Browse entries in the PDBbind-CN Database
HEADER 4XUE_COMPLEX COMPND 4XUE_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 215 ALA GLY ASP THR LYS GLU GLN ARG ILE LEU ASN HIS VAL SEQRES 2 B 215 LEU GLN HIS ALA GLU PRO GLY ASN ALA GLN SER VAL LEU SEQRES 3 B 215 GLU ALA ILE ASP THR TYR CYS GLU GLN LYS GLU TRP ALA SEQRES 4 B 215 MET ASN VAL GLY ASP LYS LYS GLY LYS ILE VAL ASP ALA SEQRES 5 B 215 VAL ILE GLN GLU HIS GLN PRO SER VAL LEU LEU GLU LEU SEQRES 6 B 215 GLY ALA TYR CYS GLY TYR SER ALA VAL ARG MET ALA ARG SEQRES 7 B 215 LEU LEU SER PRO GLY ALA ARG LEU ILE THR ILE GLU ILE SEQRES 8 B 215 ASN PRO ASP CYS ALA ALA ILE THR GLN ARG MET VAL ASP SEQRES 9 B 215 PHE ALA GLY VAL LYS ASP LYS VAL THR LEU VAL VAL GLY SEQRES 10 B 215 ALA SER GLN ASP ILE ILE PRO GLN LEU LYS LYS LYS TYR SEQRES 11 B 215 ASP VAL ASP THR LEU ASP MET VAL PHE LEU ASP HIS TRP SEQRES 12 B 215 LYS ASP ARG TYR LEU PRO ASP THR LEU LEU LEU GLU GLU SEQRES 13 B 215 CYS GLY LEU LEU ARG LYS GLY THR VAL LEU LEU ALA ASP SEQRES 14 B 215 ASN VAL ILE CYS PRO GLY ALA PRO ASP PHE LEU ALA HIS SEQRES 15 B 215 VAL ARG GLY SER SER CYS PHE GLU CYS THR HIS TYR GLN SEQRES 16 B 215 SER PHE LEU GLU TYR ARG GLU VAL VAL ASP GLY LEU GLU SEQRES 17 B 215 LYS ALA ILE TYR LYS GLY PRO HET MG A 1 1 HET UNN A 282 37 ATOM 1 N ALA B 51 3.446 5.787 -19.538 1.00 53.69 N ATOM 2 CA ALA B 51 3.412 6.762 -18.401 1.00 53.66 C ATOM 3 C ALA B 51 4.813 7.263 -18.022 1.00 53.16 C ATOM 4 O ALA B 51 5.074 8.477 -18.057 1.00 53.64 O ATOM 5 CB ALA B 51 2.696 6.152 -17.176 1.00 53.85 C ATOM 6 HN3 ALA B 51 4.022 4.964 -19.270 1.00 0.00 H ATOM 7 HN2 ALA B 51 3.862 6.245 -20.374 1.00 0.00 H ATOM 8 HN1 ALA B 51 2.477 5.478 -19.757 1.00 0.00 H ATOM 9 N GLY B 52 5.696 6.325 -17.672 1.00 52.17 N ATOM 10 CA GLY B 52 7.076 6.622 -17.261 1.00 50.75 C ATOM 11 C GLY B 52 7.205 6.857 -15.765 1.00 49.76 C ATOM 12 O GLY B 52 8.273 7.240 -15.272 1.00 49.45 O ATOM 13 H GLY B 52 5.391 5.331 -17.691 1.00 0.00 H ATOM 14 N ASP B 53 6.111 6.610 -15.041 1.00 48.63 N ATOM 15 CA ASP B 53 6.018 6.946 -13.622 1.00 47.30 C ATOM 16 C ASP B 53 6.805 6.031 -12.695 1.00 45.30 C ATOM 17 O ASP B 53 7.521 6.512 -11.810 1.00 45.50 O ATOM 18 CB ASP B 53 4.556 7.036 -13.200 1.00 48.19 C ATOM 19 CG ASP B 53 3.915 8.322 -13.667 1.00 51.05 C ATOM 20 OD1 ASP B 53 4.337 9.395 -13.161 1.00 53.84 O ATOM 21 OD2 ASP B 53 3.013 8.269 -14.548 1.00 54.10 O ATOM 22 H ASP B 53 5.295 6.162 -15.504 1.00 0.00 H ATOM 23 N THR B 54 6.674 4.722 -12.910 1.00 42.42 N ATOM 24 CA THR B 54 7.433 3.715 -12.164 1.00 39.37 C ATOM 25 C THR B 54 8.587 3.170 -13.009 1.00 37.62 C ATOM 26 O THR B 54 8.562 3.251 -14.253 1.00 37.08 O ATOM 27 CB THR B 54 6.522 2.547 -11.683 1.00 39.36 C ATOM 28 OG1 THR B 54 6.009 1.835 -12.813 1.00 38.71 O ATOM 29 CG2 THR B 54 5.339 3.069 -10.856 1.00 38.72 C ATOM 30 HG1 THR B 54 5.480 2.452 -13.378 1.00 0.00 H ATOM 31 H THR B 54 6.004 4.402 -13.638 1.00 0.00 H ATOM 32 N LYS B 55 9.595 2.617 -12.330 1.00 35.30 N ATOM 33 CA LYS B 55 10.725 1.973 -12.992 1.00 33.15 C ATOM 34 C LYS B 55 10.253 0.881 -13.945 1.00 32.00 C ATOM 35 O LYS B 55 10.784 0.745 -15.047 1.00 31.06 O ATOM 36 CB LYS B 55 11.674 1.366 -11.967 1.00 33.39 C ATOM 37 CG LYS B 55 13.024 0.949 -12.555 1.00 32.81 C ATOM 38 CD LYS B 55 13.651 -0.240 -11.847 1.00 33.36 C ATOM 39 CE LYS B 55 13.455 -0.224 -10.345 1.00 32.56 C ATOM 40 NZ LYS B 55 14.259 -1.260 -9.686 1.00 30.66 N ATOM 41 HZ1 LYS B 55 13.979 -2.195 -10.045 1.00 0.00 H ATOM 42 HZ2 LYS B 55 15.266 -1.097 -9.889 1.00 0.00 H ATOM 43 HZ3 LYS B 55 14.100 -1.220 -8.659 1.00 0.00 H ATOM 44 H LYS B 55 9.574 2.646 -11.291 1.00 0.00 H ATOM 45 N GLU B 56 9.264 0.109 -13.488 1.00 30.81 N ATOM 46 CA GLU B 56 8.665 -0.975 -14.247 1.00 30.18 C ATOM 47 C GLU B 56 8.055 -0.466 -15.565 1.00 29.83 C ATOM 48 O GLU B 56 8.300 -1.049 -16.614 1.00 29.04 O ATOM 49 CB GLU B 56 7.623 -1.725 -13.398 1.00 30.45 C ATOM 50 CG GLU B 56 8.177 -2.484 -12.152 1.00 31.25 C ATOM 51 CD GLU B 56 8.675 -1.561 -11.027 1.00 31.86 C ATOM 52 OE1 GLU B 56 8.008 -0.549 -10.719 1.00 33.03 O ATOM 53 OE2 GLU B 56 9.736 -1.847 -10.444 1.00 30.97 O ATOM 54 H GLU B 56 8.901 0.295 -12.531 1.00 0.00 H ATOM 55 N GLN B 57 7.272 0.614 -15.494 1.00 29.62 N ATOM 56 CA GLN B 57 6.742 1.304 -16.684 1.00 30.37 C ATOM 57 C GLN B 57 7.868 1.819 -17.612 1.00 29.22 C ATOM 58 O GLN B 57 7.753 1.736 -18.831 1.00 29.65 O ATOM 59 CB GLN B 57 5.769 2.448 -16.289 1.00 29.96 C ATOM 60 CG GLN B 57 4.429 1.931 -15.751 1.00 32.74 C ATOM 61 CD GLN B 57 3.486 2.999 -15.145 1.00 32.97 C ATOM 62 OE1 GLN B 57 3.912 4.036 -14.616 1.00 36.04 O ATOM 63 NE2 GLN B 57 2.188 2.710 -15.201 1.00 35.68 N ATOM 64 HE22 GLN B 57 1.870 1.829 -15.654 1.00 0.00 H ATOM 65 HE21 GLN B 57 1.491 3.365 -14.792 1.00 0.00 H ATOM 66 H GLN B 57 7.025 0.986 -14.555 1.00 0.00 H ATOM 67 N ARG B 58 8.952 2.324 -17.029 1.00 28.02 N ATOM 68 CA ARG B 58 10.113 2.776 -17.790 1.00 27.54 C ATOM 69 C ARG B 58 10.881 1.638 -18.482 1.00 27.50 C ATOM 70 O ARG B 58 11.393 1.820 -19.587 1.00 27.25 O ATOM 71 CB ARG B 58 11.062 3.584 -16.897 1.00 27.33 C ATOM 72 CG ARG B 58 10.464 4.880 -16.360 1.00 27.77 C ATOM 73 CD ARG B 58 11.502 5.774 -15.700 1.00 27.79 C ATOM 74 NE ARG B 58 11.998 5.261 -14.413 1.00 29.35 N ATOM 75 CZ ARG B 58 11.496 5.576 -13.216 1.00 29.45 C ATOM 76 NH1 ARG B 58 10.456 6.394 -13.114 1.00 28.38 N ATOM 77 NH2 ARG B 58 12.038 5.073 -12.111 1.00 27.18 N ATOM 78 HE ARG B 58 12.802 4.602 -14.437 1.00 0.00 H ATOM 79 HH12 ARG B 58 10.072 6.633 -12.177 1.00 0.00 H ATOM 80 HH11 ARG B 58 10.025 6.796 -13.971 1.00 0.00 H ATOM 81 HH22 ARG B 58 11.645 5.320 -11.180 1.00 0.00 H ATOM 82 HH21 ARG B 58 12.855 4.433 -12.177 1.00 0.00 H ATOM 83 H ARG B 58 8.973 2.400 -15.992 1.00 0.00 H ATOM 84 N ILE B 59 10.982 0.480 -17.821 1.00 27.34 N ATOM 85 CA ILE B 59 11.570 -0.727 -18.424 1.00 26.94 C ATOM 86 C ILE B 59 10.711 -1.167 -19.608 1.00 27.17 C ATOM 87 O ILE B 59 11.242 -1.503 -20.674 1.00 26.99 O ATOM 88 CB ILE B 59 11.710 -1.890 -17.392 1.00 26.93 C ATOM 89 CG1 ILE B 59 12.822 -1.577 -16.376 1.00 27.46 C ATOM 90 CG2 ILE B 59 11.992 -3.228 -18.086 1.00 25.50 C ATOM 91 CD1 ILE B 59 12.661 -2.292 -15.039 1.00 27.03 C ATOM 92 H ILE B 59 10.632 0.430 -16.843 1.00 0.00 H ATOM 93 N LEU B 60 9.391 -1.140 -19.425 1.00 27.03 N ATOM 94 CA LEU B 60 8.478 -1.510 -20.505 1.00 28.02 C ATOM 95 C LEU B 60 8.563 -0.533 -21.691 1.00 28.53 C ATOM 96 O LEU B 60 8.701 -0.970 -22.836 1.00 28.76 O ATOM 97 CB LEU B 60 7.040 -1.658 -20.023 1.00 27.13 C ATOM 98 CG LEU B 60 6.014 -1.878 -21.153 1.00 27.66 C ATOM 99 CD1 LEU B 60 6.234 -3.195 -21.951 1.00 26.56 C ATOM 100 CD2 LEU B 60 4.605 -1.816 -20.604 1.00 25.39 C ATOM 101 H LEU B 60 9.006 -0.852 -18.503 1.00 0.00 H ATOM 102 N ASN B 61 8.488 0.772 -21.398 1.00 28.97 N ATOM 103 CA ASN B 61 8.649 1.825 -22.408 1.00 28.86 C ATOM 104 C ASN B 61 9.906 1.634 -23.247 1.00 29.05 C ATOM 105 O ASN B 61 9.874 1.811 -24.466 1.00 29.14 O ATOM 106 CB ASN B 61 8.697 3.203 -21.745 1.00 28.83 C ATOM 107 CG ASN B 61 7.358 3.633 -21.191 1.00 28.99 C ATOM 108 OD1 ASN B 61 6.322 3.067 -21.525 1.00 30.50 O ATOM 109 ND2 ASN B 61 7.375 4.625 -20.315 1.00 30.52 N ATOM 110 HD22 ASN B 61 8.276 5.078 -20.059 1.00 0.00 H ATOM 111 HD21 ASN B 61 6.488 4.952 -19.882 1.00 0.00 H ATOM 112 H ASN B 61 8.308 1.051 -20.412 1.00 0.00 H ATOM 113 N HIS B 62 11.010 1.273 -22.586 1.00 28.89 N ATOM 114 CA HIS B 62 12.283 1.070 -23.262 1.00 28.44 C ATOM 115 C HIS B 62 12.190 -0.062 -24.266 1.00 28.66 C ATOM 116 O HIS B 62 12.683 0.059 -25.390 1.00 28.59 O ATOM 117 CB HIS B 62 13.417 0.806 -22.261 1.00 28.41 C ATOM 118 CG HIS B 62 14.757 0.626 -22.913 1.00 27.21 C ATOM 119 ND1 HIS B 62 15.586 1.686 -23.218 1.00 26.85 N ATOM 120 CD2 HIS B 62 15.397 -0.486 -23.344 1.00 27.47 C ATOM 121 CE1 HIS B 62 16.687 1.234 -23.791 1.00 26.94 C ATOM 122 NE2 HIS B 62 16.597 -0.082 -23.884 1.00 28.20 N ATOM 123 H HIS B 62 10.958 1.133 -21.557 1.00 0.00 H ATOM 124 N VAL B 63 11.581 -1.170 -23.840 1.00 28.92 N ATOM 125 CA VAL B 63 11.280 -2.303 -24.723 1.00 28.92 C ATOM 126 C VAL B 63 10.374 -1.884 -25.910 1.00 29.12 C ATOM 127 O VAL B 63 10.654 -2.236 -27.063 1.00 28.82 O ATOM 128 CB VAL B 63 10.640 -3.498 -23.933 1.00 28.74 C ATOM 129 CG1 VAL B 63 10.065 -4.552 -24.884 1.00 28.02 C ATOM 130 CG2 VAL B 63 11.660 -4.132 -22.995 1.00 27.90 C ATOM 131 H VAL B 63 11.308 -1.234 -22.839 1.00 0.00 H ATOM 132 N LEU B 64 9.306 -1.141 -25.622 1.00 29.24 N ATOM 133 CA LEU B 64 8.407 -0.656 -26.676 1.00 30.38 C ATOM 134 C LEU B 64 9.144 0.192 -27.735 1.00 31.01 C ATOM 135 O LEU B 64 8.872 0.074 -28.936 1.00 30.60 O ATOM 136 CB LEU B 64 7.214 0.099 -26.073 1.00 30.54 C ATOM 137 CG LEU B 64 6.280 -0.720 -25.155 1.00 30.49 C ATOM 138 CD1 LEU B 64 5.304 0.172 -24.408 1.00 29.92 C ATOM 139 CD2 LEU B 64 5.518 -1.832 -25.894 1.00 31.62 C ATOM 140 H LEU B 64 9.105 -0.900 -24.630 1.00 0.00 H ATOM 141 N GLN B 65 10.117 0.986 -27.273 1.00 31.66 N ATOM 142 CA GLN B 65 10.931 1.855 -28.117 1.00 32.43 C ATOM 143 C GLN B 65 12.076 1.175 -28.874 1.00 32.28 C ATOM 144 O GLN B 65 12.456 1.653 -29.936 1.00 32.38 O ATOM 145 CB GLN B 65 11.480 3.021 -27.296 1.00 32.96 C ATOM 146 CG GLN B 65 10.423 4.075 -26.968 1.00 36.93 C ATOM 147 CD GLN B 65 10.765 4.918 -25.738 1.00 41.93 C ATOM 148 OE1 GLN B 65 11.937 5.154 -25.427 1.00 43.66 O ATOM 149 NE2 GLN B 65 9.729 5.375 -25.032 1.00 43.74 N ATOM 150 HE22 GLN B 65 8.758 5.152 -25.330 1.00 0.00 H ATOM 151 HE21 GLN B 65 9.893 5.954 -24.184 1.00 0.00 H ATOM 152 H GLN B 65 10.305 0.984 -26.250 1.00 0.00 H ATOM 153 N HIS B 66 12.622 0.071 -28.355 1.00 31.72 N ATOM 154 CA HIS B 66 13.859 -0.474 -28.920 1.00 31.09 C ATOM 155 C HIS B 66 13.862 -1.926 -29.396 1.00 30.76 C ATOM 156 O HIS B 66 14.732 -2.313 -30.190 1.00 30.07 O ATOM 157 CB HIS B 66 15.025 -0.246 -27.956 1.00 31.62 C ATOM 158 CG HIS B 66 15.357 1.197 -27.752 1.00 32.40 C ATOM 159 ND1 HIS B 66 14.952 1.901 -26.640 1.00 32.56 N ATOM 160 CD2 HIS B 66 16.031 2.076 -28.533 1.00 33.68 C ATOM 161 CE1 HIS B 66 15.380 3.148 -26.730 1.00 33.24 C ATOM 162 NE2 HIS B 66 16.035 3.281 -27.870 1.00 35.21 N ATOM 163 H HIS B 66 12.168 -0.402 -27.548 1.00 0.00 H ATOM 164 N ALA B 67 12.919 -2.732 -28.912 1.00 30.08 N ATOM 165 CA ALA B 67 12.912 -4.155 -29.263 1.00 29.67 C ATOM 166 C ALA B 67 12.013 -4.452 -30.465 1.00 29.09 C ATOM 167 O ALA B 67 11.051 -3.722 -30.747 1.00 29.02 O ATOM 168 CB ALA B 67 12.504 -5.022 -28.041 1.00 29.16 C ATOM 169 H ALA B 67 12.185 -2.350 -28.282 1.00 0.00 H ATOM 170 N GLU B 68 12.328 -5.543 -31.150 1.00 28.65 N ATOM 171 CA GLU B 68 11.512 -6.049 -32.238 1.00 28.58 C ATOM 172 C GLU B 68 10.349 -6.909 -31.698 1.00 28.47 C ATOM 173 O GLU B 68 10.577 -7.896 -30.982 1.00 28.17 O ATOM 174 CB GLU B 68 12.390 -6.855 -33.191 1.00 28.44 C ATOM 175 CG GLU B 68 11.699 -7.284 -34.479 1.00 29.40 C ATOM 176 CD GLU B 68 12.574 -8.197 -35.307 1.00 30.72 C ATOM 177 OE1 GLU B 68 13.607 -7.717 -35.846 1.00 30.02 O ATOM 178 OE2 GLU B 68 12.234 -9.403 -35.411 1.00 32.56 O ATOM 179 H GLU B 68 13.196 -6.057 -30.897 1.00 0.00 H ATOM 180 N PRO B 69 9.095 -6.536 -32.037 1.00 28.43 N ATOM 181 CA PRO B 69 7.953 -7.353 -31.613 1.00 28.22 C ATOM 182 C PRO B 69 8.103 -8.797 -32.098 1.00 28.02 C ATOM 183 O PRO B 69 8.620 -9.028 -33.203 1.00 27.67 O ATOM 184 CB PRO B 69 6.755 -6.688 -32.301 1.00 28.64 C ATOM 185 CG PRO B 69 7.218 -5.332 -32.723 1.00 28.18 C ATOM 186 CD PRO B 69 8.692 -5.356 -32.830 1.00 28.46 C ATOM 187 N GLY B 70 7.671 -9.746 -31.273 1.00 27.46 N ATOM 188 CA GLY B 70 7.675 -11.160 -31.638 1.00 27.34 C ATOM 189 C GLY B 70 9.051 -11.786 -31.537 1.00 27.59 C ATOM 190 O GLY B 70 9.233 -12.974 -31.831 1.00 27.78 O ATOM 191 H GLY B 70 7.318 -9.471 -30.334 1.00 0.00 H ATOM 192 N ASN B 71 10.026 -10.983 -31.129 1.00 27.46 N ATOM 193 CA ASN B 71 11.403 -11.422 -31.060 1.00 28.00 C ATOM 194 C ASN B 71 11.814 -11.463 -29.580 1.00 27.55 C ATOM 195 O ASN B 71 12.273 -10.459 -29.026 1.00 27.47 O ATOM 196 CB ASN B 71 12.286 -10.483 -31.900 1.00 27.85 C ATOM 197 CG ASN B 71 13.705 -10.997 -32.084 1.00 30.54 C ATOM 198 OD1 ASN B 71 14.261 -11.681 -31.220 1.00 34.16 O ATOM 199 ND2 ASN B 71 14.309 -10.652 -33.212 1.00 32.06 N ATOM 200 HD22 ASN B 71 13.806 -10.074 -33.916 1.00 0.00 H ATOM 201 HD21 ASN B 71 15.286 -10.959 -33.394 1.00 0.00 H ATOM 202 H ASN B 71 9.793 -10.008 -30.850 1.00 0.00 H ATOM 203 N ALA B 72 11.612 -12.618 -28.940 1.00 27.46 N ATOM 204 CA ALA B 72 11.899 -12.779 -27.492 1.00 27.56 C ATOM 205 C ALA B 72 13.332 -12.358 -27.097 1.00 27.55 C ATOM 206 O ALA B 72 13.527 -11.690 -26.083 1.00 27.18 O ATOM 207 CB ALA B 72 11.603 -14.221 -27.029 1.00 27.32 C ATOM 208 H ALA B 72 11.242 -13.431 -29.473 1.00 0.00 H ATOM 209 N GLN B 73 14.319 -12.736 -27.907 1.00 27.66 N ATOM 210 CA GLN B 73 15.723 -12.387 -27.628 1.00 28.82 C ATOM 211 C GLN B 73 15.968 -10.877 -27.632 1.00 28.35 C ATOM 212 O GLN B 73 16.728 -10.347 -26.810 1.00 28.27 O ATOM 213 CB GLN B 73 16.655 -13.081 -28.624 1.00 29.33 C ATOM 214 CG GLN B 73 18.111 -12.980 -28.274 1.00 32.57 C ATOM 215 CD GLN B 73 18.988 -13.094 -29.494 1.00 38.04 C ATOM 216 OE1 GLN B 73 19.372 -14.194 -29.902 1.00 41.11 O ATOM 217 NE2 GLN B 73 19.307 -11.953 -30.097 1.00 39.51 N ATOM 218 HE22 GLN B 73 18.960 -11.049 -29.717 1.00 0.00 H ATOM 219 HE21 GLN B 73 19.903 -11.964 -30.949 1.00 0.00 H ATOM 220 H GLN B 73 14.093 -13.291 -28.757 1.00 0.00 H ATOM 221 N SER B 74 15.301 -10.199 -28.562 1.00 28.18 N ATOM 222 CA SER B 74 15.313 -8.746 -28.669 1.00 27.70 C ATOM 223 C SER B 74 14.749 -8.060 -27.420 1.00 27.47 C ATOM 224 O SER B 74 15.301 -7.060 -26.956 1.00 27.42 O ATOM 225 CB SER B 74 14.498 -8.330 -29.900 1.00 27.82 C ATOM 226 OG SER B 74 14.694 -6.962 -30.192 1.00 28.62 O ATOM 227 HG SER B 74 14.160 -6.716 -30.988 1.00 0.00 H ATOM 228 H SER B 74 14.739 -10.737 -29.252 1.00 0.00 H ATOM 229 N VAL B 75 13.639 -8.586 -26.891 1.00 27.31 N ATOM 230 CA VAL B 75 13.013 -8.044 -25.674 1.00 26.60 C ATOM 231 C VAL B 75 13.970 -8.190 -24.469 1.00 26.52 C ATOM 232 O VAL B 75 14.232 -7.227 -23.748 1.00 26.40 O ATOM 233 CB VAL B 75 11.616 -8.694 -25.421 1.00 27.37 C ATOM 234 CG1 VAL B 75 11.046 -8.338 -24.016 1.00 25.42 C ATOM 235 CG2 VAL B 75 10.629 -8.306 -26.532 1.00 26.08 C ATOM 236 H VAL B 75 13.202 -9.407 -27.356 1.00 0.00 H ATOM 237 N LEU B 76 14.537 -9.383 -24.311 1.00 26.02 N ATOM 238 CA LEU B 76 15.464 -9.675 -23.219 1.00 25.80 C ATOM 239 C LEU B 76 16.732 -8.792 -23.262 1.00 26.19 C ATOM 240 O LEU B 76 17.143 -8.262 -22.231 1.00 26.21 O ATOM 241 CB LEU B 76 15.829 -11.172 -23.208 1.00 24.93 C ATOM 242 CG LEU B 76 14.671 -12.186 -23.126 1.00 24.27 C ATOM 243 CD1 LEU B 76 15.119 -13.585 -23.503 1.00 20.86 C ATOM 244 CD2 LEU B 76 13.972 -12.172 -21.766 1.00 21.00 C ATOM 245 H LEU B 76 14.312 -10.137 -24.991 1.00 0.00 H ATOM 246 N GLU B 77 17.335 -8.637 -24.447 1.00 26.12 N ATOM 247 CA GLU B 77 18.481 -7.738 -24.625 1.00 26.72 C ATOM 248 C GLU B 77 18.159 -6.301 -24.267 1.00 25.95 C ATOM 249 O GLU B 77 18.960 -5.635 -23.606 1.00 26.53 O ATOM 250 CB GLU B 77 19.007 -7.804 -26.056 1.00 27.23 C ATOM 251 CG GLU B 77 19.714 -9.113 -26.357 1.00 32.01 C ATOM 252 CD GLU B 77 19.980 -9.339 -27.838 1.00 37.19 C ATOM 253 OE1 GLU B 77 19.844 -8.383 -28.644 1.00 40.27 O ATOM 254 OE2 GLU B 77 20.323 -10.488 -28.186 1.00 38.33 O ATOM 255 H GLU B 77 16.980 -9.170 -25.267 1.00 0.00 H ATOM 256 N ALA B 78 16.992 -5.819 -24.700 1.00 25.39 N ATOM 257 CA ALA B 78 16.565 -4.469 -24.365 1.00 25.15 C ATOM 258 C ALA B 78 16.369 -4.251 -22.849 1.00 25.22 C ATOM 259 O ALA B 78 16.822 -3.235 -22.314 1.00 25.60 O ATOM 260 CB ALA B 78 15.303 -4.071 -25.161 1.00 24.75 C ATOM 261 H ALA B 78 16.377 -6.419 -25.287 1.00 0.00 H ATOM 262 N ILE