33.16 O HETATM 3802 O HOH 61 5.972 30.711 -0.560 1.00 25.91 O HETATM 3803 O HOH 62 -9.388 -15.571 15.349 1.00 35.38 O HETATM 3804 O HOH 63 28.128 -19.432 20.798 1.00 25.07 O HETATM 3805 O HOH 64 -18.105 -9.850 25.534 1.00 26.57 O HETATM 3806 O HOH 65 -10.042 22.413 1.166 1.00 32.47 O HETATM 3807 O HOH 66 -23.380 6.428 0.740 1.00 32.48 O HETATM 3808 O HOH 67 32.025 -30.792 24.656 1.00 31.87 O HETATM 3809 O HOH 68 1.331 -17.132 2.963 1.00 29.78 O HETATM 3810 O HOH 69 -23.208 -14.240 8.730 1.00 44.00 O HETATM 3811 O HOH 70 -25.371 -1.515 -4.084 1.00 23.20 O HETATM 3812 O HOH 71 4.155 -13.655 -3.417 1.00 20.35 O HETATM 3813 O HOH 72 -5.666 19.124 4.095 1.00 28.17 O HETATM 3814 O HOH 73 -23.186 -14.247 26.168 1.00 34.39 O HETATM 3815 O HOH 74 38.764 -17.321 13.636 1.00 40.10 O HETATM 3816 O HOH 75 3.311 21.398 25.893 1.00 25.45 O HETATM 3817 O HOH 76 3.012 17.794 20.784 1.00 22.58 O HETATM 3818 O HOH 77 6.414 10.364 21.125 1.00 27.24 O HETATM 3819 O HOH 78 -9.087 -6.701 -7.116 1.00 39.95 O HETATM 3820 O HOH 79 -9.710 -13.583 22.640 1.00 28.86 O HETATM 3821 O HOH 80 -14.732 18.815 -1.170 1.00 37.20 O HETATM 3822 O HOH 81 -20.472 -9.189 -0.015 1.00 28.10 O HETATM 3823 O HOH 82 -11.535 24.733 26.257 1.00 23.92 O HETATM 3824 O HOH 83 26.539 -19.619 30.312 1.00 30.10 O HETATM 3825 O HOH 84 -4.620 14.036 31.395 1.00 23.56 O HETATM 3826 O HOH 85 -8.590 18.192 33.498 1.00 29.56 O HETATM 3827 O HOH 86 -21.603 -10.442 1.817 1.00 40.79 O HETATM 3828 O HOH 87 -1.799 -20.692 5.149 1.00 29.14 O HETATM 3829 O HOH 88 -12.878 -13.181 16.498 1.00 34.33 O HETATM 3830 O HOH 89 -0.503 -21.994 7.621 1.00 23.53 O HETATM 3831 O HOH 90 -21.690 -11.555 12.053 1.00 31.44 O HETATM 3832 O HOH 91 -2.095 19.671 -0.377 1.00 34.49 O HETATM 3833 O HOH 92 -0.623 -10.323 -2.320 1.00 39.58 O HETATM 3834 O HOH 93 21.216 -27.710 30.025 1.00 44.11 O HETATM 3835 O HOH 94 -7.926 26.714 9.446 1.00 22.00 O HETATM 3836 O HOH 95 -6.099 -20.671 9.002 1.00 29.71 O HETATM 3837 O HOH 96 -15.998 14.456 -3.617 1.00 23.04 O HETATM 3838 O HOH 97 2.941 -22.404 6.105 1.00 27.64 O HETATM 3839 O HOH 98 7.922 -13.926 2.892 1.00 18.34 O HETATM 3840 O HOH 99 -17.867 19.607 2.241 1.00 34.00 O HETATM 3841 O HOH 100 -21.995 -17.247 23.936 1.00 25.43 O HETATM 3842 O HOH 101 -2.458 10.475 22.633 1.00 17.18 O HETATM 3843 O HOH 102 -20.820 -6.297 0.979 1.00 33.68 O HETATM 3844 O HOH 103 22.892 -15.029 26.771 1.00 42.05 O HETATM 3845 O HOH 104 -23.468 -7.103 13.485 1.00 33.42 O HETATM 3846 O HOH 105 3.599 -21.367 18.369 1.00 23.93 O HETATM 3847 O HOH 106 32.195 -31.868 20.089 1.00 44.63 O HETATM 3848 O HOH 107 -13.340 -14.589 14.213 1.00 31.90 O HETATM 3849 O HOH 108 -21.712 6.991 30.835 1.00 38.25 O HETATM 3850 O HOH 109 -10.639 4.165 31.541 1.00 24.31 O HETATM 3851 O HOH 110 -4.808 16.035 -6.746 1.00 34.65 O HETATM 3852 O HOH 111 37.302 -19.675 6.182 1.00 40.16 O HETATM 3853 O HOH 112 7.071 24.590 19.984 1.00 38.46 O HETATM 3854 O HOH 113 28.256 -17.709 3.494 1.00 44.23 O HETATM 3855 O HOH 114 -23.077 19.922 25.140 1.00 43.81 O HETATM 3856 O HOH 115 -20.236 12.363 26.633 1.00 26.53 O HETATM 3857 O HOH 116 2.703 30.377 -2.219 1.00 25.33 O HETATM 3858 O HOH 117 -6.989 -12.644 21.576 1.00 52.99 O HETATM 3859 O HOH 118 -2.550 11.349 25.239 1.00 17.53 O HETATM 3860 O HOH 119 -21.871 -8.081 3.237 1.00 36.43 O HETATM 3861 O HOH 120 -26.797 12.477 28.209 1.00 43.95 O HETATM 3862 O HOH 121 -15.098 -12.199 26.745 1.00 45.45 O HETATM 3863 O HOH 122 -0.731 19.542 -3.609 1.00 32.38 O HETATM 3864 O HOH 123 -3.293 32.546 8.409 1.00 45.42 O HETATM 3865 O HOH 124 -7.402 4.071 30.444 1.00 41.32 O HETATM 3866 O HOH 125 27.158 -10.468 22.877 1.00 40.85 O HETATM 3867 O HOH 126 4.771 8.438 24.620 1.00 30.27 O HETATM 3868 O HOH 127 25.518 -12.541 13.289 1.00 44.10 O HETATM 3869 O HOH 128 -18.577 -0.608 -6.490 1.00 36.73 O HETATM 3870 O HOH 129 -4.419 -7.279 -0.163 1.00 32.50 O HETATM 3871 O HOH 130 -0.227 -7.159 -0.580 1.00 40.65 O HETATM 3872 O HOH 131 -24.894 14.414 27.066 1.00 40.35 O HETATM 3873 O HOH 132 25.869 -16.752 26.217 1.00 28.88 O HETATM 3874 O HOH 133 17.159 -20.254 1.113 1.00 40.72 O HETATM 3875 O HOH 134 -16.716 13.491 28.712 1.00 34.03 O HETATM 3876 O HOH 135 -24.376 17.812 24.348 1.00 45.93 O HETATM 3877 O HOH 136 -24.984 4.655 -4.869 1.00 32.48 O HETATM 3878 O HOH 137 -6.561 28.573 13.276 1.00 39.38 O HETATM 3879 O HOH 138 1.926 -18.572 19.666 1.00 36.16 O HETATM 3880 O HOH 139 -5.845 29.476 15.986 1.00 38.31 O HETATM 3881 O HOH 140 -23.957 8.513 -0.842 1.00 37.94 O HETATM 3882 O HOH 141 -25.149 -2.463 5.034 1.00 42.65 O HETATM 3883 O HOH 142 -2.065 27.308 5.108 1.00 28.85 O HETATM 3884 O HOH 143 23.101 -30.260 8.391 1.00 42.71 O HETATM 3885 O HOH 144 -13.615 -11.087 25.300 1.00 36.93 O HETATM 3886 O HOH 145 21.843 -29.778 29.539 1.00 43.79 O HETATM 3887 O HOH 146 -19.223 16.180 4.206 1.00 31.82 O HETATM 3888 O HOH 147 26.977 -31.615 21.830 1.00 43.80 O HETATM 3889 O HOH 148 8.624 27.324 3.487 1.00 35.07 O HETATM 3890 O HOH 149 -1.185 35.010 5.793 1.00 58.98 O HETATM 3891 O HOH 150 8.666 18.864 14.721 1.00 48.09 O HETATM 3892 O HOH 151 -22.046 2.166 3.000 1.00 20.30 O HETATM 3893 O HOH 152 31.614 -29.942 11.563 1.00 45.79 O HETATM 3894 O HOH 153 -5.693 26.451 7.875 1.00 22.17 O HETATM 3895 O HOH 154 -3.101 14.528 -10.368 1.00 31.45 O HETATM 3896 O HOH 155 -10.599 19.486 -2.280 1.00 31.23 O HETATM 3897 O HOH 156 -25.438 17.019 26.554 1.00 38.72 O HETATM 3898 O HOH 157 -25.325 -9.376 16.928 1.00 42.66 O HETATM 3899 O HOH 158 10.719 30.174 6.931 1.00 46.15 O HETATM 3900 O HOH 159 3.461 -27.092 12.817 1.00 30.54 O HETATM 3901 O HOH 160 -4.101 28.525 9.218 1.00 35.20 O HETATM 3902 O HOH 161 -1.920 13.362 -8.541 1.00 34.77 O HETATM 3903 O HOH 162 21.927 -30.563 26.925 1.00 42.12 O HETATM 3904 O HOH 163 -25.615 -1.892 7.768 1.00 51.15 O HETATM 3905 O HOH 164 -5.135 10.359 -13.099 1.00 40.31 O HETATM 3906 O HOH 165 -7.059 8.580 -2.837 1.00 14.20 O HETATM 3907 O HOH 166 0.329 23.198 13.149 1.00 12.99 O HETATM 3908 O HOH 167 3.722 -7.770 3.077 1.00 