Browse entries in the PDBbind-CN Database
HEADER 6DN6_COMPLEX COMPND 6DN6_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 136 GLU ASN LEU TYR PHE GLN SER MET PRO GLU GLY LEU GLU SEQRES 2 A 136 GLU LEU LEU SER ALA PRO PRO PRO ASP LEU GLY ALA GLN SEQRES 3 A 136 ARG ARG HIS GLY TRP ASN PRO LYS ASP CYS SER GLU ASN SEQRES 4 A 136 ILE GLU VAL LYS GLU GLY GLY LEU TYR PHE GLU ARG ARG SEQRES 5 A 136 PRO VAL ALA GLN SER THR ASP GLY ALA ARG GLY LYS ARG SEQRES 6 A 136 GLY TYR SER ARG GLY LEU HIS ALA TRP GLU ILE SER TRP SEQRES 7 A 136 PRO LEU GLU GLN ARG GLY THR HIS ALA VAL VAL GLY VAL SEQRES 8 A 136 ALA THR ALA LEU ALA PRO LEU GLN THR ASP HIS TYR ALA SEQRES 9 A 136 ALA LEU LEU GLY SER ASN SER GLU SER TRP GLY TRP ASP SEQRES 10 A 136 ILE GLY ARG GLY LYS LEU TYR HIS GLN SER LYS GLY PRO SEQRES 11 A 136 GLY ALA PRO GLN TYR PRO SEQRES 1 A 58 GLU VAL PRO GLU ARG LEU LEU VAL VAL LEU ASP MET GLU SEQRES 2 A 58 GLU GLY THR LEU GLY TYR ALA ILE GLY GLY THR TYR LEU SEQRES 3 A 58 GLY PRO ALA PHE ARG GLY LEU LYS GLY ARG THR LEU TYR SEQRES 4 A 58 PRO ALA VAL SER ALA VAL TRP GLY GLN CYS GLN VAL ARG SEQRES 5 A 58 ILE ARG TYR LEU GLY GLU HET ILE A 449 74 ATOM 1 N GLU A 18 18.670 -13.054 -21.623 1.00 45.50 N ATOM 2 CA GLU A 18 17.879 -12.146 -22.452 1.00 44.36 C ATOM 3 C GLU A 18 16.825 -12.908 -23.263 1.00 44.02 C ATOM 4 O GLU A 18 15.697 -12.441 -23.377 1.00 39.92 O ATOM 5 CB GLU A 18 18.792 -11.316 -23.374 1.00 46.73 C ATOM 6 HN3 GLU A 18 19.155 -13.744 -22.232 1.00 0.00 H ATOM 7 HN2 GLU A 18 18.042 -13.555 -20.963 1.00 0.00 H ATOM 8 HN1 GLU A 18 19.374 -12.508 -21.087 1.00 0.00 H ATOM 9 N ASN A 19 17.208 -14.064 -23.844 1.00 40.55 N ATOM 10 CA ASN A 19 16.325 -14.937 -24.621 1.00 38.94 C ATOM 11 C ASN A 19 15.213 -15.468 -23.711 1.00 37.58 C ATOM 12 O ASN A 19 14.040 -15.395 -24.085 1.00 32.97 O ATOM 13 CB ASN A 19 17.115 -16.087 -25.260 1.00 44.28 C ATOM 14 H ASN A 19 18.200 -14.356 -23.732 1.00 0.00 H ATOM 15 N LEU A 20 15.592 -15.946 -22.492 1.00 33.16 N ATOM 16 CA LEU A 20 14.695 -16.443 -21.442 1.00 31.44 C ATOM 17 C LEU A 20 13.631 -15.410 -21.101 1.00 29.58 C ATOM 18 O LEU A 20 12.437 -15.747 -21.107 1.00 29.07 O ATOM 19 CB LEU A 20 15.495 -16.785 -20.163 1.00 32.63 C ATOM 20 H LEU A 20 16.611 -15.960 -22.287 1.00 0.00 H ATOM 21 N TYR A 21 14.046 -14.150 -20.801 1.00 22.85 N ATOM 22 CA TYR A 21 13.065 -13.123 -20.456 1.00 20.44 C ATOM 23 C TYR A 21 12.170 -12.829 -21.661 1.00 18.96 C ATOM 24 O TYR A 21 10.962 -12.718 -21.508 1.00 17.49 O ATOM 25 CB TYR A 21 13.702 -11.785 -20.014 1.00 22.68 C ATOM 26 CG TYR A 21 14.616 -11.758 -18.805 1.00 26.71 C ATOM 27 CD1 TYR A 21 14.488 -12.695 -17.784 1.00 28.48 C ATOM 28 CD2 TYR A 21 15.539 -10.733 -18.636 1.00 28.36 C ATOM 29 CE1 TYR A 21 15.312 -12.652 -16.655 1.00 29.28 C ATOM 30 CE2 TYR A 21 16.369 -10.683 -17.519 1.00 30.16 C ATOM 31 CZ TYR A 21 16.248 -11.640 -16.528 1.00 37.45 C ATOM 32 OH TYR A 21 17.089 -11.597 -15.439 1.00 39.63 O ATOM 33 HH TYR A 21 16.874 -12.345 -14.828 1.00 0.00 H ATOM 34 H TYR A 21 15.060 -13.918 -20.817 1.00 0.00 H ATOM 35 N PHE A 22 12.772 -12.635 -22.845 1.00 17.58 N ATOM 36 CA PHE A 22 11.968 -12.281 -24.018 1.00 15.58 C ATOM 37 C PHE A 22 10.933 -13.364 -24.355 1.00 16.85 C ATOM 38 O PHE A 22 9.789 -13.032 -24.669 1.00 14.88 O ATOM 39 CB PHE A 22 12.876 -11.990 -25.220 1.00 16.52 C ATOM 40 CG PHE A 22 12.087 -11.380 -26.365 1.00 17.28 C ATOM 41 CD1 PHE A 22 11.843 -10.014 -26.411 1.00 19.45 C ATOM 42 CD2 PHE A 22 11.535 -12.185 -27.358 1.00 20.11 C ATOM 43 CE1 PHE A 22 11.071 -9.459 -27.441 1.00 20.45 C ATOM 44 CE2 PHE A 22 10.766 -11.631 -28.386 1.00 21.94 C ATOM 45 CZ PHE A 22 10.524 -10.277 -28.409 1.00 19.04 C ATOM 46 H PHE A 22 13.804 -12.735 -22.929 1.00 0.00 H ATOM 47 N GLN A 23 11.321 -14.642 -24.257 1.00 14.23 N ATOM 48 CA GLN A 23 10.407 -15.742 -24.578 1.00 12.87 C ATOM 49 C GLN A 23 9.255 -15.855 -23.552 1.00 15.20 C ATOM 50 O GLN A 23 8.307 -16.616 -23.780 1.00 15.63 O ATOM 51 CB GLN A 23 11.175 -17.054 -24.694 1.00 15.43 C ATOM 52 CG GLN A 23 10.480 -18.013 -25.679 1.00 25.84 C ATOM 53 CD GLN A 23 11.339 -19.183 -26.089 1.00 30.98 C ATOM 54 OE1 GLN A 23 12.223 -19.610 -25.335 1.00 21.91 O ATOM 55 NE2 GLN A 23 11.129 -19.705 -27.313 1.00 25.03 N ATOM 56 HE22 GLN A 23 10.377 -19.321 -27.920 1.00 0.00 H ATOM 57 HE21 GLN A 23 11.719 -20.492 -27.651 1.00 0.00 H ATOM 58 H GLN A 23 12.290 -14.858 -23.947 1.00 0.00 H ATOM 59 N SER A 24 9.360 -15.152 -22.421 1.00 14.21 N ATOM 60 CA SER A 24 8.308 -15.190 -21.395 1.00 13.90 C ATOM 61 C SER A 24 7.302 -14.063 -21.564 1.00 15.77 C ATOM 62 O SER A 24 6.349 -13.988 -20.789 1.00 15.22 O ATOM 63 CB SER A 24 8.935 -15.094 -19.998 1.00 15.16 C ATOM 64 OG SER A 24 9.327 -13.773 -19.651 1.00 16.85 O ATOM 65 HG SER A 24 9.996 -13.447 -20.303 1.00 0.00 H ATOM 66 H SER A 24 10.204 -14.565 -22.263 1.00 0.00 H ATOM 67 N MET A 25 7.493 -13.169 -22.552 1.00 14.96 N ATOM 68 CA MET A 25 6.659 -11.957 -22.652 1.00 15.86 C ATOM 69 C MET A 25 5.170 -12.250 -22.814 1.00 16.95 C ATOM 70 O MET A 25 4.822 -13.091 -23.639 1.00 15.52 O ATOM 71 CB MET A 25 7.076 -11.111 -23.876 1.00 20.26 C ATOM 72 CG MET A 25 8.435 -10.450 -23.761 1.00 26.19 C ATOM 73 SD MET A 25 8.568 -8.873 -24.677 1.00 31.07 S ATOM 74 CE MET A 25 7.295 -8.918 -25.526 1.00 14.09 C ATOM 75 H MET A 25 8.240 -13.336 -23.256 1.00 0.00 H ATOM 76 N PRO A 26 4.275 -11.484 -22.152 1.00 13.40 N ATOM 77 CA PRO A 26 2.832 -11.638 -22.423 1.00 12.39 C ATOM 78 C PRO A 26 2.542 -11.407 -23.912 1.00 13.59 C ATOM 79 O PRO A 26 3.178 -10.569 -24.577 1.00 14.34 O ATOM 80 CB PRO A 26 2.203 -10.517 -21.578 1.00 13.30 C ATOM 81 CG PRO A 26 3.150 -10.413 -20.407 1.00 16.53 C ATOM 82 CD PRO A 26 4.509 -10.502 -21.073 1.00 13.62 C ATOM 83 N GLU A 27 1.523 -12.091 -24.404 1.00 13.42 N ATOM 84 CA GLU A 27 1.052 -11.910 -25.772 1.00 13.05 C ATOM 85 C GLU A 27 0.626 -10.462 -25.975 1.00 16.01 C ATOM 86 O GLU A 27 -0.040 -9.872 -25.113 1.00 14.79 O ATOM 87 CB GLU A 27 -0.164 -12.819 -26.021 1.00 15.08 C ATOM 88 CG GLU A 27 0.150 -14.280 -25.962 1.00 19.33 C ATOM 89 CD GLU A 27 -0.990 -15.125 -26.503 1.00 22.88 C ATOM 90 OE1 GLU A 27 -1.410 -16.057 -25.783 1.00 29.88 O ATOM 91 OE2 GLU A 27 -1.430 -14.882 -27.649 1.00 26.38 O ATOM 92 H GLU A 27 1.041 -12.782 -23.794 1.00 0.00 H ATOM 93 N GLY A 28 1.009 -9.897 -27.110 1.00 13.59 N ATOM 94 CA GLY A 28 0.607 -8.533 -27.452 1.00 13.14 C ATOM 95 C GLY A 28 1.363 -7.401 -26.795 1.00 15.54 C ATOM 96 O GLY A 28 1.044 -6.237 -27.037 1.00 15.93 O ATOM 97 H GLY A 28 1.607 -10.433 -27.771 1.00 0.00 H ATOM 98 N LEU A 29 2.398 -7.692 -26.000 1.00 12.94 N ATOM 99 CA LEU A 29 3.080 -6.596 -25.295 1.00 12.44 C ATOM 100 C LEU A 29 3.821 -5.625 -26.229 1.00 16.22 C ATOM 101 O LEU A 29 3.736 -4.421 -26.037 1.00 15.89 O ATOM 102 CB LEU A 29 4.024 -7.160 -24.223 1.00 12.37 C ATOM 103 CG LEU A 29 4.725 -6.095 -23.338 1.00 14.87 C ATOM 104 CD1 LEU A 29 3.702 -5.225 -22.543 1.00 14.87 C ATOM 105 CD2 LEU A 29 5.673 -6.749 -22.340 1.00 17.59 C ATOM 106 H LEU A 29 2.715 -8.675 -25.882 1.00 0.00 H ATOM 107 N GLU A 30 4.536 -6.154 -27.240 1.00 14.85 N ATOM 108 CA GLU A 30 5.286 -5.259 -28.139 1.00 14.09 C ATOM 109 C GLU A 30 4.372 -4.264 -28.850 1.00 19.13 C ATOM 110 O GLU A 30 4.683 -3.067 -28.895 1.00 19.47 O ATOM 111 CB GLU A 30 6.071 -6.071 -29.170 1.00 14.74 C ATOM 112 CG GLU A 30 7.232 -6.829 -28.558 1.00 17.08 C ATOM 113 CD GLU A 30 7.809 -7.839 -29.520 1.00 18.07 C ATOM 114 OE1 GLU A 30 8.933 -7.624 -30.032 1.00 17.23 O ATOM 115 OE2 GLU A 30 7.099 -8.824 -29.819 1.00 17.18 O ATOM 116 H GLU A 30 4.559 -7.184 -27.385 1.00 0.00 H ATOM 117 N GLU A 31 3.223 -4.736 -29.357 1.00 16.01 N ATOM 118 CA GLU A 31 2.272 -3.844 -30.032 1.00 17.56 C ATOM 119 C GLU A 31 1.618 -2.870 -29.046 1.00 21.44 C ATOM 120 O GLU A 31 1.357 -1.721 -29.408 1.00 22.56 O ATOM 121 CB GLU A 31 1.227 -4.643 -30.793 1.00 18.89 C ATOM 122 CG GLU A 31 1.857 -5.384 -31.963 1.00 27.52 C ATOM 123 CD GLU A 31 1.021 -6.428 -32.673 1.00 58.51 C ATOM 124 OE1 GLU A 31 1.115 -6.494 -33.922 1.00 45.79 O ATOM 125 OE2 GLU A 31 0.373 -7.252 -31.984 1.00 60.00 O ATOM 126 H GLU A 31 3.003 -5.749 -29.271 1.00 0.00 H ATOM 127 N LEU A 32 1.401 -3.297 -27.794 1.00 17.28 N ATOM 128 CA LEU A 32 0.811 -2.377 -26.809 1.00 16.84 C ATOM 129 C LEU A 32 1.786 -1.223 -26.593 1.00 20.92 C ATOM 130 O LEU A 32 1.362 -0.069 -26.575 1.00 22.59 O ATOM 131 CB LEU A 32 0.530 -3.144 -25.482 1.00 15.88 C ATOM 132 CG LEU A 32 -0.049 -2.383 -24.264 1.00 20.20 C ATOM 133 CD1 LEU A 32 -0.590 -3.380 -23.219 1.00 20.49 C ATOM 134 CD2 LEU A 32 1.007 -1.555 -23.543 1.00 26.03 C ATOM 135 H LEU A 32 1.647 -4.270 -27.521 1.00 0.00 H ATOM 136 N LEU A 33 3.084 -1.532 -26.414 1.00 17.51 N ATOM 137 CA LEU A 33 4.114 -0.532 -26.147 1.00 17.29 C ATOM 138 C LEU A 33 4.458 0.377 -27.345 1.00 23.17 C ATOM 139 O LEU A 33 4.906 1.513 -27.123 1.00 23.09 O ATOM 140 CB LEU A 33 5.383 -1.165 -25.568 1.00 18.35 C ATOM 141 CG LEU A 33 5.224 -1.869 -24.224 1.00 22.37 C ATOM 142 CD1 LEU A 33 6.512 -2.501 -23.807 1.00 23.24 C ATOM 143 CD2 LEU A 33 4.755 -0.889 -23.133 1.00 25.62 C ATOM 144 H LEU A 33 3.367 -2.531 -26.469 1.00 0.00 H ATOM 145 N SER A 34 4.244 -0.108 -28.584 1.00 21.27 N ATOM 146 CA SER A 34 4.525 0.671 -29.794 1.00 23.14 C ATOM 147 C SER A 34 3.350 1.539 -30.252 1.00 27.48 C ATOM 148 O SER A 34 3.532 2.402 -31.117 1.00 27.36 O ATOM 149 CB SER A 34 4.938 -0.256 -30.932 1.00 27.54 C ATOM 150 OG SER A 34 6.179 -0.860 -30.617 1.00 44.23 O ATOM 151 HG SER A 34 6.088 -1.382 -29.781 1.00 0.00 H ATOM 152 H SER A 34 3.865 -1.071 -28.686 1.00 0.00 H ATOM 153 N ALA A 35 2.145 1.266 -29.730 1.00 23.79 N ATOM 154 CA ALA A 35 0.914 1.985 -30.095 1.00 24.42 C ATOM 155 C ALA A 35 0.942 3.456 -29.621 1.00 24.83 C ATOM 156 O ALA A 35 1.677 3.768 -28.679 1.00 20.76 O ATOM 157 CB ALA A 35 -0.302 1.267 -29.508 1.00 25.17 C ATOM 158 H ALA A 35 2.077 0.503 -29.027 1.00 0.00 H ATOM 159 N PRO A 36 0.203 4.379 -30.300 1.00 24.56 N ATOM 160 CA PRO A 36 0.166 5.775 -29.820 1.00 24.95 C ATOM 161 C PRO A 36 -0.399 5.708 -28.395 1.00 27.42 C ATOM 162 O PRO A 36 -1.440 5.072 -28.176 1.00 26.88 O ATOM 163 CB PRO A 36 -0.784 6.470 -30.808 1.00 28.04 C ATOM 164 CG PRO A 36 -0.808 5.568 -32.012 1.00 32.46 C ATOM 165 CD PRO A 36 -0.719 4.192 -31.438 1.00 27.28 C ATOM 166 N PRO A 37 0.339 6.239 -27.410 1.00 24.06 N ATOM 167 CA PRO A 37 -0.088 6.068 -26.012 1.00 23.43 C ATOM 168 C PRO A 37 -1.451 6.655 -25.654 1.00 25.44 C ATOM 169 O PRO A 37 -1.874 7.651 -26.250 1.00 25.00 O ATOM 170 CB PRO A 37 1.041 6.730 -25.209 1.00 25.90 C ATOM 171 CG PRO A 37 1.703 7.650 -26.169 1.00 30.64 C ATOM 172 CD PRO A 37 1.632 6.949 -27.486 1.00 26.02 C ATOM 173 N PRO A 38 -2.160 6.018 -24.701 1.00 20.89 N ATOM 174 CA PRO A 38 -3.445 6.575 -24.236 1.00 20.31 C ATOM 175 C PRO A 38 -3.273 8.043 -23.822 1.00 23.04 C ATOM 176 O PRO A 38 -2.269 8.407 -23.193 1.00 21.59 O ATOM 177 CB PRO A 38 -3.771 5.701 -23.022 1.00 21.51 C ATOM 178 CG PRO A 38 -3.120 4.386 -23.326 1.00 25.61 C ATOM 179 CD PRO A 38 -1.813 4.779 -23.967 1.00 21.50 C ATOM 180 N ASP A 39 -4.235 8.886 -24.216 1.00 18.60 N ATOM 181 CA ASP A 39 -4.243 10.328 -23.918 1.00 18.07 C ATOM 182 C ASP A 39 -4.405 10.632 -22.425 1.00 19.51 C ATOM 183 O ASP A 39 -4.609 9.719 -21.612 1.00 17.85 O ATOM 184 CB ASP A 39 -5.295 11.057 -24.773 1.00 20.36 C ATOM 185 CG ASP A 39 -6.747 10.669 -24.545 1.00 29.26 C ATOM 186 OD1 ASP A 39 -7.074 10.195 -23.434 1.00 25.13 O ATOM 187 OD2 ASP A 39 -7.569 10.887 -25.459 1.00 34.42 O ATOM 188 H ASP A 39 -5.027 8.498 -24.767 1.00 0.00 H ATOM 189 N LEU A 40 -4.329 11.916 -22.050 1.00 17.01 N ATOM 190 CA LEU A 40 -4.434 12.274 -20.627 1.00 14.82 C ATOM 191 C LEU A 40 -5.729 11.835 -19.962 1.00 15.13 C ATOM 192 O LEU A 40 -5.684 11.445 -18.790 1.00 13.91 O ATOM 193 CB LEU A 40 -4.197 13.767 -20.373 1.00 15.57 C ATOM 194 CG LEU A 40 -2.784 14.262 -20.619 1.00 19.63 C ATOM 195 CD1 LEU A 40 -2.724 15.796 -20.565 1.00 20.27 C ATOM 196 CD2 LEU A 40 -1.820 13.677 -19.612 1.00 18.48 C ATOM 197 H LEU A 40 -4.196 12.660 -22.765 1.00 0.00 H ATOM 198 N GLY A 41 -6.843 11.877 -20.703 1.00 14.63 N ATOM 199 CA GLY A 41 -8.120 11.449 -20.144 1.00 15.30 C ATOM 200 C GLY A 41 -8.059 9.989 -19.744 1.00 17.24 C ATOM 201 O GLY A 41 -8.447 9.644 -18.619 1.00 16.51 O ATOM 202 H GLY A 41 -6.797 12.217 -21.685 1.00 0.00 H ATOM 203 N ALA A 42 -7.498 9.140 -20.635 1.00 14.72 N ATOM 204 CA ALA A 42 -7.349 7.711 -20.322 1.00 14.29 C ATOM 205 C ALA A 42 -6.391 7.473 -19.159 1.00 16.27 C ATOM 206 O ALA A 42 -6.686 6.668 -18.246 1.00 13.75 O ATOM 207 CB ALA A 42 -6.874 6.947 -21.559 1.00 15.20 C ATOM 208 H ALA A 42 -7.168 9.502 -21.552 1.00 0.00 H ATOM 209 N GLN A 43 -5.255 8.221 -19.129 1.00 13.81 N ATOM 210 CA GLN A 43 -4.304 8.120 -18.026 1.00 11.72 C ATOM 211 C GLN A 43 -4.969 8.502 -16.693 1.00 13.55 C ATOM 212 O GLN A 43 -4.692 7.877 -15.660 1.00 14.47 O ATOM 213 CB GLN A 43 -3.098 9.042 -18.261 1.00 12.51 C ATOM 214 CG GLN A 43 -2.227 8.598 -19.438 1.00 13.29 C ATOM 215 CD GLN A 43 -1.199 9.681 -19.697 1.00 16.97 C ATOM 216 OE1 GLN A 43 -0.468 10.093 -18.792 1.00 15.60 O ATOM 217 NE2 GLN A 43 -1.149 10.163 -20.945 1.00 16.53 N ATOM 218 HE22 GLN A 43 -1.786 9.784 -21.675 1.00 0.00 H ATOM 219 HE21 GLN A 43 -0.473 10.917 -21.185 1.00 0.00 H ATOM 220 H GLN A 43 -5.060 8.880 -19.910 1.00 0.00 H ATOM 221 N ARG A 44 -5.873 9.513 -16.711 1.00 11.50 N ATOM 222 CA ARG A 44 -6.539 9.913 -15.473 1.00 11.52 C ATOM 223 C ARG A 44 -7.614 8.876 -15.053 1.00 13.95 C ATOM 224 O ARG A 44 -7.741 8.573 -13.864 1.00 13.72 O ATOM 225 CB ARG A 44 -7.159 11.308 -15.622 1.00 12.61 C ATOM 226 CG ARG A 44 -6.092 12.391 -15.617 1.00 12.46 C ATOM 227 CD ARG A 44 -6.737 13.761 -15.639 1.00 14.36 C ATOM 228 NE ARG A 44 -5.706 14.783 -15.492 1.00 12.55 N ATOM 229 CZ ARG A 44 -5.326 15.618 -16.461 1.00 14.79 C ATOM 230 NH1 ARG A 44 -5.913 15.578 -17.658 1.00 13.89 N ATOM 231 NH2 ARG A 44 -4.367 16.508 -16.236 1.00 14.14 N ATOM 232 HE ARG A 44 -5.235 14.866 -14.569 1.00 0.00 H ATOM 233 HH12 ARG A 44 -5.611 16.232 -18.408 1.00 0.00 H ATOM 234 HH11 ARG A 44 -6.673 14.892 -17.842 1.00 0.00 H ATOM 235 HH22 ARG A 44 -4.073 17.158 -16.993 1.00 0.00 H ATOM 236 HH21 ARG A 44 -3.910 16.556 -15.303 1.00 0.00 H ATOM 237 H ARG A 44 -6.091 10.002 -17.603 1.00 0.00 H ATOM 238 N ARG A 45 -8.341 8.293 -16.044 1.00 12.69 N ATOM 239 CA ARG A 45 -9.339 7.279 -15.721 1.00 12.55 C ATOM 240 C ARG A 45 -8.722 6.022 -15.094 1.00 13.62 C ATOM 241 O ARG A 45 -9.403 5.349 -14.307 1.00 14.48 O ATOM 242 CB ARG A 45 -10.194 6.915 -16.939 1.00 14.57 C ATOM 243 CG ARG A 45 -11.077 8.101 -17.371 1.00 22.58 C ATOM 244 CD ARG A 45 -12.013 7.820 -18.570 1.00 25.06 C ATOM 245 NE ARG A 45 -11.391 7.003 -19.617 1.00 30.26 N ATOM 246 CZ ARG A 45 -10.915 7.444 -20.781 1.00 50.26 C ATOM 247 NH1 ARG A 45 -10.991 8.734 -21.095 1.00 32.86 N ATOM 248 NH2 ARG A 45 -10.373 6.596 -21.646 1.00 38.02 N ATOM 249 HE ARG A 45 -11.314 5.982 -19.434 1.00 0.00 H ATOM 250 HH12 ARG A 45 -10.617 9.070 -22.005 1.00 0.00 H ATOM 251 HH11 ARG A 45 -11.424 9.406 -20.430 1.00 0.00 H ATOM 252 HH22 ARG A 45 -10.003 6.944 -22.553 1.00 0.00 H ATOM 253 HH21 ARG A 45 -10.319 5.583 -21.417 1.00 0.00 H ATOM 254 H ARG A 45 -8.185 8.571 -17.034 1.00 0.00 H ATOM 255 N HIS A 46 -7.484 5.693 -15.463 1.00 10.97 N ATOM 256 CA HIS A 46 -6.793 4.518 -14.930 1.00 11.00 C ATOM 257 C HIS A 46 -5.765 4.903 -13.852 1.00 12.98 C ATOM 258 O HIS A 46 -5.018 4.042 -13.391 1.00 12.71 O ATOM 259 CB HIS A 46 -6.080 3.774 -16.079 1.00 11.77 C ATOM 260 CG HIS A 46 -7.023 3.050 -16.990 1.00 15.45 C ATOM 261 ND1 HIS A 46 -7.342 1.701 -16.792 1.00 16.65 N ATOM 262 CD2 HIS A 46 -7.687 3.502 -18.080 1.00 16.55 C ATOM 263 CE1 HIS A 46 -8.186 1.384 -17.760 1.00 16.65 C ATOM 264 NE2 HIS A 46 -8.440 2.433 -18.561 1.00 16.94 N ATOM 265 H HIS A 46 -6.991 6.293 -16.155 1.00 0.00 H ATOM 266 N GLY A 47 -5.734 6.196 -13.463 1.00 10.85 N ATOM 267 CA GLY A 47 -4.758 6.698 -12.502 1.00 10.10 C ATOM 268 C GLY A 47 -5.100 6.467 -11.048 1.00 12.20 C ATOM 269 O GLY A 47 -6.021 5.710 -10.714 1.00 11.55 O ATOM 270 H GLY A 47 -6.430 6.857 -13.863 1.00 0.00 H ATOM 271 N TRP A 48 -4.356 7.116 -10.172 1.00 10.82 N ATOM 272 CA TRP A 48 -4.576 6.935 -8.740 1.00 