B 79 15.698 -5.183 -22.164 1.00 25.13 N ATOM 263 CA ILE B 79 15.541 -5.105 -20.695 1.00 24.60 C ATOM 264 C ILE B 79 16.909 -5.117 -20.000 1.00 24.85 C ATOM 265 O ILE B 79 17.175 -4.292 -19.112 1.00 24.06 O ATOM 266 CB ILE B 79 14.664 -6.262 -20.111 1.00 24.84 C ATOM 267 CG1 ILE B 79 13.248 -6.233 -20.677 1.00 22.38 C ATOM 268 CG2 ILE B 79 14.615 -6.189 -18.572 1.00 24.96 C ATOM 269 CD1 ILE B 79 12.448 -7.478 -20.402 1.00 24.24 C ATOM 270 H ILE B 79 15.276 -5.983 -22.677 1.00 0.00 H ATOM 271 N ASP B 80 17.778 -6.037 -20.425 1.00 25.28 N ATOM 272 CA ASP B 80 19.101 -6.177 -19.820 1.00 26.20 C ATOM 273 C ASP B 80 19.958 -4.925 -20.013 1.00 27.01 C ATOM 274 O ASP B 80 20.596 -4.450 -19.063 1.00 27.37 O ATOM 275 CB ASP B 80 19.814 -7.442 -20.322 1.00 25.82 C ATOM 276 CG ASP B 80 19.315 -8.708 -19.621 1.00 26.58 C ATOM 277 OD1 ASP B 80 18.900 -8.615 -18.436 1.00 28.40 O ATOM 278 OD2 ASP B 80 19.321 -9.790 -20.245 1.00 23.81 O ATOM 279 H ASP B 80 17.507 -6.669 -21.205 1.00 0.00 H ATOM 280 N THR B 81 19.941 -4.376 -21.226 1.00 27.83 N ATOM 281 CA THR B 81 20.680 -3.142 -21.546 1.00 28.81 C ATOM 282 C THR B 81 20.231 -1.972 -20.672 1.00 28.76 C ATOM 283 O THR B 81 21.060 -1.258 -20.102 1.00 29.11 O ATOM 284 CB THR B 81 20.515 -2.768 -23.042 1.00 29.30 C ATOM 285 OG1 THR B 81 21.008 -3.845 -23.854 1.00 29.63 O ATOM 286 CG2 THR B 81 21.268 -1.481 -23.376 1.00 29.86 C ATOM 287 HG1 THR B 81 20.493 -4.667 -23.657 1.00 0.00 H ATOM 288 H THR B 81 19.385 -4.835 -21.976 1.00 0.00 H ATOM 289 N TYR B 82 18.921 -1.782 -20.559 1.00 28.66 N ATOM 290 CA TYR B 82 18.396 -0.697 -19.738 1.00 28.80 C ATOM 291 C TYR B 82 18.774 -0.864 -18.262 1.00 28.51 C ATOM 292 O TYR B 82 19.142 0.102 -17.597 1.00 27.93 O ATOM 293 CB TYR B 82 16.881 -0.568 -19.900 1.00 28.63 C ATOM 294 CG TYR B 82 16.297 0.609 -19.144 1.00 29.27 C ATOM 295 CD1 TYR B 82 16.147 1.858 -19.760 1.00 28.53 C ATOM 296 CD2 TYR B 82 15.902 0.477 -17.803 1.00 29.29 C ATOM 297 CE1 TYR B 82 15.612 2.936 -19.060 1.00 28.44 C ATOM 298 CE2 TYR B 82 15.377 1.543 -17.097 1.00 28.81 C ATOM 299 CZ TYR B 82 15.226 2.770 -17.731 1.00 28.92 C ATOM 300 OH TYR B 82 14.704 3.821 -17.024 1.00 28.39 O ATOM 301 HH TYR B 82 15.283 4.012 -16.244 1.00 0.00 H ATOM 302 H TYR B 82 18.264 -2.413 -21.061 1.00 0.00 H ATOM 303 N CYS B 83 18.682 -2.091 -17.759 1.00 28.62 N ATOM 304 CA CYS B 83 18.953 -2.352 -16.352 1.00 28.85 C ATOM 305 C CYS B 83 20.443 -2.352 -16.010 1.00 30.00 C ATOM 306 O CYS B 83 20.810 -1.987 -14.895 1.00 29.99 O ATOM 307 CB CYS B 83 18.259 -3.636 -15.888 1.00 28.42 C ATOM 308 SG CYS B 83 16.466 -3.545 -16.048 1.00 25.60 S ATOM 309 H CYS B 83 18.412 -2.879 -18.382 1.00 0.00 H ATOM 310 N GLU B 84 21.284 -2.761 -16.966 1.00 31.47 N ATOM 311 CA GLU B 84 22.742 -2.614 -16.866 1.00 33.03 C ATOM 312 C GLU B 84 23.162 -1.141 -16.856 1.00 33.30 C ATOM 313 O GLU B 84 24.051 -0.745 -16.098 1.00 32.93 O ATOM 314 CB GLU B 84 23.451 -3.283 -18.057 1.00 33.84 C ATOM 315 CG GLU B 84 23.741 -4.775 -17.949 1.00 37.16 C ATOM 316 CD GLU B 84 24.875 -5.112 -16.972 1.00 41.68 C ATOM 317 OE1 GLU B 84 25.452 -4.179 -16.361 1.00 43.93 O ATOM 318 OE2 GLU B 84 25.186 -6.320 -16.816 1.00 41.73 O ATOM 319 H GLU B 84 20.887 -3.204 -17.820 1.00 0.00 H ATOM 320 N GLN B 85 22.518 -0.339 -17.702 1.00 33.56 N ATOM 321 CA GLN B 85 22.994 1.012 -18.009 1.00 34.53 C ATOM 322 C GLN B 85 22.294 2.166 -17.303 1.00 33.92 C ATOM 323 O GLN B 85 22.914 3.204 -17.092 1.00 34.57 O ATOM 324 CB GLN B 85 22.986 1.240 -19.529 1.00 34.33 C ATOM 325 CG GLN B 85 24.152 0.541 -20.245 1.00 35.31 C ATOM 326 CD GLN B 85 24.038 0.599 -21.758 1.00 36.90 C ATOM 327 OE1 GLN B 85 23.194 1.318 -22.316 1.00 39.71 O ATOM 328 NE2 GLN B 85 24.885 -0.171 -22.438 1.00 40.15 N ATOM 329 HE22 GLN B 85 25.577 -0.758 -21.930 1.00 0.00 H ATOM 330 HE21 GLN B 85 24.855 -0.185 -23.477 1.00 0.00 H ATOM 331 H GLN B 85 21.649 -0.683 -18.159 1.00 0.00 H ATOM 332 N LYS B 86 21.025 1.987 -16.927 1.00 33.71 N ATOM 333 CA LYS B 86 20.188 3.084 -16.404 1.00 33.12 C ATOM 334 C LYS B 86 19.586 2.828 -15.023 1.00 32.05 C ATOM 335 O LYS B 86 19.820 3.607 -14.098 1.00 32.10 O ATOM 336 CB LYS B 86 19.078 3.447 -17.404 1.00 33.81 C ATOM 337 CG LYS B 86 19.581 4.017 -18.744 1.00 36.66 C ATOM 338 CD LYS B 86 19.844 5.532 -18.658 1.00 38.46 C ATOM 339 CE LYS B 86 20.120 6.138 -20.051 1.00 40.07 C ATOM 340 NZ LYS B 86 19.970 7.667 -20.113 1.00 40.59 N ATOM 341 HZ1 LYS B 86 18.998 7.930 -19.852 1.00 0.00 H ATOM 342 HZ2 LYS B 86 20.639 8.107 -19.450 1.00 0.00 H ATOM 343 HZ3 LYS B 86 20.171 7.995 -21.079 1.00 0.00 H ATOM 344 H LYS B 86 20.610 1.037 -17.006 1.00 0.00 H ATOM 345 N GLU B 87 18.794 1.761 -14.883 1.00 30.61 N ATOM 346 CA GLU B 87 18.182 1.421 -13.587 1.00 29.06 C ATOM 347 C GLU B 87 18.270 -0.061 -13.310 1.00 27.78 C ATOM 348 O GLU B 87 17.612 -0.858 -13.989 1.00 26.88 O ATOM 349 CB GLU B 87 16.711 1.830 -13.517 1.00 29.51 C ATOM 350 CG GLU B 87 16.421 3.274 -13.879 1.00 30.55 C ATOM 351 CD GLU B 87 14.992 3.642 -13.614 1.00 31.41 C ATOM 352 OE1 GLU B 87 14.660 3.898 -12.440 1.00 31.12 O ATOM 353 OE2 GLU B 87 14.198 3.694 -14.578 1.00 33.15 O ATOM 354 H GLU B 87 18.605 1.157 -15.708 1.00 0.00 H ATOM 355 N TRP B 88 19.086 -0.422 -12.314 1.00 26.20 N ATOM 356 CA TRP B 88 19.096 -1.780 -11.773 1.00 24.22 C ATOM 357 C TRP B 88 17.668 -2.233 -11.487 1.00 23.46 C ATOM 358 O TRP B 88 16.860 -1.468 -10.965 1.00 23.29 O ATOM 359 CB TRP B 88 19.957 -1.875 -10.501 1.00 23.45 C ATOM 360 CG TRP B 88 20.126 -3.315 -10.041 1.00 21.92 C ATOM 361 CD1 TRP B 88 21.132 -4.187 -10.390 1.00 21.28 C ATOM 362 CD2 TRP B 88 19.234 -4.048 -9.197 1.00 20.58 C ATOM 363 NE1 TRP B 88 20.921 -5.416 -9.804 1.00 20.04 N ATOM 364 CE2 TRP B 88 19.767 -5.358 -9.060 1.00 21.83 C ATOM 365 CE3 TRP B 88 18.028 -3.729 -8.538 1.00 21.44 C ATOM 366 CZ2 TRP B 88 19.134 -6.351 -8.281 1.00 20.25 C ATOM 367 CZ3 TRP B 88 17.397 -4.721 -7.770 1.00 21.48 C ATOM 368 CH2 TRP B 88 17.958 -6.017 -7.656 1.00 21.03 C ATOM 369 HE1 TRP B 88 21.534 -6.250 -9.908 1.00 0.00 H ATOM 370 H TRP B 88 19.734 0.285 -11.912 1.00 0.00 H ATOM 371 N ALA B 89 17.353 -3.466 -11.876 1.00 22.68 N ATOM 372 CA ALA B 89 16.073 -4.097 -11.548 1.00 22.08 C ATOM 373 C ALA B 89 16.281 -5.595 -11.304 1.00 21.72 C ATOM 374 O ALA B 89 17.301 -6.162 -11.713 1.00 21.35 O ATOM 375 CB ALA B 89 15.021 -3.842 -12.626 1.00 21.72 C ATOM 376 H ALA B 89 18.045 -4.004 -12.436 1.00 0.00 H ATOM 377 N MET B 90 15.326 -6.217 -10.610 1.00 21.44 N ATOM 378 CA MET B 90 15.495 -7.580 -10.109 1.00 21.62 C ATOM 379 C MET B 90 15.109 -8.648 -11.129 1.00 21.67 C ATOM 380 O MET B 90 14.527 -9.659 -10.761 1.00 21.58 O ATOM 381 CB MET B 90 14.733 -7.781 -8.782 1.00 21.74 C ATOM 382 CG MET B 90 13.279 -7.395 -8.784 1.00 21.65 C ATOM 383 SD MET B 90 12.492 -7.417 -7.148 1.00 22.38 S ATOM 384 CE MET B 90 10.883 -6.753 -7.548 1.00 21.16 C ATOM 385 H MET B 90 14.434 -5.717 -10.420 1.00 0.00 H ATOM 386 N ASN B 91 15.415 -8.411 -12.408 1.00 21.40 N ATOM 387 CA ASN B 91 15.258 -9.442 -13.434 1.00 21.36 C ATOM 388 C ASN B 91 16.368 -10.453 -13.229 1.00 21.37 C ATOM 389 O ASN B 91 17.468 -10.079 -12.861 1.00 22.30 O ATOM 390 CB ASN B 91 15.342 -8.855 -14.857 1.00 21.13 C ATOM 391 CG ASN B 91 14.586 -7.548 -15.007 1.00 20.32 C ATOM 392 OD1 ASN B 91 13.373 -7.494 -14.833 1.00 21.18 O ATOM 393 ND2 ASN B 91 15.308 -6.480 -15.333 1.00 18.31 N ATOM 394 HD22 ASN B 91 16.335 -6.569 -15.472 1.00 0.00 H ATOM 395 HD21 ASN B 91 14.846 -5.556 -15.449 1.00 0.00 H ATOM 396 H ASN B 91 15.773 -7.473 -12.680 1.00 0.00 H ATOM 397 N VAL B 92 16.101 -11.731 -13.453 1.00 22.24 N ATOM 398 CA VAL B 92 17.150 -12.755 -13.322 1.00 22.70 C ATOM 399 C VAL B 92 18.391 -12.412 -14.174 1.00 22.88 C ATOM 400 O VAL B 92 19.535 -12.728 -13.796 1.00 22.93 O ATOM 401 CB VAL B 92 16.593 -14.222 -13.540 1.00 22.97 C ATOM 402 CG1 VAL B 92 16.231 -14.508 -15.017 1.00 22.79 C ATOM 403 CG2 VAL B 92 17.569 -15.248 -12.993 1.00 22.85 C ATOM 404 H VAL B 92 15.138 -12.014 -13.725 1.00 0.00 H ATOM 405 N GLY B 93 18.173 -11.721 -15.297 1.00 22.99 N ATOM 406 CA GLY B 93 19.291 -11.161 -16.066 1.00 22.85 C ATOM 407 C GLY B 93 19.910 -12.198 -16.964 1.00 23.40 C ATOM 408 O GLY B 93 19.515 -13.363 -16.926 1.00 22.89 O ATOM 409 H GLY B 93 17.198 -11.578 -15.631 1.00 0.00 H ATOM 410 N ASP B 94 20.886 -11.780 -17.768 1.00 24.01 N ATOM 411 CA ASP B 94 21.415 -12.620 -18.840 1.00 25.17 C ATOM 412 C ASP B 94 22.418 -13.678 -18.392 1.00 24.88 C ATOM 413 O ASP B 94 22.433 -14.770 -18.948 1.00 25.55 O ATOM 414 CB ASP B 94 22.047 -11.781 -19.964 1.00 26.07 C ATOM 415 CG ASP B 94 22.430 -12.639 -21.176 1.00 30.09 C ATOM 416 OD1 ASP B 94 21.515 -13.125 -21.879 1.00 33.44 O ATOM 417 OD2 ASP B 94 23.645 -12.864 -21.409 1.00 35.85 O ATOM 418 H ASP B 94 21.283 -10.829 -17.629 1.00 0.00 H ATOM 419 N LYS B 95 23.259 -13.350 -17.414 1.00 24.32 N ATOM 420 CA LYS B 95 24.250 -14.294 -16.885 1.00 24.29 C ATOM 421 C LYS B 95 23.558 -15.478 -16.182 1.00 23.24 C ATOM 422 O LYS B 95 23.806 -16.632 -16.522 1.00 24.02 O ATOM 423 CB LYS B 95 25.207 -13.573 -15.928 1.00 24.47 C ATOM 424 CG LYS B 95 26.652 -14.003 -16.019 1.00 28.63 C ATOM 425 CD LYS B 95 27.436 -13.518 -14.800 1.00 35.57 C ATOM 426 CE LYS B 95 28.737 -12.769 -15.179 1.00 39.33 C ATOM 427 NZ LYS B 95 29.917 -13.685 -15.339 1.00 42.39 N ATOM 428 HZ1 LYS B 95 30.090 -14.186 -14.444 1.00 0.00 H ATOM 429 HZ2 LYS B 95 29.719 -14.375 -16.091 1.00 0.00 H ATOM 430 HZ3 LYS B 95 30.757 -13.126 -15.592 1.00 0.00 H ATOM 431 H LYS B 95 23.212 -12.392 -17.011 1.00 0.00 H ATOM 432 N LYS B 96 22.685 -15.200 -15.214 1.00 21.90 N ATOM 433 CA LYS B 96 21.949 -16.273 -14.535 1.00 20.83 C ATOM 434 C LYS B 96 20.870 -16.856 -15.469 1.00 20.78 C ATOM 435 O LYS B 96 20.534 -18.033 -15.362 1.00 19.85 O ATOM 436 CB LYS B 96 21.350 -15.796 -13.202 1.00 20.49 C ATOM 437 CG LYS B 96 22.393 -15.471 -12.120 1.00 20.04 C ATOM 438 CD LYS B 96 21.766 -15.184 -10.762 1.00 19.86 C ATOM 439 CE LYS B 96 20.965 -13.883 -10.778 1.00 19.79 C ATOM 440 NZ LYS B 96 20.222 -13.676 -9.519 1.00 19.37 N ATOM 441 HZ1 LYS B 96 19.559 -14.465 -9.375 1.00 0.00 H ATOM 442 HZ2 LYS B 96 20.892 -13.636 -8.725 1.00 0.00 H ATOM 443 HZ3 LYS B 96 19.693 -12.782 -9.573 1.00 0.00 H ATOM 444 H LYS B 96 22.523 -14.211 -14.936 1.00 0.00 H ATOM 445 N GLY B 97 20.355 -16.021 -16.385 1.00 20.55 N ATOM 446 CA GLY B 97 19.493 -16.475 -17.487 1.00 21.31 C ATOM 447 C GLY B 97 20.009 -17.675 -18.270 1.00 21.84 C ATOM 448 O GLY B 97 19.228 -18.541 -18.641 1.00 22.60 O ATOM 449 H GLY B 97 20.575 -15.007 -16.312 1.00 0.00 H ATOM 450 N LYS B 98 21.318 -17.745 -18.505 1.00 22.82 N ATOM 451 CA LYS B 98 21.926 -18.883 -19.226 1.00 23.99 C ATOM 452 C LYS B 98 21.860 -20.200 -18.455 1.00 23.92 C ATOM 453 O LYS B 98 21.691 -21.273 -19.059 1.00 24.22 O ATOM 454 CB LYS B 98 23.383 -18.580 -19.586 1.00 24.47 C ATOM 455 CG LYS B 98 23.537 -17.484 -20.627 1.00 27.07 C ATOM 456 CD LYS B 98 24.999 -17.152 -20.839 1.00 30.56 C ATOM 457 CE LYS B 98 25.173 -16.191 -22.001 1.00 32.91 C ATOM 458 NZ LYS B 98 26.454 -15.437 -21.817 1.00 36.54 N ATOM 459 HZ1 LYS B 98 26.417 -14.907 -20.923 1.00 0.00 H ATOM 460 HZ2 LYS B 98 27.249 -16.107 -21.792 1.00 0.00 H ATOM 461 HZ3 LYS B 98 26.582 -14.775 -22.609 1.00 0.00 H ATOM 462 H LYS B 98 21.932 -16.975 -18.171 1.00 0.00 H ATOM 463 N ILE B 99 21.998 -20.107 -17.128 1.00 23.55 N ATOM 464 CA ILE B 99 21.757 -21.231 -16.225 1.00 23.26 C ATOM 465 C ILE B 99 20.284 -21.642 -16.269 1.00 22.69 C ATOM 466 O ILE B 99 19.972 -22.827 -16.385 1.00 23.39 O ATOM 467 CB ILE B 99 22.223 -20.919 -14.762 1.00 23.56 C ATOM 468 CG1 ILE B 99 23.717 -20.569 -14.740 1.00 22.89 C ATOM 469 CG2 ILE B 99 21.913 -22.089 -13.832 1.00 22.03 C ATOM 470 CD1 ILE B 99 24.157 -19.794 -13.506 1.00 23.59 C ATOM 471 H ILE B 99 22.289 -19.195 -16.721 1.00 0.00 H ATOM 472 N VAL B 100 19.378 -20.676 -16.209 1.00 22.44 N ATOM 473 CA VAL B 100 17.951 -20.976 -16.394 1.00 22.12 C ATOM 474 C VAL B 100 17.685 -21.709 -17.747 1.00 22.16 C ATOM 475 O VAL B 100 17.055 -22.774 -17.745 1.00 21.12 O ATOM 476 CB VAL B 100 17.060 -19.716 -16.233 1.00 22.95 C ATOM 477 CG1 VAL B 100 15.600 -20.020 -16.625 1.00 21.91 C ATOM 478 CG2 VAL B 100 17.129 -19.160 -14.782 1.00 22.48 C ATOM 479 H VAL B 100 19.680 -19.697 -16.029 1.00 0.00 H ATOM 480 N ASP B 101 18.190 -21.147 -18.859 1.00 21.87 N ATOM 481 CA ASP B 101 18.163 -21.783 -20.194 1.00 22.64 C ATOM 482 C ASP B 101 18.637 -23.239 -20.142 1.00 22.48 C ATOM 483 O ASP B 101 17.939 -24.151 -20.589 1.00 23.16 O ATOM 484 CB ASP B 101 19.075 -21.043 -21.227 1.00 22.71 C ATOM 485 CG ASP B 101 18.579 -19.641 -21.613 1.00 24.86 C ATOM 486 OD1 ASP B 101 17.490 -19.204 -21.166 1.00 25.11 O ATOM 487 OD2 ASP B 101 19.312 -18.962 -22.388 1.00 27.67 O ATOM 488 H ASP B 101 18.627 -20.207 -18.775 1.00 0.00 H ATOM 489 N ALA B 102 19.837 -23.446 -19.609 1.00 22.21 N ATOM 490 CA ALA B 102 20.445 -24.779 -19.580 1.00 22.58 C ATOM 491 C ALA B 102 19.586 -25.793 -18.824 1.00 22.62 C ATOM 492 O ALA B 102 19.482 -26.937 -19.241 1.00 22.89 O ATOM 493 CB ALA B 102 21.866 -24.713 -18.978 1.00 22.15 C ATOM 494 H ALA B 102 20.357 -22.642 -19.203 1.00 0.00 H ATOM 495 N VAL B 103 18.975 -25.366 -17.714 1.00 22.48 N ATOM 496 CA VAL B 103 18.065 -26.230 -16.957 1.00 22.46 C ATOM 497 C VAL B 103 16.816 -26.601 -17.781 1.00 22.92 C ATOM 498 O VAL B 103 16.431 -27.763 -17.838 1.00 23.06 O ATOM 499 CB VAL B 103 17.683 -25.610 -15.575 1.00 22.09 C ATOM 500 CG1 VAL B 103 16.631 -26.464 -14.866 1.00 21.40 C ATOM 501 CG2 VAL B 103 18.944 -25.416 -14.684 1.00 20.38 C ATOM 502 H VAL B 103 19.150 -24.397 -17.380 1.00 0.00 H ATOM 503 N ILE B 104 16.202 -25.614 -18.422 1.00 23.69 N ATOM 504 CA ILE B 104 15.057 -25.857 -19.294 1.00 24.72 C ATOM 505 C ILE B 104 15.437 -26.776 -20.474 1.00 25.92 C ATOM 506 O ILE B 104 14.705 -27.702 -20.787 1.00 25.83 O ATOM 507 CB ILE B 104 14.434 -24.516 -19.810 1.00 24.98 C ATOM 508 CG1 ILE B 104 14.015 -23.628 -18.621 1.00 23.59 C ATOM 509 CG2 ILE B 104 13.361 -24.762 -20.897 1.00 23.49 C ATOM 510 CD1 ILE B 104 12.639 -23.136 -18.642 1.00 22.37 C ATOM 511 H ILE B 104 16.546 -24.640 -18.299 1.00 0.00 H ATOM 512 N GLN B 105 16.588 -26.539 -21.095 1.00 26.93 N ATOM 513 CA GLN B 105 17.009 -27.354 -22.242 1.00 29.39 C ATOM 514 C GLN B 105 17.353 -28.806 -21.878 1.00 29.65 C ATOM 515 O GLN B 105 17.179 -29.719 -22.695 1.00 29.70 O ATOM 516 CB GLN B 105 18.166 -26.679 -22.989 1.00 29.19 C ATOM 517 CG GLN B 105 17.737 -25.394 -23.719 1.00 30.84 C ATOM 518 CD GLN B 105 18.912 -24.567 -24.231 1.00 32.62 C ATOM 519 OE1 GLN B 105 19.852 -24.225 -23.482 1.00 37.22 O ATOM 520 NE2 GLN B 105 18.861 -24.226 -25.518 1.00 35.74 N ATOM 521 HE22 GLN B 105 18.060 -24.532 -26.106 1.00 0.00 H ATOM 522 HE21 GLN B 105 19.623 -23.654 -25.935 1.00 0.00 H ATOM 523 H GLN B 105 17.199 -25.765 -20.764 1.00 0.00 H ATOM 524 N GLU B 106 17.839 -29.023 -20.657 1.00 29.99 N ATOM 525 CA GLU B 106 18.111 -30.376 -20.199 1.00 30.34 C ATOM 526 C GLU B 106 16.810 -31.107 -19.854 1.00 30.40 C ATOM 527 O GLU B 106 16.584 -32.225 -20.309 1.00 31.03 O ATOM 528 CB GLU B 106 19.073 -30.386 -19.009 1.00 30.07 C ATOM 529 CG GLU B 106 19.304 -31.789 -18.455 1.00 31.16 C ATOM 530 CD GLU B 106 20.203 -31.823 -17.242 1.00 31.67 C ATOM 531 OE1 GLU B 106 20.819 -30.786 -16.913 1.00 34.37 O ATOM 532 OE2 GLU B 106 20.317 -32.908 -16.626 1.00 34.69 O ATOM 533 H GLU B 106 18.026 -28.218 -20.026 1.00 0.00 H ATOM 534 N HIS B 107 15.935 -30.476 -19.079 1.00 30.05 N ATOM 535 CA HIS B 107 14.798 -31.207 -18.535 1.00 29.61 C ATOM 536 C HIS B 107 13.533 -31.129 -19.372 1.00 30.02 C ATOM 537 O HIS B 107 12.617 -31.943 -19.187 1.00 29.90 O ATOM 538 CB HIS B 107 14.555 -30.813 -17.073 1.00 28.66 C ATOM 539 CG HIS B 107 15.708 -31.155 -16.176 1.00 28.29 C ATOM 540 ND1 HIS B 107 15.981 -32.448 -15.770 1.00 25.41 N ATOM 541 CD2 HIS B 107 16.679 -30.378 -15.638 1.00 24.25 C ATOM 542 CE1 HIS B 107 17.057 -32.446 -15.004 1.00 24.75 C ATOM 543 NE2 HIS B 107 17.495 -31.202 -14.906 1.00 24.84 N ATOM 544 H HIS B 107 16.061 -29.467 -18.862 1.00 0.00 H ATOM 545 N GLN B 108 13.486 -30.139 -20.266 1.00 30.36 N ATOM 546 CA GLN B 108 12.421 -29.982 -21.261 1.00 30.94 C ATOM 547 C GLN B 108 11.013 -30.082 -20.664 1.00 30.17 C ATOM 548 O GLN B 108 10.231 -30.974 -21.041 1.00 30.02 O ATOM 549 CB GLN B 108 12.618 -30.985 -22.406 1.00 30.96 C ATOM 550 CG GLN B 108 13.790 -30.635 -23.343 1.00 32.80 C ATOM 551 CD GLN B 108 14.202 -31.789 -24.266 1.00 33.76 C ATOM 552 OE1 GLN B 108 15.215 -31.705 -24.968 1.00 38.32 O ATOM 553 NE2 GLN B 108 13.427 -32.873 -24.258 1.00 36.47 N ATOM 554 HE22 GLN B 108 12.582 -32.904 -23.652 1.00 0.00 H ATOM 555 HE21 GLN B 108 13.667 -33.688 -24.858 1.00 0.00 H ATOM 556 H GLN B 108 14.252 -29.436 -20.256 1.00 0.00 H ATOM 557 N PRO B 109 10.685 -29.163 -19.728 1.00 29.53 N ATOM 558 CA PRO B 109 9.382 -29.164 -19.049 1.00 28.84 C ATOM 559 C PRO B 109 8.216 -28.792 -19.978 1.00 28.93 C ATOM 560 O PRO B 109 8.366 -27.938 -20.866 1.00 29.07 O ATOM 561 CB PRO B 109 9.562 -28.095 -17.960 1.00 28.91 C ATOM 562 CG PRO B 109 10.632 -27.167 -18.514 1.00 27.94 C ATOM 563 CD PRO B 109 11.556 -28.058 -19.265 1.00 28.88 C ATOM 564 N SER B 110 7.059 -29.417 -19.760 1.00 28.49 N ATOM 565 CA SER B 110 5.852 -29.094 -20.520 1.00 28.08 C ATOM 566 C SER B 110 4.872 -28.315 -19.667 1.00 27.65 C ATOM 567 O SER B 110 4.078 -27.523 -20.185 1.00 27.81 O ATOM 568 CB SER B 110 5.192 -30.368 -21.055 1.00 28.30 C ATOM 569 OG SER B 110 6.059 -31.010 -21.980 1.00 29.55 O ATOM 570 HG SER B 110 5.625 -31.832 -22.321 1.00 0.00 H ATOM 571 H SER B 110 7.013 -30.155 -19.029 1.00 0.00 H ATOM 572 N VAL B 111 4.925 -28.555 -18.357 1.00 26.75 N ATOM 573 CA VAL B 111 4.137 -27.797 -17.400 1.00 26.27 C ATOM 574 C VAL B 111 5.100 -27.100 -16.448 1.00 25.60 C ATOM 575 O VAL B 111 5.683 -27.731 -15.554 1.00 25.53 O ATOM 576 CB VAL B 111 3.128 -28.677 -16.622 1.00 26.51 C ATOM 577 CG1 VAL B 111 2.253 -27.805 -15.726 1.00 26.78 C ATOM 578 CG2 VAL B 111 2.261 -29.492 -17.589 1.00 26.96 C ATOM 579 H VAL B 111 5.551 -29.309 -18.009 1.00 0.00 H ATOM 580 N LEU B 112 5.272 -25.800 -16.652 1.00 24.44 N ATOM 581 CA LEU B 112 6.220 -25.030 -15.871 1.00 23.88 C ATOM 582 C LEU B 112 5.471 -24.019 -15.007 1.00 23.71 C ATOM 583 O LEU B 112 4.477 -23.440 -15.455 1.00 24.30 O ATOM 584 CB LEU B 112 7.262 -24.379 -16.803 1.00 23.35 C ATOM 585 CG LEU B 112 8.229 -23.277 -16.330 1.00 24.79 C ATOM 586 CD1 LEU B 112 9.136 -23.670 -15.135 1.00 22.76 C ATOM 587 CD2 LEU B 112 9.081 -22.776 -17.503 1.00 23.92 C ATOM 588 H LEU B 112 4.714 -25.323 -17.389 1.00 0.00 H ATOM 589 N LEU B 113 5.934 -23.834 -13.768 1.00 22.79 N ATOM 590 CA LEU B 113 5.377 -22.853 -12.848 1.00 22.33 C ATOM 591 C LEU B 113 6.444 -21.851 -12.425 1.00 22.43 C ATOM 592 O LEU B 113 7.560 -22.225 -12.105 1.00 22.54 O ATOM 593 CB LEU B 113 4.765 -23.538 -11.608 1.00 22.17 C ATOM 594 CG LEU B 113 4.148 -22.667 -10.498 1.00 22.38 C ATOM 595 CD1 LEU B 113 2.967 -21.848 -10.991 1.00 21.40 C ATOM 596 CD2 LEU B 113 3.743 -23.467 -9.263 1.00 21.97 C ATOM 597 H LEU B 113 6.731 -24.419 -13.445 1.00 0.00 H ATOM 598 N GLU B 114 6.092 -20.570 -12.443 1.00 22.69 N ATOM 599 CA GLU B 114 6.987 -19.520 -12.004 1.00 23.09 C ATOM 600 C GLU B 114 6.343 -18.738 -10.871 1.00 22.64 C ATOM 601 O GLU B 114 5.170 -18.364 -10.949 1.00 22.04 O ATOM 602 CB GLU B 114 7.354 -18.598 -13.173 1.00 23.11 C ATOM 603 CG GLU B 114 7.802 -17.185 -12.758 1.00 24.82 C ATOM 604 CD GLU B 114 8.195 -16.313 -13.950 1.00 24.21 C ATOM 605 OE1 GLU B 114 7.398 -15.447 -14.372 1.00 25.61 O ATOM 606 OE2 GLU B 114 9.299 -16.504 -14.462 1.00 25.01 O ATOM 607 H GLU B 114 5.143 -20.313 -12.783 1.00 0.00 H ATOM 608 N LEU B 115 7.129 -18.495 -9.821 1.00 22.60 N ATOM 609 CA LEU B 115 6.677 -17.705 -8.679 1.00 22.12 C ATOM 610 C LEU B 115 7.389 -16.362 -8.673 1.00 22.14 C ATOM 611 O LEU B 115 8.583 -16.309 -8.425 1.00 22.52 O ATOM 612 CB LEU B 115 6.903 -18.477 -7.366 1.00 21.58 C ATOM 613 CG LEU B 115 6.332 -19.906 -7.365 1.00 21.09 C ATOM 614 CD1 LEU B 115 6.684 -20.668 -6.064 1.00 20.76 C ATOM 615 CD2 LEU B 115 4.806 -19.892 -7.609 1.00 20.14 C ATOM 616 H LEU B 115 8.095 -18.881 -9.815 1.00 0.00 H ATOM 617 N GLY B 116 6.644 -15.283 -8.951 1.00 22.06 N ATOM 618 CA GLY B 116 7.208 -13.940 -9.087 1.00 21.53 C ATOM 619 C GLY B 116 7.503 -13.644 -10.556 1.00 21.91 C ATOM 620 O GLY B 116 8.493 -14.131 -11.108 1.00 21.69 O ATOM 621 H GLY B 116 5.619 -15.406 -9.076 1.00 0.00 H ATOM 622 N ALA B 117 6.633 -12.863 -11.194 1.00 21.35 N ATOM 623 CA ALA B 117 6.753 -12.557 -12.626 1.00 21.04 C ATOM 624 C ALA B 117 7.422 -11.198 -12.890 1.00 21.34 C ATOM 625 O ALA B 117 8.161 -11.051 -13.881 1.00 21.29 O ATOM 626 CB ALA B 117 5.381 -12.612 -13.307 1.00 20.56 C ATOM 627 H ALA B 117 5.840 -12.455 -10.659 1.00 0.00 H ATOM 628 N TYR B 118 7.153 -10.228 -12.011 1.00 20.96 N ATOM 629 CA TYR B 118 7.718 -8.873 -12.097 1.00 21.53 C ATOM 630 C TYR B 118 7.362 -8.149 -13.427 1.00 22.41 C ATOM 631 O TYR B 118 6.184 -7.802 -13.639 1.00 22.26 O ATOM 632 CB TYR B 118 9.230 -8.890 -11.790 1.00 21.12 C ATOM 633 CG TYR B 118 9.840 -7.526 -11.570 1.00 20.29 C ATOM 634 CD1 TYR B 118 9.157 -6.544 -10.831 1.00 18.14 C ATOM 635 CD2 TYR B 118 11.099 -7.206 -12.110 1.00 19.84 C ATOM 636 CE1 TYR B 118 9.697 -5.296 -10.634 1.00 16.63 C ATOM 637 CE2 TYR B 118 11.662 -5.928 -11.918 1.00 19.11 C ATOM 638 CZ TYR B 118 10.951 -4.982 -11.190 1.00 19.36 C ATOM 639 OH TYR B 118 11.486 -3.728 -10.985 1.00 19.07 O ATOM 640 HH TYR B 118 10.854 -3.184 -10.452 1.00 0.00 H ATOM 641 H TYR B 118 6.509 -10.443 -11.223 1.00 0.00 H ATOM 642 N CYS B 119 8.340 -7.949 -14.319 1.00 22.80 N ATOM 643 CA CYS B 119 8.073 -7.294 -15.625 1.00 23.40 C ATOM 644 C CYS B 119 7.927 -8.282 -16.788 1.00 23.24 C ATOM 645 O CYS B 119 7.666 -7.885 -17.916 1.00 23.61 O ATOM 646 CB CYS B 119 9.166 -6.275 -15.955 1.00 23.62 C ATOM 647 SG CYS B 119 9.177 -4.863 -14.850 1.00 25.59 S ATOM 648 H CYS B 119 9.307 -8.259 -14.093 1.00 0.00 H ATOM 649 N GLY B 120 8.129 -9.568 -16.512 1.00 23.30 N ATOM 650 CA GLY B 120 7.956 -10.618 -17.505 1.00 22.13 C ATOM 651 C GLY B 120 9.245 -11.137 -18.086 1.00 22.10 C ATOM 652 O GLY B 120 9.221 -11.987 -18.975 1.00 22.85 O ATOM 653 H GLY B 120 8.422 -9.833 -15.550 1.00 0.00 H ATOM 654 N TYR B 121 10.375 -10.633 -17.597 1.00 21.84 N ATOM 655 CA TYR B 121 11.681 -11.001 -18.151 1.00 21.60 C ATOM 656 C TYR B 121 11.944 -12.530 -18.185 1.00 21.65 C ATOM 657 O TYR B 121 12.266 -13.084 -19.241 1.00 21.75 O ATOM 658 CB TYR B 121 12.823 -10.245 -17.442 1.00 21.34 C ATOM 659 CG TYR B 121 14.190 -10.652 -17.932 1.00 20.05 C ATOM 660 CD1 TYR B 121 14.873 -9.879 -18.877 1.00 18.97 C ATOM 661 CD2 TYR B 121 14.789 -11.840 -17.489 1.00 19.80 C ATOM 662 CE1 TYR B 121 16.130 -10.266 -19.357 1.00 18.89 C ATOM 663 CE2 TYR B 121 16.048 -12.245 -17.967 1.00 18.77 C ATOM 664 CZ TYR B 121 16.719 -11.440 -18.894 1.00 20.26 C ATOM 665 OH TYR B 121 17.967 -11.823 -19.385 1.00 21.54 O ATOM 666 HH TYR B 121 18.292 -11.141 -20.025 1.00 0.00 H ATOM 667 H TYR B 121 10.331 -9.962 -16.803 1.00 0.00 H ATOM 668 N SER B 122 11.799 -13.201 -17.041 1.00 21.11 N ATOM 669 CA SER B 122 12.025 -14.654 -16.969 1.00 20.73 C ATOM 670 C SER B 122 10.931 -15.497 -17.656 1.00 20.36 C ATOM 671 O SER B 122 11.222 -16.550 -18.239 1.00 20.25 O ATOM 672 CB SER B 122 12.218 -15.108 -15.513 1.00 20.74 C ATOM 673 OG SER B 122 11.091 -14.792 -14.725 1.00 19.51 O ATOM 674 HG SER B 122 10.293 -15.247 -15.095 1.00 0.00 H ATOM 675 H SER B 122 11.520 -12.686 -16.181 1.00 0.00 H ATOM 676 N ALA B 123 9.683 -15.047 -17.575 1.00 20.55 N ATOM 677 CA ALA B 123 8.578 -15.655 -18.329 1.00 20.85 C ATOM 678 C ALA B 123 8.868 -15.682 -19.841 1.00 21.37 C ATOM 679 O ALA B 123 8.697 -16.715 -20.484 1.00 21.44 O ATOM 680 CB ALA B 123 7.265 -14.921 -18.049 1.00 20.99 C ATOM 681 H ALA B 123 9.481 -14.236 -16.956 1.00 0.00 H ATOM 682 N VAL B 124 9.304 -14.549 -20.399 1.00 21.72 N ATOM 683 CA VAL B 124 9.757 -14.490 -21.805 1.00 22.49 C ATOM 684 C VAL B 124 10.974 -15.379 -22.049 1.00 22.95 C ATOM 685 O VAL B 124 11.028 -16.122 -23.028 1.00 23.83 O ATOM 686 CB VAL B 124 10.086 -13.022 -22.278 1.00 22.31 C ATOM 687 CG1 VAL B 124 10.741 -13.025 -23.649 1.00 20.46 C ATOM 688 CG2 VAL B 124 8.833 -12.167 -22.293 1.00 21.89 C ATOM 689 H VAL B 124 9.325 -13.681 -19.826 1.00 0.00 H ATOM 690 N ARG B 125 11.953 -15.301 -21.160 1.00 23.62 N ATOM 691 CA ARG B 125 13.156 -16.118 -21.269 1.00 23.48 C ATOM 692 C ARG B 125 12.848 -17.612 -21.339 1.00 23.92 C ATOM 693 O ARG B 125 13.390 -18.319 -22.185 1.00 23.68 O ATOM 694 CB ARG B 125 14.081 -15.810 -20.109 1.00 24.08 C ATOM 695 CG ARG B 125 15.390 -16.572 -20.124 1.00 25.01 C ATOM 696 CD ARG B 125 16.553 -15.641 -19.967 1.00 25.86 C ATOM 697 NE ARG B 125 17.746 -16.237 -20.559 1.00 26.99 N ATOM 698 CZ ARG B 125 18.787 -15.547 -20.992 1.00 26.19 C ATOM 699 NH1 ARG B 125 18.789 -14.221 -20.903 1.00 26.88 N ATOM 700 NH2 ARG B 125 19.819 -16.188 -21.524 1.00 28.22 N ATOM 701 HE ARG B 125 17.780 -17.273 -20.646 1.00 0.00 H ATOM 702 HH12 ARG B 125 19.608 -13.678 -21.244 1.00 0.00 H ATOM 703 HH11 ARG B 125 17.971 -13.726 -20.493 1.00 0.00 H ATOM 704 HH22 ARG B 125 20.642 -15.653 -21.867 1.00 0.00 H ATOM 705 HH21 ARG B 125 19.805 -17.225 -21.598 1.00 0.00 H ATOM 706 H ARG B 125 11.861 -14.639 -20.363 1.00 0.00 H ATOM 707 N MET B 126 11.974 -18.091 -20.454 1.00 24.41 N ATOM 708 CA MET B 126 11.653 -19.511 -20.397 1.00 24.88 C ATOM 709 C MET B 126 10.646 -19.900 -21.481 1.00 25.15 C ATOM 710 O MET B 126 10.789 -20.944 -22.096 1.00 24.90 O ATOM 711 CB MET B 126 11.114 -19.910 -19.012 1.00 24.73 C ATOM 712 CG MET B 126 12.050 -19.559 -17.851 1.00 25.09 C ATOM 713 SD MET B 126 11.530 -20.257 -16.262 1.00 25.09 S ATOM 714 CE MET B 126 10.210 -19.162 -15.760 1.00 18.37 C ATOM 715 H MET B 126 11.511 -17.437 -19.790 1.00 0.00 H ATOM 716 N ALA B 127 9.631 -19.065 -21.695 1.00 25.55 N ATOM 717 CA ALA B 127 8.590 -19.356 -22.691 1.00 26.52 C ATOM 718 C ALA B 127 9.147 -19.551 -24.102 1.00 26.79 C ATOM 719 O ALA B 127 8.629 -20.369 -24.850 1.00 27.11 O ATOM 720 CB ALA B 127 7.496 -18.302 -22.681 1.00 25.96 C ATOM 721 H ALA B 127 9.573 -18.185 -21.144 1.00 0.00 H ATOM 722 N ARG B 128 10.212 -18.819 -24.436 1.00 27.31 N ATOM 723 CA ARG B 128 10.834 -18.870 -25.762 1.00 27.54 C ATOM 724 C ARG B 128 11.503 -20.224 -26.040 1.00 28.58 C ATOM 725 O ARG B 128 11.726 -20.593 -27.200 1.00 28.02 O ATOM 726 CB ARG B 128 11.848 -17.728 -25.919 1.00 27.14 C ATOM 727 CG ARG B 128 13.305 -18.064 -25.565 1.00 26.94 C ATOM 728 CD ARG B 128 14.165 -16.807 -25.337 1.00 26.94 C ATOM 729 NE ARG B 128 15.601 -17.085 -25.434 1.00 27.51 N ATOM 730 CZ ARG B 128 16.351 -17.565 -24.442 1.00 28.76 C ATOM 731 NH1 ARG B 128 15.815 -17.832 -23.252 1.00 28.52 N ATOM 732 NH2 ARG B 128 17.642 -17.791 -24.634 1.00 26.84 N ATOM 733 HE ARG B 128 16.069 -16.894 -26.343 1.00 0.00 H ATOM 734 HH12 ARG B 128 16.410 -18.206 -22.486 1.00 0.00 H ATOM 735 HH11 ARG B 128 14.801 -17.666 -23.089 1.00 0.00 H ATOM 736 HH22 ARG B 128 18.225 -18.166 -23.859 1.00 0.00 H ATOM 737 HH21 ARG B 128 18.072 -17.594 -25.560 1.00 0.00 H ATOM 738 H ARG B 128 10.620 -18.182 -23.722 1.00 0.00 H ATOM 739 N LEU B 129 11.839 -20.954 -24.978 1.00 29.20 N ATOM 740 CA LEU B 129 12.515 -22.235 -25.146 1.00 30.16 C ATOM 741 C LEU B 129 11.546 -23.404 -25.160 1.00 31.12 C ATOM 742 O LEU B 129 11.939 -24.514 -25.509 1.00 31.40 O ATOM 743 CB LEU B 129 13.574 -22.455 -24.058 1.00 29.92 C ATOM 744 CG LEU B 129 14.729 -21.456 -23.970 1.00 28.98 C ATOM 745 CD1 LEU B 129 15.494 -21.676 -22.683 1.00 25.86 C ATOM 746 CD2 LEU B 129 15.646 -21.513 -25.191 1.00 29.29 C ATOM 747 H LEU B 129 11.618 -20.608 -24.022 1.00 0.00 H ATOM 748 N LEU B 130 10.293 -23.153 -24.782 1.00 32.04 N ATOM 749 CA LEU B 130 9.311 -24.216 -24.612 1.00 33.16 C ATOM 750 C LEU B 130 8.757 -24.694 -25.946 1.00 34.26 C ATOM 751 O LEU B 130 8.655 -23.920 -26.901 1.00 34.40 O ATOM 752 CB LEU B 130 8.166 -23.767 -23.690 1.00 33.08 C ATOM 753 CG LEU B 130 8.451 -23.400 -22.223 1.00 32.68 C ATOM 754 CD1 LEU B 130 7.167 -22.992 -21.499 1.00 30.63 C ATOM 755 CD2 LEU B 130 9.171 -24.524 -21.471 1.00 33.02 C ATOM 756 H LEU B 130 10.008 -22.169 -24.603 1.00 0.00 H ATOM 757 N SER B 131 8.393 -25.975 -25.981 1.00 35.56 N ATOM 758 CA SER B 131 7.876 -26.654 -27.169 1.00 36.93 C ATOM 759 C SER B 131 6.421 -26.305 -27.428 1.00 37.24 C ATOM 760 O SER B 131 5.738 -25.808 -26.539 1.00 37.50 O ATOM 761 CB SER B 131 8.000 -28.169 -26.988 1.00 37.15 C ATOM 762 OG SER B 131 9.349 -28.533 -26.747 1.00 39.52 O ATOM 763 HG SER B 131 9.669 -28.084 -25.925 1.00 0.00 H ATOM 764 H SER B 131 8.482 -26.529 -25.105 1.00 0.00 H ATOM 765 N PRO B 132 5.934 -26.558 -28.654 1.00 38.17 N ATOM 766 CA PRO B 132 4.496 -26.358 -28.909 1.00 38.33 C ATOM 767 C PRO B 132 3.621 -27.159 -27.940 1.00 38.21 C ATOM 768 O PRO B 132 3.889 -28.341 -27.693 1.00 38.26 O ATOM 769 CB PRO B 132 4.330 -26.859 -30.347 1.00 38.64 C ATOM 770 CG PRO B 132 5.709 -26.616 -30.973 1.00 38.93 C ATOM 771 CD PRO B 132 6.654 -27.000 -29.868 1.00 38.14 C ATOM 772 N GLY B 133 2.614 -26.506 -27.366 1.00 37.90 N ATOM 773 CA GLY B 133 1.731 -27.166 -26.409 1.00 37.92 C ATOM 774 C GLY B 133 2.168 -27.084 -24.953 1.00 37.88 C ATOM 775 O GLY B 133 1.395 -27.425 -24.054 1.00 37.66 O ATOM 776 H GLY B 133 2.453 -25.506 -27.604 1.00 0.00 H ATOM 777 N ALA B 134 3.406 -26.638 -24.723 1.00 37.86 N ATOM 778 CA ALA B 134 3.937 -26.426 -23.371 1.00 37.35 C ATOM 779 C ALA B 134 3.284 -25.204 -22.705 1.00 37.02 C ATOM 780 O ALA B 134 2.890 -24.259 -23.387 1.00 36.98 O ATOM 781 CB ALA B 134 5.440 -26.275 -23.421 1.00 37.17 C ATOM 782 H ALA B 134 4.020 -26.432 -25.537 1.00 0.00 H ATOM 783 N ARG B 135 3.159 -25.247 -21.378 1.00 36.71 N ATOM 784 CA ARG B 135 2.489 -24.193 -20.596 1.00 36.23 C ATOM 785 C ARG B 135 3.405 -23.634 -19.509 1.00 35.10 C ATOM 786 O ARG B 135 4.037 -24.389 -18.751 1.00 35.04 O ATOM 787 CB ARG B 135 1.257 -24.732 -19.870 1.00 36.52 C ATOM 788 CG ARG B 135 0.268 -25.533 -20.691 1.00 40.02 C ATOM 789 CD ARG B 135 -0.846 -26.035 -19.772 1.00 43.50 C ATOM 790 NE ARG B 135 -1.517 -24.925 -19.093 1.00 46.20 N ATOM 791 CZ ARG B 135 -2.315 -25.060 -18.033 1.00 47.02 C ATOM 792 NH1 ARG B 135 -2.534 -26.266 -17.513 1.00 46.00 N ATOM 793 NH2 ARG B 135 -2.892 -23.983 -17.493 1.00 46.28 N ATOM 794 HE ARG B 135 -1.361 -23.966 -19.463 1.00 0.00 H ATOM 795 HH12 ARG B 135 -3.156 -26.371 -16.686 1.00 0.00 H ATOM 796 HH11 ARG B 135 -2.083 -27.103 -17.933 1.00 0.00 H ATOM 797 HH22 ARG B 135 -3.515 -24.086 -16.666 1.00 0.00 H ATOM 798 HH21 ARG B 135 -2.719 -23.041 -17.899 1.00 0.00 H ATOM 799 H ARG B 135 3.554 -26.064 -20.870 1.00 0.00 H ATOM 800 N LEU B 136 3.442 -22.312 -19.422 1.00 33.26 N ATOM 801 CA LEU B 136 4.087 -21.631 -18.327 1.00 31.68 C ATOM 802 C LEU B 136 3.007 -20.903 -17.558 1.00 30.28 C ATOM 803 O LEU B 136 2.349 -20.003 -18.087 1.00 30.40 O ATOM 804 CB LEU B 136 5.164 -20.650 -18.820 1.00 31.47 C ATOM 805 CG LEU B 136 5.794 -19.583 -17.893 1.00 32.81 C ATOM 806 CD1 LEU B 136 6.097 -20.064 -16.458 1.00 33.09 C ATOM 807 CD2 LEU B 136 7.076 -19.066 -18.540 1.00 32.32 C ATOM 808 H LEU B 136 2.990 -21.747 -20.169 1.00 0.00 H ATOM 809 N ILE B 137 2.833 -21.303 -16.308 1.00 28.45 N ATOM 810 CA ILE B 137 1.953 -20.605 -15.401 1.00 27.32 C ATOM 811 C ILE B 137 2.841 -19.765 -14.506 1.00 26.70 C ATOM 812 O ILE B 137 3.741 -20.295 -13.844 1.00 27.01 O ATOM 813 CB ILE B 137 1.066 -21.578 -14.575 1.00 26.76 C ATOM 814 CG1 ILE B 137 0.301 -22.504 -15.528 1.00 27.00 C ATOM 815 CG2 ILE B 137 0.125 -20.787 -13.626 1.00 26.02 C ATOM 816 CD1 ILE B 137 -0.303 -23.766 -14.859 1.00 27.65 C ATOM 817 H ILE B 137 3.344 -22.143 -15.970 1.00 0.00 H ATOM 818 N THR B 138 2.591 -18.458 -14.506 1.00 25.54 N ATOM 819 CA THR B 138 3.338 -17.530 -13.679 1.00 24.69 C ATOM 820 C THR B 138 2.405 -16.772 -12.709 1.00 24.48 C ATOM 821 O THR B 138 1.333 -16.331 -13.086 1.00 24.56 O ATOM 822 CB THR B 138 4.244 -16.591 -14.536 1.00 24.97 C ATOM 823 OG1 THR B 138 4.973 -15.708 -13.670 1.00 25.51 O ATOM 824 CG2 THR B 138 3.440 -15.787 -15.566 1.00 22.58 C ATOM 825 HG1 THR B 138 5.547 -15.113 -14.215 1.00 0.00 H ATOM 826 H THR B 138 1.836 -18.090 -15.119 1.00 0.00 H ATOM 827 N ILE B 139 2.813 -16.669 -11.448 1.00 23.89 N ATOM 828 CA ILE B 139 1.960 -16.118 -10.400 1.00 22.46 C ATOM 829 C ILE B 139 2.619 -14.859 -9.882 1.00 21.87 C ATOM 830 O ILE B 139 3.786 -14.884 -9.525 1.00 21.43 O ATOM 831 CB ILE B 139 1.738 -17.120 -9.220 1.00 22.65 C ATOM 832 CG1 ILE B 139 1.189 -18.458 -9.719 1.00 21.87 C ATOM 833 CG2 ILE B 139 0.821 -16.526 -8.150 1.00 20.63 C ATOM 834 CD1 ILE B 139 1.238 -19.577 -8.650 1.00 22.44 C ATOM 835 H ILE B 139 3.770 -16.991 -11.201 1.00 0.00 H ATOM 836 N GLU B 140 1.857 -13.767 -9.841 1.00 21.60 N ATOM 837 CA GLU B 140 2.387 -12.457 -9.522 1.00 21.73 C ATOM 838 C GLU B 140 1.428 -11.743 -8.601 1.00 22.31 C ATOM 839 O GLU B 140 0.269 -11.551 -8.945 1.00 22.76 O ATOM 840 CB GLU B 140 2.628 -11.644 -10.818 1.00 22.11 C ATOM 841 CG GLU B 140 3.054 -10.175 -10.606 1.00 20.23 C ATOM 842 CD GLU B 140 4.181 -10.029 -9.606 1.00 20.83 C ATOM 843 OE1 GLU B 140 5.293 -10.559 -9.861 1.00 21.18 O ATOM 844 OE2 GLU B 140 3.956 -9.379 -8.562 1.00 20.08 O ATOM 845 H GLU B 140 0.842 -13.859 -10.046 1.00 0.00 H ATOM 846 N ILE B 141 1.928 -11.336 -7.434 1.00 23.34 N ATOM 847 CA ILE B 141 1.095 -10.770 -6.374 1.00 24.35 C ATOM 848 C ILE B 141 0.665 -9.308 -6.634 1.00 25.43 C ATOM 849 O ILE B 141 -0.445 -8.902 -6.255 1.00 25.61 O ATOM 850 CB ILE B 141 1.781 -10.912 -4.975 1.00 24.03 C ATOM 851 CG1 ILE B 141 0.741 -10.834 -3.840 1.00 24.52 C ATOM 852 CG2 ILE B 141 2.917 -9.902 -4.804 1.00 23.19 C ATOM 853 CD1 ILE B 141 1.293 -11.159 -2.438 1.00 24.34 C ATOM 854 H ILE B 141 2.951 -11.425 -7.271 1.00 0.00 H ATOM 855 N ASN B 142 1.559 -8.546 -7.261 1.00 26.15 N ATOM 856 CA ASN B 142 1.393 -7.118 -7.484 1.00 27.04 C ATOM 857 C ASN B 142 0.710 -6.899 -8.837 1.00 27.50 C ATOM 858 O ASN B 142 1.299 -7.209 -9.881 1.00 27.24 O ATOM 859 CB ASN B 142 2.761 -6.417 -7.428 1.00 26.84 C ATOM 860 CG ASN B 142 2.658 -4.896 -7.539 1.00 28.03 C ATOM 861 OD1 ASN B 142 1.974 -4.365 -8.407 1.00 29.56 O ATOM 862 ND2 ASN B 142 3.354 -4.195 -6.662 1.00 27.95 N ATOM 863 HD22 ASN B 142 3.923 -4.682 -5.940 1.00 0.00 H ATOM 864 HD21 ASN B 142 3.333 -3.156 -6.693 1.00 0.00 H ATOM 865 H ASN B 142 2.427 -8.998 -7.612 1.00 0.00 H ATOM 866 N PRO B 143 -0.539 -6.372 -8.819 1.00 28.11 N ATOM 867 CA PRO B 143 -1.369 -6.304 -10.032 1.00 28.52 C ATOM 868 C PRO B 143 -0.784 -5.364 -11.079 1.00 28.58 C ATOM 869 O PRO B 143 -1.072 -5.530 -12.268 1.00 28.93 O ATOM 870 CB PRO B 143 -2.714 -5.760 -9.534 1.00 28.54 C ATOM 871 CG PRO B 143 -2.647 -5.822 -8.037 1.00 29.15 C ATOM 872 CD PRO B 143 -1.218 -5.780 -7.651 1.00 27.99 C ATOM 873 N ASP B 144 0.029 -4.403 -10.641 1.00 28.43 N ATOM 874 CA ASP B 144 0.707 -3.480 -11.566 1.00 29.31 C ATOM 875 C ASP B 144 1.878 -4.146 -12.292 1.00 28.92 C ATOM 876 O ASP B 144 2.113 -3.897 -13.482 1.00 28.97 O ATOM 877 CB ASP B 144 1.175 -2.219 -10.834 1.00 29.58 C ATOM 878 CG ASP B 144 0.017 -1.417 -10.268 1.00 32.50 C ATOM 879 OD1 ASP B 144 -1.036 -1.308 -10.940 1.00 34.20 O ATOM 880 OD2 ASP B 144 0.156 -0.906 -9.140 1.00 36.47 O ATOM 881 H ASP B 144 0.189 -4.302 -9.618 1.00 0.00 H ATOM 882 N CYS B 145 2.607 -5.002 -11.575 1.00 28.35 N ATOM 883 CA CYS B 145 3.632 -5.844 -12.194 1.00 27.48 C ATOM 884 C CYS B 145 3.009 -6.776 -13.205 1.00 26.80 C ATOM 885 O CYS B 145 3.531 -6.939 -14.310 1.00 26.51 O ATOM 886 CB CYS B 145 4.404 -6.630 -11.135 1.00 27.04 C ATOM 887 SG CYS B 145 5.557 -5.578 -10.296 1.00 28.52 S ATOM 888 H CYS B 145 2.443 -5.073 -10.550 1.00 0.00 H ATOM 889 N ALA B 146 1.889 -7.382 -12.820 1.00 26.67 N ATOM 890 CA ALA B 146 1.166 -8.299 -13.689 1.00 26.69 C ATOM 891 C ALA B 146 0.785 -7.641 -15.006 1.00 27.01 C ATOM 892 O ALA B 146 1.007 -8.224 -16.078 1.00 27.24 O ATOM 893 CB ALA B 146 -0.080 -8.837 -12.991 1.00 26.99 C ATOM 894 H ALA B 146 1.518 -7.194 -11.867 1.00 0.00 H ATOM 895 N ALA B 147 0.227 -6.430 -14.939 1.00 26.77 N ATOM 896 CA ALA B 147 -0.184 -5.732 -16.166 1.00 27.02 C ATOM 897 C ALA B 147 0.991 -5.514 -17.136 1.00 26.64 C ATOM 898 O ALA B 147 0.845 -5.711 -18.341 1.00 26.75 O ATOM 899 CB ALA B 147 -0.917 -4.415 -15.843 1.00 27.17 C ATOM 900 H ALA B 147 0.082 -5.978 -14.014 1.00 0.00 H ATOM 901 N ILE B 148 2.149 -5.134 -16.596 1.00 26.71 N ATOM 902 CA ILE B 148 3.401 -5.025 -17.361 1.00 26.50 C ATOM 903 C ILE B 148 3.821 -6.373 -17.975 1.00 26.52 C ATOM 904 O ILE B 148 4.222 -6.429 -19.151 1.00 26.86 O ATOM 905 CB ILE B 148 4.578 -4.491 -16.475 1.00 26.60 C ATOM 906 CG1 ILE B 148 4.207 -3.185 -15.735 1.00 27.57 C ATOM 907 CG2 ILE B 148 5.901 -4.401 -17.274 1.00 25.98 C ATOM 908 CD1 ILE B 148 4.187 -1.923 -16.547 1.00 28.87 C ATOM 909 H ILE B 148 2.168 -4.903 -15.582 1.00 0.00 H ATOM 910 N THR B 149 3.746 -7.448 -17.178 1.00 25.90 N ATOM 911 CA THR B 149 4.110 -8.801 -17.629 1.00 25.02 C ATOM 912 C THR B 149 3.290 -9.235 -18.840 1.00 25.33 C ATOM 913 O THR B 149 3.862 -9.738 -19.812 1.00 25.47 O ATOM 914 CB THR B 149 3.992 -9.878 -16.472 1.00 24.75 C ATOM 915 OG1 THR B 149 4.919 -9.574 -15.429 1.00 25.36 O ATOM 916 CG2 THR B 149 4.279 -11.283 -16.963 1.00 23.10 C ATOM 917 HG1 THR B 149 4.719 -8.677 -15.062 1.00 0.00 H ATOM 918 H THR B 149 3.417 -7.321 -16.200 1.00 0.00 H ATOM 919 N GLN B 150 1.965 -9.061 -18.789 1.00 25.54 N ATOM 920 CA GLN B 150 1.108 -9.453 -19.929 1.00 26.47 C ATOM 921 C GLN B 150 1.510 -8.702 -21.210 1.00 26.57 C ATOM 922 O GLN B 150 1.696 -9.315 -22.269 1.00 26.24 O ATOM 923 CB GLN B 150 -0.388 -9.265 -19.626 1.00 26.67 C ATOM 924 CG GLN B 150 -1.331 -10.007 -20.610 1.00 27.43 C ATOM 925 CD GLN B 150 -1.194 -11.545 -20.573 1.00 27.69 C ATOM 926 OE1 GLN B 150 -0.631 -12.166 -21.490 1.00 28.20 O ATOM 927 NE2 GLN B 150 -1.717 -12.156 -19.517 1.00 27.38 N ATOM 928 HE22 GLN B 150 -2.180 -11.599 -18.771 1.00 0.00 H ATOM 929 HE21 GLN B 150 -1.664 -13.191 -19.436 1.00 0.00 H ATOM 930 H GLN B 150 1.533 -8.646 -17.939 1.00 0.00 H ATOM 931 N ARG B 151 1.697 -7.389 -21.081 1.00 26.35 N ATOM 932 CA ARG B 151 2.147 -6.552 -22.200 1.00 27.28 C ATOM 933 C ARG B 151 3.503 -7.011 -22.747 1.00 26.24 C ATOM 934 O ARG B 151 3.706 -7.046 -23.966 1.00 25.45 O ATOM 935 CB ARG B 151 2.159 -5.069 -21.808 1.00 26.36 C ATOM 936 CG ARG B 151 0.738 -4.534 -21.489 1.00 29.28 C ATOM 937 CD ARG B 151 0.645 -2.998 -21.393 1.00 29.98 C ATOM 938 NE ARG B 151 0.968 -2.362 -22.672 1.00 35.95 N ATOM 939 CZ ARG B 151 1.296 -1.076 -22.814 1.00 37.84 C ATOM 940 NH1 ARG B 151 1.343 -0.265 -21.758 1.00 37.90 N ATOM 941 NH2 ARG B 151 1.573 -0.596 -24.023 1.00 38.82 N ATOM 942 HE ARG B 151 0.940 -2.952 -23.528 1.00 0.00 H ATOM 943 HH12 ARG B 151 1.600 0.735 -21.881 1.00 0.00 H ATOM 944 HH11 ARG B 151 1.123 -0.632 -20.810 1.00 0.00 H ATOM 945 HH22 ARG B 151 1.829 0.405 -24.139 1.00 0.00 H ATOM 946 HH21 ARG B 151 1.534 -1.222 -24.853 1.00 0.00 H ATOM 947 H ARG B 151 1.519 -6.943 -20.159 1.00 0.00 H ATOM 948 N MET B 152 4.407 -7.388 -21.837 1.00 26.01 N ATOM 949 CA MET B 152 5.760 -7.827 -22.207 1.00 25.45 C ATOM 950 C MET B 152 5.751 -9.142 -22.962 1.00 25.22 C ATOM 951 O MET B 152 6.486 -9.318 -23.932 1.00 25.28 O ATOM 952 CB MET B 152 6.646 -7.951 -20.973 1.00 25.50 C ATOM 953 CG MET B 152 8.126 -8.010 -21.279 1.00 24.83 C ATOM 954 SD MET B 152 8.814 -6.410 -21.742 1.00 25.99 S ATOM 955 CE MET B 152 8.927 -5.542 -20.162 1.00 23.11 C ATOM 956 H MET B 152 4.143 -7.370 -20.831 1.00 0.00 H ATOM 957 N VAL B 153 4.912 -10.056 -22.481 1.00 25.24 N ATOM 958 CA VAL B 153 4.715 -11.381 -23.044 1.00 24.68 C ATOM 959 C VAL B 153 4.021 -11.305 -24.415 1.00 24.95 C ATOM 960 O VAL B 153 4.386 -12.016 -25.338 1.00 24.42 O ATOM 961 CB VAL B 153 3.907 -12.270 -22.044 1.00 24.38 C ATOM 962 CG1 VAL B 153 3.200 -13.412 -22.752 1.00 23.76 C ATOM 963 CG2 VAL B 153 4.828 -12.805 -20.918 1.00 23.79 C ATOM 964 H VAL B 153 4.356 -9.803 -21.639 1.00 0.00 H ATOM 965 N ASP B 154 3.008 -10.450 -24.520 1.00 25.79 N ATOM 966 CA ASP B 154 2.329 -10.171 -25.790 1.00 26.49 C ATOM 967 C ASP B 154 3.266 -9.565 -26.822 1.00 26.85 C ATOM 968 O ASP B 154 3.321 -10.045 -27.965 1.00 26.72 O ATOM 969 CB ASP B 154 1.094 -9.306 -25.547 1.00 26.33 C ATOM 970 CG ASP B 154 0.017 -10.059 -24.784 1.00 28.10 C ATOM 971 OD1 ASP B 154 0.302 -11.193 -24.323 1.00 27.78 O ATOM 972 OD2 ASP B 154 -1.103 -9.533 -24.643 1.00 30.32 O ATOM 973 H ASP B 154 2.683 -9.957 -23.664 1.00 0.00 H ATOM 974 N PHE B 155 4.037 -8.553 -26.403 1.00 26.99 N ATOM 975 CA PHE B 155 5.030 -7.926 -27.284 1.00 27.30 C ATOM 976 C PHE B 155 6.037 -8.941 -27.832 1.00 27.46 C ATOM 977 O PHE B 155 6.353 -8.917 -29.027 1.00 27.66 O ATOM 978 CB PHE B 155 5.770 -6.791 -26.570 1.00 27.15 C ATOM 979 CG PHE B 155 6.580 -5.914 -27.496 1.00 27.80 C ATOM 980 CD1 PHE B 155 6.017 -4.761 -28.061 1.00 27.86 C ATOM 981 CD2 PHE B 155 7.896 -6.245 -27.821 1.00 27.36 C ATOM 982 CE1 PHE B 155 6.766 -3.943 -28.921 1.00 27.04 C ATOM 983 CE2 PHE B 155 8.654 -5.441 -28.687 1.00 26.06 C ATOM 984 CZ PHE B 155 8.087 -4.286 -29.237 1.00 26.62 C ATOM 985 H PHE B 155 3.930 -8.203 -25.430 1.00 0.00 H ATOM 986 N ALA B 156 6.517 -9.838 -26.963 1.00 27.35 N ATOM 987 CA ALA B 156 7.613 -10.766 -27.299 1.00 27.38 C ATOM 988 C ALA B 156 7.170 -11.953 -28.130 1.00 27.39 C ATOM 989 O ALA B 156 8.010 -12.707 -28.632 1.00 27.45 O ATOM 990 CB ALA B 156 8.321 -11.256 -26.026 1.00 27.49 C ATOM 991 H ALA B 156 6.100 -9.883 -26.011 1.00 0.00 H ATOM 992 N GLY B 157 5.859 -12.146 -28.238 1.00 27.40 N ATOM 993 CA GLY B 157 5.297 -13.168 -29.131 1.00 28.08 C ATOM 994 C GLY B 157 5.134 -14.542 -28.500 1.00 28.26 C ATOM 995 O GLY B 157 5.080 -15.551 -29.209 1.00 27.82 O ATOM 996 H GLY B 157 5.213 -11.557 -27.674 1.00 0.00 H ATOM 997 N VAL B 158 5.069 -14.578 -27.168 1.00 28.57 N ATOM 998 CA VAL B 158 4.944 -15.844 -26.419 1.00 29.07 C ATOM 999 C VAL B 158 3.648 -15.911 -25.611 1.00 29.47 C ATOM 1000 O VAL B 158 3.551 -16.669 -24.642 1.00 29.58 O ATOM 1001 CB VAL B 158 6.202 -16.149 -25.507 1.00 28.99 C ATOM 1002 CG1 VAL B 158 7.434 -16.372 -26.343 1.00 28.43 C ATOM 1003 CG2 VAL B 158 6.449 -15.035 -24.476 1.00 28.26 C ATOM 1004 H VAL B 158 5.108 -13.683 -26.639 1.00 0.00 H ATOM 1005 N LYS B 159 2.664 -15.111 -26.027 1.00 29.97 N ATOM 1006 CA LYS B 159 1.337 -15.039 -25.405 1.00 31.08 C ATOM 1007 C LYS B 159 0.662 -16.399 -25.144 1.00 31.71 C ATOM 1008 O LYS B 159 0.100 -16.619 -24.066 1.00 31.42 O ATOM 1009 CB LYS B 159 0.421 -14.158 -26.266 1.00 31.08 C ATOM 1010 CG LYS B 159 -0.977 -13.940 -25.729 1.00 32.28 C ATOM 1011 CD LYS B 159 -1.775 -13.117 -26.718 1.00 35.24 C ATOM 1012 CE LYS B 159 -3.263 -13.210 -26.462 1.00 36.72 C ATOM 1013 NZ LYS B 159 -3.705 -12.162 -25.503 1.00 39.30 N ATOM 1014 HZ1 LYS B 159 -3.202 -12.285 -24.601 1.00 0.00 H ATOM 1015 HZ2 LYS B 159 -3.491 -11.223 -25.895 1.00 0.00 H ATOM 1016 HZ3 LYS B 159 -4.729 -12.248 -25.345 1.00 0.00 H ATOM 1017 H LYS B 159 2.850 -14.498 -26.846 1.00 0.00 H ATOM 1018 N ASP B 160 0.715 -17.294 -26.132 1.00 32.34 N ATOM 1019 CA ASP B 160 0.045 -18.592 -26.040 1.00 33.78 C ATOM 1020 C ASP B 160 0.748 -19.619 -25.140 1.00 33.18 C ATOM 1021 O ASP B 160 0.171 -20.648 -24.814 1.00 32.99 O ATOM 1022 CB ASP B 160 -0.192 -19.176 -27.438 1.00 34.84 C ATOM 1023 CG ASP B 160 -1.308 -18.451 -28.195 1.00 39.51 C ATOM 1024 OD1 ASP B 160 -2.208 -17.835 -27.540 1.00 42.66 O ATOM 1025 OD2 ASP B 160 -1.280 -18.499 -29.455 1.00 44.21 O ATOM 1026 H ASP B 160 1.249 -17.062 -26.994 1.00 0.00 H ATOM 1027 N LYS B 161 1.982 -19.330 -24.732 1.00 32.82 N ATOM 1028 CA LYS B 161 2.713 -20.213 -23.818 1.00 32.14 C ATOM 1029 C LYS B 161 2.402 -19.898 -22.354 1.00 31.19 C ATOM 1030 O LYS B 161 2.592 -20.747 -21.478 1.00 31.48 O ATOM 1031 CB LYS B 161 4.225 -20.107 -24.054 1.00 32.11 C ATOM 1032 CG LYS B 161 4.686 -20.485 -25.453 1.00 33.01 C ATOM 1033 CD LYS B 161 4.727 -21.983 -25.648 1.00 36.63 C ATOM 1034 CE LYS B 161 5.760 -22.358 -26.687 1.00 39.30 C ATOM 1035 NZ LYS B 161 5.331 -21.935 -28.062 1.00 41.89 N ATOM 1036 HZ1 LYS B 161 4.434 -22.403 -28.303 1.00 0.00 H ATOM 1037 HZ2 LYS B 161 5.201 -20.903 -28.081 1.00 0.00 H ATOM 1038 HZ3 LYS B 161 6.061 -22.207 -28.751 1.00 0.00 H ATOM 1039 H LYS B 161 2.438 -18.458 -25.069 1.00 0.00 H ATOM 1040 N VAL B 162 1.910 -18.687 -22.105 1.00 29.75 N ATOM 1041 CA VAL B 162 1.847 -18.120 -20.759 1.00 28.26 C ATOM 1042 C VAL B 162 0.424 -18.000 -20.199 1.00 27.83 C ATOM 1043 O VAL B 162 -0.487 -17.493 -20.865 1.00 27.38 O ATOM 1044 CB VAL B 162 2.573 -16.731 -20.711 1.00 28.06 C ATOM 1045 CG1 VAL B 162 2.452 -16.069 -19.346 1.00 27.65 C ATOM 1046 CG2 VAL B 162 4.047 -16.873 -21.095 1.00 26.74 C ATOM 1047 H VAL B 162 1.555 -18.120 -22.901 1.00 0.00 H ATOM 1048 N THR B 163 0.250 -18.481 -18.970 1.00 27.16 N ATOM 1049 CA THR B 163 -0.931 -18.172 -18.168 1.00 27.00 C ATOM 1050 C THR B 163 -0.471 -17.365 -16.956 1.00 27.42 C ATOM 1051 O THR B 163 0.200 -17.889 -16.028 1.00 27.76 O ATOM 1052 CB THR B 163 -1.678 -19.425 -17.683 1.00 26.79 C ATOM 1053 OG1 THR B 163 -2.001 -20.252 -18.803 1.00 26.79 O ATOM 1054 CG2 THR B 163 -2.955 -19.037 -16.951 1.00 25.06 C ATOM 1055 HG1 THR B 163 -2.482 -21.058 -18.489 1.00 0.00 H ATOM 1056 H THR B 163 0.982 -19.100 -18.566 1.00 0.00 H ATOM 1057 N LEU B 164 -0.813 -16.087 -16.986 1.00 26.65 N ATOM 1058 CA LEU B 164 -0.486 -15.194 -15.903 1.00 26.88 C ATOM 1059 C LEU B 164 -1.634 -15.188 -14.888 1.00 26.88 C ATOM 1060 O LEU B 164 -2.793 -15.030 -15.252 1.00 27.16 O ATOM 1061 CB LEU B 164 -0.210 -13.787 -16.450 1.00 26.39 C ATOM 1062 CG LEU B 164 -0.153 -12.606 -15.488 1.00 26.22 C ATOM 1063 CD1 LEU B 164 0.999 -12.754 -14.480 1.00 25.45 C ATOM 1064 CD2 LEU B 164 -0.032 -11.287 -16.283 1.00 26.48 C ATOM 1065 H LEU B 164 -1.330 -15.719 -17.810 1.00 0.00 H ATOM 1066 N VAL B 165 -1.301 -15.375 -13.616 1.00 27.08 N ATOM 1067 CA VAL B 165 -2.300 -15.363 -12.561 1.00 27.04 C ATOM 1068 C VAL B 165 -1.912 -14.283 -11.551 1.00 27.15 C ATOM 1069 O VAL B 165 -0.753 -14.228 -11.086 1.00 26.95 O ATOM 1070 CB VAL B 165 -2.467 -16.762 -11.872 1.00 27.64 C ATOM 1071 CG1 VAL B 165 -3.720 -16.783 -10.970 1.00 27.08 C ATOM 1072 CG2 VAL B 165 -2.567 -17.889 -12.909 1.00 25.85 C ATOM 1073 H VAL B 165 -0.303 -15.534 -13.370 1.00 0.00 H ATOM 1074 N VAL B 166 -2.874 -13.419 -11.237 1.00 26.23 N ATOM 1075 CA VAL B 166 -2.660 -12.355 -10.264 1.00 26.56 C ATOM 1076 C VAL B 166 -3.090 -12.823 -8.892 1.00 26.62 C ATOM 1077 O VAL B 166 -4.253 -13.134 -8.670 1.00 27.58 O ATOM 1078 CB VAL B 166 -3.442 -11.037 -10.612 1.00 26.68 C ATOM 1079 CG1 VAL B 166 -3.132 -9.936 -9.579 1.00 25.32 C ATOM 1080 CG2 VAL B 166 -3.134 -10.572 -12.046 1.00 25.19 C ATOM 1081 H VAL B 166 -3.802 -13.505 -11.698 1.00 0.00 H ATOM 1082 N GLY B 167 -2.149 -12.854 -7.963 1.00 26.24 N ATOM 1083 CA GLY B 167 -2.467 -13.223 -6.599 1.00 25.86 C ATOM 1084 C GLY B 167 -1.240 -13.801 -5.946 1.00 25.57 C ATOM 1085 O GLY B 167 -0.197 -13.953 -6.590 1.00 25.25 