12.57 O HETATM 3909 O HOH 168 1.929 13.909 15.000 1.00 13.46 O HETATM 3910 O HOH 169 19.479 -25.995 22.410 1.00 17.62 O HETATM 3911 O HOH 170 6.555 -9.504 14.756 1.00 15.78 O HETATM 3912 O HOH 171 -0.637 23.626 4.765 1.00 15.48 O HETATM 3913 O HOH 172 1.304 -14.859 16.078 1.00 17.57 O HETATM 3914 O HOH 173 -13.453 2.863 4.637 1.00 13.28 O HETATM 3915 O HOH 174 5.871 17.110 12.515 1.00 16.57 O HETATM 3916 O HOH 175 6.047 26.703 13.025 1.00 17.91 O HETATM 3917 O HOH 176 -7.740 5.865 22.609 1.00 18.42 O HETATM 3918 O HOH 177 -7.191 11.152 -3.993 1.00 16.20 O HETATM 3919 O HOH 178 0.272 -9.115 14.465 1.00 18.01 O HETATM 3920 O HOH 179 -20.694 -6.321 20.475 1.00 19.19 O HETATM 3921 O HOH 180 9.891 -6.674 15.186 1.00 22.91 O HETATM 3922 O HOH 181 -4.039 24.258 8.707 1.00 16.71 O HETATM 3923 O HOH 182 -1.365 7.742 7.542 1.00 15.51 O HETATM 3924 O HOH 183 -19.960 4.094 3.335 1.00 15.70 O HETATM 3925 O HOH 184 0.931 24.241 10.717 1.00 17.83 O HETATM 3926 O HOH 185 -0.149 0.271 0.675 1.00 15.66 O HETATM 3927 O HOH 186 10.565 -18.364 20.432 1.00 18.81 O HETATM 3928 O HOH 187 -16.349 14.035 26.113 1.00 19.41 O HETATM 3929 O HOH 188 -16.542 -6.202 2.370 1.00 20.12 O HETATM 3930 O HOH 189 -10.523 16.823 15.992 1.00 22.52 O HETATM 3931 O HOH 190 4.703 -4.736 -2.443 1.00 18.42 O HETATM 3932 O HOH 191 0.295 13.321 5.054 1.00 16.57 O HETATM 3933 O HOH 192 -15.180 -9.381 23.613 1.00 20.18 O HETATM 3934 O HOH 193 -20.372 -11.096 9.553 1.00 20.00 O HETATM 3935 O HOH 194 -21.895 12.809 21.919 1.00 21.00 O HETATM 3936 O HOH 195 6.866 17.937 8.418 1.00 28.44 O HETATM 3937 O HOH 196 15.668 -16.395 2.906 1.00 23.64 O HETATM 3938 O HOH 197 -6.880 -7.885 17.763 1.00 29.99 O HETATM 3939 O HOH 198 16.252 -4.767 12.350 1.00 23.39 O HETATM 3940 O HOH 199 -23.880 1.483 9.447 1.00 24.16 O HETATM 3941 O HOH 200 -17.156 13.300 -1.330 1.00 18.08 O HETATM 3942 O HOH 201 -5.767 -3.278 12.606 1.00 21.95 O HETATM 3943 O HOH 202 16.414 -25.864 7.903 1.00 21.46 O HETATM 3944 O HOH 203 6.471 -5.482 9.667 1.00 23.81 O HETATM 3945 O HOH 204 17.405 -15.724 21.326 1.00 23.02 O HETATM 3946 O HOH 205 -17.337 22.738 24.083 1.00 25.64 O HETATM 3947 O HOH 206 -0.809 -7.785 5.143 1.00 21.71 O HETATM 3948 O HOH 207 -5.598 28.258 18.372 1.00 20.17 O HETATM 3949 O HOH 208 7.646 28.457 15.915 1.00 29.51 O HETATM 3950 O HOH 209 -2.945 9.977 -8.816 1.00 28.48 O HETATM 3951 O HOH 210 -22.329 -6.948 10.709 1.00 22.66 O HETATM 3952 O HOH 211 -18.808 11.237 -2.010 1.00 19.67 O HETATM 3953 O HOH 212 -10.166 -12.664 0.830 1.00 23.63 O HETATM 3954 O HOH 213 -1.482 25.046 9.464 1.00 22.51 O HETATM 3955 O HOH 214 -23.280 1.645 20.093 1.00 25.51 O HETATM 3956 O HOH 215 -12.138 0.173 25.334 1.00 26.39 O HETATM 3957 O HOH 216 -12.489 13.411 30.683 1.00 26.59 O HETATM 3958 O HOH 217 -16.234 11.754 8.792 1.00 21.84 O HETATM 3959 O HOH 218 -19.193 7.767 26.390 1.00 26.28 O HETATM 3960 O HOH 219 3.042 -26.646 15.381 1.00 28.64 O HETATM 3961 O HOH 220 -13.014 4.116 -5.144 1.00 24.66 O HETATM 3962 O HOH 221 -0.581 1.244 4.673 1.00 22.79 O HETATM 3963 O HOH 222 -12.446 10.193 -9.142 1.00 29.52 O HETATM 3964 O HOH 223 -17.723 15.501 0.162 1.00 23.61 O HETATM 3965 O HOH 224 -8.069 15.696 13.283 1.00 25.85 O HETATM 3966 O HOH 225 11.521 -12.535 18.222 1.00 23.17 O HETATM 3967 O HOH 226 21.670 -25.632 15.206 1.00 24.54 O HETATM 3968 O HOH 227 12.239 -7.999 17.268 1.00 29.12 O HETATM 3969 O HOH 228 -1.559 -10.887 15.897 1.00 30.61 O HETATM 3970 O HOH 229 2.919 26.482 10.821 1.00 23.79 O HETATM 3971 O HOH 230 15.654 -2.278 11.776 1.00 22.83 O HETATM 3972 O HOH 231 30.972 -26.159 10.602 1.00 33.56 O HETATM 3973 O HOH 232 10.139 -24.177 20.945 1.00 36.74 O HETATM 3974 O HOH 233 22.706 -23.395 4.526 1.00 28.79 O HETATM 3975 O HOH 234 -13.149 -11.042 -2.522 1.00 28.59 O HETATM 3976 O HOH 235 -21.985 7.808 16.916 1.00 24.67 O HETATM 3977 O HOH 236 -23.218 15.946 22.916 1.00 30.79 O HETATM 3978 O HOH 237 -3.178 -2.458 13.188 1.00 36.28 O HETATM 3979 O HOH 238 -5.610 -8.072 15.490 1.00 30.13 O HETATM 3980 O HOH 239 -1.232 5.571 18.316 1.00 23.74 O HETATM 3981 O HOH 240 -0.804 6.992 -0.561 1.00 39.35 O HETATM 3982 O HOH 241 9.500 22.775 9.233 1.00 29.45 O HETATM 3983 O HOH 242 4.890 -14.113 19.525 1.00 28.20 O HETATM 3984 O HOH 243 -9.071 3.392 24.665 1.00 29.25 O HETATM 3985 O HOH 244 -5.805 8.566 -7.910 1.00 31.51 O HETATM 3986 O HOH 245 -3.631 -5.136 1.531 1.00 30.99 O HETATM 3987 O HOH 246 -1.837 27.687 10.365 1.00 27.15 O HETATM 3988 O HOH 247 -11.654 26.500 24.234 1.00 32.78 O HETATM 3989 O HOH 248 -18.705 -6.995 24.677 1.00 32.20 O HETATM 3990 O HOH 249 -1.597 -5.098 3.865 1.00 25.66 O HETATM 3991 O HOH 250 -5.151 -13.308 14.083 1.00 38.14 O HETATM 3992 O HOH 251 -13.887 1.415 -5.848 1.00 26.90 O HETATM 3993 O HOH 252 -10.148 26.189 21.688 1.00 38.31 O HETATM 3994 O HOH 253 -21.723 5.832 4.342 1.00 30.93 O HETATM 3995 O HOH 254 4.024 11.563 2.623 1.00 28.44 O HETATM 3996 O HOH 255 -0.990 -13.475 16.445 1.00 30.92 O HETATM 3997 O HOH 256 20.818 -16.691 5.468 1.00 31.77 O HETATM 3998 O HOH 257 7.584 18.717 10.823 1.00 26.56 O HETATM 3999 O HOH 258 33.871 -23.125 9.726 1.00 35.60 O HETATM 4000 O HOH 259 -9.427 5.453 -7.909 1.00 46.97 O HETATM 4001 O HOH 260 5.463 -6.904 14.359 1.00 25.95 O HETATM 4002 O HOH 261 -23.216 2.634 16.322 1.00 38.27 O HETATM 4003 O HOH 262 -6.851 -8.767 22.140 1.00 31.27 O HETATM 4004 O HOH 263 -8.324 28.275 18.516 1.00 31.53 O HETATM 4005 O HOH 264 9.428 -28.760 15.937 1.00 30.23 O HETATM 4006 O HOH 265 -24.106 4.196 10.365 1.00 40.82 O HETATM 4007 O HOH 266 1.887 -5.823 1.201 1.00 30.67 O HETATM 4008 O HOH 267 4.270 33.646 11.888 1.00 37.52 O HETATM 4009 O HOH 268 2.412 -15.519 18.511 1.00 24.35 O HETATM 4010 O HOH 269 17.789 -18.199 2.784 1.00 31.19 O HETATM 4011 O HOH 270 8.221 -4.427 12.751 1.00 32.36 O HETATM 4012 O HOH 271 -3.361 -0.273 16.462 1.00 36.44 O HETATM 4013 O HOH 272 -16.196 24.712 25.306 1.00 29.39 O HETATM 4014 O HOH 273 -1.778 -21.844 10.255 1.00 28.90 O HETATM 4015 O HOH 274 -17.816 23.071 21.335 1.00 43.26 O