10.66 C ATOM 273 C TRP A 48 -5.954 7.395 -8.334 1.00 12.83 C ATOM 274 O TRP A 48 -6.467 8.415 -8.838 1.00 12.86 O ATOM 275 CB TRP A 48 -3.525 7.705 -7.940 1.00 9.94 C ATOM 276 CG TRP A 48 -2.106 7.276 -8.239 1.00 10.17 C ATOM 277 CD1 TRP A 48 -1.084 8.093 -8.607 1.00 13.37 C ATOM 278 CD2 TRP A 48 -1.545 5.948 -8.140 1.00 10.21 C ATOM 279 NE1 TRP A 48 0.086 7.375 -8.730 1.00 12.78 N ATOM 280 CE2 TRP A 48 -0.167 6.053 -8.464 1.00 13.23 C ATOM 281 CE3 TRP A 48 -2.063 4.687 -7.788 1.00 10.40 C ATOM 282 CZ2 TRP A 48 0.688 4.942 -8.497 1.00 12.25 C ATOM 283 CZ3 TRP A 48 -1.212 3.583 -7.813 1.00 11.12 C ATOM 284 CH2 TRP A 48 0.145 3.717 -8.154 1.00 11.71 C ATOM 285 HE1 TRP A 48 1.013 7.772 -8.984 1.00 0.00 H ATOM 286 H TRP A 48 -3.609 7.760 -10.503 1.00 0.00 H ATOM 287 N ASN A 49 -6.563 6.644 -7.426 1.00 11.59 N ATOM 288 CA ASN A 49 -7.922 6.948 -6.996 1.00 11.92 C ATOM 289 C ASN A 49 -7.917 7.798 -5.726 1.00 13.21 C ATOM 290 O ASN A 49 -7.540 7.277 -4.693 1.00 12.89 O ATOM 291 CB ASN A 49 -8.664 5.624 -6.741 1.00 13.65 C ATOM 292 CG ASN A 49 -10.143 5.812 -6.515 1.00 15.46 C ATOM 293 OD1 ASN A 49 -10.649 6.941 -6.411 1.00 14.94 O ATOM 294 ND2 ASN A 49 -10.880 4.708 -6.502 1.00 13.29 N ATOM 295 HD22 ASN A 49 -10.424 3.777 -6.591 1.00 0.00 H ATOM 296 HD21 ASN A 49 -11.913 4.774 -6.402 1.00 0.00 H ATOM 297 H ASN A 49 -6.065 5.828 -7.016 1.00 0.00 H ATOM 298 N PRO A 50 -8.417 9.059 -5.751 1.00 12.22 N ATOM 299 CA PRO A 50 -8.453 9.857 -4.507 1.00 12.98 C ATOM 300 C PRO A 50 -9.387 9.257 -3.454 1.00 16.66 C ATOM 301 O PRO A 50 -9.263 9.567 -2.278 1.00 17.18 O ATOM 302 CB PRO A 50 -8.948 11.247 -4.951 1.00 15.80 C ATOM 303 CG PRO A 50 -9.556 11.044 -6.288 1.00 19.47 C ATOM 304 CD PRO A 50 -8.985 9.786 -6.909 1.00 14.00 C ATOM 305 N LYS A 51 -10.287 8.369 -3.888 1.00 14.91 N ATOM 306 CA LYS A 51 -11.252 7.696 -3.006 1.00 15.47 C ATOM 307 C LYS A 51 -10.754 6.321 -2.529 1.00 17.48 C ATOM 308 O LYS A 51 -11.477 5.605 -1.824 1.00 17.29 O ATOM 309 CB LYS A 51 -12.632 7.595 -3.707 1.00 18.99 C ATOM 310 CG LYS A 51 -13.306 8.944 -3.899 1.00 30.67 C ATOM 311 CD LYS A 51 -14.620 8.818 -4.668 1.00 46.52 C ATOM 312 CE LYS A 51 -15.336 10.147 -4.777 1.00 62.55 C ATOM 313 NZ LYS A 51 -16.666 10.013 -5.438 1.00 75.51 N ATOM 314 HZ1 LYS A 51 -16.538 9.633 -6.398 1.00 0.00 H ATOM 315 HZ2 LYS A 51 -17.263 9.366 -4.884 1.00 0.00 H ATOM 316 HZ3 LYS A 51 -17.121 10.947 -5.491 1.00 0.00 H ATOM 317 H LYS A 51 -10.306 8.142 -4.903 1.00 0.00 H ATOM 318 N ASP A 52 -9.500 5.968 -2.868 1.00 13.80 N ATOM 319 CA ASP A 52 -8.963 4.662 -2.490 1.00 12.53 C ATOM 320 C ASP A 52 -7.458 4.741 -2.267 1.00 14.24 C ATOM 321 O ASP A 52 -6.678 4.137 -2.988 1.00 14.70 O ATOM 322 CB ASP A 52 -9.322 3.595 -3.562 1.00 13.42 C ATOM 323 CG ASP A 52 -9.164 2.169 -3.068 1.00 14.37 C ATOM 324 OD1 ASP A 52 -9.013 1.981 -1.830 1.00 16.79 O ATOM 325 OD2 ASP A 52 -9.183 1.231 -3.926 1.00 14.59 O ATOM 326 H ASP A 52 -8.906 6.632 -3.405 1.00 0.00 H ATOM 327 N CYS A 53 -7.051 5.528 -1.253 1.00 12.63 N ATOM 328 CA CYS A 53 -5.654 5.703 -0.918 1.00 12.46 C ATOM 329 C CYS A 53 -5.540 6.002 0.553 1.00 14.16 C ATOM 330 O CYS A 53 -6.531 6.321 1.219 1.00 14.24 O ATOM 331 CB CYS A 53 -4.995 6.797 -1.761 1.00 12.49 C ATOM 332 SG CYS A 53 -5.720 8.445 -1.544 1.00 15.58 S ATOM 333 H CYS A 53 -7.767 6.029 -0.689 1.00 0.00 H ATOM 334 N SER A 54 -4.317 5.902 1.075 1.00 12.35 N ATOM 335 CA SER A 54 -4.068 6.279 2.478 1.00 11.58 C ATOM 336 C SER A 54 -4.575 7.714 2.766 1.00 13.12 C ATOM 337 O SER A 54 -4.483 8.601 1.904 1.00 12.61 O ATOM 338 CB SER A 54 -2.564 6.257 2.732 1.00 12.37 C ATOM 339 OG SER A 54 -2.303 6.927 3.960 1.00 14.38 O ATOM 340 HG SER A 54 -1.329 6.920 4.138 1.00 0.00 H ATOM 341 H SER A 54 -3.532 5.555 0.487 1.00 0.00 H ATOM 342 N GLU A 55 -5.014 7.970 4.014 1.00 13.98 N ATOM 343 CA GLU A 55 -5.398 9.330 4.409 1.00 14.30 C ATOM 344 C GLU A 55 -4.186 10.300 4.319 1.00 15.66 C ATOM 345 O GLU A 55 -4.374 11.518 4.346 1.00 15.39 O ATOM 346 CB GLU A 55 -5.913 9.324 5.859 1.00 16.08 C ATOM 347 CG GLU A 55 -4.865 8.934 6.880 1.00 22.43 C ATOM 348 CD GLU A 55 -5.394 8.730 8.290 1.00 42.30 C ATOM 349 OE1 GLU A 55 -6.380 9.404 8.663 1.00 34.08 O ATOM 350 OE2 GLU A 55 -4.791 7.924 9.034 1.00 29.08 O ATOM 351 H GLU A 55 -5.081 7.195 4.705 1.00 0.00 H ATOM 352 N ASN A 56 -2.950 9.744 4.296 1.00 13.03 N ATOM 353 CA ASN A 56 -1.723 10.562 4.231 1.00 12.47 C ATOM 354 C ASN A 56 -1.297 10.839 2.802 1.00 15.08 C ATOM 355 O ASN A 56 -0.260 11.465 2.604 1.00 15.59 O ATOM 356 CB ASN A 56 -0.597 9.903 5.001 1.00 12.21 C ATOM 357 CG ASN A 56 -0.959 9.775 6.462 1.00 15.65 C ATOM 358 OD1 ASN A 56 -1.496 10.731 7.073 1.00 15.29 O ATOM 359 ND2 ASN A 56 -0.676 8.608 7.045 1.00 15.79 N ATOM 360 HD22 ASN A 56 -0.230 7.846 6.495 1.00 0.00 H ATOM 361 HD21 ASN A 56 -0.901 8.460 8.050 1.00 0.00 H ATOM 362 H ASN A 56 -2.863 8.708 4.325 1.00 0.00 H ATOM 363 N ILE A 57 -2.090 10.392 1.800 1.00 11.93 N ATOM 364 CA ILE A 57 -1.732 10.614 0.400 1.00 11.23 C ATOM 365 C ILE A 57 -2.727 11.564 -0.226 1.00 15.30 C ATOM 366 O ILE A 57 -3.916 11.431 0.021 1.00 15.85 O ATOM 367 CB ILE A 57 -1.658 9.258 -0.349 1.00 13.12 C ATOM 368 CG1 ILE A 57 -0.331 8.554 0.025 1.00 13.52 C ATOM 369 CG2 ILE A 57 -1.775 9.440 -1.892 1.00 12.37 C ATOM 370 CD1 ILE A 57 -0.127 7.151 -0.546 1.00 14.83 C ATOM 371 H ILE A 57 -2.967 9.883 2.030 1.00 0.00 H ATOM 372 N GLU A 58 -2.231 12.480 -1.062 1.00 13.09 N ATOM 373 CA GLU A 58 -3.077 13.424 -1.822 1.00 13.55 C ATOM 374 C GLU A 58 -2.903 13.035 -3.302 1.00 15.35 C ATOM 375 O GLU A 58 -1.764 12.994 -3.797 1.00 14.13 O ATOM 376 CB GLU A 58 -2.557 14.875 -1.621 1.00 14.06 C ATOM 377 CG GLU A 58 -3.316 15.860 -2.487 1.00 21.59 C ATOM 378 CD GLU A 58 -2.988 17.329 -2.328 1.00 30.74 C ATOM 379 OE1 GLU A 58 -2.720 17.767 -1.188 1.00 40.19 O ATOM 380 OE2 GLU A 58 -3.068 18.054 -3.340 1.00 22.23 O ATOM 381 H GLU A 58 -1.199 12.531 -1.184 1.00 0.00 H ATOM 382 N VAL A 59 -4.011 12.746 -4.002 1.00 12.24 N ATOM 383 CA VAL A 59 -3.922 12.439 -5.436 1.00 9.95 C ATOM 384 C VAL A 59 -3.995 13.788 -6.167 1.00 13.90 C ATOM 385 O VAL A 59 -4.835 14.634 -5.838 1.00 14.81 O ATOM 386 CB VAL A 59 -5.031 11.467 -5.876 1.00 12.38 C ATOM 387 CG1 VAL A 59 -5.107 11.343 -7.412 1.00 13.43 C ATOM 388 CG2 VAL A 59 -4.793 10.093 -5.237 1.00 11.39 C ATOM 389 H VAL A 59 -4.936 12.739 -3.527 1.00 0.00 H ATOM 390 N LYS A 60 -3.066 14.002 -7.101 1.00 11.88 N ATOM 391 CA LYS A 60 -2.961 15.257 -7.835 1.00 11.88 C ATOM 392 C LYS A 60 -3.154 15.035 -9.325 1.00 12.60 C ATOM 393 O LYS A 60 -3.114 13.901 -9.808 1.00 12.28 O ATOM 394 CB LYS A 60 -1.614 15.905 -7.534 1.00 14.46 C ATOM 395 CG LYS A 60 -1.499 16.296 -6.031 1.00 17.01 C ATOM 396 CD LYS A 60 -0.328 17.217 -5.775 1.00 23.67 C ATOM 397 CE LYS A 60 -0.068 17.516 -4.328 1.00 41.69 C ATOM 398 NZ LYS A 60 0.986 18.558 -4.184 1.00 55.25 N ATOM 399 HZ1 LYS A 60 1.867 18.220 -4.621 1.00 0.00 H ATOM 400 HZ2 LYS A 60 0.676 19.431 -4.657 1.00 0.00 H ATOM 401 HZ3 LYS A 60 1.148 18.748 -3.174 1.00 0.00 H ATOM 402 H LYS A 60 -2.389 13.242 -7.314 1.00 0.00 H ATOM 403 N GLU A 61 -3.372 16.138 -10.049 1.00 11.71 N ATOM 404 CA GLU A 61 -3.612 16.081 -11.498 1.00 11.64 C ATOM 405 C GLU A 61 -4.708 15.037 -11.898 1.00 12.21 C ATOM 406 O GLU A 61 -4.610 14.398 -12.948 1.00 12.77 O ATOM 407 CB GLU A 61 -2.277 15.876 -12.258 1.00 13.32 C ATOM 408 CG GLU A 61 -1.503 17.180 -12.380 1.00 14.47 C ATOM 409 CD GLU A 61 -2.140 18.201 -13.309 1.00 15.18 C ATOM 410 OE1 GLU A 61 -3.022 17.815 -14.113 1.00 15.88 O ATOM 411 OE2 GLU A 61 -1.743 19.385 -13.242 1.00 15.35 O ATOM 412 H GLU A 61 -3.372 17.063 -9.573 1.00 0.00 H ATOM 413 N GLY A 62 -5.743 14.896 -11.040 1.00 12.58 N ATOM 414 CA GLY A 62 -6.874 14.007 -11.328 1.00 12.49 C ATOM 415 C GLY A 62 -6.506 12.543 -11.515 1.00 13.87 C ATOM 416 O GLY A 62 -7.236 11.793 -12.169 1.00 14.11 O ATOM 417 H GLY A 62 -5.737 15.433 -10.150 1.00 0.00 H ATOM 418 N GLY A 63 -5.404 12.142 -10.891 1.00 11.20 N ATOM 419 CA GLY A 63 -4.974 10.745 -10.949 1.00 11.00 C ATOM 420 C GLY A 63 -3.587 10.493 -11.501 1.00 12.73 C ATOM 421 O GLY A 63 -3.050 9.397 -11.326 1.00 12.21 O ATOM 422 H GLY A 63 -4.839 12.831 -10.354 1.00 0.00 H ATOM 423 N LEU A 64 -2.982 11.475 -12.170 1.00 10.54 N ATOM 424 CA LEU A 64 -1.665 11.212 -12.798 1.00 10.11 C ATOM 425 C LEU A 64 -0.550 10.939 -11.795 1.00 11.81 C ATOM 426 O LEU A 64 0.397 10.213 -12.104 1.00 11.87 O ATOM 427 CB LEU A 64 -1.264 12.365 -13.732 1.00 9.87 C ATOM 428 CG LEU A 64 -2.307 12.660 -14.836 1.00 14.44 C ATOM 429 CD1 LEU A 64 -1.863 13.852 -15.694 1.00 15.48 C ATOM 430 CD2 LEU A 64 -2.483 11.417 -15.766 1.00 14.01 C ATOM 431 H LEU A 64 -3.427 12.411 -12.250 1.00 0.00 H ATOM 432 N TYR A 65 -0.626 11.564 -10.620 1.00 9.82 N ATOM 433 CA TYR A 65 0.406 11.283 -9.618 1.00 10.25 C ATOM 434 C TYR A 65 -0.161 11.471 -8.251 1.00 11.42 C ATOM 435 O TYR A 65 -1.249 12.031 -8.105 1.00 11.08 O ATOM 436 CB TYR A 65 1.704 12.118 -9.824 1.00 10.96 C ATOM 437 CG TYR A 65 1.656 13.576 -9.426 1.00 12.16 C ATOM 438 CD1 TYR A 65 1.266 14.555 -10.338 1.00 14.17 C ATOM 439 CD2 TYR A 65 2.123 13.993 -8.181 1.00 13.10 C ATOM 440 CE1 TYR A 65 1.275 15.905 -9.992 1.00 15.97 C ATOM 441 CE2 TYR A 65 2.141 15.339 -7.827 1.00 14.29 C ATOM 442 CZ TYR A 65 1.719 16.292 -8.733 1.00 19.13 C ATOM 443 OH TYR A 65 1.764 17.619 -8.342 1.00 18.93 O ATOM 444 HH TYR A 65 1.436 18.191 -9.081 1.00 0.00 H ATOM 445 H TYR A 65 -1.397 12.233 -10.420 1.00 0.00 H ATOM 446 N PHE A 66 0.553 10.951 -7.230 1.00 10.12 N ATOM 447 CA PHE A 66 0.099 11.255 -5.862 1.00 9.70 C ATOM 448 C PHE A 66 1.282 11.829 -5.097 1.00 12.80 C ATOM 449 O PHE A 66 2.442 11.617 -5.490 1.00 11.81 O ATOM 450 CB PHE A 66 -0.500 10.053 -5.129 1.00 10.59 C ATOM 451 CG PHE A 66 0.448 8.938 -4.717 1.00 10.43 C ATOM 452 CD1 PHE A 66 1.362 9.122 -3.673 1.00 12.11 C ATOM 453 CD2 PHE A 66 0.392 7.697 -5.334 1.00 11.93 C ATOM 454 CE1 PHE A 66 2.219 8.079 -3.270 1.00 12.16 C ATOM 455 CE2 PHE A 66 1.266 6.666 -4.948 1.00 13.13 C ATOM 456 CZ PHE A 66 2.175 6.869 -3.916 1.00 13.11 C ATOM 457 H PHE A 66 1.391 10.359 -7.403 1.00 0.00 H ATOM 458 N GLU A 67 1.007 12.537 -3.998 1.00 11.21 N ATOM 459 CA GLU A 67 2.077 13.047 -3.141 1.00 10.11 C ATOM 460 C GLU A 67 1.792 12.558 -1.722 1.00 13.28 C ATOM 461 O GLU A 67 0.677 12.763 -1.196 1.00 13.94 O ATOM 462 CB GLU A 67 2.127 14.583 -3.176 1.00 12.50 C ATOM 463 CG GLU A 67 3.302 15.142 -2.389 1.00 15.29 C ATOM 464 CD GLU A 67 3.574 16.605 -2.682 1.00 23.91 C ATOM 465 OE1 GLU A 67 3.333 17.040 -3.829 1.00 23.23 O ATOM 466 OE2 GLU A 67 4.079 17.295 -1.769 1.00 32.44 O ATOM 467 H GLU A 67 0.016 12.729 -3.748 1.00 0.00 H ATOM 468 N ARG A 68 2.769 11.866 -1.096 1.00 10.47 N ATOM 469 CA ARG A 68 2.560 11.418 0.288 1.00 10.51 C ATOM 470 C ARG A 68 2.951 12.587 1.214 1.00 13.23 C ATOM 471 O ARG A 68 4.039 13.146 1.080 1.00 13.06 O ATOM 472 CB ARG A 68 3.475 10.220 0.594 1.00 10.78 C ATOM 473 CG ARG A 68 3.237 9.659 2.000 1.00 11.79 C ATOM 474 CD ARG A 68 4.311 8.617 2.290 1.00 12.58 C ATOM 475 NE ARG A 68 4.387 8.169 3.693 1.00 12.58 N ATOM 476 CZ ARG A 68 5.060 8.828 4.648 1.00 13.64 C ATOM 477 NH1 ARG A 68 5.581 10.030 4.398 1.00 13.32 N ATOM 478 NH2 ARG A 68 5.179 8.311 5.864 1.00 13.67 N ATOM 479 HE ARG A 68 3.891 7.294 3.957 1.00 0.00 H ATOM 480 HH12 ARG A 68 6.102 10.536 5.142 1.00 0.00 H ATOM 481 HH11 ARG A 68 5.466 10.461 3.459 1.00 0.00 H ATOM 482 HH22 ARG A 68 5.702 8.827 6.600 1.00 0.00 H ATOM 483 HH21 ARG A 68 4.749 7.389 6.082 1.00 0.00 H ATOM 484 H ARG A 68 3.660 11.653 -1.588 1.00 0.00 H ATOM 485 N ARG A 69 2.078 12.972 2.144 1.00 10.39 N ATOM 486 CA ARG A 69 2.464 14.051 3.060 1.00 11.92 C ATOM 487 C ARG A 69 3.552 13.555 4.016 1.00 15.19 C ATOM 488 O ARG A 69 3.667 12.347 4.253 1.00 12.97 O ATOM 489 CB ARG A 69 1.233 14.473 3.872 1.00 15.13 C ATOM 490 CG ARG A 69 0.226 15.158 2.964 1.00 20.95 C ATOM 491 CD ARG A 69 -0.803 15.938 3.741 1.00 32.10 C ATOM 492 NE ARG A 69 -1.935 15.085 4.052 1.00 41.54 N ATOM 493 CZ ARG A 69 -3.008 14.946 3.286 1.00 50.93 C ATOM 494 NH1 ARG A 69 -3.985 14.141 3.655 1.00 43.28 N ATOM 495 NH2 ARG A 69 -3.121 15.631 2.151 1.00 33.18 N ATOM 496 HE ARG A 69 -1.902 14.544 4.940 1.00 0.00 H ATOM 497 HH12 ARG A 69 -4.826 14.034 3.052 1.00 0.00 H ATOM 498 HH11 ARG A 69 -3.915 13.614 4.549 1.00 0.00 H ATOM 499 HH22 ARG A 69 -3.966 15.516 1.556 1.00 0.00 H ATOM 500 HH21 ARG A 69 -2.364 16.282 1.859 1.00 0.00 H ATOM 501 H ARG A 69 1.145 12.518 2.219 1.00 0.00 H ATOM 502 N PRO A 70 4.334 14.469 4.603 1.00 12.88 N ATOM 503 CA PRO A 70 5.343 14.038 5.582 1.00 13.12 C ATOM 504 C PRO A 70 4.623 13.620 6.855 1.00 19.92 C ATOM 505 O PRO A 70 3.900 14.420 7.447 1.00 23.61 O ATOM 506 CB PRO A 70 6.186 15.308 5.815 1.00 16.43 C ATOM 507 CG PRO A 70 5.773 16.281 4.769 1.00 22.02 C ATOM 508 CD PRO A 70 4.368 15.933 4.393 1.00 16.61 C ATOM 509 N VAL A 71 4.703 12.343 7.200 1.00 15.93 N ATOM 510 CA VAL A 71 4.068 11.807 8.417 1.00 15.35 C ATOM 511 C VAL A 71 5.056 10.770 8.925 1.00 16.39 C ATOM 512 O VAL A 71 5.452 9.878 8.168 1.00 15.08 O ATOM 513 CB VAL A 71 2.674 11.164 8.139 1.00 19.14 C ATOM 514 CG1 VAL A 71 2.141 10.419 9.374 1.00 18.73 C ATOM 515 CG2 VAL A 71 1.657 12.201 7.665 1.00 20.60 C ATOM 516 H VAL A 71 5.235 11.693 6.587 1.00 0.00 H ATOM 517 N ALA A 72 5.459 10.895 10.192 1.00 15.10 N ATOM 518 CA ALA A 72 6.435 9.998 10.778 1.00 16.04 C ATOM 519 C ALA A 72 5.840 8.618 11.039 1.00 19.85 C ATOM 520 O ALA A 72 4.663 8.500 11.395 1.00 18.93 O ATOM 521 CB ALA A 72 6.958 10.580 12.082 1.00 18.20 C ATOM 522 H ALA A 72 5.061 11.658 10.775 1.00 0.00 H ATOM 523 N GLN A 73 6.676 7.590 10.871 1.00 16.91 N ATOM 524 CA GLN A 73 6.371 6.199 11.219 1.00 16.80 C ATOM 525 C GLN A 73 5.039 5.709 10.628 1.00 19.21 C ATOM 526 O GLN A 73 4.115 5.238 11.319 1.00 18.92 O ATOM 527 CB GLN A 73 6.459 6.025 12.735 1.00 19.35 C ATOM 528 CG GLN A 73 7.924 6.201 13.234 1.00 24.59 C ATOM 529 CD GLN A 73 8.811 5.016 12.860 1.00 32.94 C ATOM 530 OE1 GLN A 73 8.336 3.888 12.698 1.00 27.36 O ATOM 531 NE2 GLN A 73 10.132 5.226 12.758 1.00 24.69 N ATOM 532 HE22 GLN A 73 10.519 6.181 12.897 1.00 0.00 H ATOM 533 HE21 GLN A 73 10.769 4.433 12.540 1.00 0.00 H ATOM 534 H GLN A 73 7.612 7.791 10.464 1.00 0.00 H ATOM 535 N SER A 74 4.971 5.812 9.310 1.00 14.30 N ATOM 536 CA SER A 74 3.801 5.398 8.566 1.00 13.90 C ATOM 537 C SER A 74 4.253 4.912 7.208 1.00 15.33 C ATOM 538 O SER A 74 5.173 5.512 6.615 1.00 13.74 O ATOM 539 CB SER A 74 2.897 6.618 8.341 1.00 16.35 C ATOM 540 OG SER A 74 1.728 6.308 7.594 1.00 16.84 O ATOM 541 HG SER A 74 1.989 5.957 6.706 1.00 0.00 H ATOM 542 H SER A 74 5.784 6.203 8.793 1.00 0.00 H ATOM 543 N THR A 75 3.555 3.871 6.679 1.00 12.22 N ATOM 544 CA THR A 75 3.726 3.418 5.298 1.00 12.04 C ATOM 545 C THR A 75 2.356 3.612 4.673 1.00 14.12 C ATOM 546 O THR A 75 1.336 3.324 5.317 1.00 13.98 O ATOM 547 CB THR A 75 4.209 1.981 5.184 1.00 14.95 C ATOM 548 OG1 THR A 75 5.451 1.868 5.885 1.00 13.09 O ATOM 549 CG2 THR A 75 4.428 1.582 3.725 1.00 13.81 C ATOM 550 HG1 THR A 75 5.315 2.107 6.836 1.00 0.00 H ATOM 551 H THR A 75 2.869 3.375 7.283 1.00 0.00 H ATOM 552 N ASP A 76 2.329 4.168 3.447 1.00 11.92 N ATOM 553 CA ASP A 76 1.100 4.640 2.816 1.00 11.46 C ATOM 554 C ASP A 76 1.022 4.218 1.378 1.00 13.11 C ATOM 555 O ASP A 76 1.988 4.403 0.629 1.00 12.82 O ATOM 556 CB ASP A 76 1.115 6.175 2.900 1.00 13.11 C ATOM 557 CG ASP A 76 1.145 6.623 4.363 1.00 14.79 C ATOM 558 OD1 ASP A 76 0.062 6.650 4.989 1.00 14.16 O ATOM 559 OD2 ASP A 76 2.271 6.717 4.936 1.00 14.12 O ATOM 560 H ASP A 76 3.224 4.266 2.926 1.00 0.00 H ATOM 561 N GLY A 77 -0.120 3.661 1.012 1.00 11.83 N ATOM 562 CA GLY A 77 -0.302 3.175 -0.350 1.00 12.13 C ATOM 563 C GLY A 77 -1.495 3.779 -1.053 1.00 15.42 C ATOM 564 O GLY A 77 -2.299 4.516 -0.451 1.00 13.64 O ATOM 565 H GLY A 77 -0.894 3.569 1.701 1.00 0.00 H ATOM 566 N ALA A 78 -1.592 3.498 -2.349 1.00 12.32 N ATOM 567 CA ALA A 78 -2.714 3.965 -3.147 1.00 11.61 C ATOM 568 C ALA A 78 -3.047 2.881 -4.139 1.00 13.02 C ATOM 569 O ALA A 78 -2.148 2.157 -4.561 1.00 12.95 O ATOM 570 CB ALA A 78 -2.335 5.247 -3.907 1.00 12.56 C ATOM 571 H ALA A 78 -0.848 2.931 -2.803 1.00 0.00 H ATOM 572 N ARG A 79 -4.314 2.799 -4.532 1.00 11.03 