Browse entries in the PDBbind-CN Database
HEADER 4XKC_COMPLEX COMPND 4XKC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 10 ASN LEU THR GLU LEU SER GLN GLN LEU HIS SEQRES 1 A 215 LYS GLN LEU THR ALA ILE ALA ALA LEU ALA GLU MET GLY SEQRES 2 A 215 GLU GLY GLY GLN GLY ILE LEU LEU ASP TYR LEU ALA LYS SEQRES 3 A 215 ASN VAL PRO LEU GLU LYS PRO VAL LEU ALA VAL GLY ASN SEQRES 4 A 215 VAL TYR GLN THR LEU ARG ASN LEU GLU GLN GLU THR ILE SEQRES 5 A 215 THR THR GLN LEU GLN ARG ASN TYR PRO THR GLY ILE PHE SEQRES 6 A 215 PRO LEU GLN SER ALA GLN GLY ILE ASP TYR LEU PRO LEU SEQRES 7 A 215 GLN GLU ALA LEU GLY SER GLN ASP PHE GLU THR ALA ASP SEQRES 8 A 215 GLU ILE THR ARG ASP LYS LEU CYS GLU LEU ALA GLY PRO SEQRES 9 A 215 GLY ALA SER GLN ARG GLN TRP LEU TYR PHE THR GLU VAL SEQRES 10 A 215 GLU LYS PHE PRO ALA LEU ASP LEU HIS THR ILE ASN ALA SEQRES 11 A 215 LEU TRP TRP LEU HIS SER ASN GLY ASN PHE GLY PHE SER SEQRES 12 A 215 VAL GLN ARG ARG LEU TRP LEU ALA SER GLY LYS GLU PHE SEQRES 13 A 215 THR LYS LEU TRP PRO LYS ILE GLY TRP LYS SER GLY ASN SEQRES 14 A 215 VAL TRP THR ARG TRP PRO LYS GLY PHE THR TRP ASP LEU SEQRES 15 A 215 SER ALA PRO GLN GLY HIS LEU PRO LEU LEU ASN GLN LEU SEQRES 16 A 215 ARG GLY VAL ARG VAL ALA GLU SER LEU TYR ARG HIS PRO SEQRES 17 A 215 VAL TRP SER GLN TYR GLY TRP HET MD A 9 65 ATOM 1 N ASN A 4 -15.907 11.059 -11.905 1.00 26.38 N ATOM 2 CA ASN A 4 -15.261 9.767 -11.701 1.00 27.31 C ATOM 3 C ASN A 4 -14.739 9.605 -10.274 1.00 36.19 C ATOM 4 O ASN A 4 -15.177 8.716 -9.539 1.00 31.76 O ATOM 5 CB ASN A 4 -14.121 9.568 -12.705 1.00 39.17 C ATOM 6 CG ASN A 4 -13.434 8.217 -12.557 1.00 46.16 C ATOM 7 OD1 ASN A 4 -12.471 8.076 -11.802 1.00 47.48 O ATOM 8 ND2 ASN A 4 -13.922 7.219 -13.287 1.00 50.60 N ATOM 9 HD22 ASN A 4 -14.737 7.382 -13.912 1.00 0.00 H ATOM 10 HD21 ASN A 4 -13.489 6.275 -13.233 1.00 0.00 H ATOM 11 HN3 ASN A 4 -15.223 11.820 -11.721 1.00 0.00 H ATOM 12 HN2 ASN A 4 -16.712 11.150 -11.253 1.00 0.00 H ATOM 13 HN1 ASN A 4 -16.245 11.125 -12.886 1.00 0.00 H ATOM 14 N LEU A 5 -13.805 10.473 -9.891 1.00 34.06 N ATOM 15 CA LEU A 5 -13.155 10.389 -8.587 1.00 31.72 C ATOM 16 C LEU A 5 -14.114 10.651 -7.429 1.00 28.07 C ATOM 17 O LEU A 5 -14.028 9.997 -6.388 1.00 26.31 O ATOM 18 CB LEU A 5 -11.968 11.352 -8.518 1.00 30.61 C ATOM 19 CG LEU A 5 -10.739 10.976 -9.344 1.00 26.46 C ATOM 20 CD1 LEU A 5 -9.622 11.990 -9.156 1.00 23.39 C ATOM 21 CD2 LEU A 5 -10.266 9.585 -8.967 1.00 34.27 C ATOM 22 H LEU A 5 -13.530 11.236 -10.542 1.00 0.00 H ATOM 23 N THR A 6 -15.021 11.607 -7.611 1.00 23.47 N ATOM 24 CA THR A 6 -16.018 11.920 -6.590 1.00 29.65 C ATOM 25 C THR A 6 -16.937 10.720 -6.359 1.00 30.10 C ATOM 26 O THR A 6 -17.330 10.432 -5.225 1.00 24.15 O ATOM 27 CB THR A 6 -16.851 13.169 -6.964 1.00 30.86 C ATOM 28 OG1 THR A 6 -15.990 14.311 -7.062 1.00 30.13 O ATOM 29 CG2 THR A 6 -17.922 13.443 -5.915 1.00 26.74 C ATOM 30 HG1 THR A 6 -16.527 15.108 -7.301 1.00 0.00 H ATOM 31 H THR A 6 -15.020 12.144 -8.501 1.00 0.00 H ATOM 32 N GLU A 7 -17.264 10.016 -7.439 1.00 31.48 N ATOM 33 CA GLU A 7 -18.063 8.799 -7.348 1.00 32.88 C ATOM 34 C GLU A 7 -17.344 7.759 -6.493 1.00 28.43 C ATOM 35 O GLU A 7 -17.956 7.101 -5.651 1.00 28.15 O ATOM 36 CB GLU A 7 -18.345 8.238 -8.742 1.00 34.77 C ATOM 37 H GLU A 7 -16.942 10.342 -8.373 1.00 0.00 H ATOM 38 N LEU A 8 -16.040 7.626 -6.711 1.00 30.88 N ATOM 39 CA LEU A 8 -15.215 6.729 -5.911 1.00 25.72 C ATOM 40 C LEU A 8 -15.164 7.177 -4.454 1.00 28.64 C ATOM 41 O LEU A 8 -15.091 6.350 -3.545 1.00 33.65 O ATOM 42 CB LEU A 8 -13.801 6.639 -6.488 1.00 28.15 C ATOM 43 CG LEU A 8 -13.640 5.784 -7.747 1.00 29.27 C ATOM 44 CD1 LEU A 8 -12.273 6.000 -8.379 1.00 29.15 C ATOM 45 CD2 LEU A 8 -13.852 4.313 -7.418 1.00 22.40 C ATOM 46 H LEU A 8 -15.596 8.177 -7.473 1.00 0.00 H ATOM 47 N SER A 9 -15.211 8.489 -4.239 1.00 31.60 N ATOM 48 CA SER A 9 -15.186 9.051 -2.893 1.00 22.02 C ATOM 49 C SER A 9 -16.417 8.627 -2.102 1.00 31.33 C ATOM 50 O SER A 9 -16.340 8.365 -0.901 1.00 34.92 O ATOM 51 CB SER A 9 -15.110 10.579 -2.948 1.00 28.83 C ATOM 52 OG SER A 9 -14.030 11.011 -3.756 1.00 40.99 O ATOM 53 HG SER A 9 -14.150 10.667 -4.677 1.00 0.00 H ATOM 54 H SER A 9 -15.267 9.133 -5.054 1.00 0.00 H ATOM 55 N GLN A 10 -17.554 8.558 -2.785 1.00 34.12 N ATOM 56 CA GLN A 10 -18.812 8.203 -2.140 1.00 35.37 C ATOM 57 C GLN A 10 -18.901 6.707 -1.859 1.00 37.71 C ATOM 58 O GLN A 10 -19.729 6.266 -1.062 1.00 34.66 O ATOM 59 CB GLN A 10 -19.996 8.661 -2.992 1.00 33.40 C ATOM 60 CG GLN A 10 -20.008 10.157 -3.271 1.00 32.46 C ATOM 61 CD GLN A 10 -21.228 10.595 -4.057 1.00 39.59 C ATOM 62 OE1 GLN A 10 -22.170 9.824 -4.244 1.00 43.19 O ATOM 63 NE2 GLN A 10 -21.216 11.839 -4.523 1.00 44.44 N ATOM 64 HE22 GLN A 10 -20.398 12.455 -4.340 1.00 0.00 H ATOM 65 HE21 GLN A 10 -22.024 12.197 -5.071 1.00 0.00 H ATOM 66 H GLN A 10 -17.547 8.762 -3.805 1.00 0.00 H ATOM 67 N GLN A 11 -18.042 5.930 -2.512 1.00 30.37 N ATOM 68 CA GLN A 11 -18.004 4.488 -2.295 1.00 29.63 C ATOM 69 C GLN A 11 -17.286 4.129 -0.996 1.00 36.45 C ATOM 70 O GLN A 11 -17.345 2.984 -0.545 1.00 33.70 O ATOM 71 CB GLN A 11 -17.338 3.774 -3.474 1.00 33.43 C ATOM 72 CG GLN A 11 -18.151 3.773 -4.756 1.00 38.14 C ATOM 73 CD GLN A 11 -17.591 2.819 -5.795 1.00 39.40 C ATOM 74 OE1 GLN A 11 -16.793 1.936 -5.477 1.00 42.71 O ATOM 75 NE2 GLN A 11 -18.006 2.992 -7.043 1.00 46.54 N ATOM 76 HE22 GLN A 11 -18.681 3.751 -7.266 1.00 0.00 H ATOM 77 HE21 GLN A 11 -17.656 2.369 -7.798 1.00 0.00 H ATOM 78 H GLN A 11 -17.383 6.360 -3.192 1.00 0.00 H ATOM 79 N LEU A 12 -16.606 5.107 -0.403 1.00 37.58 N ATOM 80 CA LEU A 12 -15.924 4.900 0.871 1.00 41.70 C ATOM 81 C LEU A 12 -16.915 4.531 1.972 1.00 35.12 C ATOM 82 O LEU A 12 -16.598 3.751 2.870 1.00 38.96 O ATOM 83 CB LEU A 12 -15.129 6.144 1.277 1.00 28.04 C ATOM 84 CG LEU A 12 -13.681 6.247 0.789 1.00 32.61 C ATOM 85 CD1 LEU A 12 -12.927 4.965 1.097 1.00 38.15 C ATOM 86 CD2 LEU A 12 -13.607 6.573 -0.692 1.00 36.64 C ATOM 87 H LEU A 12 -16.559 6.041 -0.858 1.00 0.00 H ATOM 88 N HIS A 13 -18.117 5.095 1.892 1.00 41.37 N ATOM 89 CA HIS A 13 -19.161 4.814 2.869 1.00 40.22 C ATOM 90 C HIS A 13 -20.124 3.752 2.350 1.00 39.26 C ATOM 91 O HIS A 13 -21.203 3.554 2.907 1.00 36.41 O ATOM 92 CB HIS A 13 -19.925 6.093 3.220 1.00 41.36 C ATOM 93 H HIS A 13 -18.317 5.753 1.112 1.00 0.00 H TER 94 HIS A 13 ATOM 95 N LYS A 19 -16.530 -3.857 -0.892 1.00 31.72 N ATOM 96 CA LYS A 19 -16.873 -2.827 -1.866 1.00 24.20 C ATOM 97 C LYS A 19 -16.054 -1.569 -1.623 1.00 29.24 C ATOM 98 O LYS A 19 -15.567 -0.940 -2.563 1.00 30.26 O ATOM 99 CB LYS A 19 -18.365 -2.496 -1.797 1.00 32.07 C ATOM 100 HN3 LYS A 19 -16.727 -3.505 0.067 1.00 0.00 H ATOM 101 HN2 LYS A 19 -15.520 -4.090 -0.976 1.00 0.00 H ATOM 102 HN1 LYS A 19 -17.099 -4.708 -1.074 1.00 0.00 H ATOM 103 N GLN A 20 -15.909 -1.207 -0.353 1.00 32.06 N ATOM 104 CA GLN A 20 -15.132 -0.036 0.023 1.00 29.18 C ATOM 105 C GLN A 20 -13.679 -0.199 -0.401 1.00 15.44 C ATOM 106 O GLN A 20 -13.048 0.753 -0.854 1.00 18.48 O ATOM 107 CB GLN A 20 -15.221 0.200 1.531 1.00 28.27 C ATOM 108 CG GLN A 20 -16.611 0.578 2.016 1.00 35.31 C ATOM 109 CD GLN A 20 -16.716 0.588 3.528 1.00 38.42 C ATOM 110 OE1 GLN A 20 -16.496 -0.430 4.184 1.00 31.55 O ATOM 111 NE2 GLN A 20 -17.049 1.745 4.090 1.00 37.88 N ATOM 112 HE22 GLN A 20 -17.226 2.580 3.496 1.00 0.00 H ATOM 113 HE21 GLN A 20 -17.133 1.816 5.124 1.00 0.00 H ATOM 114 H GLN A 20 -16.362 -1.775 0.391 1.00 0.00 H ATOM 115 N LEU A 21 -13.161 -1.417 -0.266 1.00 20.68 N ATOM 116 CA LEU A 21 -11.769 -1.705 -0.599 1.00 29.10 C ATOM 117 C LEU A 21 -11.469 -1.499 -2.083 1.00 17.65 C ATOM 118 O LEU A 21 -10.403 -0.993 -2.437 1.00 21.58 O ATOM 119 CB LEU A 21 -11.390 -3.127 -0.169 1.00 24.72 C ATOM 120 CG LEU A 21 -9.939 -3.553 -0.416 1.00 28.80 C ATOM 121 CD1 LEU A 21 -8.955 -2.502 0.091 1.00 33.21 C ATOM 122 CD2 LEU A 21 -9.656 -4.907 0.221 1.00 31.34 C ATOM 123 H LEU A 21 -13.765 -2.186 0.087 1.00 0.00 H ATOM 124 N THR A 22 -12.407 -1.889 -2.942 1.00 27.97 N ATOM 125 CA THR A 22 -12.232 -1.737 -4.385 1.00 23.91 C ATOM 126 C THR A 22 -12.055 -0.268 -4.757 1.00 19.31 C ATOM 127 O THR A 22 -11.199 0.078 -5.572 1.00 18.31 O ATOM 128 CB THR A 22 -13.425 -2.314 -5.176 1.00 21.69 C ATOM 129 OG1 THR A 22 -14.579 -1.485 -4.987 1.00 25.20 O ATOM 130 CG2 THR A 22 -13.736 -3.736 -4.724 1.00 22.45 C ATOM 131 HG1 THR A 22 -14.808 -1.454 -4.024 1.00 0.00 H ATOM 132 H THR A 22 -13.285 -2.312 -2.578 1.00 0.00 H ATOM 133 N ALA A 23 -12.866 0.591 -4.149 1.00 21.94 N ATOM 134 CA ALA A 23 -12.766 2.027 -4.374 1.00 19.69 C ATOM 135 C ALA A 23 -11.427 2.560 -3.877 1.00 18.21 C ATOM 136 O ALA A 23 -10.786 3.373 -4.545 1.00 17.31 O ATOM 137 CB ALA A 23 -13.909 2.748 -3.691 1.00 24.55 C ATOM 138 H ALA A 23 -13.590 0.229 -3.496 1.00 0.00 H ATOM 139 N ILE A 24 -11.015 2.098 -2.699 1.00 17.42 N ATOM 140 CA ILE A 24 -9.738 2.490 -2.109 1.00 15.83 C ATOM 141 C ILE A 24 -8.584 2.080 -3.013 1.00 13.48 C ATOM 142 O ILE A 24 -7.678 2.870 -3.276 1.00 15.88 O ATOM 143 CB ILE A 24 -9.536 1.844 -0.721 1.00 16.09 C ATOM 144 CG1 ILE A 24 -10.575 2.370 0.268 1.00 14.39 C ATOM 145 CG2 ILE A 24 -8.127 2.106 -0.202 1.00 8.88 C ATOM 146 CD1 ILE A 24 -10.637 1.586 1.562 1.00 12.39 C ATOM 147 H ILE A 24 -11.624 1.434 -2.180 1.00 0.00 H ATOM 148 N ALA A 25 -8.629 0.839 -3.486 1.00 16.26 N ATOM 149 CA ALA A 25 -7.609 0.325 -4.391 1.00 18.17 C ATOM 150 C ALA A 25 -7.558 1.147 -5.677 1.00 18.45 C ATOM 151 O ALA A 25 -6.479 1.479 -6.169 1.00 13.81 O ATOM 152 CB ALA A 25 -7.870 -1.139 -4.705 1.00 23.84 C ATOM 153 H ALA A 25 -9.413 0.218 -3.203 1.00 0.00 H ATOM 154 N ALA A 26 -8.732 1.479 -6.207 1.00 17.75 N ATOM 155 CA ALA A 26 -8.829 2.269 -7.431 1.00 19.46 C ATOM 156 C ALA A 26 -8.251 3.669 -7.249 1.00 16.17 C ATOM 157 O ALA A 26 -7.476 4.138 -8.079 1.00 19.44 O ATOM 158 CB ALA A 26 -10.275 2.348 -7.901 1.00 13.24 C ATOM 159 H ALA A 26 -9.605 1.167 -5.736 1.00 0.00 H ATOM 160 N LEU A 27 -8.630 4.326 -6.157 1.00 18.07 N ATOM 161 CA LEU A 27 -8.160 5.676 -5.863 1.00 19.32 C ATOM 162 C LEU A 27 -6.641 5.757 -5.728 1.00 19.58 C ATOM 163 O LEU A 27 -6.019 6.706 -6.202 1.00 19.55 O ATOM 164 CB LEU A 27 -8.826 6.205 -4.592 1.00 20.33 C ATOM 165 CG LEU A 27 -10.298 6.597 -4.724 1.00 21.10 C ATOM 166 CD1 LEU A 27 -10.925 6.796 -3.358 1.00 22.99 C ATOM 167 CD2 LEU A 27 -10.430 7.858 -5.562 1.00 23.96 C ATOM 168 H LEU A 27 -9.282 3.863 -5.492 1.00 0.00 H ATOM 169 N ALA A 28 -6.044 4.757 -5.088 1.00 15.16 N ATOM 170 CA ALA A 28 -4.605 4.768 -4.843 1.00 19.22 C ATOM 171 C ALA A 28 -3.795 4.598 -6.125 1.00 20.41 C ATOM 172 O ALA A 28 -2.626 4.982 -6.186 1.00 23.17 O ATOM 173 CB ALA A 28 -4.229 3.701 -3.833 1.00 17.20 C ATOM 174 H ALA A 28 -6.612 3.952 -4.756 1.00 0.00 H ATOM 175 N GLU A 29 -4.419 4.025 -7.149 1.00 22.71 N ATOM 176 CA GLU A 29 -3.752 3.825 -8.430 1.00 21.62 C ATOM 177 C GLU A 29 -4.011 4.984 -9.388 1.00 21.70 C ATOM 178 O GLU A 29 -3.616 4.937 -10.553 1.00 25.90 O ATOM 179 CB GLU A 29 -4.198 2.505 -9.063 1.00 24.75 C ATOM 180 CG GLU A 29 -3.772 1.275 -8.282 1.00 32.96 C ATOM 181 CD GLU A 29 -4.349 -0.005 -8.852 1.00 42.95 C ATOM 182 OE1 GLU A 29 -5.121 0.077 -9.830 1.00 36.61 O ATOM 183 OE2 GLU A 29 -4.033 -1.091 -8.320 1.00 37.50 O ATOM 184 H GLU A 29 -5.404 3.713 -7.034 1.00 0.00 H ATOM 185 N MET A 30 -4.668 6.026 -8.891 1.00 21.50 N ATOM 186 CA MET A 30 -5.026 7.165 -9.730 1.00 22.04 C ATOM 187 C MET A 30 -4.270 8.442 -9.366 1.00 25.42 C ATOM 188 O MET A 30 -4.854 9.526 -9.309 1.00 31.35 O ATOM 189 CB MET A 30 -6.537 7.398 -9.697 1.00 20.60 C ATOM 190 CG MET A 30 -7.327 6.304 -10.398 1.00 24.06 C ATOM 191 SD MET A 30 -9.107 6.429 -10.150 1.00 36.45 S ATOM 192 CE MET A 30 -9.681 5.034 -11.118 1.00 39.48 C ATOM 193 H MET A 30 -4.932 6.030 -7.885 1.00 0.00 H ATOM 194 N GLY A 31 -2.971 8.301 -9.124 1.00 15.95 N ATOM 195 CA GLY A 31 -2.090 9.439 -8.933 1.00 22.77 C ATOM 196 C GLY A 31 -2.440 10.360 -7.781 1.00 24.18 C ATOM 197 O GLY A 31 -3.123 9.964 -6.836 1.00 23.67 O ATOM 198 H GLY A 31 -2.572 7.342 -9.070 1.00 0.00 H ATOM 199 N GLU A 32 -1.971 11.601 -7.873 1.00 21.71 N ATOM 200 CA GLU A 32 -2.144 12.587 -6.811 1.00 25.87 C ATOM 201 C GLU A 32 -3.610 12.875 -6.508 1.00 23.57 C ATOM 202 O GLU A 32 -3.967 13.185 -5.371 1.00 24.69 O ATOM 203 CB GLU A 32 -1.430 13.889 -7.179 1.00 29.27 C ATOM 204 CG GLU A 32 0.053 13.723 -7.462 1.00 40.64 C ATOM 205 CD GLU A 32 0.703 15.010 -7.927 1.00 50.09 C ATOM 206 OE1 GLU A 32 0.009 16.049 -7.961 1.00 46.52 O ATOM 207 OE2 GLU A 32 1.907 14.984 -8.260 1.00 49.34 O ATOM 208 H GLU A 32 -1.461 11.880 -8.735 1.00 0.00 H ATOM 209 N GLY A 33 -4.453 12.776 -7.530 1.00 16.70 N ATOM 210 CA GLY A 33 -5.870 13.041 -7.373 1.00 21.18 C ATOM 211 C GLY A 33 -6.546 12.065 -6.429 1.00 21.91 C ATOM 212 O GLY A 33 -7.158 12.468 -5.439 1.00 20.91 O ATOM 213 H GLY A 33 -4.088 12.502 -8.465 1.00 0.00 H ATOM 214 N GLY A 34 -6.434 10.777 -6.735 1.00 19.38 N ATOM 215 CA GLY A 34 -7.059 9.747 -5.926 1.00 15.21 C ATOM 216 C GLY A 34 -6.447 9.641 -4.544 1.00 11.95 C ATOM 217 O GLY A 34 -7.148 9.405 -3.562 1.00 17.15 O ATOM 218 H GLY A 34 -5.885 10.500 -7.574 1.00 0.00 H ATOM 219 N GLN A 35 -5.132 9.815 -4.471 1.00 14.18 N ATOM 220 CA GLN A 35 -4.417 9.765 -3.202 1.00 12.96 C ATOM 221 C GLN A 35 -4.763 10.963 -2.325 1.00 16.83 C ATOM 222 O GLN A 35 -4.805 10.856 -1.099 1.00 14.27 O ATOM 223 CB GLN A 35 -2.911 9.701 -3.448 1.00 20.39 C ATOM 224 CG GLN A 35 -2.465 8.441 -4.170 1.00 20.37 C ATOM 225 CD GLN A 35 -1.087 8.580 -4.776 1.00 22.55 C ATOM 226 OE1 GLN A 35 -0.450 9.628 -4.661 1.00 27.92 O ATOM 227 NE2 GLN A 35 -0.618 7.523 -5.431 1.00 20.18 N ATOM 228 HE22 GLN A 35 -1.192 6.659 -5.502 1.00 0.00 H ATOM 229 HE21 GLN A 35 0.323 7.560 -5.872 1.00 0.00 H ATOM 230 H GLN A 35 -4.597 9.992 -5.345 1.00 0.00 H ATOM 231 N GLY A 36 -5.011 12.105 -2.960 1.00 12.21 N ATOM 232 CA GLY A 36 -5.453 13.288 -2.249 1.00 12.40 C ATOM 233 C GLY A 36 -6.805 13.039 -1.609 1.00 16.80 C ATOM 234 O GLY A 36 -7.080 13.505 -0.504 1.00 16.58 O ATOM 235 H GLY A 36 -4.885 12.150 -3.991 1.00 0.00 H ATOM 236 N ILE A 37 -7.650 12.290 -2.310 1.00 13.11 N ATOM 237 CA ILE A 37 -8.954 11.912 -1.783 1.00 13.63 C ATOM 238 C ILE A 37 -8.810 10.986 -0.575 1.00 12.27 C ATOM 239 O ILE A 37 -9.476 11.178 0.442 1.00 11.16 O ATOM 240 CB ILE A 37 -9.814 11.229 -2.859 1.00 14.15 C ATOM 241 CG1 ILE A 37 -10.060 12.188 -4.024 1.00 21.64 C ATOM 242 CG2 ILE A 37 -11.138 10.763 -2.271 1.00 14.04 C ATOM 243 CD1 ILE A 37 -10.851 11.582 -5.147 1.00 23.23 C ATOM 244 H ILE A 37 -7.373 11.966 -3.259 1.00 0.00 H ATOM 245 N LEU A 38 -7.935 9.990 -0.696 1.00 10.06 N ATOM 246 CA LEU A 38 -7.661 9.061 0.399 1.00 11.14 C ATOM 247 C LEU A 38 -7.129 9.792 1.625 1.00 11.65 C ATOM 248 O LEU A 38 -7.562 9.535 2.748 1.00 12.58 O ATOM 249 CB LEU A 38 -6.652 7.995 -0.035 1.00 9.56 C ATOM 250 CG LEU A 38 -7.128 6.999 -1.091 1.00 13.03 C ATOM 251 CD1 LEU A 38 -6.037 5.985 -1.389 1.00 9.01 C ATOM 252 CD2 LEU A 38 -8.411 6.310 -0.639 1.00 6.86 C ATOM 253 H LEU A 38 -7.431 9.869 -1.597 1.00 0.00 H ATOM 254 N LEU A 39 -6.184 10.699 1.398 1.00 8.79 N ATOM 255 CA LEU A 39 -5.585 11.474 2.478 1.00 12.27 C ATOM 256 C LEU A 39 -6.632 12.315 3.194 1.00 12.91 C ATOM 257 O LEU A 39 -6.630 12.417 4.419 1.00 12.44 O ATOM 258 CB LEU A 39 -4.466 12.366 1.939 1.00 11.28 C ATOM 259 CG LEU A 39 -3.136 11.668 1.651 1.00 15.47 C ATOM 260 CD1 LEU A 39 -2.179 12.606 0.935 1.00 14.17 C ATOM 261 CD2 LEU A 39 -2.521 11.159 2.946 1.00 12.72 C ATOM 262 H LEU A 39 -5.863 10.860 0.422 1.00 0.00 H ATOM 263 N ASP A 40 -7.530 12.914 2.419 1.00 15.87 N ATOM 264 CA ASP A 40 -8.597 13.729 2.980 1.00 14.53 C ATOM 265 C ASP A 40 -9.569 12.874 3.784 1.00 16.09 C ATOM 266 O ASP A 40 -10.134 13.328 4.777 1.00 12.03 O ATOM 267 CB ASP A 40 -9.349 14.467 1.875 1.00 17.82 C ATOM 268 CG ASP A 40 -10.578 15.184 2.393 1.00 28.99 C ATOM 269 OD1 ASP A 40 -10.426 16.287 2.961 1.00 29.91 O ATOM 270 OD2 ASP A 40 -11.693 14.642 2.238 1.00 22.97 O ATOM 271 H ASP A 40 -7.469 12.798 1.387 1.00 0.00 H ATOM 272 N TYR A 41 -9.763 11.635 3.346 1.00 14.43 N ATOM 273 CA TYR A 41 -10.655 10.715 4.044 1.00 15.45 C ATOM 274 C TYR A 41 -10.138 10.407 5.449 1.00 14.09 C ATOM 275 O TYR A 41 -10.915 10.339 6.401 1.00 16.90 O ATOM 276 CB TYR A 41 -10.833 9.422 3.243 1.00 16.25 C ATOM 277 CG TYR A 41 -11.669 8.370 3.937 1.00 13.73 C ATOM 278 CD1 TYR A 41 -13.051 8.367 3.818 1.00 18.41 C ATOM 279 CD2 TYR A 41 -11.075 7.373 4.700 1.00 13.24 C ATOM 280 CE1 TYR A 41 -13.818 7.410 4.445 1.00 18.74 C ATOM 281 CE2 TYR A 41 -11.836 6.408 5.335 1.00 15.96 C ATOM 282 CZ TYR A 41 -13.209 6.433 5.202 1.00 21.06 C ATOM 283 OH TYR A 41 -13.986 5.482 5.822 1.00 23.92 O ATOM 284 HH TYR A 41 -14.940 5.653 5.619 1.00 0.00 H ATOM 285 H TYR A 41 -9.269 11.314 2.489 1.00 0.00 H ATOM 286 N LEU A 42 -8.828 10.214 5.570 1.00 11.51 N ATOM 287 CA LEU A 42 -8.210 9.956 6.866 1.00 14.72 C ATOM 288 C LEU A 42 -8.386 11.150 7.792 1.00 16.01 C ATOM 289 O LEU A 42 -8.684 10.992 8.975 1.00 14.06 O ATOM 290 CB LEU A 42 -6.720 9.660 6.706 1.00 14.49 C ATOM 291 CG LEU A 42 -6.318 8.341 6.052 1.00 14.14 C ATOM 292 CD1 LEU A 42 -4.802 8.233 5.990 1.00 6.30 C ATOM 293 CD2 LEU A 42 -6.910 7.168 6.814 1.00 7.40 C ATOM 294 H LEU A 42 -8.229 10.248 4.720 1.00 0.00 H ATOM 295 N ALA A 43 -8.203 12.345 7.239 1.00 13.66 N ATOM 296 CA ALA A 43 -8.313 13.581 8.004 1.00 17.32 C ATOM 297 C ALA A 43 -9.703 13.753 8.613 1.00 17.73 C ATOM 298 O ALA A 43 -9.863 14.433 9.625 1.00 26.01 O ATOM 299 CB ALA A 43 -7.963 14.778 7.125 1.00 14.03 C ATOM 300 H ALA A 43 -7.974 12.400 6.226 1.00 0.00 H ATOM 301 N LYS A 44 -10.700 13.126 7.998 1.00 14.59 N ATOM 302 CA LYS A 44 -12.077 13.235 8.469 1.00 20.05 C ATOM 303 C LYS A 44 -12.492 12.104 9.408 1.00 23.61 C ATOM 304 O LYS A 44 -13.596 12.125 9.955 1.00 21.84 O ATOM 305 CB LYS A 44 -13.044 13.287 7.284 1.00 21.16 C ATOM 306 CG LYS A 44 -13.045 14.606 6.531 1.00 22.87 C ATOM 307 CD LYS A 44 -14.083 14.596 