O ATOM 1086 H GLY B 167 -1.170 -12.611 -8.215 1.00 0.00 H ATOM 1087 N ALA B 168 -1.373 -14.113 -4.662 1.00 25.02 N ATOM 1088 CA ALA B 168 -0.279 -14.607 -3.852 1.00 24.72 C ATOM 1089 C ALA B 168 -0.127 -16.093 -4.125 1.00 24.73 C ATOM 1090 O ALA B 168 -1.120 -16.822 -4.153 1.00 25.50 O ATOM 1091 CB ALA B 168 -0.560 -14.348 -2.384 1.00 24.63 C ATOM 1092 H ALA B 168 -2.306 -13.997 -4.218 1.00 0.00 H ATOM 1093 N SER B 169 1.110 -16.516 -4.372 1.00 24.41 N ATOM 1094 CA SER B 169 1.477 -17.925 -4.573 1.00 24.42 C ATOM 1095 C SER B 169 0.901 -18.874 -3.493 1.00 24.58 C ATOM 1096 O SER B 169 0.364 -19.925 -3.822 1.00 24.17 O ATOM 1097 CB SER B 169 3.001 -18.057 -4.632 1.00 23.40 C ATOM 1098 OG SER B 169 3.582 -17.587 -3.424 1.00 23.50 O ATOM 1099 HG SER B 169 4.566 -17.678 -3.475 1.00 0.00 H ATOM 1100 H SER B 169 1.866 -15.804 -4.426 1.00 0.00 H ATOM 1101 N GLN B 170 0.995 -18.494 -2.219 1.00 25.39 N ATOM 1102 CA GLN B 170 0.389 -19.304 -1.149 1.00 26.74 C ATOM 1103 C GLN B 170 -1.115 -19.495 -1.329 1.00 26.86 C ATOM 1104 O GLN B 170 -1.635 -20.552 -0.975 1.00 27.72 O ATOM 1105 CB GLN B 170 0.719 -18.786 0.264 1.00 26.71 C ATOM 1106 CG GLN B 170 0.219 -17.384 0.593 1.00 28.54 C ATOM 1107 CD GLN B 170 1.231 -16.303 0.239 1.00 31.00 C ATOM 1108 OE1 GLN B 170 1.823 -16.324 -0.835 1.00 32.23 O ATOM 1109 NE2 GLN B 170 1.429 -15.349 1.147 1.00 30.42 N ATOM 1110 HE22 GLN B 170 0.905 -15.369 2.045 1.00 0.00 H ATOM 1111 HE21 GLN B 170 2.107 -14.584 0.958 1.00 0.00 H ATOM 1112 H GLN B 170 1.501 -17.618 -1.978 1.00 0.00 H ATOM 1113 N ASP B 171 -1.802 -18.506 -1.908 1.00 26.96 N ATOM 1114 CA ASP B 171 -3.228 -18.642 -2.230 1.00 26.73 C ATOM 1115 C ASP B 171 -3.495 -19.365 -3.547 1.00 26.19 C ATOM 1116 O ASP B 171 -4.494 -20.081 -3.658 1.00 26.70 O ATOM 1117 CB ASP B 171 -3.938 -17.276 -2.273 1.00 27.35 C ATOM 1118 CG ASP B 171 -3.860 -16.526 -0.958 1.00 29.09 C ATOM 1119 OD1 ASP B 171 -3.885 -17.170 0.115 1.00 29.79 O ATOM 1120 OD2 ASP B 171 -3.752 -15.275 -0.998 1.00 32.95 O ATOM 1121 H ASP B 171 -1.314 -17.617 -2.137 1.00 0.00 H ATOM 1122 N ILE B 172 -2.646 -19.150 -4.555 1.00 25.14 N ATOM 1123 CA ILE B 172 -2.891 -19.700 -5.906 1.00 23.95 C ATOM 1124 C ILE B 172 -2.422 -21.151 -6.082 1.00 24.01 C ATOM 1125 O ILE B 172 -3.059 -21.922 -6.811 1.00 23.47 O ATOM 1126 CB ILE B 172 -2.208 -18.851 -7.049 1.00 23.75 C ATOM 1127 CG1 ILE B 172 -2.685 -17.387 -7.061 1.00 23.89 C ATOM 1128 CG2 ILE B 172 -2.407 -19.519 -8.413 1.00 21.59 C ATOM 1129 CD1 ILE B 172 -4.232 -17.166 -7.227 1.00 22.85 C ATOM 1130 H ILE B 172 -1.791 -18.582 -4.386 1.00 0.00 H ATOM 1131 N ILE B 173 -1.284 -21.496 -5.464 1.00 23.99 N ATOM 1132 CA ILE B 173 -0.725 -22.863 -5.538 1.00 23.78 C ATOM 1133 C ILE B 173 -1.777 -23.937 -5.230 1.00 24.77 C ATOM 1134 O ILE B 173 -1.941 -24.870 -6.024 1.00 24.79 O ATOM 1135 CB ILE B 173 0.582 -23.034 -4.683 1.00 23.95 C ATOM 1136 CG1 ILE B 173 1.778 -22.398 -5.415 1.00 23.20 C ATOM 1137 CG2 ILE B 173 0.847 -24.521 -4.315 1.00 21.67 C ATOM 1138 CD1 ILE B 173 2.974 -22.080 -4.515 1.00 21.88 C ATOM 1139 H ILE B 173 -0.775 -20.776 -4.912 1.00 0.00 H ATOM 1140 N PRO B 174 -2.518 -23.798 -4.105 1.00 25.56 N ATOM 1141 CA PRO B 174 -3.509 -24.841 -3.817 1.00 26.55 C ATOM 1142 C PRO B 174 -4.752 -24.819 -4.720 1.00 27.49 C ATOM 1143 O PRO B 174 -5.614 -25.688 -4.588 1.00 27.49 O ATOM 1144 CB PRO B 174 -3.865 -24.595 -2.344 1.00 26.79 C ATOM 1145 CG PRO B 174 -3.547 -23.177 -2.096 1.00 25.96 C ATOM 1146 CD PRO B 174 -2.480 -22.764 -3.053 1.00 25.58 C ATOM 1147 N GLN B 175 -4.822 -23.862 -5.648 1.00 28.39 N ATOM 1148 CA GLN B 175 -5.908 -23.807 -6.627 1.00 29.41 C ATOM 1149 C GLN B 175 -5.508 -24.387 -7.956 1.00 29.27 C ATOM 1150 O GLN B 175 -6.356 -24.523 -8.830 1.00 29.73 O ATOM 1151 CB GLN B 175 -6.353 -22.378 -6.903 1.00 29.65 C ATOM 1152 CG GLN B 175 -6.712 -21.538 -5.700 1.00 32.80 C ATOM 1153 CD GLN B 175 -7.070 -20.128 -6.124 1.00 35.60 C ATOM 1154 OE1 GLN B 175 -7.109 -19.823 -7.318 1.00 38.12 O ATOM 1155 NE2 GLN B 175 -7.314 -19.263 -5.161 1.00 37.40 N ATOM 1156 HE22 GLN B 175 -7.270 -19.565 -4.167 1.00 0.00 H ATOM 1157 HE21 GLN B 175 -7.551 -18.278 -5.395 1.00 0.00 H ATOM 1158 H GLN B 175 -4.081 -23.133 -5.676 1.00 0.00 H ATOM 1159 N LEU B 176 -4.227 -24.701 -8.132 1.00 29.19 N ATOM 1160 CA LEU B 176 -3.733 -25.143 -9.440 1.00 29.62 C ATOM 1161 C LEU B 176 -4.459 -26.371 -9.980 1.00 30.27 C ATOM 1162 O LEU B 176 -4.805 -26.420 -11.162 1.00 30.23 O ATOM 1163 CB LEU B 176 -2.208 -25.326 -9.438 1.00 29.36 C ATOM 1164 CG LEU B 176 -1.373 -24.028 -9.411 1.00 29.59 C ATOM 1165 CD1 LEU B 176 0.113 -24.297 -9.111 1.00 27.91 C ATOM 1166 CD2 LEU B 176 -1.554 -23.225 -10.710 1.00 29.35 C ATOM 1167 H LEU B 176 -3.567 -24.632 -7.331 1.00 0.00 H ATOM 1168 N LYS B 177 -4.703 -27.349 -9.110 1.00 31.17 N ATOM 1169 CA LYS B 177 -5.432 -28.568 -9.488 1.00 32.25 C ATOM 1170 C LYS B 177 -6.889 -28.269 -9.844 1.00 32.98 C ATOM 1171 O LYS B 177 -7.394 -28.701 -10.899 1.00 32.38 O ATOM 1172 CB LYS B 177 -5.339 -29.642 -8.384 1.00 32.08 C ATOM 1173 CG LYS B 177 -3.968 -30.360 -8.290 1.00 31.13 C ATOM 1174 CD LYS B 177 -4.039 -31.537 -7.304 1.00 32.41 C ATOM 1175 CE LYS B 177 -2.679 -32.135 -6.954 1.00 30.63 C ATOM 1176 NZ LYS B 177 -2.123 -32.950 -8.065 1.00 33.60 N ATOM 1177 HZ1 LYS B 177 -2.775 -33.731 -8.280 1.00 0.00 H ATOM 1178 HZ2 LYS B 177 -2.007 -32.352 -8.908 1.00 0.00 H ATOM 1179 HZ3 LYS B 177 -1.199 -33.335 -7.782 1.00 0.00 H ATOM 1180 H LYS B 177 -4.367 -27.247 -8.131 1.00 0.00 H ATOM 1181 N LYS B 178 -7.547 -27.498 -8.977 1.00 34.21 N ATOM 1182 CA LYS B 178 -8.955 -27.149 -9.167 1.00 35.12 C ATOM 1183 C LYS B 178 -9.224 -26.185 -10.341 1.00 35.24 C ATOM 1184 O LYS B 178 -10.150 -26.414 -11.124 1.00 34.96 O ATOM 1185 CB LYS B 178 -9.549 -26.580 -7.877 1.00 35.64 C ATOM 1186 CG LYS B 178 -11.069 -26.578 -7.877 1.00 37.57 C ATOM 1187 CD LYS B 178 -11.654 -25.750 -6.748 1.00 40.17 C ATOM 1188 CE LYS B 178 -13.166 -25.696 -6.895 1.00 41.54 C ATOM 1189 NZ LYS B 178 -13.726 -24.446 -6.315 1.00 45.14 N ATOM 1190 HZ1 LYS B 178 -13.491 -24.399 -5.303 1.00 0.00 H ATOM 1191 HZ2 LYS B 178 -13.318 -23.625 -6.805 1.00 0.00 H ATOM 1192 HZ3 LYS B 178 -14.759 -24.443 -6.433 1.00 0.00 H ATOM 1193 H LYS B 178 -7.045 -27.135 -8.142 1.00 0.00 H ATOM 1194 N LYS B 179 -8.436 -25.111 -10.450 1.00 35.23 N ATOM 1195 CA LYS B 179 -8.735 -24.042 -11.422 1.00 35.95 C ATOM 1196 C LYS B 179 -7.897 -24.045 -12.707 1.00 35.31 C ATOM 1197 O LYS B 179 -8.349 -23.512 -13.708 1.00 35.11 O ATOM 1198 CB LYS B 179 -8.669 -22.649 -10.774 1.00 35.66 C ATOM 1199 CG LYS B 179 -9.698 -22.394 -9.679 1.00 36.93 C ATOM 1200 CD LYS B 179 -9.588 -20.984 -9.092 1.00 37.63 C ATOM 1201 CE LYS B 179 -10.156 -19.898 -10.037 1.00 41.97 C ATOM 1202 NZ LYS B 179 -10.708 -18.713 -9.274 1.00 43.03 N ATOM 1203 HZ1 LYS B 179 -11.475 -19.032 -8.648 1.00 0.00 H ATOM 1204 HZ2 LYS B 179 -9.950 -18.285 -8.705 1.00 0.00 H ATOM 1205 HZ3 LYS B 179 -11.078 -18.011 -9.946 1.00 0.00 H ATOM 1206 H LYS B 179 -7.598 -25.027 -9.840 1.00 0.00 H ATOM 1207 N TYR B 180 -6.691 -24.622 -12.682 1.00 35.19 N ATOM 1208 CA TYR B 180 -5.731 -24.432 -13.793 1.00 34.92 C ATOM 1209 C TYR B 180 -5.315 -25.698 -14.529 1.00 35.50 C ATOM 1210 O TYR B 180 -4.344 -25.687 -15.286 1.00 35.67 O ATOM 1211 CB TYR B 180 -4.516 -23.555 -13.365 1.00 34.09 C ATOM 1212 CG TYR B 180 -4.965 -22.180 -12.893 1.00 33.01 C ATOM 1213 CD1 TYR B 180 -5.214 -21.144 -13.809 1.00 32.06 C ATOM 1214 CD2 TYR B 180 -5.219 -21.938 -11.538 1.00 32.78 C ATOM 1215 CE1 TYR B 180 -5.683 -19.892 -13.377 1.00 31.72 C ATOM 1216 CE2 TYR B 180 -5.677 -20.691 -11.095 1.00 32.36 C ATOM 1217 CZ TYR B 180 -5.915 -19.680 -12.019 1.00 32.51 C ATOM 1218 OH TYR B 180 -6.369 -18.469 -11.561 1.00 32.53 O ATOM 1219 HH TYR B 180 -6.492 -17.853 -12.326 1.00 0.00 H ATOM 1220 H TYR B 180 -6.423 -25.213 -11.870 1.00 0.00 H ATOM 1221 N ASP B 181 -6.057 -26.785 -14.317 1.00 36.54 N ATOM 1222 CA ASP B 181 -5.894 -28.004 -15.126 1.00 37.65 C ATOM 1223 C ASP B 181 -4.561 -28.714 -14.848 1.00 37.39 C ATOM 1224 O ASP B 181 -4.054 -29.470 -15.684 1.00 38.01 O ATOM 1225 CB ASP B 181 -6.073 -27.661 -16.633 1.00 38.83 C ATOM 1226 CG ASP B 181 -5.884 -28.870 -17.568 1.00 41.33 C ATOM 1227 OD1 ASP B 181 -6.603 -29.886 -17.398 1.00 44.30 O ATOM 1228 OD2 ASP B 181 -5.013 -28.790 -18.477 1.00 43.43 O ATOM 1229 H ASP B 181 -6.770 -26.771 -13.560 1.00 0.00 H ATOM 1230 N VAL B 182 -3.994 -28.486 -13.660 1.00 36.70 N ATOM 1231 CA VAL B 182 -2.725 -29.113 -13.304 1.00 35.37 C ATOM 1232 C VAL B 182 -2.935 -30.422 -12.546 1.00 35.20 C ATOM 1233 O VAL B 182 -3.748 -30.502 -11.612 1.00 34.68 O ATOM 1234 CB VAL B 182 -1.783 -28.163 -12.509 1.00 35.29 C ATOM 1235 CG1 VAL B 182 -0.503 -28.884 -12.096 1.00 34.52 C ATOM 1236 CG2 VAL B 182 -1.430 -26.944 -13.342 1.00 34.28 C ATOM 1237 H VAL B 182 -4.463 -27.854 -12.980 1.00 0.00 H ATOM 1238 N ASP B 183 -2.215 -31.446 -12.996 1.00 34.65 N ATOM 1239 CA ASP B 183 -2.036 -32.667 -12.231 1.00 34.91 C ATOM 1240 C ASP B 183 -0.784 -32.477 -11.360 1.00 33.48 C ATOM 1241 O ASP B 183 -0.886 -32.057 -10.202 1.00 33.73 O ATOM 1242 CB ASP B 183 -1.905 -33.875 -13.177 1.00 35.75 C ATOM 1243 CG ASP B 183 -1.849 -35.199 -12.432 1.00 38.53 C ATOM 1244 OD1 ASP B 183 -2.443 -35.288 -11.327 1.00 40.12 O ATOM 1245 OD2 ASP B 183 -1.206 -36.146 -12.960 1.00 41.94 O ATOM 1246 H ASP B 183 -1.764 -31.369 -13.930 1.00 0.00 H ATOM 1247 N THR B 184 0.391 -32.762 -11.925 1.00 31.98 N ATOM 1248 CA THR B 184 1.669 -32.467 -11.260 1.00 30.46 C ATOM 1249 C THR B 184 2.554 -31.611 -12.168 1.00 29.39 C ATOM 1250 O THR B 184 2.354 -31.570 -13.389 1.00 29.36 O ATOM 1251 CB THR B 184 2.431 -33.751 -10.836 1.00 30.42 C ATOM 1252 OG1 THR B 184 2.729 -34.531 -11.994 1.00 31.31 O ATOM 1253 CG2 THR B 184 1.614 -34.583 -9.854 1.00 29.80 C ATOM 1254 HG1 THR B 184 3.215 -35.350 -11.723 1.00 0.00 H ATOM 1255 H THR B 184 0.403 -33.207 -12.865 1.00 0.00 H ATOM 1256 N LEU B 185 3.537 -30.949 -11.565 1.00 27.69 N ATOM 1257 CA LEU B 185 4.396 -29.994 -12.260 1.00 26.39 C ATOM 1258 C LEU B 185 5.674 -30.645 -12.759 1.00 25.97 C ATOM 1259 O LEU B 185 6.241 -31.518 -12.085 1.00 26.43 O ATOM 1260 CB LEU B 185 4.738 -28.804 -11.341 1.00 25.94 C ATOM 1261 CG LEU B 185 3.572 -27.952 -10.824 1.00 25.41 C ATOM 1262 CD1 LEU B 185 4.012 -27.091 -9.659 1.00 22.37 C ATOM 1263 CD2 LEU B 185 2.919 -27.096 -11.947 1.00 23.95 C ATOM 1264 H LEU B 185 3.702 -31.119 -10.552 1.00 0.00 H ATOM 1265 N ASP B 186 6.127 -30.222 -13.933 1.00 24.77 N ATOM 1266 CA ASP B 186 7.400 -30.679 -14.464 1.00 24.37 C ATOM 1267 C ASP B 186 8.570 -29.908 -13.855 1.00 24.06 C ATOM 1268 O ASP B 186 9.637 -30.488 -13.592 1.00 23.57 O ATOM 1269 CB ASP B 186 7.449 -30.528 -15.989 1.00 24.40 C ATOM 1270 CG ASP B 186 6.523 -31.503 -16.718 1.00 26.14 C ATOM 1271 OD1 ASP B 186 6.068 -32.507 -16.103 1.00 25.78 O ATOM 1272 OD2 ASP B 186 6.260 -31.261 -17.922 1.00 26.92 O ATOM 1273 H ASP B 186 5.558 -29.549 -14.485 1.00 0.00 H ATOM 1274 N MET B 187 8.361 -28.605 -13.658 1.00 23.04 N ATOM 1275 CA MET B 187 9.391 -27.686 -13.203 1.00 23.06 C ATOM 1276 C MET B 187 8.754 -26.471 -12.540 1.00 22.84 C ATOM 1277 O MET B 187 7.669 -26.020 -12.954 1.00 22.77 O ATOM 1278 CB MET B 187 10.281 -27.245 -14.363 1.00 23.16 C ATOM 1279 CG MET B 187 11.433 -26.294 -13.983 1.00 22.82 C ATOM 1280 SD MET B 187 12.568 -26.012 -15.347 1.00 24.74 S ATOM 1281 CE MET B 187 13.334 -24.457 -14.842 1.00 23.42 C ATOM 1282 H MET B 187 7.410 -28.226 -13.840 1.00 0.00 H ATOM 1283 N VAL B 188 9.420 -25.976 -11.490 1.00 21.87 N ATOM 1284 CA VAL B 188 9.046 -24.733 -10.821 1.00 20.98 C ATOM 1285 C VAL B 188 10.245 -23.789 -10.754 1.00 20.35 C ATOM 1286 O VAL B 188 11.321 -24.197 -10.334 1.00 19.94 O ATOM 1287 CB VAL B 188 8.555 -24.958 -9.369 1.00 20.99 C ATOM 1288 CG1 VAL B 188 7.992 -23.641 -8.786 1.00 20.38 C ATOM 1289 CG2 VAL B 188 7.528 -26.080 -9.301 1.00 20.34 C ATOM 1290 H VAL B 188 10.243 -26.502 -11.133 1.00 0.00 H ATOM 1291 N PHE B 189 10.037 -22.533 -11.160 1.00 19.77 N ATOM 1292 CA PHE B 189 11.015 -21.468 -10.984 1.00 19.13 C ATOM 1293 C PHE B 189 10.594 -20.586 -9.803 1.00 19.23 C ATOM 1294 O PHE B 189 9.591 -19.875 -9.864 1.00 19.38 O ATOM 1295 CB PHE B 189 11.169 -20.637 -12.266 1.00 18.66 C ATOM 1296 CG PHE B 189 12.260 -19.589 -12.198 1.00 18.41 C ATOM 1297 CD1 PHE B 189 13.563 -19.930 -11.815 1.00 17.85 C ATOM 1298 CD2 PHE B 189 11.994 -18.265 -12.537 1.00 18.85 C ATOM 1299 CE1 PHE B 189 14.581 -18.968 -11.769 1.00 19.11 C ATOM 1300 CE2 PHE B 189 13.008 -17.285 -12.497 1.00 20.08 C ATOM 1301 CZ PHE B 189 14.311 -17.647 -12.115 1.00 19.88 C ATOM 1302 H PHE B 189 9.134 -22.305 -11.623 1.00 0.00 H ATOM 1303 N LEU B 190 11.363 -20.661 -8.725 1.00 18.93 N ATOM 1304 CA LEU B 190 11.119 -19.872 -7.526 1.00 18.92 C ATOM 1305 C LEU B 190 11.936 -18.598 -7.642 1.00 18.93 C ATOM 1306 O LEU B 190 13.165 -18.654 -7.739 1.00 19.03 O ATOM 1307 CB LEU B 190 11.528 -20.650 -6.263 1.00 17.87 C ATOM 1308 CG LEU B 190 10.757 -21.951 -5.945 1.00 18.66 C ATOM 1309 CD1 LEU B 190 11.364 -23.182 -6.617 1.00 15.54 C ATOM 1310 CD2 LEU B 190 10.665 -22.158 -4.436 1.00 17.45 C ATOM 1311 H LEU B 190 12.175 -21.311 -8.737 1.00 0.00 H ATOM 1312 N ASP B 191 11.265 -17.451 -7.627 1.00 19.06 N ATOM 1313 CA ASP B 191 11.978 -16.185 -7.799 1.00 19.97 C ATOM 1314 C ASP B 191 11.178 -15.012 -7.202 1.00 19.88 C ATOM 1315 O ASP B 191 11.291 -13.870 -7.670 1.00 20.12 O ATOM 1316 CB ASP B 191 12.297 -15.959 -9.288 1.00 19.20 C ATOM 1317 CG ASP B 191 13.340 -14.886 -9.513 1.00 21.92 C ATOM 1318 OD1 ASP B 191 14.184 -14.687 -8.592 1.00 22.58 O ATOM 1319 OD2 ASP B 191 13.335 -14.244 -10.611 1.00 19.77 O ATOM 1320 H ASP B 191 10.234 -17.453 -7.493 1.00 0.00 H ATOM 1321 N HIS B 192 10.396 -15.301 -6.164 1.00 19.96 N ATOM 1322 CA HIS B 192 9.565 -14.285 -5.473 1.00 20.38 C ATOM 1323 C HIS B 192 10.249 -13.796 -4.192 1.00 20.52 C ATOM 1324 O HIS B 192 11.472 -13.820 -4.140 1.00 21.46 O ATOM 1325 CB HIS B 192 8.104 -14.775 -5.271 1.00 20.03 C ATOM 1326 CG HIS B 192 7.972 -16.094 -4.565 1.00 19.41 C ATOM 1327 ND1 HIS B 192 8.901 -17.111 -4.676 1.00 19.12 N ATOM 1328 CD2 HIS B 192 6.976 -16.585 -3.791 1.00 19.36 C ATOM 1329 CE1 HIS B 192 8.501 -18.157 -3.976 1.00 19.12 C ATOM 1330 NE2 HIS B 192 7.338 -17.861 -3.424 1.00 20.23 N ATOM 1331 H HIS B 192 10.366 -16.283 -5.822 1.00 0.00 H ATOM 1332 N TRP B 193 9.513 -13.320 -3.188 1.00 21.31 N ATOM 1333 CA TRP B 193 10.159 -12.943 -1.907 1.00 22.84 C ATOM 1334 C TRP B 193 10.792 -14.178 -1.261 1.00 22.59 C ATOM 1335 O TRP B 193 10.158 -15.242 -1.155 1.00 22.62 O ATOM 1336 CB TRP B 193 9.214 -12.212 -0.916 1.00 23.05 C ATOM 1337 CG TRP B 193 8.551 -10.902 -1.396 1.00 24.34 C ATOM 1338 CD1 TRP B 193 7.330 -10.415 -0.980 1.00 25.05 C ATOM 1339 CD2 TRP B 193 9.038 -9.947 -2.380 1.00 25.58 C ATOM 1340 NE1 TRP B 193 7.033 -9.228 -1.627 1.00 25.69 N ATOM 1341 CE2 TRP B 193 8.057 -8.914 -2.484 1.00 26.19 C ATOM 1342 CE3 TRP B 193 10.191 -9.867 -3.182 1.00 24.46 C ATOM 1343 CZ2 TRP B 193 8.200 -7.812 -3.362 1.00 24.98 C ATOM 1344 CZ3 TRP B 193 10.337 -8.779 -4.051 1.00 24.46 C ATOM 1345 CH2 TRP B 193 9.340 -7.763 -4.135 1.00 25.31 C ATOM 1346 HE1 TRP B 193 6.171 -8.664 -1.486 1.00 0.00 H ATOM 1347 H TRP B 193 8.485 -13.213 -3.303 1.00 0.00 H ATOM 1348 N LYS B 194 12.050 -14.045 -0.856 1.00 23.35 N ATOM 1349 CA LYS B 194 12.884 -15.217 -0.532 1.00 23.53 C ATOM 1350 C LYS B 194 12.411 -15.989 0.704 1.00 24.64 C ATOM 1351 O LYS B 194 12.683 -17.191 0.825 1.00 25.00 O ATOM 1352 CB LYS B 194 14.372 -14.849 -0.438 1.00 23.24 C ATOM 1353 CG LYS B 194 14.959 -14.099 -1.668 1.00 22.92 C ATOM 1354 CD LYS B 194 14.517 -14.672 -3.021 1.00 