N ATOM 573 CA ARG A 79 -4.715 1.915 -5.627 1.00 10.20 C ATOM 574 C ARG A 79 -5.154 2.774 -6.826 1.00 13.02 C ATOM 575 O ARG A 79 -5.680 3.891 -6.671 1.00 12.08 O ATOM 576 CB ARG A 79 -5.888 0.995 -5.214 1.00 13.00 C ATOM 577 CG ARG A 79 -5.407 -0.318 -4.564 1.00 12.66 C ATOM 578 CD ARG A 79 -6.582 -1.247 -4.234 1.00 13.37 C ATOM 579 NE ARG A 79 -7.381 -0.719 -3.141 1.00 13.35 N ATOM 580 CZ ARG A 79 -7.252 -1.105 -1.873 1.00 16.32 C ATOM 581 NH1 ARG A 79 -7.934 -0.488 -0.913 1.00 15.41 N ATOM 582 NH2 ARG A 79 -6.468 -2.142 -1.559 1.00 14.95 N ATOM 583 HE ARG A 79 -8.096 0.003 -3.362 1.00 0.00 H ATOM 584 HH12 ARG A 79 -7.831 -0.792 0.076 1.00 0.00 H ATOM 585 HH11 ARG A 79 -8.571 0.299 -1.151 1.00 0.00 H ATOM 586 HH22 ARG A 79 -6.371 -2.439 -0.567 1.00 0.00 H ATOM 587 HH21 ARG A 79 -5.955 -2.651 -2.307 1.00 0.00 H ATOM 588 H ARG A 79 -5.035 3.375 -4.052 1.00 0.00 H ATOM 589 N GLY A 80 -5.006 2.211 -8.014 1.00 11.16 N ATOM 590 CA GLY A 80 -5.559 2.828 -9.221 1.00 11.64 C ATOM 591 C GLY A 80 -7.085 2.741 -9.203 1.00 13.24 C ATOM 592 O GLY A 80 -7.678 1.949 -8.447 1.00 12.33 O ATOM 593 H GLY A 80 -4.487 1.313 -8.092 1.00 0.00 H ATOM 594 N LYS A 81 -7.748 3.578 -10.001 1.00 10.68 N ATOM 595 CA LYS A 81 -9.208 3.598 -10.071 1.00 11.48 C ATOM 596 C LYS A 81 -9.823 2.348 -10.686 1.00 15.05 C ATOM 597 O LYS A 81 -10.994 2.063 -10.427 1.00 15.27 O ATOM 598 CB LYS A 81 -9.657 4.766 -10.931 1.00 11.64 C ATOM 599 CG LYS A 81 -9.346 6.122 -10.289 1.00 15.50 C ATOM 600 CD LYS A 81 -9.604 7.236 -11.321 1.00 18.31 C ATOM 601 CE LYS A 81 -9.278 8.575 -10.735 1.00 19.61 C ATOM 602 NZ LYS A 81 -9.294 9.633 -11.759 1.00 17.23 N ATOM 603 HZ1 LYS A 81 -8.590 9.415 -12.492 1.00 0.00 H ATOM 604 HZ2 LYS A 81 -10.240 9.683 -12.189 1.00 0.00 H ATOM 605 HZ3 LYS A 81 -9.064 10.546 -11.316 1.00 0.00 H ATOM 606 H LYS A 81 -7.208 4.240 -10.594 1.00 0.00 H ATOM 607 N ARG A 82 -9.079 1.656 -11.558 1.00 11.64 N ATOM 608 CA ARG A 82 -9.628 0.517 -12.293 1.00 12.44 C ATOM 609 C ARG A 82 -8.945 -0.782 -11.885 1.00 17.21 C ATOM 610 O ARG A 82 -7.714 -0.845 -11.807 1.00 15.78 O ATOM 611 CB ARG A 82 -9.489 0.736 -13.807 1.00 15.56 C ATOM 612 CG ARG A 82 -10.175 1.977 -14.379 1.00 21.79 C ATOM 613 CD ARG A 82 -11.692 1.951 -14.350 1.00 47.26 C ATOM 614 NE ARG A 82 -12.267 0.790 -15.036 1.00 67.47 N ATOM 615 CZ ARG A 82 -12.499 0.719 -16.345 1.00 87.45 C ATOM 616 NH1 ARG A 82 -12.178 1.733 -17.141 1.00 75.15 N ATOM 617 NH2 ARG A 82 -13.042 -0.372 -16.869 1.00 77.67 N ATOM 618 HE ARG A 82 -12.512 -0.039 -14.458 1.00 0.00 H ATOM 619 HH12 ARG A 82 -12.362 1.671 -18.163 1.00 0.00 H ATOM 620 HH11 ARG A 82 -11.743 2.589 -16.742 1.00 0.00 H ATOM 621 HH22 ARG A 82 -13.222 -0.423 -17.892 1.00 0.00 H ATOM 622 HH21 ARG A 82 -13.288 -1.176 -16.257 1.00 0.00 H ATOM 623 H ARG A 82 -8.090 1.934 -11.716 1.00 0.00 H ATOM 624 N GLY A 83 -9.768 -1.798 -11.613 1.00 15.32 N ATOM 625 CA GLY A 83 -9.276 -3.126 -11.274 1.00 15.33 C ATOM 626 C GLY A 83 -9.402 -4.026 -12.479 1.00 16.42 C ATOM 627 O GLY A 83 -10.404 -3.977 -13.206 1.00 17.64 O ATOM 628 H GLY A 83 -10.795 -1.635 -11.644 1.00 0.00 H ATOM 629 N TYR A 84 -8.383 -4.848 -12.706 1.00 13.62 N ATOM 630 CA TYR A 84 -8.302 -5.722 -13.881 1.00 12.71 C ATOM 631 C TYR A 84 -8.440 -7.180 -13.535 1.00 16.02 C ATOM 632 O TYR A 84 -7.782 -7.678 -12.615 1.00 14.44 O ATOM 633 CB TYR A 84 -6.986 -5.447 -14.657 1.00 12.79 C ATOM 634 CG TYR A 84 -6.698 -3.965 -14.787 1.00 12.36 C ATOM 635 CD1 TYR A 84 -7.584 -3.117 -15.457 1.00 14.47 C ATOM 636 CD2 TYR A 84 -5.555 -3.405 -14.217 1.00 12.45 C ATOM 637 CE1 TYR A 84 -7.350 -1.748 -15.540 1.00 14.70 C ATOM 638 CE2 TYR A 84 -5.303 -2.029 -14.296 1.00 12.04 C ATOM 639 CZ TYR A 84 -6.203 -1.210 -14.962 1.00 15.44 C ATOM 640 OH TYR A 84 -5.992 0.146 -15.023 1.00 14.03 O ATOM 641 HH TYR A 84 -6.727 0.571 -15.533 1.00 0.00 H ATOM 642 H TYR A 84 -7.605 -4.873 -12.017 1.00 0.00 H ATOM 643 N SER A 85 -9.315 -7.861 -14.282 1.00 14.53 N ATOM 644 CA SER A 85 -9.556 -9.281 -14.063 1.00 15.49 C ATOM 645 C SER A 85 -9.261 -10.112 -15.306 1.00 17.43 C ATOM 646 O SER A 85 -9.183 -11.337 -15.208 1.00 18.85 O ATOM 647 CB SER A 85 -11.003 -9.490 -13.624 1.00 20.97 C ATOM 648 OG SER A 85 -11.914 -9.092 -14.629 1.00 26.26 O ATOM 649 HG SER A 85 -12.840 -9.241 -14.311 1.00 0.00 H ATOM 650 H SER A 85 -9.835 -7.367 -15.035 1.00 0.00 H ATOM 651 N ARG A 86 -9.123 -9.457 -16.476 1.00 15.04 N ATOM 652 CA ARG A 86 -8.878 -10.092 -17.776 1.00 15.02 C ATOM 653 C ARG A 86 -8.020 -9.167 -18.630 1.00 18.21 C ATOM 654 O ARG A 86 -7.928 -7.980 -18.333 1.00 16.56 O ATOM 655 CB ARG A 86 -10.200 -10.385 -18.526 1.00 18.50 C ATOM 656 CG ARG A 86 -11.075 -11.492 -17.904 1.00 30.80 C ATOM 657 CD ARG A 86 -10.459 -12.905 -17.900 1.00 42.34 C ATOM 658 NE ARG A 86 -10.034 -13.370 -19.229 1.00 43.96 N ATOM 659 CZ ARG A 86 -10.842 -13.898 -20.146 1.00 59.23 C ATOM 660 NH1 ARG A 86 -12.142 -14.029 -19.902 1.00 48.51 N ATOM 661 NH2 ARG A 86 -10.359 -14.290 -21.317 1.00 43.55 N ATOM 662 HE ARG A 86 -9.027 -13.280 -19.471 1.00 0.00 H ATOM 663 HH12 ARG A 86 -12.767 -14.442 -20.623 1.00 0.00 H ATOM 664 HH11 ARG A 86 -12.534 -13.718 -18.990 1.00 0.00 H ATOM 665 HH22 ARG A 86 -10.994 -14.702 -22.030 1.00 0.00 H ATOM 666 HH21 ARG A 86 -9.345 -14.186 -21.522 1.00 0.00 H ATOM 667 H ARG A 86 -9.196 -8.420 -16.456 1.00 0.00 H ATOM 668 N GLY A 87 -7.414 -9.716 -19.677 1.00 16.84 N ATOM 669 CA GLY A 87 -6.619 -8.917 -20.607 1.00 16.26 C ATOM 670 C GLY A 87 -5.233 -8.538 -20.126 1.00 17.44 C ATOM 671 O GLY A 87 -4.796 -8.905 -19.023 1.00 17.62 O ATOM 672 H GLY A 87 -7.508 -10.739 -19.839 1.00 0.00 H ATOM 673 N LEU A 88 -4.527 -7.795 -20.998 1.00 13.47 N ATOM 674 CA LEU A 88 -3.176 -7.298 -20.726 1.00 12.60 C ATOM 675 C LEU A 88 -3.251 -5.829 -20.330 1.00 15.54 C ATOM 676 O LEU A 88 -3.937 -5.015 -20.970 1.00 15.42 O ATOM 677 CB LEU A 88 -2.326 -7.432 -21.999 1.00 12.92 C ATOM 678 CG LEU A 88 -0.879 -6.922 -21.894 1.00 15.30 C ATOM 679 CD1 LEU A 88 -0.094 -7.682 -20.812 1.00 16.08 C ATOM 680 CD2 LEU A 88 -0.193 -7.036 -23.253 1.00 16.37 C ATOM 681 H LEU A 88 -4.963 -7.561 -21.913 1.00 0.00 H ATOM 682 N HIS A 89 -2.549 -5.494 -19.250 1.00 11.95 N ATOM 683 CA HIS A 89 -2.539 -4.131 -18.709 1.00 12.50 C ATOM 684 C HIS A 89 -1.123 -3.746 -18.347 1.00 15.42 C ATOM 685 O HIS A 89 -0.431 -4.505 -17.652 1.00 16.81 O ATOM 686 CB HIS A 89 -3.454 -4.066 -17.481 1.00 12.42 C ATOM 687 CG HIS A 89 -4.853 -4.442 -17.844 1.00 14.24 C ATOM 688 ND1 HIS A 89 -5.710 -3.535 -18.416 1.00 15.65 N ATOM 689 CD2 HIS A 89 -5.459 -5.654 -17.804 1.00 15.20 C ATOM 690 CE1 HIS A 89 -6.824 -4.203 -18.688 1.00 15.54 C ATOM 691 NE2 HIS A 89 -6.724 -5.478 -18.339 1.00 16.38 N ATOM 692 H HIS A 89 -1.986 -6.226 -18.772 1.00 0.00 H ATOM 693 N ALA A 90 -0.685 -2.567 -18.798 1.00 11.72 N ATOM 694 CA ALA A 90 0.664 -2.136 -18.441 1.00 11.42 C ATOM 695 C ALA A 90 0.615 -0.658 -18.117 1.00 14.20 C ATOM 696 O ALA A 90 -0.140 0.086 -18.744 1.00 13.00 O ATOM 697 CB ALA A 90 1.643 -2.411 -19.581 1.00 12.69 C ATOM 698 H ALA A 90 -1.293 -1.968 -19.392 1.00 0.00 H ATOM 699 N TRP A 91 1.417 -0.235 -17.146 1.00 10.63 N ATOM 700 CA TRP A 91 1.491 1.174 -16.783 1.00 10.81 C ATOM 701 C TRP A 91 2.902 1.503 -16.354 1.00 13.66 C ATOM 702 O TRP A 91 3.584 0.642 -15.785 1.00 12.90 O ATOM 703 CB TRP A 91 0.488 1.534 -15.665 1.00 10.15 C ATOM 704 CG TRP A 91 0.591 0.683 -14.417 1.00 9.76 C ATOM 705 CD1 TRP A 91 1.349 0.937 -13.312 1.00 12.09 C ATOM 706 CD2 TRP A 91 -0.072 -0.568 -14.174 1.00 9.58 C ATOM 707 NE1 TRP A 91 1.164 -0.065 -12.370 1.00 10.68 N ATOM 708 CE2 TRP A 91 0.275 -0.981 -12.862 1.00 11.91 C ATOM 709 CE3 TRP A 91 -0.995 -1.341 -14.907 1.00 10.96 C ATOM 710 CZ2 TRP A 91 -0.204 -2.171 -12.295 1.00 11.88 C ATOM 711 CZ3 TRP A 91 -1.451 -2.531 -14.357 1.00 11.95 C ATOM 712 CH2 TRP A 91 -1.040 -2.953 -13.078 1.00 11.65 C ATOM 713 HE1 TRP A 91 1.627 -0.112 -11.440 1.00 0.00 H ATOM 714 H TRP A 91 2.004 -0.924 -16.634 1.00 0.00 H ATOM 715 N GLU A 92 3.352 2.729 -16.659 1.00 11.65 N ATOM 716 CA GLU A 92 4.688 3.145 -16.242 1.00 10.99 C ATOM 717 C GLU A 92 4.554 3.857 -14.903 1.00 15.42 C ATOM 718 O GLU A 92 3.668 4.705 -14.740 1.00 14.97 O ATOM 719 CB GLU A 92 5.320 4.096 -17.277 1.00 13.25 C ATOM 720 CG GLU A 92 6.804 4.356 -17.030 1.00 24.39 C ATOM 721 CD GLU A 92 7.549 4.823 -18.263 1.00 44.71 C ATOM 722 OE1 GLU A 92 7.192 5.905 -18.770 1.00 30.99 O ATOM 723 OE2 GLU A 92 8.440 4.093 -18.756 1.00 44.41 O ATOM 724 H GLU A 92 2.748 3.385 -17.194 1.00 0.00 H ATOM 725 N ILE A 93 5.417 3.505 -13.944 1.00 11.01 N ATOM 726 CA ILE A 93 5.479 4.201 -12.657 1.00 10.21 C ATOM 727 C ILE A 93 6.730 5.077 -12.739 1.00 14.30 C ATOM 728 O ILE A 93 7.793 4.588 -13.152 1.00 13.89 O ATOM 729 CB ILE A 93 5.617 3.182 -11.481 1.00 11.86 C ATOM 730 CG1 ILE A 93 4.312 2.393 -11.279 1.00 11.23 C ATOM 731 CG2 ILE A 93 6.088 3.893 -10.172 1.00 12.01 C ATOM 732 CD1 ILE A 93 3.119 3.275 -10.709 1.00 11.94 C ATOM 733 H ILE A 93 6.066 2.711 -14.118 1.00 0.00 H ATOM 734 N SER A 94 6.623 6.355 -12.354 1.00 11.32 N ATOM 735 CA SER A 94 7.783 7.243 -12.319 1.00 11.13 C ATOM 736 C SER A 94 7.938 7.677 -10.865 1.00 14.40 C ATOM 737 O SER A 94 7.001 8.223 -10.260 1.00 12.88 O ATOM 738 CB SER A 94 7.596 8.411 -13.288 1.00 15.35 C ATOM 739 OG SER A 94 8.772 9.189 -13.381 1.00 22.37 O ATOM 740 HG SER A 94 8.998 9.551 -12.488 1.00 0.00 H ATOM 741 H SER A 94 5.692 6.724 -12.073 1.00 0.00 H ATOM 742 N TRP A 95 9.081 7.336 -10.278 1.00 13.40 N ATOM 743 CA TRP A 95 9.301 7.535 -8.842 1.00 12.35 C ATOM 744 C TRP A 95 10.743 8.012 -8.639 1.00 14.76 C ATOM 745 O TRP A 95 11.675 7.201 -8.750 1.00 14.11 O ATOM 746 CB TRP A 95 9.101 6.181 -8.136 1.00 11.29 C ATOM 747 CG TRP A 95 8.972 6.283 -6.641 1.00 11.71 C ATOM 748 CD1 TRP A 95 9.454 7.274 -5.825 1.00 14.26 C ATOM 749 CD2 TRP A 95 8.321 5.336 -5.786 1.00 11.43 C ATOM 750 NE1 TRP A 95 9.114 7.011 -4.509 1.00 13.46 N ATOM 751 CE2 TRP A 95 8.397 5.840 -4.461 1.00 13.66 C ATOM 752 CE3 TRP A 95 7.654 4.116 -6.017 1.00 12.75 C ATOM 753 CZ2 TRP A 95 7.832 5.155 -3.364 1.00 12.79 C ATOM 754 CZ3 TRP A 95 7.082 3.446 -4.939 1.00 13.54 C ATOM 755 CH2 TRP A 95 7.144 3.976 -3.638 1.00 12.56 C ATOM 756 HE1 TRP A 95 9.361 7.603 -3.690 1.00 0.00 H ATOM 757 H TRP A 95 9.840 6.917 -10.853 1.00 0.00 H ATOM 758 N PRO A 96 10.931 9.314 -8.386 1.00 12.97 N ATOM 759 CA PRO A 96 12.299 9.865 -8.266 1.00 14.15 C ATOM 760 C PRO A 96 13.171 9.080 -7.318 1.00 16.45 C ATOM 761 O PRO A 96 12.710 8.695 -6.257 1.00 14.13 O ATOM 762 CB PRO A 96 12.063 11.308 -7.807 1.00 16.27 C ATOM 763 CG PRO A 96 10.725 11.651 -8.401 1.00 19.50 C ATOM 764 CD PRO A 96 9.917 10.380 -8.225 1.00 14.67 C ATOM 765 N LEU A 97 14.419 8.826 -7.725 1.00 16.42 N ATOM 766 CA LEU A 97 15.349 8.018 -6.921 1.00 16.71 C ATOM 767 C LEU A 97 15.515 8.569 -5.500 1.00 18.27 C ATOM 768 O LEU A 97 15.539 7.787 -4.541 1.00 19.14 O ATOM 769 CB LEU A 97 16.740 7.973 -7.595 1.00 18.88 C ATOM 770 CG LEU A 97 16.813 7.365 -9.021 1.00 25.43 C ATOM 771 CD1 LEU A 97 18.256 7.212 -9.474 1.00 27.20 C ATOM 772 CD2 LEU A 97 16.089 6.047 -9.121 1.00 25.11 C ATOM 773 H LEU A 97 14.741 9.211 -8.636 1.00 0.00 H ATOM 774 N GLU A 98 15.585 9.896 -5.362 1.00 14.97 N ATOM 775 CA GLU A 98 15.785 10.543 -4.056 1.00 15.35 C ATOM 776 C GLU A 98 14.540 10.565 -3.174 1.00 17.50 C ATOM 777 O GLU A 98 14.603 11.124 -2.064 1.00 18.49 O ATOM 778 CB GLU A 98 16.354 11.975 -4.219 1.00 18.53 C ATOM 779 CG GLU A 98 15.353 13.001 -4.734 1.00 30.45 C ATOM 780 CD GLU A 98 15.012 13.029 -6.214 1.00 53.01 C ATOM 781 OE1 GLU A 98 15.541 12.196 -6.994 1.00 34.83 O ATOM 782 OE2 GLU A 98 14.212 13.916 -6.593 1.00 49.60 O ATOM 783 H GLU A 98 15.495 10.493 -6.209 1.00 0.00 H ATOM 784 N GLN A 99 13.409 10.035 -3.675 1.00 13.35 N ATOM 785 CA GLN A 99 12.145 10.073 -2.938 1.00 13.11 C ATOM 786 C GLN A 99 11.647 8.674 -2.591 1.00 14.97 C ATOM 787 O GLN A 99 10.454 8.491 -2.344 1.00 13.17 O ATOM 788 CB GLN A 99 11.085 10.807 -3.778 1.00 12.51 C ATOM 789 CG GLN A 99 11.385 12.323 -3.951 1.00 15.22 C ATOM 790 CD GLN A 99 10.372 12.984 -4.866 1.00 20.44 C ATOM 791 OE1 GLN A 99 9.348 12.399 -5.231 1.00 15.69 O ATOM 792 NE2 GLN A 99 10.705 14.184 -5.348 1.00 25.02 N ATOM 793 HE22 GLN A 99 11.574 14.653 -5.022 1.00 0.00 H ATOM 794 HE21 GLN A 99 10.095 14.650 -6.050 1.00 0.00 H ATOM 795 H GLN A 99 13.434 9.586 -4.613 1.00 0.00 H ATOM 796 N ARG A 100 12.572 7.693 -2.532 1.00 14.01 N ATOM 797 CA ARG A 100 12.170 6.318 -2.276 1.00 12.15 C ATOM 798 C ARG A 100 12.303 5.930 -0.814 1.00 15.09 C ATOM 799 O ARG A 100 11.494 5.149 -0.315 1.00 14.74 O ATOM 800 CB ARG A 100 12.953 5.373 -3.195 1.00 13.37 C ATOM 801 CG ARG A 100 12.479 5.515 -4.635 1.00 14.86 C ATOM 802 CD ARG A 100 13.363 4.777 -5.617 1.00 16.08 C ATOM 803 NE ARG A 100 12.869 5.026 -6.968 1.00 16.77 N ATOM 804 CZ ARG A 100 13.262 4.367 -8.052 1.00 19.21 C ATOM 805 NH1 ARG A 100 12.696 4.616 -9.227 1.00 15.48 N ATOM 806 NH2 ARG A 100 14.213 3.437 -7.966 1.00 14.83 N ATOM 807 HE ARG A 100 12.157 5.774 -7.091 1.00 0.00 H ATOM 808 HH12 ARG A 100 13.006 4.098 -10.074 1.00 0.00 H ATOM 809 HH11 ARG A 100 11.942 5.329 -9.301 1.00 0.00 H ATOM 810 HH22 ARG A 100 14.517 2.924 -8.818 1.00 0.00 H ATOM 811 HH21 ARG A 100 14.651 3.225 -7.047 1.00 0.00 H ATOM 812 H ARG A 100 13.577 7.921 -2.670 1.00 0.00 H ATOM 813 N GLY A 101 13.327 6.450 -0.140 1.00 14.39 N ATOM 814 CA GLY A 101 13.511 6.137 1.266 1.00 15.08 C ATOM 815 C GLY A 101 13.771 4.664 1.525 1.00 18.42 C ATOM 816 O GLY A 101 14.314 3.948 0.671 1.00 18.32 O ATOM 817 H GLY A 101 13.997 7.082 -0.622 1.00 0.00 H ATOM 818 N THR A 102 13.351 4.200 2.696 1.00 15.25 N ATOM 819 CA THR A 102 13.680 2.838 3.159 1.00 14.80 C ATOM 820 C THR A 102 12.858 1.710 2.539 1.00 17.76 C ATOM 821 O THR A 102 13.332 0.561 2.535 1.00 17.89 O ATOM 822 CB THR A 102 13.556 2.734 4.685 1.00 14.86 C ATOM 823 OG1 THR A 102 12.223 3.058 5.055 1.00 16.07 O ATOM 824 CG2 THR A 102 14.541 3.637 5.428 1.00 16.53 C ATOM 825 HG1 THR A 102 11.598 2.424 4.622 1.00 0.00 H ATOM 826 H THR A 102 12.773 4.814 3.305 1.00 0.00 H ATOM 827 N HIS A 103 11.612 1.994 2.116 1.00 12.04 N ATOM 828 CA HIS A 103 10.727 0.954 1.586 1.00 11.63 C ATOM 829 C HIS A 103 9.881 1.533 0.453 1.00 14.86 C ATOM 830 O HIS A 103 8.887 2.233 0.709 1.00 14.05 O ATOM 831 CB HIS A 103 9.784 0.443 2.712 1.00 13.26 C ATOM 832 CG HIS A 103 10.481 -0.167 3.890 1.00 16.43 C ATOM 833 ND1 HIS A 103 10.904 0.612 4.965 1.00 17.89 N ATOM 834 CD2 HIS A 103 10.813 -1.461 4.128 1.00 18.74 C ATOM 835 CE1 HIS A 103 11.464 -0.232 5.822 1.00 18.89 C ATOM 836 NE2 HIS A 103 11.453 -1.488 5.353 1.00 18.81 N ATOM 837 H HIS A 103 11.270 2.975 2.167 1.00 0.00 H ATOM 838 N ALA A 104 10.275 1.241 -0.786 1.00 12.60 N ATOM 839 CA ALA A 104 9.554 1.717 -1.978 1.00 12.76 C ATOM 840 C ALA A 104 9.119 0.455 -2.723 1.00 14.50 C ATOM 841 O ALA A 104 9.985 -0.281 -3.216 1.00 14.73 O ATOM 842 CB ALA A 104 10.474 2.567 -2.843 1.00 14.30 C ATOM 843 H ALA A 104 11.124 0.655 -0.916 1.00 0.00 H ATOM 844 N VAL A 105 7.787 0.159 -2.753 1.00 11.06 N ATOM 845 CA VAL A 105 7.299 -1.112 -3.293 1.00 9.92 C ATOM 846 C VAL A 105 6.286 -0.853 -4.396 1.00 12.77 C ATOM 847 O VAL A 105 5.372 -0.049 -4.201 1.00 10.90 O ATOM 848 CB VAL A 105 6.707 -2.034 -2.188 1.00 13.12 C ATOM 849 CG1 VAL A 105 6.379 -3.422 -2.753 1.00 13.40 C ATOM 850 CG2 VAL A 105 7.656 -2.160 -0.993 1.00 14.14 C ATOM 851 H VAL A 105 7.104 0.851 -2.384 1.00 0.00 H ATOM 852 N VAL A 106 6.454 -1.526 -5.546 1.00 10.96 N ATOM 853 CA VAL A 106 5.570 -1.302 -6.698 1.00 8.90 C ATOM 854 C VAL A 106 4.914 -2.618 -7.134 1.00 12.13 C ATOM 855 O VAL A 106 5.616 -3.616 -7.318 1.00 12.59 O ATOM 856 CB VAL A 106 6.411 -0.716 -7.859 1.00 11.03 C ATOM 857 CG1 VAL A 106 5.569 -0.558 -9.127 1.00 12.19 C ATOM 858 CG2 VAL A 106 7.055 0.623 -7.467 1.00 11.22 C ATOM 859 H VAL A 106 7.225 -2.220 -5.623 1.00 0.00 H ATOM 860 N GLY A 107 3.598 -2.600 -7.363 1.00 9.33 N ATOM 861 CA GLY A 107 2.944 -3.824 -7.817 1.00 11.24 C ATOM 862 C GLY A 107 1.454 -3.668 -7.993 1.00 12.84 C ATOM 863 O GLY A 107 0.991 -2.772 -8.705 1.00 10.79 O ATOM 864 H GLY A 107 3.048 -1.729 -7.220 1.00 0.00 H ATOM 865 N VAL A 108 0.710 -4.605 -7.406 1.00 10.56 N ATOM 866 CA VAL A 108 -0.749 -4.613 -7.509 1.00 10.35 C ATOM 867 C VAL A 108 -1.371 -5.053 -6.194 1.00 14.39 C ATOM 868 O VAL A 108 -0.702 -5.650 -5.348 1.00 13.59 O ATOM 869 CB VAL A 108 -1.280 -5.523 -8.663 1.00 12.39 C ATOM 870 CG1 VAL A 108 -0.735 -5.073 -10.029 1.00 12.40 C ATOM 871 CG2 VAL A 108 -0.967 -6.994 -8.392 1.00 11.96 C ATOM 872 H VAL A 108 1.181 -5.353 -6.858 1.00 0.00 H ATOM 873 N ALA A 109 -2.674 -4.812 -6.057 1.00 12.16 N ATOM 874 CA ALA A 109 -3.404 -5.240 -4.853 1.00 12.41 C ATOM 875 C ALA A 109 -4.839 -5.530 -5.204 1.00 14.04 C ATOM 876 O ALA A 109 -5.394 -4.879 -6.099 1.00 13.94 O ATOM 877 CB ALA A 109 -3.361 -4.112 -3.809 1.00 13.78 C ATOM 878 H ALA A 109 -3.184 -4.313 -6.814 1.00 0.00 H ATOM 879 N THR A 110 -5.496 -6.431 -4.431 1.00 12.87 N ATOM 880 CA THR A 110 -6.940 -6.568 -4.556 1.00 13.65 C ATOM 881 C THR A 110 -7.499 -5.331 -3.807 1.00 16.09 C ATOM 882 O THR A 110 -6.746 -4.601 -3.138 1.00 15.19 O ATOM 883 CB THR A 110 -7.425 -7.812 -3.818 1.00 17.14 C ATOM 884 OG1 THR A 110 -7.285 -7.601 -2.402 1.00 18.22 O ATOM 885 CG2 THR A 110 -6.701 -9.079 -4.296 1.00 15.14 C ATOM 886 HG1 THR A 110 -7.598 -8.405 -1.917 1.00 0.00 H ATOM 887 H THR A 110 -4.971 -7.020 -3.753 1.00 0.00 H ATOM 888 N ALA A 111 -8.830 -5.139 -3.860 1.00 15.87 N ATOM 889 CA ALA A 111 -9.501 -4.068 -3.127 1.00 15.56 C ATOM 890 C ALA A 111 -9.381 -4.248 -1.588 1.00 18.97 C ATOM 891 O ALA A 111 -9.653 -3.298 -0.846 1.00 20.67 O ATOM 892 CB ALA A 111 -10.978 -4.035 -3.515 1.00 16.91 C ATOM 893 H ALA A 111 -9.404 -5.778 -4.446 1.00 0.00 H ATOM 894 N LEU A 112 -9.011 -5.446 -1.108 1.00 17.13 N ATOM 895 CA LEU A 112 -8.967 -5.745 0.345 1.00 18.49 C ATOM 896 C LEU A 112 -7.636 -5.426 1.032 1.00 20.78 C ATOM 897 O LEU A 112 -7.581 -5.405 2.272 1.00 21.80 O ATOM 898 CB LEU A 112 -9.304 -7.220 0.611 1.00 20.36 C ATOM 899 CG LEU A 112 -10.635 -7.763 0.057 1.00 27.74 C ATOM 900 CD1 LEU A 112 -10.809 -9.226 0.428 1.00 29.68 C ATOM 901 CD2 LEU A 112 -11.822 -6.960 0.577 1.00 34.03 C ATOM 902 H LEU A 112 -8.745 -6.193 -1.780 1.00 0.00 H ATOM 903 N ALA A 113 -6.550 -5.243 0.254 1.00 15.45 N ATOM 904 CA ALA A 113 -5.259 -4.968 0.890 1.00 15.05 C ATOM 905 C ALA A 113 -5.289 -3.666 1.701 1.00 16.69 C ATOM 906 O ALA A 113 -5.750 -2.642 1.196 1.00 15.20 O ATOM 907 CB ALA A 113 -4.151 -4.870 -0.151 1.00 14.34 C ATOM 908 H ALA A 113 -6.628 -5.296 -0.782 1.00 0.00 H ATOM 909 N PRO A 114 -4.694 -3.679 2.901 1.00 15.17 N ATOM 910 CA PRO A 114 -4.594 -2.426 3.681 1.00 15.43 C ATOM 911 C PRO A 114 -3.623 -1.443 3.021 1.00 17.50 C ATOM 912 O PRO A 114 -2.596 -1.858 2.480 1.00 16.60 O ATOM 913 CB PRO A 114 -4.038 -2.884 5.028 1.00 17.66 C ATOM 914 CG PRO A 114 -3.343 -4.179 4.737 1.00 21.42 C ATOM 915 CD PRO A 114 -4.105 -4.828 3.624 1.00 17.40 C ATOM 916 N LEU A 115 -3.947 -0.143 3.075 1.00 14.16 N ATOM 917 CA LEU A 115 -3.117 0.887 2.445 1.00 13.33 C ATOM 918 C LEU A 115 -2.404 1.781 3.424 1.00 14.72 C ATOM 919 O LEU A 115 -1.795 2.765 3.011 1.00 13.31 O ATOM 920 CB LEU A 115 -3.901 1.718 1.415 1.00 13.48 C ATOM 921 CG LEU A 115 -4.476 0.930 0.214 1.00 16.01 C ATOM 922 CD1 LEU A 115 -5.280 1.847 -0.697 1.00 17.19 C ATOM 923 CD2 LEU A 115 -3.372 0.155 -0.576 1.00 18.10 C ATOM 924 H LEU A 115 -4.811 0.142 3.578 1.00 0.00 H ATOM 925 N GLN A 116 -2.430 1.421 4.712 1.00 14.26 N ATOM 926 CA GLN A 116 -1.708 2.195 5.725 1.00 13.92 C ATOM 927 C GLN A 116 -1.254 1.264 6.820 1.00 17.63 C ATOM 928 O GLN A 116 -1.978 0.321 7.162 1.00 18.44 O ATOM 929 CB GLN A 116 -2.633 3.230 6.395 1.00 15.73 C ATOM 930 CG GLN A 116 -2.966 4.418 5.549 1.00 16.23 C ATOM 931 CD GLN A 116 -3.881 5.389 6.261 1.00 23.82 C ATOM 932 OE1 GLN A 116 -5.021 5.654 5.815 1.00 16.99 O ATOM 933 NE2 GLN A 116 -3.414 5.901 7.413 1.00 22.78 N ATOM 934 HE22 GLN A 116 -2.460 5.652 7.744 1.00 0.00 H ATOM 935 HE21 GLN A 116 -4.007 6.546 7.973 1.00 0.00 H ATOM 936 H GLN A 116 -2.970 0.580 4.998 1.00 0.00 H ATOM 937 N THR A 117 -0.068 1.523 7.380 1.00 14.57 N ATOM 938 CA THR A 117 0.442 0.808 8.547 1.00 14.76 C ATOM 939 C THR A 117 1.248 1.828 9.371 1.00 17.63 C ATOM 940 O THR A 117 1.750 2.805 8.812 1.00 18.09 O ATOM 941 CB THR A 117 1.112 -0.540 8.281 1.00 18.61 C ATOM 942 OG1 THR A 117 1.200 -1.214 9.548 1.00 20.09 O ATOM 943 CG2 THR A 117 2.492 -0.411 7.672 1.00 16.27 C ATOM 944 HG1 THR A 117 1.630 -2.097 9.422 1.00 0.00 H ATOM 945 H THR A 117 0.521 2.272 6.963 1.00 0.00 H ATOM 946 N ASP A 118 1.369 1.574 10.685 1.00 17.05 N ATOM 947 CA ASP A 118 1.972 2.429 11.700 1.00 16.56 C ATOM 948 C ASP A 118 3.488 2.334 11.863 1.00 21.21 C ATOM 949 O ASP A 118 3.981 2.590 12.981 1.00 20.95 O ATOM 950 CB ASP A 118 1.283 2.097 13.048 1.00 18.33 C ATOM 951 CG ASP A 118 1.471 0.685 13.602 1.00 20.74 C ATOM 952 OD1 ASP A 118 2.147 -0.146 12.937 1.00 18.00 O ATOM 953 OD2 ASP A 118 0.974 0.419 14.721 1.00 29.43 O ATOM 954 H ASP A 118 0.989 0.664 11.015 1.00 0.00 H ATOM 955 N HIS A 119 4.230 1.943 10.818 1.00 18.11 N ATOM 956 CA HIS A 119 5.678 1.786 10.869 1.00 18.04 C ATOM 957 C HIS A 119 6.180 1.741 9.438 1.00 20.02 C ATOM 958 O HIS A 119 5.365 1.614 8.514 1.00 18.88 O ATOM 959 CB HIS A 119 6.131 0.538 11.681 1.00 19.69 C ATOM 960 CG HIS A 119 5.620 -0.766 11.153 1.00 23.04 C ATOM 961 ND1 HIS A 119 4.308 -1.145 11.330 1.00 25.54 N ATOM 962 CD2 HIS A 119 6.272 -1.734 10.464 1.00 25.56 C ATOM 963 CE1 HIS A 119 4.193 -2.333 10.747 1.00 25.74 C ATOM 964 NE2 HIS A 119 5.351 -2.733 10.214 1.00 25.83 N ATOM 965 H HIS A 119 3.746 1.740 9.920 1.00 0.00 H ATOM 966 N TYR A 120 7.505 1.827 9.258 1.00 15.45 N ATOM 967 CA TYR A 120 8.092 1.761 7.926 1.00 14.97 C ATOM 968 C TYR A 120 8.262 0.299 7.543 1.00 17.21 C ATOM 969 O TYR A 120 8.936 -0.479 8.248 1.00 18.53 O ATOM 970 CB TYR A 120 9.428 2.509 7.874 1.00 15.60 C ATOM 971 CG TYR A 120 9.281 3.981 8.218 1.00 14.10 C ATOM 972 CD1 TYR A 120 8.336 4.780 7.568 1.00 14.66 C ATOM 973 CD2 TYR A 120 10.136 4.588 9.128 1.00 14.96 C ATOM 974 CE1 TYR A 120 8.214 6.142 7.868 1.00 13.82 C ATOM 975 CE2 TYR A 120 10.021 5.944 9.439 1.00 15.52 C ATOM 976 CZ TYR A 120 9.084 6.722 8.780 1.00 14.85 C ATOM 977 OH TYR A 120 8.974 8.055 9.066 1.00 15.87 O ATOM 978 HH TYR A 120 9.835 8.505 8.874 1.00 0.00 H ATOM 979 H TYR A 120 8.126 1.943 10.084 1.00 0.00 H ATOM 980 N ALA A 121 7.602 -0.087 6.449 1.00 14.75 N ATOM 981 CA ALA A 121 7.637 -1.490 6.005 1.00 15.42 C ATOM 982 C ALA A 121 7.339 -1.610 4.532 1.00 17.47 C ATOM 983 O ALA A 121 6.828 -0.658 3.924 1.00 15.20 O ATOM 984 CB ALA A 121 6.590 -2.297 6.792 1.00 16.53 C ATOM 985 H ALA A 121 7.057 0.611 5.904 1.00 0.00 H ATOM 986 N ALA A 122 7.544 -2.824 3.989 1.00 16.23 N ATOM 987 CA ALA A 122 7.152 -3.159 2.619 1.00 16.18 C ATOM 988 C ALA A 122 5.669 -3.607 2.744 1.00 16.92 C ATOM 989 O ALA A 122 5.351 -4.808 2.780 1.00 17.50 O ATOM 990 CB ALA A 122 8.026 -4.293 2.095 1.00 18.55 C ATOM 991 H ALA A 122 8.001 -3.557 4.568 1.00 0.00 H ATOM 992 N LEU A 123 4.770 -2.614 2.956 1.00 14.71 N ATOM 993 CA LEU A 123 3.337 -2.862 3.169 1.00 13.65 C ATOM 994 C LEU A 123 2.707 -3.605 1.982 1.00 14.50 C ATOM 995 O LEU A 123 1.928 -4.544 2.176 1.00 13.98 O ATOM 996 CB LEU A 123 2.610 -1.524 3.456 1.00 13.16 C ATOM 997 CG LEU A 123 1.073 -1.538 3.504 1.00 15.99 C ATOM 998 CD1 LEU A 123 0.525 -2.436 4.655 1.00 14.95 C ATOM 999 CD2 LEU A 123 0.554 -0.118 3.602 1.00 16.09 C ATOM 1000 H LEU A 123 5.110 -1.631 2.968 1.00 0.00 H ATOM 1001 N LEU A 124 3.052 -3.183 0.766 1.00 12.94 N ATOM 1002 CA LEU A 124 2.526 -3.852 -0.419 1.00 12.62 C ATOM 1003 C LEU A 124 3.252 -5.179 -0.569 1.00 15.68 C ATOM 1004 O LEU A 124 4.475 -5.203 -0.745 1.00 15.40 O ATOM 1005 CB LEU A 124 2.720 -2.985 -1.667 1.00 11.93 C ATOM 1006 CG LEU A 124 1.878 -3.463 -2.863 1.00 13.42 C ATOM 1007 CD1 LEU A 124 0.391 -3.072 -2.699 1.00 12.82 C ATOM 1008 CD2 LEU A 124 2.434 -2.917 -4.181 1.00 11.68 C ATOM 1009 H LEU A 124 3.698 -2.375 0.661 1.00 0.00 H ATOM 1010 N GLY A 125 2.491 -6.264 -0.453 1.00 12.71 N ATOM 1011 CA GLY A 125 3.057 -7.610 -0.526 1.00 13.50 C ATOM 1012 C GLY A 125 3.261 -8.262 0.843 1.00 17.68 C ATOM 1013 O GLY A 125 3.739 -9.397 0.918 1.00 17.50 O ATOM 1014 H GLY A 125 1.467 -6.152 -0.307 1.00 0.00 H ATOM 1015 N SER A 126 2.865 -7.573 1.942 1.00 15.02 N ATOM 1016 CA SER A 126 3.008 -8.084 3.316 1.00 15.11 C ATOM 1017 C SER A 126 1.831 -8.977 3.711 1.00 20.14 C ATOM 1018 O SER A 126 1.739 -9.406 4.872 1.00 22.18 O ATOM 1019 CB SER A 126 3.125 -6.927 4.309 1.00 16.19 C ATOM 1020 OG SER A 126 1.920 -6.171 4.383 1.00 18.11 O ATOM 1021 HG SER A 126 1.712 -5.796 3.491 1.00 0.00 H ATOM 1022 H SER A 126 2.438 -6.634 1.807 1.00 0.00 H ATOM 1023 N ASN A 127 0.947 -9.296 2.746 1.00 17.21 N ATOM 1024 CA ASN A 127 -0.259 -10.078 3.045 1.00 17.76 C ATOM 1025 C ASN A 127 -0.686 -10.840 1.805 1.00 20.19 C ATOM 1026 O ASN A 127 0.002 -10.770 0.770 1.00 19.45 O ATOM 1027 CB ASN A 127 -1.374 -9.117 3.541 1.00 17.90 C ATOM 1028 CG ASN A 127 -1.555 -7.944 2.600 1.00 19.97 C ATOM 1029 OD1 ASN A 127 -1.872 -8.120 1.405 1.00 17.26 O ATOM 1030 ND2 ASN A 127 -1.295 -6.739 3.108 1.00 19.09 N ATOM 1031 HD22 ASN A 127 -1.035 -6.642 4.110 1.00 0.00 H ATOM 1032 HD21 ASN A 127 -1.352 -5.896 2.502 1.00 0.00 H ATOM 1033 H ASN A 127 1.122 -8.982 1.770 1.00 0.00 H ATOM 1034 N SER A 128 -1.807 -11.586 1.889 1.00 18.71 N ATOM 1035 CA SER A 128 -2.290 -12.379 0.758 1.00 18.10 C ATOM 1036 C SER A 128 -3.116 -11.587 -0.259 1.00 19.43 C ATOM 1037 O SER A 128 -3.645 -12.186 -1.207 1.00 18.52 O ATOM 1038 CB SER A 128 -3.095 -13.573 1.264 1.00 23.20 C ATOM 1039 OG SER A 128 -4.208 -13.100 2.006 1.00 34.25 O ATOM 1040 HG SER A 128 -3.887 -12.564 2.774 1.00 0.00 H ATOM 1041 H SER A 128 -2.342 -11.598 2.781 1.00 0.00 H ATOM 1042 N GLU A 129 -3.223 -10.259 -0.069 1.00 16.00 N ATOM 1043 CA GLU A 129 -4.034 -9.404 -0.933 1.00 15.53 C ATOM 1044 C GLU A 129 -3.215 -8.440 -1.784 1.00 17.66 C ATOM 1045 O GLU A 129 -3.777 -7.522 -2.408 1.00 15.23 O ATOM 1046 CB GLU A 129 -5.003 -8.591 -0.044 1.00 16.66 C ATOM 1047 CG GLU A 129 -5.963 -9.457 0.784 1.00 20.83 C ATOM 1048 CD GLU A 129 -6.916 -10.356 0.011 1.00 25.50 C ATOM 1049 OE1 GLU A 129 -7.283 -9.989 -1.125 1.00 21.31 O ATOM 1050 OE2 GLU A 129 -7.355 -11.394 0.563 1.00 27.92 O ATOM 1051 H GLU A 129 -2.709 -9.824 0.723 1.00 0.00 H ATOM 1052 N SER A 130 -1.878 -8.589 -1.768 1.00 14.17 N ATOM 1053 CA SER A 130 -1.028 -7.659 -2.499 1.00 12.91 C ATOM 1054 C SER A 130 0.275 -8.337 -2.918 1.00 14.98 C ATOM 1055 O SER A 130 0.682 -9.353 -2.326 1.00 15.62 O ATOM 1056 CB SER A 130 -0.761 -6.429 -1.632 1.00 14.34 C ATOM 1057 OG SER A 130 -0.258 -6.795 -0.351 1.00 16.32 O ATOM 1058 HG SER A 130 -0.920 -7.368 0.111 1.00 0.00 H ATOM 1059 H SER A 130 -1.450 -9.371 -1.232 1.00 0.00 H ATOM 1060 N TRP A 131 0.868 -7.809 -4.006 1.00 12.79 N ATOM 1061 CA TRP A 131 2.084 -8.351 -4.602 1.00 12.64 C ATOM 1062 C TRP A 131 2.940 -7.164 -4.972 1.00 15.31 C ATOM 1063 O TRP A 131 2.452 -6.245 -5.638 1.00 13.22 O ATOM 1064 CB TRP A 131 1.747 -9.128 -5.891 1.00 12.09 C ATOM 1065 CG TRP A 131 0.891 -10.347 -5.698 1.00 14.55 C ATOM 1066 CD1 TRP A 131 1.296 -11.650 -5.772 1.00 18.03 C ATOM 1067 CD2 TRP A 131 -0.529 -10.380 -5.482 1.00 14.45 C ATOM 1068 NE1 TRP A 131 0.229 -12.493 -5.553 1.00 18.13 N ATOM 1069 CE2 TRP A 131 -0.905 -11.738 -5.372 1.00 18.04 C ATOM 1070 CE3 TRP A 131 -1.528 -9.392 -5.394 1.00 15.02 C ATOM 1071 CZ2 TRP A 131 -2.222 -12.129 -5.121 1.00 17.43 C ATOM 1072 CZ3 TRP A 131 -2.830 -9.782 -5.108 1.00 15.86 C ATOM 1073 CH2 TRP A 131 -3.170 -11.135 -5.000 1.00 17.16 C ATOM 1074 HE1 TRP A 131 0.274 -13.532 -5.529 1.00 0.00 H ATOM 1075 H TRP A 131 0.436 -6.971 -4.444 1.00 0.00 H ATOM 1076 N GLY A 132 4.188 -7.180 -4.523 1.00 13.85 N ATOM 1077 CA GLY A 132 5.065 -6.036 -4.752 1.00 14.48 C ATOM 1078 C GLY A 132 6.523 -6.340 -5.005 1.00 16.68 C ATOM 1079 O GLY A 132 7.045 -7.344 -4.521 1.00 16.78 O ATOM 1080 H GLY A 132 4.543 -8.010 -4.006 1.00 0.00 H ATOM 1081 N TRP A 133 7.171 -5.453 -5.749 1.00 13.05 N ATOM 1082 CA TRP A 133 8.609 -5.511 -5.979 1.00 14.34 C ATOM 1083 C TRP A 133 9.213 -4.336 -5.214 1.00 16.01 C ATOM 1084 O TRP A 133 8.838 -3.176 -5.431 1.00 13.32 O ATOM 1085 CB TRP A 133 8.931 -5.383 -7.477 1.00 13.62 C ATOM 1086 CG TRP A 133 10.363 -5.543 -7.873 1.00 14.46 C ATOM 1087 CD1 TRP A 133 11.336 -6.266 -7.231 1.00 17.84 C ATOM 1088 CD2 TRP A 133 10.971 -4.995 -9.039 1.00 13.73 C ATOM 1089 NE1 TRP A 133 12.509 -6.221 -7.951 1.00 17.65 N ATOM 1090 CE2 TRP A 133 12.315 -5.436 -9.059 1.00 18.67 C ATOM 1091 CE3 TRP A 133 10.495 -4.206 -10.102 1.00 14.78 C ATOM 1092 CZ2 TRP A 133 13.194 -5.090 -10.086 1.00 19.04 C ATOM 1093 CZ3 TRP A 133 11.368 -3.875 -11.131 1.00 16.42 C ATOM 1094 CH2 TRP A 133 12.692 -4.329 -11.123 1.00 17.80 C ATOM 1095 HE1 TRP A 133 13.395 -6.702 -7.697 1.00 0.00 H ATOM 1096 H TRP A 133 6.629 -4.682 -6.188 1.00 0.00 H ATOM 1097 N ASP A 134 10.149 -4.654 -4.314 1.00 14.16 N ATOM 1098 CA ASP A 134 10.881 -3.622 -3.584 1.00 14.76 C ATOM 1099 C ASP A 134 11.909 -3.080 -4.577 1.00 18.08 C ATOM 1100 O ASP A 134 12.876 -3.772 -4.915 1.00 17.35 O ATOM 1101 CB ASP A 134 11.578 -4.270 -2.397 1.00 17.94 C ATOM 1102 CG ASP A 134 12.310 -3.294 -1.495 1.00 20.63 C ATOM 1103 OD1 ASP A 134 12.912 -2.331 -2.023 1.00 18.04 O ATOM 1104 OD2 ASP A 134 12.327 -3.531 -0.266 1.00 22.16 O ATOM 1105 H ASP A 134 10.360 -5.656 -4.130 1.00 0.00 H ATOM 1106 N ILE A 135 11.714 -1.856 -5.047 1.00 14.24 N ATOM 1107 CA ILE A 135 12.596 -1.296 -6.088 1.00 15.13 C ATOM 1108 C ILE A 135 13.935 -0.802 -5.540 1.00 21.09 C ATOM 1109 O ILE A 135 14.809 -0.401 -6.313 1.00 21.66 O ATOM 1110 CB ILE A 135 11.849 -0.227 -6.931 1.00 17.67 C ATOM 1111 CG1 ILE A 135 11.396 0.977 -6.082 1.00 17.69 C ATOM 1112 CG2 ILE A 135 10.674 -0.903 -7.674 1.00 16.39 C ATOM 1113 CD1 ILE A 135 10.793 2.140 -6.891 1.00 16.75 C ATOM 1114 H ILE A 135 10.929 -1.283 -4.677 1.00 0.00 H ATOM 1115 N GLY A 136 14.094 -0.835 -4.221 1.00 18.17 N ATOM 1116 CA GLY A 136 15.356 -0.462 -3.588 1.00 18.61 C ATOM 1117 C GLY A 136 16.247 -1.664 -3.348 1.00 25.01 C ATOM 1118 O GLY A 136 17.456 -1.611 -3.622 1.00 27.61 O ATOM 1119 H GLY A 136 13.298 -1.135 -3.623 1.00 0.00 H ATOM 1120 N ARG A 137 15.645 -2.772 -2.875 1.00 19.42 N ATOM 1121 CA ARG A 137 16.349 -4.019 -2.503 1.00 20.32 C ATOM 1122 C ARG A 137 16.320 -5.109 -3.594 1.00 23.67 C ATOM 1123 O ARG A 137 17.101 -6.076 -3.529 1.00 24.61 O ATOM 1124 CB ARG A 137 15.703 -4.614 -1.249 1.00 20.80 C ATOM 1125 CG ARG A 137 15.803 -3.716 -0.037 1.00 26.39 C ATOM 1126 CD ARG A 137 15.139 -4.331 1.176 1.00 29.56 C ATOM 1127 NE ARG A 137 15.305 -3.452 2.337 1.00 36.54 N ATOM 1128 CZ ARG A 137 14.544 -2.389 2.582 1.00 45.70 C ATOM 1129 NH1 ARG A 137 14.776 -1.631 3.646 1.00 38.82 N ATOM 1130 NH2 ARG A 137 13.552 -2.066 1.755 1.00 21.44 N ATOM 1131 HE ARG A 137 16.065 -3.673 3.011 1.00 0.00 H ATOM 1132 HH12 ARG A 137 14.178 -0.801 3.833 1.00 0.00 H ATOM 1133 HH11 ARG A 137 15.556 -1.867 4.293 1.00 0.00 H ATOM 1134 HH22 ARG A 137 12.961 -1.234 1.952 1.00 0.00 H ATOM 1135 HH21 ARG A 137 13.368 -2.646 0.912 1.00 0.00 H ATOM 1136 H ARG A 137 14.611 -2.749 -2.763 1.00 0.00 H ATOM 1137 N GLY A 138 15.371 -4.991 -4.522 1.00 20.29 N ATOM 1138 CA GLY A 138 15.181 -5.966 -5.597 1.00 20.59 C ATOM 1139 C GLY A 138 14.445 -7.227 -5.187 1.00 26.65 C ATOM 1140 O GLY A 138 14.407 -8.191 -5.951 1.00 30.22 O ATOM 1141 H GLY A 138 14.736 -4.168 -4.481 1.00 0.00 H ATOM 1142 N LYS A 139 13.790 -7.213 -4.018 1.00 19.83 N ATOM 1143 CA LYS A 139 13.064 -8.368 -3.479 1.00 18.73 C ATOM 1144 C LYS A 139 11.568 -8.406 -3.825 1.00 19.51 C ATOM 1145 O LYS A 139 10.961 -7.348 -3.917 1.00 17.16 O ATOM 1146 CB LYS A 139 13.233 -8.423 -1.955 1.00 21.54 C ATOM 1147 CG LYS A 139 14.669 -8.751 -1.510 1.00 25.81 C ATOM 1148 CD LYS A 139 14.758 -8.820 -0.002 1.00 40.60 C ATOM 1149 CE LYS A 139 16.063 -9.429 0.449 1.00 64.77 C ATOM 1150 NZ LYS A 139 16.010 -9.811 1.884 1.00 80.81 N ATOM 1151 HZ1 LYS A 139 15.821 -8.966 2.460 1.00 0.00 H ATOM 1152 HZ2 LYS A 139 15.251 -10.507 2.028 1.00 0.00 H ATOM 1153 HZ3 LYS A 139 16.921 -10.227 2.165 1.00 0.00 H ATOM 1154 H LYS A 139 13.797 -6.334 -3.462 1.00 0.00 H ATOM 1155 N LEU A 140 10.966 -9.618 -3.943 1.00 17.21 N ATOM 1156 CA LEU A 140 9.524 -9.739 -4.226 1.00 16.32 C ATOM 1157 C LEU A 