Browse entries in the PDBbind-CN Database
HEADER 4MNY_COMPLEX COMPND 4MNY_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 245 ILE ILE GLY GLY GLU PHE THR THR ILE GLU ASN GLN PRO SEQRES 2 A 245 TRP PHE ALA ALA ILE TYR ARG ARG HIS ARG GLY GLY SER SEQRES 3 A 245 VAL THR TYR VAL CYS GLY GLY SER LEU ILE SER PRO CYS SEQRES 4 A 245 TRP VAL ILE SER ALA THR HIS CYS PHE ILE ASP TYR PRO SEQRES 5 A 245 LYS LYS GLU ASP TYR ILE VAL TYR LEU GLY ARG SER ARG SEQRES 6 A 245 LEU ASN SER ASN THR GLN GLY GLU MET LYS PHE GLU VAL SEQRES 7 A 245 GLU ASN LEU ILE LEU HIS LYS ASP TYR SER ALA ASP THR SEQRES 8 A 245 LEU ALA HIS HIS ASN ASP ILE ALA LEU LEU LYS ILE ARG SEQRES 9 A 245 SER LYS GLU GLY ARG CYS ALA GLN PRO SER ARG THR ILE SEQRES 10 A 245 GLN THR ILE ALA LEU PRO SER MET TYR ASN ASP PRO GLN SEQRES 11 A 245 PHE GLY THR SER CYS GLU ILE THR GLY PHE GLY LYS GLU SEQRES 12 A 245 GLN SER THR ASP TYR LEU TYR PRO GLU GLN LEU LYS MET SEQRES 13 A 245 THR VAL VAL LYS LEU ILE SER HIS ARG GLU CYS GLN GLN SEQRES 14 A 245 PRO HIS TYR TYR GLY SER GLU VAL THR THR LYS MET LEU SEQRES 15 A 245 CYS ALA ALA ASP PRO GLN TRP LYS THR ASP SER CYS GLN SEQRES 16 A 245 GLY ASP SER GLY GLY PRO LEU VAL CYS SER LEU GLN GLY SEQRES 17 A 245 ARG MET THR LEU THR GLY ILE VAL SER TRP GLY ARG GLY SEQRES 18 A 245 CYS ALA LEU LYS ASP LYS PRO GLY VAL TYR THR ARG VAL SEQRES 19 A 245 SER HIS PHE LEU PRO TRP ILE ARG SER HIS THR HET GLY A 482 190 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 50 CYS A 111 SSBOND 3 CYS A 168 CYS A 182 SSBOND 4 CYS A 136 CYS A 201 SSBOND 5 CYS A 191 CYS A 220 ATOM 1 N ILE A 16 -19.853 -1.649 -43.111 1.00 12.55 N ATOM 2 CA ILE A 16 -19.222 -0.639 -44.010 1.00 12.43 C ATOM 3 C ILE A 16 -20.171 -0.340 -45.165 1.00 10.60 C ATOM 4 O ILE A 16 -20.579 -1.241 -45.884 1.00 9.93 O ATOM 5 CB ILE A 16 -17.876 -1.151 -44.595 1.00 13.72 C ATOM 6 CG1 ILE A 16 -16.851 -1.463 -43.483 1.00 14.82 C ATOM 7 CG2 ILE A 16 -17.307 -0.171 -45.617 1.00 15.17 C ATOM 8 CD1 ILE A 16 -16.245 -0.258 -42.791 1.00 15.13 C ATOM 9 HN3 ILE A 16 -20.039 -2.520 -43.647 1.00 0.00 H ATOM 10 HN2 ILE A 16 -20.748 -1.271 -42.741 1.00 0.00 H ATOM 11 HN1 ILE A 16 -19.210 -1.857 -42.321 1.00 0.00 H ATOM 12 N ILE A 17 -20.509 0.932 -45.341 1.00 12.20 N ATOM 13 CA ILE A 17 -21.284 1.373 -46.492 1.00 12.78 C ATOM 14 C ILE A 17 -20.311 1.627 -47.630 1.00 13.05 C ATOM 15 O ILE A 17 -19.324 2.336 -47.455 1.00 15.01 O ATOM 16 CB ILE A 17 -22.033 2.704 -46.229 1.00 13.08 C ATOM 17 CG1 ILE A 17 -22.782 2.691 -44.883 1.00 12.24 C ATOM 18 CG2 ILE A 17 -22.985 3.024 -47.373 1.00 14.05 C ATOM 19 CD1 ILE A 17 -23.870 1.652 -44.767 1.00 12.18 C ATOM 20 H ILE A 17 -20.211 1.635 -44.635 1.00 0.00 H ATOM 21 N GLY A 18 -20.609 1.071 -48.796 1.00 14.17 N ATOM 22 CA GLY A 18 -19.759 1.230 -49.957 1.00 12.16 C ATOM 23 C GLY A 18 -18.470 0.451 -49.777 1.00 12.84 C ATOM 24 O GLY A 18 -18.441 -0.570 -49.093 1.00 14.50 O ATOM 25 H GLY A 18 -21.477 0.505 -48.879 1.00 0.00 H ATOM 26 N GLY A 19 -17.396 0.941 -50.377 1.00 14.17 N ATOM 27 CA GLY A 19 -16.127 0.222 -50.356 1.00 14.00 C ATOM 28 C GLY A 19 -16.189 -1.113 -51.083 1.00 15.41 C ATOM 29 O GLY A 19 -16.968 -1.280 -52.033 1.00 15.80 O ATOM 30 H GLY A 19 -17.458 1.854 -50.871 1.00 0.00 H ATOM 31 N GLU A 20 -15.381 -2.062 -50.609 1.00 15.41 N ATOM 32 CA GLU A 20 -15.194 -3.362 -51.256 1.00 16.80 C ATOM 33 C GLU A 20 -15.194 -4.449 -50.215 1.00 13.18 C ATOM 34 O GLU A 20 -14.970 -4.187 -49.043 1.00 12.40 O ATOM 35 CB GLU A 20 -13.798 -3.475 -51.874 1.00 21.42 C ATOM 36 CG GLU A 20 -13.483 -2.695 -53.116 1.00 27.17 C ATOM 37 CD GLU A 20 -12.163 -3.168 -53.718 1.00 30.82 C ATOM 38 OE1 GLU A 20 -11.146 -2.492 -53.493 1.00 44.19 O ATOM 39 OE2 GLU A 20 -12.135 -4.232 -54.389 1.00 32.14 O ATOM 40 H GLU A 20 -14.855 -1.868 -49.733 1.00 0.00 H ATOM 41 N PHE A 21 -15.364 -5.683 -50.660 1.00 11.47 N ATOM 42 CA PHE A 21 -15.015 -6.812 -49.826 1.00 10.00 C ATOM 43 C PHE A 21 -13.505 -6.937 -49.768 1.00 11.18 C ATOM 44 O PHE A 21 -12.794 -6.531 -50.698 1.00 13.66 O ATOM 45 CB PHE A 21 -15.677 -8.085 -50.326 1.00 8.68 C ATOM 46 CG PHE A 21 -17.168 -8.051 -50.164 1.00 10.80 C ATOM 47 CD1 PHE A 21 -17.718 -8.172 -48.905 1.00 11.37 C ATOM 48 CD2 PHE A 21 -18.008 -7.836 -51.247 1.00 11.80 C ATOM 49 CE1 PHE A 21 -19.085 -8.110 -48.722 1.00 12.58 C ATOM 50 CE2 PHE A 21 -19.383 -7.781 -51.076 1.00 13.98 C ATOM 51 CZ PHE A 21 -19.920 -7.912 -49.811 1.00 15.98 C ATOM 52 H PHE A 21 -15.750 -5.842 -51.613 1.00 0.00 H ATOM 53 N THR A 22 -13.023 -7.432 -48.635 1.00 12.22 N ATOM 54 CA THR A 22 -11.606 -7.588 -48.434 1.00 12.02 C ATOM 55 C THR A 22 -11.342 -8.954 -47.835 1.00 12.41 C ATOM 56 O THR A 22 -12.259 -9.720 -47.550 1.00 13.30 O ATOM 57 CB THR A 22 -11.012 -6.443 -47.564 1.00 12.16 C ATOM 58 OG1 THR A 22 -9.580 -6.422 -47.695 1.00 15.40 O ATOM 59 CG2 THR A 22 -11.374 -6.595 -46.102 1.00 14.26 C ATOM 60 HG1 THR A 22 -9.339 -6.271 -48.643 1.00 0.00 H ATOM 61 H THR A 22 -13.680 -7.712 -47.879 1.00 0.00 H ATOM 62 N THR A 23 -10.065 -9.263 -47.682 1.00 13.51 N ATOM 63 CA THR A 23 -9.642 -10.495 -47.049 1.00 16.33 C ATOM 64 C THR A 23 -8.657 -10.122 -45.949 1.00 14.88 C ATOM 65 O THR A 23 -8.097 -9.026 -45.944 1.00 12.71 O ATOM 66 CB THR A 23 -8.960 -11.437 -48.048 1.00 18.01 C ATOM 67 OG1 THR A 23 -7.794 -10.800 -48.566 1.00 19.02 O ATOM 68 CG2 THR A 23 -9.881 -11.774 -49.206 1.00 19.03 C ATOM 69 HG1 THR A 23 -7.349 -11.404 -49.212 1.00 0.00 H ATOM 70 H THR A 23 -9.342 -8.600 -48.027 1.00 0.00 H ATOM 71 N ILE A 24 -8.448 -11.043 -45.022 1.00 14.29 N ATOM 72 CA ILE A 24 -7.729 -10.733 -43.793 1.00 13.71 C ATOM 73 C ILE A 24 -6.246 -10.441 -44.073 1.00 14.60 C ATOM 74 O ILE A 24 -5.609 -9.724 -43.305 1.00 14.78 O ATOM 75 CB ILE A 24 -7.967 -11.822 -42.709 1.00 16.14 C ATOM 76 CG1 ILE A 24 -7.521 -11.341 -41.319 1.00 16.07 C ATOM 77 CG2 ILE A 24 -7.292 -13.135 -43.082 1.00 16.42 C ATOM 78 CD1 ILE A 24 -8.350 -10.212 -40.740 1.00 16.17 C ATOM 79 H ILE A 24 -8.804 -12.008 -45.174 1.00 0.00 H ATOM 80 N GLU A 25 -5.729 -10.934 -45.204 1.00 16.47 N ATOM 81 CA GLU A 25 -4.375 -10.577 -45.677 1.00 17.18 C ATOM 82 C GLU A 25 -4.160 -9.068 -45.798 1.00 15.69 C ATOM 83 O GLU A 25 -3.040 -8.576 -45.586 1.00 16.76 O ATOM 84 CB GLU A 25 -4.076 -11.223 -47.040 1.00 19.15 C ATOM 85 CG GLU A 25 -3.818 -12.728 -47.001 1.00 20.47 C ATOM 86 CD GLU A 25 -5.079 -13.576 -46.917 1.00 18.28 C ATOM 87 OE1 GLU A 25 -6.210 -13.030 -46.953 1.00 20.22 O ATOM 88 OE2 GLU A 25 -4.946 -14.811 -46.809 1.00 25.07 O ATOM 89 H GLU A 25 -6.301 -11.592 -45.771 1.00 0.00 H ATOM 90 N ASN A 26 -5.223 -8.346 -46.157 1.00 16.34 N ATOM 91 CA ASN A 26 -5.180 -6.889 -46.312 1.00 17.94 C ATOM 92 C ASN A 26 -5.385 -6.118 -45.004 1.00 14.46 C ATOM 93 O ASN A 26 -5.236 -4.895 -44.977 1.00 16.72 O ATOM 94 CB ASN A 26 -6.215 -6.434 -47.341 1.00 17.99 C ATOM 95 CG ASN A 26 -5.896 -6.928 -48.740 1.00 21.67 C ATOM 96 OD1 ASN A 26 -4.838 -6.625 -49.286 1.00 30.64 O ATOM 97 ND2 ASN A 26 -6.794 -7.712 -49.318 1.00 22.65 N ATOM 98 HD22 ASN A 26 -7.678 -7.945 -48.821 1.00 0.00 H ATOM 99 HD21 ASN A 26 -6.615 -8.095 -50.268 1.00 0.00 H ATOM 100 H ASN A 26 -6.122 -8.839 -46.335 1.00 0.00 H ATOM 101 N GLN A 27 -5.725 -6.827 -43.931 1.00 12.03 N ATOM 102 CA GLN A 27 -5.940 -6.203 -42.627 1.00 11.94 C ATOM 103 C GLN A 27 -5.667 -7.211 -41.491 1.00 12.45 C ATOM 104 O GLN A 27 -6.552 -7.521 -40.697 1.00 12.95 O ATOM 105 CB GLN A 27 -7.375 -5.660 -42.561 1.00 12.72 C ATOM 106 CG GLN A 27 -7.576 -4.555 -41.534 1.00 17.01 C ATOM 107 CD GLN A 27 -7.172 -3.158 -41.999 1.00 20.08 C ATOM 108 OE1 GLN A 27 -7.200 -2.220 -41.198 1.00 23.56 O ATOM 109 NE2 GLN A 27 -6.798 -3.002 -43.272 1.00 21.10 N ATOM 110 HE22 GLN A 27 -6.788 -3.819 -43.915 1.00 0.00 H ATOM 111 HE21 GLN A 27 -6.516 -2.063 -43.620 1.00 0.00 H ATOM 112 H GLN A 27 -5.841 -7.856 -44.023 1.00 0.00 H ATOM 113 N PRO A 28 -4.414 -7.706 -41.391 1.00 12.30 N ATOM 114 CA PRO A 28 -4.106 -8.873 -40.557 1.00 12.62 C ATOM 115 C PRO A 28 -4.172 -8.639 -39.037 1.00 11.88 C ATOM 116 O PRO A 28 -4.073 -9.588 -38.266 1.00 11.78 O ATOM 117 CB PRO A 28 -2.682 -9.238 -41.001 1.00 12.35 C ATOM 118 CG PRO A 28 -2.100 -7.937 -41.438 1.00 13.68 C ATOM 119 CD PRO A 28 -3.226 -7.225 -42.119 1.00 11.73 C ATOM 120 N TRP A 29 -4.341 -7.384 -38.626 1.00 11.19 N ATOM 121 CA TRP A 29 -4.574 -7.016 -37.215 1.00 11.55 C ATOM 122 C TRP A 29 -6.061 -7.046 -36.829 1.00 10.91 C ATOM 123 O TRP A 29 -6.397 -6.858 -35.662 1.00 10.39 O ATOM 124 CB TRP A 29 -4.043 -5.604 -36.942 1.00 15.47 C ATOM 125 CG TRP A 29 -4.435 -4.643 -37.984 1.00 13.78 C ATOM 126 CD1 TRP A 29 -5.610 -3.953 -38.065 1.00 16.83 C ATOM 127 CD2 TRP A 29 -3.678 -4.290 -39.137 1.00 14.52 C ATOM 128 NE1 TRP A 29 -5.618 -3.174 -39.193 1.00 19.62 N ATOM 129 CE2 TRP A 29 -4.439 -3.366 -39.870 1.00 17.11 C ATOM 130 CE3 TRP A 29 -2.413 -4.663 -39.618 1.00 13.13 C ATOM 131 CZ2 TRP A 29 -3.985 -2.809 -41.064 1.00 17.37 C ATOM 132 CZ3 TRP A 29 -1.963 -4.102 -40.801 1.00 15.84 C ATOM 133 CH2 TRP A 29 -2.747 -3.188 -41.510 1.00 16.92 C ATOM 134 HE1 TRP A 29 -6.390 -2.542 -39.487 1.00 0.00 H ATOM 135 H TRP A 29 -4.307 -6.624 -39.335 1.00 0.00 H ATOM 136 N PHE A 30 -6.933 -7.261 -37.801 1.00 10.83 N ATOM 137 CA PHE A 30 -8.374 -7.174 -37.525 1.00 10.10 C ATOM 138 C PHE A 30 -8.835 -8.369 -36.702 1.00 11.41 C ATOM 139 O PHE A 30 -8.589 -9.520 -37.070 1.00 12.06 O ATOM 140 CB PHE A 30 -9.227 -7.073 -38.786 1.00 10.87 C ATOM 141 CG PHE A 30 -10.696 -6.911 -38.488 1.00 11.95 C ATOM 142 CD1 PHE A 30 -11.221 -5.658 -38.164 1.00 12.08 C ATOM 143 CD2 PHE A 30 -11.543 -8.007 -38.481 1.00 13.36 C ATOM 144 CE1 PHE A 30 -12.569 -5.510 -37.872 1.00 11.72 C ATOM 145 CE2 PHE A 30 -12.890 -7.861 -38.190 1.00 14.53 C ATOM 146 CZ PHE A 30 -13.402 -6.614 -37.883 1.00 13.93 C ATOM 147 H PHE A 30 -6.599 -7.491 -38.759 1.00 0.00 H ATOM 148 N ALA A 31 -9.502 -8.067 -35.593 1.00 10.14 N ATOM 149 CA ALA A 31 -10.000 -9.063 -34.668 1.00 9.64 C ATOM 150 C ALA A 31 -11.536 -9.044 -34.746 1.00 10.56 C ATOM 151 O ALA A 31 -12.150 -7.985 -34.662 1.00 12.52 O ATOM 152 CB ALA A 31 -9.551 -8.746 -33.254 1.00 12.04 C ATOM 153 H ALA A 31 -9.675 -7.064 -35.379 1.00 0.00 H ATOM 154 N ALA A 32 -12.127 -10.213 -34.928 1.00 9.96 N ATOM 155 CA ALA A 32 -13.591 -10.365 -34.976 1.00 9.75 C ATOM 156 C ALA A 32 -14.087 -10.852 -33.622 1.00 10.52 C ATOM 157 O ALA A 32 -13.679 -11.922 -33.168 1.00 11.10 O ATOM 158 CB ALA A 32 -13.972 -11.353 -36.060 1.00 11.58 C ATOM 159 H ALA A 32 -11.534 -11.060 -35.042 1.00 0.00 H ATOM 160 N ILE A 33 -14.991 -10.094 -32.995 1.00 9.80 N ATOM 161 CA ILE A 33 -15.391 -10.368 -31.621 1.00 9.08 C ATOM 162 C ILE A 33 -16.844 -10.804 -31.628 1.00 9.43 C ATOM 163 O ILE A 33 -17.707 -10.101 -32.173 1.00 10.36 O ATOM 164 CB ILE A 33 -15.198 -9.160 -30.680 1.00 9.77 C ATOM 165 CG1 ILE A 33 -13.765 -8.640 -30.787 1.00 9.37 C ATOM 166 CG2 ILE A 33 -15.458 -9.581 -29.236 1.00 12.31 C ATOM 167 CD1 ILE A 33 -13.515 -7.319 -30.104 1.00 10.80 C ATOM 168 H ILE A 33 -15.419 -9.291 -33.499 1.00 0.00 H ATOM 169 N TYR A 34 -17.077 -11.979 -31.050 1.00 9.23 N ATOM 170 CA TYR A 34 -18.425 -12.557 -30.929 1.00 9.31 C ATOM 171 C TYR A 34 -18.799 -12.779 -29.461 1.00 10.19 C ATOM 172 O TYR A 34 -17.933 -12.817 -28.592 1.00 10.48 O ATOM 173 CB TYR A 34 -18.500 -13.903 -31.634 1.00 11.09 C ATOM 174 CG TYR A 34 -18.169 -13.913 -33.104 1.00 9.14 C ATOM 175 CD1 TYR A 34 -16.846 -13.832 -33.539 1.00 10.68 C ATOM 176 CD2 TYR A 34 -19.164 -14.081 -34.066 1.00 10.25 C ATOM 177 CE1 TYR A 34 -16.531 -13.883 -34.883 1.00 11.71 C ATOM 178 CE2 TYR A 34 -18.856 -14.131 -35.418 1.00 9.32 C ATOM 179 CZ TYR A 34 -17.526 -14.016 -35.818 1.00 10.00 C ATOM 180 OH TYR A 34 -17.186 -14.076 -37.154 1.00 11.08 O ATOM 181 HH TYR A 34 -17.468 -14.949 -37.526 1.00 0.00 H ATOM 182 H TYR A 34 -16.271 -12.513 -30.667 1.00 0.00 H ATOM 183 N ARG A 35 -20.096 -12.947 -29.202 1.00 10.10 N ATOM 184 CA ARG A 35 -20.592 -13.267 -27.875 1.00 12.24 C ATOM 185 C ARG A 35 -21.469 -14.524 -27.879 1.00 13.32 C ATOM 186 