HETATM 4016 O HOH 275 0.624 -25.011 11.514 1.00 32.58 O HETATM 4017 O HOH 276 15.307 -28.678 12.168 1.00 37.27 O HETATM 4018 O HOH 277 -18.622 -12.539 0.522 1.00 39.25 O HETATM 4019 O HOH 278 -18.963 4.829 -6.270 1.00 36.83 O HETATM 4020 O HOH 279 -6.249 5.741 26.290 1.00 35.37 O HETATM 4021 O HOH 280 -24.032 7.233 -3.284 1.00 31.17 O HETATM 4022 O HOH 281 -24.169 11.891 21.579 1.00 37.62 O HETATM 4023 O HOH 282 0.659 30.994 16.872 1.00 31.16 O HETATM 4024 O HOH 283 -12.991 -14.165 1.393 1.00 32.69 O HETATM 4025 O HOH 284 13.289 -20.107 23.683 1.00 31.71 O HETATM 4026 O HOH 285 -7.880 -2.019 -7.260 1.00 45.33 O HETATM 4027 O HOH 286 -14.554 -5.774 26.686 1.00 41.59 O HETATM 4028 O HOH 287 -19.225 11.185 15.601 1.00 39.94 O HETATM 4029 O HOH 288 -4.023 -10.675 14.772 1.00 37.58 O HETATM 4030 O HOH 289 -7.371 -13.572 15.685 1.00 29.90 O HETATM 4031 O HOH 290 23.657 -11.866 11.622 1.00 41.06 O HETATM 4032 O HOH 291 2.501 -5.515 4.030 1.00 25.07 O HETATM 4033 O HOH 292 -0.438 2.837 -5.279 1.00 40.30 O HETATM 4034 O HOH 293 -22.241 -8.858 9.047 1.00 39.09 O HETATM 4035 O HOH 294 9.251 -22.078 22.074 1.00 41.30 O HETATM 4036 O HOH 295 -20.005 9.874 27.868 1.00 33.28 O HETATM 4037 O HOH 296 -21.119 -3.435 21.645 1.00 38.70 O HETATM 4038 O HOH 297 -18.693 10.945 -4.433 1.00 36.33 O HETATM 4039 O HOH 298 2.503 -7.168 15.620 1.00 35.48 O HETATM 4040 O HOH 299 -22.849 2.555 22.931 1.00 37.88 O HETATM 4041 O HOH 300 31.865 -24.134 8.942 1.00 32.96 O HETATM 4042 O HOH 301 -4.952 6.997 28.126 1.00 39.62 O HETATM 4043 O HOH 302 -12.503 -2.244 26.702 1.00 29.07 O HETATM 4044 O HOH 303 -5.272 -11.898 12.380 1.00 35.55 O HETATM 4045 O HOH 304 -13.482 -8.560 -5.066 1.00 31.24 O HETATM 4046 O HOH 305 -7.279 0.935 -5.773 1.00 36.22 O HETATM 4047 O HOH 306 9.080 -26.930 20.031 1.00 41.53 O HETATM 4048 O HOH 307 -14.420 10.926 14.124 1.00 42.31 O HETATM 4049 O HOH 308 11.652 -24.186 24.788 1.00 42.69 O HETATM 4050 O HOH 309 -4.605 0.204 -5.776 1.00 38.76 O HETATM 4051 O HOH 310 -22.544 5.952 23.621 1.00 35.49 O HETATM 4052 O HOH 311 -14.153 -1.139 -5.422 1.00 36.10 O HETATM 4053 O HOH 312 -9.013 2.224 -7.273 1.00 35.06 O HETATM 4054 O HOH 313 -14.425 26.473 23.260 1.00 43.44 O HETATM 4055 O HOH 314 -20.155 23.152 24.747 1.00 37.59 O HETATM 4056 O HOH 315 15.674 -27.399 27.923 1.00 45.00 O HETATM 4057 O HOH 316 -24.332 8.492 18.246 1.00 40.98 O HETATM 4058 O HOH 317 -1.961 7.888 22.478 1.00 29.74 O HETATM 4059 O HOH 318 -22.236 5.508 15.119 1.00 36.06 O HETATM 4060 O HOH 319 14.436 -26.417 24.466 1.00 39.29 O HETATM 4061 O HOH 320 11.246 -21.791 23.995 1.00 42.67 O HETATM 4062 O HOH 321 -11.560 5.690 -7.419 1.00 46.90 O HETATM 4063 O HOH 322 -9.436 22.767 16.100 1.00 18.23 O HETATM 4064 O HOH 323 -16.273 11.143 -5.623 1.00 36.07 O HETATM 4065 O HOH 324 -20.866 14.843 -0.640 1.00 39.07 O HETATM 4066 O HOH 325 -8.627 0.223 24.979 1.00 38.91 O HETATM 4067 O HOH 326 -2.076 7.069 -6.338 1.00 43.69 O HETATM 4068 O HOH 327 8.823 -10.120 16.750 1.00 32.95 O HETATM 4069 O HOH 328 14.882 -6.677 17.494 1.00 40.37 O HETATM 4070 O HOH 329 -15.368 -8.218 26.654 1.00 50.60 O HETATM 4071 O HOH 330 6.639 -28.615 17.432 1.00 35.95 O HETATM 4072 O HOH 331 -21.268 -6.949 23.757 1.00 33.11 O HETATM 4073 O HOH 332 8.436 22.165 12.327 1.00 39.19 O HETATM 4074 O HOH 333 8.140 20.991 15.361 1.00 43.61 O HETATM 4075 O HOH 334 -1.826 31.192 15.632 1.00 37.42 O HETATM 4076 O HOH 335 19.234 -8.385 18.461 1.00 40.55 O HETATM 4077 O HOH 336 5.357 19.880 4.272 1.00 37.68 O HETATM 4078 O HOH 337 -17.836 1.922 -7.158 1.00 45.27 O HETATM 4079 O HOH 338 19.783 -28.747 22.476 1.00 41.97 O HETATM 4080 O HOH 339 12.130 -27.885 22.064 1.00 40.07 O HETATM 4081 O HOH 340 -24.180 13.776 24.129 1.00 43.97 O HETATM 4082 O HOH 341 -5.676 17.552 6.338 1.00 12.70 O HETATM 4083 O HOH 342 -0.918 31.504 20.459 1.00 44.55 O HETATM 4084 O HOH 343 -20.417 -3.218 24.431 1.00 46.43 O HETATM 4085 O HOH 344 4.955 -5.728 11.728 1.00 40.15 O HETATM 4086 O HOH 345 -5.555 -4.476 19.770 1.00 51.39 O HETATM 4087 O HOH 346 1.363 -13.758 21.046 1.00 46.38 O HETATM 4088 O HOH 347 -1.670 24.853 6.851 1.00 40.70 O HETATM 4089 O HOH 348 28.769 -30.710 20.288 1.00 40.78 O HETATM 4090 O HOH 349 -9.196 -16.019 13.039 1.00 43.42 O HETATM 4091 O HOH 350 0.561 -1.951 3.226 1.00 46.00 O HETATM 4092 O HOH 351 0.064 -3.715 10.773 1.00 24.12 O HETATM 4093 O HOH 352 10.993 -1.973 11.864 1.00 28.84 O HETATM 4094 O HOH 353 25.029 -12.815 16.016 1.00 37.05 O HETATM 4095 O HOH 354 14.948 -22.358 27.832 1.00 47.40 O HETATM 4096 O HOH 355 -22.625 -3.745 8.615 1.00 42.40 O HETATM 4097 O HOH 356 16.227 -26.992 22.835 1.00 37.16 O HETATM 4098 O HOH 357 31.497 -25.105 6.357 1.00 46.09 O HETATM 4099 O HOH 358 -21.503 -4.223 18.966 1.00 36.25 O HETATM 4100 O HOH 359 26.778 -25.994 5.492 1.00 43.04 O HETATM 4101 O HOH 360 -3.974 -6.042 15.220 1.00 45.33 O HETATM 4102 O HOH 361 -19.095 -2.415 26.255 1.00 49.11 O HETATM 4103 O HOH 362 8.773 24.537 13.968 1.00 39.87 O HETATM 4104 O HOH 363 -22.095 21.853 23.408 1.00 42.18 O HETATM 4105 O HOH 364 24.825 -31.437 21.142 1.00 53.01 O HETATM 4106 O HOH 365 7.652 -22.887 24.248 1.00 51.72 O HETATM 4107 O HOH 366 3.696 16.136 0.622 1.00 35.90 O HETATM 4108 O HOH 367 -24.976 0.592 15.759 1.00 52.71 O HETATM 4109 O HOH 368 -17.161 1.040 27.184 1.00 47.06 O HETATM 4110 O HOH 369 -7.319 7.399 -10.549 1.00 47.16 O HETATM 4111 O HOH 370 -15.875 -16.468 0.876 1.00 53.71 O HETATM 4112 O HOH 371 3.367 -3.175 -0.218 1.00 20.49 O HETATM 4113 O HOH 372 1.016 -2.201 1.034 1.00 36.50 O HETATM 4114 O HOH 373 18.263 -9.775 5.732 1.00 22.38 O HETATM 4115 O HOH 374 -4.639 29.854 20.484 1.00 29.28 O HETATM 4116 O HOH 375 22.758 -10.847 6.824 1.00 34.99 O HETATM 4117 O HOH 376 -2.310 -5.315 14.024 1.00 44.48 O HETATM 4118 O HOH 377 7.913 24.901 15.972 1.00 36.91 O HETATM 4119 O HOH 378 -1.422 8.908 -7.390 1.00 44.31 O HETATM 4120 O HOH 379 3.788 17.729 2.814 1.00 47.90 O HETATM 4121 O HOH 380 26.146 -14.657 18.076 1.00 36.26 O HETATM 4122 O HOH 381 12.607 14.274 