140 8.771 -10.084 -2.959 1.00 19.58 C ATOM 1158 O LEU A 140 9.167 -10.993 -2.218 1.00 18.43 O ATOM 1159 CB LEU A 140 9.232 -10.845 -5.265 1.00 16.15 C ATOM 1160 CG LEU A 140 9.863 -10.674 -6.640 1.00 18.14 C ATOM 1161 CD1 LEU A 140 9.613 -11.921 -7.491 1.00 18.29 C ATOM 1162 CD2 LEU A 140 9.326 -9.401 -7.368 1.00 16.63 C ATOM 1163 H LEU A 140 11.536 -10.481 -3.831 1.00 0.00 H ATOM 1164 N TYR A 141 7.652 -9.391 -2.742 1.00 15.14 N ATOM 1165 CA TYR A 141 6.824 -9.609 -1.571 1.00 15.56 C ATOM 1166 C TYR A 141 5.430 -10.048 -1.934 1.00 16.89 C ATOM 1167 O TYR A 141 4.721 -9.348 -2.649 1.00 15.48 O ATOM 1168 CB TYR A 141 6.734 -8.328 -0.710 1.00 16.58 C ATOM 1169 CG TYR A 141 8.072 -7.726 -0.342 1.00 21.20 C ATOM 1170 CD1 TYR A 141 8.947 -8.387 0.510 1.00 26.86 C ATOM 1171 CD2 TYR A 141 8.463 -6.496 -0.849 1.00 24.07 C ATOM 1172 CE1 TYR A 141 10.170 -7.815 0.877 1.00 29.72 C ATOM 1173 CE2 TYR A 141 9.672 -5.915 -0.483 1.00 27.87 C ATOM 1174 CZ TYR A 141 10.561 -6.615 0.313 1.00 32.75 C ATOM 1175 OH TYR A 141 11.761 -6.035 0.666 1.00 36.63 O ATOM 1176 HH TYR A 141 12.278 -5.826 -0.152 1.00 0.00 H ATOM 1177 H TYR A 141 7.364 -8.671 -3.435 1.00 0.00 H ATOM 1178 N HIS A 142 5.019 -11.193 -1.395 1.00 16.28 N ATOM 1179 CA HIS A 142 3.644 -11.692 -1.435 1.00 15.23 C ATOM 1180 C HIS A 142 3.528 -12.520 -0.178 1.00 20.35 C ATOM 1181 O HIS A 142 4.349 -13.432 0.017 1.00 20.73 O ATOM 1182 CB HIS A 142 3.271 -12.518 -2.678 1.00 15.25 C ATOM 1183 CG HIS A 142 1.851 -13.021 -2.598 1.00 17.92 C ATOM 1184 ND1 HIS A 142 0.775 -12.142 -2.472 1.00 18.53 N ATOM 1185 CD2 HIS A 142 1.378 -14.291 -2.535 1.00 21.47 C ATOM 1186 CE1 HIS A 142 -0.310 -12.903 -2.341 1.00 19.49 C ATOM 1187 NE2 HIS A 142 -0.002 -14.202 -2.398 1.00 21.09 N ATOM 1188 H HIS A 142 5.729 -11.777 -0.909 1.00 0.00 H ATOM 1189 N GLN A 143 2.576 -12.169 0.722 1.00 18.93 N ATOM 1190 CA GLN A 143 2.433 -12.833 2.037 1.00 20.73 C ATOM 1191 C GLN A 143 3.815 -12.885 2.753 1.00 25.36 C ATOM 1192 O GLN A 143 4.166 -13.924 3.344 1.00 26.15 O ATOM 1193 CB GLN A 143 1.879 -14.270 1.887 1.00 23.56 C ATOM 1194 CG GLN A 143 0.533 -14.375 1.206 1.00 31.25 C ATOM 1195 CD GLN A 143 0.048 -15.801 1.084 1.00 47.36 C ATOM 1196 OE1 GLN A 143 0.319 -16.493 0.103 1.00 45.72 O ATOM 1197 NE2 GLN A 143 -0.680 -16.272 2.078 1.00 43.40 N ATOM 1198 HE22 GLN A 143 -0.896 -15.668 2.896 1.00 0.00 H ATOM 1199 HE21 GLN A 143 -1.038 -17.248 2.043 1.00 0.00 H ATOM 1200 H GLN A 143 1.919 -11.401 0.478 1.00 0.00 H ATOM 1201 N SER A 144 4.599 -11.784 2.679 1.00 21.85 N ATOM 1202 CA SER A 144 5.954 -11.739 3.238 1.00 22.56 C ATOM 1203 C SER A 144 6.215 -10.568 4.164 1.00 28.22 C ATOM 1204 O SER A 144 5.834 -9.436 3.843 1.00 26.54 O ATOM 1205 CB SER A 144 6.990 -11.742 2.113 1.00 25.24 C ATOM 1206 OG SER A 144 8.327 -11.732 2.597 1.00 25.70 O ATOM 1207 HG SER A 144 8.481 -12.536 3.154 1.00 0.00 H ATOM 1208 H SER A 144 4.225 -10.936 2.207 1.00 0.00 H ATOM 1209 N LYS A 145 6.918 -10.826 5.273 1.00 27.67 N ATOM 1210 CA LYS A 145 7.303 -9.785 6.230 1.00 28.41 C ATOM 1211 C LYS A 145 8.754 -9.350 5.934 1.00 34.25 C ATOM 1212 O LYS A 145 9.332 -8.532 6.668 1.00 34.43 O ATOM 1213 CB LYS A 145 7.170 -10.299 7.680 1.00 31.41 C ATOM 1214 H LYS A 145 7.203 -11.808 5.464 1.00 0.00 H ATOM 1215 N GLY A 146 9.343 -9.948 4.894 1.00 30.33 N ATOM 1216 CA GLY A 146 10.717 -9.664 4.493 1.00 30.73 C ATOM 1217 C GLY A 146 11.622 -10.882 4.453 1.00 36.29 C ATOM 1218 O GLY A 146 12.225 -11.138 3.402 1.00 33.72 O ATOM 1219 H GLY A 146 8.799 -10.646 4.347 1.00 0.00 H ATOM 1220 N PRO A 147 11.773 -11.647 5.576 1.00 35.05 N ATOM 1221 CA PRO A 147 12.683 -12.806 5.554 1.00 34.98 C ATOM 1222 C PRO A 147 12.270 -13.858 4.543 1.00 35.06 C ATOM 1223 O PRO A 147 11.124 -14.317 4.543 1.00 34.50 O ATOM 1224 CB PRO A 147 12.633 -13.350 6.990 1.00 39.18 C ATOM 1225 CG PRO A 147 11.415 -12.777 7.588 1.00 44.51 C ATOM 1226 CD PRO A 147 11.167 -11.472 6.913 1.00 38.50 C ATOM 1227 N GLY A 148 13.191 -14.176 3.647 1.00 29.22 N ATOM 1228 CA GLY A 148 12.961 -15.177 2.617 1.00 29.19 C ATOM 1229 C GLY A 148 12.416 -14.637 1.315 1.00 31.89 C ATOM 1230 O GLY A 148 12.188 -15.407 0.381 1.00 33.12 O ATOM 1231 H GLY A 148 14.111 -13.693 3.681 1.00 0.00 H ATOM 1232 N ALA A 149 12.187 -13.318 1.232 1.00 24.96 N ATOM 1233 CA ALA A 149 11.670 -12.761 -0.021 1.00 23.33 C ATOM 1234 C ALA A 149 12.698 -12.990 -1.154 1.00 25.76 C ATOM 1235 O ALA A 149 13.875 -12.654 -0.978 1.00 26.23 O ATOM 1236 CB ALA A 149 11.380 -11.280 0.144 1.00 22.65 C ATOM 1237 H ALA A 149 12.374 -12.699 2.046 1.00 0.00 H ATOM 1238 N PRO A 150 12.287 -13.575 -2.299 1.00 25.26 N ATOM 1239 CA PRO A 150 13.262 -13.825 -3.375 1.00 26.32 C ATOM 1240 C PRO A 150 13.691 -12.586 -4.148 1.00 26.94 C ATOM 1241 O PRO A 150 12.936 -11.612 -4.261 1.00 23.54 O ATOM 1242 CB PRO A 150 12.538 -14.817 -4.284 1.00 28.65 C ATOM 1243 CG PRO A 150 11.090 -14.528 -4.079 1.00 32.14 C ATOM 1244 CD PRO A 150 10.941 -14.072 -2.656 1.00 26.63 C ATOM 1245 N GLN A 151 14.876 -12.664 -4.764 1.00 23.83 N ATOM 1246 CA GLN A 151 15.404 -11.586 -5.593 1.00 23.60 C ATOM 1247 C GLN A 151 14.741 -11.647 -6.977 1.00 26.37 C ATOM 1248 O GLN A 151 14.465 -12.740 -7.478 1.00 26.32 O ATOM 1249 CB GLN A 151 16.932 -11.732 -5.716 1.00 27.51 C ATOM 1250 CG GLN A 151 17.680 -10.662 -6.543 1.00 42.25 C ATOM 1251 CD GLN A 151 17.491 -9.206 -6.140 1.00 57.80 C ATOM 1252 OE1 GLN A 151 17.289 -8.337 -7.003 1.00 49.72 O ATOM 1253 NE2 GLN A 151 17.609 -8.888 -4.840 1.00 40.25 N ATOM 1254 HE22 GLN A 151 17.778 -9.634 -4.135 1.00 0.00 H ATOM 1255 HE21 GLN A 151 17.531 -7.896 -4.538 1.00 0.00 H ATOM 1256 H GLN A 151 15.443 -13.528 -4.647 1.00 0.00 H ATOM 1257 N TYR A 152 14.530 -10.479 -7.598 1.00 20.90 N ATOM 1258 CA TYR A 152 13.988 -10.385 -8.962 1.00 20.04 C ATOM 1259 C TYR A 152 14.704 -9.258 -9.703 1.00 24.36 C ATOM 1260 O TYR A 152 14.885 -8.191 -9.116 1.00 22.98 O ATOM 1261 CB TYR A 152 12.474 -10.149 -8.934 1.00 19.16 C ATOM 1262 CG TYR A 152 11.835 -9.839 -10.274 1.00 17.79 C ATOM 1263 CD1 TYR A 152 11.343 -10.858 -11.087 1.00 19.30 C ATOM 1264 CD2 TYR A 152 11.685 -8.523 -10.709 1.00 17.09 C ATOM 1265 CE1 TYR A 152 10.749 -10.577 -12.321 1.00 16.99 C ATOM 1266 CE2 TYR A 152 11.115 -8.228 -11.947 1.00 16.67 C ATOM 1267 CZ TYR A 152 10.619 -9.259 -12.736 1.00 17.01 C ATOM 1268 OH TYR A 152 9.965 -8.934 -13.902 1.00 16.49 O ATOM 1269 HH TYR A 152 9.670 -9.763 -14.356 1.00 0.00 H ATOM 1270 H TYR A 152 14.760 -9.599 -7.093 1.00 0.00 H ATOM 1271 N PRO A 153 15.051 -9.443 -11.000 1.00 24.02 N ATOM 1272 CA PRO A 153 15.752 -8.379 -11.748 1.00 29.27 C ATOM 1273 C PRO A 153 14.967 -7.089 -11.923 1.00100.76 C ATOM 1274 O PRO A 153 15.561 -6.038 -12.159 1.00 80.54 O ATOM 1275 CB PRO A 153 16.033 -9.036 -13.104 1.00 30.71 C ATOM 1276 CG PRO A 153 14.987 -10.091 -13.235 1.00 33.88 C ATOM 1277 CD PRO A 153 14.892 -10.645 -11.839 1.00 28.54 C TER 1278 PRO A 153 ATOM 1279 N GLU A 162 19.787 -2.098 -10.709 1.00 30.53 N ATOM 1280 CA GLU A 162 19.324 -0.799 -10.214 1.00 30.27 C ATOM 1281 C GLU A 162 18.061 -0.372 -10.971 1.00 29.99 C ATOM 1282 O GLU A 162 18.017 -0.440 -12.204 1.00 29.44 O ATOM 1283 CB GLU A 162 20.401 0.269 -10.364 1.00 33.41 C ATOM 1284 HN3 GLU A 162 20.003 -2.024 -11.724 1.00 0.00 H ATOM 1285 HN2 GLU A 162 19.042 -2.809 -10.563 1.00 0.00 H ATOM 1286 HN1 GLU A 162 20.643 -2.380 -10.191 1.00 0.00 H ATOM 1287 N VAL A 163 17.022 0.024 -10.231 1.00 21.19 N ATOM 1288 CA VAL A 163 15.774 0.402 -10.878 1.00 16.98 C ATOM 1289 C VAL A 163 15.827 1.917 -11.111 1.00 18.27 C ATOM 1290 O VAL A 163 15.926 2.687 -10.134 1.00 16.64 O ATOM 1291 CB VAL A 163 14.537 -0.029 -10.037 1.00 18.76 C ATOM 1292 CG1 VAL A 163 13.245 0.413 -10.715 1.00 17.26 C ATOM 1293 CG2 VAL A 163 14.522 -1.536 -9.787 1.00 18.89 C ATOM 1294 H VAL A 163 17.104 0.062 -9.195 1.00 0.00 H ATOM 1295 N PRO A 164 15.717 2.376 -12.387 1.00 16.82 N ATOM 1296 CA PRO A 164 15.804 3.811 -12.655 1.00 16.27 C ATOM 1297 C PRO A 164 14.504 4.493 -12.259 1.00 18.72 C ATOM 1298 O PRO A 164 13.577 3.810 -11.768 1.00 16.45 O ATOM 1299 CB PRO A 164 16.101 3.875 -14.164 1.00 19.14 C ATOM 1300 CG PRO A 164 15.449 2.675 -14.704 1.00 21.91 C ATOM 1301 CD PRO A 164 15.598 1.607 -13.646 1.00 17.62 C ATOM 1302 N GLU A 165 14.429 5.816 -12.494 1.00 16.99 N ATOM 1303 CA GLU A 165 13.237 6.594 -12.131 1.00 15.12 C ATOM 1304 C GLU A 165 11.951 5.971 -12.669 1.00 17.50 C ATOM 1305 O GLU A 165 10.957 5.915 -11.941 1.00 15.67 O ATOM 1306 CB GLU A 165 13.400 8.061 -12.567 1.00 17.24 C ATOM 1307 CG GLU A 165 12.209 8.941 -12.233 1.00 19.00 C ATOM 1308 CD GLU A 165 12.491 10.434 -12.165 1.00 31.40 C ATOM 1309 OE1 GLU A 165 13.673 10.831 -12.139 1.00 35.65 O ATOM 1310 OE2 GLU A 165 11.519 11.204 -12.020 1.00 35.01 O ATOM 1311 H GLU A 165 15.233 6.299 -12.943 1.00 0.00 H ATOM 1312 N ARG A 166 11.973 5.511 -13.927 1.00 14.76 N ATOM 1313 CA ARG A 166 10.793 4.934 -14.552 1.00 15.20 C ATOM 1314 C ARG A 166 10.902 3.433 -14.654 1.00 18.41 C ATOM 1315 O ARG A 166 11.966 2.892 -14.995 1.00 17.76 O ATOM 1316 CB ARG A 166 10.591 5.516 -15.956 1.00 18.48 C ATOM 1317 CG ARG A 166 10.291 7.004 -15.944 1.00 22.22 C ATOM 1318 CD ARG A 166 10.077 7.624 -17.322 1.00 38.02 C ATOM 1319 NE ARG A 166 11.230 7.460 -18.214 1.00 54.53 N ATOM 1320 CZ ARG A 166 12.337 8.200 -18.180 1.00 71.94 C ATOM 1321 NH1 ARG A 166 13.321 7.970 -19.040 1.00 52.47 N ATOM 1322 NH2 ARG A 166 12.473 9.168 -17.278 1.00 62.21 N ATOM 1323 HE ARG A 166 11.179 6.707 -18.929 1.00 0.00 H ATOM 1324 HH12 ARG A 166 14.184 8.550 -19.010 1.00 0.00 H ATOM 1325 HH11 ARG A 166 13.229 7.210 -19.744 1.00 0.00 H ATOM 1326 HH22 ARG A 166 13.340 9.742 -17.258 1.00 0.00 H ATOM 1327 HH21 ARG A 166 11.712 9.351 -16.593 1.00 0.00 H ATOM 1328 H ARG A 166 12.857 5.568 -14.471 1.00 0.00 H ATOM 1329 N LEU A 167 9.773 2.753 -14.398 1.00 12.93 N ATOM 1330 CA LEU A 167 9.719 1.308 -14.641 1.00 13.14 C ATOM 1331 C LEU A 167 8.341 0.975 -15.169 1.00 15.20 C ATOM 1332 O LEU A 167 7.367 1.695 -14.888 1.00 14.88 O ATOM 1333 CB LEU A 167 10.082 0.467 -13.396 1.00 13.71 C ATOM 1334 CG LEU A 167 9.091 0.511 -12.210 1.00 16.06 C ATOM 1335 CD1 LEU A 167 9.209 -0.760 -11.365 1.00 16.94 C ATOM 1336 CD2 LEU A 167 9.360 1.712 -11.304 1.00 15.45 C ATOM 1337 H LEU A 167 8.938 3.250 -14.028 1.00 0.00 H ATOM 1338 N LEU A 168 8.249 -0.106 -15.932 1.00 12.17 N ATOM 1339 CA LEU A 168 6.964 -0.562 -16.459 1.00 11.83 C ATOM 1340 C LEU A 168 6.445 -1.737 -15.632 1.00 13.33 C ATOM 1341 O LEU A 168 7.205 -2.662 -15.284 1.00 13.58 O ATOM 1342 CB LEU A 168 7.148 -0.978 -17.930 1.00 13.58 C ATOM 1343 CG LEU A 168 5.891 -1.377 -18.686 1.00 18.96 C ATOM 1344 CD1 LEU A 168 5.027 -0.133 -19.021 1.00 19.74 C ATOM 1345 CD2 LEU A 168 6.248 -2.200 -19.938 1.00 20.01 C ATOM 1346 H LEU A 168 9.111 -0.641 -16.161 1.00 0.00 H ATOM 1347 N VAL A 169 5.149 -1.694 -15.310 1.00 10.39 N ATOM 1348 CA VAL A 169 4.456 -2.737 -14.558 1.00 9.28 C ATOM 1349 C VAL A 169 3.547 -3.434 -15.555 1.00 13.29 C ATOM 1350 O VAL A 169 2.792 -2.759 -16.256 1.00 11.99 O ATOM 1351 CB VAL A 169 3.668 -2.145 -13.356 1.00 12.28 C ATOM 1352 CG1 VAL A 169 3.104 -3.270 -12.498 1.00 12.14 C ATOM 1353 CG2 VAL A 169 4.599 -1.257 -12.509 1.00 12.73 C ATOM 1354 H VAL A 169 4.599 -0.865 -15.614 1.00 0.00 H ATOM 1355 N VAL A 170 3.692 -4.779 -15.684 1.00 11.36 N ATOM 1356 CA VAL A 170 2.993 -5.543 -16.715 1.00 10.18 C ATOM 1357 C VAL A 170 2.139 -6.628 -16.072 1.00 13.26 C ATOM 1358 O VAL A 170 2.690 -7.589 -15.535 1.00 13.33 O ATOM 1359 CB VAL A 170 3.999 -6.150 -17.736 1.00 12.97 C ATOM 1360 CG1 VAL A 170 3.247 -6.882 -18.855 1.00 13.79 C ATOM 1361 CG2 VAL A 170 4.941 -5.079 -18.316 1.00 13.06 C ATOM 1362 H VAL A 170 4.322 -5.282 -15.027 1.00 0.00 H ATOM 1363 N LEU A 171 0.806 -6.456 -16.130 1.00 10.59 N ATOM 1364 CA LEU A 171 -0.152 -7.382 -15.539 1.00 10.76 C ATOM 1365 C LEU A 171 -0.862 -8.133 -16.643 1.00 13.56 C ATOM 1366 O LEU A 171 -1.641 -7.553 -17.394 1.00 12.85 O ATOM 1367 CB LEU A 171 -1.177 -6.613 -14.675 1.00 10.67 C ATOM 1368 CG LEU A 171 -2.147 -7.492 -13.908 1.00 14.26 C ATOM 1369 CD1 LEU A 171 -1.424 -8.289 -12.767 1.00 13.89 C ATOM 1370 CD2 LEU A 171 -3.311 -6.666 -13.388 1.00 14.69 C ATOM 1371 H LEU A 171 0.439 -5.617 -16.623 1.00 0.00 H ATOM 1372 N ASP A 172 -0.554 -9.420 -16.756 1.00 11.78 N ATOM 1373 CA ASP A 172 -1.131 -10.286 -17.778 1.00 11.73 C ATOM 1374 C ASP A 172 -2.253 -11.101 -17.109 1.00 14.56 C ATOM 1375 O ASP A 172 -1.966 -12.100 -16.449 1.00 15.08 O ATOM 1376 CB ASP A 172 -0.037 -11.202 -18.352 1.00 12.94 C ATOM 1377 CG ASP A 172 -0.527 -12.228 -19.361 1.00 14.81 C ATOM 1378 OD1 ASP A 172 -1.769 -12.384 -19.501 1.00 16.25 O ATOM 1379 OD2 ASP A 172 0.331 -12.903 -19.979 1.00 15.55 O ATOM 1380 H ASP A 172 0.129 -9.828 -16.086 1.00 0.00 H ATOM 1381 N MET A 173 -3.516 -10.658 -17.244 1.00 14.22 N ATOM 1382 CA MET A 173 -4.624 -11.368 -16.604 1.00 13.06 C ATOM 1383 C MET A 173 -5.190 -12.494 -17.459 1.00 18.08 C ATOM 1384 O MET A 173 -6.109 -13.197 -17.015 1.00 19.94 O ATOM 1385 CB MET A 173 -5.715 -10.396 -16.124 1.00 14.49 C ATOM 1386 CG MET A 173 -5.236 -9.491 -14.960 1.00 14.89 C ATOM 1387 SD MET A 173 -4.579 -10.387 -13.528 1.00 17.46 S ATOM 1388 CE MET A 173 -6.115 -10.989 -12.761 1.00 15.82 C ATOM 1389 H MET A 173 -3.706 -9.805 -17.807 1.00 0.00 H ATOM 1390 N GLU A 174 -4.597 -12.730 -18.647 1.00 16.01 N ATOM 1391 CA GLU A 174 -4.979 -13.902 -19.433 1.00 16.85 C ATOM 1392 C GLU A 174 -4.201 -15.103 -18.879 1.00 19.98 C ATOM 1393 O GLU A 174 -4.781 -16.165 -18.667 1.00 21.40 O ATOM 1394 CB GLU A 174 -4.686 -13.672 -20.917 1.00 17.73 C ATOM 1395 CG GLU A 174 -5.603 -12.625 -21.525 1.00 20.99 C ATOM 1396 CD GLU A 174 -7.078 -12.975 -21.413 1.00 36.37 C ATOM 1397 OE1 GLU A 174 -7.494 -14.000 -21.997 1.00 34.74 O ATOM 1398 OE2 GLU A 174 -7.801 -12.277 -20.670 1.00 23.75 O ATOM 1399 H GLU A 174 -3.869 -12.079 -19.004 1.00 0.00 H ATOM 1400 N GLU A 175 -2.892 -14.926 -18.589 1.00 15.88 N ATOM 1401 CA GLU A 175 -2.075 -16.002 -17.985 1.00 15.83 C ATOM 1402 C GLU A 175 -2.084 -15.930 -16.449 1.00 17.98 C ATOM 1403 O GLU A 175 -1.820 -16.941 -15.798 1.00 17.49 O ATOM 1404 CB GLU A 175 -0.624 -15.935 -18.479 1.00 16.70 C ATOM 1405 CG GLU A 175 -0.487 -16.168 -19.980 1.00 17.15 C ATOM 1406 CD GLU A 175 -0.807 -17.582 -20.403 1.00 25.34 C ATOM 1407 OE1 GLU A 175 -0.134 -18.511 -19.906 1.00 24.01 O ATOM 1408 OE2 GLU A 175 -1.773 -17.764 -21.175 1.00 24.83 O ATOM 1409 H GLU A 175 -2.447 -14.009 -18.796 1.00 0.00 H ATOM 1410 N GLY A 176 -2.349 -14.738 -15.895 1.00 14.71 N ATOM 1411 CA GLY A 176 -2.357 -14.508 -14.456 1.00 14.93 C ATOM 1412 C GLY A 176 -0.968 -14.254 -13.895 1.00 16.03 C ATOM 1413 O GLY A 176 -0.577 -14.887 -12.911 1.00 15.97 O ATOM 1414 H GLY A 176 -2.559 -13.937 -16.524 1.00 0.00 H ATOM 1415 N THR A 177 -0.201 -13.329 -14.523 1.00 12.51 N ATOM 1416 CA THR A 177 1.134 -13.008 -14.029 1.00 11.97 C ATOM 1417 C THR A 177 1.315 -11.507 -13.861 1.00 14.65 C ATOM 1418 O THR A 177 0.620 -10.715 -14.503 1.00 13.04 O ATOM 1419 CB THR A 177 2.232 -13.530 -14.985 1.00 15.18 C ATOM 1420 OG1 THR A 177 2.130 -12.826 -16.239 1.00 13.90 O ATOM 1421 CG2 THR A 177 2.145 -15.059 -15.240 1.00 15.69 C ATOM 1422 HG1 THR A 177 2.254 -11.856 -16.083 1.00 0.00 H ATOM 1423 H THR A 177 -0.568 -12.843 -15.366 1.00 0.00 H ATOM 1424 N LEU A 178 2.291 -11.129 -13.018 1.00 12.39 N ATOM 1425 CA LEU A 178 2.716 -9.742 -12.855 1.00 11.56 C ATOM 1426 C LEU A 178 4.227 -9.757 -13.090 1.00 14.98 C ATOM 1427 O LEU A 178 4.935 -10.567 -12.498 1.00 14.46 O ATOM 1428 CB LEU A 178 2.406 -9.242 -11.430 1.00 11.36 C ATOM 1429 CG LEU A 178 2.972 -7.874 -11.069 1.00 13.64 C ATOM 1430 CD1 LEU A 178 2.399 -6.784 -12.008 1.00 13.69 C ATOM 1431 CD2 LEU A 178 2.668 -7.537 -9.612 1.00 13.56 C ATOM 1432 H LEU A 178 2.767 -11.861 -12.454 1.00 0.00 H ATOM 1433 N GLY A 179 4.696 -8.861 -13.934 1.00 12.30 N ATOM 1434 CA GLY A 179 6.112 -8.719 -14.222 1.00 12.19 C ATOM 1435 C GLY A 179 6.450 -7.264 -14.457 1.00 15.39 C ATOM 1436 O GLY A 179 5.564 -6.397 -14.399 1.00 13.08 O ATOM 1437 H GLY A 179 4.024 -8.229 -14.414 1.00 0.00 H ATOM 1438 N TYR A 180 7.724 -6.989 -14.744 1.00 12.20 N ATOM 1439 CA TYR A 180 8.159 -5.610 -14.902 1.00 12.18 C ATOM 