O ARG A 35 -22.387 -14.652 -28.708 1.00 12.81 O ATOM 187 CB ARG A 35 -21.427 -12.098 -27.335 1.00 15.16 C ATOM 188 CG ARG A 35 -21.943 -12.336 -25.923 1.00 17.40 C ATOM 189 CD ARG A 35 -22.312 -11.050 -25.212 1.00 19.84 C ATOM 190 NE ARG A 35 -23.576 -10.498 -25.683 1.00 21.87 N ATOM 191 CZ ARG A 35 -24.780 -10.861 -25.243 1.00 24.80 C ATOM 192 NH1 ARG A 35 -24.918 -11.801 -24.316 1.00 29.00 N ATOM 193 NH2 ARG A 35 -25.859 -10.273 -25.739 1.00 27.05 N ATOM 194 HE ARG A 35 -23.535 -9.764 -26.419 1.00 0.00 H ATOM 195 HH12 ARG A 35 -25.867 -12.070 -23.986 1.00 0.00 H ATOM 196 HH11 ARG A 35 -24.077 -12.268 -23.920 1.00 0.00 H ATOM 197 HH22 ARG A 35 -26.803 -10.549 -25.402 1.00 0.00 H ATOM 198 HH21 ARG A 35 -25.762 -9.535 -26.465 1.00 0.00 H ATOM 199 H ARG A 35 -20.779 -12.845 -29.980 1.00 0.00 H ATOM 200 N ARG A 36 -21.216 -15.412 -26.920 1.00 13.18 N ATOM 201 CA ARG A 36 -22.035 -16.611 -26.716 1.00 12.94 C ATOM 202 C ARG A 36 -23.160 -16.315 -25.728 1.00 12.15 C ATOM 203 O ARG A 36 -22.933 -15.730 -24.661 1.00 12.72 O ATOM 204 CB ARG A 36 -21.158 -17.757 -26.198 1.00 13.82 C ATOM 205 CG ARG A 36 -21.874 -19.085 -26.008 1.00 13.90 C ATOM 206 CD ARG A 36 -20.936 -20.114 -25.397 1.00 15.12 C ATOM 207 NE ARG A 36 -19.939 -20.576 -26.351 1.00 16.36 N ATOM 208 CZ ARG A 36 -18.639 -20.289 -26.298 1.00 16.22 C ATOM 209 NH1 ARG A 36 -18.146 -19.536 -25.328 1.00 19.89 N ATOM 210 NH2 ARG A 36 -17.830 -20.769 -27.226 1.00 15.67 N ATOM 211 HE ARG A 36 -20.266 -21.176 -27.135 1.00 0.00 H ATOM 212 HH12 ARG A 36 -17.129 -19.322 -25.302 1.00 0.00 H ATOM 213 HH11 ARG A 36 -18.776 -19.158 -24.592 1.00 0.00 H ATOM 214 HH22 ARG A 36 -16.814 -20.551 -27.193 1.00 0.00 H ATOM 215 HH21 ARG A 36 -18.210 -21.365 -27.989 1.00 0.00 H ATOM 216 H ARG A 36 -20.405 -15.249 -26.290 1.00 0.00 H ATOM 217 N HIS A 37 -24.372 -16.720 -26.090 1.00 11.81 N ATOM 218 CA HIS A 37 -25.568 -16.500 -25.289 1.00 12.77 C ATOM 219 C HIS A 37 -25.854 -17.703 -24.382 1.00 14.80 C ATOM 220 O HIS A 37 -25.217 -18.746 -24.517 1.00 14.32 O ATOM 221 CB HIS A 37 -26.731 -16.225 -26.230 1.00 13.68 C ATOM 222 CG HIS A 37 -26.641 -14.889 -26.900 1.00 14.36 C ATOM 223 ND1 HIS A 37 -25.897 -14.673 -28.039 1.00 16.01 N ATOM 224 CD2 HIS A 37 -27.185 -13.695 -26.576 1.00 14.61 C ATOM 225 CE1 HIS A 37 -26.003 -13.407 -28.396 1.00 15.24 C ATOM 226 NE2 HIS A 37 -26.773 -12.790 -27.523 1.00 17.16 N ATOM 227 H HIS A 37 -24.472 -17.222 -26.995 1.00 0.00 H ATOM 228 N ARG A 37A -26.823 -17.551 -23.473 1.00 15.29 N ATOM 229 CA ARG A 37A -27.133 -18.579 -22.473 1.00 17.85 C ATOM 230 C ARG A 37A -27.288 -19.967 -23.089 1.00 17.90 C ATOM 231 O ARG A 37A -26.708 -20.944 -22.609 1.00 19.90 O ATOM 232 CB ARG A 37A -28.459 -18.269 -21.785 1.00 20.95 C ATOM 233 CG ARG A 37A -28.486 -17.120 -20.792 1.00 25.67 C ATOM 234 CD ARG A 37A -29.943 -16.784 -20.442 1.00 28.85 C ATOM 235 NE ARG A 37A -30.844 -17.911 -20.745 1.00 35.95 N ATOM 236 CZ ARG A 37A -31.854 -17.905 -21.624 1.00 34.50 C ATOM 237 NH1 ARG A 37A -32.194 -16.814 -22.311 1.00 25.85 N ATOM 238 NH2 ARG A 37A -32.556 -19.018 -21.807 1.00 41.01 N ATOM 239 HE ARG A 37A -30.679 -18.797 -20.225 1.00 0.00 H ATOM 240 HH12 ARG A 37A -32.985 -16.850 -22.985 1.00 0.00 H ATOM 241 HH11 ARG A 37A -31.668 -15.928 -22.173 1.00 0.00 H ATOM 242 HH22 ARG A 37A -33.344 -19.030 -22.486 1.00 0.00 H ATOM 243 HH21 ARG A 37A -32.318 -19.877 -21.271 1.00 0.00 H ATOM 244 H ARG A 37A -27.378 -16.671 -23.475 1.00 0.00 H ATOM 245 N GLY A 37B -28.100 -20.036 -24.143 1.00 19.08 N ATOM 246 CA GLY A 37B -28.421 -21.299 -24.819 1.00 17.37 C ATOM 247 C GLY A 37B -27.354 -21.819 -25.771 1.00 16.75 C ATOM 248 O GLY A 37B -27.498 -22.912 -26.316 1.00 17.54 O ATOM 249 H GLY A 37B -28.525 -19.157 -24.502 1.00 0.00 H ATOM 250 N GLY A 37C -26.300 -21.038 -25.994 1.00 14.91 N ATOM 251 CA GLY A 37C -25.172 -21.468 -26.828 1.00 16.72 C ATOM 252 C GLY A 37C -25.049 -20.792 -28.186 1.00 14.74 C ATOM 253 O GLY A 37C -24.018 -20.918 -28.848 1.00 14.47 O ATOM 254 H GLY A 37C -26.275 -20.092 -25.563 1.00 0.00 H ATOM 255 N SER A 37D -26.088 -20.081 -28.623 1.00 13.32 N ATOM 256 CA SER A 37D -26.009 -19.330 -29.875 1.00 11.60 C ATOM 257 C SER A 37D -24.954 -18.224 -29.756 1.00 12.81 C ATOM 258 O SER A 37D -24.766 -17.642 -28.691 1.00 14.45 O ATOM 259 CB SER A 37D -27.361 -18.744 -30.270 1.00 10.58 C ATOM 260 OG SER A 37D -28.251 -19.762 -30.669 1.00 12.85 O ATOM 261 HG SER A 37D -28.384 -20.395 -29.920 1.00 0.00 H ATOM 262 H SER A 37D -26.966 -20.060 -28.066 1.00 0.00 H ATOM 263 N VAL A 38 -24.262 -17.967 -30.857 1.00 13.72 N ATOM 264 CA VAL A 38 -23.140 -17.019 -30.877 1.00 12.88 C ATOM 265 C VAL A 38 -23.441 -15.936 -31.913 1.00 12.57 C ATOM 266 O VAL A 38 -23.721 -16.236 -33.078 1.00 12.72 O ATOM 267 CB VAL A 38 -21.808 -17.724 -31.214 1.00 13.47 C ATOM 268 CG1 VAL A 38 -20.710 -16.703 -31.489 1.00 13.80 C ATOM 269 CG2 VAL A 38 -21.389 -18.663 -30.087 1.00 15.29 C ATOM 270 H VAL A 38 -24.523 -18.454 -31.738 1.00 0.00 H ATOM 271 N THR A 39 -23.374 -14.681 -31.483 1.00 10.60 N ATOM 272 CA THR A 39 -23.651 -13.562 -32.369 1.00 11.04 C ATOM 273 C THR A 39 -22.442 -12.646 -32.488 1.00 10.62 C ATOM 274 O THR A 39 -21.596 -12.610 -31.600 1.00 14.16 O ATOM 275 CB THR A 39 -24.837 -12.744 -31.865 1.00 12.27 C ATOM 276 OG1 THR A 39 -24.551 -12.262 -30.546 1.00 14.55 O ATOM 277 CG2 THR A 39 -26.089 -13.604 -31.848 1.00 13.99 C ATOM 278 HG1 THR A 39 -23.741 -11.693 -30.572 1.00 0.00 H ATOM 279 H THR A 39 -23.118 -14.495 -30.492 1.00 0.00 H ATOM 280 N TYR A 40 -22.364 -11.913 -33.592 1.00 10.20 N ATOM 281 CA TYR A 40 -21.269 -10.970 -33.786 1.00 11.16 C ATOM 282 C TYR A 40 -21.481 -9.730 -32.932 1.00 10.87 C ATOM 283 O TYR A 40 -22.597 -9.239 -32.826 1.00 12.58 O ATOM 284 CB TYR A 40 -21.145 -10.574 -35.247 1.00 10.67 C ATOM 285 CG TYR A 40 -19.907 -9.756 -35.520 1.00 10.11 C ATOM 286 CD1 TYR A 40 -18.650 -10.341 -35.486 1.00 10.12 C ATOM 287 CD2 TYR A 40 -19.991 -8.403 -35.814 1.00 11.79 C ATOM 288 CE1 TYR A 40 -17.520 -9.604 -35.736 1.00 10.38 C ATOM 289 CE2 TYR A 40 -18.856 -7.652 -36.072 1.00 9.37 C ATOM 290 CZ TYR A 40 -17.622 -8.260 -36.030 1.00 9.13 C ATOM 291 OH TYR A 40 -16.504 -7.518 -36.291 1.00 11.25 O ATOM 292 HH TYR A 40 -16.564 -7.143 -37.205 1.00 0.00 H ATOM 293 H TYR A 40 -23.093 -12.013 -34.327 1.00 0.00 H ATOM 294 N VAL A 41 -20.405 -9.223 -32.339 1.00 12.78 N ATOM 295 CA VAL A 41 -20.480 -8.034 -31.499 1.00 14.00 C ATOM 296 C VAL A 41 -19.870 -6.835 -32.201 1.00 11.68 C ATOM 297 O VAL A 41 -20.567 -5.892 -32.554 1.00 12.65 O ATOM 298 CB VAL A 41 -19.774 -8.251 -30.152 1.00 14.68 C ATOM 299 CG1 VAL A 41 -19.799 -6.980 -29.306 1.00 16.81 C ATOM 300 CG2 VAL A 41 -20.410 -9.408 -29.406 1.00 15.39 C ATOM 301 H VAL A 41 -19.485 -9.687 -32.478 1.00 0.00 H ATOM 302 N CYS A 42 -18.558 -6.878 -32.406 1.00 11.03 N ATOM 303 CA CYS A 42 -17.811 -5.700 -32.832 1.00 10.59 C ATOM 304 C CYS A 42 -16.465 -6.128 -33.376 1.00 10.13 C ATOM 305 O CYS A 42 -16.086 -7.283 -33.232 1.00 10.97 O ATOM 306 CB CYS A 42 -17.592 -4.773 -31.640 1.00 11.96 C ATOM 307 SG CYS A 42 -18.952 -3.667 -31.226 1.00 17.48 S ATOM 308 H CYS A 42 -18.051 -7.774 -32.259 1.00 0.00 H ATOM 309 N GLY A 43 -15.811 -5.197 -34.061 1.00 9.28 N ATOM 310 CA GLY A 43 -14.407 -5.340 -34.476 1.00 8.12 C ATOM 311 C GLY A 43 -13.451 -4.923 -33.384 1.00 9.67 C ATOM 312 O GLY A 43 -13.850 -4.425 -32.326 1.00 10.37 O ATOM 313 H GLY A 43 -16.316 -4.324 -34.316 1.00 0.00 H ATOM 314 N GLY A 44 -12.170 -5.161 -33.647 1.00 10.41 N ATOM 315 CA GLY A 44 -11.077 -4.783 -32.770 1.00 10.50 C ATOM 316 C GLY A 44 -9.797 -4.902 -33.568 1.00 11.23 C ATOM 317 O GLY A 44 -9.834 -5.302 -34.742 1.00 10.34 O ATOM 318 H GLY A 44 -11.937 -5.648 -34.536 1.00 0.00 H ATOM 319 N SER A 45 -8.681 -4.559 -32.918 1.00 10.31 N ATOM 320 CA SER A 45 -7.355 -4.528 -33.526 1.00 11.60 C ATOM 321 C SER A 45 -6.310 -5.160 -32.611 1.00 12.16 C ATOM 322 O SER A 45 -6.224 -4.835 -31.423 1.00 11.54 O ATOM 323 CB SER A 45 -6.948 -3.085 -33.807 1.00 13.13 C ATOM 324 OG SER A 45 -7.757 -2.514 -34.814 1.00 13.66 O ATOM 325 HG SER A 45 -8.703 -2.525 -34.522 1.00 0.00 H ATOM 326 H SER A 45 -8.763 -4.297 -31.915 1.00 0.00 H ATOM 327 N LEU A 46 -5.495 -6.044 -33.170 1.00 13.53 N ATOM 328 CA LEU A 46 -4.418 -6.663 -32.407 1.00 11.71 C ATOM 329 C LEU A 46 -3.254 -5.675 -32.274 1.00 12.20 C ATOM 330 O LEU A 46 -2.677 -5.277 -33.277 1.00 12.39 O ATOM 331 CB LEU A 46 -3.951 -7.946 -33.097 1.00 13.81 C ATOM 332 CG LEU A 46 -2.967 -8.801 -32.300 1.00 16.05 C ATOM 333 CD1 LEU A 46 -3.637 -9.449 -31.095 1.00 17.79 C ATOM 334 CD2 LEU A 46 -2.361 -9.859 -33.205 1.00 13.38 C ATOM 335 H LEU A 46 -5.626 -6.300 -34.169 1.00 0.00 H ATOM 336 N ILE A 47 -2.945 -5.260 -31.044 1.00 11.29 N ATOM 337 CA ILE A 47 -1.863 -4.281 -30.801 1.00 12.61 C ATOM 338 C ILE A 47 -0.613 -4.912 -30.188 1.00 14.39 C ATOM 339 O ILE A 47 0.470 -4.325 -30.226 1.00 16.22 O ATOM 340 CB ILE A 47 -2.324 -3.046 -29.983 1.00 15.90 C ATOM 341 CG1 ILE A 47 -2.914 -3.434 -28.629 1.00 15.45 C ATOM 342 CG2 ILE A 47 -3.294 -2.213 -30.809 1.00 17.21 C ATOM 343 CD1 ILE A 47 -2.979 -2.280 -27.650 1.00 15.22 C ATOM 344 H ILE A 47 -3.479 -5.635 -30.234 1.00 0.00 H ATOM 345 N SER A 48 -0.762 -6.104 -29.630 1.00 15.47 N ATOM 346 CA SER A 48 0.383 -6.930 -29.241 1.00 16.52 C ATOM 347 C SER A 48 -0.137 -8.365 -29.204 1.00 16.02 C ATOM 348 O SER A 48 -1.331 -8.575 -29.356 1.00 15.87 O ATOM 349 CB SER A 48 0.975 -6.478 -27.903 1.00 18.04 C ATOM 350 OG SER A 48 0.116 -6.767 -26.826 1.00 20.56 O ATOM 351 HG SER A 48 -0.040 -7.744 -26.783 1.00 0.00 H ATOM 352 H SER A 48 -1.723 -6.465 -29.463 1.00 0.00 H ATOM 353 N PRO A 49 0.745 -9.360 -29.025 1.00 16.11 N ATOM 354 CA PRO A 49 0.210 -10.721 -29.164 1.00 17.91 C ATOM 355 C PRO A 49 -0.902 -11.109 -28.187 1.00 16.85 C ATOM 356 O PRO A 49 -1.711 -11.977 -28.522 1.00 16.87 O ATOM 357 CB PRO A 49 1.443 -11.604 -28.958 1.00 17.35 C ATOM 358 CG PRO A 49 2.568 -10.754 -29.427 1.00 17.74 C ATOM 359 CD PRO A 49 2.216 -9.353 -29.009 1.00 15.04 C ATOM 360 N CYS A 50 -0.931 -10.491 -27.003 1.00 17.06 N ATOM 361 CA CYS A 50 -1.905 -10.833 -25.967 1.00 17.87 C ATOM 362 C CYS A 50 -3.062 -9.835 -25.845 1.00 15.13 C ATOM 363 O CYS A 50 -3.951 -10.045 -25.023 1.00 14.46 O ATOM 364 CB CYS A 50 -1.230 -10.945 -24.596 1.00 21.39 C ATOM 365 SG CYS A 50 0.189 -12.051 -24.535 1.00 28.35 S ATOM 366 H CYS A 50 -0.237 -9.741 -26.811 1.00 0.00 H ATOM 367 N TRP A 51 -3.054 -8.764 -26.640 1.00 13.61 N ATOM 368 CA TRP A 51 -3.995 -7.646 -26.453 1.00 13.72 C ATOM 369 C TRP A 51 -4.702 -7.144 -27.721 1.00 13.17 C ATOM 370 O TRP A 51 -4.067 -6.795 -28.712 1.00 13.05 O ATOM 371 CB TRP A 51 -3.284 -6.456 -25.822 1.00 14.96 C ATOM 372 CG TRP A 51 -2.880 -6.672 -24.420 1.00 14.77 C ATOM 373 CD1 TRP A 51 -1.633 -7.007 -23.958 1.00 16.59 C ATOM 374 CD2 TRP A 51 -3.719 -6.578 -23.281 1.00 14.86 C ATOM 375 NE1 TRP A 51 -1.650 -7.113 -22.592 1.00 16.49 N ATOM 376 CE2 TRP A 51 -2.921 -6.856 -22.148 1.00 15.46 C ATOM 377 CE3 TRP A 51 -5.074 -6.274 -23.098 1.00 14.53 C ATOM 378 CZ2 TRP A 51 -3.435 -6.837 -20.854 1.00 17.20 C ATOM 379 CZ3 TRP A 51 -5.583 -6.258 -21.812 1.00 15.78 C ATOM 380 CH2 TRP A 51 -4.764 -6.543 -20.706 1.00 16.01 C ATOM 381 HE1 TRP A 51 -0.834 -7.349 -21.992 1.00 0.00 H ATOM 382 H TRP A 51 -2.363 -8.717 -27.415 1.00 0.00 H ATOM 383 N VAL A 52 -6.031 -7.089 -27.648 1.00 13.55 N ATOM 384 CA VAL A 52 -6.862 -6.516 -28.693 1.00 12.79 C ATOM 385 C VAL A 52 -7.495 -5.256 -28.119 1.00 12.48 C ATOM 386 O VAL A 52 -7.900 -5.232 -26.950 1.00 13.50 O ATOM 387 CB VAL A 52 -7.975 -7.497 -29.133 1.00 13.29 C ATOM 388 CG1 VAL A 52 -8.991 -6.808 -30.042 1.00 13.24 C ATOM 389 CG2 VAL A 52 -7.387 -8.711 -29.827 1.00 15.27 C ATOM 390 H VAL A 52 -6.496 -7.475 -26.802 1.00 0.00 H ATOM 391 N ILE A 53 -7.562 -4.220 -28.945 1.00 10.43 N ATOM 392 CA ILE A 53 -8.141 -2.947 -28.568 1.00 10.85 C ATOM 393 C ILE A 53 -9.425 -2.762 -29.370 1.00 11.77 C ATOM 394 O ILE A 53 -9.496 -3.085 -30.573 1.00 11.50 O ATOM 395 CB