5.420 1.00 30.97 C ATOM 308 CE LYS A 44 -14.229 15.969 4.782 1.00 46.86 C ATOM 309 NZ LYS A 44 -12.948 16.455 4.197 1.00 43.18 N ATOM 310 HZ1 LYS A 44 -12.229 16.520 4.946 1.00 0.00 H ATOM 311 HZ2 LYS A 44 -12.628 15.789 3.465 1.00 0.00 H ATOM 312 HZ3 LYS A 44 -13.096 17.393 3.774 1.00 0.00 H ATOM 313 H LYS A 44 -10.494 12.544 7.161 1.00 0.00 H ATOM 314 N ASN A 45 -11.617 11.120 9.595 1.00 17.78 N ATOM 315 CA ASN A 45 -11.974 9.941 10.382 1.00 18.27 C ATOM 316 C ASN A 45 -10.934 9.517 11.418 1.00 17.90 C ATOM 317 O ASN A 45 -11.172 8.599 12.200 1.00 21.36 O ATOM 318 CB ASN A 45 -12.299 8.764 9.458 1.00 18.11 C ATOM 319 CG ASN A 45 -13.565 8.988 8.655 1.00 21.02 C ATOM 320 OD1 ASN A 45 -14.668 8.743 9.140 1.00 21.57 O ATOM 321 ND2 ASN A 45 -13.411 9.458 7.420 1.00 17.19 N ATOM 322 HD22 ASN A 45 -12.458 9.651 7.052 1.00 0.00 H ATOM 323 HD21 ASN A 45 -14.244 9.633 6.822 1.00 0.00 H ATOM 324 H ASN A 45 -10.668 11.190 9.176 1.00 0.00 H ATOM 325 N VAL A 46 -9.788 10.187 11.422 1.00 16.83 N ATOM 326 CA VAL A 46 -8.710 9.862 12.351 1.00 14.26 C ATOM 327 C VAL A 46 -8.552 10.999 13.364 1.00 21.05 C ATOM 328 O VAL A 46 -8.556 12.168 12.980 1.00 18.15 O ATOM 329 CB VAL A 46 -7.386 9.612 11.584 1.00 16.50 C ATOM 330 CG1 VAL A 46 -6.237 9.318 12.534 1.00 9.57 C ATOM 331 CG2 VAL A 46 -7.563 8.465 10.597 1.00 11.68 C ATOM 332 H VAL A 46 -9.655 10.965 10.745 1.00 0.00 H ATOM 333 N PRO A 47 -8.415 10.667 14.663 1.00 18.00 N ATOM 334 CA PRO A 47 -8.342 9.323 15.253 1.00 14.59 C ATOM 335 C PRO A 47 -9.679 8.595 15.344 1.00 13.34 C ATOM 336 O PRO A 47 -10.714 9.212 15.585 1.00 12.42 O ATOM 337 CB PRO A 47 -7.797 9.590 16.660 1.00 13.19 C ATOM 338 CG PRO A 47 -8.252 10.964 16.976 1.00 16.04 C ATOM 339 CD PRO A 47 -8.214 11.719 15.677 1.00 16.85 C ATOM 340 N LEU A 48 -9.640 7.281 15.147 1.00 12.59 N ATOM 341 CA LEU A 48 -10.820 6.441 15.292 1.00 15.56 C ATOM 342 C LEU A 48 -11.292 6.423 16.739 1.00 16.03 C ATOM 343 O LEU A 48 -10.488 6.544 17.665 1.00 17.52 O ATOM 344 CB LEU A 48 -10.511 5.012 14.842 1.00 10.55 C ATOM 345 CG LEU A 48 -10.219 4.790 13.357 1.00 12.82 C ATOM 346 CD1 LEU A 48 -9.655 3.399 13.134 1.00 12.52 C ATOM 347 CD2 LEU A 48 -11.480 4.995 12.535 1.00 9.39 C ATOM 348 H LEU A 48 -8.737 6.839 14.881 1.00 0.00 H ATOM 349 N GLU A 49 -12.598 6.275 16.931 1.00 15.78 N ATOM 350 CA GLU A 49 -13.151 6.073 18.263 1.00 19.61 C ATOM 351 C GLU A 49 -13.562 4.613 18.379 1.00 30.51 C ATOM 352 O GLU A 49 -13.474 4.009 19.448 1.00 35.87 O ATOM 353 CB GLU A 49 -14.344 6.999 18.509 1.00 28.94 C ATOM 354 CG GLU A 49 -14.800 7.042 19.957 1.00 31.01 C ATOM 355 CD GLU A 49 -15.772 8.173 20.231 1.00 38.53 C ATOM 356 OE1 GLU A 49 -16.148 8.879 19.273 1.00 41.96 O ATOM 357 OE2 GLU A 49 -16.157 8.359 21.404 1.00 51.97 O ATOM 358 H GLU A 49 -13.239 6.304 16.113 1.00 0.00 H ATOM 359 N LYS A 50 -14.015 4.058 17.260 1.00 25.06 N ATOM 360 CA LYS A 50 -14.209 2.620 17.124 1.00 21.61 C ATOM 361 C LYS A 50 -13.466 2.158 15.877 1.00 14.64 C ATOM 362 O LYS A 50 -13.302 2.929 14.931 1.00 13.75 O ATOM 363 CB LYS A 50 -15.695 2.270 17.027 1.00 27.77 C ATOM 364 CG LYS A 50 -16.432 2.332 18.358 1.00 46.15 C ATOM 365 CD LYS A 50 -17.836 1.753 18.248 1.00 49.19 C ATOM 366 CE LYS A 50 -18.767 2.677 17.481 1.00 61.03 C ATOM 367 NZ LYS A 50 -19.010 3.951 18.215 1.00 65.60 N ATOM 368 HZ1 LYS A 50 -19.443 3.741 19.137 1.00 0.00 H ATOM 369 HZ2 LYS A 50 -18.106 4.444 18.360 1.00 0.00 H ATOM 370 HZ3 LYS A 50 -19.650 4.554 17.659 1.00 0.00 H ATOM 371 H LYS A 50 -14.239 4.672 16.451 1.00 0.00 H ATOM 372 N PRO A 51 -12.989 0.906 15.878 1.00 12.64 N ATOM 373 CA PRO A 51 -12.292 0.398 14.691 1.00 9.90 C ATOM 374 C PRO A 51 -13.202 0.347 13.463 1.00 13.54 C ATOM 375 O PRO A 51 -14.291 -0.223 13.517 1.00 12.34 O ATOM 376 CB PRO A 51 -11.855 -1.013 15.108 1.00 10.68 C ATOM 377 CG PRO A 51 -12.693 -1.357 16.293 1.00 15.10 C ATOM 378 CD PRO A 51 -12.990 -0.067 16.983 1.00 13.81 C ATOM 379 N VAL A 52 -12.748 0.966 12.378 1.00 9.92 N ATOM 380 CA VAL A 52 -13.453 0.955 11.103 1.00 10.46 C ATOM 381 C VAL A 52 -12.483 0.453 10.042 1.00 11.55 C ATOM 382 O VAL A 52 -11.453 1.083 9.787 1.00 9.22 O ATOM 383 CB VAL A 52 -13.949 2.366 10.721 1.00 13.69 C ATOM 384 CG1 VAL A 52 -14.586 2.359 9.335 1.00 9.42 C ATOM 385 CG2 VAL A 52 -14.930 2.886 11.766 1.00 15.30 C ATOM 386 H VAL A 52 -11.847 1.482 12.442 1.00 0.00 H ATOM 387 N LEU A 53 -12.808 -0.684 9.434 1.00 10.74 N ATOM 388 CA LEU A 53 -11.880 -1.359 8.528 1.00 10.13 C ATOM 389 C LEU A 53 -11.482 -0.501 7.331 1.00 10.76 C ATOM 390 O LEU A 53 -10.330 -0.531 6.894 1.00 8.30 O ATOM 391 CB LEU A 53 -12.457 -2.694 8.053 1.00 11.10 C ATOM 392 CG LEU A 53 -11.456 -3.614 7.352 1.00 11.08 C ATOM 393 CD1 LEU A 53 -10.228 -3.818 8.230 1.00 14.08 C ATOM 394 CD2 LEU A 53 -12.101 -4.949 7.016 1.00 13.14 C ATOM 395 H LEU A 53 -13.744 -1.103 9.607 1.00 0.00 H ATOM 396 N ALA A 54 -12.438 0.265 6.813 1.00 10.10 N ATOM 397 CA ALA A 54 -12.190 1.145 5.675 1.00 11.78 C ATOM 398 C ALA A 54 -11.068 2.131 5.974 1.00 8.95 C ATOM 399 O ALA A 54 -10.212 2.384 5.128 1.00 11.63 O ATOM 400 CB ALA A 54 -13.463 1.888 5.288 1.00 15.32 C ATOM 401 H ALA A 54 -13.390 0.236 7.231 1.00 0.00 H ATOM 402 N VAL A 55 -11.074 2.676 7.185 1.00 11.60 N ATOM 403 CA VAL A 55 -10.054 3.633 7.598 1.00 10.56 C ATOM 404 C VAL A 55 -8.685 2.962 7.676 1.00 8.41 C ATOM 405 O VAL A 55 -7.676 3.533 7.258 1.00 6.67 O ATOM 406 CB VAL A 55 -10.406 4.276 8.950 1.00 11.85 C ATOM 407 CG1 VAL A 55 -9.290 5.200 9.412 1.00 14.02 C ATOM 408 CG2 VAL A 55 -11.722 5.035 8.841 1.00 17.65 C ATOM 409 H VAL A 55 -11.825 2.414 7.855 1.00 0.00 H ATOM 410 N GLY A 56 -8.661 1.744 8.206 1.00 8.74 N ATOM 411 CA GLY A 56 -7.443 0.955 8.244 1.00 6.25 C ATOM 412 C GLY A 56 -6.920 0.662 6.850 1.00 7.18 C ATOM 413 O GLY A 56 -5.724 0.788 6.584 1.00 5.94 O ATOM 414 H GLY A 56 -9.536 1.346 8.603 1.00 0.00 H ATOM 415 N ASN A 57 -7.823 0.276 5.954 1.00 5.93 N ATOM 416 CA ASN A 57 -7.446 -0.032 4.578 1.00 7.61 C ATOM 417 C ASN A 57 -6.921 1.184 3.819 1.00 7.71 C ATOM 418 O ASN A 57 -5.995 1.062 3.018 1.00 8.53 O ATOM 419 CB ASN A 57 -8.609 -0.682 3.822 1.00 9.14 C ATOM 420 CG ASN A 57 -8.809 -2.138 4.202 1.00 19.55 C ATOM 421 OD1 ASN A 57 -7.848 -2.859 4.479 1.00 17.16 O ATOM 422 ND2 ASN A 57 -10.063 -2.580 4.217 1.00 17.06 N ATOM 423 HD22 ASN A 57 -10.844 -1.937 3.976 1.00 0.00 H ATOM 424 HD21 ASN A 57 -10.263 -3.569 4.469 1.00 0.00 H ATOM 425 H ASN A 57 -8.819 0.192 6.240 1.00 0.00 H ATOM 426 N VAL A 58 -7.503 2.353 4.075 1.00 7.00 N ATOM 427 CA VAL A 58 -7.018 3.584 3.457 1.00 5.50 C ATOM 428 C VAL A 58 -5.600 3.905 3.923 1.00 8.43 C ATOM 429 O VAL A 58 -4.718 4.174 3.107 1.00 8.04 O ATOM 430 CB VAL A 58 -7.937 4.789 3.748 1.00 9.46 C ATOM 431 CG1 VAL A 58 -7.271 6.085 3.304 1.00 9.82 C ATOM 432 CG2 VAL A 58 -9.279 4.615 3.054 1.00 9.94 C ATOM 433 H VAL A 58 -8.315 2.390 4.724 1.00 0.00 H ATOM 434 N TYR A 59 -5.383 3.869 5.236 1.00 7.27 N ATOM 435 CA TYR A 59 -4.062 4.135 5.802 1.00 7.63 C ATOM 436 C TYR A 59 -3.019 3.160 5.269 1.00 6.20 C ATOM 437 O TYR A 59 -1.921 3.563 4.877 1.00 10.64 O ATOM 438 CB TYR A 59 -4.093 4.065 7.335 1.00 5.29 C ATOM 439 CG TYR A 59 -2.728 4.219 7.980 1.00 6.97 C ATOM 440 CD1 TYR A 59 -1.942 3.108 8.274 1.00 7.29 C ATOM 441 CD2 TYR A 59 -2.223 5.476 8.289 1.00 7.65 C ATOM 442 CE1 TYR A 59 -0.694 3.246 8.857 1.00 7.56 C ATOM 443 CE2 TYR A 59 -0.977 5.624 8.875 1.00 9.18 C ATOM 444 CZ TYR A 59 -0.217 4.508 9.155 1.00 10.32 C ATOM 445 OH TYR A 59 1.020 4.654 9.736 1.00 9.00 O ATOM 446 HH TYR A 59 0.921 5.106 10.611 1.00 0.00 H ATOM 447 H TYR A 59 -6.173 3.646 5.875 1.00 0.00 H ATOM 448 N GLN A 60 -3.361 1.877 5.265 1.00 6.69 N ATOM 449 CA GLN A 60 -2.396 0.848 4.898 1.00 10.62 C ATOM 450 C GLN A 60 -2.117 0.841 3.398 1.00 8.59 C ATOM 451 O GLN A 60 -0.985 0.614 2.975 1.00 7.63 O ATOM 452 CB GLN A 60 -2.854 -0.533 5.371 1.00 10.39 C ATOM 453 CG GLN A 60 -1.716 -1.539 5.466 1.00 6.83 C ATOM 454 CD GLN A 60 -0.553 -1.005 6.287 1.00 9.88 C ATOM 455 OE1 GLN A 60 -0.710 -0.669 7.462 1.00 6.45 O ATOM 456 NE2 GLN A 60 0.619 -0.912 5.666 1.00 4.36 N ATOM 457 HE22 GLN A 60 0.706 -1.207 4.673 1.00 0.00 H ATOM 458 HE21 GLN A 60 1.449 -0.544 6.174 1.00 0.00 H ATOM 459 H GLN A 60 -4.329 1.603 5.527 1.00 0.00 H ATOM 460 N THR A 61 -3.151 1.090 2.600 1.00 10.01 N ATOM 461 CA THR A 61 -2.985 1.182 1.153 1.00 11.53 C ATOM 462 C THR A 61 -2.024 2.312 0.798 1.00 8.48 C ATOM 463 O THR A 61 -1.136 2.140 -0.033 1.00 11.11 O ATOM 464 CB THR A 61 -4.328 1.402 0.436 1.00 7.88 C ATOM 465 OG1 THR A 61 -5.193 0.292 0.697 1.00 7.51 O ATOM 466 CG2 THR A 61 -4.120 1.523 -1.060 1.00 8.68 C ATOM 467 HG1 THR A 61 -5.346 0.217 1.672 1.00 0.00 H ATOM 468 H THR A 61 -4.096 1.222 3.015 1.00 0.00 H ATOM 469 N LEU A 62 -2.201 3.462 1.444 1.00 11.06 N ATOM 470 CA LEU A 62 -1.300 4.598 1.252 1.00 8.31 C ATOM 471 C LEU A 62 0.128 4.260 1.687 1.00 10.77 C ATOM 472 O LEU A 62 1.086 4.561 0.971 1.00 11.04 O ATOM 473 CB LEU A 62 -1.810 5.830 2.007 1.00 7.58 C ATOM 474 CG LEU A 62 -3.071 6.505 1.461 1.00 9.68 C ATOM 475 CD1 LEU A 62 -3.597 7.543 2.443 1.00 8.84 C ATOM 476 CD2 LEU A 62 -2.798 7.141 0.102 1.00 11.10 C ATOM 477 H LEU A 62 -3.001 3.555 2.102 1.00 0.00 H ATOM 478 N ARG A 63 0.264 3.636 2.856 1.00 8.14 N ATOM 479 CA ARG A 63 1.569 3.189 3.340 1.00 10.20 C ATOM 480 C ARG A 63 2.238 2.236 2.353 1.00 11.70 C ATOM 481 O ARG A 63 3.449 2.300 2.142 1.00 15.05 O ATOM 482 CB ARG A 63 1.445 2.503 4.707 1.00 10.96 C ATOM 483 CG ARG A 63 1.254 3.447 5.890 1.00 11.54 C ATOM 484 CD ARG A 63 2.490 4.303 6.156 1.00 13.31 C ATOM 485 NE ARG A 63 3.688 3.511 6.428 1.00 13.12 N ATOM 486 CZ ARG A 63 4.057 3.094 7.637 1.00 14.23 C ATOM 487 NH1 ARG A 63 3.320 3.383 8.701 1.00 11.24 N ATOM 488 NH2 ARG A 63 5.167 2.382 7.782 1.00 14.36 N ATOM 489 HE ARG A 63 4.293 3.256 5.622 1.00 0.00 H ATOM 490 HH12 ARG A 63 3.615 3.054 9.643 1.00 0.00 H ATOM 491 HH11 ARG A 63 2.448 3.939 8.594 1.00 0.00 H ATOM 492 HH22 ARG A 63 5.456 2.056 8.726 1.00 0.00 H ATOM 493 HH21 ARG A 63 5.748 2.150 6.951 1.00 0.00 H ATOM 494 H ARG A 63 -0.580 3.462 3.439 1.00 0.00 H ATOM 495 N ASN A 64 1.442 1.357 1.749 1.00 8.08 N ATOM 496 CA ASN A 64 1.967 0.336 0.844 1.00 13.93 C ATOM 497 C ASN A 64 2.471 0.877 -0.495 1.00 16.89 C ATOM 498 O ASN A 64 3.191 0.186 -1.216 1.00 20.65 O ATOM 499 CB ASN A 64 0.933 -0.773 0.613 1.00 14.77 C ATOM 500 CG ASN A 64 0.707 -1.626 1.850 1.00 12.15 C ATOM 501 OD1 ASN A 64 1.510 -1.610 2.784 1.00 16.97 O ATOM 502 ND2 ASN A 64 -0.387 -2.376 1.861 1.00 11.85 N ATOM 503 HD22 ASN A 64 -1.038 -2.358 1.050 1.00 0.00 H ATOM 504 HD21 ASN A 64 -0.594 -2.982 2.681 1.00 0.00 H ATOM 505 H ASN A 64 0.418 1.398 1.926 1.00 0.00 H ATOM 506 N LEU A 65 2.090 2.108 -0.824 1.00 13.87 N ATOM 507 CA LEU A 65 2.577 2.761 -2.036 1.00 19.29 C ATOM 508 C LEU A 65 4.081 2.984 -1.952 1.00 20.60 C ATOM 509 O LEU A 65 4.765 3.043 -2.974 1.00 26.94 O ATOM 510 CB LEU A 65 1.872 4.103 -2.254 1.00 17.54 C ATOM 511 CG LEU A 65 0.406 4.059 -2.681 1.00 14.92 C ATOM 512 CD1 LEU A 65 -0.167 5.464 -2.765 1.00 14.68 C ATOM 513 CD2 LEU A 65 0.260 3.338 -4.012 1.00 21.04 C ATOM 514 H LEU A 65 1.429 2.618 -0.203 1.00 0.00 H ATOM 515 N GLU A 66 4.575 3.111 -0.722 1.00 23.59 N ATOM 516 CA GLU A 66 5.995 3.333 -0.460 1.00 24.45 C ATOM 517 C GLU A 66 6.540 4.556 -1.190 1.00 30.19 C ATOM 518 O GLU A 66 7.605 4.506 -1.808 1.00 33.85 O ATOM 519 CB GLU A 66 6.816 2.089 -0.803 1.00 28.90 C ATOM 520 CG GLU A 66 6.487 0.881 0.055 1.00 28.09 C ATOM 521 CD GLU A 66 7.398 -0.295 -0.228 1.00 29.81 C ATOM 522 OE1 GLU A 66 8.117 -0.258 -1.248 1.00 34.77 O ATOM 523 OE2 GLU A 66 7.398 -1.253 0.572 1.00 31.28 O ATOM 524 H GLU A 66 3.923 3.050 0.086 1.00 0.00 H ATOM 525 N GLN A 67 5.797 5.654 -1.110 1.00 26.76 N ATOM 526 CA GLN A 67 6.239 6.924 -1.665 1.00 30.20 C ATOM 527 C GLN A 67 6.615 7.831 -0.502 1.00 27.12 C ATOM 528 O GLN A 67 5.846 7.970 0.450 1.00 24.45 O ATOM 529 CB GLN A 67 5.135 7.555 -2.513 1.00 25.86 C ATOM 530 CG GLN A 67 4.692 6.688 -3.684 1.00 27.16 C ATOM 531 CD GLN A 67 3.693 7.386 -4.585 1.00 32.41 C ATOM 532 OE1 GLN A 67 3.467 8.591 -4.467 1.00 39.14 O ATOM 533 NE2 GLN A 67 3.086 6.630 -5.493 1.00 32.68 N ATOM 534 HE22 GLN A 67 3.307 5.616 -5.557 1.00 0.00 H ATOM 535 HE21 GLN A 67 2.389 7.052 -6.139 1.00 0.00 H ATOM 536 H GLN A 67 4.872 5.604 -0.637 1.00 0.00 H ATOM 537 N GLU A 68 7.802 8.427 -0.579 1.00 23.68 N ATOM 538 CA GLU A 68 8.349 9.227 0.516 1.00 28.60 C ATOM 539 C GLU A 68 7.404 10.315 1.013 1.00 23.58 C ATOM 540 O GLU A 68 7.196 10.463 2.217 1.00 18.89 O ATOM 541 CB GLU A 68 9.686 9.855 0.112 1.00 33.91 C ATOM 542 CG GLU A 68 10.224 10.853 1.127 1.00 31.95 C ATOM 543 CD GLU A 68 11.456 11.588 0.636 1.00 44.08 C ATOM 544 OE1 GLU A 68 11.674 12.740 1.069 1.00 46.39 O ATOM 545 OE2 GLU A 68 12.207 11.015 -0.179 1.00 47.57 O ATOM 546 H GLU A 68 8.361 8.320 -1.449 1.00 0.00 H ATOM 547 N THR A 69 6.832 11.072 0.085 1.00 21.65 N ATOM 548 CA THR A 69 5.970 12.193 0.449 1.00 29.77 C ATOM 549 C THR A 69 4.708 11.736 1.176 1.00 21.55 C ATOM 550 O THR A 69 4.273 12.370 2.138 1.00 24.49 O ATOM 551 CB THR A 69 5.581 13.027 -0.782 1.00 31.68 C ATOM 552 OG1 THR A 69 6.768 13.433 -1.473 1.00 35.64 O ATOM 553 CG2 THR A 69 4.798 14.258 -0.364 1.00 24.13 C ATOM 554 HG1 THR A 69 7.271 12.631 -1.761 1.00 0.00 H ATOM 555 H THR A 69 7.001 10.863 -0.920 1.00 0.00 H ATOM 556 N ILE A 70 4.124 10.635 0.714 1.00 20.02 N ATOM 557 CA ILE A 70 2.946 10.072 1.364 1.00 19.54 C ATOM 558 C ILE A 70 3.288 9.566 2.762 1.00 14.00 C ATOM 559 O ILE A 70 2.615 9.902 3.736 1.00 15.57 O ATOM 560 CB ILE A 70 2.341 8.917 0.543 1.00 19.72 C ATOM 561 CG1 ILE A 70 1.922 9.412 -0.842 1.00 25.92 C ATOM 562 CG2 ILE A 70 1.149 8.309 1.273 1.00 16.41 C ATOM 563 CD1 ILE A 70 0.886 10.510 -0.806 1.00 26.51 C ATOM 564 H ILE A 70 4.515 10.166 -0.128 1.00 0.00 H ATOM 565 N THR A 71 4.343 8.761 2.848 1.00 14.34 N ATOM 566 CA THR A 71 4.773 8.175 4.113 1.00 18.32 C ATOM 567 C THR A 71 5.134 9.243 5.139 1.00 14.72 C ATOM 568 O THR A 71 4.736 9.159 6.302 1.00 13.75 O ATOM 569 CB THR A 71 5.980 7.244 3.909 1.00 14.73 C ATOM 570 OG1 THR A 71 5.628 6.206 2.986 1.00 15.68 O ATOM 571 CG2 THR A 71 6.406 6.620 5.231 1.00 15.21 C ATOM 572 HG1 THR A 71 5.370 6.610 2.120 1.00 0.00 H ATOM 573 H THR A 71 4.880 8.542 1.984 1.00 0.00 H ATOM 574 N THR A 72 5.885 10.248 4.698 1.00 17.43 N ATOM 575 CA THR A 72 6.283 11.348 5.568 1.00 13.95 C ATOM 576 C THR A 72 5.063 12.103 6.086 1.00 13.07 C ATOM 577 O THR A 72 4.981 12.427 7.272 1.00 16.14 O ATOM 578 CB THR A 72 7.230 12.326 4.845 1.00 16.73 C ATOM 579 OG1 THR A 72 8.414 11.632 4.434 1.00 27.35 O ATOM 580 CG2 THR A 72 7.618 13.473 5.763 1.00 22.58 C ATOM 581 HG1 THR A 72 8.167 10.896 3.819 1.00 0.00 H ATOM 582 H THR A 72 6.197 10.249 3.706 1.00 0.00 H ATOM 583 N GLN A 73 4.112 12.373 5.196 1.00 11.13 N ATOM 584 CA GLN A 73 2.883 13.058 5.582 1.00 13.62 C ATOM 585 C GLN A 73 2.068 12.234 6.578 1.00 12.92 C ATOM 586 O GLN A 73 1.533 12.772 7.549 1.00 13.17 O ATOM 587 CB GLN A 73 2.035 13.396 4.353 1.00 14.31 C ATOM 588 CG GLN A 73 0.733 14.113 4.686 1.00 23.39 C ATOM 589 CD GLN A 73 -0.013 14.585 3.452 1.00 27.44 C ATOM 590 OE1 GLN A 73 0.516 14.554 2.340 1.00 29.43 O ATOM 591 NE2 GLN A 73 -1.250 15.026 3.643 1.00 22.08 N ATOM 592 HE22 GLN A 73 -1.657 15.034 4.600 1.00 0.00 H ATOM 593 HE21 GLN A 73 -1.812 15.363 2.836 1.00 0.00 H ATOM 594 H GLN A 73 4.247 12.090 4.204 1.00 0.00 H ATOM 595 N LEU A 74 1.978 10.929 6.333 1.00 12.84 N ATOM 596 CA LEU A 74 1.263 10.030 7.234 1.00 9.58 C ATOM 597 C LEU A 74 1.912 10.003 8.616 1.00 9.04 C ATOM 598 O LEU A 74 1.223 10.032 9.637 1.00 10.84 O ATOM 599 CB LEU A 74 1.208 8.617 6.651 1.00 8.78 C ATOM 600 CG LEU A 74 0.313 8.426 5.424 1.00 8.82 C ATOM 601 CD1 LEU A 74 0.435 7.009 4.877 1.00 9.96 C ATOM 602 CD2 LEU A 74 -1.134 8.753 5.757 1.00 8.65 C ATOM 603 H LEU A 74 2.428 10.540 5.480 1.00 0.00 H ATOM 604 N GLN A 75 3.240 9.954 8.638 1.00 11.03 N ATOM 605 CA GLN A 75 3.991 9.918 9.888 1.00 16.50 C ATOM 606 C GLN A 75 3.870 11.235 10.642 1.00 18.78 C ATOM 607 O GLN A 75 3.932 11.266 11.870 1.00 13.64 O ATOM 608 CB GLN A 75 5.464 9.608 9.617 1.00 16.06 C ATOM 609 H GLN A 75 3.759 9.941 7.737 1.00 0.00 H ATOM 610 N ARG A 76 3.700 12.321 9.895 1.00 21.70 N ATOM 611 CA ARG A 76 3.611 13.652 10.482 1.00 14.50 C ATOM 612 C ARG A 76 2.216 13.927 11.038 1.00 13.92 C ATOM 613 O ARG A 76 2.068 14.467 12.134 1.00 14.25 O ATOM 614 CB ARG A 76 3.986 14.713 9.444 1.00 21.40 C ATOM 615 CG ARG A 76 3.907 16.137 9.959 1.00 27.54 C ATOM 616 CD ARG A 76 4.344 17.143 8.905 1.00 30.03 C ATOM 617 NE ARG A 76 3.445 17.177 7.754 1.00 24.85 N ATOM 618 CZ ARG A 76 3.791 16.811 6.523 1.00 21.46 C ATOM 619 NH1 ARG A 76 5.022 16.387 6.274 1.00 25.81 N ATOM 620 NH2 ARG A 76 2.906 16.875 5.537 1.00 21.76 N ATOM 621 HE ARG A 76 2.471 17.509 7.907 1.00 0.00 H ATOM 622 HH12 ARG A 76 5.289 16.102 5.310 1.00 0.00 H ATOM 623 HH11 ARG A 76 5.721 16.340 7.043 1.00 0.00 H ATOM 624 HH22 ARG A 76 3.178 16.589 4.575 1.00 0.00 H ATOM 625 HH21 ARG A 76 1.940 17.212 5.726 1.00 0.00 H ATOM 626 H ARG A 76 3.628 12.218 8.863 1.00 0.00 H ATOM 627 N ASN A 77 1.195 13.553 10.276 1.00 13.76 N ATOM 628 CA ASN A 77 -0.187 13.759 10.695 1.00 12.47 C ATOM 629 C ASN A 77 -0.650 12.710 11.696 1.00 13.00 C ATOM 630 O ASN A 77 -1.433 13.004 12.604 1.00 8.11 O ATOM 631 CB ASN A 77 -1.121 13.756 9.484 1.00 15.68 C ATOM 632 CG ASN A 77 -1.086 15.060 8.715 1.00 30.48 C ATOM 633 OD1 ASN A 77 -1.936 15.929 8.909 1.00 41.00 O ATOM 634 ND2 ASN A 77 -0.101 15.205 7.838 1.00 21.75 N ATOM 635 HD22 ASN A 77 0.595 14.444 7.707 1.00 0.00 H ATOM 636 HD21 ASN A 77 -0.025 16.080 7.281 1.00 0.00 H ATOM 637 H ASN A 77 1.385 13.102 9.358 1.00 0.00 H ATOM 638 N TYR A 78 -0.165 11.484 11.519 1.00 8.15 N ATOM 639 CA TYR A 78 -0.585 10.361 12.351 1.00 8.00 C ATOM 640 C TYR A 78 0.621 9.582 12.871 1.00 9.00 C ATOM 641 O TYR A 78 0.860 8.447 12.456 1.00 9.83 O ATOM 642 CB TYR A 78 -1.508 9.444 11.547 1.00 8.70 C ATOM 643 CG TYR A 78 -2.516 10.214 10.727 1.00 12.23 C ATOM 644 CD1 TYR A 78 -3.502 10.970 11.345 1.00 14.38 C ATOM 645 CD2 TYR A 78 -2.469 10.208 9.338 1.00 18.43 C ATOM 646 CE1 TYR A 78 -4.422 11.687 10.610 1.00 17.67 C ATOM 647 CE2 TYR A 78 -3.389 10.926 8.590 1.00 14.86 C ATOM 648 CZ TYR A 78 -4.363 11.663 9.235 1.00 19.17 C ATOM 649 OH TYR A 78 -5.284 12.381 8.511 1.00 19.85 O ATOM 650 HH TYR A 78 -4.814 13.049 7.951 1.00 0.00 H ATOM 651 H TYR A 78 0.534 11.321 10.766 1.00 0.00 H ATOM 652 N PRO A 79 1.378 10.188 13.797 1.00 7.09 N ATOM 653 CA PRO A 79 2.630 9.592 14.275 1.00 10.22 C ATOM 654 C PRO A 79 2.410 8.309 15.075 1.00 6.49 C ATOM 655 O PRO A 79 3.313 7.476 15.132 1.00 12.28 O ATOM 656 CB PRO A 79 3.225 10.690 15.159 1.00 8.13 C ATOM 657 CG PRO A 79 2.051 11.476 15.623 1.00 10.62 C ATOM 658 CD PRO A 79 1.060 11.446 14.495 1.00 10.05 C ATOM 659 N THR A 80 1.231 8.150 15.670 1.00 7.85 N ATOM 660 CA THR A 80 0.909 6.932 16.412 1.00 7.26 C ATOM 661 C THR A 80 -0.144 6.085 15.697 1.00 6.62 C ATOM 662 O THR A 80 -0.796 5.240 16.310 1.00 7.69 O ATOM 663 CB THR A 80 0.420 7.237 17.846 1.00 8.86 C ATOM 664 OG1 THR A 80 -0.820 7.954 17.793 1.00 6.82 O ATOM 665 CG2 THR A 80 1.456 8.059 18.609 1.00 8.76 C ATOM 666 HG1 THR A 80 -1.498 7.405 17.325 1.00 0.00 H ATOM 667 H THR A 80 0.523 8.909 15.606 1.00 0.00 H ATOM 668 N GLY A 81 -0.303 6.308 14.397 1.00 7.24 N ATOM 669 CA GLY A 81 -1.265 5.555 13.614 1.00 5.51 C ATOM 670 C GLY A 81 -2.653 6.161 13.662 1.00 7.86 C ATOM 671 O GLY A 81 -2.819 7.328 14.020 1.00 4.26 O ATOM 672 H GLY A 81 0.274 7.037 13.931 1.00 0.00 H ATOM 673 N ILE A 82 -3.656 5.363 13.311 1.00 4.75 N ATOM 674 CA ILE A 82 -5.026 5.855 13.211 1.00 7.49 C ATOM 675 C ILE A 82 -5.897 5.477 14.408 1.00 5.57 C ATOM 676 O ILE A 82 -7.054 5.890 14.491 1.00 9.84 O ATOM 677 CB ILE A 82 -5.712 5.319 11.943 1.00 8.94 C ATOM 678 CG1 ILE A 82 -5.838 3.797 12.021 1.00 11.29 C ATOM 679 CG2 ILE A 82 -4.940 5.737 10.701 1.00 8.68 C ATOM 680 CD1 ILE A 82 -6.526 3.184 10.832 1.00 9.59 C ATOM 681 H ILE A 82 -3.460 4.363 13.102 1.00 0.00 H ATOM 682 N PHE A 83 -5.344 4.693 15.328 1.00 6.38 N ATOM 683 CA PHE A 83 -6.114 4.179 16.460 1.00 6.85 C ATOM 684 C PHE A 83 -5.408 4.495 17.777 1.00 8.05 C ATOM 685 O PHE A 83 -4.201 4.285 17.898 1.00 5.42 O ATOM 686 CB PHE A 83 -6.321 2.667 16.311 1.00 7.09 C ATOM 687 CG PHE A 83 -7.392 2.106 17.204 1.00 7.40 C ATOM 688 CD1 PHE A 83 -8.728 2.199 16.848 1.00 9.84 C ATOM 689 CD2 PHE A 83 -7.064 1.478 18.397 1.00 7.00 C ATOM 690 CE1 PHE A 83 -9.719 1.682 17.667 1.00 10.41 C ATOM 691 CE2 PHE A 83 -8.049 0.959 19.219 1.00 8.85 C ATOM 692 CZ PHE A 83 -9.378 1.060 18.852 1.00 10.35 C ATOM 693 H PHE A 83 -4.339 4.439 15.241 1.00 0.00 H ATOM 694 N PRO A 84 -6.160 5.009 18.766 1.00 7.20 N ATOM 695 CA PRO A 84 -5.595 5.399 20.063 1.00 10.37 C ATOM 696 C PRO A 84 -4.894 4.229 20.737 1.00 7.49 C ATOM 697 O PRO A 84 -5.485 3.159 20.879 1.00 3.88 O ATOM 698 CB PRO A 84 -6.829 5.812 20.871 1.00 13.45 C ATOM 699 CG PRO A 84 -7.834 6.206 19.843 1.00 15.43 C ATOM 700 CD PRO A 84 -7.610 5.256 18.704 1.00 8.14 C ATOM 701 N LEU A 85 -3.641 4.433 21.131 1.00 5.12 N ATOM 702 CA LEU A 85 -2.842 3.368 21.727 1.00 5.12 C ATOM 703 C LEU A 85 -3.062 3.311 23.235 1.00 8.04 C ATOM 704 O LEU A 85 -2.157 3.597 24.021 1.00 5.77 O ATOM 705 CB LEU A 85 -1.361 3.573 21.404 1.00 4.94 C ATOM 706 CG LEU A 85 -1.037 3.681 19.911 1.00 3.26 C ATOM 707 CD1 LEU A 85 0.457 3.880 19.685 1.00 4.81 C ATOM 708 CD2 LEU A 85 -1.537 2.452 19.165 1.00 4.60 C ATOM 709 H LEU A 85 -3.219 5.376 21.011 1.00 0.00 H ATOM 710 N GLN A 86 -4.274 2.931 23.628 1.00 5.90 N ATOM 711 CA GLN A 86 -4.677 2.951 25.028 1.00 6.37 C ATOM 712 C GLN A 86 -4.293 1.683 25.782 1.00 9.69 C ATOM 713 O GLN A 86 -4.338 0.578 25.240 1.00 5.95 O ATOM 714 CB GLN A 86 -6.184 3.189 25.146 1.00 7.15 C ATOM 715 CG GLN A 86 -6.631 4.549 24.649 1.00 9.48 C ATOM 716 CD GLN A 86 -8.136 4.707 24.676 1.00 13.28 C ATOM 717 OE1 GLN A 86 -8.862 3.958 24.023 1.00 25.56 O ATOM 718 NE2 GLN A 86 -8.614 5.679 25.438 1.00 14.49 N ATOM 719 HE22 GLN A 86 -7.963 6.288 25.973 1.00 0.00 H ATOM 720 HE21 GLN A 86 -9.641 5.833 25.501 1.00 0.00 H ATOM 721 H GLN A 86 -4.957 2.609 22.913 1.00 0.00 H ATOM 722 N SER A 87 -3.923 1.860 27.044 1.00 5.60 N ATOM 723 CA SER A 87 -3.520 0.750 27.894 1.00 6.37 C ATOM 724 C SER A 87 -3.978 1.005 29.322 1.00 7.07 C ATOM 725 O SER A 87 -3.784 2.096 29.859 1.00 8.90 O ATOM 726 CB SER A 87 -2.000 0.578 27.863 1.00 5.21 C ATOM 727 OG SER A 87 -1.578 -0.402 28.801 1.00 7.90 O ATOM 728 HG SER A 87 -2.000 -1.270 28.582 1.00 0.00 H ATOM 729 H SER A 87 -3.921 2.822 27.438 1.00 0.00 H ATOM 730 N ALA A 88 -4.585 -0.005 29.935 1.00 5.75 N ATOM 731 CA ALA A 88 -5.021 0.105 31.318 1.00 7.64 C ATOM 732 C ALA A 88 -3.824 0.026 32.258 1.00 6.70 C ATOM 733 O ALA A 88 -3.950 0.272 33.456 1.00 5.37 O ATOM 734 CB ALA A 88 -6.032 -0.982 31.646 1.00 6.91 C ATOM 735 H ALA A 88 -4.752 -0.891 29.416 1.00 0.00 H ATOM 736 N GLN A 89 -2.662 -0.313 31.707 1.00 5.41 N ATOM 737 CA GLN A 89 -1.445 -0.447 32.498 1.00 7.64 C ATOM 738 C GLN A 89 -0.328 0.480 32.023 1.00 7.16 C ATOM 739 O GLN A 89 0.815 0.357 32.456 1.00 8.57 O ATOM 740 CB GLN A 89 -0.960 -1.898 32.490 1.00 8.16 C ATOM 741 CG GLN A 89 -1.767 -2.820 33.387 1.00 7.30 C ATOM 742 CD GLN A 89 -1.615 -2.476 34.857 1.00 13.99 C ATOM 743 OE1 GLN A 89 -0.618 -1.881 35.269 1.00 9.67 O ATOM 744 NE2 GLN A 89 -2.609 -2.846 35.657 1.00 12.14 N ATOM 745 HE22 GLN A 89 -3.432 -3.347 35.266 1.00 0.00 H ATOM 746 HE21 GLN A 89 -2.564 -2.635 36.674 1.00 0.00 H ATOM 747 H GLN A 89 -2.620 -0.487 30.683 1.00 0.00 H ATOM 748 N GLY A 90 -0.661 1.402 31.125 1.00 8.16 N ATOM 749 CA GLY A 90 0.303 2.376 30.637 1.00 6.27 C ATOM 750 C GLY A 90 1.356 1.825 29.694 1.00 6.34 C ATOM 751 O GLY A 90 2.406 2.433 29.496 1.00 7.34 O ATOM 752 H GLY A 90 -1.635 1.428 30.762 1.00 0.00 H ATOM 753 N ILE A 91 1.067 0.670 29.107 1.00 5.00 N ATOM 754 CA ILE A 91 1.969 0.017 28.162 1.00 5.29 C ATOM 755 C ILE A 91 2.093 0.814 26.861 1.00 3.84 C ATOM 756 O ILE A 91 1.128 1.429 26.405 1.00 3.50 O ATOM 757 CB ILE A 91 1.486 -1.426 27.873 1.00 7.06 C ATOM 758 CG1 ILE A 91 1.530 -2.255 29.156 1.00 8.71 C ATOM 759 CG2 ILE A 91 2.310 -2.092 26.779 1.00 6.07 C ATOM 760 CD1 ILE A 91 1.039 -3.673 28.978 1.00 8.75 C ATOM 761 H ILE A 91 0.161 0.211 29.329 1.00 0.00 H ATOM 762 N ASP A 92 3.290 0.813 26.279 1.00 2.60 N ATOM 763 CA ASP A 92 3.540 1.484 25.006 1.00 4.43 C ATOM 764 C ASP A 92 3.307 0.536 23.827 1.00 5.93 C ATOM 765 O ASP A 92 4.013 -0.460 23.672 1.00 3.86 O ATOM 766 CB ASP A 92 4.971 2.028 24.974 1.00 6.26 C ATOM 767 CG ASP A 92 5.324 2.681 23.649 1.00 5.48 C ATOM 768 OD1 ASP A 92 4.404 3.102 22.918 1.00 4.74 O ATOM 769 OD2 ASP A 92 6.530 2.775 23.341 1.00 10.43 O ATOM 770 H ASP A 92 4.075 0.317 26.747 1.00 0.00 H ATOM 771 N TYR A 93 2.321 0.857 22.995 1.00 3.99 N ATOM 772 CA TYR A 93 1.969 0.006 21.863 1.00 6.03 C ATOM 773 C TYR A 93 2.420 0.561 20.512 1.00 4.90 C ATOM 774 O TYR A 93 2.071 0.015 19.468 1.00 7.32 O ATOM 775 CB TYR A 93 0.461 -0.268 21.840 1.00 5.24 C ATOM 776 CG TYR A 93 0.003 -1.190 22.948 1.00 6.52 C ATOM 777 CD1 TYR A 93 0.426 -2.512 22.990 1.00 6.13 C ATOM 778 CD2 TYR A 93 -0.853 -0.741 23.947 1.00 4.53 C ATOM 779 CE1 TYR A 93 0.015 -3.362 23.997 1.00 6.80 C ATOM 780 CE2 TYR A 93 -1.270 -1.587 24.964 1.00 3.72 C ATOM 781 CZ TYR A 93 -0.832 -2.896 24.981 1.00 3.09 C ATOM 782 OH TYR A 93 -1.236 -3.749 25.983 1.00 5.96 O ATOM 783 HH TYR A 93 -0.945 -3.389 26.858 1.00 0.00 H ATOM 784 H TYR A 93 1.788 1.736 23.155 1.00 0.00 H ATOM 785 N LEU A 94 3.189 1.644 20.530 1.00 4.25 N ATOM 786 CA LEU A 94 3.692 2.224 19.285 1.00 4.01 C ATOM 787 C LEU A 94 4.599 1.282 18.474 1.00 6.11 C ATOM 788 O LEU A 94 4.443 1.191 17.256 1.00 4.72 O ATOM 789 CB LEU A 94 4.370 3.578 19.526 1.00 4.24 C ATOM 790 CG LEU A 94 4.887 4.288 18.269 1.00 8.70 C ATOM 791 CD1 LEU A 94 3.754 4.522 17.277 1.00 6.04 C ATOM 792 CD2 LEU A 94 5.574 5.602 18.617 1.00 9.00 C ATOM 793 H LEU A 94 3.436 2.084 21.439 1.00 0.00 H ATOM 794 N PRO A 95 5.549 0.586 19.132 1.00 7.15 N ATOM 795 CA PRO A 95 6.348 -0.367 18.348 1.00 7.99 C ATOM 796 C PRO A 95 5.504 -1.435 17.647 1.00 5.00 C ATOM 797 O PRO A 95 5.869 -1.882 16.561 1.00 4.64 O ATOM 798 CB PRO A 95 7.250 -1.011 19.403 1.00 5.91 C ATOM 799 CG PRO A 95 7.415 0.050 20.434 1.00 8.23 C ATOM 800 CD PRO A 95 6.070 0.723 20.507 1.00 6.69 C ATOM 801 N LEU A 96 4.391 -1.831 18.255 1.00 4.14 N ATOM 802 CA LEU A 96 3.481 -2.772 17.613 1.00 4.65 C ATOM 803 C LEU A 96 2.820 -2.127 16.397 1.00 6.17 C ATOM 804 O LEU A 96 2.779 -2.718 15.315 1.00 4.62 O ATOM 805 CB LEU A 96 2.418 -3.262 18.597 1.00 2.88 C ATOM 806 CG LEU A 96 1.390 -4.242 18.024 1.00 4.59 C ATOM 807 CD1 LEU A 96 2.081 -5.449 17.386 1.00 4.08 C ATOM 808 CD2 LEU A 96 0.408 -4.683 19.105 1.00 2.23 C ATOM 809 H LEU A 96 4.166 -1.465 19.202 1.00 0.00 H ATOM 810 N GLN A 97 2.303 -0.916 16.581 1.00 4.94 N ATOM 811 CA GLN A 97 1.689 -0.176 15.483 1.00 3.85 C ATOM 812 C GLN A 97 2.684 0.031 14.348 1.00 4.66 C ATOM 813 O GLN A 97 2.333 -0.098 13.175 1.00 5.13 O ATOM 814 CB GLN A 97 1.159 1.175 15.970 1.00 6.23 C ATOM 815 CG GLN A 97 0.258 1.901 14.965 1.00 4.13 C ATOM 816 CD GLN A 97 1.034 2.616 13.874 1.00 6.70 C ATOM 817 OE1 GLN A 97 2.193 2.988 14.063 1.00 7.96 O ATOM 818 NE2 GLN A 97 0.401 2.803 12.720 1.00 5.88 N ATOM 819 HE22 GLN A 97 -0.578 2.472 12.604 1.00 0.00 H ATOM 820 HE21 GLN A 97 0.885 3.280 11.933 1.00 0.00 H ATOM 821 H GLN A 97 2.337 -0.487 17.528 1.00 0.00 H ATOM 822 N GLU A 98 3.923 0.358 14.700 1.00 3.63 N ATOM 823 CA GLU A 98 4.947 0.624 13.695 1.00 6.78 C ATOM 824 C GLU A 98 5.291 -0.622 12.876 1.00 6.04 C ATOM 825 O GLU A 98 5.471 -0.545 11.660 1.00 5.62 O ATOM 826 CB GLU A 98 6.196 1.234 14.340 1.00 9.17 C ATOM 827 CG GLU A 98 5.997 2.678 14.784 1.00 11.48 C ATOM 828 CD GLU A 98 7.213 3.262 15.481 1.00 14.96 C ATOM 829 OE1 GLU A 98 8.032 2.485 16.012 1.00 20.50 O ATOM 830 OE2 GLU A 98 7.347 4.503 15.498 1.00 23.84 O ATOM 831 H GLU A 98 4.167 0.425 15.709 1.00 0.00 H ATOM 832 N ALA A 99 5.361 -1.770 13.544 1.00 4.05 N ATOM 833 CA ALA A 99 5.615 -3.033 12.857 1.00 7.83 C ATOM 834 C ALA A 99 4.477 -3.389 11.901 1.00 7.24 C ATOM 835 O ALA A 99 4.715 -3.793 10.763 1.00 5.16 O ATOM 836 CB ALA A 99 5.839 -4.156 13.865 1.00 5.09 C ATOM 837 H ALA A 99 5.232 -1.768 14.576 1.00 0.00 H ATOM 838 N LEU A 100 3.240 -3.241 12.367 1.00 3.70 N ATOM 839 CA LEU A 100 2.077 -3.516 11.526 1.00 4.92 C ATOM 840 C LEU A 100 1.964 -2.508 10.381 1.00 6.03 C ATOM 841 O LEU A 100 1.604 -2.868 9.261 1.00 4.91 O ATOM 842 CB LEU A 100 0.795 -3.529 12.365 1.00 4.17 C ATOM 843 CG LEU A 100 0.688 -4.707 13.337 1.00 4.77 C ATOM 844 CD1 LEU A 100 -0.407 -4.481 14.370 1.00 2.52 C ATOM 845 CD2 LEU A 100 0.442 -5.991 12.563 1.00 4.90 C ATOM 846 H LEU A 100 3.098 -2.924 13.347 1.00 0.00 H ATOM 847 N GLY A 101 2.285 -1.250 10.665 1.00 7.63 N ATOM 848 CA GLY A 101 2.266 -0.214 9.647 1.00 7.23 C ATOM 849 C GLY A 101 3.270 -0.489 8.545 1.00 7.50 C ATOM 850 O GLY A 101 3.078 -0.082 7.399 1.00 11.73 O ATOM 851 H GLY A 101 2.556 -1.002 11.638 1.00 0.00 H ATOM 852 N SER A 102 4.348 -1.185 8.894 1.00 6.04 N ATOM 853 CA SER A 102 5.371 -1.551 7.923 1.00 10.81 C ATOM 854 C SER A 102 5.076 -2.916 7.312 1.00 9.05 C ATOM 855 O SER A 102 5.825 -3.398 6.466 1.00 9.82 O ATOM 856 CB SER A 102 6.756 -1.558 8.573 1.00 9.65 C ATOM 857 OG SER A 102 7.134 -0.257 8.986 1.00 11.64 O ATOM 858 HG SER A 102 6.477 0.083 9.644 1.00 0.00 H ATOM 859 H SER A 102 4.464 -1.476 9.886 1.00 0.00 H ATOM 860 N GLN A 103 3.978 -3.526 7.751 1.00 6.70 N ATOM 861 CA GLN A 103 3.564 -4.853 7.296 1.00 6.51 C ATOM 862 C GLN A 103 4.614 -5.910 7.631 1.00 11.12 C ATOM 863 O GLN A 103 4.757 -6.910 6.926 1.00 11.10 O ATOM 864 CB GLN A 103 3.234 -4.852 5.798 1.00 7.64 C ATOM 865 CG GLN A 103 2.110 -3.900 5.405 1.00 8.35 C ATOM 866 CD GLN A 103 0.734 -4.404 5.817 1.00 9.63 C ATOM 867 OE1 GLN A 103 0.102 -5.175 5.095 1.00 9.83 O ATOM 868 NE2 GLN A 103 0.265 -3.966 6.979 1.00 6.72 N ATOM 869 HE22 GLN A 103 0.834 -3.315 7.557 1.00 0.00 H ATOM 870 HE21 GLN A 103 -0.671 -4.274 7.311 1.00 0.00 H ATOM 871 H GLN A 103 3.386 -3.036 8.451 1.00 0.00 H ATOM 872 N ASP A 104 5.348 -5.672 8.714 1.00 6.44 N ATOM 873 CA ASP A 104 6.313 -6.632 9.226 1.00 9.04 C ATOM 874 C ASP A 104 5.598 -7.494 10.254 1.00 8.65 C ATOM 875 O ASP A 104 5.757 -7.302 11.459 1.00 5.02 O ATOM 876 CB ASP A 104 7.493 -5.907 9.873 1.00 6.57 C ATOM 877 CG ASP A 104 8.618 -6.848 10.269 1.00 11.57 C ATOM 878 OD1 ASP A 104 8.437 -8.081 10.175 1.00 10.32 O ATOM 879 OD2 ASP A 104 9.684 -6.350 10.692 1.00 12.62 O ATOM 880 H ASP A 104 5.228 -4.767 9.213 1.00 0.00 H ATOM 881 N PHE A 105 4.801 -8.439 9.771 1.00 10.66 N ATOM 882 CA PHE A 105 3.958 -9.234 10.652 1.00 5.88 C ATOM 883 C PHE A 105 4.749 -10.142 11.590 1.00 8.25 C ATOM 884 O PHE A 105 4.296 -10.434 12.698 1.00 6.26 O ATOM 885 CB PHE A 105 2.944 -10.037 9.837 1.00 9.73 C ATOM 886 CG PHE A 105 2.006 -9.181 9.041 1.00 9.47 C ATOM 887 CD1 PHE A 105 1.008 -8.454 9.674 1.00 6.21 C ATOM 888 CD2 PHE A 105 2.124 -9.093 7.663 1.00 5.09 C ATOM 889 CE1 PHE A 105 0.144 -7.658 8.948 1.00 4.95 C ATOM 890 CE2 PHE A 105 1.262 -8.298 6.930 1.00 7.55 C ATOM 891 CZ PHE A 105 0.271 -7.579 7.573 1.00 7.00 C ATOM 892 H PHE A 105 4.778 -8.614 8.746 1.00 0.00 H ATOM 893 N GLU A 106 5.927 -10.584 11.159 1.00 5.87 N ATOM 894 CA GLU A 106 6.747 -11.432 12.019 1.00 9.59 C ATOM 895 C GLU A 106 7.201 -10.667 13.259 1.00 7.67 C ATOM 896 O GLU A 106 7.109 -11.172 14.379 1.00 6.07 O ATOM 897 CB GLU A 106 7.948 -12.016 11.269 1.00 12.35 C ATOM 898 CG GLU A 106 8.718 -13.043 12.090 1.00 13.40 C ATOM 899 CD GLU A 106 9.799 -13.759 11.298 1.00 17.98 C ATOM 900 OE1 GLU A 106 10.131 -13.304 10.184 1.00 19.88 O ATOM 901 OE2 GLU A 106 10.317 -14.782 11.794 1.00 20.18 O ATOM 902 H GLU A 106 6.264 -10.326 10.210 1.00 0.00 H ATOM 903 N THR A 107 7.674 -9.442 13.056 1.00 6.83 N ATOM 904 CA THR A 107 8.072 -8.593 14.173 1.00 7.58 C ATOM 905 C THR A 107 6.865 -8.242 15.039 1.00 2.95 C ATOM 906 O THR A 107 6.937 -8.284 16.267 1.00 4.77 O ATOM 907 CB THR A 107 8.776 -7.307 13.689 1.00 7.33 C ATOM 908 OG1 THR A 107 10.037 -7.649 13.099 1.00 7.91 O ATOM 909 CG2 THR A 107 9.013 -6.346 14.847 1.00 5.93 C ATOM 910 HG1 THR A 107 10.603 -8.103 13.773 1.00 0.00 H ATOM 911 H THR A 107 7.762 -9.083 12.084 1.00 0.00 H ATOM 912 N ALA A 108 5.753 -7.906 14.393 1.00 6.00 N ATOM 913 CA ALA A 108 4.523 -7.584 15.108 1.00 3.77 C ATOM 914 C ALA A 108 4.087 -8.745 16.001 1.00 3.25 C ATOM 915 O ALA A 108 3.642 -8.537 17.129 1.00 2.59 O ATOM 916 CB ALA A 108 3.419 -7.216 14.130 1.00 2.58 C ATOM 917 H ALA A 108 5.760 -7.872 13.354 1.00 0.00 H ATOM 918 N ASP A 109 4.229 -9.965 15.494 1.00 1.67 N ATOM 919 CA ASP A 109 3.908 -11.162 16.268 1.00 3.27 C ATOM 920 C ASP A 109 4.789 -11.264 17.514 1.00 5.33 C ATOM 921 O ASP A 109 4.304 -11.552 18.608 1.00 3.49 O ATOM 922 CB ASP A 109 4.073 -12.417 15.407 1.00 5.37 C ATOM 923 CG ASP A 109 3.546 -13.666 16.089 1.00 6.49 C ATOM 924 OD1 ASP A 109 2.370 -13.663 16.509 1.00 7.71 O ATOM 925 OD2 ASP A 109 4.307 -14.647 16.211 1.00 10.17 O ATOM 926 H ASP A 109 4.578 -10.071 14.520 1.00 0.00 H ATOM 927 N GLU A 110 6.085 -11.018 17.341 1.00 4.67 N ATOM 928 CA GLU A 110 7.035 -11.083 18.450 1.00 6.79 C ATOM 929 C GLU A 110 6.719 -10.033 19.513 1.00 4.00 C ATOM 930 O GLU A 110 6.744 -10.320 20.711 1.00 5.33 O ATOM 931 CB GLU A 110 8.469 -10.911 17.937 1.00 5.27 C ATOM 932 CG GLU A 110 8.895 -11.995 16.954 1.00 8.51 C ATOM 933 CD GLU A 110 10.240 -11.718 16.303 1.00 22.52 C ATOM 934 OE1 GLU A 110 10.808 -10.628 16.534 1.00 18.53 O ATOM 935 OE2 GLU A 110 10.730 -12.594 15.558 1.00 22.90 O ATOM 936 H GLU A 110 6.431 -10.773 16.391 1.00 0.00 H ATOM 937 N ILE A 111 6.419 -8.821 19.061 1.00 3.70 N ATOM 938 CA ILE A 111 6.066 -7.727 19.960 1.00 5.64 C ATOM 939 C ILE A 111 4.801 -8.049 20.747 1.00 5.39 C ATOM 940 O ILE A 111 4.748 -7.857 21.963 1.00 5.05 O ATOM 941 CB ILE A 111 5.883 -6.402 19.185 1.00 4.96 C ATOM 942 CG1 ILE A 111 7.222 -5.951 18.591 1.00 7.52 C ATOM 943 CG2 ILE A 111 5.303 -5.317 20.089 1.00 4.87 C ATOM 944 CD1 ILE A 111 7.115 -4.731 17.692 1.00 6.33 C ATOM 945 H ILE A 111 6.436 -8.646 18.036 1.00 0.00 H ATOM 946 N THR A 112 3.786 -8.547 20.049 1.00 3.52 N ATOM 947 CA THR A 112 2.518 -8.899 20.682 1.00 2.94 C ATOM 948 C THR A 112 2.711 -9.924 21.798 1.00 3.30 C ATOM 949 O THR A 112 2.146 -9.788 22.882 1.00 3.72 O ATOM 950 CB THR A 112 1.510 -9.430 19.647 1.00 2.88 C ATOM 951 OG1 THR A 112 1.279 -8.424 18.652 1.00 3.07 O ATOM 952 CG2 THR A 112 0.192 -9.783 20.318 1.00 3.11 C ATOM 953 HG1 THR A 112 2.133 -8.205 18.202 1.00 0.00 H ATOM 954 H THR A 112 3.898 -8.690 19.025 1.00 0.00 H ATOM 955 N ARG A 113 3.524 -10.941 21.527 1.00 4.21 N ATOM 956 CA ARG A 113 3.843 -11.967 22.515 1.00 7.01 C ATOM 957 C ARG A 113 4.517 -11.349 23.739 1.00 8.92 C ATOM 958 O ARG A 113 4.180 -11.667 24.880 1.00 7.34 O ATOM 959 CB ARG A 113 4.751 -13.028 21.889 1.00 8.65 C ATOM 960 CG ARG A 113 4.933 -14.287 22.721 1.00 11.37 C ATOM 961 CD ARG A 113 5.537 -15.413 21.887 1.00 11.77 C ATOM 962 NE ARG A 113 4.687 -15.769 20.753 1.00 10.45 N ATOM 963 CZ ARG A 113 4.906 -15.384 19.498 1.00 11.14 C ATOM 964 NH1 ARG A 113 5.959 -14.633 19.203 1.00 8.37 N ATOM 965 NH2 ARG A 113 4.071 -15.752 18.537 1.00 9.31 N ATOM 966 HE ARG A 113 3.854 -16.364 20.939 1.00 0.00 H ATOM 967 HH12 ARG A 113 6.126 -14.335 18.221 1.00 0.00 H ATOM 968 HH11 ARG A 113 6.617 -14.343 19.954 1.00 0.00 H ATOM 969 HH22 ARG A 113 4.242 -15.451 17.556 1.00 0.00 H ATOM 970 HH21 ARG A 113 3.245 -16.342 18.764 1.00 0.00 H ATOM 971 H ARG A 113 3.947 -11.008 20.579 1.00 0.00 H ATOM 972 N ASP A 114 5.470 -10.458 23.492 1.00 7.59 N ATOM 973 CA ASP A 114 6.167 -9.771 24.573 1.00 9.34 C ATOM 974 C ASP A 114 5.229 -8.849 25.350 1.00 8.01 C ATOM 975 O ASP A 114 5.308 -8.762 26.575 1.00 8.24 O ATOM 976 CB ASP A 114 7.359 -8.986 24.026 1.00 8.84 C ATOM 977 CG ASP A 114 8.482 -9.889 23.555 1.00 10.77 C ATOM 978 OD1 ASP A 114 9.562 -9.368 23.209 1.00 13.03 O ATOM 979 OD2 ASP A 114 8.287 -11.122 23.539 1.00 10.78 O ATOM 980 H ASP A 114 5.725 -10.246 22.506 1.00 0.00 H ATOM 981 N LYS A 115 4.337 -8.169 24.638 1.00 5.97 N ATOM 982 CA LYS A 115 3.395 -7.255 25.277 1.00 7.22 C ATOM 983 C LYS A 115 2.389 -7.973 26.178 1.00 6.07 C ATOM 984 O LYS A 115 1.995 -7.449 27.220 1.00 6.00 O ATOM 985 CB LYS A 115 2.669 -6.406 24.230 1.00 6.50 C ATOM 986 CG LYS A 115 3.184 -4.979 24.133 1.00 14.15 C ATOM 987 CD LYS A 115 4.617 -4.938 23.652 1.00 17.99 C ATOM 988 CE LYS A 115 5.489 -4.084 24.558 1.00 18.15 C ATOM 989 NZ LYS A 115 4.964 -2.705 24.735 1.00 19.95 N ATOM 990 HZ1 LYS A 115 4.912 -2.234 23.809 1.00 0.00 H ATOM 991 HZ2 LYS A 115 4.015 -2.748 25.158 1.00 0.00 H ATOM 992 HZ3 LYS A 115 5.600 -2.171 25.362 1.00 0.00 H ATOM 993 H LYS A 115 4.309 -8.290 23.605 1.00 0.00 H ATOM 994 N LEU A 116 1.975 -9.172 25.781 1.00 3.68 N ATOM 995 CA LEU A 116 1.032 -9.935 26.591 1.00 3.89 C ATOM 996 C LEU A 116 1.662 -10.357 27.919 1.00 5.72 C ATOM 997 O LEU A 116 1.003 -10.340 28.958 1.00 6.33 O ATOM 998 CB LEU A 116 0.488 -11.141 25.821 1.00 4.27 C ATOM 999 CG LEU A 116 -0.458 -10.793 24.665 1.00 6.36 C ATOM 1000 CD1 LEU A 116 -0.944 -12.043 23.950 1.00 4.03 C ATOM 1001 CD2 LEU A 116 -1.638 -9.959 25.153 1.00 6.19 C ATOM 1002 H LEU A 116 2.326 -9.569 24.886 1.00 0.00 H ATOM 1003 N CYS A 117 2.939 -10.724 27.885 1.00 5.81 N ATOM 1004 CA CYS A 117 3.656 -11.048 29.115 1.00 7.87 C ATOM 1005 C CYS A 117 3.825 -9.810 29.995 1.00 6.51 C ATOM 1006 O CYS A 117 3.643 -9.878 31.211 1.00 7.01 O ATOM 1007 CB CYS A 117 5.012 -11.690 28.810 1.00 6.55 C ATOM 1008 SG CYS A 117 4.896 -13.373 28.144 1.00 8.52 S ATOM 1009 H CYS A 117 3.433 -10.781 26.972 1.00 0.00 H ATOM 1010 N GLU A 118 4.168 -8.683 29.375 1.00 7.37 N ATOM 1011 CA GLU A 118 4.295 -7.416 30.093 1.00 10.40 C ATOM 1012 C GLU A 118 2.971 -7.035 30.747 1.00 8.68 C ATOM 1013 O GLU A 118 2.936 -6.566 31.884 1.00 12.83 O ATOM 1014 CB GLU A 118 4.756 -6.297 29.149 1.00 9.27 C ATOM 1015 CG GLU A 118 4.791 -4.915 29.798 1.00 10.26 C ATOM 1016 CD GLU A 118 5.271 -3.827 28.852 1.00 15.99 C ATOM 1017 OE1 GLU A 118 5.619 -4.153 27.698 1.00 15.37 O ATOM 1018 OE2 GLU A 118 5.300 -2.646 29.261 1.00 14.07 O ATOM 1019 H GLU A 118 4.351 -8.705 28.351 1.00 0.00 H ATOM 1020 N LEU A 119 1.882 -7.253 30.019 1.00 9.50 N ATOM 1021 CA LEU A 119 0.547 -6.960 30.518 1.00 7.63 C ATOM 1022 C LEU A 119 0.207 -7.829 31.727 1.00 11.29 C ATOM 1023 O LEU A 119 -0.427 -7.372 32.678 1.00 10.37 O ATOM 1024 CB LEU A 119 -0.480 -7.179 29.407 1.00 8.83 C ATOM 1025 CG LEU A 119 -1.947 -6.896 29.728 1.00 8.59 C ATOM 1026 CD1 LEU A 119 -2.134 -5.435 30.110 1.00 7.72 C ATOM 1027 CD2 LEU A 119 -2.825 -7.263 28.541 1.00 4.02 C ATOM 1028 H LEU A 119 1.987 -7.646 29.062 1.00 0.00 H ATOM 1029 N ALA A 120 0.640 -9.085 31.684 1.00 8.75 N ATOM 1030 CA ALA A 120 0.332 -10.036 32.745 1.00 8.98 C ATOM 1031 C ALA A 120 1.088 -9.737 34.041 1.00 11.93 C ATOM 1032 O ALA A 120 0.625 -10.081 35.126 1.00 14.08 O ATOM 1033 CB ALA A 120 0.607 -11.460 32.280 1.00 7.65 C ATOM 1034 H ALA A 120 1.212 -9.397 30.874 1.00 0.00 H ATOM 1035 N GLY A 121 2.249 -9.101 33.926 1.00 14.99 N ATOM 1036 CA GLY A 121 3.011 -8.709 35.098 1.00 13.51 C ATOM 1037 C GLY A 121 4.444 -9.209 35.103 1.00 16.37 C ATOM 1038 O GLY A 121 4.895 -9.820 34.134 1.00 15.34 O ATOM 1039 H GLY A 121 2.619 -8.880 32.979 1.00 0.00 H ATOM 1040 N PRO A 122 5.170 -8.946 36.202 1.00 19.06 N ATOM 1041 CA PRO A 122 6.577 -9.330 36.375 1.00 22.07 C ATOM 1042 C PRO A 122 6.790 -10.838 36.311 1.00 10.75 C ATOM 1043 O PRO A 122 7.817 -11.288 35.804 1.00 19.94 O ATOM 1044 CB PRO A 122 6.907 -8.820 37.784 1.00 23.76 C ATOM 1045 CG PRO A 122 5.933 -7.721 38.025 1.00 28.80 C ATOM 1046 CD PRO A 122 4.672 -8.162 37.346 1.00 23.87 C ATOM 1047 N GLY A 123 5.832 -11.603 36.826 1.00 16.79 N ATOM 1048 CA GLY A 123 5.925 -13.051 36.834 1.00 14.22 C ATOM 1049 C GLY A 123 5.959 -13.644 35.438 1.00 17.39 C ATOM 1050 O GLY A 123 6.829 -14.457 35.122 1.00 13.51 O ATOM 1051 H GLY A 123 4.990 -11.150 37.236 1.00 0.00 H ATOM 1052 N ALA A 124 5.011 -13.236 34.599 1.00 10.13 N ATOM 1053 CA ALA A 124 4.971 -13.696 33.218 1.00 12.14 C ATOM 1054 C ALA A 124 6.114 -13.092 32.408 1.00 10.66 C ATOM 1055 O ALA A 124 6.649 -13.731 31.505 1.00 11.16 O ATOM 1056 CB ALA A 124 3.633 -13.364 32.582 1.00 10.04 C ATOM 1057 H ALA A 124 4.283 -12.574 34.936 1.00 0.00 H ATOM 1058 N SER A 125 6.487 -11.859 32.738 1.00 14.09 N ATOM 1059 CA SER A 125 7.575 -11.179 32.044 1.00 13.35 C ATOM 1060 C SER A 125 8.899 -11.891 32.287 1.00 15.46 C ATOM 1061 O SER A 125 9.761 -11.934 31.411 1.00 14.33 O ATOM 1062 CB SER A 125 7.676 -9.722 32.495 1.00 16.31 C ATOM 1063 OG SER A 125 6.483 -9.018 32.203 1.00 26.52 O ATOM 1064 HG SER A 125 5.725 -9.446 32.675 1.00 0.00 H ATOM 1065 H SER A 125 5.991 -11.368 33.509 1.00 0.00 H ATOM 1066 N GLN A 126 9.050 -12.450 33.483 1.00 14.28 N ATOM 1067 CA GLN A 126 10.263 -13.173 33.844 1.00 16.39 C ATOM 1068 C GLN A 126 10.303 -14.566 33.220 1.00 16.74 C ATOM 1069 O GLN A 126 11.309 -14.956 32.628 1.00 17.51 O ATOM 1070 CB GLN A 126 10.396 -13.279 35.364 1.00 17.53 C ATOM 1071 CG GLN A 126 11.569 -14.135 35.818 1.00 29.49 C ATOM 1072 CD GLN A 126 11.616 -14.305 37.322 1.00 45.89 C ATOM 1073 OE1 GLN A 126 11.100 -13.473 38.070 1.00 49.33 O ATOM 1074 NE2 GLN A 126 12.233 -15.391 37.776 1.00 53.90 N ATOM 1075 HE22 GLN A 126 12.655 -16.067 37.108 1.00 0.00 H ATOM 1076 HE21 GLN A 126 12.294 -15.565 38.800 1.00 0.00 H ATOM 1077 H GLN A 126 8.282 -12.369 34.180 1.00 0.00 H ATOM 1078 N ARG A 127 9.210 -15.314 33.351 1.00 11.15 N ATOM 1079 CA ARG A 127 9.176 -16.681 32.839 1.00 13.41 C ATOM 1080 C ARG A 127 8.952 -16.705 31.328 1.00 10.21 C ATOM 1081 O ARG A 127 9.204 -17.710 30.672 1.00 15.57 O ATOM 1082 CB ARG A 127 8.119 -17.516 33.570 1.00 14.94 C ATOM 1083 CG ARG A 127 6.717 -17.411 32.999 1.00 14.15 C ATOM 1084 CD ARG A 127 5.725 -18.208 33.836 1.00 13.43 C ATOM 1085 NE ARG A 127 5.251 -17.453 34.993 1.00 14.48 N ATOM 1086 CZ ARG A 127 4.133 -16.735 35.004 1.00 14.64 C ATOM 1087 NH1 ARG A 127 3.372 -16.678 33.920 1.00 8.12 N ATOM 1088 NH2 ARG A 127 3.771 -16.074 36.098 1.00 12.20 N ATOM 1089 HE ARG A 127 5.823 -17.479 35.861 1.00 0.00 H ATOM 1090 HH12 ARG A 127 2.497 -16.116 33.928 1.00 0.00 H ATOM 1091 HH11 ARG A 127 3.650 -17.195 33.062 1.00 0.00 H ATOM 1092 HH22 ARG A 127 2.895 -15.514 36.101 1.00 0.00 H ATOM 1093 HH21 ARG A 127 4.364 -16.117 36.952 1.00 0.00 H ATOM 1094 H ARG A 127 8.371 -14.921 33.823 1.00 0.00 H ATOM 1095 N GLN A 128 8.492 -15.579 30.790 1.00 12.99 N ATOM 1096 CA GLN A 128 8.280 -15.396 29.351 1.00 15.83 C ATOM 1097 C GLN A 128 7.212 -16.304 28.742 1.00 15.45 C ATOM 1098 O GLN A 128 7.261 -16.624 27.555 1.00 15.71 O ATOM 1099 CB GLN A 128 9.596 -15.484 28.570 1.00 19.13 C ATOM 1100 CG GLN A 128 10.431 -14.215 28.636 1.00 21.61 C ATOM 1101 CD GLN A 128 9.767 -13.040 27.936 1.00 35.34 C ATOM 1102 OE1 GLN A 128 9.462 -13.104 26.744 1.00 35.93 O ATOM 1103 NE2 GLN A 128 9.536 -11.961 28.677 1.00 27.87 N ATOM 1104 HE22 GLN A 128 9.810 -11.951 29.680 1.00 0.00 H ATOM 1105 HE21 GLN A 128 9.081 -11.127 28.254 1.00 0.00 H ATOM 1106 H GLN A 128 8.271 -14.785 31.425 1.00 0.00 H ATOM 1107 N TRP A 129 6.252 -16.715 29.563 1.00 10.71 N ATOM 1108 CA TRP A 129 5.024 -17.328 29.062 1.00 11.35 C ATOM 1109 C TRP A 129 3.881 -17.108 30.045 1.00 7.97 C ATOM 1110 O TRP A 129 4.106 -16.699 31.187 1.00 9.93 O ATOM 1111 CB TRP A 129 5.209 -18.813 28.726 1.00 12.25 C ATOM 1112 CG TRP A 129 5.945 -19.608 29.756 1.00 13.78 C ATOM 1113 CD1 TRP A 129 7.298 -19.743 29.873 1.00 17.68 C ATOM 1114 CD2 TRP A 129 5.371 -20.405 30.798 1.00 13.26 C ATOM 1115 NE1 TRP A 129 7.604 -20.561 30.935 1.00 14.73 N ATOM 1116 CE2 TRP A 129 6.438 -20.982 31.518 1.00 14.17 C ATOM 1117 CE3 TRP A 129 4.059 -20.682 31.196 1.00 13.75 C ATOM 1118 CZ2 TRP A 129 6.234 -21.821 32.612 1.00 15.22 C ATOM 1119 CZ3 TRP A 129 3.859 -21.515 32.281 1.00 12.83 C ATOM 1120 CH2 TRP A 129 4.940 -22.073 32.978 1.00 16.46 C ATOM 1121 HE1 TRP A 129 8.563 -20.818 31.245 1.00 0.00 H ATOM 1122 H TRP A 129 6.378 -16.597 30.589 1.00 0.00 H ATOM 1123 N LEU A 130 2.660 -17.380 29.596 1.00 7.30 N ATOM 1124 CA LEU A 130 1.464 -17.019 30.347 1.00 8.08 C ATOM 1125 C LEU A 130 0.800 -18.196 31.054 1.00 9.18 C ATOM 1126 O LEU A 130 0.899 -19.340 30.611 1.00 8.82 O ATOM 1127 CB LEU A 130 0.437 -16.376 29.408 1.00 5.41 C ATOM 1128 CG LEU A 130 0.835 -15.115 28.643 1.00 8.27 C ATOM 1129 CD1 LEU A 130 -0.219 -14.776 27.595 1.00 3.52 C ATOM 1130 CD2 LEU A 130 1.038 -13.950 29.599 1.00 9.12 C ATOM 1131 H LEU A 130 2.555 -17.865 28.682 1.00 0.00 H ATOM 1132 N TYR A 131 0.117 -17.893 32.155 1.00 9.32 N ATOM 1133 CA TYR A 131 -0.822 -18.817 32.780 1.00 8.11 C ATOM 1134 C TYR A 131 -2.211 -18.434 32.288 1.00 8.99 C ATOM 1135 O TYR A 131 -2.477 -17.256 32.042 1.00 7.72 O ATOM 1136 CB TYR A 131 -0.784 -18.680 34.304 1.00 9.18 C ATOM 1137 CG TYR A 131 0.471 -19.206 34.962 1.00 8.76 C ATOM 1138 CD1 TYR A 131 1.076 -20.375 34.521 1.00 10.57 C ATOM 1139 CD2 TYR A 131 1.047 -18.533 36.031 1.00 14.10 C ATOM 1140 CE1 TYR A 131 2.223 -20.858 35.127 1.00 12.83 C ATOM 1141 CE2 TYR A 131 2.193 -19.006 36.642 1.00 12.22 C ATOM 1142 CZ TYR A 131 2.778 -20.168 36.187 1.00 11.05 C ATOM 1143 OH TYR A 131 3.918 -20.643 36.794 1.00 13.52 O ATOM 1144 HH TYR A 131 4.204 -21.479 36.348 1.00 0.00 H ATOM 1145 H TYR A 131 0.259 -16.958 32.588 1.00 0.00 H ATOM 1146 N PHE A 132 -3.103 -19.409 32.153 1.00 5.96 N ATOM 1147 CA PHE A 132 -4.452 -19.105 31.680 1.00 6.34 C ATOM 1148 C PHE A 132 -5.200 -18.151 32.622 1.00 7.94 C ATOM 1149 O PHE A 132 -6.015 -17.344 32.176 1.00 7.22 O ATOM 1150 CB PHE A 132 -5.257 -20.384 31.433 1.00 8.01 C ATOM 1151 CG PHE A 132 -5.684 -21.092 32.686 1.00 8.66 C ATOM 1152 CD1 PHE A 132 -6.936 -20.863 33.236 1.00 12.95 C ATOM 1153 CD2 PHE A 132 -4.842 -22.001 33.307 1.00 9.56 C ATOM 1154 CE1 PHE A 132 -7.336 -21.517 34.389 1.00 12.85 C ATOM 1155 CE2 PHE A 132 -5.240 -22.661 34.460 1.00 7.34 C ATOM 1156 CZ PHE A 132 -6.485 -22.418 34.999 1.00 7.59 C ATOM 1157 H PHE A 132 -2.841 -20.389 32.384 1.00 0.00 H ATOM 1158 N THR A 133 -4.911 -18.243 33.918 1.00 6.26 N ATOM 1159 CA THR A 133 -5.525 -17.362 34.914 1.00 5.85 C ATOM 1160 C THR A 133 -5.124 -15.901 34.708 1.00 8.19 C ATOM 1161 O THR A 133 -5.918 -14.989 34.944 1.00 8.57 O ATOM 1162 CB THR A 133 -5.141 -17.772 36.347 1.00 6.02 C ATOM 1163 OG1 THR A 133 -3.717 -17.920 36.436 1.00 8.60 O ATOM 1164 CG2 THR A 133 -5.810 -19.084 36.727 1.00 9.70 C ATOM 1165 HG1 THR A 133 -3.282 -17.060 36.210 1.00 0.00 H ATOM 1166 H THR A 133 -4.229 -18.962 34.233 1.00 0.00 H ATOM 1167 N GLU A 134 -3.886 -15.684 34.277 1.00 3.67 N ATOM 1168 CA GLU A 134 -3.410 -14.340 33.980 1.00 7.08 C ATOM 1169 C GLU A 134 -4.145 -13.776 32.765 1.00 9.53 C ATOM 1170 O GLU A 134 -4.451 -12.583 32.708 1.00 5.39 O ATOM 1171 CB GLU A 134 -1.894 -14.342 33.757 1.00 7.04 C ATOM 1172 CG GLU A 134 -1.092 -14.619 35.029 1.00 8.21 C ATOM 1173 CD GLU A 134 0.385 -14.866 34.767 1.00 12.93 C ATOM 1174 OE1 GLU A 134 0.738 -15.275 33.639 1.00 9.59 O ATOM 1175 OE2 GLU A 134 1.194 -14.653 35.695 1.00 8.02 O ATOM 1176 H GLU A 134 -3.243 -16.491 34.149 1.00 0.00 H ATOM 1177 N VAL A 135 -4.441 -14.646 31.805 1.00 3.59 N ATOM 1178 CA VAL A 135 -5.172 -14.247 30.608 1.00 2.96 C ATOM 1179 C VAL A 135 -6.594 -13.825 30.964 1.00 8.86 C ATOM 1180 O VAL A 135 -7.110 -12.838 30.442 1.00 7.31 O ATOM 1181 CB VAL A 135 -5.200 -15.383 29.562 1.00 4.65 C ATOM 1182 CG1 VAL A 135 -6.001 -14.965 28.336 1.00 2.87 C ATOM 1183 CG2 VAL A 135 -3.781 -15.775 29.167 1.00 8.84 C ATOM 1184 H VAL A 135 -4.144 -15.637 31.910 1.00 0.00 H ATOM 1185 N GLU A 136 -7.213 -14.573 31.871 1.00 3.59 N ATOM 1186 CA GLU A 136 -8.562 -14.272 32.333 1.00 8.62 C ATOM 1187 C GLU A 136 -8.640 -12.902 32.995 1.00 8.41 C ATOM 1188 O GLU A 136 -9.683 -12.249 32.953 1.00 13.11 O ATOM 1189 CB GLU A 136 -9.035 -15.338 33.326 1.00 11.42 C ATOM 1190 CG GLU A 136 -9.196 -16.731 32.733 1.00 12.48 C ATOM 1191 CD GLU A 136 -9.692 -17.751 33.748 1.00 12.33 C ATOM 1192 OE1 GLU A 136 -9.473 -17.535 34.958 1.00 19.42 O ATOM 1193 OE2 GLU A 136 -10.317 -18.752 33.336 1.00 16.02 O ATOM 1194 H GLU A 136 -6.719 -15.400 32.264 1.00 0.00 H ATOM 1195 N LYS A 137 -7.536 -12.476 33.603 1.00 8.03 N ATOM 1196 CA LYS A 137 -7.503 -11.223 34.349 1.00 12.86 C ATOM 1197 C LYS A 137 -6.951 -10.046 33.546 1.00 11.79 C ATOM 1198 O LYS A 137 -6.826 -8.937 34.074 1.00 10.32 O ATOM 1199 CB LYS A 137 -6.702 -11.401 35.639 1.00 18.87 C ATOM 1200 CG LYS A 137 -7.331 -12.371 36.628 1.00 21.59 C ATOM 1201 CD LYS A 137 -6.443 -12.569 37.849 1.00 35.04 C ATOM 1202 CE LYS A 137 -5.085 -13.132 37.458 1.00 26.87 C ATOM 1203 NZ LYS A 137 -4.237 -13.440 38.643 1.00 33.74 N ATOM 1204 HZ1 LYS A 137 -4.080 -12.570 39.191 1.00 0.00 H ATOM 1205 HZ2 LYS A 137 -4.718 -14.144 39.239 1.00 0.00 H ATOM 1206 HZ3 LYS A 137 -3.323 -13.821 38.324 1.00 0.00 H ATOM 1207 H LYS A 137 -6.672 -13.052 33.545 1.00 0.00 H ATOM 1208 N PHE A 138 -6.612 -10.291 32.282 1.00 6.16 N ATOM 1209 CA PHE A 138 -6.208 -9.221 31.375 1.00 6.38 C ATOM 1210 C PHE A 138 -7.262 -8.121 31.352 1.00 8.38 C ATOM 1211 O PHE A 138 -8.461 -8.409 31.328 1.00 4.74 O ATOM 1212 CB PHE A 138 -6.046 -9.759 29.953 1.00 6.06 C ATOM 1213 CG PHE A 138 -4.709 -10.388 29.679 1.00 8.29 C ATOM 1214 CD1 PHE A 138 -3.618 -10.127 30.489 1.00 9.63 C ATOM 1215 CD2 PHE A 138 -4.543 -11.232 28.591 1.00 5.81 C ATOM 1216 CE1 PHE A 138 -2.387 -10.704 30.224 1.00 5.89 C ATOM 1217 CE2 PHE A 138 -3.316 -11.809 28.322 1.00 6.54 C ATOM 1218 CZ PHE A 138 -2.239 -11.546 29.139 1.00 5.53 C ATOM 1219 H PHE A 138 -6.636 -11.270 31.932 1.00 0.00 H ATOM 1220 N PRO A 139 -6.823 -6.854 31.366 1.00 8.34 N ATOM 1221 CA PRO A 139 -7.782 -5.767 31.152 1.00 8.23 C ATOM 1222 C PRO A 139 -8.278 -5.773 29.708 1.00 7.59 C ATOM 1223 O PRO A 139 -7.491 -5.998 28.786 1.00 6.09 O ATOM 1224 CB PRO A 139 -6.957 -4.507 31.433 1.00 5.97 C ATOM 1225 CG PRO A 139 -5.545 -4.914 31.214 1.00 7.08 C ATOM 1226 CD PRO A 139 -5.459 -6.358 31.615 1.00 6.39 C ATOM 1227 N ALA A 140 -9.572 -5.535 29.525 1.00 6.60 N ATOM 1228 CA ALA A 140 -10.189 -5.569 28.204 1.00 8.13 C ATOM 1229 C ALA A 140 -9.607 -4.506 27.280 1.00 5.67 C ATOM 1230 O ALA A 140 -9.458 -4.732 26.079 1.00 6.40 O ATOM 1231 CB ALA A 140 -11.699 -5.394 28.322 1.00 4.98 C ATOM 1232 H ALA A 140 -10.165 -5.317 30.351 1.00 0.00 H ATOM 1233 N LEU A 141 -9.283 -3.349 27.845 1.00 6.74 N ATOM 1234 CA LEU A 141 -8.809 -2.218 27.055 1.00 9.43 C ATOM 1235 C LEU A 141 -7.558 -2.552 26.246 1.00 4.87 C ATOM 1236 O LEU A 141 -7.477 -2.239 25.058 1.00 6.80 O ATOM 1237 CB LEU A 141 -8.545 -1.010 27.951 1.00 9.23 C ATOM 1238 CG LEU A 141 -8.095 0.257 27.223 1.00 13.97 C ATOM 1239 CD1 LEU A 141 -9.082 0.622 26.119 1.00 13.39 C ATOM 1240 CD2 LEU A 141 -7.940 1.402 28.207 1.00 10.37 C ATOM 1241 H LEU A 141 -9.369 -3.247 28.876 1.00 0.00 H ATOM 1242 N ASP A 142 -6.592 -3.194 26.892 1.00 4.33 N ATOM 1243 CA ASP A 142 -5.342 -3.551 26.229 1.00 5.37 C ATOM 1244 C ASP A 142 -5.554 -4.565 25.110 1.00 3.64 C ATOM 1245 O ASP A 142 -4.956 -4.453 24.042 1.00 2.91 O ATOM 1246 CB ASP A 142 -4.330 -4.077 27.245 1.00 2.57 C ATOM 1247 CG ASP A 142 -3.779 -2.980 28.129 1.00 6.98 C ATOM 1248 OD1 ASP A 142 -4.524 -2.505 29.013 1.00 4.49 O ATOM 1249 OD2 ASP A 142 -2.608 -2.588 27.934 1.00 3.44 O ATOM 1250 H ASP A 142 -6.729 -3.448 27.891 1.00 0.00 H ATOM 1251 N LEU A 143 -6.407 -5.551 25.357 1.00 2.88 N ATOM 1252 CA LEU A 143 -6.703 -6.557 24.346 1.00 3.63 C ATOM 1253 C LEU A 143 -7.409 -5.923 23.152 1.00 4.93 C ATOM 1254 O LEU A 143 -7.180 -6.309 22.005 1.00 4.62 O ATOM 1255 CB LEU A 143 -7.545 -7.689 24.936 1.00 3.13 C ATOM 1256 CG LEU A 143 -6.844 -8.536 26.001 1.00 4.55 C ATOM 1257 CD1 LEU A 143 -7.748 -9.665 26.484 1.00 5.27 C ATOM 1258 CD2 LEU A 143 -5.521 -9.086 25.468 1.00 6.11 C ATOM 1259 H LEU A 143 -6.871 -5.606 26.286 1.00 0.00 H ATOM 1260 N HIS A 144 -8.259 -4.940 23.433 1.00 2.51 N ATOM 1261 CA HIS A 144 -8.966 -4.208 22.391 1.00 4.74 C ATOM 1262 C HIS A 144 -7.973 -3.473 21.494 1.00 4.57 C ATOM 1263 O HIS A 144 -8.029 -3.585 20.272 1.00 3.39 O ATOM 1264 CB HIS A 144 -9.954 -3.218 23.018 1.00 6.78 C ATOM 1265 CG HIS A 144 -10.766 -2.452 22.019 1.00 11.56 C ATOM 1266 ND1 HIS A 144 -11.613 -3.065 21.121 1.00 7.67 N ATOM 1267 CD2 HIS A 144 -10.865 -1.123 21.782 1.00 9.09 C ATOM 1268 CE1 HIS A 144 -12.195 -2.147 20.370 1.00 10.31 C ATOM 1269 NE2 HIS A 144 -11.759 -0.959 20.751 1.00 9.62 N ATOM 1270 H HIS A 144 -8.424 -4.686 24.428 1.00 0.00 H ATOM 1271 N THR A 145 -7.059 -2.732 22.113 1.00 3.06 N ATOM 1272 CA THR A 145 -6.042 -1.984 21.377 1.00 4.82 C ATOM 1273 C THR A 145 -5.189 -2.903 20.506 1.00 3.44 C ATOM 1274 O THR A 145 -5.006 -2.648 19.314 1.00 2.76 O ATOM 1275 CB THR A 145 -5.123 -1.199 22.336 1.00 6.45 C ATOM 1276 OG1 THR A 145 -5.902 -0.254 23.078 1.00 4.72 O ATOM 1277 CG2 THR A 145 -4.038 -0.461 21.562 1.00 5.42 C ATOM 1278 HG1 THR A 145 -5.311 0.249 23.693 1.00 0.00 H ATOM 1279 H THR A 145 -7.068 -2.683 23.152 1.00 0.00 H ATOM 1280 N ILE A 146 -4.680 -3.972 21.111 1.00 3.45 N ATOM 1281 CA ILE A 146 -3.842 -4.941 20.413 1.00 2.69 C ATOM 1282 C ILE A 146 -4.576 -5.571 19.231 1.00 3.88 C ATOM 1283 O ILE A 146 -4.052 -5.622 18.120 1.00 2.75 O ATOM 1284 CB ILE A 146 -3.369 -6.057 21.362 1.00 1.62 C ATOM 1285 CG1 ILE A 146 -2.430 -5.489 22.430 1.00 2.77 C ATOM 1286 CG2 ILE A 146 -2.677 -7.164 20.579 1.00 3.42 C ATOM 1287 CD1 ILE A 146 -2.012 -6.504 23.487 1.00 2.40 C ATOM 1288 H ILE A 146 -4.887 -4.123 22.119 1.00 0.00 H ATOM 1289 N ASN A 147 -5.790 -6.050 19.479 1.00 2.20 N ATOM 1290 CA ASN A 147 -6.588 -6.676 18.432 1.00 2.22 C ATOM 1291 C ASN A 147 -6.960 -5.704 17.316 1.00 3.80 C ATOM 1292 O ASN A 147 -6.943 -6.062 16.139 1.00 3.30 O ATOM 1293 CB ASN A 147 -7.852 -7.305 19.016 1.00 1.50 C ATOM 1294 CG ASN A 147 -8.586 -8.162 18.007 1.00 5.57 C ATOM 1295 OD1 ASN A 147 -8.204 -9.305 17.757 1.00 4.00 O ATOM 1296 ND2 ASN A 147 -9.640 -7.612 17.413 1.00 5.26 N ATOM 1297 HD22 ASN A 147 -9.927 -6.642 17.656 1.00 0.00 H ATOM 1298 HD21 ASN A 147 -10.178 -8.151 16.705 1.00 0.00 H ATOM 1299 H ASN A 147 -6.179 -5.977 20.441 1.00 0.00 H ATOM 1300 N ALA A 148 -7.294 -4.475 17.696 1.00 4.24 N ATOM 1301 CA ALA A 148 -7.663 -3.450 16.728 1.00 3.92 C ATOM 1302 C ALA A 148 -6.520 -3.173 15.756 1.00 2.41 C ATOM 1303 O ALA A 148 -6.736 -3.033 14.556 1.00 3.18 O ATOM 1304 CB ALA A 148 -8.081 -2.168 17.439 1.00 4.25 C ATOM 1305 H ALA A 148 -7.292 -4.239 18.709 1.00 0.00 H ATOM 1306 N LEU A 149 -5.302 -3.104 16.280 1.00 1.24 N ATOM 1307 CA LEU A 149 -4.135 -2.839 15.448 1.00 2.86 C ATOM 1308 C LEU A 149 -3.914 -3.950 14.425 1.00 3.46 C ATOM 1309 O LEU A 149 -3.691 -3.681 13.244 1.00 4.05 O ATOM 1310 CB LEU A 149 -2.889 -2.652 16.314 1.00 1.58 C ATOM 1311 CG LEU A 149 -2.871 -1.367 17.145 1.00 2.06 C ATOM 1312 CD1 LEU A 149 -1.673 -1.349 18.085 1.00 2.43 C ATOM 1313 CD2 LEU A 149 -2.861 -0.147 16.234 1.00 3.72 C ATOM 1314 H LEU A 149 -5.178 -3.242 17.303 1.00 0.00 H ATOM 1315 N TRP A 150 -3.977 -5.194 14.887 1.00 2.09 N ATOM 1316 CA TRP A 150 -3.833 -6.346 14.005 1.00 4.44 C ATOM 1317 C TRP A 150 -4.917 -6.350 12.932 1.00 4.24 C ATOM 1318 O TRP A 150 -4.639 -6.525 11.747 1.00 4.47 O ATOM 1319 CB TRP A 150 -3.886 -7.641 14.819 1.00 2.11 C ATOM 1320 CG TRP A 150 -2.553 -8.033 15.378 1.00 3.03 C ATOM 1321 CD1 TRP A 150 -2.087 -7.801 16.641 1.00 3.60 C ATOM 1322 CD2 TRP A 150 -1.506 -8.714 14.681 1.00 2.60 C ATOM 1323 NE1 TRP A 150 -0.814 -8.304 16.774 1.00 1.53 N ATOM 1324 CE2 TRP A 150 -0.434 -8.866 15.584 1.00 2.13 C ATOM 1325 CE3 TRP A 150 -1.371 -9.210 13.381 1.00 2.23 C ATOM 1326 CZ2 TRP A 150 0.755 -9.499 15.228 1.00 2.52 C ATOM 1327 CZ3 TRP A 150 -0.190 -9.835 13.028 1.00 2.63 C ATOM 1328 CH2 TRP A 150 0.858 -9.975 13.949 1.00 4.11 C ATOM 1329 HE1 TRP A 150 -0.235 -8.264 17.637 1.00 0.00 H ATOM 1330 H TRP A 150 -4.133 -5.350 15.903 1.00 0.00 H ATOM 1331 N TRP A 151 -6.151 -6.130 13.370 1.00 2.14 N ATOM 1332 CA TRP A 151 -7.322 -6.138 12.503 1.00 3.52 C ATOM 1333 C TRP A 151 -7.268 -5.024 11.454 1.00 4.31 C ATOM 1334 O TRP A 151 -7.464 -5.274 10.264 1.00 2.97 O ATOM 1335 CB TRP A 151 -8.573 -5.993 13.370 1.00 3.75 C ATOM 1336 CG TRP A 151 -9.879 -6.228 12.675 1.00 7.18 C ATOM 1337 CD1 TRP A 151 -10.415 -7.430 12.320 1.00 5.73 C ATOM 1338 CD2 TRP A 151 -10.837 -5.234 12.296 1.00 7.81 C ATOM 1339 NE1 TRP A 151 -11.640 -7.246 11.724 1.00 7.83 N ATOM 1340 CE2 TRP A 151 -11.923 -5.905 11.699 1.00 7.97 C ATOM 1341 CE3 TRP A 151 -10.880 -3.839 12.398 1.00 5.77 C ATOM 1342 CZ2 TRP A 151 -13.037 -5.231 11.204 1.00 16.53 C ATOM 1343 CZ3 TRP A 151 -11.988 -3.170 11.904 1.00 11.74 C ATOM 1344 CH2 TRP A 151 -13.051 -3.867 11.317 1.00 11.50 C ATOM 1345 HE1 TRP A 151 -12.252 -8.001 11.353 1.00 0.00 H ATOM 1346 H TRP A 151 -6.289 -5.942 14.384 1.00 0.00 H ATOM 1347 N LEU A 152 -6.995 -3.800 11.902 1.00 4.36 N ATOM 1348 CA LEU A 152 -6.990 -2.630 11.020 1.00 4.02 C ATOM 1349 C LEU A 152 -5.883 -2.664 9.970 1.00 5.68 C ATOM 1350 O LEU A 152 -6.039 -2.119 8.877 1.00 4.30 O ATOM 1351 CB LEU A 152 -6.878 -1.340 11.840 1.00 3.77 C ATOM 1352 CG LEU A 152 -8.103 -0.928 12.661 1.00 4.14 C ATOM 1353 CD1 LEU A 152 -7.742 0.145 13.689 1.00 4.30 C ATOM 1354 CD2 LEU A 152 -9.223 -0.445 11.749 1.00 8.83 C ATOM 1355 H LEU A 152 -6.778 -3.670 12.911 1.00 0.00 H ATOM 1356 N HIS A 153 -4.767 -3.300 10.307 1.00 4.31 N ATOM 1357 CA HIS A 153 -3.602 -3.308 9.430 1.00 3.25 C ATOM 1358 C HIS A 153 -3.449 -4.610 8.645 1.00 4.93 C ATOM 1359 O HIS A 153 -2.381 -4.893 8.102 1.00 6.60 O ATOM 1360 CB HIS A 153 -2.333 -3.010 10.233 1.00 5.55 C ATOM 1361 CG HIS A 153 -2.287 -1.620 10.784 1.00 5.05 C ATOM 1362 ND1 HIS A 153 -1.934 -0.529 10.019 1.00 7.72 N ATOM 1363 CD2 HIS A 153 -2.562 -1.138 12.020 1.00 6.02 C ATOM 1364 CE1 HIS A 153 -1.988 0.563 10.761 1.00 6.56 C ATOM 1365 NE2 HIS A 153 -2.368 0.221 11.979 1.00 6.63 N ATOM 1366 H HIS A 153 -4.723 -3.803 11.216 1.00 0.00 H ATOM 1367 N SER A 154 -4.520 -5.393 8.575 1.00 3.54 N ATOM 1368 CA SER A 154 -4.484 -6.654 7.846 1.00 6.54 C ATOM 1369 C SER A 154 -5.755 -6.894 7.042 1.00 6.44 C ATOM 1370 O SER A 154 -6.036 -8.028 6.662 1.00 6.10 O ATOM 1371 CB SER A 154 -4.277 -7.822 8.811 1.00 5.04 C ATOM 1372 OG SER A 154 -5.418 -8.001 9.633 1.00 4.50 O ATOM 1373 HG SER A 154 -5.578 -7.177 10.157 1.00 0.00 H ATOM 1374 H SER A 154 -5.399 -5.101 9.048 1.00 0.00 H ATOM 1375 N ASN A 155 -6.519 -5.832 6.794 1.00 8.35 N ATOM 1376 CA ASN A 155 -7.806 -5.947 6.108 1.00 9.06 C ATOM 1377 C ASN A 155 -8.734 -6.938 6.821 1.00 7.57 C ATOM 1378 O ASN A 155 -9.447 -7.712 6.187 1.00 7.68 O ATOM 1379 CB ASN A 155 -7.605 -6.338 4.637 1.00 12.60 C ATOM 1380 CG ASN A 155 -8.882 -6.238 3.819 1.00 20.86 C ATOM 1381 OD1 ASN A 155 -9.749 -5.408 4.096 1.00 20.34 O ATOM 1382 ND2 ASN A 155 -9.010 -7.101 2.817 1.00 16.00 N ATOM 1383 HD22 ASN A 155 -8.252 -7.785 2.619 1.00 0.00 H ATOM 1384 HD21 ASN A 155 -9.869 -7.093 2.230 1.00 0.00 H ATOM 1385 H ASN A 155 -6.191 -4.893 7.097 1.00 0.00 H ATOM 1386 N GLY A 156 -8.701 -6.918 8.150 1.00 7.45 N ATOM 1387 CA GLY A 156 -9.518 -7.811 8.954 1.00 4.14 C ATOM 1388 C GLY A 156 -9.110 -9.277 8.905 1.00 8.09 C ATOM 1389 O GLY A 156 -9.839 -10.140 9.394 1.00 6.78 O ATOM 1390 H GLY A 156 -8.071 -6.243 8.629 1.00 0.00 H ATOM 1391 N ASN A 157 -7.949 -9.565 8.323 1.00 7.68 N ATOM 1392 CA ASN A 157 -7.490 -10.946 8.180 1.00 7.66 C ATOM 1393 C ASN A 157 -6.864 -11.512 9.455 1.00 11.38 C ATOM 1394 O ASN A 157 -6.971 -12.708 9.730 1.00 7.56 O ATOM 1395 CB ASN A 157 -6.490 -11.062 7.027 1.00 7.79 C ATOM 1396 CG ASN A 157 -6.469 -12.446 6.406 1.00 28.25 C ATOM 1397 OD1 ASN A 157 -7.502 -13.106 6.301 1.00 28.28 O ATOM 1398 ND2 ASN A 157 -5.288 -12.892 5.989 1.00 22.45 N ATOM 1399 HD22 ASN A 157 -4.440 -12.299 6.098 1.00 0.00 H ATOM 1400 HD21 ASN A 157 -5.212 -13.833 5.554 1.00 0.00 H ATOM 1401 H ASN A 157 -7.355 -8.791 7.962 1.00 0.00 H ATOM 1402 N PHE A 158 -6.202 -10.652 10.223 1.00 5.75 N ATOM 1403 CA PHE A 158 -5.498 -11.090 11.427 1.00 4.12 C ATOM 1404 C PHE A 158 -6.141 -10.539 12.695 1.00 4.10 C ATOM 1405 O PHE A 158 -6.804 -9.501 12.668 1.00 4.31 O ATOM 1406 CB PHE A 158 -4.026 -10.666 11.371 1.00 2.88 C ATOM 1407 CG PHE A 158 -3.248 -11.298 10.247 1.00 4.84 C ATOM 1408 CD1 PHE A 158 -3.630 -12.520 9.718 1.00 5.04 C ATOM 1409 CD2 PHE A 158 -2.128 -10.670 9.726 1.00 7.41 C ATOM 1410 CE1 PHE A 158 -2.915 -13.102 8.692 1.00 4.58 C ATOM 1411 CE2 PHE A 158 -1.407 -11.247 8.698 1.00 4.89 C ATOM 1412 CZ PHE A 158 -1.799 -12.465 8.181 1.00 5.41 C ATOM 1413 H PHE A 158 -6.185 -9.646 9.961 1.00 0.00 H ATOM 1414 N GLY A 159 -5.933 -11.237 13.807 1.00 6.69 N ATOM 1415 CA GLY A 159 -6.441 -10.791 15.091 1.00 2.56 C ATOM 1416 C GLY A 159 -7.038 -11.921 15.906 1.00 7.70 C ATOM 1417 O GLY A 159 -7.510 -12.915 15.353 1.00 5.57 O ATOM 1418 H GLY A 159 -5.393 -12.124 13.755 1.00 0.00 H ATOM 1419 N PHE A 160 -7.014 -11.768 17.228 1.00 5.41 N ATOM 1420 CA PHE A 160 -7.589 -12.763 18.125 1.00 2.52 C ATOM 1421 C PHE A 160 -9.095 -12.858 17.926 1.00 4.19 C ATOM 1422 O PHE A 160 -9.681 -13.935 18.060 1.00 3.58 O ATOM 1423 CB PHE A 160 -7.273 -12.413 19.578 1.00 4.20 C ATOM 1424 CG PHE A 160 -5.809 -12.461 19.905 1.00 4.52 C ATOM 1425 CD1 PHE A 160 -5.042 -13.560 19.544 1.00 2.77 C ATOM 1426 CD2 PHE A 160 -5.195 -11.403 20.555 1.00 3.26 C ATOM 1427 CE1 PHE A 160 -3.689 -13.609 19.841 1.00 2.96 C ATOM 1428 CE2 PHE A 160 -3.841 -11.444 20.851 1.00 3.40 C ATOM 1429 CZ PHE A 160 -3.090 -12.548 20.494 1.00 2.99 C ATOM 1430 H PHE A 160 -6.574 -10.917 17.631 1.00 0.00 H ATOM 1431 N SER A 161 -9.712 -11.723 17.610 1.00 3.08 N ATOM 1432 CA SER A 161 -11.142 -11.670 17.335 1.00 4.50 C ATOM 1433 C SER A 161 -11.473 -12.541 16.129 1.00 4.88 C ATOM 1434 O SER A 161 -12.501 -13.217 16.102 1.00 9.16 O ATOM 1435 CB SER A 161 -11.578 -10.230 17.064 1.00 5.44 C ATOM 1436 OG SER A 161 -10.935 -9.709 15.910 1.00 3.40 O ATOM 1437 HG SER A 161 -11.169 -10.264 15.124 1.00 0.00 H ATOM 1438 H SER A 161 -9.156 -10.845 17.558 1.00 0.00 H ATOM 1439 N VAL A 162 -10.589 -12.517 15.137 1.00 5.70 N ATOM 1440 CA VAL A 162 -10.764 -13.303 13.923 1.00 5.46 C ATOM 1441 C VAL A 162 -10.679 -14.791 14.240 1.00 8.59 C ATOM 1442 O VAL A 162 -11.525 -15.579 13.809 1.00 7.99 O ATOM 1443 CB VAL A 162 -9.706 -12.938 12.861 1.00 6.76 C ATOM 1444 CG1 VAL A 162 -9.856 -13.819 11.634 1.00 6.96 C ATOM 1445 CG2 VAL A 162 -9.817 -11.462 12.480 1.00 6.31 C ATOM 1446 H VAL A 162 -9.744 -11.917 15.230 1.00 0.00 H ATOM 1447 N GLN A 163 -9.653 -15.164 15.001 1.00 5.15 N ATOM 1448 CA GLN A 163 -9.466 -16.544 15.434 1.00 6.07 C ATOM 1449 C GLN A 163 -10.649 -17.017 16.272 1.00 7.54 C ATOM 1450 O GLN A 163 -11.125 -18.139 16.111 1.00 4.59 O ATOM 1451 CB GLN A 163 -8.167 -16.676 16.236 1.00 6.49 C ATOM 1452 CG GLN A 163 -6.927 -16.241 15.464 1.00 5.76 C ATOM 1453 CD GLN A 163 -5.682 -16.171 16.327 1.00 5.39 C ATOM 1454 OE1 GLN A 163 -5.734 -16.389 17.539 1.00 3.15 O ATOM 1455 NE2 GLN A 163 -4.551 -15.862 15.704 1.00 4.47 N ATOM 1456 HE22 GLN A 163 -4.553 -15.686 14.679 1.00 0.00 H ATOM 1457 HE21 GLN A 163 -3.663 -15.796 16.241 1.00 0.00 H ATOM 1458 H GLN A 163 -8.961 -14.447 15.297 1.00 0.00 H ATOM 1459 N ARG A 164 -11.119 -16.149 17.162 1.00 5.93 N ATOM 1460 CA ARG A 164 -12.242 -16.466 18.039 1.00 5.45 C ATOM 1461 C ARG A 164 -13.520 -16.789 17.269 1.00 8.22 C ATOM 1462 O ARG A 164 -14.230 -17.736 17.603 1.00 9.99 O ATOM 1463 CB ARG A 164 -12.512 -15.309 19.000 1.00 7.15 C ATOM 1464 CG ARG A 164 -13.785 -15.477 19.807 1.00 5.19 C ATOM 1465 CD ARG A 164 -14.118 -14.212 20.565 1.00 10.96 C ATOM 1466 NE ARG A 164 -15.413 -14.296 21.233 1.00 6.73 N ATOM 1467 CZ ARG A 164 -16.543 -13.808 20.731 1.00 7.16 C ATOM 1468 NH1 ARG A 164 -16.539 -13.193 19.556 1.00 6.37 N ATOM 1469 NH2 ARG A 164 -17.676 -13.930 21.407 1.00 16.93 N ATOM 1470 HE ARG A 164 -15.454 -14.767 22.159 1.00 0.00 H ATOM 1471 HH12 ARG A 164 -17.424 -12.812 19.165 1.00 0.00 H ATOM 1472 HH11 ARG A 164 -15.650 -13.092 19.025 1.00 0.00 H ATOM 1473 HH22 ARG A 164 -18.560 -13.548 21.014 1.00 0.00 H ATOM 1474 HH21 ARG A 164 -17.682 -14.408 22.331 1.00 0.00 H ATOM 1475 H ARG A 164 -10.672 -15.213 17.236 1.00 0.00 H ATOM 1476 N ARG A 165 -13.816 -16.000 16.242 1.00 7.03 N ATOM 1477 CA ARG A 165 -15.022 -16.232 15.453 1.00 11.71 C ATOM 1478 C ARG A 165 -14.938 -17.518 14.630 1.00 11.63 C ATOM 1479 O ARG A 165 -15.935 -18.219 14.461 1.00 10.29 O ATOM 1480 CB ARG A 165 -15.349 -15.020 14.578 1.00 9.81 C ATOM 1481 CG ARG A 165 -15.882 -13.850 15.390 1.00 16.16 C ATOM 1482 CD ARG A 165 -16.552 -12.798 14.531 1.00 16.27 C ATOM 1483 NE ARG A 165 -17.289 -11.844 15.354 1.00 14.50 N ATOM 1484 CZ ARG A 165 -18.577 -11.964 15.666 1.00 23.50 C ATOM 1485 NH1 ARG A 165 -19.278 -12.996 15.214 1.00 18.40 N ATOM 1486 NH2 ARG A 165 -19.167 -11.050 16.425 1.00 14.40 N ATOM 1487 HE ARG A 165 -16.775 -11.018 15.720 1.00 0.00 H ATOM 1488 HH12 ARG A 165 -20.285 -13.088 15.459 1.00 0.00 H ATOM 1489 HH11 ARG A 165 -18.821 -13.713 14.615 1.00 0.00 H ATOM 1490 HH22 ARG A 165 -20.174 -11.146 16.667 1.00 0.00 H ATOM 1491 HH21 ARG A 165 -18.623 -10.237 16.778 1.00 0.00 H ATOM 1492 H ARG A 165 -13.184 -15.211 15.998 1.00 0.00 H ATOM 1493 N LEU A 166 -13.747 -17.834 14.134 1.00 9.48 N ATOM 1494 CA LEU A 166 -13.535 -19.092 13.425 1.00 13.58 C ATOM 1495 C LEU A 166 -13.662 -20.269 14.386 1.00 10.76 C ATOM 1496 O LEU A 166 -14.139 -21.342 14.016 1.00 11.59 O ATOM 1497 CB LEU A 166 -12.164 -19.104 12.746 1.00 7.98 C ATOM 1498 CG LEU A 166 -11.987 -18.122 11.587 1.00 10.49 C ATOM 1499 CD1 LEU A 166 -10.536 -18.074 11.134 1.00 6.54 C ATOM 1500 CD2 LEU A 166 -12.898 -18.507 10.432 1.00 17.27 C ATOM 1501 H LEU A 166 -12.952 -17.174 14.253 1.00 0.00 H ATOM 1502 N TRP A 167 -13.231 -20.052 15.623 1.00 6.94 N ATOM 1503 CA TRP A 167 -13.331 -21.054 16.678 1.00 7.53 C ATOM 1504 C TRP A 167 -14.795 -21.313 17.022 1.00 12.54 C ATOM 1505 O TRP A 167 -15.205 -22.458 17.218 1.00 12.42 O ATOM 1506 CB TRP A 167 -12.561 -20.575 17.910 1.00 7.48 C ATOM 1507 CG TRP A 167 -12.662 -21.452 19.120 1.00 9.98 C ATOM 1508 CD1 TRP A 167 -12.206 -22.732 19.250 1.00 13.08 C ATOM 1509 CD2 TRP A 167 -13.218 -21.093 20.393 1.00 9.19 C ATOM 1510 NE1 TRP A 167 -12.462 -23.198 20.519 1.00 12.06 N ATOM 1511 CE2 TRP A 167 -13.082 -22.210 21.239 1.00 8.67 C ATOM 1512 CE3 TRP A 167 -13.829 -19.938 20.894 1.00 9.33 C ATOM 1513 CZ2 TRP A 167 -13.530 -22.207 22.558 1.00 14.60 C ATOM 1514 CZ3 TRP A 167 -14.273 -19.938 22.206 1.00 7.06 C ATOM 1515 CH2 TRP A 167 -14.122 -21.064 23.021 1.00 10.08 C ATOM 1516 HE1 TRP A 167 -12.224 -24.146 20.874 1.00 0.00 H ATOM 1517 H TRP A 167 -12.805 -19.130 15.849 1.00 0.00 H ATOM 1518 N LEU A 168 -15.579 -20.241 17.092 1.00 10.03 N ATOM 1519 CA LEU A 168 -17.017 -20.351 17.308 1.00 11.47 C ATOM 1520 C LEU A 168 -17.684 -21.044 16.125 1.00 10.04 C ATOM 1521 O LEU A 168 -18.639 -21.800 16.292 1.00 12.73 O ATOM 1522 CB LEU A 168 -17.637 -18.967 17.516 1.00 11.86 C ATOM 1523 CG LEU A 168 -17.213 -18.207 18.775 1.00 9.29 C ATOM 1524 CD1 LEU A 168 -17.787 -16.798 18.780 1.00 6.34 C ATOM 1525 CD2 LEU A 168 -17.632 -18.961 20.026 1.00 11.07 C ATOM 1526 H LEU A 168 -15.154 -19.297 16.990 1.00 0.00 H ATOM 1527 N ALA A 169 -17.169 -20.785 14.927 1.00 13.23 N ATOM 1528 CA ALA A 169 -17.712 -21.386 13.713 1.00 14.78 C ATOM 1529 C ALA A 169 -17.234 -22.826 13.550 1.00 18.74 C ATOM 1530 O ALA A 169 -17.581 -23.499 12.579 1.00 21.16 O ATOM 1531 CB ALA A 169 -17.332 -20.558 12.497 1.00 11.19 C ATOM 1532 H ALA A 169 -16.358 -20.138 14.853 1.00 0.00 H ATOM 1533 N SER A 170 -16.436 -23.291 14.507 1.00 13.25 N ATOM 1534 CA SER A 170 -15.922 -24.654 14.490 1.00 15.39 C ATOM 1535 C SER A 170 -16.490 -25.457 15.655 1.00 13.98 C ATOM 1536 O SER A 170 -15.974 -26.520 15.996 1.00 17.95 O ATOM 1537 CB SER A 170 -14.394 -24.647 14.567 1.00 12.50 C ATOM 1538 OG SER A 170 -13.831 -23.850 13.539 1.00 16.80 O ATOM 1539 HG SER A 170 -14.156 -22.919 13.629 1.00 0.00 H ATOM 1540 H SER A 170 -16.171 -22.662 15.292 1.00 0.00 H ATOM 1541 N GLY A 171 -17.549 -24.938 16.268 1.00 12.59 N ATOM 1542 CA GLY A 171 -18.156 -25.585 17.418 1.00 11.61 C ATOM 1543 C GLY A 171 -17.215 -25.659 18.607 1.00 15.09 C ATOM 1544 O GLY A 171 -17.283 -26.593 19.407 1.00 15.77 O ATOM 1545 H GLY A 171 -17.953 -24.047 15.916 1.00 0.00 H ATOM 1546 N LYS A 172 -16.330 -24.671 18.711 1.00 13.49 N ATOM 1547 CA LYS A 172 -15.351 -24.595 19.796 1.00 13.60 C ATOM 1548 C LYS A 172 -14.420 -25.809 19.869 1.00 12.07 C ATOM 1549 O LYS A 172 -13.863 -26.109 20.925 1.00 16.35 O ATOM 1550 CB LYS A 172 -16.038 -24.363 21.147 1.00 14.04 C ATOM 1551 CG LYS A 172 -16.749 -23.023 21.266 1.00 17.84 C ATOM 1552 CD LYS A 172 -17.287 -22.821 22.673 1.00 12.17 C ATOM 1553 CE LYS A 172 -17.892 -21.440 22.845 1.00 16.69 C ATOM 1554 NZ LYS A 172 -19.104 -21.255 22.001 1.00 27.68 N ATOM 1555 HZ1 LYS A 172 -18.850 -21.377 21.000 1.00 0.00 H ATOM 1556 HZ2 LYS A 172 -19.821 -21.960 22.266 1.00 0.00 H ATOM 1557 HZ3 LYS A 172 -19.485 -20.299 22.149 1.00 0.00 H ATOM 1558 H LYS A 172 -16.334 -23.921 17.991 1.00 0.00 H ATOM 1559 N GLU A 173 -14.256 -26.503 18.747 1.00 13.39 N ATOM 1560 CA GLU A 173 -13.307 -27.607 18.676 1.00 16.99 C ATOM 1561 C GLU A 173 -11.979 -27.125 18.109 1.00 10.96 C ATOM 1562 O GLU A 173 -11.881 -26.782 16.929 1.00 11.87 O ATOM 1563 CB GLU A 173 -13.859 -28.757 17.832 1.00 17.47 C ATOM 1564 CG GLU A 173 -15.019 -29.495 18.475 1.00 23.12 C ATOM 1565 CD GLU A 173 -15.300 -30.826 17.805 1.00 41.27 C ATOM 1566 OE1 GLU A 173 -16.452 -31.047 17.376 1.00 36.65 O ATOM 1567 OE2 GLU A 173 -14.366 -31.651 17.711 1.00 45.85 O ATOM 1568 H GLU A 173 -14.814 -26.254 17.906 1.00 0.00 H ATOM 1569 N PHE A 174 -10.960 -27.098 18.958 1.00 8.89 N ATOM 1570 CA PHE A 174 -9.651 -26.593 18.562 1.00 9.10 C ATOM 1571 C PHE A 174 -8.999 -27.416 17.453 1.00 9.10 C ATOM 1572 O PHE A 174 -8.264 -26.875 16.628 1.00 10.95 O ATOM 1573 CB PHE A 174 -8.726 -26.497 19.775 1.00 10.25 C ATOM 1574 CG PHE A 174 -9.083 -25.383 20.719 1.00 10.58 C ATOM 1575 CD1 PHE A 174 -8.786 -24.067 20.399 1.00 9.04 C ATOM 1576 CD2 PHE A 174 -9.710 -25.650 21.924 1.00 10.46 C ATOM 1577 CE1 PHE A 174 -9.107 -23.035 21.264 1.00 8.74 C ATOM 1578 CE2 PHE A 174 -10.034 -24.626 22.796 1.00 8.79 C ATOM 1579 CZ PHE A 174 -9.732 -23.315 22.465 1.00 9.92 C ATOM 1580 H PHE A 174 -11.098 -27.445 19.929 1.00 0.00 H ATOM 1581 N THR A 175 -9.276 -28.718 17.428 1.00 15.53 N ATOM 1582 CA THR A 175 -8.729 -29.592 16.391 1.00 13.03 C ATOM 1583 C THR A 175 -9.259 -29.212 15.013 1.00 9.85 C ATOM 1584 O THR A 175 -8.607 -29.457 13.998 1.00 11.57 O ATOM 1585 CB THR A 175 -9.042 -31.080 16.658 1.00 18.00 C ATOM 1586 OG1 THR A 175 -10.459 -31.287 16.635 1.00 24.33 O ATOM 1587 CG2 THR A 175 -8.487 -31.512 18.007 1.00 19.20 C ATOM 1588 HG1 THR A 175 -10.884 -30.731 17.335 1.00 0.00 H ATOM 1589 H THR A 175 -9.894 -29.122 18.161 1.00 0.00 H ATOM 1590 N LYS A 176 -10.445 -28.615 14.983 1.00 10.51 N ATOM 1591 CA LYS A 176 -11.013 -28.125 13.736 1.00 11.99 C ATOM 1592 C LYS A 176 -10.484 -26.729 13.426 1.00 13.02 C ATOM 1593 O LYS A 176 -10.413 -26.324 12.267 1.00 9.92 O ATOM 1594 CB LYS A 176 -12.541 -28.113 13.808 1.00 15.45 C ATOM 1595 CG LYS A 176 -13.160 -29.495 13.948 1.00 25.25 C ATOM 1596 CD LYS A 176 -14.678 -29.433 13.922 1.00 26.76 C ATOM 1597 CE LYS A 176 -15.285 -30.829 13.958 1.00 29.71 C ATOM 1598 NZ LYS A 176 -16.775 -30.791 13.947 1.00 43.94 N ATOM 1599 HZ1 LYS A 176 -17.113 -30.268 14.780 1.00 0.00 H ATOM 1600 HZ2 LYS A 176 -17.102 -30.316 13.081 1.00 0.00 H ATOM 1601 HZ3 LYS A 176 -17.146 -31.762 13.972 1.00 