20.93 C ATOM 1355 CE LYS B 194 14.592 -13.616 -4.131 1.00 20.78 C ATOM 1356 NZ LYS B 194 13.945 -14.096 -5.405 1.00 17.57 N ATOM 1357 HZ1 LYS B 194 14.430 -14.954 -5.737 1.00 0.00 H ATOM 1358 HZ2 LYS B 194 12.943 -14.310 -5.224 1.00 0.00 H ATOM 1359 HZ3 LYS B 194 14.017 -13.354 -6.130 1.00 0.00 H ATOM 1360 H LYS B 194 12.456 -13.092 -0.765 1.00 0.00 H ATOM 1361 N ASP B 195 11.673 -15.311 1.592 1.00 24.98 N ATOM 1362 CA ASP B 195 11.126 -15.944 2.788 1.00 25.18 C ATOM 1363 C ASP B 195 9.919 -16.831 2.471 1.00 25.09 C ATOM 1364 O ASP B 195 9.402 -17.525 3.350 1.00 25.16 O ATOM 1365 CB ASP B 195 10.796 -14.909 3.875 1.00 25.59 C ATOM 1366 CG ASP B 195 9.815 -13.805 3.407 1.00 28.45 C ATOM 1367 OD1 ASP B 195 9.487 -13.666 2.202 1.00 30.44 O ATOM 1368 OD2 ASP B 195 9.372 -13.037 4.288 1.00 32.13 O ATOM 1369 H ASP B 195 11.484 -14.302 1.424 1.00 0.00 H ATOM 1370 N ARG B 196 9.488 -16.817 1.209 1.00 24.45 N ATOM 1371 CA ARG B 196 8.411 -17.687 0.743 1.00 23.89 C ATOM 1372 C ARG B 196 8.936 -18.979 0.132 1.00 22.73 C ATOM 1373 O ARG B 196 8.161 -19.889 -0.081 1.00 23.38 O ATOM 1374 CB ARG B 196 7.545 -16.987 -0.317 1.00 24.40 C ATOM 1375 CG ARG B 196 6.723 -15.783 0.136 1.00 26.29 C ATOM 1376 CD ARG B 196 5.857 -16.040 1.368 1.00 30.77 C ATOM 1377 NE ARG B 196 5.038 -17.252 1.287 1.00 32.65 N ATOM 1378 CZ ARG B 196 4.445 -17.793 2.351 1.00 34.09 C ATOM 1379 NH1 ARG B 196 4.580 -17.210 3.533 1.00 31.67 N ATOM 1380 NH2 ARG B 196 3.734 -18.919 2.242 1.00 34.58 N ATOM 1381 HE ARG B 196 4.914 -17.709 0.361 1.00 0.00 H ATOM 1382 HH12 ARG B 196 4.122 -17.622 4.371 1.00 0.00 H ATOM 1383 HH11 ARG B 196 5.144 -16.341 3.623 1.00 0.00 H ATOM 1384 HH22 ARG B 196 3.277 -19.329 3.082 1.00 0.00 H ATOM 1385 HH21 ARG B 196 3.637 -19.386 1.318 1.00 0.00 H ATOM 1386 H ARG B 196 9.934 -16.164 0.533 1.00 0.00 H ATOM 1387 N TYR B 197 10.232 -19.063 -0.177 1.00 21.97 N ATOM 1388 CA TYR B 197 10.789 -20.284 -0.801 1.00 21.02 C ATOM 1389 C TYR B 197 10.451 -21.555 -0.009 1.00 20.98 C ATOM 1390 O TYR B 197 9.894 -22.512 -0.570 1.00 20.73 O ATOM 1391 CB TYR B 197 12.307 -20.183 -0.988 1.00 20.25 C ATOM 1392 CG TYR B 197 12.795 -19.334 -2.162 1.00 19.37 C ATOM 1393 CD1 TYR B 197 11.986 -18.345 -2.749 1.00 17.38 C ATOM 1394 CD2 TYR B 197 14.090 -19.499 -2.653 1.00 20.28 C ATOM 1395 CE1 TYR B 197 12.443 -17.577 -3.810 1.00 17.76 C ATOM 1396 CE2 TYR B 197 14.573 -18.713 -3.701 1.00 20.24 C ATOM 1397 CZ TYR B 197 13.734 -17.755 -4.281 1.00 19.71 C ATOM 1398 OH TYR B 197 14.212 -16.975 -5.312 1.00 19.30 O ATOM 1399 HH TYR B 197 14.481 -17.556 -6.067 1.00 0.00 H ATOM 1400 H TYR B 197 10.860 -18.258 0.024 1.00 0.00 H ATOM 1401 N LEU B 198 10.787 -21.555 1.288 1.00 20.10 N ATOM 1402 CA LEU B 198 10.572 -22.732 2.121 1.00 20.15 C ATOM 1403 C LEU B 198 9.080 -23.092 2.260 1.00 19.85 C ATOM 1404 O LEU B 198 8.678 -24.206 1.862 1.00 19.53 O ATOM 1405 CB LEU B 198 11.295 -22.605 3.490 1.00 20.11 C ATOM 1406 CG LEU B 198 11.096 -23.790 4.464 1.00 21.06 C ATOM 1407 CD1 LEU B 198 11.456 -25.139 3.820 1.00 19.97 C ATOM 1408 CD2 LEU B 198 11.828 -23.607 5.776 1.00 20.62 C ATOM 1409 H LEU B 198 11.208 -20.701 1.707 1.00 0.00 H ATOM 1410 N PRO B 199 8.241 -22.150 2.784 1.00 20.11 N ATOM 1411 CA PRO B 199 6.828 -22.510 2.932 1.00 20.47 C ATOM 1412 C PRO B 199 6.097 -22.853 1.619 1.00 20.95 C ATOM 1413 O PRO B 199 5.179 -23.686 1.628 1.00 21.47 O ATOM 1414 CB PRO B 199 6.210 -21.281 3.636 1.00 20.76 C ATOM 1415 CG PRO B 199 7.175 -20.160 3.442 1.00 19.62 C ATOM 1416 CD PRO B 199 8.522 -20.790 3.305 1.00 20.03 C ATOM 1417 N ASP B 200 6.492 -22.242 0.506 1.00 20.78 N ATOM 1418 CA ASP B 200 5.886 -22.583 -0.788 1.00 21.27 C ATOM 1419 C ASP B 200 6.351 -23.948 -1.318 1.00 20.64 C ATOM 1420 O ASP B 200 5.574 -24.663 -1.932 1.00 21.16 O ATOM 1421 CB ASP B 200 6.103 -21.458 -1.818 1.00 21.58 C ATOM 1422 CG ASP B 200 5.094 -20.296 -1.648 1.00 24.21 C ATOM 1423 OD1 ASP B 200 4.212 -20.358 -0.755 1.00 24.90 O ATOM 1424 OD2 ASP B 200 5.178 -19.313 -2.414 1.00 25.54 O ATOM 1425 H ASP B 200 7.236 -21.517 0.552 1.00 0.00 H ATOM 1426 N THR B 201 7.605 -24.319 -1.064 1.00 20.29 N ATOM 1427 CA THR B 201 8.090 -25.676 -1.392 1.00 20.31 C ATOM 1428 C THR B 201 7.322 -26.737 -0.573 1.00 20.24 C ATOM 1429 O THR B 201 6.861 -27.740 -1.120 1.00 19.65 O ATOM 1430 CB THR B 201 9.618 -25.781 -1.169 1.00 20.37 C ATOM 1431 OG1 THR B 201 10.273 -24.854 -2.042 1.00 19.78 O ATOM 1432 CG2 THR B 201 10.157 -27.215 -1.419 1.00 20.78 C ATOM 1433 HG1 THR B 201 9.965 -23.936 -1.838 1.00 0.00 H ATOM 1434 H THR B 201 8.257 -23.638 -0.625 1.00 0.00 H ATOM 1435 N LEU B 202 7.175 -26.487 0.730 1.00 20.80 N ATOM 1436 CA LEU B 202 6.390 -27.362 1.607 1.00 21.51 C ATOM 1437 C LEU B 202 4.946 -27.432 1.140 1.00 22.16 C ATOM 1438 O LEU B 202 4.337 -28.508 1.148 1.00 22.70 O ATOM 1439 CB LEU B 202 6.451 -26.884 3.064 1.00 21.38 C ATOM 1440 CG LEU B 202 7.801 -26.961 3.786 1.00 22.00 C ATOM 1441 CD1 LEU B 202 7.751 -26.193 5.105 1.00 20.58 C ATOM 1442 CD2 LEU B 202 8.217 -28.437 4.009 1.00 21.81 C ATOM 1443 H LEU B 202 7.631 -25.645 1.136 1.00 0.00 H ATOM 1444 N LEU B 203 4.404 -26.293 0.700 1.00 22.43 N ATOM 1445 CA LEU B 203 3.012 -26.249 0.219 1.00 22.46 C ATOM 1446 C LEU B 203 2.824 -26.988 -1.099 1.00 22.32 C ATOM 1447 O LEU B 203 1.832 -27.683 -1.278 1.00 22.42 O ATOM 1448 CB LEU B 203 2.507 -24.794 0.122 1.00 22.42 C ATOM 1449 CG LEU B 203 1.084 -24.490 -0.347 1.00 22.88 C ATOM 1450 CD1 LEU B 203 0.012 -25.009 0.667 1.00 22.21 C ATOM 1451 CD2 LEU B 203 0.969 -22.974 -0.563 1.00 22.47 C ATOM 1452 H LEU B 203 4.974 -25.423 0.697 1.00 0.00 H ATOM 1453 N LEU B 204 3.764 -26.819 -2.025 1.00 22.62 N ATOM 1454 CA LEU B 204 3.751 -27.567 -3.289 1.00 23.33 C ATOM 1455 C LEU B 204 3.724 -29.079 -3.065 1.00 23.66 C ATOM 1456 O LEU B 204 2.952 -29.789 -3.700 1.00 23.50 O ATOM 1457 CB LEU B 204 4.954 -27.181 -4.172 1.00 22.85 C ATOM 1458 CG LEU B 204 4.891 -25.826 -4.913 1.00 22.44 C ATOM 1459 CD1 LEU B 204 6.296 -25.298 -5.270 1.00 21.22 C ATOM 1460 CD2 LEU B 204 3.974 -25.879 -6.162 1.00 17.97 C ATOM 1461 H LEU B 204 4.530 -26.138 -1.849 1.00 0.00 H ATOM 1462 N GLU B 205 4.569 -29.563 -2.158 1.00 25.20 N ATOM 1463 CA GLU B 205 4.625 -30.991 -1.840 1.00 26.59 C ATOM 1464 C GLU B 205 3.290 -31.457 -1.259 1.00 26.39 C ATOM 1465 O GLU B 205 2.681 -32.386 -1.790 1.00 26.48 O ATOM 1466 CB GLU B 205 5.788 -31.305 -0.882 1.00 26.39 C ATOM 1467 CG GLU B 205 5.899 -32.783 -0.525 1.00 27.26 C ATOM 1468 CD GLU B 205 7.093 -33.084 0.363 1.00 28.98 C ATOM 1469 OE1 GLU B 205 7.479 -32.209 1.182 1.00 31.49 O ATOM 1470 OE2 GLU B 205 7.646 -34.205 0.241 1.00 31.43 O ATOM 1471 H GLU B 205 5.207 -28.909 -1.661 1.00 0.00 H ATOM 1472 N GLU B 206 2.832 -30.771 -0.210 1.00 26.50 N ATOM 1473 CA GLU B 206 1.579 -31.089 0.459 1.00 27.19 C ATOM 1474 C GLU B 206 0.364 -31.091 -0.475 1.00 27.26 C ATOM 1475 O GLU B 206 -0.516 -31.949 -0.346 1.00 26.88 O ATOM 1476 CB GLU B 206 1.364 -30.137 1.634 1.00 27.76 C ATOM 1477 CG GLU B 206 0.127 -30.419 2.484 1.00 30.61 C ATOM 1478 CD GLU B 206 0.302 -29.978 3.946 1.00 36.42 C ATOM 1479 OE1 GLU B 206 -0.280 -28.925 4.304 1.00 38.05 O ATOM 1480 OE2 GLU B 206 1.007 -30.683 4.733 1.00 36.07 O ATOM 1481 H GLU B 206 3.396 -29.973 0.146 1.00 0.00 H ATOM 1482 N CYS B 207 0.331 -30.145 -1.416 1.00 26.57 N ATOM 1483 CA CYS B 207 -0.764 -30.033 -2.375 1.00 26.24 C ATOM 1484 C CYS B 207 -0.780 -31.133 -3.434 1.00 26.13 C ATOM 1485 O CYS B 207 -1.706 -31.195 -4.240 1.00 26.18 O ATOM 1486 CB CYS B 207 -0.768 -28.647 -3.041 1.00 26.08 C ATOM 1487 SG CYS B 207 -1.511 -27.351 -1.989 1.00 27.14 S ATOM 1488 H CYS B 207 1.114 -29.463 -1.468 1.00 0.00 H ATOM 1489 N GLY B 208 0.230 -32.001 -3.426 1.00 25.72 N ATOM 1490 CA GLY B 208 0.323 -33.100 -4.396 1.00 25.37 C ATOM 1491 C GLY B 208 0.848 -32.719 -5.771 1.00 25.16 C ATOM 1492 O GLY B 208 0.653 -33.456 -6.734 1.00 25.68 O ATOM 1493 H GLY B 208 0.977 -31.897 -2.710 1.00 0.00 H ATOM 1494 N LEU B 209 1.545 -31.588 -5.861 1.00 24.84 N ATOM 1495 CA LEU B 209 1.948 -31.027 -7.160 1.00 24.62 C ATOM 1496 C LEU B 209 3.345 -31.450 -7.600 1.00 24.26 C ATOM 1497 O LEU B 209 3.753 -31.189 -8.738 1.00 23.94 O ATOM 1498 CB LEU B 209 1.836 -29.499 -7.145 1.00 24.08 C ATOM 1499 CG LEU B 209 0.415 -28.921 -7.146 1.00 24.95 C ATOM 1500 CD1 LEU B 209 0.395 -27.533 -6.447 1.00 24.27 C ATOM 1501 CD2 LEU B 209 -0.141 -28.837 -8.569 1.00 22.85 C ATOM 1502 H LEU B 209 1.812 -31.088 -4.989 1.00 0.00 H ATOM 1503 N LEU B 210 4.085 -32.087 -6.695 1.00 23.75 N ATOM 1504 CA LEU B 210 5.399 -32.623 -7.043 1.00 23.79 C ATOM 1505 C LEU B 210 5.322 -34.139 -7.321 1.00 24.31 C ATOM 1506 O LEU B 210 4.584 -34.868 -6.661 1.00 25.13 O ATOM 1507 CB LEU B 210 6.437 -32.289 -5.957 1.00 22.94 C ATOM 1508 CG LEU B 210 6.471 -30.854 -5.393 1.00 22.15 C ATOM 1509 CD1 LEU B 210 7.476 -30.730 -4.261 1.00 19.30 C ATOM 1510 CD2 LEU B 210 6.745 -29.764 -6.463 1.00 21.06 C ATOM 1511 H LEU B 210 3.723 -32.205 -5.727 1.00 0.00 H ATOM 1512 N ARG B 211 6.071 -34.601 -8.314 1.00 24.15 N ATOM 1513 CA ARG B 211 6.191 -36.025 -8.594 1.00 24.55 C ATOM 1514 C ARG B 211 7.671 -36.359 -8.659 1.00 24.05 C ATOM 1515 O ARG B 211 8.506 -35.455 -8.703 1.00 24.10 O ATOM 1516 CB ARG B 211 5.517 -36.378 -9.934 1.00 24.07 C ATOM 1517 CG ARG B 211 6.026 -35.539 -11.105 1.00 25.54 C ATOM 1518 CD ARG B 211 5.658 -36.137 -12.473 1.00 25.89 C ATOM 1519 NE ARG B 211 6.099 -35.267 -13.566 1.00 27.62 N ATOM 1520 CZ ARG B 211 7.361 -35.171 -13.958 1.00 27.55 C ATOM 1521 NH1 ARG B 211 8.290 -35.891 -13.338 1.00 29.45 N ATOM 1522 NH2 ARG B 211 7.698 -34.366 -14.957 1.00 26.27 N ATOM 1523 HE ARG B 211 5.384 -34.695 -14.060 1.00 0.00 H ATOM 1524 HH12 ARG B 211 9.284 -35.825 -13.636 1.00 0.00 H ATOM 1525 HH11 ARG B 211 8.023 -36.521 -12.555 1.00 0.00 H ATOM 1526 HH22 ARG B 211 8.691 -34.298 -15.257 1.00 0.00 H ATOM 1527 HH21 ARG B 211 6.969 -33.803 -15.440 1.00 0.00 H ATOM 1528 H ARG B 211 6.589 -33.925 -8.911 1.00 0.00 H ATOM 1529 N LYS B 212 8.003 -37.648 -8.674 1.00 24.03 N ATOM 1530 CA LYS B 212 9.384 -38.073 -8.940 1.00 23.88 C ATOM 1531 C LYS B 212 9.858 -37.437 -10.256 1.00 23.35 C ATOM 1532 O LYS B 212 9.238 -37.628 -11.309 1.00 23.03 O ATOM 1533 CB LYS B 212 9.493 -39.601 -8.970 1.00 23.31 C ATOM 1534 CG LYS B 212 10.810 -40.139 -9.511 1.00 24.60 C ATOM 1535 CD LYS B 212 10.857 -41.679 -9.462 1.00 25.21 C ATOM 1536 CE LYS B 212 12.027 -42.259 -10.271 1.00 26.04 C ATOM 1537 NZ LYS B 212 13.325 -41.536 -10.060 1.00 27.59 N ATOM 1538 HZ1 LYS B 212 13.216 -40.541 -10.343 1.00 0.00 H ATOM 1539 HZ2 LYS B 212 13.589 -41.585 -9.055 1.00 0.00 H ATOM 1540 HZ3 LYS B 212 14.067 -41.982 -10.637 1.00 0.00 H ATOM 1541 H LYS B 212 7.273 -38.366 -8.494 1.00 0.00 H ATOM 1542 N GLY B 213 10.928 -36.643 -10.172 1.00 22.76 N ATOM 1543 CA GLY B 213 11.447 -35.926 -11.328 1.00 22.00 C ATOM 1544 C GLY B 213 11.038 -34.466 -11.475 1.00 21.94 C ATOM 1545 O GLY B 213 11.588 -33.752 -12.321 1.00 22.18 O ATOM 1546 H GLY B 213 11.405 -36.533 -9.254 1.00 0.00 H ATOM 1547 N THR B 214 10.081 -33.996 -10.676 1.00 21.45 N ATOM 1548 CA THR B 214 9.781 -32.554 -10.673 1.00 20.53 C ATOM 1549 C THR B 214 11.059 -31.750 -10.349 1.00 20.67 C ATOM 1550 O THR B 214 11.774 -32.058 -9.395 1.00 20.39 O ATOM 1551 CB THR B 214 8.616 -32.177 -9.724 1.00 19.98 C ATOM 1552 OG1 THR B 214 7.437 -32.886 -10.111 1.00 18.83 O ATOM 1553 CG2 THR B 214 8.320 -30.669 -9.780 1.00 18.75 C ATOM 1554 HG1 THR B 214 7.198 -32.643 -11.041 1.00 0.00 H ATOM 1555 H THR B 214 9.550 -34.643 -10.059 1.00 0.00 H ATOM 1556 N VAL B 215 11.354 -30.762 -11.190 1.00 20.46 N ATOM 1557 CA VAL B 215 12.535 -29.918 -11.047 1.00 20.32 C ATOM 1558 C VAL B 215 12.192 -28.573 -10.371 1.00 20.48 C ATOM 1559 O VAL B 215 11.382 -27.820 -10.892 1.00 20.77 O ATOM 1560 CB VAL B 215 13.179 -29.616 -12.454 1.00 20.95 C ATOM 1561 CG1 VAL B 215 14.428 -28.701 -12.319 1.00 19.90 C ATOM 1562 CG2 VAL B 215 13.489 -30.921 -13.241 1.00 19.28 C ATOM 1563 H VAL B 215 10.711 -30.583 -11.988 1.00 0.00 H ATOM 1564 N LEU B 216 12.818 -28.263 -9.235 1.00 20.24 N ATOM 1565 CA LEU B 216 12.739 -26.904 -8.656 1.00 20.00 C ATOM 1566 C LEU B 216 14.014 -26.155 -8.962 1.00 19.56 C ATOM 1567 O LEU B 216 15.102 -26.692 -8.809 1.00 19.70 O ATOM 1568 CB LEU B 216 12.554 -26.919 -7.137 1.00 19.92 C ATOM 1569 CG LEU B 216 11.471 -27.800 -6.529 1.00 21.39 C ATOM 1570 CD1 LEU B 216 11.526 -27.699 -5.017 1.00 21.04 C ATOM 1571 CD2 LEU B 216 10.079 -27.446 -7.067 1.00 23.86 C ATOM 1572 H LEU B 216 13.374 -28.993 -8.745 1.00 0.00 H ATOM 1573 N LEU B 217 13.884 -24.917 -9.416 1.00 19.55 N ATOM 1574 CA LEU B 217 15.052 -24.068 -9.617 1.00 18.14 C ATOM 1575 C LEU B 217 14.769 -22.765 -8.906 1.00 17.80 C ATOM 1576 O LEU B 217 13.764 -22.131 -9.165 1.00 17.33 O ATOM 1577 CB LEU B 217 15.342 -23.842 -11.116 1.00 18.55 C ATOM 1578 CG LEU B 217 16.568 -22.976 -11.455 1.00 17.03 C ATOM 1579 CD1 LEU B 217 17.900 -23.633 -10.995 1.00 18.27 C ATOM 1580 CD2 LEU B 217 16.628 -22.618 -12.932 1.00 17.31 C ATOM 1581 H LEU B 217 12.937 -24.546 -9.632 1.00 0.00 H ATOM 1582 N ALA B 218 15.665 -22.384 -8.001 1.00 18.15 N ATOM 1583 CA ALA B 218 15.493 -21.214 -7.158 1.00 18.01 C ATOM 1584 C ALA B 218 16.600 -20.198 -7.398 1.00 18.07 C ATOM 1585 O ALA B 218 17.774 -20.509 -7.251 1.00 18.20 O ATOM 1586 CB ALA B 218 15.475 -21.636 -5.680 1.00 17.86 C ATOM 1587 H ALA B 218 16.530 -22.951 -7.891 1.00 0.00 H ATOM 1588 N ASP B 219 16.220 -18.976 -7.766 1.00 18.37 N ATOM 1589 CA ASP B 219 17.189 -17.897 -7.946 1.00 18.22 C ATOM 1590 C ASP B 219 17.527 -17.299 -6.578 1.00 18.27 C ATOM 1591 O ASP B 219 16.756 -17.462 -5.634 1.00 18.00 O ATOM 1592 CB ASP B 219 16.585 -16.819 -8.862 1.00 18.21 C ATOM 1593 CG ASP B 219 17.610 -15.778 -9.310 1.00 18.61 C ATOM 1594 OD1 ASP B 219 18.808 -16.107 -9.404 1.00 21.13 O ATOM 1595 OD2 ASP B 219 17.221 -14.620 -9.558 1.00 19.14 O ATOM 1596 H ASP B 219 15.211 -18.785 -7.929 1.00 0.00 H ATOM 1597 N ASN B 220 18.666 -16.618 -6.470 1.00 18.72 N ATOM 1598 CA ASN B 220 18.981 -15.775 -5.291 1.00 19.41 C ATOM 1599 C ASN B 220 19.146 -16.527 -3.970 1.00 19.85 C ATOM 1600 O ASN B 220 18.792 -15.996 -2.904 1.00 20.23 O ATOM 1601 CB ASN B 220 17.898 -14.706 -5.066 1.00 18.93 C ATOM 1602 CG ASN B 220 17.613 -13.876 -6.291 1.00 18.86 C ATOM 1603 OD1 ASN B 220 16.532 -13.971 -6.856 1.00 19.33 O ATOM 1604 ND2 ASN B 220 18.566 -13.041 -6.697 1.00 19.47 N ATOM 1605 HD22 ASN B 220 19.470 -12.995 -6.185 1.00 0.00 H ATOM 1606 HD21 ASN B 220 18.407 -12.434 -7.527 1.00 0.00 H ATOM 1607 H ASN B 220 19.361 -16.679 -7.241 1.00 0.00 H ATOM 1608 N VAL B 221 19.668 -17.748 -4.032 1.00 20.05 N ATOM 1609 CA VAL B 221 19.808 -18.562 -2.831 1.00 20.75 C ATOM 1610 C VAL B 221 20.986 -18.093 -1.970 1.00 21.52 C ATOM 1611 O VAL B 221 21.134 -18.540 -0.821 1.00 21.63 O ATOM 1612 CB VAL B 221 19.855 -20.108 -3.135 1.00 20.77 C ATOM 1613 CG1 VAL B 221 18.563 -20.543 -3.790 1.00 19.40 C ATOM 1614 CG2 VAL B 221 21.067 -20.480 -3.996 1.00 19.61 C ATOM 1615 H VAL B 221 19.980 -18.127 -4.949 1.00 0.00 H ATOM 1616 N ILE B 222 21.785 -17.173 -2.528 1.00 21.74 N ATOM 1617 CA ILE B 222 22.888 -16.533 -1.817 1.00 22.58 C ATOM 1618 C ILE B 222 22.609 -15.046 -1.529 1.00 21.93 C ATOM 1619 O ILE B 222 22.726 -14.605 -0.388 1.00 21.71 O ATOM 1620 CB ILE B 222 24.237 -16.735 -2.537 1.00 22.47 C ATOM 1621 CG1 ILE B 222 24.602 -18.221 -2.551 1.00 23.33 C ATOM 1622 CG2 ILE B 222 25.350 -15.947 -1.841 1.00 22.97 C ATOM 1623 CD1 ILE B 222 25.874 -18.528 -3.387 1.00 25.32 C ATOM 1624 H ILE B 222 21.611 -16.901 -3.517 1.00 0.00 H ATOM 1625 N CYS B 223 22.224 -14.293 -2.556 1.00 21.50 N ATOM 1626 CA CYS B 223 21.866 -12.892 -2.388 1.00 21.47 C ATOM 1627 C