ILE A 53 -7.135 -1.769 -28.740 1.00 12.95 C ATOM 396 CG1 ILE A 53 -7.571 -0.554 -27.913 1.00 13.45 C ATOM 397 CG2 ILE A 53 -6.944 -1.406 -30.208 1.00 12.97 C ATOM 398 CD1 ILE A 53 -6.500 0.522 -27.820 1.00 13.89 C ATOM 399 H ILE A 53 -7.181 -4.327 -29.907 1.00 0.00 H ATOM 400 N SER A 54 -10.448 -2.271 -28.684 1.00 10.32 N ATOM 401 CA SER A 54 -11.794 -2.157 -29.253 1.00 9.78 C ATOM 402 C SER A 54 -12.486 -0.970 -28.595 1.00 10.52 C ATOM 403 O SER A 54 -11.807 -0.083 -28.076 1.00 11.67 O ATOM 404 CB SER A 54 -12.567 -3.476 -29.077 1.00 10.11 C ATOM 405 OG SER A 54 -13.861 -3.448 -29.702 1.00 11.66 O ATOM 406 HG SER A 54 -13.754 -3.286 -30.673 1.00 0.00 H ATOM 407 H SER A 54 -10.289 -1.955 -27.706 1.00 0.00 H ATOM 408 N ALA A 55 -13.819 -0.931 -28.647 1.00 10.05 N ATOM 409 CA ALA A 55 -14.597 0.171 -28.085 1.00 11.81 C ATOM 410 C ALA A 55 -15.450 -0.307 -26.898 1.00 12.25 C ATOM 411 O ALA A 55 -16.033 -1.390 -26.944 1.00 11.69 O ATOM 412 CB ALA A 55 -15.470 0.794 -29.160 1.00 9.64 C ATOM 413 H ALA A 55 -14.324 -1.716 -29.106 1.00 0.00 H ATOM 414 N THR A 56 -15.483 0.490 -25.829 1.00 12.05 N ATOM 415 CA THR A 56 -16.201 0.119 -24.610 1.00 12.56 C ATOM 416 C THR A 56 -17.712 -0.051 -24.852 1.00 11.61 C ATOM 417 O THR A 56 -18.318 -0.945 -24.271 1.00 10.98 O ATOM 418 CB THR A 56 -15.913 1.110 -23.453 1.00 14.27 C ATOM 419 OG1 THR A 56 -14.635 0.796 -22.868 1.00 15.94 O ATOM 420 CG2 THR A 56 -16.982 1.057 -22.372 1.00 17.79 C ATOM 421 HG1 THR A 56 -13.929 0.875 -23.558 1.00 0.00 H ATOM 422 H THR A 56 -14.984 1.402 -25.863 1.00 0.00 H ATOM 423 N HIS A 57 -18.316 0.762 -25.722 1.00 12.16 N ATOM 424 CA HIS A 57 -19.787 0.665 -25.904 1.00 11.66 C ATOM 425 C HIS A 57 -20.222 -0.707 -26.439 1.00 12.97 C ATOM 426 O HIS A 57 -21.358 -1.110 -26.221 1.00 14.09 O ATOM 427 CB HIS A 57 -20.342 1.806 -26.763 1.00 12.43 C ATOM 428 CG HIS A 57 -20.315 1.549 -28.241 1.00 11.35 C ATOM 429 ND1 HIS A 57 -19.386 2.124 -29.081 1.00 12.08 N ATOM 430 CD2 HIS A 57 -21.123 0.803 -29.030 1.00 11.84 C ATOM 431 CE1 HIS A 57 -19.624 1.745 -30.322 1.00 11.29 C ATOM 432 NE2 HIS A 57 -20.676 0.943 -30.321 1.00 11.13 N ATOM 433 H HIS A 57 -17.763 1.455 -26.266 1.00 0.00 H ATOM 434 N CYS A 58 -19.312 -1.408 -27.118 1.00 14.52 N ATOM 435 CA CYS A 58 -19.536 -2.783 -27.571 1.00 14.03 C ATOM 436 C CYS A 58 -19.839 -3.793 -26.453 1.00 14.73 C ATOM 437 O CYS A 58 -20.489 -4.803 -26.714 1.00 14.53 O ATOM 438 CB CYS A 58 -18.311 -3.280 -28.355 1.00 14.33 C ATOM 439 SG CYS A 58 -18.075 -2.395 -29.905 1.00 14.65 S ATOM 440 H CYS A 58 -18.401 -0.957 -27.336 1.00 0.00 H ATOM 441 N PHE A 59 -19.360 -3.527 -25.235 1.00 15.21 N ATOM 442 CA PHE A 59 -19.371 -4.518 -24.140 1.00 16.09 C ATOM 443 C PHE A 59 -20.043 -4.072 -22.861 1.00 17.58 C ATOM 444 O PHE A 59 -20.234 -4.883 -21.958 1.00 18.44 O ATOM 445 CB PHE A 59 -17.941 -4.873 -23.746 1.00 16.47 C ATOM 446 CG PHE A 59 -17.076 -5.208 -24.898 1.00 16.23 C ATOM 447 CD1 PHE A 59 -17.180 -6.439 -25.505 1.00 24.12 C ATOM 448 CD2 PHE A 59 -16.181 -4.278 -25.399 1.00 16.75 C ATOM 449 CE1 PHE A 59 -16.375 -6.758 -26.582 1.00 22.57 C ATOM 450 CE2 PHE A 59 -15.391 -4.582 -26.483 1.00 18.16 C ATOM 451 CZ PHE A 59 -15.489 -5.825 -27.075 1.00 19.68 C ATOM 452 H PHE A 59 -18.963 -2.584 -25.050 1.00 0.00 H ATOM 453 N ILE A 60 -20.361 -2.785 -22.776 1.00 18.18 N ATOM 454 CA ILE A 60 -20.843 -2.168 -21.540 1.00 21.73 C ATOM 455 C ILE A 60 -22.157 -2.764 -21.022 1.00 22.10 C ATOM 456 O ILE A 60 -22.392 -2.768 -19.819 1.00 24.94 O ATOM 457 CB ILE A 60 -20.968 -0.631 -21.717 1.00 23.84 C ATOM 458 CG1 ILE A 60 -21.176 0.076 -20.367 1.00 23.70 C ATOM 459 CG2 ILE A 60 -22.051 -0.272 -22.728 1.00 21.06 C ATOM 460 CD1 ILE A 60 -19.880 0.449 -19.684 1.00 25.40 C ATOM 461 H ILE A 60 -20.263 -2.191 -23.624 1.00 0.00 H ATOM 462 N ASP A 60A -23.004 -3.282 -21.907 1.00 21.43 N ATOM 463 CA ASP A 60A -24.242 -3.932 -21.455 1.00 27.05 C ATOM 464 C ASP A 60A -24.045 -5.399 -21.058 1.00 22.32 C ATOM 465 O ASP A 60A -24.885 -5.969 -20.369 1.00 23.29 O ATOM 466 CB ASP A 60A -25.341 -3.807 -22.514 1.00 33.40 C ATOM 467 CG ASP A 60A -25.788 -2.375 -22.715 1.00 33.59 C ATOM 468 OD1 ASP A 60A -25.806 -1.603 -21.727 1.00 30.94 O ATOM 469 OD2 ASP A 60A -26.120 -2.019 -23.864 1.00 38.17 O ATOM 470 H ASP A 60A -22.789 -3.227 -22.923 1.00 0.00 H ATOM 471 N TYR A 60B -22.948 -6.001 -21.502 1.00 20.47 N ATOM 472 CA TYR A 60B -22.663 -7.408 -21.239 1.00 20.25 C ATOM 473 C TYR A 60B -21.171 -7.613 -20.972 1.00 21.79 C ATOM 474 O TYR A 60B -20.490 -8.275 -21.749 1.00 23.06 O ATOM 475 CB TYR A 60B -23.118 -8.268 -22.429 1.00 18.85 C ATOM 476 CG TYR A 60B -24.617 -8.270 -22.632 1.00 22.81 C ATOM 477 CD1 TYR A 60B -25.429 -9.137 -21.917 1.00 24.61 C ATOM 478 CD2 TYR A 60B -25.221 -7.397 -23.535 1.00 24.27 C ATOM 479 CE1 TYR A 60B -26.804 -9.140 -22.090 1.00 28.85 C ATOM 480 CE2 TYR A 60B -26.591 -7.389 -23.713 1.00 27.82 C ATOM 481 CZ TYR A 60B -27.377 -8.262 -22.988 1.00 29.66 C ATOM 482 OH TYR A 60B -28.737 -8.256 -23.165 1.00 37.94 O ATOM 483 HH TYR A 60B -28.947 -8.467 -24.109 1.00 0.00 H ATOM 484 H TYR A 60B -22.265 -5.448 -22.059 1.00 0.00 H ATOM 485 N PRO A 60C -20.662 -7.072 -19.849 1.00 23.98 N ATOM 486 CA PRO A 60C -19.220 -7.037 -19.589 1.00 24.54 C ATOM 487 C PRO A 60C -18.610 -8.340 -19.035 1.00 21.52 C ATOM 488 O PRO A 60C -17.440 -8.343 -18.617 1.00 26.46 O ATOM 489 CB PRO A 60C -19.094 -5.898 -18.571 1.00 27.56 C ATOM 490 CG PRO A 60C -20.380 -5.928 -17.819 1.00 28.02 C ATOM 491 CD PRO A 60C -21.432 -6.497 -18.729 1.00 26.73 C ATOM 492 N LYS A 61 -19.368 -9.436 -19.052 1.00 24.79 N ATOM 493 CA LYS A 61 -18.859 -10.744 -18.613 1.00 26.75 C ATOM 494 C LYS A 61 -17.887 -11.322 -19.633 1.00 23.97 C ATOM 495 O LYS A 61 -18.297 -11.710 -20.734 1.00 21.97 O ATOM 496 CB LYS A 61 -20.005 -11.733 -18.414 1.00 27.57 C ATOM 497 CG LYS A 61 -19.525 -13.135 -18.066 1.00 30.28 C ATOM 498 CD LYS A 61 -20.676 -14.088 -17.813 1.00 31.59 C ATOM 499 CE LYS A 61 -20.195 -15.348 -17.116 1.00 33.30 C ATOM 500 NZ LYS A 61 -21.267 -16.372 -16.972 1.00 37.38 N ATOM 501 HZ1 LYS A 61 -22.049 -15.977 -16.412 1.00 0.00 H ATOM 502 HZ2 LYS A 61 -21.615 -16.642 -17.914 1.00 0.00 H ATOM 503 HZ3 LYS A 61 -20.882 -17.209 -16.490 1.00 0.00 H ATOM 504 H LYS A 61 -20.350 -9.364 -19.386 1.00 0.00 H ATOM 505 N LYS A 62 -16.612 -11.412 -19.260 1.00 22.43 N ATOM 506 CA LYS A 62 -15.567 -11.784 -20.214 1.00 19.60 C ATOM 507 C LYS A 62 -15.708 -13.204 -20.768 1.00 17.86 C ATOM 508 O LYS A 62 -15.389 -13.443 -21.927 1.00 17.56 O ATOM 509 CB LYS A 62 -14.174 -11.567 -19.620 1.00 18.14 C ATOM 510 CG LYS A 62 -13.839 -12.386 -18.382 1.00 18.48 C ATOM 511 CD LYS A 62 -12.552 -11.872 -17.745 1.00 23.00 C ATOM 512 CE LYS A 62 -12.619 -11.826 -16.225 1.00 30.78 C ATOM 513 NZ LYS A 62 -12.488 -13.172 -15.619 1.00 50.87 N ATOM 514 HZ1 LYS A 62 -13.260 -13.781 -15.959 1.00 0.00 H ATOM 515 HZ2 LYS A 62 -11.573 -13.586 -15.891 1.00 0.00 H ATOM 516 HZ3 LYS A 62 -12.539 -13.091 -14.583 1.00 0.00 H ATOM 517 H LYS A 62 -16.354 -11.214 -18.272 1.00 0.00 H ATOM 518 N GLU A 62A -16.228 -14.125 -19.956 1.00 17.47 N ATOM 519 CA GLU A 62A -16.307 -15.540 -20.326 1.00 20.37 C ATOM 520 C GLU A 62A -17.193 -15.825 -21.547 1.00 18.80 C ATOM 521 O GLU A 62A -16.964 -16.816 -22.248 1.00 18.48 O ATOM 522 CB GLU A 62A -16.790 -16.386 -19.139 1.00 23.06 C ATOM 523 CG GLU A 62A -15.792 -16.503 -17.991 1.00 27.06 C ATOM 524 CD GLU A 62A -15.750 -15.292 -17.069 1.00 24.87 C ATOM 525 OE1 GLU A 62A -16.588 -14.376 -17.197 1.00 25.65 O ATOM 526 OE2 GLU A 62A -14.863 -15.257 -16.198 1.00 26.90 O ATOM 527 H GLU A 62A -16.590 -13.828 -19.027 1.00 0.00 H ATOM 528 N ASP A 63 -18.185 -14.958 -21.787 1.00 16.88 N ATOM 529 CA ASP A 63 -19.089 -15.063 -22.941 1.00 16.40 C ATOM 530 C ASP A 63 -18.457 -14.683 -24.301 1.00 16.39 C ATOM 531 O ASP A 63 -19.038 -14.950 -25.360 1.00 16.25 O ATOM 532 CB ASP A 63 -20.346 -14.193 -22.706 1.00 20.60 C ATOM 533 CG ASP A 63 -21.218 -14.692 -21.556 1.00 25.43 C ATOM 534 OD1 ASP A 63 -20.936 -15.773 -21.005 1.00 33.71 O ATOM 535 OD2 ASP A 63 -22.213 -14.005 -21.210 1.00 32.60 O ATOM 536 H ASP A 63 -18.323 -14.170 -21.123 1.00 0.00 H ATOM 537 N TYR A 64 -17.283 -14.059 -24.300 1.00 14.88 N ATOM 538 CA TYR A 64 -16.745 -13.531 -25.546 1.00 13.80 C ATOM 539 C TYR A 64 -15.829 -14.508 -26.275 1.00 13.87 C ATOM 540 O TYR A 64 -15.172 -15.349 -25.657 1.00 13.37 O ATOM 541 CB TYR A 64 -16.087 -12.175 -25.308 1.00 14.62 C ATOM 542 CG TYR A 64 -17.114 -11.118 -24.996 1.00 14.20 C ATOM 543 CD1 TYR A 64 -17.804 -10.475 -26.018 1.00 13.21 C ATOM 544 CD2 TYR A 64 -17.411 -10.776 -23.688 1.00 16.86 C ATOM 545 CE1 TYR A 64 -18.754 -9.510 -25.742 1.00 14.33 C ATOM 546 CE2 TYR A 64 -18.362 -9.813 -23.399 1.00 17.54 C ATOM 547 CZ TYR A 64 -19.031 -9.183 -24.434 1.00 16.57 C ATOM 548 OH TYR A 64 -19.991 -8.230 -24.177 1.00 19.41 O ATOM 549 HH TYR A 64 -20.357 -7.893 -25.033 1.00 0.00 H ATOM 550 H TYR A 64 -16.751 -13.948 -23.413 1.00 0.00 H ATOM 551 N ILE A 65 -15.850 -14.419 -27.602 1.00 15.10 N ATOM 552 CA ILE A 65 -14.968 -15.197 -28.462 1.00 16.12 C ATOM 553 C ILE A 65 -14.289 -14.220 -29.411 1.00 13.72 C ATOM 554 O ILE A 65 -14.950 -13.419 -30.054 1.00 14.34 O ATOM 555 CB ILE A 65 -15.736 -16.253 -29.284 1.00 17.04 C ATOM 556 CG1 ILE A 65 -16.627 -17.111 -28.368 1.00 17.16 C ATOM 557 CG2 ILE A 65 -14.754 -17.123 -30.059 1.00 18.91 C ATOM 558 CD1 ILE A 65 -17.681 -17.919 -29.101 1.00 18.56 C ATOM 559 H ILE A 65 -16.526 -13.765 -28.045 1.00 0.00 H ATOM 560 N VAL A 66 -12.963 -14.288 -29.481 1.00 13.12 N ATOM 561 CA VAL A 66 -12.181 -13.438 -30.370 1.00 14.65 C ATOM 562 C VAL A 66 -11.515 -14.316 -31.420 1.00 12.76 C ATOM 563 O VAL A 66 -10.871 -15.318 -31.094 1.00 14.54 O ATOM 564 CB VAL A 66 -11.108 -12.642 -29.610 1.00 16.49 C ATOM 565 CG1 VAL A 66 -10.244 -11.832 -30.573 1.00 16.22 C ATOM 566 CG2 VAL A 66 -11.767 -11.726 -28.590 1.00 17.77 C ATOM 567 H VAL A 66 -12.465 -14.974 -28.878 1.00 0.00 H ATOM 568 N TYR A 67 -11.698 -13.940 -32.675 1.00 12.23 N ATOM 569 CA TYR A 67 -10.979 -14.553 -33.773 1.00 13.20 C ATOM 570 C TYR A 67 -9.970 -13.585 -34.369 1.00 12.48 C ATOM 571 O TYR A 67 -10.240 -12.387 -34.524 1.00 12.31 O ATOM 572 CB TYR A 67 -11.922 -14.983 -34.884 1.00 13.47 C ATOM 573 CG TYR A 67 -12.710 -16.213 -34.571 1.00 15.52 C ATOM 574 CD1 TYR A 67 -12.216 -17.466 -34.888 1.00 17.71 C ATOM 575 CD2 TYR A 67 -13.962 -16.123 -33.971 1.00 16.38 C ATOM 576 CE1 TYR A 67 -12.935 -18.609 -34.611 1.00 16.65 C ATOM 577 CE2 TYR A 67 -14.699 -17.259 -33.688 1.00 19.96 C ATOM 578 CZ TYR A 67 -14.181 -18.497 -34.007 1.00 19.80 C ATOM 579 OH TYR A 67 -14.908 -19.624 -33.731 1.00 30.19 O ATOM 580 HH TYR A 67 -14.399 -20.423 -34.019 1.00 0.00 H ATOM 581 H TYR A 67 -12.379 -13.181 -32.880 1.00 0.00 H ATOM 582 N LEU A 68 -8.813 -14.126 -34.718 1.00 12.57 N ATOM 583 CA LEU A 68 -7.842 -13.433 -35.561 1.00 12.99 C ATOM 584 C LEU A 68 -7.672 -14.262 -36.822 1.00 12.67 C ATOM 585 O LEU A 68 -7.939 -15.463 -36.811 1.00 13.06 O ATOM 586 CB LEU A 68 -6.501 -13.287 -34.847 1.00 12.74 C ATOM 587 CG LEU A 68 -6.547 -12.659 -33.451 1.00 14.36 C ATOM 588 CD1 LEU A 68 -5.161 -12.722 -32.819 1.00 14.99 C ATOM 589 CD2 LEU A 68 -7.058 -11.229 -33.491 1.00 15.04 C ATOM 590 H LEU A 68 -8.586 -15.083 -34.378 1.00 0.00 H ATOM 591 N GLY A 69 -7.243 -13.621 -37.905 1.00 12.81 N ATOM 592 CA GLY A 69 -7.055 -14.306 -39.181 1.00 12.20 C ATOM 593 C GLY A 69 -8.329 -14.747 -39.880 1.00 12.00 C ATOM 594 O GLY A 69 -8.312 -15.679 -40.688 1.00 13.25 O ATOM 595 H GLY A 69 -7.036 -12.604 -37.842 1.00 0.00 H ATOM 596 N ARG A 70 -9.433 -14.070 -39.574 1.00 13.07 N ATOM 597 CA ARG A 70 -10.759 -14.447 -40.059 1.00 13.75 C ATOM 598 C ARG A 70 -11.282 -13.408 -41.050 1.00 13.15 C ATOM 599 O ARG A 70 -11.378 -12.223 -40.718 1.00 14.49 O ATOM 600 CB ARG A 70 -11.705 -14.591 -38.870 1.00 16.55 C ATOM 601 CG ARG A 70 -13.138 -14.951 -39.215 1.00 20.31 C ATOM 602 CD ARG A 70 -13.715 -15.909 -38.179 1.00 23.90 C ATOM 603 NE ARG A 70 -15.042 -16.363 -38.558 1.00 30.32 N ATOM 604 CZ ARG A 70 -15.588 -17.527 -38.218 1.00 33.31 C ATOM 605 NH1 ARG A 70 -14.930 -18.414 -37.479 1.00 32.51 N ATOM 606 NH2 ARG A 70 -16.815 -17.807 -38.641 1.00 25.14 N ATOM 607 HE ARG A 70 -15.614 -15.723 -39.145 1.00 0.00 H ATOM 608 HH12 ARG A 70 -15.380 -19.317 -37.227 1.00 0.00 H ATOM 609 HH11 ARG A 70 -13.965 -18.205 -37.153 1.00 0.00 H ATOM 610 HH22 ARG A 70 -17.259 -18.712 -38.386 1.00 0.00 H ATOM 611 HH21 ARG A 70 -17.332 -17.121 -39.228 1.00 0.00 H ATOM 612 H ARG A 70 -9.348 -13.234 -38.961 1.00 0.00 H ATOM 613 N SER A 71 -11.607 -13.872 -42.260 1.00 13.88 N ATOM 614 CA SER A 71 -12.094 -13.027 -43.357 1.00 11.95 C ATOM 615 C SER A 71 -13.623 -13.091 -43.517 1.00 11.27 C ATOM 616 O SER A 71 -14.205 -12.230 -44.166 1.00 13.84 O ATOM 617 CB SER A 71 -11.478 -13.472 -44.694 1.00 11.59 C ATOM 618 OG SER A 71 -10.098 -13.156 -44.802 1.00 14.73 O ATOM 619 HG SER A 71 -9.758 -13.465 -45.679 1.00 0.00 H ATOM 620 H SER A 71 -11.509 -14.892 -42.435 1.00 0.00 H ATOM 621 N ARG A 72 -14.258 -14.122 -42.965 1.00 12.23 N ATOM 622 CA ARG A 72 -15.707 -14.314 -43.110 1.00 12.53 C ATOM 623 C ARG A 72 -16.458 -14.424 -41.774 1.00 12.69 C ATOM 624 O ARG A 72 -15.904 -14.827 -40.757 1.00 12.39 O ATOM 625 CB ARG A 72 -15.994 -15.509 -44.023 1.00 15.48 C ATOM 626 CG ARG A 72 -15.515 -15.266 -45.442 1.00 16.09 C ATOM 627 CD ARG A 72 -15.853 -16.413 -46.363 1.00 16.12 C ATOM 628 NE ARG A 72 -15.102 -17.632 -46.070 1.00 16.74 N ATOM 629 CZ ARG A 72 -15.317 -18.795 -46.680 1.00 20.57 C ATOM 630 NH1 ARG A 72 -16.266 -18.899 -47.606 1.00 22.11 N ATOM 631 NH2 ARG A 72 -14.582 -19.858 -46.368 1.00 21.15 N ATOM 632 HE ARG A 72 -14.358 -17.588 -45.344 1.00 0.00 H ATOM 633 HH12 ARG A 72 -16.432 -19.809 -48.081 1.00 0.00 H ATOM 634 HH11 ARG A 72 -16.842 -18.070 -47.855 1.00 0.00 H ATOM 635 HH22 ARG A 72 -14.752 -20.766 -46.846 1.00 0.00 H ATOM 636 HH21 ARG A 72 -13.837 -19.782 -45.646 1.00 0.00 H ATOM 637 H ARG A 72 -13.711 -14.814 -42.414 1.00 0.00 H ATOM 638 N LEU A 73 -17.731 -14.040 -41.784 1.00 12.44 N ATOM 639 CA LEU A 73 -18.514 -13.944 -40.550 1.00 13.83 C ATOM 640 C LEU A 73 -18.938 -15.294 -39.977 1.00 13.43 C ATOM 641 O LEU A 73 -18.896 -15.502 -38.762 1.00 14.52 O ATOM 642 CB LEU A 73 -19.758 -13.086 -40.791 1.00 14.57 C ATOM 643 CG LEU A 73 -20.537 -12.635 -39.552 1.00 17.55 C ATOM 644 CD1 LEU A 73 -19.721 -11.682 -38.691 1.00 19.90 C ATOM 645 CD2 LEU A 73 -21.830 -11.976 -39.987 1.00 16.60 C ATOM 646 H LEU A 73 -18.182 -13.802 -42.690 1.00 0.00 H ATOM 647 N ASN A 74 -19.350 -16.202 -40.852 1.00 12.61 N ATOM 648 CA ASN A 74 -19.900 -17.502 -40.432 1.00 13.59 C ATOM 649 C ASN A 74 -19.291 -18.690 -41.168 1.00 17.00 C ATOM 650 O ASN A 74 -19.798 -19.804 -41.080 1.00 23.57 O ATOM 651 CB ASN A 74 -21.411 -17.527 -40.648 1.00 15.21 C ATOM 652 CG ASN A 74 -22.134 -16.461 -39.861 1.00 19.62 C ATOM 653 OD1 ASN A 74 -22.133 -16.481 -38.631 1.00 25.24 O ATOM 654 ND2 ASN A 74 -22.762 -15.524 -40.564 1.00 18.69 N ATOM 655 HD22 ASN A 74 -22.735 -15.548 -41.603 1.00 0.00 H ATOM 656 HD21 ASN A 74 -23.280 -14.767 -40.075 1.00 0.00 H ATOM 657 H ASN A 74 -19.282 -15.989 -41.868 1.00 0.00 H ATOM 658 N SER A 75 -18.223 -18.450 -41.921 1.00 17.09 N ATOM 659 CA SER A 75 -17.433 -19.538 -42.485 1.00 19.18 C ATOM 660 C SER A 75 -16.003 -19.323 -42.046 1.00 20.70 C ATOM 661 O SER A 75 -15.636 -18.223 -41.621 1.00 19.97 O ATOM 662 CB SER A 75 -17.539 -19.568 -44.011 1.00 23.32 C ATOM 663 OG SER A 75 -18.887 -19.769 -44.412 1.00 24.85 O ATOM 664 HG SER A 75 -18.937 -19.786 -45.401 1.00 0.00 H ATOM 665 H SER A 75 -17.945 -17.466 -42.112 1.00 0.00 H ATOM 666 N ASN A 76 -15.207 -20.382 -42.147 1.00 22.12 N ATOM 667 CA ASN A 76 -13.830 -20.368 -41.665 1.00 21.89 C ATOM 668 C ASN A 76 -12.842 -19.873 -42.708 1.00 19.48 C ATOM 669 O ASN A 76 -13.096 -19.913 -43.915 1.00 25.17 O ATOM 670 CB ASN A 76 -13.414 -21.764 -41.202 1.00 24.41 C ATOM 671 CG ASN A 76 -14.306 -22.308 -40.105 1.00 29.27 C ATOM 672 OD1 ASN A 76 -14.926 -23.358 -40.272 1.00 40.40 O ATOM 673 ND2 ASN A 76 -14.380 -21.601 -38.979 1.00 38.64 N ATOM 674 HD22 ASN A 76 -13.838 -20.719 -38.882 1.00 0.00 H ATOM 675 HD21 ASN A 76 -14.980 -21.931 -38.196 1.00 0.00 H ATOM 676 H ASN A 76 -15.578 -21.250 -42.584 1.00 0.00 H ATOM 677 N THR A 77 -11.708 -19.404 -42.208 1.00 19.56 N ATOM 678 CA THR A 77 -10.589 -18.969 -43.022 1.00 16.46 C ATOM 679 C THR A 77 -9.399 -19.786 -42.555 1.00 17.06 C ATOM 680 O THR A 77 -9.115 -19.837 -41.350 1.00 18.08 O ATOM 681 CB THR A 77 -10.303 -17.469 -42.803 1.00 17.50 C ATOM 682 OG1 THR A 77 -11.418 -16.694 -43.271 1.00 17.74 O ATOM 683 CG2 THR A 77 -9.039 -17.029 -43.532 1.00 20.16 C ATOM 684 HG1 THR A 77 -11.232 -15.732 -43.129 1.00 0.00 H ATOM 685 H THR A 77 -11.615 -19.344 -41.174 1.00 0.00 H ATOM 686 N GLN A 78 -8.715 -20.443 -43.483 1.00 18.52 N ATOM 687 CA GLN A 78 -7.531 -21.209 -43.120 1.00 20.05 C ATOM 688 C GLN A 78 -6.519 -20.294 -42.431 1.00 19.45 C ATOM 689 O GLN A 78 -6.229 -19.205 -42.917 1.00 21.34 O ATOM 690 CB GLN A 78 -6.902 -21.877 -44.347 1.00 27.06 C ATOM 691 CG GLN A 78 -5.653 -22.688 -44.030 1.00 33.39 C ATOM 692 CD GLN A 78 -5.709 -24.095 -44.592 1.00 39.10 C ATOM 693 OE1 GLN A 78 -4.982 -24.434 -45.523 1.00 45.13 O ATOM 694 NE2 GLN A 78 -6.580 -24.922 -44.024 1.00 45.45 N ATOM 695 HE22 GLN A 78 -7.175 -24.591 -43.238 1.00 0.00 H ATOM 696 HE21 GLN A 78 -6.667 -25.901 -44.365 1.00 0.00 H ATOM 697 H GLN A 78 -9.026 -20.411 -44.475 1.00 0.00 H ATOM 698 N GLY A 79 -6.003 -20.741 -41.290 1.00 18.61 N ATOM 699 CA GLY A 79 -5.022 -19.971 -40.518 1.00 19.39 C ATOM 700 C GLY A 79 -5.638 -19.103 -39.431 1.00 17.68 C ATOM 701 O GLY A 79 -4.921 -18.458 -38.674 1.00 18.87 O ATOM 702 H GLY A 79 -6.306 -21.669 -40.932 1.00 0.00 H ATOM 703 N GLU A 80 -6.970 -19.067 -39.353 1.00 17.50 N ATOM 704 CA GLU A 80 -7.642 -18.330 -38.286 1.00 14.22 C ATOM 705 C GLU A 80 -7.369 -18.999 -36.940 1.00 14.27 C ATOM 706 O GLU A 80 -7.061 -20.191 -36.870 1.00 16.30 O ATOM 707 CB GLU A 80 -9.151 -18.222 -38.542 1.00 13.77 C ATOM 708 CG GLU A 80 -9.923 -19.508 -38.303 1.00 14.66 C ATOM 709 CD GLU A 80 -11.411 -19.362 -38.568 1.00 18.88 C ATOM 710 OE1 GLU A 80 -11.803 -18.447 -39.317 1.00 23.22 O ATOM 711 OE2 GLU A 80 -12.191 -20.166 -38.029 1.00 24.60 O ATOM 712 H GLU A 80 -7.538 -19.572 -40.063 1.00 0.00 H ATOM 713 N MET A 81 -7.461 -18.210 -35.881 1.00 12.89 N ATOM 714 CA MET A 81 -7.151 -18.663 -34.537 1.00 13.50 C ATOM 715 C MET A 81 -8.155 -18.033 -33.588 1.00 15.58 C ATOM 716 O MET A 81 -8.531 -16.863 -33.741 1.00 15.16 O ATOM 717 CB MET A 81 -5.714 -18.277 -34.141 1.00 12.88 C ATOM 718 CG MET A 81 -4.616 -18.894 -35.007 1.00 18.29 C ATOM 719 SD MET A 81 -4.486 -20.693 -34.926 1.00 28.12 S ATOM 720 CE MET A 81 -3.886 -20.996 -33.275 1.00 28.43 C ATOM 721 H MET A 81 -7.768 -17.226 -36.017 1.00 0.00 H ATOM 722 N LYS A 82 -8.581 -18.831 -32.613 1.00 17.78 N ATOM 723 CA LYS A 82 -9.714 -18.512 -31.757 1.00 18.23 C ATOM 724 C LYS A 82 -9.213 -18.316 -30.339 1.00 17.26 C ATOM 725 O LYS A 82 -8.303 -19.021 -29.896 1.00 18.70 O ATOM 726 CB LYS A 82 -10.691 -19.672 -31.803 1.00 22.08 C ATOM 727 CG LYS A 82 -11.928 -19.547 -30.940 1.00 27.33 C ATOM 728 CD LYS A 82 -12.710 -20.847 -31.042 1.00 26.18 C ATOM 729 CE LYS A 82 -13.198 -21.336 -29.695 1.00 28.41 C ATOM 730 NZ LYS A 82 -14.533 -20.773 -29.355 1.00 27.26 N ATOM 731 HZ1 LYS A 82 -14.473 -19.735 -29.325 1.00 0.00 H ATOM 732 HZ2 LYS A 82 -15.223 -21.060 -30.078 1.00 0.00 H ATOM 733 HZ3 LYS A 82 -14.833 -21.131 -28.426 1.00 0.00 H ATOM 734 H LYS A 82 -8.079 -19.728 -32.454 1.00 0.00 H ATOM 735 N PHE A 83 -9.807 -17.358 -29.639 1.00 15.15 N ATOM 736 CA PHE A 83 -9.356 -16.976 -28.310 1.00 14.42 C ATOM 737 C PHE A 83 -10.479 -16.731 -27.339 1.00 13.51 C ATOM 738 O PHE A 83 -11.527 -16.211 -27.705 1.00 15.47 O ATOM 739 CB PHE A 83 -8.526 -15.699 -28.392 1.00 12.67 C ATOM 740 CG PHE A 83 -7.291 -15.853 -29.211 1.00 13.03 C ATOM 741 CD1 PHE A 83 -7.321 -15.629 -30.575 1.00 12.64 C ATOM 742 CD2 PHE A 83 -6.108 -16.253 -28.625 1.00 13.66 C ATOM 743 CE1 PHE A 83 -6.185 -15.774 -31.339 1.00 11.33 C ATOM 744 CE2 PHE A 83 -4.972 -16.413 -29.384 1.00 13.80 C ATOM 745 CZ PHE A 83 -5.011 -16.175 -30.744 1.00 13.79 C ATOM 746 H PHE A 83 -10.622 -16.864 -30.054 1.00 0.00 H ATOM 747 N GLU A 84 -10.223 -17.119 -26.097 1.00 16.85 N ATOM 748 CA GLU A 84 -10.965 -16.653 -24.951 1.00 18.08 C ATOM 749 C GLU A 84 -10.448 -15.278 -24.522 1.00 16.84 C ATOM 750 O GLU A 84 -9.320 -14.880 -24.853 1.00 16.13 O ATOM 751 CB GLU A 84 -10.807 -17.638 -23.794 1.00 20.82 C ATOM 752 CG GLU A 84 -11.450 -18.994 -24.051 1.00 24.81 C ATOM 753 CD GLU A 84 -11.045 -20.040 -23.028 1.00 29.65 C ATOM 754 OE1 GLU A 84 -10.579 -19.665 -21.931 1.00 36.13 O ATOM 755 OE2 GLU A 84 -11.193 -21.246 -23.322 1.00 37.54 O ATOM 756 H GLU A 84 -9.447 -17.794 -25.941 1.00 0.00 H ATOM 757 N VAL A 85 -11.286 -14.566 -23.775 1.00 16.51 N ATOM 758 CA VAL A 85 -10.926 -13.280 -23.191 1.00 17.07 C ATOM 759 C VAL A 85 -10.611 -13.464 -21.700 1.00 17.33 C ATOM 760 O VAL A 85 -11.502 -13.741 -20.888 1.00 17.87 O ATOM 761 CB VAL A 85 -12.043 -12.246 -23.392 1.00 15.21 C ATOM 762 CG1 VAL A 85 -11.667 -10.899 -22.781 1.00 15.11 C ATOM 763 CG2 VAL A 85 -12.352 -12.102 -24.875 1.00 14.72 C ATOM 764 H VAL A 85 -12.239 -14.943 -23.600 1.00 0.00 H ATOM 765 N GLU A 86 -9.328 -13.320 -21.375 1.00 17.69 N ATOM 766 CA GLU A 86 -8.792 -13.501 -20.025 1.00 18.43 C ATOM 767 C GLU A 86 -9.058 -12.270 -19.147 1.00 19.79 C ATOM 768 O GLU A 86 -9.230 -12.391 -17.932 1.00 21.17 O ATOM 769 CB GLU A 86 -7.280 -13.755 -20.131 1.00 19.82 C ATOM 770 CG GLU A 86 -6.541 -13.990 -18.819 1.00 22.71 C ATOM 771 CD GLU A 86 -5.039 -14.178 -19.015 1.00 27.08 C ATOM 772 OE1 GLU A 86 -4.576 -14.207 -20.173 1.00 29.28 O ATOM 773 OE2 GLU A 86 -4.317 -14.296 -18.009 1.00 36.08 O ATOM 774 H GLU A 86 -8.662 -13.062 -22.131 1.00 0.00 H ATOM 775 N ASN A 87 -9.062 -11.090 -19.767 1.00 18.39 N ATOM 776 CA ASN A 87 -9.332 -9.833 -19.079 1.00 17.63 C ATOM 777 C ASN A 87 -10.044 -8.890 -20.042 1.00 15.82 C ATOM 778 O ASN A 87 -9.580 -8.684 -21.160 1.00 16.79 O ATOM 779 CB ASN A 87 -8.011 -9.210 -18.600 1.00 19.43 C ATOM 780 CG ASN A 87 -8.185 -8.101 -17.551 1.00 23.37 C ATOM 781 OD1 ASN A 87 -7.195 -7.480 -17.164 1.00 30.68 O ATOM 782 ND2 ASN A 87 -9.410 -7.852 -17.075 1.00 24.04 N ATOM 783 HD22 ASN A 87 -10.224 -8.396 -17.425 1.00 0.00 H ATOM 784 HD21 ASN A 87 -9.548 -7.114 -16.355 1.00 0.00 H ATOM 785 H ASN A 87 -8.864 -11.065 -20.788 1.00 0.00 H ATOM 786 N LEU A 88 -11.189 -8.357 -19.625 1.00 15.56 N ATOM 787 CA LEU A 88 -11.899 -7.340 -20.391 1.00 15.89 C ATOM 788 C LEU A 88 -11.858 -6.040 -19.612 1.00 17.21 C ATOM 789 O LEU A 88 -12.436 -5.936 -18.522 1.00 22.33 O ATOM 790 CB LEU A 88 -13.347 -7.767 -20.634 1.00 15.82 C ATOM 791 CG LEU A 88 -14.306 -6.779 -21.313 1.00 17.36 C ATOM 792 CD1 LEU A 88 -13.875 -6.432 -22.728 1.00 18.95 C ATOM 793 CD2 LEU A 88 -15.706 -7.368 -21.335 1.00 18.96 C ATOM 794 H LEU A 88 -11.592 -8.677 -18.721 1.00 0.00 H ATOM 795 N ILE A 89 -11.180 -5.054 -20.182 1.00 14.79 N ATOM 796 CA ILE A 89 -10.953 -3.774 -19.532 1.00 13.84 C ATOM 797 C ILE A 89 -11.711 -2.673 -20.257 1.00 15.15 C ATOM 798 O ILE A 89 -11.390 -2.333 -21.400 1.00 15.24 O ATOM 799 CB ILE A 89 -9.447 -3.424 -19.516 1.00 13.25 C ATOM 800 CG1 ILE A 89 -8.659 -4.573 -18.884 1.00 13.17 C ATOM 801 CG2 ILE A 89 -9.225 -2.121 -18.757 1.00 15.30 C ATOM 802 CD1 ILE A 89 -7.154 -4.415 -18.926 1.00 14.69 C ATOM 803 H ILE A 89 -10.794 -5.203 -21.136 1.00 0.00 H ATOM 804 N LEU A 90 -12.726 -2.134 -19.587 1.00 15.46 N ATOM 805 CA LEU A 90 -13.476 -0.992 -20.091 1.00 14.89 C ATOM 806 C LEU A 90 -12.993 0.293 -19.433 1.00 14.78 C ATOM 807 O LEU A 90 -12.580 0.295 -18.266 1.00 14.86 O ATOM 808 CB LEU A 90 -14.967 -1.188 -19.814 1.00 14.36 C ATOM 809 CG LEU A 90 -15.517 -2.543 -20.266 1.00 13.08 C ATOM 810 CD1 LEU A 90 -17.006 -2.588 -19.994 1.00 11.89 C ATOM 811 CD2 LEU A 90 -15.240 -2.813 -21.735 1.00 16.17 C ATOM 812 H LEU A 90 -12.994 -2.543 -18.669 1.00 0.00 H ATOM 813 N HIS A 91 -13.073 1.392 -20.170 1.00 15.30 N ATOM 814 CA HIS A 91 -12.643 2.682 -19.650 1.00 16.73 C ATOM 815 C HIS A 91 -13.589 3.148 -18.549 1.00 18.28 C ATOM 816 O HIS A 91 -14.794 3.222 -18.764 1.00 20.48 O ATOM 817 CB HIS A 91 -12.574 3.723 -20.765 1.00 16.45 C ATOM 818 CG HIS A 91 -11.645 4.856 -20.460 1.00 16.36 C ATOM 819 ND1 HIS A 91 -11.920 5.796 -19.494 1.00 15.74 N ATOM 820 CD2 HIS A 91 -10.433 5.181 -20.966 1.00 18.22 C ATOM 821 CE1 HIS A 91 -10.930 6.667 -19.431 1.00 16.30 C ATOM 822 NE2 HIS A 91 -10.011 6.313 -20.310 1.00 17.74 N ATOM 823 H HIS A 91 -13.450 1.332 -21.137 1.00 0.00 H ATOM 824 N LYS A 92 -13.032 3.446 -17.376 1.00 22.02 N ATOM 825 CA LYS A 92 -13.806 3.856 -16.193 1.00 22.18 C ATOM 826 C LYS A 92 -14.647 5.102 -16.407 1.00 22.64 C ATOM 827 O LYS A 92 -15.723 5.242 -15.828 1.00 23.42 O ATOM 828 CB LYS A 92 -12.864 4.138 -15.021 1.00 23.82 C ATOM 829 CG LYS A 92 -12.221 2.913 -14.413 1.00 31.54 C ATOM 830 CD LYS A 92 -10.893 3.278 -13.750 1.00 38.04 C ATOM 831 CE LYS A 92 -10.777 2.758 -12.329 1.00 42.89 C ATOM 832 NZ LYS A 92 -10.961 1.286 -12.224 1.00 43.22 N ATOM 833 HZ1 LYS A 92 -11.906 1.030 -12.576 1.00 0.00 H ATOM 834 HZ2 LYS A 92 -10.236 0.806 -12.794 1.00 0.00 H ATOM 835 HZ3 LYS A 92 -10.870 0.997 -11.229 1.00 0.00 H ATOM 836 H LYS A 92 -11.997 3.386 -17.292 1.00 0.00 H ATOM 837 N ASP A 93 -14.132 6.026 -17.207 1.00 21.43 N ATOM 838 CA ASP A 93 -14.844 7.264 -17.525 1.00 23.39 C ATOM 839 C ASP A 93 -15.583 7.223 -18.856 1.00 22.28 C ATOM 840 O ASP A 93 -15.790 8.259 -19.488 1.00 22.13 O ATOM 841 CB ASP A 93 -13.864 8.429 -17.500 1.00 24.05 C ATOM 842 CG ASP A 93 -13.108 8.504 -16.198 1.00 27.34 C ATOM 843 OD1 ASP A 93 -13.751 8.383 -15.134 1.00 29.12 O ATOM 844 OD2 ASP A 93 -11.876 8.673 -16.239 1.00 31.95 O ATOM 845 H ASP A 93 -13.192 5.865 -17.622 1.00 0.00 H ATOM 846 N TYR A 94 -15.996 6.032 -19.277 1.00 21.76 N ATOM 847 CA TYR A 94 -16.854 5.919 -20.441 1.00 18.06 C ATOM 848 C TYR A 94 -18.153 6.642 -20.125 1.00 18.38 C ATOM 849 O TYR A 94 -18.667 6.552 -19.014 1.00 20.92 O ATOM 850 CB TYR A 94 -17.153 4.464 -20.800 1.00 19.13 C ATOM 851 CG TYR A 94 -18.247 4.338 -21.844 1.00 19.18 C ATOM 852 CD1 TYR A 94 -17.959 4.469 -23.201 1.00 18.36 C ATOM 853 CD2 TYR A 94 -19.580 4.116 -21.471 1.00 20.35 C ATOM 854 CE1 TYR A 94 -18.957 4.367 -24.155 1.00 19.53 C ATOM 855 CE2 TYR A 94 -20.583 4.021 -22.418 1.00 20.58 C ATOM 856 CZ TYR A 94 -20.268 4.147 -23.759 1.00 18.79 C ATOM 857 OH TYR A 94 -21.264 4.041 -24.701 1.00 22.76 O ATOM 858 HH TYR A 94 -20.875 4.154 -25.605 1.00 0.00 H ATOM 859 H TYR A 94 -15.702 5.174 -18.768 1.00 0.00 H ATOM 860 N SER A 95 -18.658 7.388 -21.092 1.00 18.19 N ATOM 861 CA SER A 95 -19.995 7.958 -20.976 1.00 18.67 C ATOM 862 C SER A 95 -20.600 8.148 -22.348 1.00 16.90 C ATOM 863 O SER A 95 -19.894 8.159 -23.359 1.00 17.61 O ATOM 864 CB SER A 95 -19.971 9.289 -20.211 1.00 23.33 C ATOM 865 OG SER A 95 -19.448 10.349 -20.998 1.00 25.08 O ATOM 866 HG SER A 95 -19.451 11.185 -20.468 1.00 0.00 H ATOM 867 H SER A 95 -18.094 7.571 -21.947 1.00 0.00 H ATOM 868 N ALA A 96 -21.919 8.296 -22.364 1.00 17.45 N ATOM 869 CA ALA A 96 -22.659 8.512 -23.597 1.00 16.61 C ATOM 870 C ALA A 96 -23.890 9.343 -23.324 1.00 16.64 C ATOM 871 O ALA A 96 -24.481 9.228 -22.255 1.00 20.83 O ATOM 872 CB ALA A 96 -23.086 7.189 -24.205 1.00 17.90 C ATOM 873 H ALA A 96 -22.440 8.256 -21.465 1.00 0.00 H ATOM 874 N ASP A 97 -24.273 10.163 -24.296 1.00 22.37 N ATOM 875 CA ASP A 97 -25.646 10.668 -24.355 1.00 18.47 C ATOM 876 C ASP A 97 -26.398 9.843 -25.416 1.00 16.04 C ATOM 877 O ASP A 97 -26.050 8.689 -25.654 1.00 15.97 O ATOM 878 CB ASP A 97 -25.693 12.194 -24.578 1.00 21.58 C ATOM 879 CG ASP A 97 -25.099 12.637 -25.911 1.00 18.36 C ATOM 880 OD1 ASP A 97 -24.930 11.811 -26.826 1.00 16.66 O ATOM 881 OD2 ASP A 97 -24.810 13.844 -26.045 1.00 20.37 O ATOM 882 H ASP A 97 -23.589 10.450 -25.025 1.00 0.00 H ATOM 883 N THR A 97A -27.421 10.401 -26.054 1.00 18.34 N ATOM 884 CA THR A 97A -28.187 9.615 -27.028 1.00 17.49 C ATOM 885 C THR A 97A -27.470 9.477 -28.374 1.00 17.63 C ATOM 886 O THR A 97A -27.972 8.780 -29.268 1.00 19.40 O ATOM 887 CB THR A 97A -29.592 10.201 -27.284 1.00 18.74 C ATOM 888 OG1 THR A 97A -29.479 11.586 -27.638 1.00 20.35 O ATOM 889 CG2 THR A 97A -30.479 10.038 -26.042 1.00 21.23 C ATOM 890 HG1 THR A 97A -30.382 11.958 -27.801 1.00 0.00 H ATOM 891 H THR A 97A -27.678 11.391 -25.864 1.00 0.00 H ATOM 892 N LEU A 97B -26.300 10.111 -28.503 1.00 16.10 N ATOM 893 CA LEU A 97B -25.559 10.159 -29.755 1.00 12.79 C ATOM 894 C LEU A 97B -24.068 9.840 -29.598 1.00 13.18 C ATOM 895 O LEU A 97B -23.585 8.921 -30.223 1.00 13.49 O ATOM 896 CB LEU A 97B -25.705 11.538 -30.391 1.00 15.76 C ATOM 897 CG LEU A 97B -24.992 11.778 -31.718 1.00 15.21 C ATOM 898 CD1 LEU A 97B -25.449 10.804 -32.792 1.00 13.82 C ATOM 899 CD2 LEU A 97B -25.189 13.220 -32.172 1.00 15.64 C ATOM 900 H LEU A 97B -25.901 10.592 -27.671 1.00 0.00 H ATOM 901 N ALA A 98 -23.373 10.628 -28.780 1.00 15.65 N ATOM 902 CA ALA A 98 -21.911 10.545 -28.668 1.00 15.41 C ATOM 903 C ALA A 98 -21.479 9.592 -27.568 1.00 13.59 C ATOM 904 O ALA A 98 -22.149 9.451 -26.535 1.00 14.64 O ATOM 905 CB ALA A 98 -21.327 11.923 -28.430 1.00 15.40 C ATOM 906 H ALA A 98 -23.883 11.326 -28.201 1.00 0.00 H ATOM 907 N HIS A 99 -20.364 8.917 -27.821 1.00 12.67 N ATOM 908 CA HIS A 99 -19.710 8.059 -26.853 1.00 13.13 C ATOM 909 C HIS A 99 -18.412 8.762 -26.490 1.00 13.78 C ATOM 910 O HIS A 99 -17.698 9.211 -27.372 1.00 17.79 O ATOM 911 CB HIS A 99 -19.380 6.693 -27.457 1.00 13.79 C ATOM 912 CG HIS A 99 -20.548 5.996 -28.088 1.00 14.57 C ATOM 913 ND1 HIS A 99 -21.854 6.230 -27.718 1.00 18.13 N ATOM 914 CD2 HIS A 99 -20.599 5.058 -29.060 1.00 16.34 C ATOM 915 CE1 HIS A 99 -22.658 5.473 -28.440 1.00 18.47 C ATOM 916 NE2 HIS A 99 -21.923 4.755 -29.267 1.00 18.18 N ATOM 917 H HIS A 99 -19.937 9.009 -28.765 1.00 0.00 H ATOM 918 N HIS A 100 -18.119 8.853 -25.196 1.00 14.80 N ATOM 919 CA HIS A 100 -16.883 9.459 -24.700 1.00 14.64 C ATOM 920 C HIS A 100 -15.999 8.392 -24.070 1.00 14.91 C ATOM 921 O HIS A 100 -16.501 7.468 -23.436 1.00 14.81 O ATOM 922 CB HIS A 100 -17.216 10.543 -23.667 1.00 17.14 C ATOM 923 CG HIS A 100 -18.025 11.671 -24.223 1.00 17.34 C ATOM 924 ND1 HIS A 100 -19.400 11.627 -24.296 1.00 20.84 N ATOM 925 CD2 HIS A 100 -17.663 12.866 -24.746 1.00 21.67 C ATOM 926 CE1 HIS A 100 -19.848 12.745 -24.836 1.00 22.75 C ATOM 927 NE2 HIS A 100 -18.816 13.516 -25.118 1.00 21.40 N ATOM 928 H HIS A 100 -18.799 8.476 -24.505 1.00 0.00 H ATOM 929 N ASN A 101 -14.682 8.526 -24.232 1.00 14.52 N ATOM 930 CA ASN A 101 -13.738 7.538 -23.713 1.00 15.13 C ATOM 931 C ASN A 101 -14.095 6.107 -24.156 1.00 12.99 C ATOM 932 O ASN A 101 -14.053 5.149 -23.376 1.00 12.34 O ATOM 933 CB ASN A 101 -13.645 7.655 -22.196 1.00 16.47 C ATOM 934 CG ASN A 101 -13.134 9.014 -21.762 1.00 19.41 C ATOM 935 OD1 ASN A 101 -12.068 9.439 -22.192 1.00 19.43 O ATOM 936 ND2 ASN A 101 -13.892 9.703 -20.924 1.00 21.61 N ATOM 937 HD22 ASN A 101 -14.790 9.302 -20.585 1.00 0.00 H ATOM 938 HD21 ASN A 101 -13.590 10.645 -20.604 1.00 0.00 H ATOM 939 H ASN A 101 -14.317 9.356 -24.741 1.00 0.00 H ATOM 940 N ASP A 102 -14.404 5.989 -25.442 1.00 11.95 N ATOM 941 CA ASP A 102 -14.945 4.772 -26.013 1.00 13.77 C ATOM 942 C ASP A 102 -13.790 3.902 -26.515 1.00 14.99 C ATOM 943 O ASP A 102 -13.444 3.884 -27.697 1.00 14.53 O ATOM 944 CB ASP A 102 -15.927 5.133 -27.128 1.00 14.98 C ATOM 945 CG ASP A 102 -16.808 3.983 -27.534 1.00 12.94 C ATOM 946 OD1 ASP A 102 -16.832 2.956 -26.823 1.00 13.41 O ATOM 947 OD2 ASP A 102 -17.470 4.105 -28.589 1.00 12.28 O ATOM 948 H ASP A 102 -14.251 6.806 -26.067 1.00 0.00 H ATOM 949 N ILE A 103 -13.212 3.174 -25.578 1.00 12.96 N ATOM 950 CA ILE A 103 -11.983 2.427 -25.813 1.00 13.72 C ATOM 951 C ILE A 103 -11.962 1.289 -24.806 1.00 12.56 C ATOM 952 O ILE A 103 -12.374 1.455 -23.644 1.00 11.12 O ATOM 953 CB ILE A 103 -10.745 3.348 -25.706 1.00 13.95 C ATOM 954 CG1 ILE A 103 -9.468 2.610 -26.135 1.00 15.05 C ATOM 955 CG2 ILE A 103 -10.620 3.947 -24.309 1.00 15.07 C ATOM 956 CD1 ILE A 103 -8.292 3.540 -26.352 1.00 15.84 C ATOM 957 H ILE A 103 -13.650 3.132 -24.636 1.00 0.00 H ATOM 958 N ALA A 104 -11.518 0.122 -25.262 1.00 10.80 N ATOM 959 CA ALA A 104 -11.551 -1.072 -24.424 1.00 9.36 C ATOM 960 C ALA A 104 -10.404 -1.979 -24.797 1.00 10.56 C ATOM 961 O ALA A 104 -9.987 -1.999 -25.953 1.00 11.79 O ATOM 962 CB ALA A 104 -12.874 -1.804 -24.597 1.00 7.71 C ATOM 963 H ALA A 104 -11.142 0.059 -26.230 1.00 0.00 H ATOM 964 N LEU A 105 -9.932 -2.749 -23.823 1.00 11.13 N ATOM 965 CA LEU A 105 -8.875 -3.731 -24.039 1.00 13.07 C ATOM 966 C LEU A 105 -9.370 -5.125 -23.659 1.00 12.79 C ATOM 967 O LEU A 105 -10.040 -5.313 -22.637 1.00 14.04 O ATOM 968 CB LEU A 105 -7.609 -3.370 -23.241 1.00 14.95 C ATOM 969 CG LEU A 105 -6.821 -2.139 -23.702 1.00 16.14 C ATOM 970 CD1 LEU A 105 -5.831 -1.656 -22.648 1.00 17.78 C ATOM 971 CD2 LEU A 105 -6.094 -2.401 -25.013 1.00 15.31 C ATOM 972 H LEU A 105 -10.332 -2.648 -22.868 1.00 0.00 H ATOM 973 N LEU A 106 -9.034 -6.083 -24.509 1.00 13.15 N ATOM 974 CA LEU A 106 -9.303 -7.494 -24.303 1.00 12.60 C ATOM 975 C LEU A 106 -7.971 -8.248 -24.292 1.00 13.79 C ATOM 976 O LEU A 106 -7.234 -8.232 -25.277 1.00 14.09 O ATOM 977 CB LEU A 106 -10.199 -8.034 -25.424 1.00 11.35 C ATOM 978 CG LEU A 106 -11.621 -7.463 -25.582 1.00 13.38 C ATOM 979 CD1 LEU A 106 -11.620 -6.151 -26.347 1.00 16.45 C ATOM 980 CD2 LEU A 106 -12.513 -8.465 -26.301 1.00 16.86 C ATOM 981 H LEU A 106 -8.544 -5.805 -25.383 1.00 0.00 H ATOM 982 N LYS A 107 -7.650 -8.881 -23.174 1.00 14.48 N ATOM 983 CA LYS A 107 -6.474 -9.748 -23.122 1.00 14.23 C ATOM 984 C LYS A 107 -6.949 -11.102 -23.594 1.00 16.58 C ATOM 985 O LYS A 107 -7.892 -11.658 -23.016 1.00 15.93 O ATOM 986 CB LYS A 107 -5.902 -9.864 -21.712 1.00 15.73 C ATOM 987 CG LYS A 107 -4.569 -10.600 -21.671 1.00 16.80 C ATOM 988 CD LYS A 107 -3.937 -10.557 -20.289 1.00 19.14 C ATOM 989 CE LYS A 107 -2.596 -11.274 -20.314 1.00 23.03 C ATOM 990 NZ LYS A 107 -1.910 -11.217 -18.999 1.00 28.80 N ATOM 991 HZ1 LYS A 107 -1.743 -10.224 -18.739 1.00 0.00 H ATOM 992 HZ2 LYS A 107 -2.507 -11.669 -18.278 1.00 0.00 H ATOM 993 HZ3 LYS A 107 -1.001 -11.718 -19.062 1.00 0.00 H ATOM 994 H LYS A 107 -8.239 -8.760 -22.326 1.00 0.00 H ATOM 995 N ILE A 108 -6.299 -11.617 -24.636 1.00 16.10 N ATOM 996 CA ILE A 108 -6.733 -12.846 -25.304 1.00 15.62 C ATOM 997 C ILE A 108 -5.845 -14.034 -24.933 1.00 14.24 C ATOM 998 O ILE A 108 -4.634 -13.883 -24.702 1.00 16.44 O ATOM 999 CB ILE A 108 -6.804 -12.682 -26.842 1.00 14.87 C ATOM 1000 CG1 ILE A 108 -5.468 -12.188 -27.426 1.00 16.03 C ATOM 1001 CG2 ILE A 108 -7.924 -11.716 -27.203 1.00 14.52 C ATOM 1002 CD1 ILE A 108 -5.334 -12.342 -28.929 1.00 17.35 C ATOM 1003 H ILE A 108 -5.451 -11.128 -24.989 1.00 0.00 H ATOM 1004 N ARG A 109 -6.467 -15.206 -24.889 1.00 16.43 N ATOM 1005 CA ARG A 109 -5.820 -16.428 -24.455 1.00 19.45 C ATOM 1006 C ARG A 109 -6.394 -17.607 -25.224 1.00 17.40 C ATOM 1007 O ARG A 109 -7.613 -17.803 -25.250 1.00 17.85 O ATOM 1008 CB ARG A 109 -6.057 -16.608 -22.955 1.00 22.24 C ATOM 1009 CG ARG A 109 -5.351 -17.780 -22.310 1.00 26.13 C ATOM 1010 CD ARG A 109 -5.883 -17.970 -20.901 1.00 30.11 C ATOM 1011 NE ARG A 109 -5.140 -18.977 -20.158 1.00 38.60 N ATOM 1012 CZ ARG A 109 -3.991 -18.761 -19.521 1.00 45.50 C ATOM 1013 NH1 ARG A 109 -3.417 -17.559 -19.527 1.00 54.72 N ATOM 1014 NH2 ARG A 109 -3.409 -19.761 -18.872 1.00 49.27 N ATOM 1015 HE ARG A 109 -5.536 -19.938 -20.122 1.00 0.00 H ATOM 1016 HH12 ARG A 109 -2.519 -17.409 -19.024 1.00 0.00 H ATOM 1017 HH11 ARG A 109 -3.867 -16.771 -20.035 1.00 0.00 H ATOM 1018 HH22 ARG A 109 -2.511 -19.603 -18.371 1.00 0.00 H ATOM 1019 HH21 ARG A 109 -3.850 -20.703 -18.864 1.00 0.00 H ATOM 1020 H ARG A 109 -7.465 -15.249 -25.179 1.00 0.00 H ATOM 1021 