0.00 H ATOM 1602 H LYS A 176 -10.978 -28.495 15.868 1.00 0.00 H ATOM 1603 N LEU A 177 -10.102 -25.999 14.469 1.00 8.74 N ATOM 1604 CA LEU A 177 -9.616 -24.633 14.302 1.00 7.62 C ATOM 1605 C LEU A 177 -8.233 -24.574 13.655 1.00 7.31 C ATOM 1606 O LEU A 177 -8.010 -23.785 12.739 1.00 6.00 O ATOM 1607 CB LEU A 177 -9.595 -23.900 15.645 1.00 7.58 C ATOM 1608 CG LEU A 177 -9.061 -22.466 15.615 1.00 7.62 C ATOM 1609 CD1 LEU A 177 -9.925 -21.585 14.724 1.00 6.29 C ATOM 1610 CD2 LEU A 177 -8.972 -21.894 17.027 1.00 5.78 C ATOM 1611 H LEU A 177 -10.150 -26.409 15.423 1.00 0.00 H ATOM 1612 N TRP A 178 -7.312 -25.408 14.136 1.00 7.04 N ATOM 1613 CA TRP A 178 -5.923 -25.364 13.669 1.00 8.81 C ATOM 1614 C TRP A 178 -5.738 -25.416 12.142 1.00 7.48 C ATOM 1615 O TRP A 178 -5.011 -24.591 11.592 1.00 6.50 O ATOM 1616 CB TRP A 178 -5.048 -26.437 14.339 1.00 8.76 C ATOM 1617 CG TRP A 178 -5.162 -26.560 15.838 1.00 9.92 C ATOM 1618 CD1 TRP A 178 -5.237 -27.723 16.549 1.00 11.16 C ATOM 1619 CD2 TRP A 178 -5.197 -25.498 16.807 1.00 8.41 C ATOM 1620 NE1 TRP A 178 -5.321 -27.455 17.892 1.00 12.89 N ATOM 1621 CE2 TRP A 178 -5.299 -26.099 18.078 1.00 7.64 C ATOM 1622 CE3 TRP A 178 -5.158 -24.102 16.723 1.00 6.36 C ATOM 1623 CZ2 TRP A 178 -5.361 -25.354 19.254 1.00 7.44 C ATOM 1624 CZ3 TRP A 178 -5.222 -23.365 17.893 1.00 5.94 C ATOM 1625 CH2 TRP A 178 -5.320 -23.993 19.142 1.00 5.09 C ATOM 1626 HE1 TRP A 178 -5.390 -28.167 18.647 1.00 0.00 H ATOM 1627 H TRP A 178 -7.584 -26.105 14.858 1.00 0.00 H ATOM 1628 N PRO A 179 -6.384 -26.381 11.452 1.00 10.18 N ATOM 1629 CA PRO A 179 -6.173 -26.425 10.000 1.00 9.69 C ATOM 1630 C PRO A 179 -6.773 -25.217 9.289 1.00 11.81 C ATOM 1631 O PRO A 179 -6.252 -24.801 8.257 1.00 10.92 O ATOM 1632 CB PRO A 179 -6.912 -27.702 9.571 1.00 12.53 C ATOM 1633 CG PRO A 179 -7.093 -28.491 10.815 1.00 14.07 C ATOM 1634 CD PRO A 179 -7.253 -27.481 11.901 1.00 10.91 C ATOM 1635 N LYS A 180 -7.854 -24.664 9.834 1.00 10.86 N ATOM 1636 CA LYS A 180 -8.481 -23.489 9.238 1.00 11.78 C ATOM 1637 C LYS A 180 -7.534 -22.295 9.231 1.00 5.41 C ATOM 1638 O LYS A 180 -7.455 -21.563 8.245 1.00 9.18 O ATOM 1639 CB LYS A 180 -9.773 -23.119 9.973 1.00 13.32 C ATOM 1640 CG LYS A 180 -10.900 -24.124 9.808 1.00 19.31 C ATOM 1641 CD LYS A 180 -12.161 -23.652 10.515 1.00 15.74 C ATOM 1642 CE LYS A 180 -13.295 -24.655 10.353 1.00 18.17 C ATOM 1643 NZ LYS A 180 -14.538 -24.200 11.038 1.00 18.04 N ATOM 1644 HZ1 LYS A 180 -14.349 -24.081 12.054 1.00 0.00 H ATOM 1645 HZ2 LYS A 180 -14.843 -23.292 10.632 1.00 0.00 H ATOM 1646 HZ3 LYS A 180 -15.286 -24.910 10.904 1.00 0.00 H ATOM 1647 H LYS A 180 -8.258 -25.076 10.699 1.00 0.00 H ATOM 1648 N ILE A 181 -6.816 -22.099 10.332 1.00 6.18 N ATOM 1649 CA ILE A 181 -5.938 -20.938 10.451 1.00 5.87 C ATOM 1650 C ILE A 181 -4.481 -21.250 10.106 1.00 6.89 C ATOM 1651 O ILE A 181 -3.618 -20.374 10.177 1.00 7.08 O ATOM 1652 CB ILE A 181 -6.051 -20.266 11.838 1.00 5.55 C ATOM 1653 CG1 ILE A 181 -5.526 -21.183 12.940 1.00 5.41 C ATOM 1654 CG2 ILE A 181 -7.496 -19.876 12.115 1.00 7.02 C ATOM 1655 CD1 ILE A 181 -5.611 -20.565 14.330 1.00 6.58 C ATOM 1656 H ILE A 181 -6.880 -22.779 11.116 1.00 0.00 H ATOM 1657 N GLY A 182 -4.217 -22.497 9.725 1.00 9.14 N ATOM 1658 CA GLY A 182 -2.911 -22.876 9.212 1.00 7.73 C ATOM 1659 C GLY A 182 -1.867 -23.259 10.248 1.00 8.67 C ATOM 1660 O GLY A 182 -0.672 -23.262 9.951 1.00 7.39 O ATOM 1661 H GLY A 182 -4.963 -23.218 9.796 1.00 0.00 H ATOM 1662 N TRP A 183 -2.304 -23.588 11.459 1.00 5.22 N ATOM 1663 CA TRP A 183 -1.367 -23.967 12.517 1.00 6.51 C ATOM 1664 C TRP A 183 -1.108 -25.473 12.513 1.00 9.77 C ATOM 1665 O TRP A 183 -0.201 -25.965 13.187 1.00 7.55 O ATOM 1666 CB TRP A 183 -1.858 -23.496 13.886 1.00 8.56 C ATOM 1667 CG TRP A 183 -1.914 -22.002 14.013 1.00 3.58 C ATOM 1668 CD1 TRP A 183 -1.620 -21.086 13.046 1.00 4.94 C ATOM 1669 CD2 TRP A 183 -2.286 -21.254 15.175 1.00 6.61 C ATOM 1670 NE1 TRP A 183 -1.792 -19.813 13.532 1.00 5.27 N ATOM 1671 CE2 TRP A 183 -2.199 -19.888 14.837 1.00 4.39 C ATOM 1672 CE3 TRP A 183 -2.688 -21.605 16.467 1.00 4.20 C ATOM 1673 CZ2 TRP A 183 -2.497 -18.875 15.746 1.00 5.78 C ATOM 1674 CZ3 TRP A 183 -2.984 -20.597 17.366 1.00 5.86 C ATOM 1675 CH2 TRP A 183 -2.886 -19.249 17.001 1.00 4.28 C ATOM 1676 HE1 TRP A 183 -1.638 -18.935 12.996 1.00 0.00 H ATOM 1677 H TRP A 183 -3.325 -23.576 11.657 1.00 0.00 H ATOM 1678 N LYS A 184 -1.920 -26.191 11.747 1.00 7.42 N ATOM 1679 CA LYS A 184 -1.722 -27.616 11.542 1.00 11.28 C ATOM 1680 C LYS A 184 -2.103 -27.985 10.109 1.00 17.71 C ATOM 1681 O LYS A 184 -3.045 -27.428 9.543 1.00 12.14 O ATOM 1682 CB LYS A 184 -2.546 -28.418 12.551 1.00 14.41 C ATOM 1683 CG LYS A 184 -1.961 -29.775 12.897 1.00 15.09 C ATOM 1684 CD LYS A 184 -2.650 -30.380 14.109 1.00 13.71 C ATOM 1685 CE LYS A 184 -1.980 -31.676 14.539 1.00 17.14 C ATOM 1686 NZ LYS A 184 -2.594 -32.230 15.780 1.00 16.10 N ATOM 1687 HZ1 LYS A 184 -2.497 -31.539 16.551 1.00 0.00 H ATOM 1688 HZ2 LYS A 184 -3.602 -32.423 15.610 1.00 0.00 H ATOM 1689 HZ3 LYS A 184 -2.110 -33.113 16.040 1.00 0.00 H ATOM 1690 H LYS A 184 -2.721 -25.720 11.280 1.00 0.00 H ATOM 1691 N SER A 185 -1.358 -28.913 9.525 1.00 18.37 N ATOM 1692 CA SER A 185 -1.650 -29.380 8.179 1.00 24.22 C ATOM 1693 C SER A 185 -1.816 -30.887 8.240 1.00 24.22 C ATOM 1694 O SER A 185 -0.893 -31.638 7.930 1.00 33.99 O ATOM 1695 CB SER A 185 -0.527 -28.995 7.215 1.00 24.20 C ATOM 1696 OG SER A 185 -0.875 -29.302 5.877 1.00 27.27 O ATOM 1697 HG SER A 185 -1.043 -30.274 5.796 1.00 0.00 H ATOM 1698 H SER A 185 -0.549 -29.315 10.040 1.00 0.00 H ATOM 1699 N GLY A 186 -2.998 -31.325 8.660 1.00 23.20 N ATOM 1700 CA GLY A 186 -3.240 -32.733 8.900 1.00 28.99 C ATOM 1701 C GLY A 186 -2.796 -33.122 10.296 1.00 29.40 C ATOM 1702 O GLY A 186 -3.324 -32.622 11.289 1.00 27.91 O ATOM 1703 H GLY A 186 -3.766 -30.642 8.820 1.00 0.00 H ATOM 1704 N ASN A 187 -1.812 -34.012 10.373 1.00 36.54 N ATOM 1705 CA ASN A 187 -1.327 -34.506 11.656 1.00 31.03 C ATOM 1706 C ASN A 187 -0.051 -33.794 12.103 1.00 24.60 C ATOM 1707 O ASN A 187 0.446 -34.021 13.207 1.00 26.75 O ATOM 1708 CB ASN A 187 -1.102 -36.020 11.586 1.00 44.66 C ATOM 1709 CG ASN A 187 -0.904 -36.649 12.953 1.00 47.10 C ATOM 1710 OD1 ASN A 187 -1.869 -36.949 13.657 1.00 56.55 O ATOM 1711 ND2 ASN A 187 0.351 -36.857 13.334 1.00 42.98 N ATOM 1712 HD22 ASN A 187 1.136 -36.588 12.707 1.00 0.00 H ATOM 1713 HD21 ASN A 187 0.549 -37.289 14.259 1.00 0.00 H ATOM 1714 H ASN A 187 -1.377 -34.365 9.497 1.00 0.00 H ATOM 1715 N VAL A 188 0.473 -32.926 11.244 1.00 18.50 N ATOM 1716 CA VAL A 188 1.716 -32.223 11.545 1.00 27.67 C ATOM 1717 C VAL A 188 1.493 -30.750 11.896 1.00 14.98 C ATOM 1718 O VAL A 188 0.842 -30.010 11.156 1.00 14.85 O ATOM 1719 CB VAL A 188 2.742 -32.352 10.391 1.00 24.60 C ATOM 1720 CG1 VAL A 188 2.108 -31.992 9.056 1.00 29.65 C ATOM 1721 CG2 VAL A 188 3.969 -31.491 10.662 1.00 30.48 C ATOM 1722 H VAL A 188 -0.011 -32.745 10.342 1.00 0.00 H ATOM 1723 N TRP A 189 2.033 -30.339 13.039 1.00 13.56 N ATOM 1724 CA TRP A 189 1.964 -28.948 13.467 1.00 13.59 C ATOM 1725 C TRP A 189 2.864 -28.082 12.600 1.00 11.75 C ATOM 1726 O TRP A 189 3.953 -28.500 12.207 1.00 13.01 O ATOM 1727 CB TRP A 189 2.381 -28.814 14.932 1.00 12.09 C ATOM 1728 CG TRP A 189 1.371 -29.337 15.900 1.00 10.91 C ATOM 1729 CD1 TRP A 189 1.293 -30.602 16.401 1.00 11.03 C ATOM 1730 CD2 TRP A 189 0.293 -28.603 16.493 1.00 11.23 C ATOM 1731 NE1 TRP A 189 0.233 -30.704 17.270 1.00 11.21 N ATOM 1732 CE2 TRP A 189 -0.398 -29.489 17.343 1.00 15.38 C ATOM 1733 CE3 TRP A 189 -0.154 -27.281 16.389 1.00 11.43 C ATOM 1734 CZ2 TRP A 189 -1.513 -29.100 18.082 1.00 13.94 C ATOM 1735 CZ3 TRP A 189 -1.263 -26.897 17.121 1.00 13.36 C ATOM 1736 CH2 TRP A 189 -1.929 -27.803 17.957 1.00 8.29 C ATOM 1737 HE1 TRP A 189 -0.045 -31.562 17.787 1.00 0.00 H ATOM 1738 H TRP A 189 2.519 -31.030 13.645 1.00 0.00 H ATOM 1739 N THR A 190 2.402 -26.874 12.299 1.00 10.21 N ATOM 1740 CA THR A 190 3.214 -25.915 11.570 1.00 9.75 C ATOM 1741 C THR A 190 4.420 -25.548 12.430 1.00 13.56 C ATOM 1742 O THR A 190 4.275 -25.230 13.610 1.00 12.91 O ATOM 1743 CB THR A 190 2.405 -24.654 11.223 1.00 12.32 C ATOM 1744 OG1 THR A 190 1.259 -25.025 10.448 1.00 7.57 O ATOM 1745 CG2 THR A 190 3.249 -23.676 10.429 1.00 9.95 C ATOM 1746 HG1 THR A 190 0.737 -24.214 10.224 1.00 0.00 H ATOM 1747 H THR A 190 1.440 -26.609 12.591 1.00 0.00 H ATOM 1748 N ARG A 191 5.609 -25.609 11.840 1.00 16.58 N ATOM 1749 CA ARG A 191 6.845 -25.409 12.590 1.00 24.64 C ATOM 1750 C ARG A 191 7.221 -23.935 12.700 1.00 12.44 C ATOM 1751 O ARG A 191 7.316 -23.230 11.698 1.00 14.24 O ATOM 1752 CB ARG A 191 7.990 -26.198 11.950 1.00 23.44 C ATOM 1753 H ARG A 191 5.660 -25.804 10.820 1.00 0.00 H ATOM 1754 N TRP A 192 7.432 -23.475 13.928 1.00 13.60 N ATOM 1755 CA TRP A 192 7.859 -22.104 14.164 1.00 17.37 C ATOM 1756 C TRP A 192 9.377 -22.007 14.034 1.00 21.74 C ATOM 1757 O TRP A 192 10.097 -22.874 14.530 1.00 16.42 O ATOM 1758 CB TRP A 192 7.415 -21.644 15.553 1.00 11.84 C ATOM 1759 CG TRP A 192 7.780 -20.225 15.852 1.00 16.55 C ATOM 1760 CD1 TRP A 192 7.060 -19.110 15.538 1.00 15.56 C ATOM 1761 CD2 TRP A 192 8.963 -19.765 16.517 1.00 16.48 C ATOM 1762 NE1 TRP A 192 7.719 -17.985 15.968 1.00 12.87 N ATOM 1763 CE2 TRP A 192 8.889 -18.359 16.572 1.00 12.51 C ATOM 1764 CE3 TRP A 192 10.075 -20.407 17.071 1.00 17.90 C ATOM 1765 CZ2 TRP A 192 9.886 -17.582 17.160 1.00 13.50 C ATOM 1766 CZ3 TRP A 192 11.065 -19.633 17.656 1.00 19.24 C ATOM 1767 CH2 TRP A 192 10.963 -18.236 17.696 1.00 21.67 C ATOM 1768 HE1 TRP A 192 7.384 -17.007 15.853 1.00 0.00 H ATOM 1769 H TRP A 192 7.289 -24.109 14.740 1.00 0.00 H ATOM 1770 N PRO A 193 9.872 -20.946 13.374 1.00 23.34 N ATOM 1771 CA PRO A 193 9.083 -19.868 12.768 1.00 23.70 C ATOM 1772 C PRO A 193 8.919 -19.978 11.252 1.00 21.19 C ATOM 1773 O PRO A 193 8.057 -19.300 10.691 1.00 21.83 O ATOM 1774 CB PRO A 193 9.921 -18.633 13.089 1.00 23.15 C ATOM 1775 CG PRO A 193 11.329 -19.139 13.000 1.00 24.58 C ATOM 1776 CD PRO A 193 11.301 -20.588 13.453 1.00 26.67 C ATOM 1777 N LYS A 194 9.727 -20.812 10.604 1.00 18.23 N ATOM 1778 CA LYS A 194 9.778 -20.849 9.142 1.00 21.16 C ATOM 1779 C LYS A 194 8.518 -21.406 8.479 1.00 14.38 C ATOM 1780 O LYS A 194 8.203 -21.054 7.343 1.00 16.12 O ATOM 1781 CB LYS A 194 11.012 -21.624 8.665 1.00 30.57 C ATOM 1782 CG LYS A 194 12.334 -21.004 9.094 1.00 27.88 C ATOM 1783 CD LYS A 194 13.514 -21.671 8.401 1.00 48.15 C ATOM 1784 CE LYS A 194 13.628 -23.139 8.780 1.00 41.50 C ATOM 1785 NZ LYS A 194 13.879 -23.320 10.236 1.00 36.57 N ATOM 1786 HZ1 LYS A 194 14.768 -22.847 10.495 1.00 0.00 H ATOM 1787 HZ2 LYS A 194 13.094 -22.904 10.776 1.00 0.00 H ATOM 1788 HZ3 LYS A 194 13.950 -24.335 10.451 1.00 0.00 H ATOM 1789 H LYS A 194 10.337 -21.453 11.149 1.00 0.00 H ATOM 1790 N GLY A 195 7.799 -22.270 9.186 1.00 17.66 N ATOM 1791 CA GLY A 195 6.611 -22.892 8.629 1.00 15.38 C ATOM 1792 C GLY A 195 5.437 -21.945 8.465 1.00 14.65 C ATOM 1793 O GLY A 195 4.516 -22.215 7.692 1.00 11.40 O ATOM 1794 H GLY A 195 8.092 -22.505 10.156 1.00 0.00 H ATOM 1795 N PHE A 196 5.461 -20.835 9.194 1.00 12.68 N ATOM 1796 CA PHE A 196 4.346 -19.894 9.175 1.00 11.29 C ATOM 1797 C PHE A 196 4.457 -18.883 8.040 1.00 14.07 C ATOM 1798 O PHE A 196 5.542 -18.644 7.509 1.00 16.10 O ATOM 1799 CB PHE A 196 4.209 -19.188 10.526 1.00 10.58 C ATOM 1800 CG PHE A 196 3.799 -20.105 11.641 1.00 7.90 C ATOM 1801 CD1 PHE A 196 2.465 -20.414 11.843 1.00 8.18 C ATOM 1802 CD2 PHE A 196 4.747 -20.673 12.473 1.00 8.18 C ATOM 1803 CE1 PHE A 196 2.082 -21.266 12.863 1.00 10.45 C ATOM 1804 CE2 PHE A 196 4.372 -21.524 13.494 1.00 7.53 C ATOM 1805 CZ PHE A 196 3.038 -21.822 13.688 1.00 5.26 C ATOM 1806 H PHE A 196 6.290 -20.633 9.789 1.00 0.00 H ATOM 1807 N THR A 197 3.320 -18.301 7.672 1.00 9.58 N ATOM 1808 CA THR A 197 3.250 -17.353 6.567 1.00 13.29 C ATOM 1809 C THR A 197 3.117 -15.931 7.096 1.00 19.89 C ATOM 1810 O THR A 197 2.069 -15.552 7.622 1.00 15.90 O ATOM 1811 CB THR A 197 2.051 -17.658 5.653 1.00 15.41 C ATOM 1812 OG1 THR A 197 2.098 -19.030 5.241 1.00 20.45 O ATOM 1813 CG2 THR A 197 2.068 -16.758 4.427 1.00 16.02 C ATOM 1814 HG1 THR A 197 2.061 -19.614 6.039 1.00 0.00 H ATOM 1815 H THR A 197 2.449 -18.530 8.191 1.00 0.00 H ATOM 1816 N TRP A 198 4.177 -15.144 6.947 1.00 13.10 N ATOM 1817 CA TRP A 198 4.224 -13.811 7.539 1.00 15.56 C ATOM 1818 C TRP A 198 3.768 -12.705 6.589 1.00 15.51 C ATOM 1819 O TRP A 198 4.356 -11.625 6.559 1.00 21.66 O ATOM 1820 CB TRP A 198 5.633 -13.509 8.050 1.00 13.30 C ATOM 1821 CG TRP A 198 6.173 -14.555 8.972 1.00 14.27 C ATOM 1822 CD1 TRP A 198 7.132 -15.484 8.685 1.00 17.88 C ATOM 1823 CD2 TRP A 198 5.782 -14.788 10.331 1.00 12.99 C ATOM 1824 NE1 TRP A 198 7.366 -16.276 9.783 1.00 16.26 N ATOM 1825 CE2 TRP A 198 6.550 -15.870 10.806 1.00 13.63 C ATOM 1826 CE3 TRP A 198 4.860 -14.186 11.192 1.00 13.38 C ATOM 1827 CZ2 TRP A 198 6.424 -16.362 12.104 1.00 16.42 C ATOM 1828 CZ3 TRP A 198 4.737 -14.676 12.483 1.00 10.49 C ATOM 1829 CH2 TRP A 198 5.516 -15.753 12.925 1.00 11.00 C ATOM 1830 HE1 TRP A 198 8.051 -17.057 9.830 1.00 0.00 H ATOM 1831 H TRP A 198 4.991 -15.485 6.397 1.00 0.00 H ATOM 1832 N ASP A 199 2.721 -12.975 5.817 1.00 14.36 N ATOM 1833 CA ASP A 199 2.137 -11.959 4.945 1.00 14.49 C ATOM 1834 C ASP A 199 0.638 -12.180 4.762 1.00 12.92 C ATOM 1835 O ASP A 199 0.068 -13.110 5.328 1.00 9.74 O ATOM 1836 CB ASP A 199 2.855 -11.903 3.591 1.00 16.27 C ATOM 1837 CG ASP A 199 2.885 -13.243 2.885 1.00 16.88 C ATOM 1838 OD1 ASP A 199 3.990 -13.795 2.697 1.00 25.90 O ATOM 1839 OD2 ASP A 199 1.805 -13.745 2.517 1.00 18.67 O ATOM 1840 H ASP A 199 2.309 -13.930 5.834 1.00 0.00 H ATOM 1841 N LEU A 200 0.005 -11.328 3.964 1.00 14.59 N ATOM 1842 CA LEU A 200 -1.448 -11.355 3.828 1.00 10.77 C ATOM 1843 C LEU A 200 -1.978 -12.465 2.916 1.00 15.72 C ATOM 1844 O LEU A 200 -3.181 -12.561 2.690 1.00 12.51 O ATOM 1845 CB LEU A 200 -1.971 -9.987 3.382 1.00 11.72 C ATOM 1846 CG LEU A 200 -1.839 -8.875 4.426 1.00 10.09 C ATOM 1847 CD1 LEU A 200 -2.395 -7.563 3.897 1.00 16.06 C ATOM 1848 CD2 LEU A 200 -2.539 -9.271 5.717 1.00 12.89 C ATOM 1849 H LEU A 200 0.555 -10.628 3.426 1.00 0.00 H ATOM 1850 N SER A 201 -1.087 -13.303 2.399 1.00 14.70 N ATOM 1851 CA SER A 201 -1.521 -14.485 1.659 1.00 14.83 C ATOM 1852 C SER A 201 -1.861 -15.608 2.636 1.00 18.65 C ATOM 1853 O SER A 201 -2.434 -16.630 2.255 1.00 8.32 O ATOM 1854 CB SER A 201 -0.450 -14.945 0.666 1.00 15.80 C ATOM 1855 OG SER A 201 0.715 -15.389 1.341 1.00 13.92 O ATOM 1856 HG SER A 201 1.083 -14.647 1.884 1.00 0.00 H ATOM 1857 H SER A 201 -0.071 -13.116 2.522 1.00 0.00 H ATOM 1858 N ALA A 202 -1.503 -15.403 3.901 1.00 14.38 N ATOM 1859 CA ALA A 202 -1.801 -16.364 4.956 1.00 10.59 C ATOM 1860 C ALA A 202 -3.311 -16.493 5.140 1.00 8.55 C ATOM 1861 O ALA A 202 -4.052 -15.549 4.867 1.00 13.67 O ATOM 1862 CB ALA A 202 -1.137 -15.931 6.259 1.00 8.61 C ATOM 1863 H ALA A 202 -0.994 -14.529 4.145 1.00 0.00 H ATOM 1864 N PRO A 203 -3.774 -17.668 5.595 1.00 8.51 N ATOM 1865 CA PRO A 203 -5.211 -17.866 5.806 1.00 8.63 C ATOM 1866 C PRO A 203 -5.778 -16.932 6.869 1.00 13.52 C ATOM 1867 O PRO A 203 -5.031 -16.378 7.678 1.00 8.25 O ATOM 1868 CB PRO A 203 -5.302 -19.323 6.273 1.00 9.30 C ATOM 1869 CG PRO A 203 -3.937 -19.658 6.770 1.00 12.49 C ATOM 1870 CD PRO A 203 -3.001 -18.883 5.899 1.00 8.57 C ATOM 1871 N GLN A 204 -7.096 -16.760 6.851 1.00 9.29 N ATOM 1872 CA GLN A 204 -7.783 -15.921 7.824 1.00 11.85 C ATOM 1873 C GLN A 204 -7.516 -16.425 9.239 1.00 7.08 C ATOM 1874 O GLN A 204 -7.697 -17.608 9.523 1.00 5.69 O ATOM 1875 CB GLN A 204 -9.286 -15.924 7.534 1.00 13.45 C ATOM 1876 CG GLN A 204 -10.075 -14.844 8.244 1.00 15.52 C ATOM 1877 CD GLN A 204 -11.573 -14.986 8.039 1.00 23.66 C ATOM 1878 OE1 GLN A 204 -12.024 -15.677 7.126 1.00 29.53 O ATOM 1879 NE2 GLN A 204 -12.352 -14.338 8.898 1.00 24.61 N ATOM 1880 HE22 GLN A 204 -11.927 -13.765 9.655 1.00 0.00 H ATOM 1881 HE21 GLN A 204 -13.386 -14.404 8.814 1.00 0.00 H ATOM 1882 H GLN A 204 -7.656 -17.240 6.118 1.00 0.00 H ATOM 1883 N GLY A 205 -7.065 -15.530 10.116 1.00 6.01 N ATOM 1884 CA GLY A 205 -6.818 -15.875 11.508 1.00 5.76 C ATOM 1885 C GLY A 205 -5.445 -16.464 11.790 1.00 6.37 C ATOM 1886 O GLY A 205 -5.174 -16.912 12.906 1.00 3.11 O ATOM 1887 H GLY A 205 -6.884 -14.557 9.797 1.00 0.00 H ATOM 1888 N HIS A 206 -4.578 -16.460 10.782 1.00 2.57 N ATOM 1889 CA HIS A 206 -3.242 -17.045 10.898 1.00 4.47 C ATOM 1890 C HIS A 206 -2.413 -16.396 12.012 1.00 4.25 C ATOM 1891 O HIS A 206 -1.651 -17.072 12.703 1.00 4.24 O ATOM 1892 CB HIS A 206 -2.506 -16.924 9.561 1.00 5.89 C ATOM 1893 CG HIS A 206 -1.267 -17.761 9.466 1.00 6.50 C ATOM 1894 ND1 HIS A 206 -1.279 -19.131 9.621 1.00 4.74 N ATOM 1895 CD2 HIS A 206 0.019 -17.423 9.207 1.00 8.43 C ATOM 1896 CE1 HIS A 206 -0.051 -19.598 9.476 1.00 8.43 C ATOM 1897 NE2 HIS A 206 0.755 -18.583 9.223 1.00 6.99 N ATOM 1898 H HIS A 206 -4.859 -16.026 9.880 1.00 0.00 H ATOM 1899 N LEU A 207 -2.569 -15.086 12.180 1.00 3.09 N ATOM 1900 CA LEU A 207 -1.809 -14.329 13.172 1.00 3.96 C ATOM 1901 C LEU A 207 -2.750 -13.536 14.077 1.00 3.84 C ATOM 1902 O LEU A 207 -3.856 -13.194 13.663 1.00 6.10 O ATOM 1903 CB LEU A 207 -0.830 -13.382 12.469 1.00 3.84 C ATOM 1904 CG LEU A 207 0.200 -14.040 11.547 1.00 6.65 C ATOM 1905 CD1 LEU A 207 1.122 -12.997 10.931 1.00 6.07 C ATOM 1906 CD2 LEU A 207 1.004 -15.082 12.304 1.00 4.13 C ATOM 1907 H LEU A 207 -3.257 -14.582 11.584 1.00 0.00 H ATOM 1908 N PRO A 208 -2.318 -13.231 15.315 1.00 5.41 N ATOM 1909 CA PRO A 208 -1.038 -13.563 15.958 1.00 2.60 C ATOM 1910 C PRO A 208 -0.970 -15.019 16.409 1.00 6.46 C ATOM 1911 O PRO A 208 -2.004 -15.657 16.608 1.00 2.42 O ATOM 1912 CB PRO A 208 -1.013 -12.650 17.193 1.00 4.93 C ATOM 1913 CG PRO A 208 -2.132 -11.665 17.001 1.00 2.58 C ATOM 1914 CD PRO A 208 -3.148 -12.380 16.180 1.00 3.94 C ATOM 1915 N LEU A 209 