CYS B 223 20.587 -12.532 -3.139 1.00 21.53 C ATOM 1628 O CYS B 223 20.544 -12.618 -4.369 1.00 22.19 O ATOM 1629 CB CYS B 223 23.020 -11.958 -2.793 1.00 21.18 C ATOM 1630 SG CYS B 223 22.624 -10.221 -2.576 1.00 20.93 S ATOM 1631 H CYS B 223 22.178 -14.717 -3.505 1.00 0.00 H ATOM 1632 N PRO B 224 19.544 -12.083 -2.412 1.00 21.73 N ATOM 1633 CA PRO B 224 19.473 -11.872 -0.949 1.00 21.47 C ATOM 1634 C PRO B 224 19.544 -13.116 -0.060 1.00 21.37 C ATOM 1635 O PRO B 224 19.768 -13.002 1.142 1.00 21.91 O ATOM 1636 CB PRO B 224 18.122 -11.167 -0.757 1.00 21.45 C ATOM 1637 CG PRO B 224 17.736 -10.649 -2.140 1.00 21.88 C ATOM 1638 CD PRO B 224 18.302 -11.647 -3.093 1.00 21.21 C ATOM 1639 N GLY B 225 19.333 -14.295 -0.629 1.00 21.67 N ATOM 1640 CA GLY B 225 19.577 -15.526 0.104 1.00 20.45 C ATOM 1641 C GLY B 225 18.333 -16.230 0.560 1.00 19.99 C ATOM 1642 O GLY B 225 17.298 -15.608 0.819 1.00 20.59 O ATOM 1643 H GLY B 225 18.989 -14.339 -1.610 1.00 0.00 H ATOM 1644 N ALA B 226 18.434 -17.543 0.666 1.00 19.85 N ATOM 1645 CA ALA B 226 17.338 -18.361 1.189 1.00 20.12 C ATOM 1646 C ALA B 226 17.934 -19.555 1.948 1.00 19.97 C ATOM 1647 O ALA B 226 17.782 -20.680 1.526 1.00 20.24 O ATOM 1648 CB ALA B 226 16.396 -18.818 0.040 1.00 19.45 C ATOM 1649 H ALA B 226 19.316 -18.008 0.370 1.00 0.00 H ATOM 1650 N PRO B 227 18.642 -19.293 3.068 1.00 20.97 N ATOM 1651 CA PRO B 227 19.346 -20.375 3.799 1.00 21.12 C ATOM 1652 C PRO B 227 18.432 -21.471 4.383 1.00 21.50 C ATOM 1653 O PRO B 227 18.820 -22.645 4.372 1.00 22.53 O ATOM 1654 CB PRO B 227 20.127 -19.639 4.906 1.00 21.41 C ATOM 1655 CG PRO B 227 19.567 -18.244 4.962 1.00 21.89 C ATOM 1656 CD PRO B 227 18.802 -17.963 3.700 1.00 20.23 C ATOM 1657 N ASP B 228 17.239 -21.101 4.853 1.00 21.30 N ATOM 1658 CA ASP B 228 16.235 -22.058 5.362 1.00 22.08 C ATOM 1659 C ASP B 228 15.709 -23.022 4.288 1.00 21.02 C ATOM 1660 O ASP B 228 15.607 -24.222 4.526 1.00 20.46 O ATOM 1661 CB ASP B 228 15.064 -21.339 6.078 1.00 23.05 C ATOM 1662 CG ASP B 228 14.426 -20.167 5.232 1.00 28.99 C ATOM 1663 OD1 ASP B 228 15.054 -19.642 4.243 1.00 30.31 O ATOM 1664 OD2 ASP B 228 13.271 -19.749 5.602 1.00 31.62 O ATOM 1665 H ASP B 228 17.004 -20.088 4.861 1.00 0.00 H ATOM 1666 N PHE B 229 15.378 -22.481 3.113 1.00 19.92 N ATOM 1667 CA PHE B 229 15.080 -23.276 1.932 1.00 19.42 C ATOM 1668 C PHE B 229 16.235 -24.224 1.572 1.00 19.08 C ATOM 1669 O PHE B 229 16.003 -25.399 1.316 1.00 19.15 O ATOM 1670 CB PHE B 229 14.723 -22.363 0.734 1.00 19.20 C ATOM 1671 CG PHE B 229 14.659 -23.089 -0.595 1.00 19.89 C ATOM 1672 CD1 PHE B 229 13.498 -23.737 -0.995 1.00 20.86 C ATOM 1673 CD2 PHE B 229 15.767 -23.133 -1.441 1.00 19.44 C ATOM 1674 CE1 PHE B 229 13.434 -24.399 -2.234 1.00 19.49 C ATOM 1675 CE2 PHE B 229 15.707 -23.800 -2.668 1.00 19.43 C ATOM 1676 CZ PHE B 229 14.541 -24.431 -3.058 1.00 19.32 C ATOM 1677 H PHE B 229 15.331 -21.445 3.039 1.00 0.00 H ATOM 1678 N LEU B 230 17.469 -23.718 1.535 1.00 19.24 N ATOM 1679 CA LEU B 230 18.629 -24.573 1.212 1.00 19.78 C ATOM 1680 C LEU B 230 18.827 -25.719 2.224 1.00 20.16 C ATOM 1681 O LEU B 230 19.034 -26.868 1.826 1.00 19.43 O ATOM 1682 CB LEU B 230 19.918 -23.758 1.069 1.00 19.55 C ATOM 1683 CG LEU B 230 20.120 -22.765 -0.086 1.00 18.42 C ATOM 1684 CD1 LEU B 230 21.489 -22.075 0.048 1.00 15.63 C ATOM 1685 CD2 LEU B 230 20.015 -23.496 -1.396 1.00 17.37 C ATOM 1686 H LEU B 230 17.616 -22.708 1.736 1.00 0.00 H ATOM 1687 N ALA B 231 18.756 -25.397 3.522 1.00 20.96 N ATOM 1688 CA ALA B 231 18.874 -26.410 4.586 1.00 21.33 C ATOM 1689 C ALA B 231 17.802 -27.489 4.407 1.00 22.02 C ATOM 1690 O ALA B 231 18.085 -28.685 4.530 1.00 22.97 O ATOM 1691 CB ALA B 231 18.775 -25.764 5.969 1.00 20.72 C ATOM 1692 H ALA B 231 18.613 -24.402 3.787 1.00 0.00 H ATOM 1693 N HIS B 232 16.582 -27.075 4.073 1.00 22.36 N ATOM 1694 CA HIS B 232 15.518 -28.035 3.803 1.00 22.35 C ATOM 1695 C HIS B 232 15.754 -28.968 2.605 1.00 22.32 C ATOM 1696 O HIS B 232 15.727 -30.195 2.765 1.00 22.43 O ATOM 1697 CB HIS B 232 14.150 -27.361 3.669 1.00 22.61 C ATOM 1698 CG HIS B 232 13.041 -28.343 3.433 1.00 23.60 C ATOM 1699 ND1 HIS B 232 12.470 -29.075 4.450 1.00 25.29 N ATOM 1700 CD2 HIS B 232 12.444 -28.759 2.290 1.00 24.31 C ATOM 1701 CE1 HIS B 232 11.554 -29.885 3.948 1.00 25.45 C ATOM 1702 NE2 HIS B 232 11.523 -29.716 2.638 1.00 25.23 N ATOM 1703 H HIS B 232 16.385 -26.056 4.004 1.00 0.00 H ATOM 1704 N VAL B 233 15.947 -28.409 1.408 1.00 22.14 N ATOM 1705 CA VAL B 233 16.084 -29.262 0.201 1.00 21.30 C ATOM 1706 C VAL B 233 17.366 -30.112 0.227 1.00 21.47 C ATOM 1707 O VAL B 233 17.348 -31.297 -0.144 1.00 20.92 O ATOM 1708 CB VAL B 233 15.920 -28.474 -1.158 1.00 21.29 C ATOM 1709 CG1 VAL B 233 14.475 -27.972 -1.330 1.00 20.57 C ATOM 1710 CG2 VAL B 233 16.900 -27.304 -1.297 1.00 19.62 C ATOM 1711 H VAL B 233 16.001 -27.374 1.321 1.00 0.00 H ATOM 1712 N ARG B 234 18.470 -29.513 0.672 1.00 21.72 N ATOM 1713 CA ARG B 234 19.741 -30.252 0.776 1.00 23.02 C ATOM 1714 C ARG B 234 19.695 -31.291 1.902 1.00 23.50 C ATOM 1715 O ARG B 234 20.273 -32.360 1.775 1.00 23.94 O ATOM 1716 CB ARG B 234 20.936 -29.314 0.966 1.00 22.52 C ATOM 1717 CG ARG B 234 21.215 -28.404 -0.239 1.00 23.46 C ATOM 1718 CD ARG B 234 22.000 -27.169 0.167 1.00 20.83 C ATOM 1719 NE ARG B 234 22.495 -26.420 -0.995 1.00 21.17 N ATOM 1720 CZ ARG B 234 23.390 -25.433 -0.916 1.00 18.70 C ATOM 1721 NH1 ARG B 234 23.860 -25.059 0.261 1.00 15.80 N ATOM 1722 NH2 ARG B 234 23.795 -24.802 -2.010 1.00 18.46 N ATOM 1723 HE ARG B 234 22.127 -26.673 -1.934 1.00 0.00 H ATOM 1724 HH12 ARG B 234 24.557 -24.290 0.322 1.00 0.00 H ATOM 1725 HH11 ARG B 234 23.533 -25.534 1.126 1.00 0.00 H ATOM 1726 HH22 ARG B 234 24.493 -24.034 -1.939 1.00 0.00 H ATOM 1727 HH21 ARG B 234 23.415 -25.075 -2.939 1.00 0.00 H ATOM 1728 H ARG B 234 18.434 -28.511 0.949 1.00 0.00 H ATOM 1729 N GLY B 235 18.996 -30.978 2.985 1.00 24.62 N ATOM 1730 CA GLY B 235 18.897 -31.880 4.131 1.00 27.17 C ATOM 1731 C GLY B 235 17.845 -32.969 4.029 1.00 28.69 C ATOM 1732 O GLY B 235 17.751 -33.832 4.894 1.00 29.27 O ATOM 1733 H GLY B 235 18.503 -30.063 3.020 1.00 0.00 H ATOM 1734 N SER B 236 17.048 -32.932 2.972 1.00 30.16 N ATOM 1735 CA SER B 236 15.957 -33.883 2.792 1.00 31.20 C ATOM 1736 C SER B 236 16.298 -34.886 1.694 1.00 31.53 C ATOM 1737 O SER B 236 16.733 -34.496 0.601 1.00 31.90 O ATOM 1738 CB SER B 236 14.657 -33.128 2.479 1.00 31.03 C ATOM 1739 OG SER B 236 13.688 -34.007 1.938 1.00 34.66 O ATOM 1740 HG SER B 236 12.859 -33.503 1.743 1.00 0.00 H ATOM 1741 H SER B 236 17.205 -32.202 2.248 1.00 0.00 H ATOM 1742 N SER B 237 16.105 -36.175 1.979 1.00 31.88 N ATOM 1743 CA SER B 237 16.394 -37.233 0.995 1.00 32.44 C ATOM 1744 C SER B 237 15.380 -37.250 -0.173 1.00 31.66 C ATOM 1745 O SER B 237 15.568 -37.961 -1.169 1.00 31.45 O ATOM 1746 CB SER B 237 16.504 -38.615 1.673 1.00 33.10 C ATOM 1747 OG SER B 237 15.255 -39.012 2.248 1.00 35.28 O ATOM 1748 HG SER B 237 15.357 -39.900 2.674 1.00 0.00 H ATOM 1749 H SER B 237 15.742 -36.439 2.917 1.00 0.00 H ATOM 1750 N CYS B 238 14.332 -36.439 -0.051 1.00 30.87 N ATOM 1751 CA CYS B 238 13.339 -36.257 -1.121 1.00 30.86 C ATOM 1752 C CYS B 238 13.782 -35.339 -2.261 1.00 29.02 C ATOM 1753 O CYS B 238 13.055 -35.184 -3.235 1.00 28.35 O ATOM 1754 CB CYS B 238 12.027 -35.751 -0.545 1.00 30.83 C ATOM 1755 SG CYS B 238 11.222 -37.050 0.388 1.00 39.44 S ATOM 1756 H CYS B 238 14.210 -35.912 0.837 1.00 0.00 H ATOM 1757 N PHE B 239 14.957 -34.725 -2.121 1.00 27.67 N ATOM 1758 CA PHE B 239 15.522 -33.867 -3.174 1.00 26.78 C ATOM 1759 C PHE B 239 16.950 -34.233 -3.490 1.00 26.88 C ATOM 1760 O PHE B 239 17.727 -34.558 -2.594 1.00 27.68 O ATOM 1761 CB PHE B 239 15.486 -32.382 -2.784 1.00 25.87 C ATOM 1762 CG PHE B 239 14.106 -31.839 -2.583 1.00 23.97 C ATOM 1763 CD1 PHE B 239 13.332 -31.445 -3.680 1.00 20.19 C ATOM 1764 CD2 PHE B 239 13.569 -31.744 -1.299 1.00 22.93 C ATOM 1765 CE1 PHE B 239 12.066 -30.936 -3.503 1.00 21.05 C ATOM 1766 CE2 PHE B 239 12.272 -31.237 -1.097 1.00 22.09 C ATOM 1767 CZ PHE B 239 11.523 -30.829 -2.194 1.00 22.74 C ATOM 1768 H PHE B 239 15.492 -34.857 -1.239 1.00 0.00 H ATOM 1769 N GLU B 240 17.294 -34.175 -4.768 1.00 26.46 N ATOM 1770 CA GLU B 240 18.685 -34.192 -5.166 1.00 26.59 C ATOM 1771 C GLU B 240 19.018 -32.800 -5.687 1.00 25.44 C ATOM 1772 O GLU B 240 18.393 -32.325 -6.650 1.00 24.91 O ATOM 1773 CB GLU B 240 18.951 -35.263 -6.225 1.00 26.56 C ATOM 1774 CG GLU B 240 20.417 -35.547 -6.423 1.00 31.82 C ATOM 1775 CD GLU B 240 20.712 -37.017 -6.700 1.00 39.35 C ATOM 1776 OE1 GLU B 240 19.766 -37.846 -6.655 1.00 41.57 O ATOM 1777 OE2 GLU B 240 21.901 -37.345 -6.961 1.00 42.59 O ATOM 1778 H GLU B 240 16.553 -34.116 -5.496 1.00 0.00 H ATOM 1779 N CYS B 241 20.011 -32.173 -5.048 1.00 24.54 N ATOM 1780 CA CYS B 241 20.326 -30.757 -5.245 1.00 23.81 C ATOM 1781 C CYS B 241 21.643 -30.488 -5.970 1.00 23.80 C ATOM 1782 O CYS B 241 22.598 -31.252 -5.847 1.00 23.28 O ATOM 1783 CB CYS B 241 20.355 -30.043 -3.897 1.00 23.19 C ATOM 1784 SG CYS B 241 18.813 -30.130 -3.028 1.00 23.64 S ATOM 1785 H CYS B 241 20.589 -32.719 -4.377 1.00 0.00 H ATOM 1786 N THR B 242 21.674 -29.377 -6.703 1.00 23.55 N ATOM 1787 CA THR B 242 22.869 -28.904 -7.399 1.00 23.78 C ATOM 1788 C THR B 242 22.896 -27.390 -7.255 1.00 23.42 C ATOM 1789 O THR B 242 21.879 -26.723 -7.445 1.00 23.49 O ATOM 1790 CB THR B 242 22.866 -29.281 -8.912 1.00 24.15 C ATOM 1791 OG1 THR B 242 22.587 -30.680 -9.064 1.00 26.30 O ATOM 1792 CG2 THR B 242 24.222 -28.976 -9.584 1.00 23.68 C ATOM 1793 HG1 THR B 242 21.700 -30.883 -8.674 1.00 0.00 H ATOM 1794 H THR B 242 20.802 -28.816 -6.785 1.00 0.00 H ATOM 1795 N HIS B 243 24.063 -26.861 -6.901 1.00 22.63 N ATOM 1796 CA HIS B 243 24.275 -25.431 -6.787 1.00 21.37 C ATOM 1797 C HIS B 243 24.969 -24.865 -8.026 1.00 21.04 C ATOM 1798 O HIS B 243 25.893 -25.466 -8.553 1.00 20.46 O ATOM 1799 CB HIS B 243 25.112 -25.122 -5.553 1.00 20.67 C ATOM 1800 CG HIS B 243 25.210 -23.658 -5.261 1.00 19.68 C ATOM 1801 ND1 HIS B 243 24.110 -22.901 -4.918 1.00 18.56 N ATOM 1802 CD2 HIS B 243 26.267 -22.809 -5.273 1.00 16.46 C ATOM 1803 CE1 HIS B 243 24.486 -21.646 -4.732 1.00 18.65 C ATOM 1804 NE2 HIS B 243 25.787 -21.565 -4.939 1.00 17.39 N ATOM 1805 H HIS B 243 24.858 -27.500 -6.697 1.00 0.00 H ATOM 1806 N TYR B 244 24.491 -23.722 -8.496 1.00 21.20 N ATOM 1807 CA TYR B 244 25.145 -22.998 -9.580 1.00 21.77 C ATOM 1808 C TYR B 244 25.573 -21.627 -9.087 1.00 22.18 C ATOM 1809 O TYR B 244 24.751 -20.711 -8.989 1.00 22.03 O ATOM 1810 CB TYR B 244 24.224 -22.849 -10.798 1.00 21.97 C ATOM 1811 CG TYR B 244 23.640 -24.142 -11.268 1.00 22.05 C ATOM 1812 CD1 TYR B 244 22.365 -24.534 -10.862 1.00 22.69 C ATOM 1813 CD2 TYR B 244 24.365 -24.990 -12.115 1.00 22.74 C ATOM 1814 CE1 TYR B 244 21.809 -25.751 -11.284 1.00 23.49 C ATOM 1815 CE2 TYR B 244 23.830 -26.216 -12.540 1.00 22.76 C ATOM 1816 CZ TYR B 244 22.550 -26.580 -12.122 1.00 23.83 C ATOM 1817 OH TYR B 244 22.010 -27.773 -12.526 1.00 25.40 O ATOM 1818 HH TYR B 244 21.103 -27.871 -12.141 1.00 0.00 H ATOM 1819 H TYR B 244 23.623 -23.329 -8.079 1.00 0.00 H ATOM 1820 N GLN B 245 26.860 -21.489 -8.785 1.00 22.82 N ATOM 1821 CA GLN B 245 27.390 -20.223 -8.332 1.00 24.32 C ATOM 1822 C GLN B 245 27.505 -19.257 -9.503 1.00 23.87 C ATOM 1823 O GLN B 245 28.026 -19.618 -10.573 1.00 23.96 O ATOM 1824 CB GLN B 245 28.750 -20.389 -7.653 1.00 24.21 C ATOM 1825 CG GLN B 245 29.148 -19.100 -6.863 1.00 26.53 C ATOM 1826 CD GLN B 245 30.553 -19.141 -6.306 1.00 27.03 C ATOM 1827 OE1 GLN B 245 31.337 -18.213 -6.520 1.00 30.75 O ATOM 1828 NE2 GLN B 245 30.893 -20.230 -5.609 1.00 30.53 N ATOM 1829 HE22 GLN B 245 30.197 -20.987 -5.455 1.00 0.00 H ATOM 1830 HE21 GLN B 245 31.854 -20.320 -5.221 1.00 0.00 H ATOM 1831 H GLN B 245 27.497 -22.306 -8.876 1.00 0.00 H ATOM 1832 N SER B 246 27.018 -18.035 -9.289 1.00 22.86 N ATOM 1833 CA SER B 246 27.023 -17.007 -10.315 1.00 22.15 C ATOM 1834 C SER B 246 27.144 -15.638 -9.628 1.00 21.92 C ATOM 1835 O SER B 246 27.910 -15.479 -8.668 1.00 21.14 O ATOM 1836 CB SER B 246 25.746 -17.124 -11.185 1.00 22.23 C ATOM 1837 OG SER B 246 25.816 -16.353 -12.378 1.00 21.21 O ATOM 1838 HG SER B 246 26.582 -16.661 -12.924 1.00 0.00 H ATOM 1839 H SER B 246 26.621 -17.810 -8.355 1.00 0.00 H ATOM 1840 N PHE B 247 26.392 -14.653 -10.117 1.00 21.34 N ATOM 1841 CA PHE B 247 26.480 -13.290 -9.609 1.00 21.25 C ATOM 1842 C PHE B 247 25.090 -12.708 -9.581 1.00 20.27 C ATOM 1843 O PHE B 247 24.256 -13.075 -10.406 1.00 20.44 O ATOM 1844 CB PHE B 247 27.367 -12.407 -10.517 1.00 21.47 C ATOM 1845 CG PHE B 247 28.779 -12.901 -10.658 1.00 23.05 C ATOM 1846 CD1 PHE B 247 29.774 -12.469 -9.773 1.00 23.87 C ATOM 1847 CD2 PHE B 247 29.115 -13.810 -11.669 1.00 24.59 C ATOM 1848 CE1 PHE B 247 31.082 -12.935 -9.888 1.00 25.82 C ATOM 1849 CE2 PHE B 247 30.424 -14.296 -11.801 1.00 25.74 C ATOM 1850 CZ PHE B 247 31.414 -13.857 -10.908 1.00 26.22 C ATOM 1851 H PHE B 247 25.722 -14.863 -10.884 1.00 0.00 H ATOM 1852 N LEU B 248 24.849 -11.776 -8.662 1.00 19.22 N ATOM 1853 CA LEU B 248 23.583 -11.037 -8.653 1.00 18.73 C ATOM 1854 C LEU B 248 23.423 -10.291 -9.997 1.00 19.04 C ATOM 1855 O LEU B 248 24.396 -9.726 -10.493 1.00 18.85 O ATOM 1856 CB LEU B 248 23.556 -10.055 -7.472 1.00 17.97 C ATOM 1857 CG LEU B 248 22.303 -9.209 -7.222 1.00 17.65 C ATOM 1858 CD1 LEU B 248 21.166 -10.087 -6.725 1.00 14.41 C ATOM 1859 CD2 LEU B 248 22.603 -8.085 -6.220 1.00 17.57 C ATOM 1860 H LEU B 248 25.569 -11.569 -7.940 1.00 0.00 H ATOM 1861 N GLU B 249 22.218 -10.290 -10.574 1.00 19.62 N ATOM 1862 CA GLU B 249 21.971 -9.607 -11.858 1.00 20.22 C ATOM 1863 C GLU B 249 22.626 -8.224 -11.917 1.00 20.59 C ATOM 1864 O GLU B 249 22.473 -7.429 -10.983 1.00 20.11 O ATOM 1865 CB GLU B 249 20.474 -9.480 -12.173 1.00 20.35 C ATOM 1866 CG GLU B 249 19.583 -8.931 -11.037 1.00 20.81 C ATOM 1867 CD GLU B 249 19.062 -10.035 -10.121 1.00 21.81 C ATOM 1868 OE1 GLU B 249 19.744 -11.071 -9.920 1.00 22.11 O ATOM 1869 OE2 GLU B 249 17.954 -9.872 -9.604 1.00 22.78 O ATOM 1870 H GLU B 249 21.432 -10.784 -10.105 1.00 0.00 H ATOM 1871 N TYR B 250 23.368 -7.968 -13.007 1.00 21.14 N ATOM 1872 CA TYR B 250 23.943 -6.643 -13.327 1.00 21.76 C ATOM 1873 C TYR B 250 25.025 -6.201 -12.335 1.00 22.66 C ATOM 1874 O TYR B 250 25.408 -5.041 -12.310 1.00 23.11 O ATOM 1875 CB TYR B 250 22.836 -5.561 -13.474 1.00 21.52 C ATOM 1876 CG TYR B 250 21.605 -6.049 -14.225 1.00 22.04 C ATOM 1877 CD1 TYR B 250 21.682 -6.416 -15.579 1.00 22.45 C ATOM 1878 CD2 TYR B 250 20.369 -6.179 -13.575 1.00 21.19 C ATOM 1879 CE1 TYR B 250 20.549 -6.897 -16.267 1.00 21.17 C ATOM 1880 CE2 TYR B 250 19.248 -6.659 -14.237 1.00 20.47 C ATOM 1881 CZ TYR B 250 19.339 -7.014 -15.589 1.00 22.42 C ATOM 1882 OH TYR B 250 18.221 -7.489 -16.248 1.00 22.74 O ATOM 1883 HH TYR B 250 18.455 -7.692 -17.188 1.00 0.00 H ATOM 1884 H TYR B 250 23.550 -8.750 -13.668 1.00 0.00 H ATOM 1885 N ARG B 251 25.529 -7.131 -11.526 1.00 23.34 N ATOM 1886 CA ARG B 251 26.478 -6.796 -10.466 1.00 23.91 C ATOM 1887 C ARG B 251 27.614 -7.809 -10.380 1.00 24.65 C ATOM 1888 O ARG B 251 27.601 -8.831 -11.079 1.00 24.26 O ATOM 1889 CB ARG B 251 25.761 -6.688 -9.105 1.00 23.53 C ATOM 1890 CG ARG B 251 24.655 -5.619 -9.036 1.00 24.91 C ATOM 1891 CD ARG B 251 25.196 -4.186 -9.237 1.00 25.82 C ATOM 1892 NE ARG B 251 24.198 -3.173 -8.884 1.00 29.10 N ATOM 1893 CZ ARG B 251 24.160 -1.932 -9.380 1.00 30.56 C ATOM 1894 NH1 ARG B 251 25.072 -1.523 -10.263 1.00 28.86 N ATOM 1895 NH2 ARG B 251 23.207 -1.089 -8.988 1.00 29.11 N ATOM 1896 HE ARG B 251 23.465 -3.439 -8.196 1.00 0.00 H ATOM 1897 HH12 ARG B 251 25.032 -0.555 -10.642 1.00 0.00 