1440 C TYR A 180 9.118 -5.479 -16.050 1.00 14.85 C ATOM 1441 O TYR A 180 9.726 -6.475 -16.486 1.00 16.02 O ATOM 1442 CB TYR A 180 8.862 -5.108 -13.596 1.00 13.54 C ATOM 1443 CG TYR A 180 8.034 -5.304 -12.338 1.00 12.73 C ATOM 1444 CD1 TYR A 180 8.041 -6.527 -11.654 1.00 14.34 C ATOM 1445 CD2 TYR A 180 7.231 -4.281 -11.841 1.00 12.25 C ATOM 1446 CE1 TYR A 180 7.243 -6.731 -10.524 1.00 14.36 C ATOM 1447 CE2 TYR A 180 6.432 -4.474 -10.705 1.00 11.00 C ATOM 1448 CZ TYR A 180 6.463 -5.690 -10.034 1.00 13.71 C ATOM 1449 OH TYR A 180 5.728 -5.860 -8.880 1.00 12.63 O ATOM 1450 HH TYR A 180 6.025 -5.204 -8.201 1.00 0.00 H ATOM 1451 H TYR A 180 8.409 -7.764 -14.855 1.00 0.00 H ATOM 1452 N ALA A 181 9.265 -4.248 -16.546 1.00 12.38 N ATOM 1453 CA ALA A 181 10.263 -3.946 -17.557 1.00 13.48 C ATOM 1454 C ALA A 181 11.049 -2.716 -17.152 1.00 18.12 C ATOM 1455 O ALA A 181 10.503 -1.797 -16.536 1.00 16.97 O ATOM 1456 CB ALA A 181 9.628 -3.757 -18.934 1.00 14.27 C ATOM 1457 H ALA A 181 8.649 -3.485 -16.199 1.00 0.00 H ATOM 1458 N ILE A 182 12.351 -2.708 -17.465 1.00 18.33 N ATOM 1459 CA ILE A 182 13.187 -1.541 -17.203 1.00 19.08 C ATOM 1460 C ILE A 182 13.944 -1.275 -18.486 1.00 24.04 C ATOM 1461 O ILE A 182 14.494 -2.218 -19.080 1.00 21.69 O ATOM 1462 CB ILE A 182 14.149 -1.775 -16.009 1.00 23.17 C ATOM 1463 CG1 ILE A 182 13.410 -1.703 -14.665 1.00 23.09 C ATOM 1464 CG2 ILE A 182 15.346 -0.803 -16.049 1.00 26.68 C ATOM 1465 CD1 ILE A 182 14.221 -2.254 -13.507 1.00 34.70 C ATOM 1466 H ILE A 182 12.775 -3.550 -17.904 1.00 0.00 H ATOM 1467 N GLY A 183 13.937 -0.007 -18.912 1.00 23.27 N ATOM 1468 CA GLY A 183 14.673 0.434 -20.095 1.00 25.09 C ATOM 1469 C GLY A 183 14.270 -0.313 -21.350 1.00 31.10 C ATOM 1470 O GLY A 183 15.124 -0.613 -22.184 1.00 34.15 O ATOM 1471 H GLY A 183 13.385 0.695 -18.379 1.00 0.00 H ATOM 1472 N GLY A 184 12.977 -0.624 -21.454 1.00 28.26 N ATOM 1473 CA GLY A 184 12.377 -1.326 -22.582 1.00 28.70 C ATOM 1474 C GLY A 184 12.478 -2.840 -22.576 1.00 31.38 C ATOM 1475 O GLY A 184 11.957 -3.473 -23.502 1.00 33.58 O ATOM 1476 H GLY A 184 12.350 -0.345 -20.672 1.00 0.00 H ATOM 1477 N THR A 185 13.149 -3.437 -21.553 1.00 23.37 N ATOM 1478 CA THR A 185 13.344 -4.897 -21.466 1.00 21.93 C ATOM 1479 C THR A 185 12.450 -5.533 -20.399 1.00 21.48 C ATOM 1480 O THR A 185 12.597 -5.224 -19.215 1.00 19.23 O ATOM 1481 CB THR A 185 14.820 -5.239 -21.200 1.00 28.03 C ATOM 1482 OG1 THR A 185 15.613 -4.669 -22.235 1.00 29.72 O ATOM 1483 CG2 THR A 185 15.081 -6.760 -21.105 1.00 26.00 C ATOM 1484 HG1 THR A 185 16.566 -4.883 -22.074 1.00 0.00 H ATOM 1485 H THR A 185 13.542 -2.837 -20.799 1.00 0.00 H ATOM 1486 N TYR A 186 11.609 -6.485 -20.816 1.00 19.11 N ATOM 1487 CA TYR A 186 10.762 -7.231 -19.897 1.00 17.05 C ATOM 1488 C TYR A 186 11.657 -8.174 -19.133 1.00 19.22 C ATOM 1489 O TYR A 186 12.520 -8.836 -19.737 1.00 19.45 O ATOM 1490 CB TYR A 186 9.668 -7.997 -20.657 1.00 16.66 C ATOM 1491 CG TYR A 186 8.703 -8.757 -19.771 1.00 15.09 C ATOM 1492 CD1 TYR A 186 7.794 -8.080 -18.957 1.00 16.01 C ATOM 1493 CD2 TYR A 186 8.613 -10.154 -19.833 1.00 14.89 C ATOM 1494 CE1 TYR A 186 6.889 -8.768 -18.149 1.00 15.91 C ATOM 1495 CE2 TYR A 186 7.704 -10.858 -19.035 1.00 14.25 C ATOM 1496 CZ TYR A 186 6.826 -10.153 -18.212 1.00 16.20 C ATOM 1497 OH TYR A 186 5.880 -10.805 -17.460 1.00 14.68 O ATOM 1498 HH TYR A 186 5.276 -11.312 -18.059 1.00 0.00 H ATOM 1499 H TYR A 186 11.558 -6.700 -21.832 1.00 0.00 H ATOM 1500 N LEU A 187 11.485 -8.210 -17.801 1.00 16.27 N ATOM 1501 CA LEU A 187 12.349 -8.984 -16.904 1.00 16.12 C ATOM 1502 C LEU A 187 11.761 -10.328 -16.468 1.00 17.62 C ATOM 1503 O LEU A 187 12.285 -10.960 -15.551 1.00 16.95 O ATOM 1504 CB LEU A 187 12.725 -8.112 -15.689 1.00 15.96 C ATOM 1505 CG LEU A 187 13.367 -6.752 -16.030 1.00 19.27 C ATOM 1506 CD1 LEU A 187 13.422 -5.831 -14.780 1.00 20.32 C ATOM 1507 CD2 LEU A 187 14.749 -6.931 -16.648 1.00 23.19 C ATOM 1508 H LEU A 187 10.703 -7.664 -17.387 1.00 0.00 H ATOM 1509 N GLY A 188 10.686 -10.754 -17.132 1.00 14.89 N ATOM 1510 CA GLY A 188 10.061 -12.030 -16.830 1.00 13.99 C ATOM 1511 C GLY A 188 8.944 -11.939 -15.813 1.00 15.72 C ATOM 1512 O GLY A 188 8.800 -10.914 -15.148 1.00 15.53 O ATOM 1513 H GLY A 188 10.285 -10.158 -17.884 1.00 0.00 H ATOM 1514 N PRO A 189 8.123 -12.993 -15.664 1.00 13.84 N ATOM 1515 CA PRO A 189 7.064 -12.932 -14.634 1.00 14.45 C ATOM 1516 C PRO A 189 7.712 -12.949 -13.245 1.00 17.85 C ATOM 1517 O PRO A 189 8.616 -13.754 -12.948 1.00 18.05 O ATOM 1518 CB PRO A 189 6.251 -14.222 -14.863 1.00 17.23 C ATOM 1519 CG PRO A 189 7.160 -15.148 -15.607 1.00 22.01 C ATOM 1520 CD PRO A 189 8.111 -14.280 -16.406 1.00 16.93 C ATOM 1521 N ALA A 190 7.230 -12.064 -12.385 1.00 14.31 N ATOM 1522 CA ALA A 190 7.650 -11.987 -10.987 1.00 14.91 C ATOM 1523 C ALA A 190 6.699 -12.827 -10.116 1.00 17.75 C ATOM 1524 O ALA A 190 7.147 -13.526 -9.195 1.00 17.67 O ATOM 1525 CB ALA A 190 7.661 -10.539 -10.526 1.00 14.39 C ATOM 1526 H ALA A 190 6.515 -11.388 -12.722 1.00 0.00 H ATOM 1527 N PHE A 191 5.387 -12.765 -10.417 1.00 13.72 N ATOM 1528 CA PHE A 191 4.370 -13.520 -9.691 1.00 14.76 C ATOM 1529 C PHE A 191 3.477 -14.215 -10.695 1.00 17.82 C ATOM 1530 O PHE A 191 3.226 -13.681 -11.777 1.00 14.67 O ATOM 1531 CB PHE A 191 3.504 -12.583 -8.819 1.00 14.64 C ATOM 1532 CG PHE A 191 4.297 -11.695 -7.880 1.00 14.45 C ATOM 1533 CD1 PHE A 191 4.717 -12.164 -6.638 1.00 17.00 C ATOM 1534 CD2 PHE A 191 4.635 -10.393 -8.242 1.00 14.66 C ATOM 1535 CE1 PHE A 191 5.419 -11.324 -5.753 1.00 16.70 C ATOM 1536 CE2 PHE A 191 5.365 -9.567 -7.371 1.00 15.95 C ATOM 1537 CZ PHE A 191 5.749 -10.041 -6.130 1.00 15.81 C ATOM 1538 H PHE A 191 5.086 -12.152 -11.201 1.00 0.00 H ATOM 1539 N ARG A 192 2.979 -15.391 -10.312 1.00 16.26 N ATOM 1540 CA ARG A 192 2.072 -16.212 -11.106 1.00 17.70 C ATOM 1541 C ARG A 192 0.819 -16.531 -10.271 1.00 20.31 C ATOM 1542 O ARG A 192 0.764 -16.234 -9.080 1.00 20.93 O ATOM 1543 CB ARG A 192 2.728 -17.601 -11.336 1.00 22.24 C ATOM 1544 CG ARG A 192 3.890 -17.721 -12.272 1.00 36.92 C ATOM 1545 CD ARG A 192 4.153 -19.227 -12.479 1.00 43.90 C ATOM 1546 NE ARG A 192 2.920 -19.997 -12.750 1.00 44.80 N ATOM 1547 CZ ARG A 192 2.859 -21.106 -13.490 1.00 57.97 C ATOM 1548 NH1 ARG A 192 3.958 -21.608 -14.040 1.00 44.06 N ATOM 1549 NH2 ARG A 192 1.696 -21.717 -13.689 1.00 37.69 N ATOM 1550 HE ARG A 192 2.034 -19.648 -12.333 1.00 0.00 H ATOM 1551 HH12 ARG A 192 3.903 -22.473 -14.615 1.00 0.00 H ATOM 1552 HH11 ARG A 192 4.874 -21.137 -13.895 1.00 0.00 H ATOM 1553 HH22 ARG A 192 1.655 -22.581 -14.267 1.00 0.00 H ATOM 1554 HH21 ARG A 192 0.827 -21.331 -13.267 1.00 0.00 H ATOM 1555 H ARG A 192 3.258 -15.750 -9.377 1.00 0.00 H ATOM 1556 N GLY A 193 -0.124 -17.227 -10.897 1.00 18.98 N ATOM 1557 CA GLY A 193 -1.320 -17.702 -10.212 1.00 20.19 C ATOM 1558 C GLY A 193 -2.314 -16.631 -9.858 1.00 22.17 C ATOM 1559 O GLY A 193 -3.082 -16.806 -8.912 1.00 22.15 O ATOM 1560 H GLY A 193 -0.005 -17.440 -11.908 1.00 0.00 H ATOM 1561 N LEU A 194 -2.341 -15.526 -10.640 1.00 17.73 N ATOM 1562 CA LEU A 194 -3.236 -14.388 -10.374 1.00 16.18 C ATOM 1563 C LEU A 194 -4.627 -14.507 -10.989 1.00 20.92 C ATOM 1564 O LEU A 194 -5.471 -13.680 -10.670 1.00 21.02 O ATOM 1565 CB LEU A 194 -2.559 -13.073 -10.825 1.00 14.70 C ATOM 1566 CG LEU A 194 -1.178 -12.808 -10.206 1.00 16.82 C ATOM 1567 CD1 LEU A 194 -0.584 -11.525 -10.724 1.00 18.00 C ATOM 1568 CD2 LEU A 194 -1.249 -12.762 -8.701 1.00 19.21 C ATOM 1569 H LEU A 194 -1.704 -15.479 -11.461 1.00 0.00 H ATOM 1570 N LYS A 195 -4.887 -15.512 -11.855 1.00 18.87 N ATOM 1571 CA LYS A 195 -6.220 -15.624 -12.474 1.00 18.87 C ATOM 1572 C LYS A 195 -7.300 -15.780 -11.429 1.00 22.69 C ATOM 1573 O LYS A 195 -7.081 -16.455 -10.417 1.00 22.42 O ATOM 1574 CB LYS A 195 -6.309 -16.793 -13.480 1.00 20.72 C ATOM 1575 CG LYS A 195 -5.520 -16.502 -14.754 1.00 23.51 C ATOM 1576 CD LYS A 195 -5.528 -17.671 -15.758 1.00 22.26 C ATOM 1577 CE LYS A 195 -6.848 -17.901 -16.473 1.00 38.41 C ATOM 1578 NZ LYS A 195 -7.201 -16.794 -17.402 1.00 48.44 N ATOM 1579 HZ1 LYS A 195 -7.279 -15.906 -16.867 1.00 0.00 H ATOM 1580 HZ2 LYS A 195 -6.459 -16.700 -18.125 1.00 0.00 H ATOM 1581 HZ3 LYS A 195 -8.110 -17.005 -17.861 1.00 0.00 H ATOM 1582 H LYS A 195 -4.147 -16.206 -12.084 1.00 0.00 H ATOM 1583 N GLY A 196 -8.449 -15.162 -11.686 1.00 20.21 N ATOM 1584 CA GLY A 196 -9.601 -15.258 -10.795 1.00 21.45 C ATOM 1585 C GLY A 196 -9.670 -14.159 -9.760 1.00 25.56 C ATOM 1586 O GLY A 196 -10.495 -14.217 -8.848 1.00 28.89 O ATOM 1587 H GLY A 196 -8.530 -14.591 -12.551 1.00 0.00 H ATOM 1588 N ARG A 197 -8.768 -13.174 -9.876 1.00 18.64 N ATOM 1589 CA ARG A 197 -8.737 -12.040 -8.957 1.00 17.72 C ATOM 1590 C ARG A 197 -8.974 -10.756 -9.761 1.00 20.97 C ATOM 1591 O ARG A 197 -8.864 -10.777 -10.995 1.00 19.14 O ATOM 1592 CB ARG A 197 -7.384 -11.973 -8.216 1.00 21.13 C ATOM 1593 CG ARG A 197 -7.140 -13.155 -7.270 1.00 32.17 C ATOM 1594 CD ARG A 197 -5.860 -12.951 -6.492 1.00 36.85 C ATOM 1595 NE ARG A 197 -5.566 -14.039 -5.552 1.00 43.99 N ATOM 1596 CZ ARG A 197 -4.841 -15.110 -5.858 1.00 57.76 C ATOM 1597 NH1 ARG A 197 -4.366 -15.269 -7.084 1.00 37.98 N ATOM 1598 NH2 ARG A 197 -4.601 -16.038 -4.944 1.00 54.22 N ATOM 1599 HE ARG A 197 -5.948 -13.968 -4.587 1.00 0.00 H ATOM 1600 HH12 ARG A 197 -3.799 -16.109 -7.317 1.00 0.00 H ATOM 1601 HH11 ARG A 197 -4.560 -14.554 -7.814 1.00 0.00 H ATOM 1602 HH22 ARG A 197 -4.033 -16.874 -5.189 1.00 0.00 H ATOM 1603 HH21 ARG A 197 -4.980 -15.931 -3.982 1.00 0.00 H ATOM 1604 H ARG A 197 -8.069 -13.219 -10.644 1.00 0.00 H ATOM 1605 N THR A 198 -9.315 -9.648 -9.054 1.00 16.14 N ATOM 1606 CA THR A 198 -9.500 -8.330 -9.665 1.00 14.52 C ATOM 1607 C THR A 198 -8.388 -7.503 -9.024 1.00 15.80 C ATOM 1608 O THR A 198 -8.372 -7.320 -7.793 1.00 15.62 O ATOM 1609 CB THR A 198 -10.906 -7.764 -9.446 1.00 20.53 C ATOM 1610 OG1 THR A 198 -11.825 -8.625 -10.117 1.00 18.37 O ATOM 1611 CG2 THR A 198 -11.023 -6.329 -9.995 1.00 20.01 C ATOM 1612 HG1 THR A 198 -11.756 -9.538 -9.739 1.00 0.00 H ATOM 1613 H THR A 198 -9.452 -9.740 -8.027 1.00 0.00 H ATOM 1614 N LEU A 199 -7.415 -7.062 -9.852 1.00 12.41 N ATOM 1615 CA LEU A 199 -6.207 -6.430 -9.339 1.00 12.74 C ATOM 1616 C LEU A 199 -6.048 -5.006 -9.779 1.00 14.07 C ATOM 1617 O LEU A 199 -6.295 -4.695 -10.926 1.00 14.09 O ATOM 1618 CB LEU A 199 -4.961 -7.260 -9.728 1.00 13.09 C ATOM 1619 CG LEU A 199 -4.995 -8.731 -9.176 1.00 17.07 C ATOM 1620 CD1 LEU A 199 -3.843 -9.572 -9.734 1.00 17.14 C ATOM 1621 CD2 LEU A 199 -4.943 -8.759 -7.638 1.00 16.73 C ATOM 1622 H LEU A 199 -7.531 -7.177 -10.879 1.00 0.00 H ATOM 1623 N TYR A 200 -5.675 -4.142 -8.835 1.00 11.40 N ATOM 1624 CA TYR A 200 -5.521 -2.723 -9.105 1.00 11.52 C ATOM 1625 C TYR A 200 -4.049 -2.345 -9.072 1.00 13.56 C ATOM 1626 O TYR A 200 -3.339 -2.840 -8.209 1.00 12.43 O ATOM 1627 CB TYR A 200 -6.198 -1.919 -7.951 1.00 11.81 C ATOM 1628 CG TYR A 200 -7.694 -2.160 -7.868 1.00 13.16 C ATOM 1629 CD1 TYR A 200 -8.205 -3.326 -7.289 1.00 15.46 C ATOM 1630 CD2 TYR A 200 -8.601 -1.212 -8.347 1.00 13.82 C ATOM 1631 CE1 TYR A 200 -9.580 -3.569 -7.250 1.00 15.18 C ATOM 1632 CE2 TYR A 200 -9.982 -1.433 -8.280 1.00 14.61 C ATOM 1633 CZ TYR A 200 -10.465 -2.611 -7.731 1.00 19.78 C ATOM 1634 OH TYR A 200 -11.833 -2.845 -7.668 1.00 21.70 O ATOM 1635 HH TYR A 200 -11.997 -3.727 -7.250 1.00 0.00 H ATOM 1636 H TYR A 200 -5.488 -4.495 -7.875 1.00 0.00 H ATOM 1637 N PRO A 201 -3.583 -1.390 -9.909 1.00 10.80 N ATOM 1638 CA PRO A 201 -2.210 -0.849 -9.733 1.00 10.43 C ATOM 1639 C PRO A 201 -2.049 -0.368 -8.299 1.00 12.87 C ATOM 1640 O PRO A 201 -2.997 0.218 -7.741 1.00 11.79 O ATOM 1641 CB PRO A 201 -2.177 0.367 -10.679 1.00 10.37 C ATOM 1642 CG PRO A 201 -3.212 -0.001 -11.785 1.00 13.23 C ATOM 1643 CD PRO A 201 -4.331 -0.690 -10.980 1.00 11.86 C ATOM 1644 N ALA A 202 -0.865 -0.559 -7.714 1.00 9.51 N ATOM 1645 CA ALA A 202 -0.668 -0.109 -6.321 1.00 9.73 C ATOM 1646 C ALA A 202 0.804 0.076 -6.052 1.00 11.74 C ATOM 1647 O ALA A 202 1.669 -0.493 -6.738 1.00 11.27 O ATOM 1648 CB ALA A 202 -1.225 -1.167 -5.340 1.00 11.02 C ATOM 1649 H ALA A 202 -0.090 -1.019 -8.233 1.00 0.00 H ATOM 1650 N VAL A 203 1.075 0.885 -5.030 1.00 10.43 N ATOM 1651 CA VAL A 203 2.410 1.111 -4.511 1.00 10.39 C ATOM 1652 C VAL A 203 2.279 1.323 -3.001 1.00 12.34 C ATOM 1653 O VAL A 203 1.180 1.655 -2.536 1.00 11.64 O ATOM 1654 CB VAL A 203 3.103 2.359 -5.113 1.00 13.90 C ATOM 1655 CG1 VAL A 203 3.356 2.269 -6.620 1.00 12.12 C ATOM 1656 CG2 VAL A 203 2.363 3.621 -4.748 1.00 15.57 C ATOM 1657 H VAL A 203 0.283 1.384 -4.577 1.00 0.00 H ATOM 1658 N SER A 204 3.355 1.078 -2.250 1.00 10.57 N ATOM 1659 CA SER A 204 3.408 1.518 -0.848 1.00 8.68 C ATOM 1660 C SER A 204 4.674 2.355 -0.716 1.00 12.28 C ATOM 1661 O SER A 204 5.722 2.017 -1.277 1.00 11.15 O ATOM 1662 CB SER A 204 3.324 0.384 0.188 1.00 10.45 C ATOM 1663 OG SER A 204 4.387 -0.553 0.079 1.00 12.64 O ATOM 1664 HG SER A 204 5.251 -0.088 0.213 1.00 0.00 H ATOM 1665 H SER A 204 4.164 0.571 -2.661 1.00 0.00 H ATOM 1666 N ALA A 205 4.545 3.497 -0.017 1.00 10.30 N ATOM 1667 CA ALA A 205 5.597 4.507 0.106 1.00 11.37 C ATOM 1668 C ALA A 205 5.785 4.966 1.543 1.00 12.95 C ATOM 1669 O ALA A 205 4.840 4.950 2.337 1.00 12.76 O ATOM 1670 CB ALA A 205 5.197 5.723 -0.756 1.00 12.04 C ATOM 1671 H ALA A 205 3.641 3.673 0.466 1.00 0.00 H ATOM 1672 N VAL A 206 6.990 5.453 1.854 1.00 10.53 N ATOM 1673 CA VAL A 206 7.323 5.941 3.197 1.00 10.65 C ATOM 1674 C VAL A 206 7.931 7.337 3.209 1.00 12.61 C ATOM 1675 O VAL A 206 8.175 7.880 4.284 1.00 12.37 O ATOM 1676 CB VAL A 206 8.300 4.968 3.918 1.00 13.96 C ATOM 1677 CG1 VAL A 206 7.690 3.575 4.107 1.00 14.56 C ATOM 1678 CG2 VAL A 206 9.657 4.881 3.187 1.00 14.48 C ATOM 1679 H VAL A 206 7.721 5.487 1.115 1.00 0.00 H ATOM 1680 N TRP A 207 8.225 7.907 2.019 1.00 12.81 N ATOM 1681 CA TRP A 207 8.984 9.147 1.943 1.00 11.95 C ATOM 1682 C TRP A 207 8.130 10.406 1.972 1.00 12.77 C ATOM 1683 O TRP A 207 7.212 10.551 1.139 1.00 12.77 O ATOM 1684 CB TRP A 207 9.858 9.090 0.661 1.00 11.61 C ATOM 1685 CG TRP A 207 10.795 10.244 0.510 1.00 12.61 C ATOM 1686 CD1 TRP A 207 10.546 11.427 -0.130 1.00 15.02 C ATOM 1687 CD2 TRP A 207 12.111 10.363 1.079 1.00 12.87 C ATOM 1688 NE1 TRP A 207 11.643 12.243 -0.060 1.00 14.77 N ATOM 1689 CE2 TRP A 207 12.635 11.607 0.661 1.00 15.93 C ATOM 1690 CE3 TRP A 207 12.919 9.513 1.871 1.00 14.39 C ATOM 1691 CZ2 TRP A 207 13.916 12.038 1.023 1.00 15.72 C ATOM 1692 CZ3 TRP A 207 14.183 9.947 2.248 1.00 16.37 C ATOM 1693 CH2 TRP A 207 14.674 11.200 1.823 1.00 16.47 C ATOM 1694 HE1 TRP A 207 11.718 13.190 -0.482 1.00 0.00 H ATOM 1695 H TRP A 207 7.903 7.451 1.141 1.00 0.00 H ATOM 1696 N GLY A 208 8.440 11.300 2.921 1.00 11.56 N ATOM 1697 CA GLY A 208 7.720 12.564 3.001 1.00 11.06 C ATOM 1698 C GLY A 208 7.846 13.352 1.710 1.00 13.63 C ATOM 1699 O GLY A 208 8.961 13.598 1.226 1.00 13.89 O ATOM 1700 H GLY A 208 9.197 11.091 3.603 1.00 0.00 H ATOM 1701 N GLN A 209 6.687 13.792 1.143 1.00 10.59 N ATOM 1702 CA GLN A 209 6.664 14.604 -0.087 1.00 11.32 C ATOM 1703 C GLN A 209 7.035 13.798 -1.356 1.00 14.03 C ATOM 1704 O GLN A 209 7.250 14.411 -2.411 1.00 13.55 O ATOM 1705 CB GLN A 209 7.560 15.867 0.001 1.00 13.45 C ATOM 1706 CG GLN A 209 7.284 16.757 1.202 1.00 40.80 C ATOM 1707 CD GLN A 209 6.286 17.815 0.861 1.00 65.72 C ATOM 1708 OE1 GLN A 209 6.621 18.912 0.408 1.00 64.80 O ATOM 1709 NE2 GLN A 209 5.038 17.495 1.039 1.00 54.99 N ATOM 1710 HE22 GLN A 209 4.790 16.561 1.423 1.00 0.00 H ATOM 1711 HE21 GLN A 209 4.288 18.173 0.797 1.00 0.00 H ATOM 1712 H GLN A 209 5.784 13.545 1.596 1.00 0.00 H ATOM 1713 N CYS A 210 7.085 12.453 -1.297 1.00 11.05 N ATOM 1714 CA CYS A 210 7.355 11.744 -2.554 1.00 10.94 C ATOM 1715 C CYS A 210 6.206 11.962 -3.528 1.00 14.37 C ATOM 1716 O CYS A 210 5.056 12.117 -3.113 1.00 12.24 O ATOM 1717 CB CYS A 210 7.655 10.258 -2.347 1.00 11.81 C ATOM 1718 SG CYS A 210 6.260 9.270 -1.731 1.00 13.30 S ATOM 1719 H CYS A 210 6.939 11.941 -0.403 1.00 0.00 H ATOM 1720 N GLN A 211 6.536 12.028 -4.820 1.00 10.60 N ATOM 1721 CA GLN A 211 5.526 12.209 -5.876 1.00 10.51 C ATOM 1722 C GLN A 211 5.669 11.025 -6.812 1.00 13.50 C ATOM 1723 O GLN A 