18.289 1.00 42.38 O HETATM 4123 O HOH 382 31.695 -4.799 -5.848 1.00 39.41 O HETATM 4124 O HOH 383 28.067 -1.651 -9.081 1.00 39.14 O HETATM 4125 O HOH 384 13.883 -12.269 -15.356 1.00 40.89 O HETATM 4126 O HOH 385 18.897 -22.061 -6.406 1.00 24.20 O HETATM 4127 O HOH 386 8.914 6.664 -17.940 1.00 54.54 O HETATM 4128 O HOH 387 23.935 -3.746 3.994 1.00 33.68 O HETATM 4129 O HOH 388 9.202 -10.627 -10.073 1.00 20.42 O HETATM 4130 O HOH 389 11.033 -15.376 0.998 1.00 32.91 O HETATM 4131 O HOH 390 5.994 -12.863 -5.140 1.00 21.55 O HETATM 4132 O HOH 391 14.228 -16.708 -6.351 1.00 18.05 O HETATM 4133 O HOH 392 23.483 9.510 6.629 1.00 43.64 O HETATM 4134 O HOH 393 26.933 3.977 2.238 1.00 35.64 O HETATM 4135 O HOH 394 7.717 -13.620 -12.172 1.00 18.85 O HETATM 4136 O HOH 395 13.220 -15.095 -14.348 1.00 18.96 O HETATM 4137 O HOH 396 15.660 -14.533 -7.342 1.00 14.75 O HETATM 4138 O HOH 397 22.089 -17.791 -7.596 1.00 28.15 O HETATM 4139 O HOH 398 26.406 1.710 4.507 1.00 37.32 O HETATM 4140 O HOH 399 25.907 8.214 4.413 1.00 47.81 O HETATM 4141 O HOH 400 25.021 9.991 0.393 1.00 38.99 O HETATM 4142 O HOH 401 23.732 11.699 8.834 1.00 39.26 O HETATM 4143 O HOH 402 26.069 -0.827 3.154 1.00 22.73 O HETATM 4144 O HOH 403 3.569 -8.870 -6.213 1.00 40.00 O HETATM 4145 O HOH 404 23.885 0.161 -6.126 1.00 22.33 O HETATM 4146 O HOH 405 25.689 5.864 3.986 1.00 42.75 O HETATM 4147 O HOH 406 26.284 -11.267 -14.034 1.00 38.39 O HETATM 4148 O HOH 407 24.178 7.648 -4.560 1.00 48.83 O HETATM 4149 O HOH 408 2.367 -3.672 -7.677 1.00 44.73 O HETATM 4150 O HOH 409 26.894 3.949 5.557 1.00 36.53 O HETATM 4151 O HOH 410 19.700 -13.634 -16.168 1.00 31.77 O HETATM 4152 O HOH 411 28.071 -12.061 -15.096 1.00 44.30 O HETATM 4153 O HOH 412 3.378 1.914 4.775 1.00 15.17 O HETATM 4154 O HOH 413 13.190 -0.563 8.727 1.00 15.67 O HETATM 4155 O HOH 414 24.013 -5.845 -3.753 1.00 19.92 O HETATM 4156 O HOH 415 7.474 2.727 12.809 1.00 18.67 O HETATM 4157 O HOH 416 17.716 -10.356 0.940 1.00 19.31 O HETATM 4158 O HOH 417 19.313 -4.419 5.405 1.00 17.44 O HETATM 4159 O HOH 418 7.452 -5.969 -2.368 1.00 14.30 O HETATM 4160 O HOH 419 14.392 4.625 -6.924 1.00 19.86 O HETATM 4161 O HOH 420 12.382 14.754 6.161 1.00 21.19 O HETATM 4162 O HOH 421 3.760 4.001 -5.437 1.00 23.13 O HETATM 4163 O HOH 422 2.173 7.158 0.982 1.00 21.62 O HETATM 4164 O HOH 423 17.450 -4.660 -12.534 1.00 20.89 O HETATM 4165 O HOH 424 4.972 14.280 9.007 1.00 20.54 O HETATM 4166 O HOH 425 13.288 -2.612 10.416 1.00 19.77 O HETATM 4167 O HOH 426 6.534 15.529 6.947 1.00 22.80 O HETATM 4168 O HOH 427 16.015 -6.834 -13.428 1.00 22.54 O HETATM 4169 O HOH 428 16.996 -0.391 -13.487 1.00 31.26 O HETATM 4170 O HOH 429 18.880 15.229 5.279 1.00 25.26 O HETATM 4171 O HOH 430 1.334 4.419 -2.184 1.00 25.64 O HETATM 4172 O HOH 431 3.839 -3.359 6.572 1.00 27.30 O HETATM 4173 O HOH 432 13.535 -2.804 -11.467 1.00 29.05 O HETATM 4174 O HOH 433 21.101 7.944 -10.616 1.00 31.43 O HETATM 4175 O HOH 434 0.177 0.295 11.705 1.00 33.81 O HETATM 4176 O HOH 435 20.229 -7.755 -11.388 1.00 22.00 O HETATM 4177 O HOH 436 8.060 -1.810 11.701 1.00 28.84 O HETATM 4178 O HOH 437 16.964 8.980 -1.853 1.00 28.92 O HETATM 4179 O HOH 438 16.312 -2.549 -11.781 1.00 29.09 O HETATM 4180 O HOH 439 18.419 -8.525 -14.597 1.00 28.95 O HETATM 4181 O HOH 440 9.307 1.320 14.519 1.00 28.45 O HETATM 4182 O HOH 441 11.844 5.790 -5.383 1.00 31.87 O HETATM 4183 O HOH 442 14.053 -11.995 2.368 1.00 35.45 O HETATM 4184 O HOH 443 7.464 -9.510 -11.610 1.00 30.50 O HETATM 4185 O HOH 444 15.116 2.091 -14.009 1.00 31.39 O HETATM 4186 O HOH 445 20.747 -6.731 -15.030 1.00 26.15 O HETATM 4187 O HOH 446 23.439 -1.339 -14.302 1.00 32.36 O HETATM 4188 O HOH 447 -1.140 4.056 16.278 1.00 37.91 O HETATM 4189 O HOH 448 6.814 8.832 0.847 1.00 28.96 O HETATM 4190 O HOH 449 6.277 10.215 3.314 1.00 26.84 O HETATM 4191 O HOH 450 4.043 -3.080 3.025 1.00 32.95 O HETATM 4192 O HOH 451 1.673 0.903 -3.990 1.00 34.90 O HETATM 4193 O HOH 452 4.345 -5.853 -5.074 1.00 35.04 O HETATM 4194 O HOH 453 3.834 -1.080 4.651 1.00 44.64 O HETATM 4195 O HOH 454 3.195 12.879 4.584 1.00 25.78 O HETATM 4196 O HOH 455 5.933 7.961 20.955 1.00 31.26 O HETATM 4197 O HOH 456 18.515 -4.401 10.545 1.00 36.95 O HETATM 4198 O HOH 457 5.335 -3.399 8.723 1.00 27.38 O HETATM 4199 O HOH 458 1.788 5.550 -4.358 1.00 30.21 O HETATM 4200 O HOH 459 16.271 9.605 16.170 1.00 30.42 O HETATM 4201 O HOH 460 12.255 -8.983 -12.962 1.00 29.62 O HETATM 4202 O HOH 461 4.284 8.883 1.272 1.00 30.63 O HETATM 4203 O HOH 462 18.298 11.283 -1.479 1.00 37.54 O HETATM 4204 O HOH 463 9.320 5.859 -5.701 1.00 38.13 O HETATM 4205 O HOH 464 19.213 -8.672 2.384 1.00 33.17 O HETATM 4206 O HOH 465 21.131 -20.414 -6.377 1.00 35.47 O HETATM 4207 O HOH 466 10.711 7.247 -11.928 1.00 43.69 O HETATM 4208 O HOH 467 16.676 16.009 3.892 1.00 38.56 O HETATM 4209 O HOH 468 11.632 5.432 -8.879 1.00 34.14 O HETATM 4210 O HOH 469 13.631 -14.762 1.692 1.00 30.62 O HETATM 4211 O HOH 470 17.687 -1.735 10.293 1.00 33.87 O HETATM 4212 O HOH 471 11.050 17.101 6.410 1.00 32.72 O HETATM 4213 O HOH 472 18.133 -6.312 7.390 1.00 39.54 O HETATM 4214 O HOH 473 20.099 -2.687 7.660 1.00 39.21 O HETATM 4215 O HOH 474 24.452 -7.913 -5.277 1.00 39.84 O HETATM 4216 O HOH 475 7.004 -1.977 -8.139 1.00 32.75 O HETATM 4217 O HOH 476 22.430 -9.074 -8.176 1.00 35.56 O HETATM 4218 O HOH 477 11.010 8.876 -2.494 1.00 33.21 O HETATM 4219 O HOH 478 9.635 7.771 20.311 1.00 47.05 O HETATM 4220 O HOH 479 19.167 -10.616 -16.158 1.00 42.78 O HETATM 4221 O HOH 480 9.767 2.995 16.559 1.00 42.12 O HETATM 4222 O HOH 481 20.530 -6.863 2.822 1.00 32.50 O HETATM 4223 O HOH 482 21.987 -5.002 3.943 1.00 37.51 O HETATM 4224 O HOH 483 19.917 -6.051 9.108 1.00 41.70 O HETATM 4225 O HOH 484 18.419 -12.888 -0.888 1.00 37.85 O HETATM 4226 O HOH 485 3.189 -3.269 10.545 1.00 45.92 O HETATM 4227 O HOH 486 19.380 1.359 9.876 1.00 29.20 O HETATM 4228 O HOH 487 8.346 -3.438 -10.751 1.00 41.02 O HETATM 4229 O HOH 488 12.989 -1.582 -13.699 1.00 45.37 O HETATM 4230 O HOH 489 9.415 17.702 