0.245 -15.528 16.584 1.00 6.82 N ATOM 1916 CA LEU A 209 0.442 -16.915 16.987 1.00 4.38 C ATOM 1917 C LEU A 209 0.249 -17.124 18.485 1.00 6.18 C ATOM 1918 O LEU A 209 0.586 -16.259 19.295 1.00 4.78 O ATOM 1919 CB LEU A 209 1.834 -17.398 16.577 1.00 7.39 C ATOM 1920 CG LEU A 209 2.153 -17.365 15.083 1.00 6.07 C ATOM 1921 CD1 LEU A 209 3.511 -18.004 14.818 1.00 9.43 C ATOM 1922 CD2 LEU A 209 1.065 -18.066 14.292 1.00 4.65 C ATOM 1923 H LEU A 209 1.076 -14.922 16.430 1.00 0.00 H ATOM 1924 N LEU A 210 -0.299 -18.283 18.838 1.00 2.96 N ATOM 1925 CA LEU A 210 -0.425 -18.702 20.227 1.00 3.68 C ATOM 1926 C LEU A 210 0.209 -20.077 20.365 1.00 6.52 C ATOM 1927 O LEU A 210 -0.393 -21.080 19.977 1.00 6.73 O ATOM 1928 CB LEU A 210 -1.897 -18.765 20.640 1.00 1.77 C ATOM 1929 CG LEU A 210 -2.662 -17.442 20.688 1.00 2.82 C ATOM 1930 CD1 LEU A 210 -4.156 -17.690 20.861 1.00 3.27 C ATOM 1931 CD2 LEU A 210 -2.129 -16.557 21.807 1.00 2.13 C ATOM 1932 H LEU A 210 -0.652 -18.916 18.092 1.00 0.00 H ATOM 1933 N ASN A 211 1.426 -20.118 20.904 1.00 3.26 N ATOM 1934 CA ASN A 211 2.176 -21.367 21.048 1.00 7.04 C ATOM 1935 C ASN A 211 1.377 -22.430 21.794 1.00 6.02 C ATOM 1936 O ASN A 211 0.809 -22.165 22.856 1.00 7.42 O ATOM 1937 CB ASN A 211 3.511 -21.107 21.753 1.00 5.94 C ATOM 1938 CG ASN A 211 4.472 -22.293 21.674 1.00 8.65 C ATOM 1939 OD1 ASN A 211 4.297 -23.221 20.873 1.00 10.19 O ATOM 1940 ND2 ASN A 211 5.515 -22.246 22.495 1.00 10.25 N ATOM 1941 HD22 ASN A 211 5.624 -21.448 23.153 1.00 0.00 H ATOM 1942 HD21 ASN A 211 6.223 -23.008 22.480 1.00 0.00 H ATOM 1943 H ASN A 211 1.859 -19.232 21.234 1.00 0.00 H ATOM 1944 N GLN A 212 1.324 -23.629 21.227 1.00 7.24 N ATOM 1945 CA GLN A 212 0.549 -24.710 21.821 1.00 7.10 C ATOM 1946 C GLN A 212 1.423 -25.689 22.597 1.00 7.14 C ATOM 1947 O GLN A 212 0.971 -26.769 22.975 1.00 4.50 O ATOM 1948 CB GLN A 212 -0.264 -25.433 20.748 1.00 5.47 C ATOM 1949 CG GLN A 212 -1.354 -24.566 20.153 1.00 3.67 C ATOM 1950 CD GLN A 212 -2.317 -24.071 21.209 1.00 5.35 C ATOM 1951 OE1 GLN A 212 -2.926 -24.866 21.921 1.00 5.62 O ATOM 1952 NE2 GLN A 212 -2.447 -22.753 21.330 1.00 4.31 N ATOM 1953 HE22 GLN A 212 -1.911 -22.118 20.705 1.00 0.00 H ATOM 1954 HE21 GLN A 212 -3.085 -22.357 22.050 1.00 0.00 H ATOM 1955 H GLN A 212 1.845 -23.800 20.343 1.00 0.00 H ATOM 1956 N LEU A 213 2.670 -25.296 22.842 1.00 6.39 N ATOM 1957 CA LEU A 213 3.603 -26.107 23.617 1.00 4.51 C ATOM 1958 C LEU A 213 3.038 -26.464 24.991 1.00 5.14 C ATOM 1959 O LEU A 213 3.289 -27.550 25.512 1.00 6.71 O ATOM 1960 CB LEU A 213 4.937 -25.373 23.775 1.00 6.08 C ATOM 1961 CG LEU A 213 5.979 -26.020 24.691 1.00 5.43 C ATOM 1962 CD1 LEU A 213 6.335 -27.411 24.192 1.00 5.06 C ATOM 1963 CD2 LEU A 213 7.221 -25.149 24.794 1.00 5.64 C ATOM 1964 H LEU A 213 2.991 -24.380 22.469 1.00 0.00 H ATOM 1965 N ARG A 214 2.262 -25.552 25.569 1.00 3.79 N ATOM 1966 CA ARG A 214 1.692 -25.769 26.895 1.00 6.05 C ATOM 1967 C ARG A 214 0.171 -25.941 26.869 1.00 3.34 C ATOM 1968 O ARG A 214 -0.512 -25.633 27.846 1.00 3.39 O ATOM 1969 CB ARG A 214 2.093 -24.628 27.837 1.00 4.99 C ATOM 1970 CG ARG A 214 3.601 -24.477 27.990 1.00 9.66 C ATOM 1971 CD ARG A 214 3.993 -23.090 28.484 1.00 14.84 C ATOM 1972 NE ARG A 214 5.277 -22.675 27.925 1.00 26.69 N ATOM 1973 CZ ARG A 214 5.414 -21.853 26.889 1.00 17.60 C ATOM 1974 NH1 ARG A 214 4.344 -21.333 26.302 1.00 22.32 N ATOM 1975 NH2 ARG A 214 6.624 -21.541 26.445 1.00 33.92 N ATOM 1976 HE ARG A 214 6.142 -23.047 28.367 1.00 0.00 H ATOM 1977 HH12 ARG A 214 4.456 -20.690 25.492 1.00 0.00 H ATOM 1978 HH11 ARG A 214 3.393 -21.568 26.652 1.00 0.00 H ATOM 1979 HH22 ARG A 214 6.731 -20.898 25.635 1.00 0.00 H ATOM 1980 HH21 ARG A 214 7.466 -21.939 26.907 1.00 0.00 H ATOM 1981 H ARG A 214 2.057 -24.665 25.066 1.00 0.00 H ATOM 1982 N GLY A 215 -0.358 -26.434 25.754 1.00 5.56 N ATOM 1983 CA GLY A 215 -1.782 -26.706 25.656 1.00 4.00 C ATOM 1984 C GLY A 215 -2.627 -25.513 25.242 1.00 5.52 C ATOM 1985 O GLY A 215 -2.110 -24.416 25.026 1.00 6.11 O ATOM 1986 H GLY A 215 0.257 -26.628 24.938 1.00 0.00 H ATOM 1987 N VAL A 216 -3.936 -25.733 25.144 1.00 4.64 N ATOM 1988 CA VAL A 216 -4.856 -24.731 24.610 1.00 5.88 C ATOM 1989 C VAL A 216 -5.435 -23.806 25.675 1.00 5.51 C ATOM 1990 O VAL A 216 -6.236 -22.929 25.355 1.00 4.67 O ATOM 1991 CB VAL A 216 -6.058 -25.392 23.899 1.00 6.08 C ATOM 1992 CG1 VAL A 216 -5.593 -26.312 22.793 1.00 12.05 C ATOM 1993 CG2 VAL A 216 -6.915 -26.151 24.898 1.00 5.54 C ATOM 1994 H VAL A 216 -4.317 -26.648 25.458 1.00 0.00 H ATOM 1995 N ARG A 217 -5.041 -24.009 26.930 1.00 3.20 N ATOM 1996 CA ARG A 217 -5.648 -23.293 28.052 1.00 5.51 C ATOM 1997 C ARG A 217 -5.566 -21.773 27.906 1.00 4.97 C ATOM 1998 O ARG A 217 -6.551 -21.069 28.127 1.00 3.89 O ATOM 1999 CB ARG A 217 -5.030 -23.740 29.379 1.00 6.66 C ATOM 2000 CG ARG A 217 -5.296 -25.202 29.722 1.00 5.79 C ATOM 2001 CD ARG A 217 -4.635 -25.579 31.040 1.00 7.11 C ATOM 2002 NE ARG A 217 -3.234 -25.173 31.055 1.00 2.71 N ATOM 2003 CZ ARG A 217 -2.240 -25.919 30.588 1.00 4.58 C ATOM 2004 NH1 ARG A 217 -2.489 -27.119 30.078 1.00 2.87 N ATOM 2005 NH2 ARG A 217 -0.996 -25.465 30.630 1.00 4.62 N ATOM 2006 HE ARG A 217 -3.000 -24.242 31.456 1.00 0.00 H ATOM 2007 HH12 ARG A 217 -1.708 -27.701 29.713 1.00 0.00 H ATOM 2008 HH11 ARG A 217 -3.465 -27.477 30.043 1.00 0.00 H ATOM 2009 HH22 ARG A 217 -0.217 -26.049 30.264 1.00 0.00 H ATOM 2010 HH21 ARG A 217 -0.799 -24.525 31.029 1.00 0.00 H ATOM 2011 H ARG A 217 -4.282 -24.695 27.118 1.00 0.00 H ATOM 2012 N VAL A 218 -4.396 -21.274 27.523 1.00 2.59 N ATOM 2013 CA VAL A 218 -4.225 -19.844 27.296 1.00 4.42 C ATOM 2014 C VAL A 218 -5.130 -19.359 26.161 1.00 4.30 C ATOM 2015 O VAL A 218 -5.842 -18.367 26.311 1.00 3.10 O ATOM 2016 CB VAL A 218 -2.755 -19.485 26.999 1.00 8.71 C ATOM 2017 CG1 VAL A 218 -2.653 -18.094 26.385 1.00 7.34 C ATOM 2018 CG2 VAL A 218 -1.922 -19.579 28.272 1.00 5.80 C ATOM 2019 H VAL A 218 -3.588 -21.914 27.383 1.00 0.00 H ATOM 2020 N ALA A 219 -5.113 -20.079 25.042 1.00 2.32 N ATOM 2021 CA ALA A 219 -5.925 -19.725 23.880 1.00 3.57 C ATOM 2022 C ALA A 219 -7.418 -19.669 24.207 1.00 5.89 C ATOM 2023 O ALA A 219 -8.101 -18.708 23.851 1.00 3.36 O ATOM 2024 CB ALA A 219 -5.668 -20.693 22.734 1.00 3.19 C ATOM 2025 H ALA A 219 -4.503 -20.920 24.993 1.00 0.00 H ATOM 2026 N GLU A 220 -7.921 -20.696 24.887 1.00 3.42 N ATOM 2027 CA GLU A 220 -9.339 -20.747 25.224 1.00 5.57 C ATOM 2028 C GLU A 220 -9.721 -19.606 26.158 1.00 5.52 C ATOM 2029 O GLU A 220 -10.759 -18.972 25.980 1.00 5.10 O ATOM 2030 CB GLU A 220 -9.721 -22.091 25.847 1.00 9.71 C ATOM 2031 CG GLU A 220 -11.200 -22.182 26.202 1.00 8.64 C ATOM 2032 CD GLU A 220 -11.634 -23.578 26.598 1.00 18.49 C ATOM 2033 OE1 GLU A 220 -12.844 -23.770 26.847 1.00 19.50 O ATOM 2034 OE2 GLU A 220 -10.774 -24.482 26.659 1.00 13.60 O ATOM 2035 H GLU A 220 -7.295 -21.472 25.182 1.00 0.00 H ATOM 2036 N SER A 221 -8.875 -19.349 27.151 1.00 4.43 N ATOM 2037 CA SER A 221 -9.109 -18.255 28.085 1.00 4.83 C ATOM 2038 C SER A 221 -9.171 -16.919 27.358 1.00 4.70 C ATOM 2039 O SER A 221 -9.980 -16.053 27.697 1.00 3.70 O ATOM 2040 CB SER A 221 -8.018 -18.221 29.155 1.00 7.24 C ATOM 2041 OG SER A 221 -8.174 -19.295 30.066 1.00 7.86 O ATOM 2042 HG SER A 221 -8.115 -20.153 29.576 1.00 0.00 H ATOM 2043 H SER A 221 -8.028 -19.942 27.264 1.00 0.00 H ATOM 2044 N LEU A 222 -8.318 -16.764 26.352 1.00 2.69 N ATOM 2045 CA LEU A 222 -8.272 -15.534 25.573 1.00 3.40 C ATOM 2046 C LEU A 222 -9.526 -15.370 24.714 1.00 5.07 C ATOM 2047 O LEU A 222 -10.104 -14.285 24.645 1.00 4.78 O ATOM 2048 CB LEU A 222 -7.021 -15.513 24.695 1.00 2.82 C ATOM 2049 CG LEU A 222 -6.794 -14.263 23.843 1.00 5.82 C ATOM 2050 CD1 LEU A 222 -6.617 -13.042 24.730 1.00 2.40 C ATOM 2051 CD2 LEU A 222 -5.584 -14.455 22.942 1.00 2.82 C ATOM 2052 H LEU A 222 -7.667 -17.540 26.115 1.00 0.00 H ATOM 2053 N TYR A 223 -9.944 -16.451 24.063 1.00 4.91 N ATOM 2054 CA TYR A 223 -11.118 -16.407 23.198 1.00 2.52 C ATOM 2055 C TYR A 223 -12.397 -16.191 24.007 1.00 6.32 C ATOM 2056 O TYR A 223 -13.368 -15.621 23.506 1.00 5.92 O ATOM 2057 CB TYR A 223 -11.225 -17.682 22.351 1.00 3.70 C ATOM 2058 CG TYR A 223 -10.081 -17.884 21.373 1.00 4.73 C ATOM 2059 CD1 TYR A 223 -9.261 -16.825 21.000 1.00 3.27 C ATOM 2060 CD2 TYR A 223 -9.826 -19.135 20.822 1.00 3.43 C ATOM 2061 CE1 TYR A 223 -8.214 -17.007 20.111 1.00 3.67 C ATOM 2062 CE2 TYR A 223 -8.785 -19.326 19.930 1.00 3.22 C ATOM 2063 CZ TYR A 223 -7.982 -18.259 19.579 1.00 4.22 C ATOM 2064 OH TYR A 223 -6.944 -18.443 18.698 1.00 3.63 O ATOM 2065 HH TYR A 223 -6.475 -17.582 18.558 1.00 0.00 H ATOM 2066 H TYR A 223 -9.424 -17.345 24.172 1.00 0.00 H ATOM 2067 N ARG A 224 -12.388 -16.642 25.260 1.00 4.21 N ATOM 2068 CA ARG A 224 -13.551 -16.516 26.135 1.00 8.64 C ATOM 2069 C ARG A 224 -13.539 -15.232 26.964 1.00 6.96 C ATOM 2070 O ARG A 224 -14.469 -14.976 27.729 1.00 6.92 O ATOM 2071 CB ARG A 224 -13.658 -17.727 27.067 1.00 8.50 C ATOM 2072 CG ARG A 224 -13.994 -19.035 26.368 1.00 8.55 C ATOM 2073 CD ARG A 224 -14.222 -20.148 27.381 1.00 13.14 C ATOM 2074 NE ARG A 224 -14.589 -21.410 26.743 1.00 16.93 N ATOM 2075 CZ ARG A 224 -15.838 -21.770 26.459 1.00 19.35 C ATOM 2076 NH1 ARG A 224 -16.849 -20.963 26.752 1.00 16.39 N ATOM 2077 NH2 ARG A 224 -16.078 -22.938 25.877 1.00 12.56 N ATOM 2078 HE ARG A 224 -13.824 -22.070 26.495 1.00 0.00 H ATOM 2079 HH12 ARG A 224 -17.824 -21.248 26.528 1.00 0.00 H ATOM 2080 HH11 ARG A 224 -16.667 -20.045 27.205 1.00 0.00 H ATOM 2081 HH22 ARG A 224 -17.055 -23.218 25.656 1.00 0.00 H ATOM 2082 HH21 ARG A 224 -15.289 -23.574 25.642 1.00 0.00 H ATOM 2083 H ARG A 224 -11.528 -17.097 25.626 1.00 0.00 H ATOM 2084 N HIS A 225 -12.486 -14.435 26.815 1.00 8.78 N ATOM 2085 CA HIS A 225 -12.364 -13.172 27.542 1.00 8.16 C ATOM 2086 C HIS A 225 -13.500 -12.229 27.155 1.00 5.98 C ATOM 2087 O HIS A 225 -13.834 -12.108 25.979 1.00 8.27 O ATOM 2088 CB HIS A 225 -11.010 -12.519 27.249 1.00 7.93 C ATOM 2089 CG HIS A 225 -10.681 -11.368 28.150 1.00 10.44 C ATOM 2090 ND1 HIS A 225 -11.303 -10.142 28.051 1.00 3.66 N ATOM 2091 CD2 HIS A 225 -9.787 -11.256 29.161 1.00 7.06 C ATOM 2092 CE1 HIS A 225 -10.810 -9.325 28.965 1.00 8.04 C ATOM 2093 NE2 HIS A 225 -9.889 -9.976 29.652 1.00 7.25 N ATOM 2094 H HIS A 225 -11.727 -14.718 26.163 1.00 0.00 H ATOM 2095 N PRO A 226 -14.097 -11.554 28.148 1.00 9.03 N ATOM 2096 CA PRO A 226 -15.259 -10.683 27.922 1.00 10.41 C ATOM 2097 C PRO A 226 -15.014 -9.511 26.969 1.00 10.49 C ATOM 2098 O PRO A 226 -15.982 -8.878 26.550 1.00 9.38 O ATOM 2099 CB PRO A 226 -15.588 -10.160 29.329 1.00 14.15 C ATOM 2100 CG PRO A 226 -14.342 -10.385 30.134 1.00 13.86 C ATOM 2101 CD PRO A 226 -13.744 -11.637 29.575 1.00 9.69 C ATOM 2102 N VAL A 227 -13.758 -9.229 26.631 1.00 7.72 N ATOM 2103 CA VAL A 227 -13.432 -8.088 25.774 1.00 5.96 C ATOM 2104 C VAL A 227 -14.147 -8.122 24.419 1.00 8.32 C ATOM 2105 O VAL A 227 -14.614 -7.094 23.929 1.00 6.95 O ATOM 2106 CB VAL A 227 -11.899 -7.943 25.557 1.00 6.83 C ATOM 2107 CG1 VAL A 227 -11.304 -9.216 24.969 1.00 5.99 C ATOM 2108 CG2 VAL A 227 -11.590 -6.747 24.665 1.00 7.35 C ATOM 2109 H VAL A 227 -12.989 -9.834 26.984 1.00 0.00 H ATOM 2110 N TRP A 228 -14.249 -9.308 23.829 1.00 5.61 N ATOM 2111 CA TRP A 228 -14.776 -9.440 22.476 1.00 7.55 C ATOM 2112 C TRP A 228 -16.245 -9.023 22.385 1.00 10.60 C ATOM 2113 O TRP A 228 -16.634 -8.300 21.469 1.00 12.83 O ATOM 2114 CB TRP A 228 -14.557 -10.865 21.966 1.00 9.16 C ATOM 2115 CG TRP A 228 -13.176 -11.366 22.286 1.00 10.52 C ATOM 2116 CD1 TRP A 228 -12.850 -12.449 23.050 1.00 5.81 C ATOM 2117 CD2 TRP A 228 -11.935 -10.772 21.883 1.00 4.55 C ATOM 2118 NE1 TRP A 228 -11.483 -12.580 23.127 1.00 10.51 N ATOM 2119 CE2 TRP A 228 -10.899 -11.561 22.422 1.00 6.46 C ATOM 2120 CE3 TRP A 228 -11.600 -9.654 21.110 1.00 6.22 C ATOM 2121 CZ2 TRP A 228 -9.552 -11.268 22.215 1.00 8.71 C ATOM 2122 CZ3 TRP A 228 -10.260 -9.362 20.909 1.00 5.16 C ATOM 2123 CH2 TRP A 228 -9.254 -10.167 21.458 1.00 3.52 C ATOM 2124 HE1 TRP A 228 -10.975 -13.331 23.637 1.00 0.00 H ATOM 2125 H TRP A 228 -13.947 -10.160 24.343 1.00 0.00 H ATOM 2126 N SER A 229 -17.053 -9.461 23.343 1.00 8.02 N ATOM 2127 CA SER A 229 -18.461 -9.083 23.375 1.00 11.48 C ATOM 2128 C SER A 229 -18.620 -7.637 23.834 1.00 13.63 C ATOM 2129 O SER A 229 -19.477 -6.907 23.338 1.00 12.16 O ATOM 2130 CB SER A 229 -19.250 -10.020 24.292 1.00 12.54 C ATOM 2131 OG SER A 229 -18.722 -10.008 25.608 1.00 12.52 O ATOM 2132 HG SER A 229 -18.772 -9.089 25.974 1.00 0.00 H ATOM 2133 H SER A 229 -16.675 -10.085 24.084 1.00 0.00 H ATOM 2134 N GLN A 230 -17.782 -7.232 24.782 1.00 11.51 N ATOM 2135 CA GLN A 230 -17.830 -5.883 25.336 1.00 15.05 C ATOM 2136 C GLN A 230 -17.555 -4.807 24.284 1.00 14.65 C ATOM 2137 O GLN A 230 -18.167 -3.741 24.305 1.00 12.70 O ATOM 2138 CB GLN A 230 -16.840 -5.755 26.495 1.00 15.34 C ATOM 2139 CG GLN A 230 -16.762 -4.370 27.114 1.00 21.51 C ATOM 2140 CD GLN A 230 -15.890 -4.339 28.354 1.00 29.89 C ATOM 2141 OE1 GLN A 230 -15.415 -5.377 28.817 1.00 27.06 O ATOM 2142 NE2 GLN A 230 -15.676 -3.147 28.899 1.00 27.77 N ATOM 2143 HE22 GLN A 230 -16.098 -2.297 28.473 1.00 0.00 H ATOM 2144 HE21 GLN A 230 -15.086 -3.063 29.752 1.00 0.00 H ATOM 2145 H GLN A 230 -17.069 -7.898 25.141 1.00 0.00 H ATOM 2146 N TYR A 231 -16.642 -5.092 23.361 1.00 11.12 N ATOM 2147 CA TYR A 231 -16.251 -4.108 22.352 1.00 11.12 C ATOM 2148 C TYR A 231 -16.813 -4.417 20.965 1.00 10.54 C ATOM 2149 O TYR A 231 -16.419 -3.802 19.973 1.00 19.38 O ATOM 2150 CB TYR A 231 -14.727 -3.963 22.302 1.00 10.06 C ATOM 2151 CG TYR A 231 -14.156 -3.194 23.474 1.00 9.26 C ATOM 2152 CD1 TYR A 231 -13.967 -1.821 23.400 1.00 14.56 C ATOM 2153 CD2 TYR A 231 -13.817 -3.839 24.654 1.00 17.04 C ATOM 2154 CE1 TYR A 231 -13.451 -1.112 24.468 1.00 18.00 C ATOM 2155 CE2 TYR A 231 -13.299 -3.139 25.728 1.00 14.36 C ATOM 2156 CZ TYR A 231 -13.118 -1.776 25.628 1.00 17.63 C ATOM 2157 OH TYR A 231 -12.603 -1.074 26.694 1.00 18.26 O ATOM 2158 HH TYR A 231 -12.539 -0.115 26.456 1.00 0.00 H ATOM 2159 H TYR A 231 -16.197 -6.032 23.356 1.00 0.00 H ATOM 2160 N GLY A 232 -17.734 -5.372 20.903 1.00 11.74 N ATOM 2161 CA GLY A 232 -18.428 -5.685 19.667 1.00 14.10 C ATOM 2162 C GLY A 232 -17.577 -6.360 18.608 1.00 20.00 C ATOM 2163 O GLY A 232 -17.756 -6.115 17.414 1.00 12.91 O ATOM 2164 H GLY A 232 -17.964 -5.910 21.763 1.00 0.00 H ATOM 2165 N TRP A 233 -16.653 -7.215 19.038 1.00 13.24 N ATOM 2166 CA TRP A 233 -15.819 -7.966 18.105 1.00 13.09 C ATOM 2167 C TRP A 233 -16.512 -9.241 17.629 1.00 18.21 C ATOM 2168 O TRP A 233 -16.055 -9.893 16.690 1.00 13.85 O ATOM 2169 CB TRP A 233 -14.470 -8.313 18.738 1.00 12.19 C ATOM 2170 CG TRP A 233 -13.541 -7.149 18.842 1.00 5.19 C ATOM 2171 CD1 TRP A 233 -13.207 -6.467 19.974 1.00 7.37 C ATOM 2172 CD2 TRP A 233 -12.832 -6.520 17.769 1.00 6.52 C ATOM 2173 NE1 TRP A 233 -12.330 -5.454 19.673 1.00 6.96 N ATOM 2174 CE2 TRP A 233 -12.083 -5.464 18.325 1.00 5.29 C ATOM 2175 CE3 TRP A 233 -12.755 -6.747 16.391 1.00 5.53 C ATOM 2176 CZ2 TRP A 233 -11.268 -4.638 17.555 1.00 8.10 C ATOM 2177 CZ3 TRP A 233 -11.945 -5.925 15.626 1.00 6.22 C ATOM 2178 CH2 TRP A 233 -11.214 -4.884 16.209 1.00 10.03 C ATOM 2179 OXT TRP A 233 -17.538 -9.653 18.173 1.00 15.28 O ATOM 2180 HE1 TRP A 233 -11.920 -4.787 20.357 1.00 0.00 H ATOM 2181 H TRP A 233 -16.522 -7.351 20.061 1.00 0.00 H TER 2182 TRP A 233 HETATM 2183 O HOH 1 1.953 13.761 0.767 1.00 29.51 O HETATM 2184 O HOH 2 -16.932 11.476 -9.891 1.00 23.46 O HETATM 2185 O HOH 3 7.066 -23.990 28.584 1.00 25.31 O HETATM 2186 O HOH 4 -1.338 -10.856 36.119 1.00 22.35 O HETATM 2187 O HOH 5 8.620 -12.235 21.489 1.00 19.97 O HETATM 2188 O HOH 6 7.271 16.757 6.976 1.00 27.26 O HETATM 2189 O HOH 7 8.406 -5.730 22.641 1.00 22.54 O HETATM 2190 O HOH 8 -8.796 -24.890 28.003 1.00 16.91 O HETATM 2191 O HOH 9 9.701 0.636 15.949 1.00 19.75 O HETATM 2192 O HOH 10 9.715 -14.730 14.732 1.00 23.78 O HETATM 2193 O HOH 11 13.040 -20.785 26.213 1.00 24.08 O HETATM 2194 O HOH 12 11.306 -19.311 22.042 1.00 33.81 O HETATM 2195 O HOH 13 -0.664 -34.397 15.495 1.00 34.89 O HETATM 2196 O HOH 14 9.484 -7.901 21.097 1.00 24.48 O HETATM 2197 O HOH 15 7.648 3.957 21.291 1.00 11.83 O HETATM 2198 O HOH 16 -7.377 14.987 -4.750 1.00 21.32 O HETATM 2199 O HOH 17 -18.572 -23.741 25.782 1.00 25.18 O HETATM 2200 O HOH 18 -3.303 6.923 17.892 1.00 9.46 O HETATM 2201 O HOH 19 4.652 -19.047 38.832 1.00 17.76 O HETATM 2202 O HOH 20 11.444 -9.883 13.635 1.00 29.21 O HETATM 2203 O HOH 21 -4.150 -13.294 41.335 1.00 31.93 O HETATM 2204 O HOH 22 -24.280 8.233 -3.612 1.00 33.20 O HETATM 2205 O HOH 23 -1.509 9.346 15.286 1.00 10.09 O HETATM 2206 O HOH 24 -18.493 -17.366 14.063 1.00 16.29 O HETATM 2207 O HOH 25 -10.055 -1.621 -7.379 1.00 27.34 O HETATM 2208 O HOH 26 -10.961 5.882 26.827 1.00 29.65 O HETATM 2209 O HOH 27 7.369 11.030 -2.647 1.00 28.86 O HETATM 2210 O HOH 28 0.505 2.954 24.192 1.00 4.10 O HETATM 2211 O HOH 29 -19.649 -8.551 19.576 1.00 19.54 O HETATM 2212 O HOH 30 11.609 -11.244 11.324 1.00 32.84 O HETATM 2213 O HOH 31 0.043 -14.813 38.230 1.00 17.49 O HETATM 2214 O HOH 32 4.417 3.511 27.875 1.00 3.69 O HETATM 2215 O HOH 33 8.488 3.724 18.501 1.00 26.13 O HETATM 2216 O HOH 34 -19.943 -19.276 23.837 1.00 29.62 O HETATM 2217 O HOH 35 4.661 -23.364 37.048 1.00 11.01 O HETATM 2218 O HOH 36 -14.848 14.666 10.062 1.00 33.23 O HETATM 2219 O HOH 37 -15.680 12.169 -14.505 1.00 21.55 O HETATM 2220 O HOH 38 -3.085 -27.668 21.506 1.00 6.48 O HETATM 2221 O HOH 39 3.971 -32.076 14.235 1.00 23.12 O HETATM 2222 O HOH 40 -9.508 16.927 11.000 1.00 34.29 O HETATM 2223 O HOH 41 11.241 -8.246 18.089 1.00 25.07 O HETATM 2224 O HOH 42 10.688 -23.415 11.400 1.00 24.95 O HETATM 2225 O HOH 43 -10.371 8.517 19.778 1.00 22.93 O HETATM 2226 O HOH 44 -5.166 -28.946 20.388 1.00 15.27 O HETATM 2227 O HOH 45 8.961 0.459 6.830 1.00 27.99 O HETATM 2228 O HOH 46 -5.429 15.763 