H ATOM 1898 HH11 ARG B 251 25.823 -2.172 -10.573 1.00 0.00 H ATOM 1899 HH22 ARG B 251 23.176 -0.123 -9.373 1.00 0.00 H ATOM 1900 HH21 ARG B 251 22.493 -1.396 -8.297 1.00 0.00 H ATOM 1901 H ARG B 251 25.240 -8.122 -11.652 1.00 0.00 H ATOM 1902 N GLU B 252 28.580 -7.505 -9.507 1.00 25.59 N ATOM 1903 CA GLU B 252 29.743 -8.356 -9.226 1.00 26.91 C ATOM 1904 C GLU B 252 29.624 -9.058 -7.879 1.00 25.70 C ATOM 1905 O GLU B 252 30.520 -9.806 -7.466 1.00 25.42 O ATOM 1906 CB GLU B 252 31.033 -7.531 -9.270 1.00 27.47 C ATOM 1907 CG GLU B 252 31.349 -7.020 -10.655 1.00 33.64 C ATOM 1908 CD GLU B 252 32.762 -6.476 -10.778 1.00 40.60 C ATOM 1909 OE1 GLU B 252 33.140 -6.088 -11.906 1.00 44.80 O ATOM 1910 OE2 GLU B 252 33.488 -6.431 -9.757 1.00 43.55 O ATOM 1911 H GLU B 252 28.502 -6.605 -8.992 1.00 0.00 H ATOM 1912 N VAL B 253 28.513 -8.807 -7.198 1.00 24.93 N ATOM 1913 CA VAL B 253 28.174 -9.531 -5.976 1.00 23.70 C ATOM 1914 C VAL B 253 27.902 -11.010 -6.298 1.00 23.17 C ATOM 1915 O VAL B 253 27.141 -11.329 -7.223 1.00 22.26 O ATOM 1916 CB VAL B 253 26.931 -8.910 -5.292 1.00 23.69 C ATOM 1917 CG1 VAL B 253 26.539 -9.699 -4.055 1.00 23.26 C ATOM 1918 CG2 VAL B 253 27.188 -7.458 -4.935 1.00 23.90 C ATOM 1919 H VAL B 253 27.864 -8.072 -7.545 1.00 0.00 H ATOM 1920 N VAL B 254 28.518 -11.897 -5.522 1.00 22.54 N ATOM 1921 CA VAL B 254 28.296 -13.334 -5.668 1.00 22.40 C ATOM 1922 C VAL B 254 26.842 -13.723 -5.326 1.00 21.99 C ATOM 1923 O VAL B 254 26.267 -13.251 -4.339 1.00 22.56 O ATOM 1924 CB VAL B 254 29.310 -14.153 -4.832 1.00 22.75 C ATOM 1925 CG1 VAL B 254 28.991 -15.663 -4.898 1.00 22.85 C ATOM 1926 CG2 VAL B 254 30.753 -13.878 -5.313 1.00 22.29 C ATOM 1927 H VAL B 254 29.176 -11.559 -4.791 1.00 0.00 H ATOM 1928 N ASP B 255 26.239 -14.545 -6.180 1.00 20.93 N ATOM 1929 CA ASP B 255 24.917 -15.093 -5.933 1.00 19.80 C ATOM 1930 C ASP B 255 24.917 -16.526 -6.476 1.00 19.61 C ATOM 1931 O ASP B 255 25.924 -16.972 -6.984 1.00 20.55 O ATOM 1932 CB ASP B 255 23.844 -14.221 -6.595 1.00 19.45 C ATOM 1933 CG ASP B 255 22.436 -14.607 -6.177 1.00 19.73 C ATOM 1934 OD1 ASP B 255 22.280 -15.279 -5.126 1.00 18.68 O ATOM 1935 OD2 ASP B 255 21.489 -14.258 -6.906 1.00 20.19 O ATOM 1936 H ASP B 255 26.733 -14.805 -7.058 1.00 0.00 H ATOM 1937 N GLY B 256 23.809 -17.249 -6.369 1.00 19.21 N ATOM 1938 CA GLY B 256 23.716 -18.574 -6.945 1.00 18.21 C ATOM 1939 C GLY B 256 22.288 -19.064 -7.112 1.00 18.53 C ATOM 1940 O GLY B 256 21.355 -18.519 -6.531 1.00 18.18 O ATOM 1941 H GLY B 256 22.991 -16.856 -5.861 1.00 0.00 H ATOM 1942 N LEU B 257 22.128 -20.105 -7.922 1.00 18.71 N ATOM 1943 CA LEU B 257 20.858 -20.779 -8.090 1.00 18.76 C ATOM 1944 C LEU B 257 21.010 -22.180 -7.513 1.00 18.80 C ATOM 1945 O LEU B 257 22.108 -22.702 -7.434 1.00 18.18 O ATOM 1946 CB LEU B 257 20.443 -20.834 -9.567 1.00 19.04 C ATOM 1947 CG LEU B 257 20.199 -19.483 -10.261 1.00 19.38 C ATOM 1948 CD1 LEU B 257 21.452 -19.029 -10.991 1.00 16.96 C ATOM 1949 CD2 LEU B 257 18.953 -19.522 -11.217 1.00 19.02 C ATOM 1950 H LEU B 257 22.950 -20.450 -8.458 1.00 0.00 H ATOM 1951 N GLU B 258 19.901 -22.763 -7.080 1.00 18.70 N ATOM 1952 CA GLU B 258 19.889 -24.128 -6.617 1.00 18.97 C ATOM 1953 C GLU B 258 18.864 -24.892 -7.444 1.00 19.36 C ATOM 1954 O GLU B 258 17.727 -24.449 -7.622 1.00 19.09 O ATOM 1955 CB GLU B 258 19.508 -24.170 -5.130 1.00 19.43 C ATOM 1956 CG GLU B 258 19.777 -25.518 -4.441 1.00 19.54 C ATOM 1957 CD GLU B 258 21.241 -25.744 -4.101 1.00 19.56 C ATOM 1958 OE1 GLU B 258 22.063 -24.798 -4.268 1.00 17.56 O ATOM 1959 OE2 GLU B 258 21.564 -26.880 -3.652 1.00 19.94 O ATOM 1960 H GLU B 258 19.014 -22.220 -7.074 1.00 0.00 H ATOM 1961 N LYS B 259 19.271 -26.033 -7.966 1.00 19.45 N ATOM 1962 CA LYS B 259 18.330 -26.919 -8.596 1.00 19.78 C ATOM 1963 C LYS B 259 18.066 -28.031 -7.605 1.00 19.74 C ATOM 1964 O LYS B 259 18.995 -28.574 -7.019 1.00 19.95 O ATOM 1965 CB LYS B 259 18.872 -27.471 -9.927 1.00 19.60 C ATOM 1966 CG LYS B 259 17.878 -28.391 -10.659 1.00 19.75 C ATOM 1967 CD LYS B 259 18.343 -28.808 -12.074 1.00 20.13 C ATOM 1968 CE LYS B 259 19.484 -29.848 -12.051 1.00 20.09 C ATOM 1969 NZ LYS B 259 19.885 -30.227 -13.459 1.00 21.01 N ATOM 1970 HZ1 LYS B 259 19.066 -30.635 -13.954 1.00 0.00 H ATOM 1971 HZ2 LYS B 259 20.211 -29.379 -13.966 1.00 0.00 H ATOM 1972 HZ3 LYS B 259 20.653 -30.927 -13.423 1.00 0.00 H ATOM 1973 H LYS B 259 20.277 -26.293 -7.922 1.00 0.00 H ATOM 1974 N ALA B 260 16.796 -28.344 -7.400 1.00 19.59 N ATOM 1975 CA ALA B 260 16.417 -29.429 -6.508 1.00 20.09 C ATOM 1976 C ALA B 260 15.416 -30.336 -7.213 1.00 20.55 C ATOM 1977 O ALA B 260 14.300 -29.915 -7.535 1.00 20.29 O ATOM 1978 CB ALA B 260 15.835 -28.873 -5.163 1.00 19.38 C ATOM 1979 H ALA B 260 16.053 -27.803 -7.887 1.00 0.00 H ATOM 1980 N ILE B 261 15.829 -31.573 -7.476 1.00 21.57 N ATOM 1981 CA ILE B 261 14.944 -32.556 -8.132 1.00 22.12 C ATOM 1982 C ILE B 261 14.227 -33.392 -7.085 1.00 21.73 C ATOM 1983 O ILE B 261 14.867 -34.056 -6.275 1.00 22.43 O ATOM 1984 CB ILE B 261 15.699 -33.499 -9.109 1.00 22.23 C ATOM 1985 CG1 ILE B 261 16.753 -32.740 -9.941 1.00 23.28 C ATOM 1986 CG2 ILE B 261 14.710 -34.323 -9.992 1.00 21.19 C ATOM 1987 CD1 ILE B 261 16.216 -31.830 -10.957 1.00 26.22 C ATOM 1988 H ILE B 261 16.796 -31.853 -7.214 1.00 0.00 H ATOM 1989 N TYR B 262 12.904 -33.340 -7.096 1.00 22.14 N ATOM 1990 CA TYR B 262 12.081 -34.208 -6.254 1.00 22.86 C ATOM 1991 C TYR B 262 12.237 -35.692 -6.624 1.00 23.51 C ATOM 1992 O TYR B 262 12.157 -36.067 -7.812 1.00 23.19 O ATOM 1993 CB TYR B 262 10.607 -33.810 -6.350 1.00 22.53 C ATOM 1994 CG TYR B 262 9.752 -34.311 -5.202 1.00 22.33 C ATOM 1995 CD1 TYR B 262 10.037 -33.945 -3.875 1.00 22.88 C ATOM 1996 CD2 TYR B 262 8.644 -35.123 -5.437 1.00 21.85 C ATOM 1997 CE1 TYR B 262 9.242 -34.382 -2.825 1.00 22.47 C ATOM 1998 CE2 TYR B 262 7.842 -35.562 -4.387 1.00 21.92 C ATOM 1999 CZ TYR B 262 8.146 -35.189 -3.090 1.00 21.78 C ATOM 2000 OH TYR B 262 7.350 -35.618 -2.048 1.00 22.96 O ATOM 2001 HH TYR B 262 7.706 -35.264 -1.195 1.00 0.00 H ATOM 2002 H TYR B 262 12.434 -32.658 -7.725 1.00 0.00 H ATOM 2003 N LYS B 263 12.468 -36.521 -5.603 1.00 24.10 N ATOM 2004 CA LYS B 263 12.667 -37.960 -5.803 1.00 25.45 C ATOM 2005 C LYS B 263 11.363 -38.739 -5.622 1.00 25.59 C ATOM 2006 O LYS B 263 11.328 -39.940 -5.855 1.00 25.73 O ATOM 2007 CB LYS B 263 13.737 -38.535 -4.837 1.00 25.37 C ATOM 2008 CG LYS B 263 15.056 -37.766 -4.728 1.00 27.33 C ATOM 2009 CD LYS B 263 15.813 -37.742 -6.026 1.00 31.18 C ATOM 2010 CE LYS B 263 16.775 -38.907 -6.132 1.00 34.13 C ATOM 2011 NZ LYS B 263 17.466 -38.921 -7.464 1.00 33.63 N ATOM 2012 HZ1 LYS B 263 16.757 -39.006 -8.220 1.00 0.00 H ATOM 2013 HZ2 LYS B 263 18.000 -38.037 -7.585 1.00 0.00 H ATOM 2014 HZ3 LYS B 263 18.118 -39.730 -7.506 1.00 0.00 H ATOM 2015 H LYS B 263 12.508 -36.135 -4.638 1.00 0.00 H ATOM 2016 N GLY B 264 10.302 -38.056 -5.207 1.00 25.96 N ATOM 2017 CA GLY B 264 9.086 -38.731 -4.739 1.00 26.66 C ATOM 2018 C GLY B 264 9.011 -38.711 -3.217 1.00 27.17 C ATOM 2019 O GLY B 264 10.017 -38.427 -2.557 1.00 26.84 O ATOM 2020 H GLY B 264 10.334 -37.017 -5.214 1.00 0.00 H ATOM 2021 N PRO B 265 7.823 -39.009 -2.651 1.00 27.89 N ATOM 2022 CA PRO B 265 7.613 -38.973 -1.200 1.00 28.86 C ATOM 2023 C PRO B 265 8.076 -40.253 -0.471 1.00 29.79 C ATOM 2024 O PRO B 265 8.480 -41.240 -1.118 1.00 30.50 O ATOM 2025 CB PRO B 265 6.100 -38.822 -1.082 1.00 28.76 C ATOM 2026 CG PRO B 265 5.586 -39.630 -2.257 1.00 28.57 C ATOM 2027 CD PRO B 265 6.594 -39.417 -3.369 1.00 28.02 C TER 2028 PRO B 265 HETATM 2029 MG MG A 1 15.706 -13.389 -8.786 1.00 20.31 MG HETATM 2030 O HOH 2 -1.077 -28.007 6.443 1.00 24.55 O HETATM 2031 O HOH 3 -7.029 -27.226 -6.137 1.00 31.22 O HETATM 2032 O HOH 4 22.062 -18.776 1.662 1.00 23.95 O HETATM 2033 O HOH 5 23.665 -28.524 -3.870 1.00 22.68 O HETATM 2034 O HOH 6 26.957 -12.797 -1.693 1.00 22.76 O HETATM 2035 O HOH 7 10.704 -31.572 -17.201 1.00 26.86 O HETATM 2036 O HOH 8 10.293 -32.928 -14.780 1.00 17.21 O HETATM 2037 O HOH 9 22.721 -3.835 -6.609 1.00 34.71 O HETATM 2038 O HOH 10 15.490 -15.035 2.917 1.00 27.91 O HETATM 2039 O HOH 11 9.151 -41.296 1.668 1.00 42.76 O HETATM 2040 O HOH 12 3.956 -33.085 -17.977 1.00 43.38 O HETATM 2041 O HOH 13 17.274 1.071 -9.605 1.00 29.97 O HETATM 2042 O HOH 14 25.674 -22.648 -1.365 1.00 29.60 O HETATM 2043 O HOH 15 23.013 -25.577 3.082 1.00 17.17 O HETATM 2044 O HOH 16 20.588 1.727 -10.798 1.00 24.57 O HETATM 2045 O HOH 17 30.295 -11.033 -3.224 1.00 23.73 O HETATM 2046 O HOH 18 -4.614 -28.829 -3.988 1.00 27.29 O HETATM 2047 O HOH 19 22.309 -23.319 4.297 1.00 35.06 O HETATM 2048 O HOH 20 20.368 -33.852 -10.051 1.00 26.98 O HETATM 2049 O HOH 21 15.306 -12.295 -10.461 1.00 14.02 O HETATM 2050 O HOH 22 12.337 -19.416 2.360 1.00 20.32 O HETATM 2051 O HOH 23 11.118 -9.124 -14.920 1.00 21.95 O HETATM 2052 O HOH 24 19.838 -31.604 -8.870 1.00 19.92 O HETATM 2053 O HOH 25 20.556 -28.516 -15.709 1.00 16.11 O HETATM 2054 O HOH 26 8.606 -13.150 -15.566 1.00 22.19 O HETATM 2055 O HOH 27 3.685 -33.404 -4.032 1.00 21.17 O HETATM 2056 O HOH 28 24.144 -12.072 -13.011 1.00 15.28 O HETATM 2057 O HOH 29 -2.738 -10.034 -5.435 1.00 26.61 O HETATM 2058 O HOH 30 22.128 -12.340 -14.496 1.00 18.33 O HETATM 2059 O HOH 31 -3.148 -27.300 -6.876 1.00 26.01 O HETATM 2060 O HOH 32 -2.342 -9.622 -27.064 1.00 28.33 O HETATM 2061 O HOH 33 23.297 -10.067 -15.536 1.00 27.68 O HETATM 2062 O HOH 34 5.127 -12.889 -0.419 1.00 28.70 O HETATM 2063 O HOH 35 -2.279 -15.097 -19.583 1.00 28.75 O HETATM 2064 O HOH 36 22.516 -1.657 -13.015 1.00 24.83 O HETATM 2065 O HOH 37 9.904 5.866 -20.235 1.00 30.21 O HETATM 2066 O HOH 38 22.657 0.857 -12.359 1.00 32.38 O HETATM 2067 O HOH 39 13.840 -14.953 -30.057 1.00 29.06 O HETATM 2068 O HOH 40 -5.521 -13.662 -12.673 1.00 27.71 O HETATM 2069 O HOH 41 4.068 -24.005 3.822 1.00 27.21 O HETATM 2070 O HOH 42 10.018 -10.560 -34.736 1.00 31.96 O HETATM 2071 O HOH 43 4.180 1.922 -19.090 1.00 38.92 O HETATM 2072 O HOH 44 18.333 -1.337 -25.674 1.00 37.26 O HETATM 2073 O HOH 45 26.190 -10.265 -13.084 1.00 24.83 O HETATM 2074 O HOH 46 10.443 -1.242 -30.820 1.00 27.81 O HETATM 2075 O HOH 47 -2.923 -10.934 -23.610 1.00 39.75 O HETATM 2076 O HOH 48 4.851 -0.973 -11.007 1.00 37.64 O HETATM 2077 O HOH 49 21.315 -28.048 -20.715 1.00 26.03 O HETATM 2078 O HOH 50 8.862 -27.674 -23.746 1.00 42.02 O HETATM 2079 O HOH 51 2.210 -26.625 3.635 1.00 36.97 O HETATM 2080 O HOH 52 30.266 -16.468 -8.496 1.00 26.88 O HETATM 2081 O HOH 53 6.657 -12.485 1.780 1.00 34.22 O HETATM 2082 O HOH 54 11.935 -27.693 -24.037 1.00 43.91 O HETATM 2083 O HOH 55 -0.869 -14.978 -22.218 1.00 28.71 O HETATM 2084 O HOH 56 12.119 4.336 -20.630 1.00 26.40 O HETATM 2085 O HOH 57 26.091 -17.817 -16.673 1.00 27.58 O HETATM 2086 O HOH 58 -1.792 -5.547 -19.144 1.00 34.78 O HETATM 2087 O HOH 59 27.300 -17.596 -14.288 1.00 27.73 O HETATM 2088 O HOH 60 1.344 -11.820 -28.630 1.00 40.21 O HETATM 2089 O HOH 61 21.477 -19.752 -23.267 1.00 32.19 O HETATM 2090 O HOH 62 10.874 -18.806 5.462 1.00 33.76 O HETATM 2091 O HOH 63 -0.046 -31.302 -15.177 1.00 36.68 O HETATM 2092 O HOH 64 15.162 -25.616 6.972 1.00 30.88 O HETATM 2093 O HOH 65 2.853 -18.853 -28.193 1.00 69.54 O HETATM 2094 O HOH 66 13.711 -4.005 -9.241 1.00 13.81 O HETATM 2095 C12 UNN A 67 14.256 -7.382 -3.981 1.00 -0.05 C HETATM 2096 C11 UNN A 67 13.684 -6.786 -2.840 1.00 -0.06 C HETATM 2097 C10 UNN A 67 13.309 -7.572 -1.745 1.00 -0.05 C HETATM 2098 C9 UNN A 67 13.467 -8.959 -1.736 1.00 -0.02 C HETATM 2099 C13 UNN A 67 13.073 -9.807 -0.543 1.00 -0.02 C HETATM 2100 C18 UNN A 67 13.951 -10.765 -0.027 1.00 -0.05 C HETATM 2101 C17 UNN A 67 13.630 -11.561 1.082 1.00 -0.06 C HETATM 2102 C16 UNN A 67 12.388 -11.406 1.708 1.00 -0.06 C HETATM 2103 C15 UNN A 67 11.485 -10.451 1.216 1.00 -0.06 C HETATM 2104 C14 UNN A 67 11.838 -9.663 0.113 1.00 -0.05 C HETATM 2105 H3 UNN A 67 11.137 -8.919 -0.246 1.00 0.06 H HETATM 2106 H4 UNN A 67 10.518 -10.324 1.688 1.00 0.06 H HETATM 2107 H5 UNN A 67 12.126 -12.017 2.564 1.00 0.06 H HETATM 2108 H16 UNN A 67 14.340 -12.292 1.452 1.00 0.06 H HETATM 2109 H2 UNN A 67 14.916 -10.897 -0.502 1.00 0.06 H HETATM 2110 C8 UNN A 67 14.037 -9.538 -2.876 1.00 -0.04 C HETATM 2111 C6 UNN A 67 14.424 -8.777 -3.989 1.00 0.02 C HETATM 2112 C4 UNN A 67 15.034 -9.521 -5.150 1.00 0.11 C HETATM 2113 N UNN A 67 16.288 -9.178 -5.513 1.00 -0.34 N HETATM 2114 C UNN A 67 16.869 -9.829 -6.542 1.00 -0.02 C HETATM 2115 C1 UNN A 67 16.203 -10.844 -7.220 1.00 0.13 C HETATM 2116 C2 UNN A 67 14.908 -11.191 -6.820 1.00 0.21 C HETATM 2117 N3 UNN A 67 14.343 -10.502 -5.782 1.00 -0.25 N HETATM 2118 C7 UNN A 67 12.977 -10.875 -5.407 1.00 0.02 C HETATM 2119 H11 UNN A 67 12.644 -10.250 -4.566 1.00 0.05 H HETATM 2120 H12 UNN A 67 12.955 -11.933 -5.108 1.00 0.05 H HETATM 2121 H13 UNN A 67 12.306 -10.722 -6.265 1.00 0.05 H HETATM 2122 O UNN A 67 14.331 -12.176 -7.495 1.00 -0.35 O HETATM 2123 H9 UNN A 67 14.926 -12.490 -8.165 1.00 0.22 H HETATM 2124 H8 UNN A 67 15.302 -11.924 -6.100 1.00 0.11 H HETATM 2125 O5 UNN A 67 16.760 -11.524 -8.233 1.00 -0.32 O HETATM 2126 H10 UNN A 67 16.227 -11.421 -9.013 1.00 0.26 H HETATM 2127 H7 UNN A 67 17.878 -9.555 -6.847 1.00 0.03 H HETATM 2128 H14 UNN A 67 14.184 -10.612 -2.900 1.00 0.07 H HETATM 2129 H15 UNN A 67 12.882 -7.088 -0.875 1.00 0.06 H HETATM 2130 H6 UNN A 67 13.534 -5.713 -2.810 1.00 0.06 H HETATM 2131 H1 UNN A 67 14.559 -6.780 -4.830 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1318 1317 2029 CONECT 1595 1593 2029 CONECT 1603 1602 2029 CONECT 2029 1318 1595 1603 CONECT 2095 2096 2111 2131 CONECT 2096 2095 2097 2130 CONECT 2097 2096 2098 2129 CONECT 2098 2097 2099 2110 CONECT 2099 2098 2100 2104 CONECT 2100 2099 2101 2109 CONECT 2101 2100 2102 2108 CONECT 2102 2101 2103 2107 CONECT 2103 2102 2104 2106 CONECT 2104 2099 2103 2105 CONECT 2105 2104 CONECT 2106 2103 CONECT 2107 2102 CONECT 2108 2101 CONECT 2109 2100 CONECT 2110 2098 2111 2128 CONECT 2111 2095 2110 2112 CONECT 2112 2111 2113 2117 CONECT 2113 2112 2114 CONECT 2114 2113 2115 2127 CONECT 2115 2114 2116 2125 CONECT 2116 2115 2117 2122 2124 CONECT 2117 2112 2116 2118 CONECT 2118 2117 2119 2120 2121 CONECT 2119 2118 CONECT 2120 2118 CONECT 2121 2118 CONECT 2122 2116 2123 CONECT 2123 2122 CONECT 2124 2116 CONECT 2125 2115 2126 CONECT 2126 2125 CONECT 2127 2114 CONECT 2128 2110 CONECT 2129 2097 CONECT 2130 2096 CONECT 2131 2095 MASTER 0 0 0 0 0 0 0 0 2130 1 45 17 END
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Structure:
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Related entries of code: 4xue
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4xuc
RCSB PDB
PDBbind
218aa, >4XUC_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4xue
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human soluble form Catechol O-methyltransferase
Ligand Name
43J
EC.Number
E.C.2.1.1.6
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
IC50>5000nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Acs Med.Chem.Lett. Vol. 6: pp. 318-323
Ligand Properties
Formula
C
1
7
H
1
6
N
2
O
2
Molecular Weight
280.321
Exact Mass
280.121
No. of atoms
37
No. of bonds
39
Polar Surface Area
56.06
LOGP Value
1.90 (
Computed with XLOGP3
)
2.14 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
OC1=CN=C(N([C@H]1O)C)c1cccc(c1)c1ccccc1
InChI String
InChI=1S/C17H16N2O2/c1-19-16(18-11-15(20)17(19)21)14-9-5-8-13(10-14)12-6-3-2-4-7-12/h2-11,17,20-21H,1H3/t17-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P21964
Entrez Gene ID
NCBI Entrez Gene ID:
1312
ASD
Information of known allosteric effects of PDB entries
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