12.745 1.00 40.68 O HETATM 4231 O HOH 490 8.763 8.772 -2.439 1.00 39.40 O HETATM 4232 O HOH 491 3.596 -2.261 12.524 1.00 49.64 O HETATM 4233 O HOH 492 -1.700 -1.618 11.259 1.00 26.76 O HETATM 4234 O HOH 493 13.071 14.136 3.124 1.00 37.14 O HETATM 4235 O HOH 494 7.927 8.038 -4.945 1.00 40.95 O HETATM 4236 O HOH 495 21.686 0.838 9.186 1.00 48.13 O HETATM 4237 O HOH 496 15.654 7.320 16.673 1.00 48.48 O HETATM 4238 O HOH 497 23.544 10.543 -2.632 1.00 46.40 O HETATM 4239 O HOH 498 2.178 -1.128 -1.751 1.00 37.31 O HETATM 4240 O HOH 499 5.423 1.424 18.315 1.00 36.27 O HETATM 4241 O HOH 500 21.888 0.781 -13.264 1.00 34.77 O HETATM 4242 O HOH 501 -1.372 1.316 16.593 1.00 45.20 O HETATM 4243 O HOH 502 8.017 15.430 13.763 1.00 34.00 O HETATM 4244 O HOH 503 14.984 5.272 14.612 1.00 45.72 O HETATM 4245 O HOH 504 -19.024 15.562 8.112 1.00 34.63 O HETATM 4246 O HOH 505 -19.355 23.411 17.254 1.00 35.67 O HETATM 4247 O HOH 506 -15.169 23.309 17.274 1.00 36.04 O HETATM 4248 O HOH 507 -11.958 26.156 15.819 1.00 44.69 O HETATM 4249 O HOH 508 -17.160 23.953 19.181 1.00 33.69 O HETATM 4250 O HOH 509 -22.177 26.887 17.241 1.00 39.04 O HETATM 4251 O HOH 510 -13.204 16.756 15.630 1.00 25.75 O HETATM 4252 O HOH 511 -20.139 6.483 10.463 1.00 26.18 O HETATM 4253 O HOH 512 -21.023 9.222 14.688 1.00 38.93 O HETATM 4254 O HOH 513 -21.190 13.880 12.171 1.00 35.92 O HETATM 4255 O HOH 514 -20.764 21.822 21.260 1.00 33.97 O HETATM 4256 O HOH 515 -26.144 17.280 19.204 1.00 39.67 O HETATM 4257 O HOH 516 -21.652 6.782 6.687 1.00 24.37 O HETATM 4258 O HOH 517 -21.583 22.501 18.542 1.00 31.14 O HETATM 4259 O HOH 518 -20.846 6.881 13.285 1.00 48.73 O HETATM 4260 O HOH 519 -24.819 15.913 20.714 1.00 51.63 O HETATM 4261 O HOH 520 -22.914 6.514 9.525 1.00 46.29 O HETATM 4262 O HOH 521 -13.784 7.855 15.662 1.00 29.24 O HETATM 4263 O HOH 522 -18.408 13.221 8.334 1.00 42.87 O HETATM 4264 O HOH 523 -13.906 14.700 14.659 1.00 31.47 O HETATM 4265 N PHE A 524 -15.247 1.000 7.913 1.00 0.24 N HETATM 4266 CA PHE A 524 -16.326 2.020 7.776 1.00 0.07 C HETATM 4267 C PHE A 524 -15.990 3.168 8.745 1.00 0.23 C HETATM 4268 O PHE A 524 -15.954 2.986 9.967 1.00 -0.39 O HETATM 4269 N PHE A 524 -15.721 4.337 8.176 1.00 -0.26 N HETATM 4270 CA PHE A 524 -15.302 5.467 8.983 1.00 0.13 C HETATM 4271 C PHE A 524 -16.417 5.976 9.879 1.00 0.20 C HETATM 4272 O PHE A 524 -17.603 5.925 9.570 1.00 -0.39 O HETATM 4273 N PHE A 524 -16.003 6.613 10.974 1.00 -0.26 N HETATM 4274 CA PHE A 524 -16.935 7.383 11.790 1.00 0.15 C HETATM 4275 C PHE A 524 -17.221 8.745 11.164 1.00 0.21 C HETATM 4276 O PHE A 524 -16.499 9.206 10.304 1.00 -0.39 O HETATM 4277 N PHE A 524 -18.311 9.358 11.580 1.00 -0.26 N HETATM 4278 CA PHE A 524 -18.526 10.776 11.245 1.00 0.13 C HETATM 4279 C PHE A 524 -17.704 11.680 12.148 1.00 0.20 C HETATM 4280 O PHE A 524 -17.266 11.269 13.225 1.00 -0.39 O HETATM 4281 N PHE A 524 -17.527 12.941 11.766 1.00 -0.26 N HETATM 4282 CA PHE A 524 -16.814 13.890 12.628 1.00 0.14 C HETATM 4283 C PHE A 524 -17.621 14.239 13.887 1.00 0.21 C HETATM 4284 O PHE A 524 -18.849 14.162 13.876 1.00 -0.39 O HETATM 4285 N PHE A 524 -16.936 14.621 14.967 1.00 -0.26 N HETATM 4286 CA PHE A 524 -17.627 14.988 16.212 1.00 0.13 C HETATM 4287 C PHE A 524 -18.579 16.127 15.911 1.00 0.20 C HETATM 4288 O PHE A 524 -18.147 17.113 15.354 1.00 -0.39 O HETATM 4289 N PHE A 524 -19.856 15.963 16.248 1.00 -0.26 N HETATM 4290 CA PHE A 524 -20.872 16.953 15.935 1.00 0.13 C HETATM 4291 C PHE A 524 -21.821 17.109 17.120 1.00 0.20 C HETATM 4292 O PHE A 524 -22.256 16.102 17.705 1.00 -0.39 O HETATM 4293 N PHE A 524 -22.184 18.358 17.436 1.00 -0.26 N HETATM 4294 CA PHE A 524 -23.128 18.628 18.513 1.00 0.13 C HETATM 4295 C PHE A 524 -24.002 19.781 18.089 1.00 0.20 C HETATM 4296 O PHE A 524 -23.481 20.822 17.689 1.00 -0.39 O HETATM 4297 N PHE A 524 -25.323 19.594 18.160 1.00 -0.26 N HETATM 4298 CA PHE A 524 -26.262 20.665 17.831 1.00 0.14 C HETATM 4299 C PHE A 524 -26.032 21.205 16.413 1.00 0.21 C HETATM 4300 O PHE A 524 -26.031 22.410 16.199 1.00 -0.39 O HETATM 4301 N PHE A 524 -25.815 20.303 15.459 1.00 -0.27 N HETATM 4302 CA PHE A 524 -25.610 20.675 14.068 1.00 0.12 C HETATM 4303 C PHE A 524 -24.232 21.207 13.686 1.00 0.20 C HETATM 4304 O PHE A 524 -23.976 21.493 12.502 1.00 -0.39 O HETATM 4305 N PHE A 524 -23.336 21.342 14.665 1.00 -0.26 N HETATM 4306 CA PHE A 524 -22.041 21.974 14.412 1.00 0.14 C HETATM 4307 C PHE A 524 -20.919 21.071 14.821 1.00 0.21 C HETATM 4308 O PHE A 524 -20.979 20.424 15.855 1.00 -0.39 O HETATM 4309 N PHE A 524 -19.904 21.018 13.976 1.00 -0.26 N HETATM 4310 CA PHE A 524 -18.768 20.147 14.243 1.00 0.14 C HETATM 4311 C PHE A 524 -17.903 20.682 15.380 1.00 0.21 C HETATM 4312 O PHE A 524 -17.881 21.886 15.644 1.00 -0.39 O HETATM 4313 N PHE A 524 -17.259 19.770 16.106 1.00 -0.26 N HETATM 4314 CA PHE A 524 -16.473 20.135 17.268 1.00 0.13 C HETATM 4315 C PHE A 524 -15.053 19.637 17.051 1.00 0.20 C HETATM 4316 O PHE A 524 -14.839 18.440 16.983 1.00 -0.39 O HETATM 4317 N PHE A 524 -14.100 20.552 16.918 1.00 -0.26 N HETATM 4318 CA PHE A 524 -12.706 20.217 16.602 1.00 0.16 C HETATM 4319 C PHE A 524 -11.839 20.433 17.856 1.00 0.21 C HETATM 4320 O PHE A 524 -12.365 20.771 18.912 1.00 -0.39 O HETATM 4321 N PHE A 524 -10.527 20.227 17.766 1.00 -0.27 N HETATM 4322 CA PHE A 524 -9.682 20.420 18.945 1.00 0.10 C HETATM 4323 C PHE A 524 -9.648 21.831 19.491 1.00 0.06 C HETATM 4324 O PHE A 524 -9.999 22.805 18.785 1.00 -0.57 O HETATM 4325 OXT PHE A 524 -9.213 21.982 20.654 1.00 -0.57 O HETATM 4326 CB PHE A 524 -8.261 20.105 18.595 1.00 -0.01 C HETATM 4327 CG PHE A 524 -8.029 18.693 18.347 1.00 -0.00 C HETATM 4328 SD PHE A 524 -6.266 18.599 17.940 1.00 -0.16 S HETATM 4329 CE PHE A 524 -6.177 16.825 18.042 1.00 -0.02 C HETATM 4330 H PHE A 524 -5.150 16.496 17.824 1.00 0.03 H HETATM 4331 H PHE A 524 -6.867 16.381 17.310 1.00 0.03 H HETATM 4332 H PHE A 524 -6.458 16.501 19.055 1.00 0.03 H HETATM 4333 H PHE A 524 -8.643 18.338 17.506 1.00 0.04 H HETATM 4334 H PHE A 524 -8.255 18.097 