0.346 1.00 22.83 O HETATM 2229 O HOH 47 -19.091 -14.834 12.944 1.00 26.93 O HETATM 2230 O HOH 48 -2.498 -16.063 38.372 1.00 23.65 O HETATM 2231 O HOH 49 -2.589 7.174 20.873 1.00 6.25 O HETATM 2232 O HOH 50 -19.766 -22.182 18.996 1.00 21.61 O HETATM 2233 O HOH 51 -4.277 16.932 7.395 1.00 31.73 O HETATM 2234 O HOH 52 8.353 4.323 25.117 1.00 22.22 O HETATM 2235 O HOH 53 -20.028 -26.098 20.480 1.00 26.03 O HETATM 2236 O HOH 54 -7.284 15.280 10.988 1.00 33.24 O HETATM 2237 O HOH 55 6.390 -16.657 37.704 1.00 19.53 O HETATM 2238 O HOH 56 -17.036 13.843 -11.353 1.00 33.35 O HETATM 2239 O HOH 57 -6.408 14.331 12.522 1.00 31.82 O HETATM 2240 O HOH 58 7.257 2.063 5.460 1.00 30.17 O HETATM 2241 O HOH 59 -15.583 -27.185 11.312 1.00 29.10 O HETATM 2242 O HOH 60 9.497 -16.772 36.934 1.00 29.06 O HETATM 2243 O HOH 61 3.006 -11.247 38.319 1.00 19.58 O HETATM 2244 O HOH 62 8.783 14.612 0.760 1.00 32.49 O HETATM 2245 O HOH 63 -5.076 -30.648 18.602 1.00 28.13 O HETATM 2246 O HOH 64 9.650 -25.013 17.098 1.00 23.18 O HETATM 2247 O HOH 65 -8.611 15.588 -2.736 1.00 23.74 O HETATM 2248 O HOH 66 1.151 -22.776 30.911 1.00 7.95 O HETATM 2249 O HOH 67 11.445 -0.593 -0.370 1.00 25.46 O HETATM 2250 O HOH 68 -20.416 -16.262 15.165 1.00 20.91 O HETATM 2251 O HOH 69 -5.175 16.515 -5.024 1.00 26.33 O HETATM 2252 O HOH 70 -21.229 11.844 -8.089 1.00 31.97 O HETATM 2253 O HOH 71 -19.329 12.246 -11.330 1.00 31.09 O HETATM 2254 O HOH 72 -18.372 -16.988 11.936 1.00 28.00 O HETATM 2255 O HOH 73 -21.372 -5.448 18.066 1.00 30.03 O HETATM 2256 O HOH 74 11.033 -16.572 21.262 1.00 29.25 O HETATM 2257 O HOH 75 6.796 2.193 28.403 1.00 14.06 O HETATM 2258 O HOH 76 -16.600 -18.479 9.926 1.00 37.81 O HETATM 2259 O HOH 77 -21.391 -24.531 18.800 1.00 26.95 O HETATM 2260 O HOH 78 11.325 -1.679 3.466 1.00 37.59 O HETATM 2261 O HOH 79 -5.460 18.701 10.524 1.00 33.76 O HETATM 2262 O HOH 80 -7.159 -30.171 21.599 1.00 22.98 O HETATM 2263 O HOH 81 7.027 -14.012 40.923 1.00 29.58 O HETATM 2264 O HOH 82 -11.667 3.663 28.759 1.00 26.53 O HETATM 2265 O HOH 83 10.646 -2.799 17.558 1.00 27.34 O HETATM 2266 O HOH 84 -20.603 -3.069 2.206 1.00 33.94 O HETATM 2267 O HOH 85 -0.797 -20.194 23.901 1.00 5.29 O HETATM 2268 O HOH 86 5.448 -0.527 27.510 1.00 5.43 O HETATM 2269 O HOH 87 -5.492 -3.123 6.420 1.00 6.27 O HETATM 2270 O HOH 88 -15.532 -1.804 9.516 1.00 14.24 O HETATM 2271 O HOH 89 2.043 -21.147 6.916 1.00 17.01 O HETATM 2272 O HOH 90 -17.900 -2.267 1.525 1.00 23.78 O HETATM 2273 O HOH 91 2.629 -12.159 35.765 1.00 13.73 O HETATM 2274 O HOH 92 -10.035 -2.450 30.552 1.00 10.02 O HETATM 2275 O HOH 93 -11.305 -5.194 31.783 1.00 21.70 O HETATM 2276 O HOH 94 -12.702 -10.138 13.833 1.00 9.75 O HETATM 2277 O HOH 95 2.300 -18.105 26.788 1.00 8.82 O HETATM 2278 O HOH 96 -14.470 -12.187 17.907 1.00 7.10 O HETATM 2279 O HOH 97 -2.722 3.484 15.952 1.00 5.10 O HETATM 2280 O HOH 98 1.963 -13.057 19.043 1.00 6.87 O HETATM 2281 O HOH 99 -14.600 -3.112 17.691 1.00 25.81 O HETATM 2282 O HOH 100 4.629 -2.050 21.245 1.00 11.12 O HETATM 2283 O HOH 101 -3.233 -7.934 33.571 1.00 14.68 O HETATM 2284 O HOH 102 -0.810 0.444 -2.111 1.00 10.61 O HETATM 2285 O HOH 103 3.821 3.606 11.747 1.00 20.23 O HETATM 2286 O HOH 104 10.832 -9.584 9.918 1.00 15.97 O HETATM 2287 O HOH 105 0.538 -23.316 25.028 1.00 11.33 O HETATM 2288 O HOH 106 0.266 -13.957 20.872 1.00 7.64 O HETATM 2289 O HOH 107 1.444 -21.098 28.623 1.00 12.70 O HETATM 2290 O HOH 108 -16.188 -12.133 24.705 1.00 12.03 O HETATM 2291 O HOH 109 2.679 -14.263 25.421 1.00 10.65 O HETATM 2292 O HOH 110 1.215 -6.427 3.022 1.00 15.78 O HETATM 2293 O HOH 111 -11.612 -16.000 29.704 1.00 9.39 O HETATM 2294 O HOH 112 -9.046 -19.479 7.929 1.00 8.10 O HETATM 2295 O HOH 113 3.778 5.599 0.761 1.00 15.57 O HETATM 2296 O HOH 114 1.926 7.016 10.392 1.00 16.75 O HETATM 2297 O HOH 115 5.763 1.845 10.597 1.00 10.12 O HETATM 2298 O HOH 116 0.821 -17.708 24.424 1.00 17.22 O HETATM 2299 O HOH 117 -8.610 -17.951 4.684 1.00 17.67 O HETATM 2300 O HOH 118 1.303 -15.203 23.230 1.00 12.09 O HETATM 2301 O HOH 119 6.304 -9.833 6.659 1.00 22.64 O HETATM 2302 O HOH 120 -10.493 2.329 21.838 1.00 26.08 O HETATM 2303 O HOH 121 3.917 -8.602 4.753 1.00 19.06 O HETATM 2304 O HOH 122 -15.292 -0.181 7.024 1.00 11.98 O HETATM 2305 O HOH 123 8.394 -1.818 15.711 1.00 11.10 O HETATM 2306 O HOH 124 4.513 -16.391 25.660 1.00 20.08 O HETATM 2307 O HOH 125 -15.601 -3.555 15.013 1.00 28.57 O HETATM 2308 O HOH 126 -11.071 -28.031 10.153 1.00 20.60 O HETATM 2309 O HOH 127 -3.070 -10.791 34.249 1.00 12.98 O HETATM 2310 O HOH 128 4.888 15.384 3.583 1.00 27.33 O HETATM 2311 O HOH 129 7.295 13.303 9.091 1.00 27.63 O HETATM 2312 O HOH 130 4.515 -2.156 31.924 1.00 22.69 O HETATM 2313 O HOH 131 -11.841 -13.568 31.457 1.00 15.43 O HETATM 2314 O HOH 132 -12.753 1.603 20.167 1.00 20.55 O HETATM 2315 O HOH 133 -15.279 -8.597 14.153 1.00 20.14 O HETATM 2316 O HOH 134 -13.398 -14.899 11.617 1.00 16.60 O HETATM 2317 O HOH 135 0.045 -22.980 7.186 1.00 12.52 O HETATM 2318 O HOH 136 -6.808 -22.737 5.614 1.00 21.31 O HETATM 2319 O HOH 137 -8.304 -16.175 36.581 1.00 26.42 O HETATM 2320 O HOH 138 -5.972 -30.326 13.931 1.00 17.40 O HETATM 2321 O HOH 139 -12.233 -10.115 10.297 1.00 23.80 O HETATM 2322 O HOH 140 -8.930 -22.535 29.700 1.00 18.52 O HETATM 2323 O HOH 141 4.207 7.112 7.964 1.00 26.19 O HETATM 2324 O HOH 142 6.277 5.752 8.539 1.00 21.58 O HETATM 2325 O HOH 143 -13.529 -11.784 12.016 1.00 12.32 O HETATM 2326 O HOH 144 7.822 -1.634 23.934 1.00 22.64 O HETATM 2327 O HOH 145 -12.011 -7.436 0.794 1.00 30.94 O HETATM 2328 O HOH 146 6.995 -15.270 16.088 1.00 17.23 O HETATM 2329 O HOH 147 7.642 -8.965 28.145 1.00 13.79 O HETATM 2330 O HOH 148 5.067 3.414 3.727 1.00 17.35 O HETATM 2331 O HOH 149 -14.110 -4.967 30.954 1.00 29.06 O HETATM 2332 O HOH 150 4.865 -18.564 23.943 1.00 19.13 O HETATM 2333 O HOH 151 -7.554 1.843 22.252 1.00 16.06 O HETATM 2334 O HOH 152 1.678 -8.884 3.104 1.00 19.36 O HETATM 2335 O HOH 153 3.108 -5.290 1.737 1.00 19.91 O HETATM 2336 O HOH 154 0.308 -21.276 26.532 1.00 17.27 O HETATM 2337 O HOH 155 -4.473 12.712 5.992 1.00 16.89 O HETATM 2338 O HOH 156 8.646 0.882 24.190 1.00 18.67 O HETATM 2339 O HOH 157 7.721 -3.087 21.935 1.00 19.94 O HETATM 2340 O HOH 158 -11.469 -28.460 21.484 1.00 20.41 O HETATM 2341 O HOH 159 -10.407 -30.665 9.960 1.00 23.58 O HETATM 2342 O HOH 160 9.177 -14.766 20.279 1.00 28.01 O HETATM 2343 O HOH 161 -11.173 -30.039 19.303 1.00 21.92 O HETATM 2344 O HOH 162 -5.332 -31.926 15.699 1.00 24.24 O HETATM 2345 O HOH 163 -10.604 4.218 20.307 1.00 19.42 O HETATM 2346 O HOH 164 -13.413 -25.533 23.362 1.00 22.86 O HETATM 2347 O HOH 165 -12.253 -18.546 30.649 1.00 27.85 O HETATM 2348 O HOH 166 -5.793 -11.365 3.429 1.00 27.16 O HETATM 2349 O HOH 167 8.744 -12.806 39.657 1.00 28.99 O HETATM 2350 O HOH 168 4.512 -24.746 6.712 1.00 24.47 O HETATM 2351 O HOH 169 -11.998 12.431 0.741 1.00 23.19 O HETATM 2352 O HOH 170 8.858 -2.023 13.000 1.00 20.40 O HETATM 2353 O HOH 171 1.250 6.012 -7.769 1.00 34.35 O HETATM 2354 O HOH 172 -14.037 5.806 14.660 1.00 26.10 O HETATM 2355 O HOH 173 9.248 -12.331 8.006 1.00 25.82 O HETATM 2356 O HOH 174 -0.250 -19.892 4.027 1.00 26.68 O HETATM 2357 O HOH 175 -11.570 -19.736 7.232 1.00 23.28 O HETATM 2358 O HOH 176 -16.933 2.161 6.719 1.00 29.94 O HETATM 2359 O HOH 177 -12.111 -9.023 5.909 1.00 33.43 O HETATM 2360 O HOH 178 9.050 -14.128 6.167 1.00 27.14 O HETATM 2361 O HOH 179 9.320 -2.360 0.007 1.00 31.53 O HETATM 2362 O HOH 180 -15.854 4.791 5.861 1.00 31.69 O HETATM 2363 O HOH 181 -13.715 7.751 12.746 1.00 20.32 O HETATM 2364 O HOH 182 -14.270 -3.339 1.561 1.00 29.17 O HETATM 2365 O HOH 183 6.313 -15.648 5.119 1.00 25.84 O HETATM 2366 O HOH 184 -8.470 -25.065 5.102 1.00 41.51 O HETATM 2367 O HOH 185 -12.844 -6.049 3.510 1.00 30.29 O HETATM 2368 O HOH 186 -17.452 -18.470 28.098 1.00 23.21 O HETATM 2369 O HOH 187 -9.473 -11.959 5.948 1.00 25.63 O HETATM 2370 O HOH 188 -15.791 -15.799 10.874 1.00 23.05 O HETATM 2371 O HOH 189 -2.095 0.697 -4.788 1.00 28.90 O HETATM 2372 O HOH 190 -6.377 -34.221 16.156 1.00 33.12 O HETATM 2373 O HOH 191 0.373 3.693 -7.940 1.00 35.42 O HETATM 2374 O HOH 192 -11.310 -21.186 29.656 1.00 23.71 O HETATM 2375 O HOH 193 -8.871 1.665 32.757 1.00 27.25 O HETATM 2376 O HOH 194 -17.204 -15.725 26.661 1.00 25.43 O HETATM 2377 O HOH 195 -16.402 -28.076 21.826 1.00 35.67 O HETATM 2378 O HOH 196 5.985 7.647 14.891 1.00 22.43 O HETATM 2379 O HOH 197 -12.704 1.916 26.602 1.00 29.04 O HETATM 2380 O HOH 198 -10.067 -19.647 36.871 1.00 33.03 O HETATM 2381 O HOH 199 -18.199 -8.874 27.712 1.00 20.53 O HETATM 2382 O HOH 200 -9.777 0.169 31.365 1.00 27.64 O HETATM 2383 O HOH 201 -2.936 -21.874 24.300 1.00 1.49 O HETATM 2384 O HOH 202 -1.035 -5.708 0.664 1.00 16.67 O HETATM 2385 O HOH 203 7.461 -10.284 8.475 1.00 17.77 O HETATM 2386 O HOH 204 -1.979 -4.338 3.255 1.00 20.84 O HETATM 2387 O HOH 205 -3.517 -4.313 4.541 1.00 22.41 O HETATM 2388 O HOH 206 -5.141 -30.986 11.359 1.00 26.80 O HETATM 2389 O HOH 207 9.898 -3.664 11.234 1.00 21.53 O HETATM 2390 O HOH 208 -9.494 -31.517 11.883 1.00 29.42 O HETATM 2391 O HOH 209 -6.339 -1.121 -1.549 1.00 25.83 O HETATM 2392 O HOH 210 -10.581 -23.938 5.762 1.00 33.01 O HETATM 2393 O HOH 211 -16.445 -4.895 1.567 1.00 32.40 O HETATM 2394 O HOH 212 -20.002 3.131 5.613 1.00 38.55 O HETATM 2395 O HOH 213 -4.542 -3.548 1.950 1.00 33.22 O HETATM 2396 O HOH 214 -3.990 -0.171 -5.495 1.00 32.15 O HETATM 2397 O HOH 215 -3.760 -26.168 7.157 1.00 34.96 O HETATM 2398 O HOH 216 -10.153 -4.094 33.448 1.00 38.03 O HETATM 2399 O HOH 217 -15.005 1.022 21.211 1.00 38.98 O HETATM 2400 O HOH 218 1.985 -4.135 32.746 1.00 22.88 O HETATM 2401 O HOH 219 9.137 0.126 11.306 1.00 27.79 O HETATM 2402 O HOH 220 7.156 -13.548 26.304 1.00 30.87 O HETATM 2403 O HOH 221 -9.844 -14.073 38.273 1.00 38.12 O HETATM 2404 O HOH 222 3.705 5.730 12.461 1.00 29.33 O HETATM 2405 O HOH 223 -9.705 -26.404 7.279 1.00 32.58 O HETATM 2406 O HOH 224 -7.050 -27.118 6.133 1.00 31.73 O HETATM 2407 O HOH 225 10.987 1.292 22.913 1.00 36.10 O HETATM 2408 O HOH 226 -15.685 -11.371 3.274 1.00 33.24 O HETATM 2409 O HOH 227 -3.717 -16.852 -0.285 1.00 33.89 O HETATM 2410 O HOH 228 -3.772 12.423 -10.574 1.00 30.81 O HETATM 2411 O HOH 229 -15.145 -13.018 5.280 1.00 35.15 O HETATM 2412 O HOH 230 10.776 -19.024 30.529 1.00 34.14 O HETATM 2413 O HOH 231 -12.700 -1.781 3.466 1.00 29.42 O HETATM 2414 O HOH 232 -2.591 2.555 13.316 1.00 4.21 O HETATM 2415 O HOH 233 -1.848 -22.940 28.028 1.00 3.10 O HETATM 2416 O HOH 234 -2.590 -4.984 -3.375 1.00 33.38 O HETATM 2417 O HOH 235 -19.351 -4.652 0.418 1.00 32.26 O HETATM 2418 O HOH 236 -0.389 1.420 -6.941 1.00 35.70 O HETATM 2419 O HOH 237 -1.813 -2.127 -0.987 1.00 28.85 O HETATM 2420 O HOH 238 -12.618 2.925 23.814 1.00 35.72 O HETATM 2421 O HOH 239 -15.527 -4.068 3.477 1.00 37.85 O HETATM 2422 O HOH 240 -5.605 -4.393 -3.832 1.00 32.25 O HETATM 2423 O HOH 241 -17.374 -0.268 24.549 1.00 34.03 O HETATM 2424 O HOH 242 -9.698 -30.339 20.682 1.00 30.49 O HETATM 2425 O HOH 243 -17.034 -0.749 26.946 1.00 29.88 O HETATM 2426 O HOH 244 -1.666 -2.850 -5.344 1.00 38.58 O HETATM 2427 O HOH 245 -15.983 -4.386 8.910 1.00 35.55 O HETATM 2428 O HOH 246 7.854 -21.072 25.129 1.00 28.19 O HETATM 2429 CMB MD A 9 1.204 -21.505 16.466 1.00 -0.03 C HETATM 2430 C2B MD A 9 1.958 -22.570 17.205 1.00 -0.01 C HETATM 2431 C1B MD A 9 3.216 -22.475 17.788 1.00 0.10 C HETATM 2432 CHB MD A 9 3.902 -21.186 17.660 1.00 0.10 C HETATM 2433 C4A MD A 9 5.139 -21.245 18.481 1.00 0.27 C HETATM 2434 C3A MD A 9 5.700 -19.999 18.726 1.00 0.19 C HETATM 2435 CMA MD A 9 5.213 -18.654 18.275 1.00 0.07 C HETATM 2436 H MD A 9 5.895 -17.874 18.645 1.00 0.09 H HETATM 2437 H MD A 9 4.203 -18.477 18.674 1.00 0.09 H HETATM 2438 H MD A 9 5.184 -18.624 17.176 1.00 0.09 H HETATM 2439 C2A MD A 9 6.808 -20.267 19.481 1.00 0.18 C HETATM 2440 CAA MD A 9 7.787 -19.239 20.027 1.00 0.06 C HETATM 2441 CBA MD A 9 7.486 -18.651 21.394 1.00 0.03 C HETATM 2442 CGA MD A 9 7.804 -19.480 22.576 1.00 0.04 C HETATM 2443 O1A MD A 9 8.929 -20.043 22.665 1.00 -0.57 O HETATM 2444 O2A MD A 9 6.955 -19.624 23.487 1.00 -0.57 O HETATM 2445 H MD A 9 6.409 -18.428 21.427 1.00 0.05 H HETATM 2446 H MD A 9 8.057 -17.715 21.484 1.00 0.05 H HETATM 2447 H MD A 9 8.774 -19.720 20.084 1.00 0.07 H HETATM 2448 H MD A 9 7.826 -18.406 19.310 1.00 0.07 H HETATM 2449 C1A MD A 9 6.839 -21.646 19.637 1.00 0.25 C HETATM 2450 NA MD A 9 5.792 -22.331 19.020 1.00 -0.10 N HETATM 2451 MG MD A 9 5.525 -24.012 19.033 1.00 2.00 MG HETATM 2452 NB MD A 9 3.642 -23.600 18.402 1.00 -0.27 N HETATM 2453 C4B MD A 9 2.603 -24.441 18.172 1.00 0.08 C HETATM 2454 C3B MD A 9 1.565 -23.856 17.461 1.00 -0.03 C HETATM 2455 H MD A 9 0.627 -24.325 17.166 1.00 0.04 H HETATM 2456 CHC MD A 9 2.409 -25.829 18.562 1.00 0.06 C HETATM 2457 C1C MD A 9 3.616 -26.316 19.185 1.00 0.11 C HETATM 2458 C2C MD A 9 3.480 -27.605 19.668 1.00 -0.00 C HETATM 2459 CMC MD A 9 2.272 -28.495 19.606 1.00 -0.02 C HETATM 2460 H MD A 9 2.502 -29.459 20.085 1.00 0.04 H HETATM 2461 H MD A 9 1.995 -28.665 18.555 1.00 0.04 H HETATM 2462 H MD A 9 1.435 -28.014 20.133 1.00 0.04 H HETATM 2463 C3C MD A 9 4.690 -27.891 20.211 1.00 -0.02 C HETATM 2464 C4C MD A 9 5.453 -26.761 20.013 1.00 0.10 C HETATM 2465 NC MD A 9 4.828 -25.717 19.368 1.00 -0.25 N HETATM 2466 CHD MD A 9 6.814 -26.910 20.560 1.00 0.11 C HETATM 2467 C1D MD A 9 7.457 -25.585 20.677 1.00 0.27 C HETATM 2468 C2D MD A 9 8.723 -25.519 21.263 1.00 0.20 C HETATM 2469 CMD MD A 9 9.540 -26.656 21.802 1.00 0.04 C HETATM 2470 H MD A 9 8.987 -27.598 21.674 1.00 0.07 H HETATM 2471 H MD A 9 9.739 -26.490 22.871 1.00 0.07 H HETATM 2472 H MD A 9 10.493 -26.714 21.256 1.00 0.07 H HETATM 2473 C3D MD A 9 9.061 -24.198 21.238 1.00 0.21 C HETATM 2474 CAD MD A 9 10.346 -23.565 21.754 1.00 0.09 C HETATM 2475 CBD MD A 9 10.236 -22.730 22.991 1.00 0.04 C HETATM 2476 CGD MD A 9 11.365 -22.729 23.969 1.00 0.04 C HETATM 2477 O1D MD A 9 11.248 -22.099 25.047 1.00 -0.57 O HETATM 2478 O2D MD A 9 12.421 -23.353 23.711 1.00 -0.57 O HETATM 2479 H MD A 9 9.342 -23.073 23.532 1.00 0.05 H HETATM 2480 H MD A 9 10.091 -21.689 22.665 1.00 0.05 H HETATM 2481 H MD A 9 11.057 -24.378 21.963 1.00 0.10 H HETATM 2482 H MD A 9 10.746 -22.924 20.954 1.00 0.10 H HETATM 2483 C4D MD A 9 7.972 -23.552 20.642 1.00 0.29 C HETATM 2484 ND MD A 9 6.967 -24.378 20.300 1.00 -0.08 N HETATM 2485 CHA MD A 9 8.015 -22.087 20.462 1.00 0.14 C HETATM 2486 H MD A 9 8.778 -21.430 20.864 1.00 0.16 H HETATM 2487 H MD A 9 7.274 -27.852 20.835 1.00 0.16 H HETATM 2488 H MD A 9 4.993 -28.816 20.699 1.00 0.04 H HETATM 2489 H MD A 9 1.503 -26.405 18.409 1.00 0.15 H HETATM 2490 H MD A 9 3.567 -20.340 17.071 1.00 0.15 H HETATM 2491 H MD A 9 0.236 -21.906 16.131 1.00 0.04 H HETATM 2492 H MD A 9 1.788 -21.181 15.592 1.00 0.04 H HETATM 2493 H MD A 9 1.034 -20.646 17.132 1.00 0.04 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 95 96 100 101 102 CONECT 100 95 CONECT 101 95 CONECT 102 95 CONECT 2429 2430 2491 2492 2493 CONECT 2430 2429 2431 2454 CONECT 2431 2430 2432 2452 CONECT 2432 2431 2433 2490 CONECT 2433 2432 2434 2450 CONECT 2434 2433 2435 2439 CONECT 2435 2434 2436 2437 2438 CONECT 2436 2435 CONECT 2437 2435 CONECT 2438 2435 CONECT 2439 2434 2440 2449 CONECT 2440 2439 2441 2447 2448 CONECT 2441 2440 2442 2445 2446 CONECT 2442 2441 2443 2444 CONECT 2443 2442 CONECT 2444 2442 CONECT 2445 2441 CONECT 2446 2441 CONECT 2447 2440 CONECT 2448 2440 CONECT 2449 2439 2450 2485 CONECT 2450 2433 2449 2451 CONECT 2451 2450 2452 2465 2484 CONECT 2452 2431 2451 2453 CONECT 2453 2452 2454 2456 CONECT 2454 2430 2453 2455 CONECT 2455 2454 CONECT 2456 2453 2457 2489 CONECT 2457 2456 2458 2465 CONECT 2458 2457 2459 2463 CONECT 2459 2458 2460 2461 2462 CONECT 2460 2459 CONECT 2461 2459 CONECT 2462 2459 CONECT 2463 2458 2464 2488 CONECT 2464 2463 2465 2466 CONECT 2465 2451 2457 2464 CONECT 2466 2464 2467 2487 CONECT 2467 2466 2468 2484 CONECT 2468 2467 2469 2473 CONECT 2469 2468 2470 2471 2472 CONECT 2470 2469 CONECT 2471 2469 CONECT 2472 2469 CONECT 2473 2468 2474 2483 CONECT 2474 2473 2475 2481 2482 CONECT 2475 2474 2476 2479 2480 CONECT 2476 2475 2477 2478 CONECT 2477 2476 CONECT 2478 2476 CONECT 2479 2475 CONECT 2480 2475 CONECT 2481 2474 CONECT 2482 2474 CONECT 2483 2473 2484 2485 CONECT 2484 2451 2467 2483 CONECT 2485 2449 2483 2486 CONECT 2486 2485 CONECT 2487 2466 CONECT 2488 2463 CONECT 2489 2456 CONECT 2490 2432 CONECT 2491 2429 CONECT 2492 2429 CONECT 2493 2429 MASTER 0 0 0 0 0 0 0 0 2491 2 73 18 END
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Structure:
Ligand 2D
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Protein
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Related entries of code: 4xkc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4xkb
RCSB PDB
PDBbind
233aa, >4XKB_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4xkc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Ycf53-like protein
Ligand Name
MD9
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=1.36uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Mol Plant Vol. 8: pp. 1125-1127
Ligand Properties
Formula
C
3
0
H
2
8
MgN
4
O
4
Molecular Weight
532.873
Exact Mass
532.196
No. of atoms
67
No. of bonds
74
Polar Surface Area
94.32
LOGP Value
5.13 (
Computed with XLOGP3
)
1.04 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 8
Canonical SMILES
OC(=O)CCc1c(C)c2=Cc3n4[Mg]56n2c1C=c1c(CCC(=O)O)c(c(n51)C=c1n6c(C=c4c(c3)C)cc1C)C
InChI String
InChI=1S/C30H28N4O4.Mg/c1-15-9-20-12-25-17(3)21(5-7-29(35)36)27(33-25)14-28-22(6-8-30(37)38)18(4)26(34-28)13-24-16(2)10-19(32-24)11-23(15)31-20;/h9-14H,5-8H2,1-4H3,(H,35,36)(H,37,38);/b19-11-,20-12-,23-11-,24-13-,25-12-,26-13-,27-14-,28-14-;
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P72583
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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