211 6.692 10.908 -7.504 1.00 14.26 O ATOM 1724 CB GLN A 211 5.769 13.526 -6.635 1.00 12.06 C ATOM 1725 CG GLN A 211 5.659 14.737 -5.671 1.00 13.61 C ATOM 1726 CD GLN A 211 5.905 16.035 -6.387 1.00 21.06 C ATOM 1727 OE1 GLN A 211 6.749 16.119 -7.275 1.00 20.48 O ATOM 1728 NE2 GLN A 211 5.180 17.088 -6.005 1.00 20.12 N ATOM 1729 HE22 GLN A 211 4.472 16.986 -5.250 1.00 0.00 H ATOM 1730 HE21 GLN A 211 5.323 18.011 -6.463 1.00 0.00 H ATOM 1731 H GLN A 211 7.538 11.949 -5.089 1.00 0.00 H ATOM 1732 N VAL A 212 4.655 10.163 -6.851 1.00 10.82 N ATOM 1733 CA VAL A 212 4.709 8.929 -7.640 1.00 10.28 C ATOM 1734 C VAL A 212 3.709 8.995 -8.771 1.00 12.50 C ATOM 1735 O VAL A 212 2.514 9.115 -8.522 1.00 11.05 O ATOM 1736 CB VAL A 212 4.487 7.691 -6.730 1.00 11.74 C ATOM 1737 CG1 VAL A 212 4.589 6.386 -7.540 1.00 12.38 C ATOM 1738 CG2 VAL A 212 5.466 7.677 -5.530 1.00 11.86 C ATOM 1739 H VAL A 212 3.796 10.372 -6.303 1.00 0.00 H ATOM 1740 N ARG A 213 4.206 8.956 -10.003 1.00 10.98 N ATOM 1741 CA ARG A 213 3.366 9.086 -11.185 1.00 11.23 C ATOM 1742 C ARG A 213 2.958 7.729 -11.726 1.00 13.07 C ATOM 1743 O ARG A 213 3.761 6.790 -11.675 1.00 12.23 O ATOM 1744 CB ARG A 213 4.143 9.859 -12.269 1.00 13.19 C ATOM 1745 CG ARG A 213 3.447 9.945 -13.627 1.00 24.81 C ATOM 1746 CD ARG A 213 4.176 10.858 -14.598 1.00 29.84 C ATOM 1747 NE ARG A 213 4.231 12.198 -14.041 1.00 19.56 N ATOM 1748 CZ ARG A 213 3.313 13.141 -14.251 1.00 27.61 C ATOM 1749 NH1 ARG A 213 2.317 12.932 -15.112 1.00 23.27 N ATOM 1750 NH2 ARG A 213 3.416 14.317 -13.652 1.00 24.76 N ATOM 1751 HE ARG A 213 5.043 12.438 -13.437 1.00 0.00 H ATOM 1752 HH12 ARG A 213 1.604 13.672 -15.272 1.00 0.00 H ATOM 1753 HH11 ARG A 213 2.253 12.029 -15.624 1.00 0.00 H ATOM 1754 HH22 ARG A 213 2.697 15.050 -13.819 1.00 0.00 H ATOM 1755 HH21 ARG A 213 4.215 14.508 -13.015 1.00 0.00 H ATOM 1756 H ARG A 213 5.231 8.828 -10.127 1.00 0.00 H ATOM 1757 N ILE A 214 1.741 7.652 -12.323 1.00 10.11 N ATOM 1758 CA ILE A 214 1.281 6.441 -12.996 1.00 9.35 C ATOM 1759 C ILE A 214 0.821 6.850 -14.408 1.00 13.28 C ATOM 1760 O ILE A 214 0.095 7.846 -14.563 1.00 12.51 O ATOM 1761 CB ILE A 214 0.166 5.726 -12.207 1.00 10.34 C ATOM 1762 CG1 ILE A 214 -0.231 4.433 -12.952 1.00 11.66 C ATOM 1763 CG2 ILE A 214 -1.090 6.657 -11.956 1.00 11.27 C ATOM 1764 CD1 ILE A 214 -1.170 3.545 -12.121 1.00 13.26 C ATOM 1765 H ILE A 214 1.116 8.483 -12.300 1.00 0.00 H ATOM 1766 N ARG A 215 1.300 6.120 -15.428 1.00 10.55 N ATOM 1767 CA ARG A 215 0.967 6.418 -16.824 1.00 10.41 C ATOM 1768 C ARG A 215 0.454 5.118 -17.436 1.00 13.81 C ATOM 1769 O ARG A 215 1.243 4.242 -17.825 1.00 13.39 O ATOM 1770 CB ARG A 215 2.216 6.925 -17.571 1.00 12.33 C ATOM 1771 CG ARG A 215 1.978 7.275 -19.050 1.00 18.08 C ATOM 1772 CD ARG A 215 3.292 7.740 -19.721 1.00 21.97 C ATOM 1773 NE ARG A 215 3.822 8.950 -19.087 1.00 29.84 N ATOM 1774 CZ ARG A 215 3.519 10.196 -19.445 1.00 48.68 C ATOM 1775 NH1 ARG A 215 2.713 10.422 -20.479 1.00 31.94 N ATOM 1776 NH2 ARG A 215 4.030 11.228 -18.777 1.00 32.76 N ATOM 1777 HE ARG A 215 4.486 8.826 -18.296 1.00 0.00 H ATOM 1778 HH12 ARG A 215 2.480 11.398 -20.753 1.00 0.00 H ATOM 1779 HH11 ARG A 215 2.316 9.623 -21.013 1.00 0.00 H ATOM 1780 HH22 ARG A 215 3.791 12.200 -19.059 1.00 0.00 H ATOM 1781 HH21 ARG A 215 4.668 11.062 -17.973 1.00 0.00 H ATOM 1782 H ARG A 215 1.928 5.317 -15.221 1.00 0.00 H ATOM 1783 N TYR A 216 -0.866 4.966 -17.480 1.00 11.78 N ATOM 1784 CA TYR A 216 -1.464 3.759 -18.072 1.00 12.32 C ATOM 1785 C TYR A 216 -1.190 3.719 -19.569 1.00 14.71 C ATOM 1786 O TYR A 216 -1.347 4.730 -20.257 1.00 14.20 O ATOM 1787 CB TYR A 216 -2.951 3.762 -17.789 1.00 14.21 C ATOM 1788 CG TYR A 216 -3.635 2.480 -18.192 1.00 14.95 C ATOM 1789 CD1 TYR A 216 -3.501 1.322 -17.421 1.00 15.39 C ATOM 1790 CD2 TYR A 216 -4.474 2.439 -19.299 1.00 16.55 C ATOM 1791 CE1 TYR A 216 -4.147 0.139 -17.781 1.00 15.63 C ATOM 1792 CE2 TYR A 216 -5.140 1.271 -19.654 1.00 16.81 C ATOM 1793 CZ TYR A 216 -4.976 0.126 -18.892 1.00 20.07 C ATOM 1794 OH TYR A 216 -5.673 -1.001 -19.253 1.00 17.86 O ATOM 1795 HH TYR A 216 -5.459 -1.735 -18.624 1.00 0.00 H ATOM 1796 H TYR A 216 -1.483 5.708 -17.092 1.00 0.00 H ATOM 1797 N LEU A 217 -0.735 2.547 -20.065 1.00 12.84 N ATOM 1798 CA LEU A 217 -0.347 2.410 -21.474 1.00 15.22 C ATOM 1799 C LEU A 217 -1.255 1.532 -22.318 1.00 22.54 C ATOM 1800 O LEU A 217 -1.090 1.482 -23.536 1.00 23.45 O ATOM 1801 CB LEU A 217 1.110 1.911 -21.560 1.00 15.80 C ATOM 1802 CG LEU A 217 2.158 2.926 -21.075 1.00 20.79 C ATOM 1803 CD1 LEU A 217 3.523 2.298 -20.984 1.00 22.17 C ATOM 1804 CD2 LEU A 217 2.231 4.165 -21.983 1.00 23.16 C ATOM 1805 H LEU A 217 -0.658 1.724 -19.434 1.00 0.00 H ATOM 1806 N GLY A 218 -2.246 0.927 -21.696 1.00 19.00 N ATOM 1807 CA GLY A 218 -3.160 0.018 -22.379 1.00 19.22 C ATOM 1808 C GLY A 218 -3.232 -1.290 -21.617 1.00 21.60 C ATOM 1809 O GLY A 218 -2.513 -1.453 -20.624 1.00 18.16 O ATOM 1810 H GLY A 218 -2.382 1.104 -20.680 1.00 0.00 H ATOM 1811 N GLU A 219 -4.066 -2.261 -22.074 1.00 20.30 N ATOM 1812 CA GLU A 219 -4.934 -2.140 -23.253 1.00 25.68 C ATOM 1813 C GLU A 219 -6.197 -1.302 -22.999 1.00 27.33 C ATOM 1814 O GLU A 219 -6.853 -0.907 -24.000 1.00 35.09 O ATOM 1815 CB GLU A 219 -5.280 -3.546 -23.807 1.00 27.64 C ATOM 1816 CG GLU A 219 -4.090 -4.257 -24.451 1.00 38.07 C ATOM 1817 CD GLU A 219 -4.284 -5.675 -24.969 1.00 58.24 C ATOM 1818 OE1 GLU A 219 -5.363 -6.268 -24.730 1.00 59.74 O ATOM 1819 OE2 GLU A 219 -3.334 -6.205 -25.592 1.00 36.85 O ATOM 1820 OXT GLU A 219 -6.497 -0.982 -21.816 1.00 27.07 O ATOM 1821 H GLU A 219 -4.092 -3.158 -21.549 1.00 0.00 H TER 1822 GLU A 219 HETATM 1823 O HOH 1 2.591 16.719 0.982 1.00 41.74 O HETATM 1824 O HOH 2 10.718 9.250 10.537 1.00 14.51 O HETATM 1825 O HOH 3 -1.914 -15.376 -23.330 1.00 23.32 O HETATM 1826 O HOH 4 -0.638 -20.618 -18.431 1.00 29.55 O HETATM 1827 O HOH 5 -1.371 10.172 -25.729 1.00 40.59 O HETATM 1828 O HOH 6 17.155 -0.019 -7.443 1.00 32.85 O HETATM 1829 O HOH 7 5.982 7.889 -17.506 1.00 31.02 O HETATM 1830 O HOH 8 -11.379 -1.293 -0.880 1.00 27.80 O HETATM 1831 O HOH 9 -0.318 20.378 -11.244 1.00 30.33 O HETATM 1832 O HOH 10 -2.337 20.598 -3.245 1.00 30.49 O HETATM 1833 O HOH 11 -5.413 13.268 1.598 1.00 44.49 O HETATM 1834 O HOH 12 5.196 -13.167 -18.541 1.00 15.77 O HETATM 1835 O HOH 13 -1.267 17.767 1.041 1.00 45.79 O HETATM 1836 O HOH 14 -0.337 -13.304 -22.525 1.00 15.63 O HETATM 1837 O HOH 15 -1.362 0.777 -26.090 1.00 29.66 O HETATM 1838 O HOH 16 8.850 4.837 -0.212 1.00 15.64 O HETATM 1839 O HOH 17 15.325 10.240 -10.126 1.00 24.13 O HETATM 1840 O HOH 18 8.866 11.431 -11.816 1.00 20.47 O HETATM 1841 O HOH 19 11.882 -20.067 -22.721 1.00 37.56 O HETATM 1842 O HOH 20 -4.358 19.773 -15.372 1.00 13.44 O HETATM 1843 O HOH 21 9.426 1.722 11.544 1.00 24.58 O HETATM 1844 O HOH 22 2.484 -13.913 -18.669 1.00 15.61 O HETATM 1845 O HOH 23 -9.463 -12.645 -12.876 1.00 24.43 O HETATM 1846 O HOH 24 7.244 -2.269 -28.588 1.00 24.21 O HETATM 1847 O HOH 25 -12.954 3.687 -9.543 1.00 32.38 O HETATM 1848 O HOH 26 2.286 16.547 7.083 1.00 41.30 O HETATM 1849 O HOH 27 -9.737 9.788 -23.366 1.00 42.89 O HETATM 1850 O HOH 28 2.712 5.730 13.571 1.00 35.29 O HETATM 1851 O HOH 29 -12.521 8.015 -8.031 1.00 26.18 O HETATM 1852 O HOH 30 11.109 -18.095 -21.032 1.00 24.74 O HETATM 1853 O HOH 31 -5.209 17.217 -4.754 1.00 22.79 O HETATM 1854 O HOH 32 7.585 -12.953 -1.241 1.00 23.61 O HETATM 1855 O HOH 33 -2.251 6.717 -15.752 1.00 13.67 O HETATM 1856 O HOH 34 12.837 0.080 -0.799 1.00 20.65 O HETATM 1857 O HOH 35 -12.034 5.831 -13.903 1.00 25.28 O HETATM 1858 O HOH 36 -7.764 11.586 -1.277 1.00 15.66 O HETATM 1859 O HOH 37 -1.396 -5.499 -27.952 1.00 22.91 O HETATM 1860 O HOH 38 11.211 -17.934 0.440 1.00 37.02 O HETATM 1861 O HOH 39 6.527 2.694 14.326 1.00 32.18 O HETATM 1862 O HOH 40 -2.266 -2.122 8.305 1.00 24.32 O HETATM 1863 O HOH 41 -12.344 -5.768 -13.830 1.00 34.28 O HETATM 1864 O HOH 42 12.802 2.083 -17.446 1.00 22.26 O HETATM 1865 O HOH 43 -12.453 -11.179 -9.450 1.00 33.47 O HETATM 1866 O HOH 44 14.003 -16.966 -0.903 1.00 46.08 O HETATM 1867 O HOH 45 15.256 -9.761 -23.286 1.00 30.30 O HETATM 1868 O HOH 46 4.850 7.483 -15.193 1.00 18.72 O HETATM 1869 O HOH 47 -2.837 -8.869 -25.819 1.00 30.45 O HETATM 1870 O HOH 48 4.116 3.130 -25.080 1.00 37.79 O HETATM 1871 O HOH 49 -2.147 11.117 9.690 1.00 33.20 O HETATM 1872 O HOH 50 6.502 -6.814 4.221 1.00 27.11 O HETATM 1873 O HOH 51 7.840 10.200 -16.276 1.00 53.98 O HETATM 1874 O HOH 52 14.514 -21.002 -25.852 1.00 41.18 O HETATM 1875 O HOH 53 -9.327 7.905 -0.111 1.00 32.15 O HETATM 1876 O HOH 54 -9.568 -10.551 -2.513 1.00 43.06 O HETATM 1877 O HOH 55 1.100 -8.080 7.175 1.00 42.18 O HETATM 1878 O HOH 56 16.995 5.525 -4.045 1.00 44.77 O HETATM 1879 O HOH 57 3.284 -6.015 -35.519 1.00 31.93 O HETATM 1880 O HOH 58 18.987 -0.411 -14.762 1.00 42.00 O HETATM 1881 O HOH 59 7.382 12.377 -9.707 1.00 19.74 O HETATM 1882 O HOH 60 -9.481 -10.977 -22.396 1.00 46.77 O HETATM 1883 O HOH 61 10.135 2.001 -18.262 1.00 35.49 O HETATM 1884 O HOH 62 6.583 0.473 1.352 1.00 13.05 O HETATM 1885 O HOH 63 -7.272 -7.270 4.253 1.00 40.40 O HETATM 1886 O HOH 64 6.006 3.476 -31.746 1.00 43.44 O HETATM 1887 O HOH 65 1.613 -3.811 8.770 1.00 26.95 O HETATM 1888 O HOH 66 14.041 2.438 -1.602 1.00 28.13 O HETATM 1889 O HOH 67 -3.980 -15.136 -1.582 1.00 47.09 O HETATM 1890 O HOH 68 4.705 -8.875 -28.478 1.00 16.30 O HETATM 1891 O HOH 69 16.329 4.921 -0.924 1.00 40.82 O HETATM 1892 O HOH 70 -11.361 -0.379 -3.427 1.00 27.28 O HETATM 1893 O HOH 71 -9.388 2.733 0.795 1.00 26.15 O HETATM 1894 O HOH 72 -4.491 -17.833 -21.673 1.00 45.94 O HETATM 1895 O HOH 73 -9.605 12.831 -13.151 1.00 15.00 O HETATM 1896 O HOH 74 -9.758 2.001 -6.523 1.00 16.04 O HETATM 1897 O HOH 75 -6.453 10.906 1.004 1.00 17.40 O HETATM 1898 O HOH 76 -6.302 1.798 -12.392 1.00 12.83 O HETATM 1899 O HOH 77 -2.331 -19.525 -16.661 1.00 28.25 O HETATM 1900 O HOH 78 12.843 -13.177 -13.983 1.00 30.68 O HETATM 1901 O HOH 79 -11.774 -2.159 -14.792 1.00 31.01 O HETATM 1902 O HOH 80 -9.526 11.607 -9.822 1.00 19.97 O HETATM 1903 O HOH 81 -2.753 2.854 -27.145 1.00 38.96 O HETATM 1904 O HOH 82 8.313 16.758 -3.457 1.00 20.82 O HETATM 1905 O HOH 83 3.232 -10.295 -16.588 1.00 13.58 O HETATM 1906 O HOH 84 7.365 -14.853 -6.759 1.00 37.77 O HETATM 1907 O HOH 85 0.884 9.968 -16.186 1.00 17.43 O HETATM 1908 O HOH 86 -1.776 -16.338 -2.624 1.00 37.22 O HETATM 1909 O HOH 87 12.423 -13.934 -8.950 1.00 35.10 O HETATM 1910 O HOH 88 9.662 -3.156 8.521 1.00 42.07 O HETATM 1911 O HOH 89 9.287 -14.347 2.422 1.00 37.00 O HETATM 1912 O HOH 90 -0.376 6.876 -21.825 1.00 21.67 O HETATM 1913 O HOH 91 -5.517 -18.768 -10.319 1.00 31.12 O HETATM 1914 O HOH 92 8.667 14.709 -8.741 1.00 30.32 O HETATM 1915 O HOH 93 2.083 -0.389 -9.679 1.00 11.52 O HETATM 1916 O HOH 94 -8.019 -1.189 1.948 1.00 29.18 O HETATM 1917 O HOH 95 1.015 -1.015 -32.096 1.00 31.13 O HETATM 1918 O HOH 96 12.309 -3.677 6.877 1.00 42.98 O HETATM 1919 O HOH 97 -1.181 -2.017 10.804 1.00 35.81 O HETATM 1920 O HOH 98 -2.029 13.411 6.420 1.00 34.18 O HETATM 1921 O HOH 99 -7.805 8.731 1.906 1.00 20.31 O HETATM 1922 O HOH 100 6.528 -5.056 9.143 1.00 33.58 O HETATM 1923 O HOH 101 -13.720 6.333 -0.284 1.00 39.78 O HETATM 1924 O HOH 102 4.985 -2.203 -33.724 1.00 28.64 O HETATM 1925 O HOH 103 -6.549 0.752 3.681 1.00 28.53 O HETATM 1926 O HOH 104 17.084 11.207 -0.713 1.00 32.37 O HETATM 1927 O HOH 105 -0.841 -20.656 -13.017 1.00 37.63 O HETATM 1928 O HOH 106 12.749 -9.423 -22.498 1.00 23.02 O HETATM 1929 O HOH 107 -12.557 -5.393 -6.659 1.00 26.02 O HETATM 1930 O HOH 108 16.028 2.615 -5.939 1.00 29.19 O HETATM 1931 O HOH 109 2.656 -7.500 -29.702 1.00 16.85 O HETATM 1932 O HOH 110 10.411 10.374 -15.386 1.00 61.44 O HETATM 1933 O HOH 111 4.430 4.446 -28.397 1.00 42.39 O HETATM 1934 O HOH 112 -0.068 -18.007 -13.814 1.00 21.64 O HETATM 1935 O HOH 113 -0.790 -6.380 5.895 1.00 24.06 O HETATM 1936 O HOH 114 -3.716 18.765 -8.982 1.00 19.73 O HETATM 1937 O HOH 115 11.543 -0.285 9.403 1.00 38.10 O HETATM 1938 O HOH 116 -10.296 -6.759 -5.704 1.00 17.78 O HETATM 1939 O HOH 117 10.768 -0.470 -19.645 1.00 28.39 O HETATM 1940 O HOH 118 8.810 -4.948 5.438 1.00 28.92 O HETATM 1941 O HOH 119 -1.034 8.073 9.838 1.00 26.01 O HETATM 1942 O HOH 120 4.081 -16.518 -7.918 1.00 20.80 O HETATM 1943 O HOH 121 -6.053 3.513 4.210 1.00 42.31 O HETATM 1944 O HOH 122 -1.121 -4.186 1.663 1.00 15.19 O HETATM 1945 O HOH 123 4.409 13.048 11.792 1.00 23.02 O HETATM 1946 O HOH 124 12.476 13.745 -11.046 1.00 42.97 O HETATM 1947 O HOH 125 -8.921 13.396 -25.013 1.00 35.51 O HETATM 1948 O HOH 126 -6.784 12.262 -27.874 1.00 33.97 O HETATM 1949 O HOH 127 15.384 8.306 -0.969 1.00 30.09 O HETATM 1950 O HOH 128 -8.016 -14.182 -15.070 1.00 37.27 O HETATM 1951 O HOH 129 0.571 -15.311 -6.339 1.00 25.76 O HETATM 1952 O HOH 130 -1.646 -10.885 -22.922 1.00 22.39 O HETATM 1953 O HOH 131 12.178 14.857 -1.199 1.00 22.56 O HETATM 1954 O HOH 132 -6.243 7.736 -25.968 1.00 33.73 O HETATM 1955 O HOH 133 -9.913 -10.152 -6.255 1.00 27.51 O HETATM 1956 O HOH 134 1.535 3.032 -25.868 1.00 27.60 O HETATM 1957 O HOH 135 17.094 -3.396 -18.495 1.00 50.91 O HETATM 1958 O HOH 136 -11.897 9.285 -13.024 1.00 26.03 O HETATM 1959 O HOH 137 -7.887 -3.295 4.264 1.00 45.62 O HETATM 1960 O HOH 138 -12.670 -1.499 -11.426 1.00 30.58 O HETATM 1961 O HOH 139 8.254 -13.946 -26.988 1.00 15.30 O HETATM 1962 O HOH 140 -10.499 -6.543 -16.614 1.00 23.14 O HETATM 1963 O HOH 141 1.711 8.475 -22.442 1.00 32.78 O HETATM 1964 O HOH 142 -13.744 4.846 -5.838 1.00 28.77 O HETATM 1965 O HOH 143 -1.962 -6.855 -30.231 1.00 39.91 O HETATM 1966 O HOH 144 11.677 -7.205 -23.676 1.00 26.83 O HETATM 1967 O HOH 145 -4.464 -10.977 4.053 1.00 40.09 O HETATM 1968 O HOH 146 13.112 15.361 -4.084 1.00 31.31 O HETATM 1969 O HOH 147 -14.517 0.823 -13.099 1.00 43.74 O HETATM 1970 O HOH 148 8.178 -13.455 5.867 1.00 34.61 O HETATM 1971 O HOH 149 14.009 6.233 -15.974 1.00 25.07 O HETATM 1972 O HOH 150 -3.579 -18.142 -12.337 1.00 24.74 O HETATM 1973 O HOH 151 10.730 -2.088 -25.852 1.00 45.02 O HETATM 1974 O HOH 152 17.016 7.129 -13.245 1.00 27.37 O HETATM 1975 O HOH 153 -1.222 0.504 11.781 1.00 44.36 O HETATM 1976 O HOH 154 -2.457 13.191 -24.058 1.00 33.70 O HETATM 1977 O HOH 155 -9.701 -5.548 -18.940 1.00 32.02 O HETATM 1978 O HOH 156 -12.993 -1.125 -5.429 1.00 34.37 O HETATM 1979 O HOH 157 -4.278 6.188 -28.315 1.00 43.75 O HETATM 1980 O HOH 158 17.142 -13.917 -13.455 1.00 41.62 O HETATM 1981 O HOH 159 3.123 -4.329 6.555 1.00 20.68 O HETATM 1982 O HOH 160 -4.290 19.695 -11.486 1.00 41.14 O HETATM 1983 O HOH 161 0.622 15.769 -0.370 1.00 31.21 O HETATM 1984 O HOH 162 7.607 -2.073 -33.118 1.00 35.10 O HETATM 1985 O HOH 163 -13.329 -0.464 -9.040 1.00 46.20 O HETATM 1986 O HOH 164 12.017 2.991 11.630 1.00 24.41 O HETATM 1987 O HOH 165 7.989 1.697 -30.729 1.00 47.77 O HETATM 1988 O HOH 166 -9.551 5.502 0.988 1.00 37.78 O HETATM 1989 O HOH 167 -6.360 -9.183 -24.135 1.00 62.73 O HETATM 1990 O HOH 168 -2.299 -12.319 4.901 1.00 45.95 O HETATM 1991 O HOH 169 -9.019 -12.122 -4.647 1.00 43.47 O HETATM 1992 O HOH 170 10.004 -14.790 -9.691 1.00 43.73 O HETATM 1993 O HOH 171 9.198 -5.015 -23.163 1.00 43.84 O HETATM 1994 O HOH 172 -6.806 13.687 -23.338 1.00 25.75 O HETATM 1995 O HOH 173 9.453 17.201 -5.845 1.00 37.45 O HETATM 1996 O HOH 174 8.117 0.355 -28.289 1.00 30.48 O HETATM 1997 O HOH 175 2.466 18.708 2.688 1.00 36.23 O HETATM 1998 O HOH 176 -4.762 -19.447 -18.880 1.00 48.14 O HETATM 1999 O HOH 177 -5.232 0.500 6.178 1.00 36.82 O HETATM 2000 O HOH 178 11.590 -15.551 -17.876 1.00 33.98 O HETATM 2001 O HOH 179 5.325 14.196 -10.893 1.00 31.13 O HETATM 2002 O HOH 180 2.822 -3.573 -34.455 1.00 73.54 O HETATM 2003 O HOH 181 7.037 -11.624 -27.754 1.00 21.33 O HETATM 2004 O HOH 182 2.110 -18.432 -15.757 1.00 24.54 O HETATM 2005 O HOH 183 -12.271 1.263 -7.262 1.00 27.38 O HETATM 2006 O HOH 184 -13.438 3.855 -12.225 1.00 63.99 O HETATM 2007 O HOH 185 0.689 -20.834 -10.121 1.00 40.56 O HETATM 2008 O HOH 186 -1.747 -1.966 -31.122 1.00 43.58 O HETATM 2009 O HOH 187 16.214 0.250 0.448 1.00 44.33 O HETATM 2010 O HOH 188 -14.416 -7.197 -8.036 1.00 41.13 O HETATM 2011 O HOH 189 -1.192 19.675 -8.814 1.00 41.52 