19.243 1.00 0.04 H HETATM 4335 H PHE A 524 -7.617 20.423 19.428 1.00 0.03 H HETATM 4336 H PHE A 524 -7.992 20.667 17.689 1.00 0.03 H HETATM 4337 H PHE A 524 -10.037 19.741 19.734 1.00 0.07 H HETATM 4338 H PHE A 524 -10.121 19.942 16.898 1.00 0.19 H HETATM 4339 CB PHE A 524 -12.219 21.063 15.400 1.00 0.09 C HETATM 4340 OG1 PHE A 524 -12.268 22.453 15.743 1.00 -0.39 O HETATM 4341 H PHE A 524 -11.706 22.613 16.492 1.00 0.21 H HETATM 4342 CG2 PHE A 524 -13.163 20.877 14.192 1.00 -0.03 C HETATM 4343 H PHE A 524 -12.803 21.484 13.348 1.00 0.03 H HETATM 4344 H PHE A 524 -14.178 21.198 14.467 1.00 0.03 H HETATM 4345 H PHE A 524 -13.180 19.817 13.900 1.00 0.03 H HETATM 4346 H PHE A 524 -11.194 20.769 15.131 1.00 0.06 H HETATM 4347 H PHE A 524 -12.651 19.155 16.320 1.00 0.08 H HETATM 4348 H PHE A 524 -14.343 21.514 17.039 1.00 0.19 H HETATM 4349 CB PHE A 524 -17.029 19.465 18.547 1.00 -0.01 C HETATM 4350 CG1 PHE A 524 -16.162 19.856 19.746 1.00 -0.06 C HETATM 4351 H PHE A 524 -16.557 19.380 20.655 1.00 0.02 H HETATM 4352 H PHE A 524 -16.177 20.949 19.869 1.00 0.02 H HETATM 4353 H PHE A 524 -15.128 19.520 19.576 1.00 0.02 H HETATM 4354 CG2 PHE A 524 -18.486 19.871 18.763 1.00 -0.06 C HETATM 4355 H PHE A 524 -19.082 19.577 17.887 1.00 0.02 H HETATM 4356 H PHE A 524 -18.547 20.961 18.899 1.00 0.02 H HETATM 4357 H PHE A 524 -18.878 19.367 19.659 1.00 0.02 H HETATM 4358 H PHE A 524 -16.986 18.373 18.423 1.00 0.03 H HETATM 4359 H PHE A 524 -16.479 21.228 17.391 1.00 0.08 H HETATM 4360 H PHE A 524 -17.319 18.807 15.842 1.00 0.19 H HETATM 4361 CB PHE A 524 -17.964 19.902 12.952 1.00 0.02 C HETATM 4362 CG PHE A 524 -18.774 19.241 11.866 1.00 -0.04 C HETATM 4363 CD1 PHE A 524 -19.116 17.899 11.965 1.00 -0.06 C HETATM 4364 CE1 PHE A 524 -19.873 17.288 10.974 1.00 -0.07 C HETATM 4365 CZ PHE A 524 -20.298 18.023 9.873 1.00 -0.07 C HETATM 4366 CE2 PHE A 524 -19.962 19.362 9.768 1.00 -0.07 C HETATM 4367 CD2 PHE A 524 -19.210 19.962 10.757 1.00 -0.06 C HETATM 4368 H PHE A 524 -18.954 21.012 10.669 1.00 0.06 H HETATM 4369 H PHE A 524 -20.289 19.938 8.910 1.00 0.06 H HETATM 4370 H PHE A 524 -20.891 17.549 9.099 1.00 0.06 H HETATM 4371 H PHE A 524 -20.132 16.239 11.059 1.00 0.06 H HETATM 4372 H PHE A 524 -18.789 17.323 12.823 1.00 0.06 H HETATM 4373 H PHE A 524 -17.106 19.256 13.191 1.00 0.05 H HETATM 4374 H PHE A 524 -17.601 20.870 12.577 1.00 0.05 H HETATM 4375 H PHE A 524 -19.166 19.175 14.570 1.00 0.08 H HETATM 4376 H PHE A 524 -19.916 21.579 13.149 1.00 0.19 H HETATM 4377 CB PHE A 524 -21.956 23.300 15.136 1.00 0.01 C HETATM 4378 CG PHE A 524 -22.901 24.313 14.580 1.00 -0.00 C HETATM 4379 ND1 PHE A 524 -24.268 24.219 14.740 1.00 -0.33 N HETATM 4380 CE1 PHE A 524 -24.853 25.227 14.113 1.00 0.09 C HETATM 4381 NE2 PHE A 524 -23.916 25.955 13.528 1.00 -0.28 N HETATM 4382 CD2 PHE A 524 -22.685 25.401 13.798 1.00 0.03 C HETATM 4383 H PHE A 524 -21.720 25.767 13.450 1.00 0.07 H HETATM 4384 H PHE A 524 -24.081 26.800 12.962 1.00 0.24 H HETATM 4385 H PHE A 524 -25.924 25.424 14.084 1.00 0.12 H HETATM 4386 H PHE A 524 -20.930 23.687 15.046 1.00 0.04 H HETATM 4387 H PHE A 524 -22.195 23.139 16.198 1.00 0.04 H HETATM 4388 H PHE A 524 -21.953 22.163 13.332 1.00 0.08 H HETATM 4389 H PHE A 524 -23.552 21.007 15.582 1.00 0.19 H HETATM 4390 H PHE A 524 -26.346 21.454 13.822 1.00 0.08 H HETATM 4391 H PHE A 524 -25.802 19.782 13.455 1.00 0.08 H HETATM 4392 H PHE A 524 -25.792 19.335 15.707 1.00 0.19 H HETATM 4393 CB PHE A 524 -26.148 21.796 18.869 1.00 0.04 C HETATM 4394 CG PHE A 524 -26.647 21.375 20.267 1.00 0.04 C HETATM 4395 OD1 PHE A 524 -27.516 20.477 20.346 1.00 -0.57 O HETATM 4396 OD2 PHE A 524 -26.173 21.940 21.282 1.00 -0.57 O HETATM 4397 H PHE A 524 -26.748 22.651 18.524 1.00 0.05 H HETATM 4398 H PHE A 524 -25.093 22.096 18.948 1.00 0.05 H HETATM 4399 H PHE A 524 -27.281 20.254 17.877 1.00 0.08 H HETATM 4400 H PHE A 524 -25.677 18.703 18.444 1.00 0.19 H HETATM 4401 CB PHE A 524 -22.403 18.993 19.847 1.00 -0.01 C HETATM 4402 CG1 PHE A 524 -23.426 19.410 20.932 1.00 -0.06 C HETATM 4403 H PHE A 524 -22.893 19.662 21.861 1.00 0.02 H HETATM 4404 H PHE A 524 -24.119 18.577 21.122 1.00 0.02 H HETATM 4405 H PHE A 524 -23.992 20.287 20.585 1.00 0.02 H HETATM 4406 CG2 PHE A 524 -21.559 17.827 20.339 1.00 -0.06 C HETATM 4407 H PHE A 524 -20.838 17.542 19.559 1.00 0.02 H HETATM 4408 H PHE A 524 -22.212 16.971 20.565 1.00 0.02 H HETATM 4409 H PHE A 524 -21.017 18.125 21.249 1.00 0.02 H HETATM 4410 H PHE A 524 -21.736 19.846 19.654 1.00 0.03 H HETATM 4411 H PHE A 524 -23.749 17.735 18.679 1.00 0.08 H HETATM 4412 H PHE A 524 -21.799 19.124 16.921 1.00 0.19 H HETATM 4413 CB PHE A 524 -21.681 16.520 14.697 1.00 -0.00 C HETATM 4414 CG PHE A 524 -22.619 17.612 14.188 1.00 0.00 C HETATM 4415 CD PHE A 524 -23.554 17.123 13.100 1.00 0.04 C HETATM 4416 OE1 PHE A 524 -23.154 16.207 12.359 1.00 -0.57 O HETATM 4417 OE2 PHE A 524 -24.690 17.647 12.994 1.00 -0.57 O HETATM 4418 H PHE A 524 -22.013 18.437 13.786 1.00 0.04 H HETATM 4419 H PHE A 524 -23.223 17.978 15.032 1.00 0.04 H HETATM 4420 H PHE A 524 -22.281 15.637 14.961 1.00 0.03 H HETATM 4421 H PHE A 524 -20.978 16.258 13.892 1.00 0.03 H HETATM 4422 H PHE A 524 -20.384 17.917 15.729 1.00 0.08 H HETATM 4423 H PHE A 524 -20.125 15.131 16.733 1.00 0.19 H HETATM 4424 CB PHE A 524 -16.629 15.434 17.284 1.00 -0.01 C HETATM 4425 CG PHE A 524 -15.642 14.340 17.656 1.00 -0.04 C HETATM 4426 CD1 PHE A 524 -14.562 14.933 18.552 1.00 -0.06 C HETATM 4427 H PHE A 524 -13.842 14.148 18.827 1.00 0.02 H HETATM 4428 H PHE A 524 -15.024 15.342 19.463 1.00 0.02 H HETATM 4429 H PHE A 524 -14.040 15.737 18.013 1.00 0.02 H HETATM 4430 CD2 PHE A 524 -16.404 13.195 18.320 1.00 -0.06 C HETATM 4431 H PHE A 524 -17.166 12.811 17.626 1.00 0.02 H HETATM 4432 H PHE A 524 -16.892 13.562 19.235 1.00 0.02 H HETATM 4433 H PHE A 524 -15.702 12.388 18.577 1.00 0.02 H HETATM 4434 H PHE A 524 -15.164 13.957 16.742 1.00 0.03 H HETATM 4435 H PHE A 524 -17.188 15.726 18.186 1.00 0.03 H HETATM 4436 H PHE A 524 -16.068 16.300 16.904 1.00 0.03 H HETATM 4437 H PHE A 524 -18.192 14.121 16.584 1.00 0.08 H HETATM 4438 H PHE A 524 -15.937 14.658 14.929 1.00 0.19 H HETATM 4439 CB PHE A 524 -16.470 15.164 11.853 1.00 0.04 C HETATM 4440 CG PHE A 524 -17.569 15.577 10.894 1.00 0.04 C HETATM 4441 OD1 PHE A 524 -18.755 15.505 11.280 1.00 -0.57 O HETATM 4442 OD2 PHE A 524 -17.247 15.973 9.754 1.00 -0.57 O HETATM 4443 H PHE A 524 -15.548 14.989 11.278 1.00 0.05 H HETATM 4444 H PHE A 524 -16.305 15.980 12.572 1.00 0.05 H HETATM 4445 H PHE A 524 -15.874 13.416 12.947 1.00 0.08 H HETATM 4446 H PHE A 524 -17.883 13.245 10.883 1.00 0.19 H HETATM 4447 CB PHE A 524 -20.002 11.097 11.378 1.00 -0.01 C HETATM 4448 CG PHE A 524 -20.877 10.002 10.700 1.00 -0.04 C HETATM 4449 CD PHE A 524 -21.141 10.310 9.223 1.00 -0.01 C HETATM 4450 CE PHE A 524 -21.676 9.077 8.486 1.00 -0.04 C HETATM 4451 NZ PHE A 524 -22.264 9.405 7.141 1.00 0.22 N HETATM 4452 H PHE A 524 -22.598 8.560 6.705 1.00 0.20 H HETATM 4453 H PHE A 524 -21.557 9.826 6.559 1.00 0.20 H HETATM 4454 H PHE A 524 -23.031 10.049 7.258 1.00 0.20 H HETATM 4455 H PHE A 524 -22.456 8.610 9.105 1.00 0.08 H HETATM 4456 H PHE A 524 -20.848 8.367 8.343 1.00 0.08 H HETATM 4457 H PHE A 524 -20.201 10.631 8.750 1.00 0.03 H HETATM 4458 H PHE A 524 -21.882 11.120 9.152 1.00 0.03 H HETATM 4459 H PHE A 524 -21.840 9.941 11.227 1.00 0.03 H HETATM 4460 H PHE A 524 -20.356 9.036 10.774 1.00 0.03 H HETATM 4461 H PHE A 524 -20.204 12.066 10.898 1.00 0.03 H HETATM 4462 H PHE A 524 -20.262 11.155 12.445 1.00 0.03 H HETATM 4463 H PHE A 524 -18.216 10.946 10.203 1.00 0.08 H HETATM 4464 H PHE A 524 -18.990 8.862 12.121 1.00 0.19 H HETATM 4465 CB PHE A 524 -16.297 7.588 13.167 1.00 0.08 C HETATM 4466 CG PHE A 524 -17.269 8.068 14.186 1.00 0.18 C HETATM 4467 OD1 PHE A 524 -18.495 8.083 13.963 1.00 -0.40 O HETATM 4468 ND2 PHE A 524 -16.742 8.460 15.349 1.00 -0.30 N HETATM 4469 H PHE A 524 -17.337 8.795 16.080 1.00 0.18 H HETATM 4470 H PHE A 524 -15.753 8.419 15.489 1.00 0.18 H HETATM 4471 H PHE A 524 -15.490 8.330 13.074 1.00 0.06 H HETATM 4472 H PHE A 524 -15.877 6.630 13.506 1.00 0.06 H HETATM 4473 H PHE A 524 -17.878 6.827 11.894 1.00 0.08 H HETATM 4474 H PHE A 524 -15.040 6.562 11.240 1.00 0.19 H HETATM 4475 CB PHE A 524 -14.868 6.596 8.026 1.00 -0.01 C HETATM 4476 CG PHE A 524 -13.556 6.428 7.273 1.00 -0.04 C HETATM 4477 CD1 PHE A 524 -13.460 7.516 6.198 1.00 -0.06 C HETATM 4478 H PHE A 524 -12.515 7.404 5.647 1.00 0.02 H HETATM 4479 H PHE A 524 -13.491 8.507 6.675 1.00 0.02 H HETATM 4480 H PHE A 524 -14.305 7.418 5.500 1.00 0.02 H HETATM 4481 CD2 PHE A 524 -12.372 6.543 8.234 1.00 -0.06 C HETATM 4482 H PHE A 524 -12.447 5.760 9.003 1.00 0.02 H HETATM 4483 H PHE A 524 -12.385 7.532 8.716 1.00 0.02 H HETATM 4484 H PHE A 524 -11.433 6.420 7.675 1.00 0.02 H HETATM 4485 H PHE A 524 -13.536 5.438 6.794 1.00 0.03 H HETATM 4486 H PHE A 524 -14.788 7.517 8.622 1.00 0.03 H HETATM 4487 H PHE A 524 -15.664 6.713 7.275 1.00 0.03 H HETATM 4488 H PHE A 524 -14.451 5.165 9.611 1.00 0.08 H HETATM 4489 H PHE A 524 -15.808 4.439 7.185 1.00 0.19 H HETATM 4490 CB PHE A 524 -17.626 1.338 8.184 1.00 0.04 C HETATM 4491 CG PHE A 524 -18.880 2.152 7.961 1.00 -0.04 C HETATM 4492 CD1 PHE A 524 -19.550 2.132 6.731 1.00 -0.06 C HETATM 4493 CE1 PHE A 524 -20.721 2.831 6.570 1.00 -0.07 C HETATM 4494 CZ PHE A 524 -21.259 3.572 7.611 1.00 -0.07 C HETATM 4495 CE2 PHE A 524 -20.614 3.616 8.845 1.00 -0.07 C HETATM 4496 CD2 PHE A 524 -19.401 2.929 9.007 1.00 -0.06 C HETATM 4497 H PHE A 524 -18.863 2.999 9.946 1.00 0.06 H HETATM 4498 H PHE A 524 -21.044 4.174 9.669 1.00 0.06 H HETATM 4499 H PHE A 524 -22.184 4.118 7.464 1.00 0.06 H HETATM 4500 H PHE A 524 -21.232 2.803 5.615 1.00 0.06 H HETATM 4501 H PHE A 524 -19.143 1.563 5.903 1.00 0.06 H HETATM 4502 H PHE A 524 -17.562 1.099 9.256 1.00 0.05 H HETATM 4503 H PHE A 524 -17.718 0.407 7.605 1.00 0.05 H HETATM 4504 H PHE A 524 -16.393 2.394 6.744 1.00 0.11 H HETATM 4505 H PHE A 524 -15.433 0.229 7.291 1.00 0.20 H HETATM 4506 H PHE A 524 -15.219 0.666 8.864 1.00 0.20 H HETATM 4507 H PHE A 524 -14.360 1.416 7.677 1.00 0.20 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 1014 1013 1645 CONECT 1645 1014 1644 CONECT 2045 2044 2592 CONECT 2592 2045 2591 CONECT 2748 2749 2759 2760 2761 CONECT 2759 2748 CONECT 2760 2748 CONECT 2761 2748 CONECT 2995 2994 3545 CONECT 3545 2995 3544 CONECT 4265 4266 4505 4506 4507 CONECT 4266 4265 4267 4490 4504 CONECT 4267 4266 4268 4269 CONECT 4268 4267 CONECT 4269 4267 4270 4489 CONECT 4270 4269 4271 4475 4488 CONECT 4271 4270 4272 4273 CONECT 4272 4271 CONECT 4273 4271 4274 4474 CONECT 4274 4273 4275 4465 4473 CONECT 4275 4274 4276 4277 CONECT 4276 4275 CONECT 4277 4275 4278 4464 CONECT 4278 4277 4279 4447 4463 CONECT 4279 4278 4280 4281 CONECT 4280 4279 CONECT 4281 4279 4282 4446 CONECT 4282 4281 4283 4439 4445 CONECT 4283 4282 4284 4285 CONECT 4284 4283 CONECT 4285 4283 4286 4438 CONECT 4286 4285 4287 4424 4437 CONECT 4287 4286 4288 4289 CONECT 4288 4287 CONECT 4289 4287 4290 4423 CONECT 4290 4289 4291 4413 4422 CONECT 4291 4290 4292 4293 CONECT 4292 4291 CONECT 4293 4291 4294 4412 CONECT 4294 4293 4295 4401 4411 CONECT 4295 4294 4296 4297 CONECT 4296 4295 CONECT 4297 4295 4298 4400 CONECT 4298 4297 4299 4393 4399 CONECT 4299 4298 4300 4301 CONECT 4300 4299 CONECT 4301 4299 4302 4392 CONECT 4302 4301 4303 4390 4391 CONECT 4303 4302 4304 4305 CONECT 4304 4303 CONECT 4305 4303 4306 4389 CONECT 4306 4305 4307 4377 4388 CONECT 4307 4306 4308 4309 CONECT 4308 4307 CONECT 4309 4307 4310 4376 CONECT 4310 4309 4311 4361 4375 CONECT 4311 4310 4312 4313 CONECT 4312 4311 CONECT 4313 4311 4314 4360 CONECT 4314 4313 4315 4349 4359 CONECT 4315 4314 4316 4317 CONECT 4316 4315 CONECT 4317 4315 4318 4348 CONECT 4318 4317 4319 4339 4347 CONECT 4319 4318 4320 4321 CONECT 4320 4319 CONECT 4321 4319 4322 4338 CONECT 4322 4321 4323 4326 4337 CONECT 4323 4322 4324 4325 CONECT 4324 4323 CONECT 4325 4323 CONECT 4326 4322 4327 4335 4336 CONECT 4327 4326 4328 4333 4334 CONECT 4328 4327 4329 CONECT 4329 4328 4330 4331 4332 CONECT 4330 4329 CONECT 4331 4329 CONECT 4332 4329 CONECT 4333 4327 CONECT 4334 4327 CONECT 4335 4326 CONECT 4336 4326 CONECT 4337 4322 CONECT 4338 4321 CONECT 4339 4318 4340 4342 4346 CONECT 4340 4339 4341 CONECT 4341 4340 CONECT 4342 4339 4343 4344 4345 CONECT 4343 4342 CONECT 4344 4342 CONECT 4345 4342 CONECT 4346 4339 CONECT 4347 4318 CONECT 4348 4317 CONECT 4349 4314 4350 4354 4358 CONECT 4350 4349 4351 4352 4353 CONECT 4351 4350 CONECT 4352 4350 CONECT 4353 4350 CONECT 4354 4349 4355 4356 4357 CONECT 4355 4354 CONECT 4356 4354 CONECT 4357 4354 CONECT 4358 4349 CONECT 4359 4314 CONECT 4360 4313 CONECT 4361 4310 4362 4373 4374 CONECT 4362 4361 4363 4367 CONECT 4363 4362 4364 4372 CONECT 4364 4363 4365 4371 CONECT 4365 4364 4366 4370 CONECT 4366 4365 4367 4369 CONECT 4367 4362 4366 4368 CONECT 4368 4367 CONECT 4369 4366 CONECT 4370 4365 CONECT 4371 4364 CONECT 4372 4363 CONECT 4373 4361 CONECT 4374 4361 CONECT 4375 4310 CONECT 4376 4309 CONECT 4377 4306 4378 4386 4387 CONECT 4378 4377 4379 4382 CONECT 4379 4378 4380 CONECT 4380 4379 4381 4385 CONECT 4381 4380 4382 4384 CONECT 4382 4378 4381 4383 CONECT 4383 4382 CONECT 4384 4381 CONECT 4385 4380 CONECT 4386 4377 CONECT 4387 4377 CONECT 4388 4306 CONECT 4389 4305 CONECT 4390 4302 CONECT 4391 4302 CONECT 4392 4301 CONECT 4393 4298 4394 4397 4398 CONECT 4394 4393 4395 4396 CONECT 4395 4394 CONECT 4396 4394 CONECT 4397 4393 CONECT 4398 4393 CONECT 4399 4298 CONECT 4400 4297 CONECT 4401 4294 4402 4406 4410 CONECT 4402 4401 4403 4404 4405 CONECT 4403 4402 CONECT 4404 4402 CONECT 4405 4402 CONECT 4406 4401 4407 4408 4409 CONECT 4407 4406 CONECT 4408 4406 CONECT 4409 4406 CONECT 4410 4401 CONECT 4411 4294 CONECT 4412 4293 CONECT 4413 4290 4414 4420 4421 CONECT 4414 4413 4415 4418 4419 CONECT 4415 4414 4416 4417 CONECT 4416 4415 CONECT 4417 4415 CONECT 4418 4414 CONECT 4419 4414 CONECT 4420 4413 CONECT 4421 4413 CONECT 4422 4290 CONECT 4423 4289 CONECT 4424 4286 4425 4435 4436 CONECT 4425 4424 4426 4430 4434 CONECT 4426 4425 4427 4428 4429 CONECT 4427 4426 CONECT 4428 4426 CONECT 4429 4426 CONECT 4430 4425 4431 4432 4433 CONECT 4431 4430 CONECT 4432 4430 CONECT 4433 4430 CONECT 4434 4425 CONECT 4435 4424 CONECT 4436 4424 CONECT 4437 4286 CONECT 4438 4285 CONECT 4439 4282 4440 4443 4444 CONECT 4440 4439 4441 4442 CONECT 4441 4440 CONECT 4442 4440 CONECT 4443 4439 CONECT 4444 4439 CONECT 4445 4282 CONECT 4446 4281 CONECT 4447 4278 4448 4461 4462 CONECT 4448 4447 4449 4459 4460 CONECT 4449 4448 4450 4457 4458 CONECT 4450 4449 4451 4455 4456 CONECT 4451 4450 4452 4453 4454 CONECT 4452 4451 CONECT 4453 4451 CONECT 4454 4451 CONECT 4455 4450 CONECT 4456 4450 CONECT 4457 4449 CONECT 4458 4449 CONECT 4459 4448 CONECT 4460 4448 CONECT 4461 4447 CONECT 4462 4447 CONECT 4463 4278 CONECT 4464 4277 CONECT 4465 4274 4466 4471 4472 CONECT 4466 4465 4467 4468 CONECT 4467 4466 CONECT 4468 4466 4469 4470 CONECT 4469 4468 CONECT 4470 4468 CONECT 4471 4465 CONECT 4472 4465 CONECT 4473 4274 CONECT 4474 4273 CONECT 4475 4270 4476 4486 4487 CONECT 4476 4475 4477 4481 4485 CONECT 4477 4476 4478 4479 4480 CONECT 4478 4477 CONECT 4479 4477 CONECT 4480 4477 CONECT 4481 4476 4482 4483 4484 CONECT 4482 4481 CONECT 4483 4481 CONECT 4484 4481 CONECT 4485 4476 CONECT 4486 4475 CONECT 4487 4475 CONECT 4488 4270 CONECT 4489 4269 CONECT 4490 4266 4491 4502 4503 CONECT 4491 4490 4492 4496 CONECT 4492 4491 4493 4501 CONECT 4493 4492 4494 4500 CONECT 4494 4493 4495 4499 CONECT 4495 4494 4496 4498 CONECT 4496 4491 4495 4497 CONECT 4497 4496 CONECT 4498 4495 CONECT 4499 4494 CONECT 4500 4493 CONECT 4501 4492 CONECT 4502 4490 CONECT 4503 4490 CONECT 4504 4266 CONECT 4505 4265 CONECT 4506 4265 CONECT 4507 4265 MASTER 0 0 0 0 0 0 0 0 4505 2 257 30 END
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6rml
RCSB PDB
PDBbind
15-mer
6q9t
RCSB PDB
PDBbind
15-mer
6hol
RCSB PDB
PDBbind
15-mer
6e5x
RCSB PDB
PDBbind
15-mer
6bnt
RCSB PDB
PDBbind
15-mer
5zk9
RCSB PDB
PDBbind
15-mer
5zjz
RCSB PDB
PDBbind
15-mer
5vtb
RCSB PDB
PDBbind
15-mer
6a5e
RCSB PDB
PDBbind
15-mer
Entry Information
PDB ID
4u6y
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
HLA class I histocompatibility antigen, A-2 alpha chain HLA-A*0201
Ligand Name
15-mer
EC.Number
E.C.-.-.-.-
Resolution
1.47(Å)
Affinity (Kd/Ki/IC50)
IC50=83nM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J.Biol.Chem. Vol. 290: pp. 2593-2603
Ligand Properties
Formula
C
8
0
H
1
2
3
N
1
9
O
2
4
S
Molecular Weight
1767.010
Exact Mass
1765.870
No. of atoms
247
No. of bonds
249
Polar Surface Area
729.18
LOGP Value
-0.48 (
Computed with XLOGP3
)
0.36 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 19
No. of Hydrogen Bond Acceptors: 25
No. of Rotatable Bonds: 69
No. of Nitrogen and Oxygen Atoms: 43
No. of Rings: 3
Canonical SMILES
CSCC[C@@H](C(=O)O)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)[NH3+])CC(C)C)CC(=O)N)CCCC[NH3+])CC(=O)O)CC(C)C)CCC(=O)O)CC(=O)O)Cc1ccccc1
InChI String
InChI=1S/C80H121N19O24S/c1-40(2)29-52(91-67(109)48(82)31-45-19-13-11-14-20-45)72(114)94-56(34-59(83)101)74(116)88-49(23-17-18-27-81)69(111)95-58(36-63(107)108)75(117)92-53(30-41(3)4)71(113)89-50(24-25-61(103)104)70(112)97-64(42(5)6)77(119)96-57(35-62(105)106)68(110)85-38-60(102)87-55(33-47-37-84-39-86-47)73(115)93-54(32-46-21-15-12-16-22-46)76(118)98-65(43(7)8)78(120)99-66(44(9)100)79(121)90-51(80(122)123)26-28-124-10/h11-16,19-22,37,39-44,48-58,64-66,100H,17-18,23-36,38,81-82H2,1-10H3,(H2,83,101)(H,84,86)(H,85,110)(H,87,102)(H,88,116)(H,89,113)(H,90,121)(H,91,109)(H,92,117)(H,93,115)(H,94,114)(H,95,111)(H,96,119)(H,97,112)(H,98,118)(H,99,120)(H,103,104)(H,105,106)(H,107,108)(H,122,123)/p+2/t44-,48+,49+,50+,51+,52+,53+,54+,55+,56+,57+,58+,64+,65+,66+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P04439
P61769
Entrez Gene ID
NCBI Entrez Gene ID:
3105
567
ASD
Information of known allosteric effects of PDB entries
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