O HETATM 2012 O HOH 190 11.715 3.708 15.673 1.00 35.55 O HETATM 2013 O HOH 191 7.543 -5.549 -25.265 1.00 41.55 O HETATM 2014 O HOH 192 -3.312 20.903 -5.651 1.00 41.63 O HETATM 2015 O HOH 193 -4.588 14.696 -24.445 1.00 39.55 O HETATM 2016 O HOH 194 -19.120 12.747 -5.126 1.00 42.79 O HETATM 2017 O HOH 195 11.300 -5.462 4.315 1.00 46.95 O HETATM 2018 O HOH 196 -7.677 12.485 2.879 1.00 42.86 O HETATM 2019 O HOH 197 -2.248 -2.989 -28.635 1.00 37.93 O HETATM 2020 O HOH 198 15.266 0.222 6.884 1.00 42.92 O HETATM 2021 O HOH 199 1.851 19.012 -12.164 1.00 50.83 O HETATM 2022 O HOH 200 -0.803 15.507 7.633 1.00 39.24 O HETATM 2023 O HOH 201 -9.936 -8.225 -22.082 1.00 46.46 O HETATM 2024 O HOH 202 -4.766 -8.264 3.927 1.00 32.05 O HETATM 2025 O HOH 203 8.327 12.966 -14.015 1.00 48.77 O HETATM 2026 O HOH 204 13.100 -6.349 -25.843 1.00 56.75 O HETATM 2027 O HOH 205 17.291 9.447 -11.856 1.00 35.61 O HETATM 2028 O HOH 206 -2.716 -10.059 -28.213 1.00 39.93 O HETATM 2029 O HOH 207 -6.126 15.001 -0.254 1.00 25.91 O HETATM 2030 O HOH 208 -11.159 -8.267 -3.494 1.00 38.12 O HETATM 2031 O HOH 209 8.274 -15.157 0.079 1.00 34.31 O HETATM 2032 O HOH 210 2.367 -19.633 -7.786 1.00 53.72 O HETATM 2033 O HOH 211 -13.580 -2.803 -0.399 1.00 46.77 O HETATM 2034 O HOH 212 -3.211 -20.383 -14.305 1.00 28.76 O HETATM 2035 O HOH 213 -3.586 -7.661 6.312 1.00 35.10 O HETATM 2036 O HOH 214 9.051 -17.497 -1.125 1.00 47.65 O HETATM 2037 O HOH 215 5.134 16.905 -10.997 1.00 48.97 O HETATM 2038 O HOH 216 14.432 4.155 -18.046 1.00 33.14 O HETATM 2039 O HOH 217 4.605 -17.381 -15.419 1.00 29.62 O HETATM 2040 O HOH 218 -12.001 10.647 -8.756 1.00 20.61 O HETATM 2041 O HOH 219 3.175 -15.444 -5.574 1.00 33.59 O HETATM 2042 O HOH 220 -14.488 2.841 -7.467 1.00 44.35 O HETATM 2043 O HOH 221 15.718 -11.808 -27.508 1.00 37.87 O HETATM 2044 O HOH 222 -4.062 -10.638 -24.225 1.00 35.54 O HETATM 2045 O HOH 223 11.914 -17.563 -30.845 1.00 24.72 O HETATM 2046 O HOH 224 -0.837 -4.436 7.760 1.00 28.26 O HETATM 2047 O HOH 225 5.292 -5.962 6.904 1.00 28.28 O HETATM 2048 O HOH 226 16.384 7.507 -15.832 1.00 43.69 O HETATM 2049 O HOH 227 -9.232 8.718 4.230 1.00 33.49 O HETATM 2050 O HOH 228 -13.337 11.104 -11.117 1.00 40.87 O HETATM 2051 O HOH 229 16.047 3.051 -3.284 1.00 29.23 O HETATM 2052 O HOH 230 13.015 -15.335 -15.607 1.00 48.35 O HETATM 2053 O HOH 231 10.755 17.081 -1.727 1.00 26.12 O HETATM 2054 O HOH 232 -9.887 15.451 -14.035 1.00 16.38 O HETATM 2055 O HOH 233 -13.016 6.338 -10.176 1.00 31.62 O HETATM 2056 O HOH 234 11.797 0.462 -25.743 1.00 29.45 O HETATM 2057 O HOH 235 15.507 -8.962 -26.279 1.00 46.24 O HETATM 2058 O HOH 236 6.885 -14.430 -4.108 1.00 33.24 O HETATM 2059 O HOH 237 -3.043 -1.305 -26.609 1.00 38.87 O HETATM 2060 O HOH 238 9.880 -0.417 13.133 1.00 39.80 O HETATM 2061 O HOH 239 -13.371 -6.780 -2.592 1.00 50.23 O HETATM 2062 O HOH 240 -11.793 -11.908 -1.668 1.00 46.02 O HETATM 2063 O HOH 241 -5.226 -5.956 7.694 1.00 51.56 O HETATM 2064 O HOH 242 14.021 17.501 2.789 1.00 16.38 O HETATM 2065 O HOH 243 13.011 16.340 6.551 1.00 16.41 O HETATM 2066 O HOH 244 9.582 16.809 5.097 1.00 20.54 O HETATM 2067 O HOH 245 14.242 14.804 8.553 1.00 14.66 O HETATM 2068 O HOH 246 15.737 7.896 5.649 1.00 31.06 O HETATM 2069 O HOH 247 8.368 14.786 12.685 1.00 22.12 O HETATM 2070 O HOH 248 15.326 11.810 6.482 1.00 23.03 O HETATM 2071 O HOH 249 10.642 17.711 0.976 1.00 23.77 O HETATM 2072 O HOH 250 8.430 16.511 9.006 1.00 31.34 O HETATM 2073 O HOH 251 15.990 6.606 3.335 1.00 31.80 O HETATM 2074 O HOH 252 11.424 16.896 8.791 1.00 17.15 O HETATM 2075 O HOH 253 6.082 13.981 13.907 1.00 34.68 O HETATM 2076 O HOH 254 7.867 18.356 7.030 1.00 30.22 O HETATM 2077 N ILE A 255 13.609 10.111 10.051 1.00 -0.27 N HETATM 2078 CA ILE A 255 14.124 9.552 8.811 1.00 0.13 C HETATM 2079 C ILE A 255 13.005 9.559 7.758 1.00 0.20 C HETATM 2080 O ILE A 255 11.852 9.877 8.067 1.00 -0.39 O HETATM 2081 N ILE A 255 13.365 9.160 6.530 1.00 -0.26 N HETATM 2082 CA ILE A 255 12.393 9.112 5.413 1.00 0.15 C HETATM 2083 C ILE A 255 11.752 10.477 5.146 1.00 0.21 C HETATM 2084 O ILE A 255 10.631 10.546 4.618 1.00 -0.39 O HETATM 2085 N ILE A 255 12.487 11.583 5.493 1.00 -0.26 N HETATM 2086 CA ILE A 255 12.038 12.940 5.230 1.00 0.15 C HETATM 2087 C ILE A 255 10.738 13.245 5.986 1.00 0.21 C HETATM 2088 O ILE A 255 9.972 14.116 5.561 1.00 -0.39 O HETATM 2089 N ILE A 255 10.521 12.557 7.122 1.00 -0.26 N HETATM 2090 CA ILE A 255 9.320 12.747 7.948 1.00 0.15 C HETATM 2091 C ILE A 255 9.637 13.328 9.347 1.00 0.20 C HETATM 2092 O ILE A 255 8.693 13.594 10.078 1.00 -0.39 O HETATM 2093 N ILE A 255 10.931 13.431 9.687 1.00 -0.28 N HETATM 2094 CA ILE A 255 11.244 13.845 11.117 1.00 0.03 C HETATM 2095 CB ILE A 255 12.626 13.423 11.549 1.00 -0.02 C HETATM 2096 CG ILE A 255 12.878 11.921 11.470 1.00 0.04 C HETATM 2097 CD ILE A 255 13.313 11.433 10.106 1.00 0.18 C HETATM 2098 OE1 ILE A 255 13.415 12.205 9.144 1.00 -0.40 O HETATM 2099 H35 ILE A 255 11.947 11.401 11.741 1.00 0.05 H HETATM 2100 H36 ILE A 255 13.665 11.665 12.194 1.00 0.05 H HETATM 2101 H33 ILE A 255 12.774 13.742 12.591 1.00 0.03 H HETATM 2102 H34 ILE A 255 13.358 13.929 10.903 1.00 0.03 H HETATM 2103 H31 ILE A 255 10.507 13.380 11.789 1.00 0.05 H HETATM 2104 H32 ILE A 255 11.170 14.940 11.192 1.00 0.05 H HETATM 2105 H30 ILE A 255 11.659 13.243 9.028 1.00 0.19 H HETATM 2106 CB ILE A 255 8.583 11.417 8.138 1.00 0.08 C HETATM 2107 CG ILE A 255 8.114 10.830 6.832 1.00 0.18 C HETATM 2108 OD1 ILE A 255 7.536 11.536 6.003 1.00 -0.40 O HETATM 2109 ND2 ILE A 255 8.370 9.531 6.642 1.00 -0.30 N HETATM 2110 H28 ILE A 255 8.084 9.084 5.795 1.00 0.18 H HETATM 2111 H29 ILE A 255 8.848 9.007 7.347 1.00 0.18 H HETATM 2112 H26 ILE A 255 7.709 11.586 8.784 1.00 0.06 H HETATM 2113 H27 ILE A 255 9.264 10.702 8.623 1.00 0.06 H HETATM 2114 H25 ILE A 255 8.656 13.450 7.423 1.00 0.08 H HETATM 2115 H24 ILE A 255 11.205 11.889 7.416 1.00 0.19 H HETATM 2116 CB ILE A 255 11.885 13.201 3.718 1.00 0.08 C HETATM 2117 CG ILE A 255 11.927 14.673 3.337 1.00 0.18 C HETATM 2118 OD1 ILE A 255 12.592 15.511 3.976 1.00 -0.40 O HETATM 2119 ND2 ILE A 255 11.172 15.037 2.317 1.00 -0.30 N HETATM 2120 H22 ILE A 255 11.159 15.992 2.021 1.00 0.18 H HETATM 2121 H23 ILE A 255 10.614 14.358 1.841 1.00 0.18 H HETATM 2122 H20 ILE A 255 10.920 12.787 3.391 1.00 0.06 H HETATM 2123 H21 ILE A 255 12.702 12.684 3.193 1.00 0.06 H HETATM 2124 H19 ILE A 255 12.811 13.625 5.608 1.00 0.08 H HETATM 2125 H18 ILE A 255 13.368 11.450 5.946 1.00 0.19 H HETATM 2126 CB ILE A 255 11.315 8.006 5.631 1.00 0.08 C HETATM 2127 CG ILE A 255 11.876 6.646 5.322 1.00 0.18 C HETATM 2128 OD1 ILE A 255 12.598 6.476 4.330 1.00 -0.40 O HETATM 2129 ND2 ILE A 255 11.521 5.653 6.143 1.00 -0.30 N HETATM 2130 H16 ILE A 255 11.864 4.727 5.986 1.00 0.18 H HETATM 2131 H17 ILE A 255 10.912 5.836 6.915 1.00 0.18 H HETATM 2132 H14 ILE A 255 10.459 8.202 4.969 1.00 0.06 H HETATM 2133 H15 ILE A 255 10.981 8.029 6.679 1.00 0.06 H HETATM 2134 H13 ILE A 255 12.957 8.839 4.509 1.00 0.08 H HETATM 2135 H12 ILE A 255 14.313 8.888 6.364 1.00 0.19 H HETATM 2136 CB ILE A 255 14.706 8.118 8.993 1.00 -0.00 C HETATM 2137 CG1 ILE A 255 13.593 7.105 9.399 1.00 -0.05 C HETATM 2138 CD1 ILE A 255 14.023 5.594 9.271 1.00 -0.06 C HETATM 2139 H9 ILE A 255 13.186 4.948 9.575 1.00 0.02 H HETATM 2140 H10 ILE A 255 14.889 5.403 9.922 1.00 0.02 H HETATM 2141 H11 ILE A 255 14.294 5.377 8.227 1.00 0.02 H HETATM 2142 H4 ILE A 255 12.720 7.272 8.751 1.00 0.03 H HETATM 2143 H5 ILE A 255 13.315 7.298 10.446 1.00 0.03 H HETATM 2144 CG2 ILE A 255 15.906 8.126 9.985 1.00 -0.06 C HETATM 2145 H6 ILE A 255 16.656 8.857 9.648 1.00 0.02 H HETATM 2146 H7 ILE A 255 16.360 7.125 10.020 1.00 0.02 H HETATM 2147 H8 ILE A 255 15.550 8.402 10.989 1.00 0.02 H HETATM 2148 H3 ILE A 255 15.096 7.795 8.017 1.00 0.03 H HETATM 2149 H2 ILE A 255 14.939 10.201 8.457 1.00 0.08 H HETATM 2150 H1 ILE A 255 13.475 9.528 10.852 1.00 0.19 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1279 1280 1284 1285 1286 CONECT 1284 1279 CONECT 1285 1279 CONECT 1286 1279 CONECT 2077 2078 2097 2150 CONECT 2078 2077 2079 2136 2149 CONECT 2079 2078 2080 2081 CONECT 2080 2079 CONECT 2081 2079 2082 2135 CONECT 2082 2081 2083 2126 2134 CONECT 2083 2082 2084 2085 CONECT 2084 2083 CONECT 2085 2083 2086 2125 CONECT 2086 2085 2087 2116 2124 CONECT 2087 2086 2088 2089 CONECT 2088 2087 CONECT 2089 2087 2090 2115 CONECT 2090 2089 2091 2106 2114 CONECT 2091 2090 2092 2093 CONECT 2092 2091 CONECT 2093 2091 2094 2105 CONECT 2094 2093 2095 2103 2104 CONECT 2095 2094 2096 2101 2102 CONECT 2096 2095 2097 2099 2100 CONECT 2097 2077 2096 2098 CONECT 2098 2097 CONECT 2099 2096 CONECT 2100 2096 CONECT 2101 2095 CONECT 2102 2095 CONECT 2103 2094 CONECT 2104 2094 CONECT 2105 2093 CONECT 2106 2090 2107 2112 2113 CONECT 2107 2106 2108 2109 CONECT 2108 2107 CONECT 2109 2107 2110 2111 CONECT 2110 2109 CONECT 2111 2109 CONECT 2112 2106 CONECT 2113 2106 CONECT 2114 2090 CONECT 2115 2089 CONECT 2116 2086 2117 2122 2123 CONECT 2117 2116 2118 2119 CONECT 2118 2117 CONECT 2119 2117 2120 2121 CONECT 2120 2119 CONECT 2121 2119 CONECT 2122 2116 CONECT 2123 2116 CONECT 2124 2086 CONECT 2125 2085 CONECT 2126 2082 2127 2132 2133 CONECT 2127 2126 2128 2129 CONECT 2128 2127 CONECT 2129 2127 2130 2131 CONECT 2130 2129 CONECT 2131 2129 CONECT 2132 2126 CONECT 2133 2126 CONECT 2134 2082 CONECT 2135 2081 CONECT 2136 2078 2137 2144 2148 CONECT 2137 2136 2138 2142 2143 CONECT 2138 2137 2139 2140 2141 CONECT 2139 2138 CONECT 2140 2138 CONECT 2141 2138 CONECT 2142 2137 CONECT 2143 2137 CONECT 2144 2136 2145 2146 2147 CONECT 2145 2144 CONECT 2146 2144 CONECT 2147 2144 CONECT 2148 2136 CONECT 2149 2078 CONECT 2150 2077 MASTER 0 0 0 0 0 0 0 0 2148 2 82 16 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 6dn6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5xn3
RCSB PDB
PDBbind
209aa, >5XN3_1|Chain... at 93%
6dn5
RCSB PDB
PDBbind
217aa, >6DN5_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1apv
RCSB PDB
PDBbind
5-mer
1apw
RCSB PDB
PDBbind
5-mer
1b6j
RCSB PDB
PDBbind
5-mer
1bhf
RCSB PDB
PDBbind
5-mer
1cpi
RCSB PDB
PDBbind
5-mer
1f1j
RCSB PDB
PDBbind
5-mer
1f9e
RCSB PDB
PDBbind
5-mer
1fch
RCSB PDB
PDBbind
5-mer
1fiv
RCSB PDB
PDBbind
5-mer
1fyr
RCSB PDB
PDBbind
5-mer
1gny
RCSB PDB
PDBbind
5-mer
1gu3
RCSB PDB
PDBbind
5-mer
1h5v
RCSB PDB
PDBbind
5-mer
1h9l
RCSB PDB
PDBbind
5-mer
1hef
RCSB PDB
PDBbind
5-mer
1iau
RCSB PDB
PDBbind
5-mer
1jq8
RCSB PDB
PDBbind
5-mer
1jq9
RCSB PDB
PDBbind
5-mer
1k9q
RCSB PDB
PDBbind
5-mer
1m7i
RCSB PDB
PDBbind
5-mer
1mf4
RCSB PDB
PDBbind
5-mer
1mhw
RCSB PDB
PDBbind
5-mer
1nh0
RCSB PDB
PDBbind
5-mer
1ny2
RCSB PDB
PDBbind
5-mer
1o9d
RCSB PDB
PDBbind
5-mer
1p02
RCSB PDB
PDBbind
5-mer
1p03
RCSB PDB
PDBbind
5-mer
1p04
RCSB PDB
PDBbind
5-mer
1p05
RCSB PDB
PDBbind
5-mer
1p06
RCSB PDB
PDBbind
5-mer
1p10
RCSB PDB
PDBbind
5-mer
1pau
RCSB PDB
PDBbind
5-mer
1qm5
RCSB PDB
PDBbind
5-mer
1qtn
RCSB PDB
PDBbind
5-mer
1shd
RCSB PDB
PDBbind
5-mer
1t37
RCSB PDB
PDBbind
5-mer
1tmb
RCSB PDB
PDBbind
5-mer
1w9u
RCSB PDB
PDBbind
5-mer
1w9v
RCSB PDB
PDBbind
5-mer
1waw
RCSB PDB
PDBbind
5-mer
1wb0
RCSB PDB
PDBbind
5-mer
1ym4
RCSB PDB
PDBbind
5-mer
1zm6
RCSB PDB
PDBbind
5-mer
2bcd
RCSB PDB
PDBbind
5-mer
2ce9
RCSB PDB
PDBbind
5-mer
2fgu
RCSB PDB
PDBbind
5-mer
2fgv
RCSB PDB
PDBbind
5-mer
2h5d
RCSB PDB
PDBbind
5-mer
2h5i
RCSB PDB
PDBbind
5-mer
2h5j
RCSB PDB
PDBbind
5-mer
2j9a
RCSB PDB
PDBbind
5-mer
2k1q
RCSB PDB
PDBbind
5-mer
2l6j
RCSB PDB
PDBbind
5-mer
2lpr
RCSB PDB
PDBbind
5-mer
2m0u
RCSB PDB
PDBbind
5-mer
2m0v
RCSB PDB
PDBbind
5-mer
2pcu
RCSB PDB
PDBbind
5-mer
2ql5
RCSB PDB
PDBbind
5-mer
2ql7
RCSB PDB
PDBbind
5-mer
2ql9
RCSB PDB
PDBbind
5-mer
2qlb
RCSB PDB
PDBbind
5-mer
2qlf
RCSB PDB
PDBbind
5-mer
2qlj
RCSB PDB
PDBbind
5-mer
3atw
RCSB PDB
PDBbind
5-mer
3ayc
RCSB PDB
PDBbind
5-mer
3c88
RCSB PDB
PDBbind
5-mer
3c89
RCSB PDB
PDBbind
5-mer
3c8a
RCSB PDB
PDBbind
5-mer
3c8b
RCSB PDB
PDBbind
5-mer
3chf
RCSB PDB
PDBbind
5-mer
3e7a
RCSB PDB
PDBbind
5-mer
3gjq
RCSB PDB
PDBbind
5-mer
3gjs
RCSB PDB
PDBbind
5-mer
3gjt
RCSB PDB
PDBbind
5-mer
3ibc
RCSB PDB
PDBbind
5-mer
3iqg
RCSB PDB
PDBbind
5-mer
3iqh
RCSB PDB
PDBbind
5-mer
3iqi
RCSB PDB
PDBbind
5-mer
3jzh
RCSB PDB
PDBbind
5-mer
3k05
RCSB PDB
PDBbind
5-mer
3k0h
RCSB PDB
PDBbind
5-mer
3k15
RCSB PDB
PDBbind
5-mer
3lpr
RCSB PDB
PDBbind
5-mer
3mp1
RCSB PDB
PDBbind
5-mer
3nin
RCSB PDB
PDBbind
5-mer
3nzw
RCSB PDB
PDBbind
5-mer
3nzx
RCSB PDB
PDBbind
5-mer
3ov1
RCSB PDB
PDBbind
5-mer
3ove
RCSB PDB
PDBbind
5-mer
3oyp
RCSB PDB
PDBbind
5-mer
3qw5
RCSB PDB
PDBbind
5-mer
3qw6
RCSB PDB
PDBbind
5-mer
3qw7
RCSB PDB
PDBbind
5-mer
3qw8
RCSB PDB
PDBbind
5-mer
3r7b
RCSB PDB
PDBbind
5-mer
3r7n
RCSB PDB
PDBbind
5-mer
3s8l
RCSB PDB
PDBbind
5-mer
3s8n
RCSB PDB
PDBbind
5-mer
3s8o
RCSB PDB
PDBbind
5-mer
3sxu
RCSB PDB
PDBbind
5-mer
3t6b
RCSB PDB
PDBbind
5-mer
3t6j
RCSB PDB
PDBbind
5-mer
3th0
RCSB PDB
PDBbind
5-mer
3u1i
RCSB PDB
PDBbind
5-mer
3u4w
RCSB PDB
PDBbind
5-mer
3vb4
RCSB PDB
PDBbind
5-mer
3vb5
RCSB PDB
PDBbind
5-mer
3vb7
RCSB PDB
PDBbind
5-mer
3wqv
RCSB PDB
PDBbind
5-mer
4czs
RCSB PDB
PDBbind
5-mer
4d8i
RCSB PDB
PDBbind
5-mer
4dkt
RCSB PDB
PDBbind
5-mer
4est
RCSB PDB
PDBbind
5-mer
4gm3
RCSB PDB
PDBbind
5-mer
4gm8
RCSB PDB
PDBbind
5-mer
4i9c
RCSB PDB
PDBbind
5-mer
4j78
RCSB PDB
PDBbind
5-mer
4j81
RCSB PDB
PDBbind
5-mer
4j82
RCSB PDB
PDBbind
5-mer
4j84
RCSB PDB
PDBbind
5-mer
4k3m
RCSB PDB
PDBbind
5-mer
4kvm
RCSB PDB
PDBbind
5-mer
4l6t
RCSB PDB
PDBbind
5-mer
4lte
RCSB PDB
PDBbind
5-mer
4omc
RCSB PDB
PDBbind
5-mer
4omd
RCSB PDB
PDBbind
5-mer
4pry
RCSB PDB
PDBbind
5-mer
4ps0
RCSB PDB
PDBbind
5-mer
4ps1
RCSB PDB
PDBbind
5-mer
4q6f
RCSB PDB
PDBbind
5-mer
4rcp
RCSB PDB
PDBbind
5-mer
4rsp
RCSB PDB
PDBbind
5-mer
4ryd
RCSB PDB
PDBbind
5-mer
4sga
RCSB PDB
PDBbind
5-mer
4whh
RCSB PDB
PDBbind
5-mer
4whl
RCSB PDB
PDBbind
5-mer
4wvs
RCSB PDB
PDBbind
5-mer
4wvu
RCSB PDB
PDBbind
5-mer
4x13
RCSB PDB
PDBbind
5-mer
4x9w
RCSB PDB
PDBbind
5-mer
4yec
RCSB PDB
PDBbind
5-mer
4yv8
RCSB PDB
PDBbind
5-mer
4z5w
RCSB PDB
PDBbind
5-mer
4z7q
RCSB PDB
PDBbind
5-mer
4zro
RCSB PDB
PDBbind
5-mer
5axi
RCSB PDB
PDBbind
5-mer
5bmm
RCSB PDB
PDBbind
5-mer
5btr
RCSB PDB
PDBbind
5-mer
5e3a
RCSB PDB
PDBbind
5-mer
5e8f
RCSB PDB
PDBbind
5-mer
5eld
RCSB PDB
PDBbind
5-mer
5ele
RCSB PDB
PDBbind
5-mer
5elf
RCSB PDB
PDBbind
5-mer
5f5b
RCSB PDB
PDBbind
5-mer
5h7h
RCSB PDB
PDBbind
5-mer
5icv
RCSB PDB
PDBbind
5-mer
5jr6
RCSB PDB
PDBbind
5-mer
5lpr
RCSB PDB
PDBbind
5-mer
5n99
RCSB PDB
PDBbind
5-mer
5nwi
RCSB PDB
PDBbind
5-mer
5nwk
RCSB PDB
PDBbind
5-mer
5ttw
RCSB PDB
PDBbind
5-mer
5x54
RCSB PDB
PDBbind
5-mer
5yc1
RCSB PDB
PDBbind
5-mer
5zob
RCSB PDB
PDBbind
5-mer
6ax4
RCSB PDB
PDBbind
5-mer
6b5q
RCSB PDB
PDBbind
5-mer
6eqv
RCSB PDB
PDBbind
5-mer
6eqw
RCSB PDB
PDBbind
5-mer
6lpr
RCSB PDB
PDBbind
5-mer
6mub
RCSB PDB
PDBbind
5-mer
7lpr
RCSB PDB
PDBbind
5-mer
8lpr
RCSB PDB
PDBbind
5-mer
9lpr
RCSB PDB
PDBbind
5-mer
6hzb
RCSB PDB
PDBbind
5-mer
6hza
RCSB PDB
PDBbind
5-mer
6hv2
RCSB PDB
PDBbind
5-mer
Entry Information
PDB ID
6dn6
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
SPRY domain-containing SOCS box protein 2
Ligand Name
5-mer
EC.Number
E.C.-.-.-.-
Resolution
1.59(Å)
Affinity (Kd/Ki/IC50)
Kd=7nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ACS Chem. Biol. Vol. 13: pp. 2930-2938
Ligand Properties
Formula
C
2
2
H
3
6
N
8
O
8
Molecular Weight
540.570
Exact Mass
540.266
No. of atoms
74
No. of bonds
74
Polar Surface Area
274.77
LOGP Value
-4.64 (
Computed with XLOGP3
)
-0.75 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 1
Canonical SMILES
CC[C@@H]([C@@H]1NC(=O)CCCNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(=O)N)CC(=O)N)CC(=O)N)C
InChI String
InChI=1S/C22H36N8O8/c1-3-10(2)18-22(38)29-13(9-16(25)33)21(37)28-12(8-15(24)32)20(36)27-11(7-14(23)31)19(35)26-6-4-5-17(34)30-18/h10-13,18H,3-9H2,1-2H3,(H2,23,31)(H2,24,32)(H2,25,33)(H,26,35)(H,27,36)(H,28,37)(H,29,38)(H,30,34)/t10-,11-,12-,13-,18-/m0/s1
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UniProtKB AC
UniProt accession number (AC):
Q99619
Entrez Gene ID
NCBI Entrez Gene ID:
84727
ASD
Information of known allosteric effects of PDB entries
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