N SER A 110 -5.518 -18.399 -25.841 1.00 19.57 N ATOM 1022 CA SER A 110 -5.945 -19.586 -26.577 1.00 25.26 C ATOM 1023 C SER A 110 -6.392 -20.669 -25.603 1.00 21.74 C ATOM 1024 O SER A 110 -6.102 -20.595 -24.414 1.00 19.74 O ATOM 1025 CB SER A 110 -4.826 -20.111 -27.486 1.00 26.76 C ATOM 1026 OG SER A 110 -3.750 -20.654 -26.735 1.00 28.41 O ATOM 1027 HG SER A 110 -3.050 -20.981 -27.353 1.00 0.00 H ATOM 1028 H SER A 110 -4.505 -18.166 -25.797 1.00 0.00 H ATOM 1029 N LYS A 110A -7.127 -21.652 -26.116 1.00 23.26 N ATOM 1030 CA LYS A 110A -7.473 -22.869 -25.365 1.00 24.67 C ATOM 1031 C LYS A 110A -6.227 -23.455 -24.687 1.00 24.38 C ATOM 1032 O LYS A 110A -6.287 -23.963 -23.565 1.00 30.23 O ATOM 1033 CB LYS A 110A -8.052 -23.910 -26.331 1.00 31.12 C ATOM 1034 CG LYS A 110A -8.983 -24.932 -25.704 1.00 37.20 C ATOM 1035 CD LYS A 110A -9.221 -26.119 -26.632 1.00 44.84 C ATOM 1036 CE LYS A 110A -9.980 -25.746 -27.901 1.00 52.06 C ATOM 1037 NZ LYS A 110A -11.454 -25.671 -27.691 1.00 60.05 N ATOM 1038 HZ1 LYS A 110A -11.805 -26.596 -27.370 1.00 0.00 H ATOM 1039 HZ2 LYS A 110A -11.664 -24.951 -26.971 1.00 0.00 H ATOM 1040 HZ3 LYS A 110A -11.918 -25.414 -28.586 1.00 0.00 H ATOM 1041 H LYS A 110A -7.473 -21.556 -27.092 1.00 0.00 H ATOM 1042 N GLU A 110B -5.103 -23.363 -25.395 1.00 19.83 N ATOM 1043 CA GLU A 110B -3.807 -23.901 -24.955 1.00 24.13 C ATOM 1044 C GLU A 110B -3.002 -22.953 -24.045 1.00 23.75 C ATOM 1045 O GLU A 110B -1.875 -23.264 -23.673 1.00 27.86 O ATOM 1046 CB GLU A 110B -2.953 -24.263 -26.179 1.00 29.61 C ATOM 1047 CG GLU A 110B -3.506 -25.400 -27.035 1.00 31.94 C ATOM 1048 CD GLU A 110B -4.634 -24.987 -27.973 1.00 33.71 C ATOM 1049 OE1 GLU A 110B -4.942 -23.775 -28.086 1.00 33.98 O ATOM 1050 OE2 GLU A 110B -5.221 -25.892 -28.605 1.00 43.02 O ATOM 1051 H GLU A 110B -5.144 -22.881 -26.316 1.00 0.00 H ATOM 1052 N GLY A 110C -3.564 -21.798 -23.711 1.00 23.68 N ATOM 1053 CA GLY A 110C -2.954 -20.885 -22.748 1.00 21.52 C ATOM 1054 C GLY A 110C -1.989 -19.891 -23.359 1.00 21.36 C ATOM 1055 O GLY A 110C -1.230 -19.240 -22.639 1.00 26.29 O ATOM 1056 H GLY A 110C -4.469 -21.534 -24.150 1.00 0.00 H ATOM 1057 N ARG A 110D -2.017 -19.764 -24.683 1.00 21.03 N ATOM 1058 CA ARG A 110D -1.073 -18.910 -25.389 1.00 20.63 C ATOM 1059 C ARG A 110D -1.718 -17.668 -25.991 1.00 18.47 C ATOM 1060 O ARG A 110D -2.940 -17.596 -26.210 1.00 19.41 O ATOM 1061 CB ARG A 110D -0.365 -19.677 -26.516 1.00 21.94 C ATOM 1062 CG ARG A 110D 0.196 -21.041 -26.150 1.00 24.86 C ATOM 1063 CD ARG A 110D 0.929 -21.102 -24.817 1.00 29.57 C ATOM 1064 NE ARG A 110D 2.026 -20.142 -24.683 1.00 36.28 N ATOM 1065 CZ ARG A 110D 3.122 -20.339 -23.947 1.00 41.32 C ATOM 1066 NH1 ARG A 110D 3.305 -21.477 -23.279 1.00 38.11 N ATOM 1067 NH2 ARG A 110D 4.056 -19.396 -23.889 1.00 48.93 N ATOM 1068 HE ARG A 110D 1.946 -19.242 -25.198 1.00 0.00 H ATOM 1069 HH12 ARG A 110D 4.165 -21.614 -22.710 1.00 0.00 H ATOM 1070 HH11 ARG A 110D 2.588 -22.229 -23.326 1.00 0.00 H ATOM 1071 HH22 ARG A 110D 4.911 -19.546 -23.317 1.00 0.00 H ATOM 1072 HH21 ARG A 110D 3.932 -18.508 -24.416 1.00 0.00 H ATOM 1073 H ARG A 110D -2.731 -20.288 -25.227 1.00 0.00 H ATOM 1074 N CYS A 111 -0.861 -16.693 -26.257 1.00 19.94 N ATOM 1075 CA CYS A 111 -1.231 -15.476 -26.958 1.00 21.58 C ATOM 1076 C CYS A 111 -1.160 -15.754 -28.460 1.00 16.64 C ATOM 1077 O CYS A 111 -0.919 -16.883 -28.863 1.00 17.77 O ATOM 1078 CB CYS A 111 -0.302 -14.335 -26.522 1.00 23.66 C ATOM 1079 SG CYS A 111 -0.583 -13.912 -24.784 1.00 29.93 S ATOM 1080 H CYS A 111 0.126 -16.805 -25.948 1.00 0.00 H ATOM 1081 N ALA A 112 -1.393 -14.740 -29.285 1.00 15.53 N ATOM 1082 CA ALA A 112 -1.391 -14.927 -30.735 1.00 15.46 C ATOM 1083 C ALA A 112 0.002 -15.246 -31.250 1.00 17.19 C ATOM 1084 O ALA A 112 0.998 -14.744 -30.729 1.00 18.17 O ATOM 1085 CB ALA A 112 -1.936 -13.695 -31.436 1.00 18.17 C ATOM 1086 H ALA A 112 -1.580 -13.795 -28.892 1.00 0.00 H ATOM 1087 N GLN A 113 0.048 -16.101 -32.265 1.00 17.57 N ATOM 1088 CA GLN A 113 1.256 -16.366 -33.010 1.00 20.00 C ATOM 1089 C GLN A 113 1.153 -15.609 -34.331 1.00 19.81 C ATOM 1090 O GLN A 113 0.308 -15.939 -35.162 1.00 17.33 O ATOM 1091 CB GLN A 113 1.392 -17.865 -33.260 1.00 22.35 C ATOM 1092 CG GLN A 113 2.580 -18.211 -34.136 1.00 25.30 C ATOM 1093 CD GLN A 113 2.827 -19.697 -34.254 1.00 28.14 C ATOM 1094 OE1 GLN A 113 2.622 -20.452 -33.311 1.00 28.46 O ATOM 1095 NE2 GLN A 113 3.291 -20.123 -35.417 1.00 34.64 N ATOM 1096 HE22 GLN A 113 3.451 -19.448 -36.192 1.00 0.00 H ATOM 1097 HE21 GLN A 113 3.496 -21.133 -35.557 1.00 0.00 H ATOM 1098 H GLN A 113 -0.823 -16.601 -32.535 1.00 0.00 H ATOM 1099 N PRO A 114 2.001 -14.587 -34.534 1.00 19.34 N ATOM 1100 CA PRO A 114 1.935 -13.887 -35.809 1.00 19.78 C ATOM 1101 C PRO A 114 2.168 -14.788 -37.023 1.00 18.30 C ATOM 1102 O PRO A 114 2.935 -15.764 -36.957 1.00 19.62 O ATOM 1103 CB PRO A 114 3.043 -12.839 -35.695 1.00 20.54 C ATOM 1104 CG PRO A 114 3.152 -12.580 -34.234 1.00 24.06 C ATOM 1105 CD PRO A 114 2.918 -13.915 -33.592 1.00 21.81 C ATOM 1106 N SER A 115 1.497 -14.440 -38.115 1.00 16.75 N ATOM 1107 CA SER A 115 1.555 -15.183 -39.365 1.00 19.22 C ATOM 1108 C SER A 115 1.289 -14.206 -40.503 1.00 16.37 C ATOM 1109 O SER A 115 1.146 -13.015 -40.266 1.00 18.93 O ATOM 1110 CB SER A 115 0.505 -16.294 -39.363 1.00 16.81 C ATOM 1111 OG SER A 115 -0.815 -15.760 -39.422 1.00 19.14 O ATOM 1112 HG SER A 115 -1.470 -16.502 -39.419 1.00 0.00 H ATOM 1113 H SER A 115 0.898 -13.591 -38.075 1.00 0.00 H ATOM 1114 N ARG A 116 1.198 -14.701 -41.733 1.00 19.49 N ATOM 1115 CA ARG A 116 0.809 -13.859 -42.860 1.00 21.73 C ATOM 1116 C ARG A 116 -0.527 -13.143 -42.614 1.00 19.57 C ATOM 1117 O ARG A 116 -0.700 -11.986 -43.018 1.00 22.83 O ATOM 1118 CB ARG A 116 0.721 -14.689 -44.147 1.00 27.00 C ATOM 1119 CG ARG A 116 0.228 -13.926 -45.367 1.00 32.05 C ATOM 1120 CD ARG A 116 1.115 -12.732 -45.664 1.00 36.20 C ATOM 1121 NE ARG A 116 0.541 -11.849 -46.670 1.00 38.31 N ATOM 1122 CZ ARG A 116 -0.303 -10.849 -46.427 1.00 31.14 C ATOM 1123 NH1 ARG A 116 -0.746 -10.122 -47.442 1.00 36.00 N ATOM 1124 NH2 ARG A 116 -0.710 -10.570 -45.188 1.00 33.91 N ATOM 1125 HE ARG A 116 0.813 -12.013 -47.660 1.00 0.00 H ATOM 1126 HH12 ARG A 116 -1.406 -9.337 -47.270 1.00 0.00 H ATOM 1127 HH11 ARG A 116 -0.434 -10.336 -48.411 1.00 0.00 H ATOM 1128 HH22 ARG A 116 -1.370 -9.784 -45.022 1.00 0.00 H ATOM 1129 HH21 ARG A 116 -0.367 -11.139 -44.388 1.00 0.00 H ATOM 1130 H ARG A 116 1.408 -15.707 -41.895 1.00 0.00 H ATOM 1131 N THR A 117 -1.454 -13.831 -41.944 1.00 15.97 N ATOM 1132 CA THR A 117 -2.824 -13.351 -41.752 1.00 14.88 C ATOM 1133 C THR A 117 -3.131 -12.835 -40.336 1.00 13.12 C ATOM 1134 O THR A 117 -4.248 -12.362 -40.076 1.00 15.88 O ATOM 1135 CB THR A 117 -3.841 -14.464 -42.096 1.00 16.90 C ATOM 1136 OG1 THR A 117 -3.628 -15.601 -41.247 1.00 18.83 O ATOM 1137 CG2 THR A 117 -3.711 -14.884 -43.555 1.00 17.16 C ATOM 1138 HG1 THR A 117 -4.283 -16.308 -41.474 1.00 0.00 H ATOM 1139 H THR A 117 -1.191 -14.752 -41.539 1.00 0.00 H ATOM 1140 N ILE A 118 -2.143 -12.906 -39.445 1.00 14.12 N ATOM 1141 CA ILE A 118 -2.265 -12.443 -38.062 1.00 14.41 C ATOM 1142 C ILE A 118 -1.036 -11.613 -37.714 1.00 13.74 C ATOM 1143 O ILE A 118 0.065 -12.153 -37.590 1.00 13.12 O ATOM 1144 CB ILE A 118 -2.410 -13.615 -37.074 1.00 15.07 C ATOM 1145 CG1 ILE A 118 -3.687 -14.418 -37.386 1.00 16.41 C ATOM 1146 CG2 ILE A 118 -2.449 -13.105 -35.630 1.00 14.55 C ATOM 1147 CD1 ILE A 118 -3.872 -15.656 -36.530 1.00 16.78 C ATOM 1148 H ILE A 118 -1.235 -13.313 -39.749 1.00 0.00 H ATOM 1149 N GLN A 119 -1.231 -10.303 -37.594 1.00 15.15 N ATOM 1150 CA GLN A 119 -0.149 -9.362 -37.339 1.00 14.77 C ATOM 1151 C GLN A 119 -0.639 -8.224 -36.457 1.00 14.62 C ATOM 1152 O GLN A 119 -1.812 -7.841 -36.502 1.00 14.49 O ATOM 1153 CB GLN A 119 0.395 -8.802 -38.655 1.00 16.27 C ATOM 1154 CG GLN A 119 1.143 -9.834 -39.494 1.00 19.13 C ATOM 1155 CD GLN A 119 1.490 -9.356 -40.893 1.00 21.59 C ATOM 1156 OE1 GLN A 119 1.400 -10.116 -41.859 1.00 25.02 O ATOM 1157 NE2 GLN A 119 1.882 -8.104 -41.014 1.00 24.49 N ATOM 1158 HE22 GLN A 119 1.945 -7.495 -40.173 1.00 0.00 H ATOM 1159 HE21 GLN A 119 2.129 -7.725 -41.950 1.00 0.00 H ATOM 1160 H GLN A 119 -2.199 -9.934 -37.686 1.00 0.00 H ATOM 1161 N THR A 120 0.261 -7.691 -35.642 1.00 18.63 N ATOM 1162 CA THR A 120 -0.053 -6.531 -34.826 1.00 17.78 C ATOM 1163 C THR A 120 -0.009 -5.284 -35.704 1.00 16.46 C ATOM 1164 O THR A 120 0.639 -5.278 -36.758 1.00 19.21 O ATOM 1165 CB THR A 120 0.941 -6.373 -33.663 1.00 16.37 C ATOM 1166 OG1 THR A 120 2.260 -6.183 -34.190 1.00 16.38 O ATOM 1167 CG2 THR A 120 0.913 -7.601 -32.755 1.00 17.69 C ATOM 1168 HG1 THR A 120 2.512 -6.968 -34.737 1.00 0.00 H ATOM 1169 H THR A 120 1.210 -8.112 -35.586 1.00 0.00 H ATOM 1170 N ILE A 121 -0.711 -4.243 -35.270 1.00 14.25 N ATOM 1171 CA ILE A 121 -0.677 -2.932 -35.918 1.00 14.95 C ATOM 1172 C ILE A 121 -0.014 -1.959 -34.955 1.00 13.26 C ATOM 1173 O ILE A 121 -0.254 -2.023 -33.758 1.00 13.50 O ATOM 1174 CB ILE A 121 -2.090 -2.417 -36.310 1.00 15.59 C ATOM 1175 CG1 ILE A 121 -1.971 -1.053 -37.010 1.00 18.00 C ATOM 1176 CG2 ILE A 121 -3.010 -2.334 -35.099 1.00 16.61 C ATOM 1177 CD1 ILE A 121 -3.224 -0.568 -37.697 1.00 18.89 C ATOM 1178 H ILE A 121 -1.313 -4.366 -34.431 1.00 0.00 H ATOM 1179 N ALA A 122 0.843 -1.082 -35.476 1.00 13.14 N ATOM 1180 CA ALA A 122 1.556 -0.116 -34.640 1.00 14.62 C ATOM 1181 C ALA A 122 0.644 0.941 -34.026 1.00 15.36 C ATOM 1182 O ALA A 122 -0.281 1.438 -34.672 1.00 17.59 O ATOM 1183 CB ALA A 122 2.665 0.556 -35.444 1.00 14.64 C ATOM 1184 H ALA A 122 1.009 -1.084 -36.503 1.00 0.00 H ATOM 1185 N LEU A 123 0.902 1.268 -32.764 1.00 17.26 N ATOM 1186 CA LEU A 123 0.182 2.333 -32.086 1.00 20.09 C ATOM 1187 C LEU A 123 0.719 3.676 -32.559 1.00 17.56 C ATOM 1188 O LEU A 123 1.895 3.778 -32.920 1.00 18.28 O ATOM 1189 CB LEU A 123 0.346 2.227 -30.571 1.00 21.35 C ATOM 1190 CG LEU A 123 -0.329 1.039 -29.891 1.00 20.19 C ATOM 1191 CD1 LEU A 123 0.091 0.957 -28.432 1.00 24.53 C ATOM 1192 CD2 LEU A 123 -1.842 1.141 -30.011 1.00 17.93 C ATOM 1193 H LEU A 123 1.639 0.747 -32.247 1.00 0.00 H ATOM 1194 N PRO A 124 -0.128 4.713 -32.521 1.00 16.29 N ATOM 1195 CA PRO A 124 0.270 6.031 -32.958 1.00 18.48 C ATOM 1196 C PRO A 124 1.090 6.727 -31.887 1.00 20.60 C ATOM 1197 O PRO A 124 1.308 6.177 -30.806 1.00 19.10 O ATOM 1198 CB PRO A 124 -1.069 6.735 -33.157 1.00 18.18 C ATOM 1199 CG PRO A 124 -1.941 6.145 -32.101 1.00 17.92 C ATOM 1200 CD PRO A 124 -1.490 4.717 -31.948 1.00 14.83 C ATOM 1201 N SER A 125 1.556 7.923 -32.215 1.00 22.09 N ATOM 1202 CA SER A 125 2.253 8.781 -31.277 1.00 22.19 C ATOM 1203 C SER A 125 1.552 10.128 -31.225 1.00 21.51 C ATOM 1204 O SER A 125 1.105 10.658 -32.248 1.00 22.52 O ATOM 1205 CB SER A 125 3.705 8.979 -31.704 1.00 24.33 C ATOM 1206 OG SER A 125 4.201 10.196 -31.185 1.00 26.57 O ATOM 1207 HG SER A 125 4.152 10.176 -30.196 1.00 0.00 H ATOM 1208 H SER A 125 1.416 8.261 -33.188 1.00 0.00 H ATOM 1209 N MET A 126 1.476 10.696 -30.029 1.00 22.40 N ATOM 1210 CA MET A 126 0.821 11.989 -29.853 1.00 24.12 C ATOM 1211 C MET A 126 1.615 13.136 -30.492 1.00 20.39 C ATOM 1212 O MET A 126 1.131 14.257 -30.553 1.00 26.94 O ATOM 1213 CB MET A 126 0.546 12.264 -28.371 1.00 26.24 C ATOM 1214 CG MET A 126 1.770 12.422 -27.482 1.00 27.56 C ATOM 1215 SD MET A 126 1.256 12.814 -25.800 1.00 42.50 S ATOM 1216 CE MET A 126 2.498 11.926 -24.863 1.00 46.68 C ATOM 1217 H MET A 126 1.889 10.214 -29.205 1.00 0.00 H ATOM 1218 N TYR A 127 2.825 12.849 -30.969 1.00 16.16 N ATOM 1219 CA TYR A 127 3.648 13.833 -31.678 1.00 16.63 C ATOM 1220 C TYR A 127 3.545 13.722 -33.191 1.00 20.23 C ATOM 1221 O TYR A 127 4.098 14.554 -33.909 1.00 24.48 O ATOM 1222 CB TYR A 127 5.117 13.634 -31.302 1.00 15.30 C ATOM 1223 CG TYR A 127 5.373 13.799 -29.839 1.00 18.98 C ATOM 1224 CD1 TYR A 127 5.546 15.059 -29.293 1.00 20.65 C ATOM 1225 CD2 TYR A 127 5.423 12.700 -28.996 1.00 17.96 C ATOM 1226 CE1 TYR A 127 5.762 15.225 -27.943 1.00 24.73 C ATOM 1227 CE2 TYR A 127 5.641 12.852 -27.641 1.00 20.49 C ATOM 1228 CZ TYR A 127 5.809 14.116 -27.122 1.00 24.92 C ATOM 1229 OH TYR A 127 6.024 14.269 -25.777 1.00 38.18 O ATOM 1230 HH TYR A 127 6.124 15.231 -25.567 1.00 0.00 H ATOM 1231 H TYR A 127 3.201 11.889 -30.833 1.00 0.00 H ATOM 1232 N ASN A 128 2.852 12.694 -33.669 1.00 19.72 N ATOM 1233 CA ASN A 128 2.879 12.339 -35.079 1.00 24.62 C ATOM 1234 C ASN A 128 1.458 12.176 -35.616 1.00 26.44 C ATOM 1235 O ASN A 128 1.082 11.122 -36.124 1.00 25.46 O ATOM 1236 CB ASN A 128 3.703 11.053 -35.235 1.00 29.60 C ATOM 1237 CG ASN A 128 3.971 10.682 -36.680 1.00 27.76 C ATOM 1238 OD1 ASN A 128 4.142 11.534 -37.547 1.00 28.49 O ATOM 1239 ND2 ASN A 128 4.000 9.390 -36.942 1.00 27.25 N ATOM 1240 HD22 ASN A 128 3.850 8.701 -36.178 1.00 0.00 H ATOM 1241 HD21 ASN A 128 4.173 9.060 -37.913 1.00 0.00 H ATOM 1242 H ASN A 128 2.274 12.127 -33.016 1.00 0.00 H ATOM 1243 N ASP A 129 0.665 13.236 -35.487 1.00 27.41 N ATOM 1244 CA ASP A 129 -0.707 13.232 -35.984 1.00 24.84 C ATOM 1245 C ASP A 129 -0.713 13.324 -37.508 1.00 27.02 C ATOM 1246 O ASP A 129 0.082 14.072 -38.088 1.00 29.57 O ATOM 1247 CB ASP A 129 -1.505 14.408 -35.401 1.00 35.07 C ATOM 1248 CG ASP A 129 -1.845 14.222 -33.929 1.00 42.21 C ATOM 1249 OD1 ASP A 129 -1.833 13.067 -33.436 1.00 47.80 O ATOM 1250 OD2 ASP A 129 -2.149 15.239 -33.265 1.00 53.36 O ATOM 1251 H ASP A 129 1.032 14.090 -35.020 1.00 0.00 H ATOM 1252 N PRO A 130 -1.587 12.541 -38.165 1.00 24.29 N ATOM 1253 CA PRO A 130 -1.818 12.778 -39.585 1.00 24.16 C ATOM 1254 C PRO A 130 -2.656 14.044 -39.741 1.00 25.90 C ATOM 1255 O PRO A 130 -3.519 14.309 -38.906 1.00 29.38 O ATOM 1256 CB PRO A 130 -2.589 11.534 -40.037 1.00 23.26 C ATOM 1257 CG PRO A 130 -3.245 11.017 -38.806 1.00 22.82 C ATOM 1258 CD PRO A 130 -2.413 11.443 -37.632 1.00 21.84 C ATOM 1259 N GLN A 131 -2.391 14.828 -40.779 1.00 28.85 N ATOM 1260 CA GLN A 131 -3.108 16.097 -40.980 1.00 28.69 C ATOM 1261 C GLN A 131 -4.506 15.865 -41.539 1.00 26.69 C ATOM 1262 O GLN A 131 -4.763 14.829 -42.154 1.00 23.99 O ATOM 1263 CB GLN A 131 -2.318 17.023 -41.907 1.00 35.41 C ATOM 1264 CG GLN A 131 -2.136 16.506 -43.323 1.00 38.38 C ATOM 1265 CD GLN A 131 -1.306 17.442 -44.174 1.00 38.82 C ATOM 1266 OE1 GLN A 131 -1.797 17.998 -45.159 1.00 41.66 O ATOM 1267 NE2 GLN A 131 -0.040 17.634 -43.792 1.00 40.62 N ATOM 1268 HE22 GLN A 131 0.330 17.143 -42.954 1.00 0.00 H ATOM 1269 HE21 GLN A 131 0.575 18.275 -44.333 1.00 0.00 H ATOM 1270 H GLN A 131 -1.663 14.540 -41.463 1.00 0.00 H ATOM 1271 N PHE A 132 -5.406 16.831 -41.332 1.00 28.07 N ATOM 1272 CA PHE A 132 -6.756 16.734 -41.888 1.00 26.08 C ATOM 1273 C PHE A 132 -6.661 16.616 -43.409 1.00 24.27 C ATOM 1274 O PHE A 132 -5.725 17.137 -44.022 1.00 26.89 O ATOM 1275 CB PHE A 132 -7.657 17.906 -41.454 1.00 26.30 C ATOM 1276 CG PHE A 132 -7.234 19.255 -41.985 1.00 30.52 C ATOM 1277 CD1 PHE A 132 -7.573 19.655 -43.277 1.00 31.16 C ATOM 1278 CD2 PHE A 132 -6.528 20.143 -41.178 1.00 29.91 C ATOM 1279 CE1 PHE A 132 -7.190 20.901 -43.759 1.00 32.52 C ATOM 1280 CE2 PHE A 132 -6.145 21.391 -41.654 1.00 25.84 C ATOM 1281 CZ PHE A 132 -6.478 21.770 -42.947 1.00 30.29 C ATOM 1282 H PHE A 132 -5.143 17.664 -40.767 1.00 0.00 H ATOM 1283 N GLY A 133 -7.600 15.887 -44.005 1.00 20.61 N ATOM 1284 CA GLY A 133 -7.594 15.642 -45.446 1.00 22.21 C ATOM 1285 C GLY A 133 -6.866 14.369 -45.858 1.00 20.57 C ATOM 1286 O GLY A 133 -6.966 13.950 -47.013 1.00 22.33 O ATOM 1287 H GLY A 133 -8.363 15.478 -43.428 1.00 0.00 H ATOM 1288 N THR A 134 -6.131 13.763 -44.921 1.00 23.03 N ATOM 1289 CA THR A 134 -5.455 12.478 -45.141 1.00 22.45 C ATOM 1290 C THR A 134 -6.494 11.394 -45.394 1.00 20.57 C ATOM 1291 O THR A 134 -7.562 11.417 -44.795 1.00 22.73 O ATOM 1292 CB THR A 134 -4.658 12.032 -43.890 1.00 24.69 C ATOM 1293 OG1 THR A 134 -3.852 13.108 -43.416 1.00 26.94 O ATOM 1294 CG2 THR A 134 -3.760 10.824 -44.194 1.00 25.40 C ATOM 1295 HG1 THR A 134 -4.433 13.873 -43.177 1.00 0.00 H ATOM 1296 H THR A 134 -6.033 14.223 -43.993 1.00 0.00 H ATOM 1297 N SER A 135 -6.169 10.442 -46.264 1.00 19.72 N ATOM 1298 CA SER A 135 -7.046 9.293 -46.512 1.00 18.50 C ATOM 1299 C SER A 135 -6.634 8.131 -45.618 1.00 18.06 C ATOM 1300 O SER A 135 -5.446 7.788 -45.539 1.00 20.78 O ATOM 1301 CB SER A 135 -6.986 8.872 -47.976 1.00 22.85 C ATOM 1302 OG SER A 135 -7.491 9.891 -48.814 1.00 26.75 O ATOM 1303 HG SER A 135 -7.442 9.595 -49.758 1.00 0.00 H ATOM 1304 H SER A 135 -5.270 10.514 -46.782 1.00 0.00 H ATOM 1305 N CYS A 136 -7.610 7.527 -44.942 1.00 18.52 N ATOM 1306 CA CYS A 136 -7.358 6.389 -44.061 1.00 17.82 C ATOM 1307 C CYS A 136 -8.323 5.251 -44.383 1.00 15.44 C ATOM 1308 O CYS A 136 -9.334 5.470 -45.028 1.00 15.80 O ATOM 1309 CB CYS A 136 -7.448 6.834 -42.600 1.00 20.24 C ATOM 1310 SG CYS A 136 -6.324 8.218 -42.250 1.00 27.40 S ATOM 1311 H CYS A 136 -8.584 7.877 -45.045 1.00 0.00 H ATOM 1312 N GLU A 137 -7.971 4.035 -43.975 1.00 15.76 N ATOM 1313 CA GLU A 137 -8.775 2.851 -44.250 1.00 15.66 C ATOM 1314 C GLU A 137 -9.590 2.476 -43.020 1.00 13.00 C ATOM 1315 O GLU A 137 -9.082 2.542 -41.900 1.00 14.32 O ATOM 1316 CB GLU A 137 -7.891 1.652 -44.620 1.00 22.10 C ATOM 1317 CG GLU A 137 -6.898 1.876 -45.759 1.00 28.69 C ATOM 1318 CD GLU A 137 -6.026 0.653 -46.013 1.00 33.58 C ATOM 1319 OE1 GLU A 137 -5.493 0.509 -47.143 1.00 41.07 O ATOM 1320 OE2 GLU A 137 -5.869 -0.174 -45.082 1.00 36.33 O ATOM 1321 H GLU A 137 -7.087 3.925 -43.438 1.00 0.00 H ATOM 1322 N ILE A 138 -10.851 2.093 -43.236 1.00 11.44 N ATOM 1323 CA ILE A 138 -11.689 1.492 -42.193 1.00 10.52 C ATOM 1324 C ILE A 138 -12.129 0.101 -42.635 1.00 10.89 C ATOM 1325 O ILE A 138 -12.343 -0.135 -43.818 1.00 11.91 O ATOM 1326 CB ILE A 138 -12.906 2.380 -41.823 1.00 10.56 C ATOM 1327 CG1 ILE A 138 -13.730 2.722 -43.058 1.00 9.28 C ATOM 1328 CG2 ILE A 138 -12.419 3.657 -41.157 1.00 10.30 C ATOM 1329 CD1 ILE A 138 -15.006 3.482 -42.766 1.00 9.15 C ATOM 1330 H ILE A 138 -11.256 2.227 -44.184 1.00 0.00 H ATOM 1331 N THR A 139 -12.213 -0.822 -41.683 1.00 10.98 N ATOM 1332 CA THR A 139 -12.516 -2.222 -41.966 1.00 12.07 C ATOM 1333 C THR A 139 -13.542 -2.778 -40.986 1.00 12.35 C ATOM 1334 O THR A 139 -13.529 -2.437 -39.801 1.00 12.50 O ATOM 1335 CB THR A 139 -11.248 -3.078 -41.857 1.00 13.08 C ATOM 1336 OG1 THR A 139 -10.266 -2.587 -42.784 1.00 16.96 O ATOM 1337 CG2 THR A 139 -11.541 -4.547 -42.148 1.00 14.76 C ATOM 1338 HG1 THR A 139 -10.052 -1.645 -42.568 1.00 0.00 H ATOM 1339 H THR A 139 -12.056 -0.535 -40.696 1.00 0.00 H ATOM 1340 N GLY A 140 -14.403 -3.672 -41.458 1.00 12.24 N ATOM 1341 CA GLY A 140 -15.332 -4.331 -40.547 1.00 11.87 C ATOM 1342 C GLY A 140 -16.426 -5.158 -41.195 1.00 11.85 C ATOM 1343 O GLY A 140 -16.575 -5.189 -42.413 1.00 11.98 O ATOM 1344 H GLY A 140 -14.415 -3.901 -42.472 1.00 0.00 H ATOM 1345 N PHE A 141 -17.166 -5.853 -40.339 1.00 10.41 N ATOM 1346 CA PHE A 141 -18.265 -6.714 -40.746 1.00 9.72 C ATOM 1347 C PHE A 141 -19.603 -6.001 -40.591 1.00 10.06 C ATOM 1348 O PHE A 141 -20.647 -6.650 -40.591 1.00 13.08 O ATOM 1349 CB PHE A 141 -18.318 -7.958 -39.861 1.00 11.43 C ATOM 1350 CG PHE A 141 -17.357 -9.040 -40.239 1.00 11.26 C ATOM 1351 CD1 PHE A 141 -17.516 -9.761 -41.412 1.00 11.71 C ATOM 1352 CD2 PHE A 141 -16.320 -9.377 -39.381 1.00 12.18 C ATOM 1353 CE1 PHE A 141 -16.642 -10.786 -41.730 1.00 11.49 C ATOM 1354 CE2 PHE A 141 -15.453 -10.401 -39.691 1.00 13.04 C ATOM 1355 CZ PHE A 141 -15.616 -11.105 -40.866 1.00 14.11 C ATOM 1356 H PHE A 141 -16.948 -5.778 -39.325 1.00 0.00 H ATOM 1357 N GLY A 142 -19.588 -4.682 -40.430 1.00 9.79 N ATOM 1358 CA GLY A 142 -20.830 -3.938 -40.176 1.00 7.94 C ATOM 1359 C GLY A 142 -21.787 -3.911 -41.351 1.00 8.79 C ATOM 1360 O GLY A 142 -21.445 -4.313 -42.466 1.00 8.64 O ATOM 1361 H GLY A 142 -18.685 -4.169 -40.484 1.00 0.00 H ATOM 1362 N LYS A 143 -22.994 -3.406 -41.097 1.00 9.26 N ATOM 1363 CA LYS A 143 -24.037 -3.357 -42.110 1.00 9.51 C ATOM 1364 C LYS A 143 -23.597 -2.620 -43.370 1.00 10.76 C ATOM 1365 O LYS A 143 -22.860 -1.639 -43.285 1.00 12.60 O ATOM 1366 CB LYS A 143 -25.291 -2.698 -41.529 1.00 10.23 C ATOM 1367 CG LYS A 143 -25.887 -3.451 -40.352 1.00 10.52 C ATOM 1368 CD LYS A 143 -27.130 -2.739 -39.823 1.00 10.14 C ATOM 1369 CE LYS A 143 -27.627 -3.360 -38.533 1.00 11.33 C ATOM 1370 NZ LYS A 143 -28.455 -4.572 -38.767 1.00 12.80 N ATOM 1371 HZ1 LYS A 143 -29.284 -4.318 -39.341 1.00 0.00 H ATOM 1372 HZ2 LYS A 143 -27.889 -5.285 -39.269 1.00 0.00 H ATOM 1373 HZ3 LYS A 143 -28.769 -4.957 -37.854 1.00 0.00 H ATOM 1374 H LYS A 143 -23.196 -3.036 -40.146 1.00 0.00 H ATOM 1375 N GLU A 144 -24.039 -3.112 -44.530 1.00 11.22 N ATOM 1376 CA GLU A 144 -23.756 -2.476 -45.825 1.00 12.18 C ATOM 1377 C GLU A 144 -24.730 -1.362 -46.142 1.00 10.69 C ATOM 1378 O GLU A 144 -24.489 -0.569 -47.057 1.00 11.75 O ATOM 1379 CB GLU A 144 -23.806 -3.496 -46.952 1.00 12.93 C ATOM 1380 CG GLU A 144 -22.726 -4.565 -46.881 1.00 13.38 C ATOM 1381 CD GLU A 144 -22.581 -5.306 -48.191 1.00 14.20 C ATOM 1382 OE1 GLU A 144 -21.945 -4.750 -49.111 1.00 16.33 O ATOM 1383 OE2 GLU A 144 -23.108 -6.436 -48.307 1.00 14.45 O ATOM 1384 H GLU A 144 -24.608 -3.983 -44.517 1.00 0.00 H ATOM 1385 N GLN A 145 -25.860 -1.378 -45.430 1.00 11.07 N ATOM 1386 CA GLN A 145 -26.877 -0.316 -45.416 1.00 11.96 C ATOM 1387 C GLN A 145 -27.508 -0.234 -44.030 1.00 10.37 C ATOM 1388 O GLN A 145 -27.684 -1.249 -43.378 1.00 11.44 O ATOM 1389 CB GLN A 145 -28.017 -0.637 -46.382 1.00 14.02 C ATOM 1390 CG GLN A 145 -27.619 -0.836 -47.826 1.00 18.54 C ATOM 1391 CD GLN A 145 -27.821 0.409 -48.646 1.00 24.46 C ATOM 1392 OE1 GLN A 145 -28.547 0.384 -49.626 1.00 32.47 O ATOM 1393 NE2 GLN A 145 -27.218 1.516 -48.228 1.00 27.75 N ATOM 1394 HE22 GLN A 145 -26.607 1.490 -47.387 1.00 0.00 H ATOM 1395 HE21 GLN A 145 -27.356 2.409 -48.742 1.00 0.00 H ATOM 1396 H GLN A 145 -26.036 -2.213 -44.835 1.00 0.00 H ATOM 1397 N SER A 146 -27.896 0.971 -43.611 1.00 9.60 N ATOM 1398 CA SER A 146 -28.554 1.165 -42.310 1.00 8.94 C ATOM 1399 C SER A 146 -29.840 0.338 -42.223 1.00 10.25 C ATOM 1400 O SER A 146 -30.249 -0.086 -41.138 1.00 10.78 O ATOM 1401 CB SER A 146 -28.863 2.646 -42.077 1.00 8.28 C ATOM 1402 OG SER A 146 -27.679 3.383 -41.779 1.00 10.81 O ATOM 1403 HG SER A 146 -27.912 4.334 -41.634 1.00 0.00 H ATOM 1404 H SER A 146 -27.729 1.796 -44.221 1.00 0.00 H ATOM 1405 N THR A 147 -30.457 0.105 -43.378 1.00 11.61 N ATOM 1406 CA THR A 147 -31.715 -0.653 -43.477 1.00 10.55 C ATOM 1407 C THR A 147 -31.553 -2.181 -43.586 1.00 9.84 C ATOM 1408 O THR A 147 -32.541 -2.916 -43.653 1.00 10.47 O ATOM 1409 CB THR A 147 -32.525 -0.186 -44.699 1.00 12.51 C ATOM 1410 OG1 THR A 147 -31.778 -0.431 -45.893 1.00 12.19 O ATOM 1411 CG2 THR A 147 -32.852 1.301 -44.609 1.00 12.42 C ATOM 1412 HG1 THR A 147 -31.593 -1.400 -45.972 1.00 0.00 H ATOM 1413 H THR A 147 -30.031 0.475 -44.251 1.00 0.00 H ATOM 1414 N ASP A 148 -30.318 -2.659 -43.640 1.00 10.83 N ATOM 1415 CA ASP A 148 -30.055 -4.103 -43.681 1.00 10.54 C ATOM 1416 C ASP A 148 -30.218 -4.708 -42.299 1.00 9.67 C ATOM 1417 O ASP A 148 -29.651 -4.213 -41.331 1.00 9.92 O ATOM 1418 CB ASP A 148 -28.639 -4.385 -44.177 1.00 9.94 C ATOM 1419 CG ASP A 148 -28.500 -4.252 -45.682 1.00 11.68 C ATOM 1420 OD1 ASP A 148 -29.505 -4.027 -46.405 1.00 13.78 O ATOM 1421 OD2 ASP A 148 -27.359 -4.385 -46.139 1.00 13.87 O ATOM 1422 H ASP A 148 -29.517 -1.996 -43.654 1.00 0.00 H ATOM 1423 N TYR A 149 -31.019 -5.770 -42.201 1.00 9.04 N ATOM 1424 CA TYR A 149 -31.141 -6.488 -40.951 1.00 8.93 C ATOM 1425 C TYR A 149 -29.890 -7.326 -40.648 1.00 9.94 C ATOM 1426 O TYR A 149 -29.467 -7.432 -39.490 1.00 11.36 O ATOM 1427 CB TYR A 149 -32.402 -7.374 -40.949 1.00 10.01 C ATOM 1428 CG TYR A 149 -32.510 -8.145 -39.673 1.00 9.79 C ATOM 1429 CD1 TYR A 149 -32.860 -7.508 -38.484 1.00 8.53 C ATOM 1430 CD2 TYR A 149 -32.196 -9.497 -39.631 1.00 9.85 C ATOM 1431 CE1 TYR A 149 -32.905 -8.203 -37.294 1.00 9.10 C ATOM 1432 CE2 TYR A 149 -32.263 -10.201 -38.446 1.00 10.61 C ATOM 1433 CZ TYR A 149 -32.617 -9.549 -37.287 1.00 9.81 C ATOM 1434 OH TYR A 149 -32.678 -10.246 -36.114 1.00 12.37 O ATOM 1435 HH TYR A 149 -31.789 -10.633 -35.915 1.00 0.00 H ATOM 1436 H TYR A 149 -31.561 -6.085 -43.031 1.00 0.00 H ATOM 1437 N LEU A 150 -29.301 -7.903 -41.689 1.00 9.91 N ATOM 1438 CA LEU A 150 -28.201 -8.842 -41.528 1.00 8.78 C ATOM 1439 C LEU A 150 -26.879 -8.144 -41.815 1.00 9.27 C ATOM 1440 O LEU A 150 -26.826 -7.205 -42.604 1.00 10.87 O ATOM 1441 CB LEU A 150 -28.361 -10.038 -42.471 1.00 11.27 C ATOM 1442 CG LEU A 150 -29.563 -10.973 -42.274 1.00 13.23 C ATOM 1443 CD1 LEU A 150 -29.530 -12.069 -43.328 1.00 15.31 C ATOM 1444 CD2 LEU A 150 -29.567 -11.566 -40.876 1.00 14.01 C ATOM 1445 H LEU A 150 -29.636 -7.677 -42.647 1.00 0.00 H ATOM 1446 N TYR A 151 -25.823 -8.620 -41.168 1.00 9.12 N ATOM 1447 CA TYR A 151 -24.448 -8.251 -41.532 1.00 8.60 C ATOM 1448 C TYR A 151 -23.982 -8.982 -42.811 1.00 11.03 C ATOM 1449 O TYR A 151 -24.470 -10.068 -43.112 1.00 11.96 O ATOM 1450 CB TYR A 151 -23.485 -8.601 -40.398 1.00 10.14 C ATOM 1451 CG TYR A 151 -23.636 -7.787 -39.123 1.00 8.44 C ATOM 1452 CD1 TYR A 151 -23.695 -6.391 -39.155 1.00 7.85 C ATOM 1453 CD2 TYR A 151 -23.671 -8.415 -37.884 1.00 8.11 C ATOM 1454 CE1 TYR A 151 -23.808 -5.655 -37.988 1.00 8.42 C ATOM 1455 CE2 TYR A 151 -23.756 -7.690 -36.712 1.00 8.32 C ATOM 1456 CZ TYR A 151 -23.841 -6.307 -36.767 1.00 9.11 C ATOM 1457 OH TYR A 151 -23.963 -5.588 -35.592 1.00 10.46 O ATOM 1458 HH TYR A 151 -23.177 -5.763 -35.016 1.00 0.00 H ATOM 1459 H TYR A 151 -25.974 -9.277 -40.376 1.00 0.00 H ATOM 1460 N PRO A 152 -23.012 -8.401 -43.549 1.00 11.60 N ATOM 1461 CA PRO A 152 -22.386 -9.127 -44.662 1.00 12.29 C ATOM 1462 C PRO A 152 -21.641 -10.376 -44.205 1.00 12.36 C ATOM 1463 O PRO A 152 -21.183 -10.442 -43.065 1.00 12.85 O ATOM 1464 CB PRO A 152 -21.376 -8.112 -45.224 1.00 12.61 C ATOM 1465 CG PRO A 152 -21.081 -7.202 -44.080 1.00 10.85 C ATOM 1466 CD PRO A 152 -22.411 -7.069 -43.384 1.00 10.31 C ATOM 1467 N GLU A 153 -21.501 -11.335 -45.117 1.00 11.69 N ATOM 1468 CA GLU A 153 -20.873 -12.618 -44.826 1.00 10.26 C ATOM 1469 C GLU A 153 -19.365 -12.514 -44.901 1.00 9.96 C ATOM 1470 O GLU A 153 -18.671 -13.464 -44.559 1.00 11.09 O ATOM 1471 CB GLU A 153 -21.343 -13.682 -45.827 1.00 10.41 C ATOM 1472 CG GLU A 153 -22.823 -14.059 -45.700 1.00 13.79 C ATOM 1473 CD GLU A 153 -23.120 -14.940 -44.501 1.00 18.88 C ATOM 1474 OE1 GLU A 153 -22.197 -15.236 -43.708 1.00 23.12 O ATOM 1475 OE2 GLU A 153 -24.297 -15.343 -44.339 1.00 30.16 O ATOM 1476 H GLU A 153 -21.855 -11.162 -46.079 1.00 0.00 H ATOM 1477 N GLN A 154 -18.871 -11.377 -45.386 1.00 10.19 N ATOM 1478 CA GLN A 154 -17.446 -11.179 -45.598 1.00 9.50 C ATOM 1479 C GLN A 154 -17.014 -9.775 -45.180 1.00 10.39 C ATOM 1480 O GLN A 154 -17.787 -8.821 -45.313 1.00 12.89 O ATOM 1481 CB GLN A 154 -17.097 -11.407 -47.073 1.00 8.54 C ATOM 1482 CG GLN A 154 -15.581 -11.420 -47.319 1.00 8.07 C ATOM 1483 CD GLN A 154 -15.183 -11.905 -48.709 1.00 9.30 C ATOM 1484 OE1 GLN A 154 -15.954 -12.558 -49.417 1.00 11.35 O ATOM 1485 NE2 GLN A 154 -13.945 -11.599 -49.095 1.00 9.87 N ATOM 1486 HE22 GLN A 154 -13.326 -11.046 -48.468 1.00 0.00 H ATOM 1487 HE21 GLN A 154 -13.597 -11.913 -50.024 1.00 0.00 H ATOM 1488 H GLN A 154 -19.526 -10.604 -45.621 1.00 0.00 H ATOM 1489 N LEU A 155 -15.778 -9.686 -44.669 1.00 10.75 N ATOM 1490 CA LEU A 155 -15.132 -8.442 -44.263 1.00 9.90 C ATOM 1491 C LEU A 155 -15.139 -7.416 -45.405 1.00 9.65 C ATOM 1492 O LEU A 155 -15.013 -7.772 -46.578 1.00 10.60 O ATOM 1493 CB LEU A 155 -13.669 -8.729 -43.841 1.00 9.27 C ATOM 1494 CG LEU A 155 -12.943 -7.757 -42.920 1.00 8.79 C ATOM 1495 CD1 LEU A 155 -13.669 -7.581 -41.598 1.00 11.00 C ATOM 1496 CD2 LEU A 155 -11.514 -8.252 -42.695 1.00 7.85 C ATOM 1497 H LEU A 155 -15.240 -10.568 -44.553 1.00 0.00 H ATOM 1498 N LYS A 156 -15.324 -6.150 -45.057 1.00 9.92 N ATOM 1499 CA LYS A 156 -15.285 -5.063 -46.029 1.00 10.04 C ATOM 1500 C LYS A 156 -14.267 -4.035 -45.587 1.00 10.77 C ATOM 1501 O LYS A 156 -13.903 -3.956 -44.412 1.00 10.41 O ATOM 1502 CB LYS A 156 -16.646 -4.369 -46.175 1.00 8.90 C ATOM 1503 CG LYS A 156 -17.721 -5.240 -46.803 1.00 9.17 C ATOM 1504 CD LYS A 156 -18.997 -4.470 -47.091 1.00 10.58 C ATOM 1505 CE LYS A 156 -18.877 -3.548 -48.289 1.00 10.92 C ATOM 1506 NZ LYS A 156 -20.075 -2.682 -48.457 1.00 11.52 N ATOM 1507 HZ1 LYS A 156 -20.916 -3.278 -48.592 1.00 0.00 H ATOM 1508 HZ2 LYS A 156 -20.198 -2.094 -47.608 1.00 0.00 H ATOM 1509 HZ3 LYS A 156 -19.945 -2.070 -49.288 1.00 0.00 H ATOM 1510 H LYS A 156 -15.503 -5.924 -44.058 1.00 0.00 H ATOM 1511 N MET A 157 -13.829 -3.231 -46.539 1.00 11.10 N ATOM 1512 CA MET A 157 -12.998 -2.086 -46.215 1.00 12.24 C ATOM 1513 C MET A 157 -13.361 -0.936 -47.126 1.00 11.66 C ATOM 1514 O MET A 157 -13.881 -1.141 -48.218 1.00 12.40 O ATOM 1515 CB MET A 157 -11.497 -2.441 -46.293 1.00 15.13 C ATOM 1516 CG MET A 157 -10.858 -2.478 -47.675 1.00 17.10 C ATOM 1517 SD MET A 157 -9.052 -2.715 -47.663 1.00 31.99 S ATOM 1518 CE MET A 157 -8.545 -1.853 -46.182 1.00 28.28 C ATOM 1519 H MET A 157 -14.082 -3.420 -47.530 1.00 0.00 H ATOM 1520 N THR A 158 -13.118 0.276 -46.655 1.00 10.75 N ATOM 1521 CA THR A 158 -13.252 1.456 -47.497 1.00 10.85 C ATOM 1522 C THR A 158 -12.255 2.505 -47.041 1.00 12.90 C ATOM 1523 O THR A 158 -11.546 2.305 -46.045 1.00 14.03 O ATOM 1524 CB THR A 158 -14.686 2.040 -47.507 1.00 11.88 C ATOM 1525 OG1 THR A 158 -14.796 2.991 -48.571 1.00 12.74 O ATOM 1526 CG2 THR A 158 -15.033 2.714 -46.188 1.00 13.03 C ATOM 1527 HG1 THR A 158 -15.711 3.368 -48.582 1.00 0.00 H ATOM 1528 H THR A 158 -12.825 0.388 -45.663 1.00 0.00 H ATOM 1529 N VAL A 159 -12.235 3.615 -47.777 1.00 13.68 N ATOM 1530 CA VAL A 159 -11.353 4.741 -47.527 1.00 15.21 C ATOM 1531 C VAL A 159 -12.195 5.966 -47.184 1.00 16.91 C ATOM 1532 O VAL A 159 -13.196 6.247 -47.847 1.00 15.13 O ATOM 1533 CB VAL A 159 -10.494 5.046 -48.771 1.00 17.55 C ATOM 1534 CG1 VAL A 159 -9.693 6.331 -48.596 1.00 18.56 C ATOM 1535 CG2 VAL A 159 -9.572 3.872 -49.061 1.00 17.27 C ATOM 1536 H VAL A 159 -12.892 3.679 -48.581 1.00 0.00 H ATOM 1537 N VAL A 160 -11.784 6.683 -46.141 1.00 16.79 N ATOM 1538 CA VAL A 160 -12.429 7.936 -45.736 1.00 14.51 C ATOM 1539 C VAL A 160 -11.338 8.964 -45.464 1.00 14.90 C ATOM 1540 O VAL A 160 -10.175 8.598 -45.252 1.00 17.68 O ATOM 1541 CB VAL A 160 -13.303 7.766 -44.473 1.00 13.49 C ATOM 1542 CG1 VAL A 160 -14.570 6.973 -44.799 1.00 10.87 C ATOM 1543 CG2 VAL A 160 -12.534 7.105 -43.342 1.00 15.36 C ATOM 1544 H VAL A 160 -10.971 6.340 -45.590 1.00 0.00 H ATOM 1545 N LYS A 161 -11.709 10.242 -45.468 1.00 14.64 N ATOM 1546 CA LYS A 161 -10.738 11.318 -45.242 1.00 14.98 C ATOM 1547 C LYS A 161 -10.961 11.972 -43.896 1.00 12.78 C ATOM 1548 O LYS A 161 -12.101 12.242 -43.521 1.00 13.71 O ATOM 1549 CB LYS A 161 -10.841 12.381 -46.325 1.00 18.00 C ATOM 1550 CG LYS A 161 -10.419 11.885 -47.695 1.00 22.72 C ATOM 1551 CD LYS A 161 -10.303 13.025 -48.687 1.00 25.28 C ATOM 1552 CE LYS A 161 -9.283 12.704 -49.764 1.00 27.91 C ATOM 1553 NZ LYS A 161 -9.226 13.794 -50.765 1.00 32.24 N ATOM 1554 HZ1 LYS A 161 -10.161 13.907 -51.207 1.00 0.00 H ATOM 1555 HZ2 LYS A 161 -8.954 14.681 -50.295 1.00 0.00 H ATOM 1556 HZ3 LYS A 161 -8.523 13.557 -51.494 1.00 0.00 H ATOM 1557 H LYS A 161 -12.707 10.483 -45.635 1.00 0.00 H ATOM 1558 N LEU A 162 -9.864 12.242 -43.200 1.00 14.01 N ATOM 1559 CA LEU A 162 -9.875 12.898 -41.899 1.00 13.90 C ATOM 1560 C LEU A 162 -10.403 14.331 -42.045 1.00 15.29 C ATOM 1561 O LEU A 162 -10.048 15.045 -42.990 1.00 13.91 O ATOM 1562 CB LEU A 162 -8.462 12.922 -41.282 1.00 13.89 C ATOM 1563 CG LEU A 162 -7.704 11.613 -41.021 1.00 15.71 C ATOM 1564 CD1 LEU A 162 -6.488 11.898 -40.164 1.00 17.04 C ATOM 1565 CD2 LEU A 162 -8.559 10.558 -40.340 1.00 18.46 C ATOM 1566 H LEU A 162 -8.946 11.970 -43.605 1.00 0.00 H ATOM 1567 N ILE A 163 -11.277 14.709 -41.115 1.00 14.74 N ATOM 1568 CA ILE A 163 -11.877 16.032 -41.044 1.00 13.61 C ATOM 1569 C ILE A 163 -11.392 16.738 -39.783 1.00 14.55 C ATOM 1570 O ILE A 163 -11.357 16.137 -38.717 1.00 15.19 O ATOM 1571 CB ILE A 163 -13.411 15.888 -41.013 1.00 13.51 C ATOM 1572 CG1 ILE A 163 -13.889 15.337 -42.356 1.00 15.80 C ATOM 1573 CG2 ILE A 163 -14.097 17.212 -40.703 1.00 16.84 C ATOM 1574 CD1 ILE A 163 -15.306 14.822 -42.333 1.00 15.52 C ATOM 1575 H ILE A 163 -11.549 14.013 -40.392 1.00 0.00 H ATOM 1576 N SER A 164 -11.029 18.013 -39.905 1.00 16.10 N ATOM 1577 CA SER A 164 -10.513 18.777 -38.769 1.00 18.57 C ATOM 1578 C SER A 164 -11.530 18.899 -37.644 1.00 17.32 C ATOM 1579 O SER A 164 -12.740 18.900 -37.875 1.00 17.70 O ATOM 1580 CB SER A 164 -10.053 20.182 -39.190 1.00 18.25 C ATOM 1581 OG SER A 164 -11.123 21.025 -39.583 1.00 18.96 O ATOM 1582 HG SER A 164 -10.766 21.911 -39.842 1.00 0.00 H ATOM 1583 H SER A 164 -11.114 18.478 -40.831 1.00 0.00 H ATOM 1584 N HIS A 165 -11.014 19.001 -36.425 1.00 20.75 N ATOM 1585 CA HIS A 165 -11.839 19.237 -35.252 1.00 19.40 C ATOM 1586 C HIS A 165 -12.620 20.532 -35.420 1.00 18.13 C ATOM 1587 O HIS A 165 -13.806 20.562 -35.165 1.00 18.05 O ATOM 1588 CB HIS A 165 -11.010 19.253 -33.962 1.00 22.95 C ATOM 1589 CG HIS A 165 -11.830 19.270 -32.711 1.00 24.07 C ATOM 1590 ND1 HIS A 165 -11.744 20.278 -31.776 1.00 26.66 N ATOM 1591 CD2 HIS A 165 -12.758 18.403 -32.241 1.00 22.94 C ATOM 1592 CE1 HIS A 165 -12.574 20.026 -30.779 1.00 24.73 C ATOM 1593 NE2 HIS A 165 -13.210 18.900 -31.044 1.00 30.13 N ATOM 1594 H HIS A 165 -9.985 18.909 -36.305 1.00 0.00 H ATOM 1595 N ARG A 166 -11.970 21.591 -35.890 1.00 19.99 N ATOM 1596 CA ARG A 166 -12.655 22.864 -36.087 1.00 19.89 C ATOM 1597 C ARG A 166 -13.899 22.682 -36.955 1.00 19.95 C ATOM 1598 O ARG A 166 -14.976 23.160 -36.604 1.00 22.46 O ATOM 1599 CB ARG A 166 -11.714 23.904 -36.697 1.00 22.89 C ATOM 1600 CG ARG A 166 -12.421 25.157 -37.195 1.00 28.15 C ATOM 1601 CD ARG A 166 -11.502 26.364 -37.189 1.00 37.93 C ATOM 1602 NE ARG A 166 -11.160 26.751 -35.818 1.00 46.80 N ATOM 1603 CZ ARG A 166 -9.931 26.766 -35.301 1.00 53.10 C ATOM 1604 NH1 ARG A 166 -8.863 26.437 -36.030 1.00 60.64 N ATOM 1605 NH2 ARG A 166 -9.771 27.132 -34.038 1.00 59.26 N ATOM 1606 HE ARG A 166 -11.942 27.038 -35.195 1.00 0.00 H ATOM 1607 HH12 ARG A 166 -7.915 26.457 -35.602 1.00 0.00 H ATOM 1608 HH11 ARG A 166 -8.978 26.161 -37.026 1.00 0.00 H ATOM 1609 HH22 ARG A 166 -8.820 27.150 -33.618 1.00 0.00 H ATOM 1610 HH21 ARG A 166 -10.597 27.402 -33.466 1.00 0.00 H ATOM 1611 H ARG A 166 -10.959 21.512 -36.121 1.00 0.00 H ATOM 1612 N GLU A 167 -13.757 21.958 -38.060 1.00 19.88 N ATOM 1613 CA GLU A 167 -14.869 21.723 -38.966 1.00 18.89 C ATOM 1614 C GLU A 167 -15.932 20.832 -38.329 1.00 18.37 C ATOM 1615 O GLU A 167 -17.132 21.101 -38.463 1.00 19.36 O ATOM 1616 CB GLU A 167 -14.390 21.094 -40.283 1.00 22.23 C ATOM 1617 CG GLU A 167 -15.541 20.699 -41.196 1.00 26.66 C ATOM 1618 CD GLU A 167 -15.162 20.591 -42.655 1.00 29.31 C ATOM 1619 OE1 GLU A 167 -14.151 19.924 -42.971 1.00 33.63 O ATOM 1620 OE2 GLU A 167 -15.894 21.164 -43.493 1.00 35.61 O ATOM 1621 H GLU A 167 -12.827 21.549 -38.282 1.00 0.00 H ATOM 1622 N CYS A 168 -15.504 19.768 -37.652 1.00 17.25 N ATOM 1623 CA CYS A 168 -16.458 18.810 -37.074 1.00 16.31 C ATOM 1624 C CYS A 168 -17.284 19.420 -35.931 1.00 16.64 C ATOM 1625 O CYS A 168 -18.398 18.965 -35.661 1.00 18.06 O ATOM 1626 CB CYS A 168 -15.755 17.527 -36.604 1.00 18.18 C ATOM 1627 SG CYS A 168 -16.801 16.074 -36.834 1.00 22.76 S ATOM 1628 H CYS A 168 -14.483 19.613 -37.531 1.00 0.00 H ATOM 1629 N GLN A 169 -16.740 20.452 -35.282 1.00 18.14 N ATOM 1630 CA GLN A 169 -17.417 21.136 -34.178 1.00 17.50 C ATOM 1631 C GLN A 169 -18.381 22.224 -34.599 1.00 15.21 C ATOM 1632 O GLN A 169 -18.961 22.859 -33.736 1.00 16.37 O ATOM 1633 CB GLN A 169 -16.426 21.864 -33.294 1.00 22.75 C ATOM 1634 CG GLN A 169 -15.365 21.066 -32.616 1.00 26.46 C ATOM 1635 CD GLN A 169 -14.364 22.025 -32.015 1.00 28.50 C ATOM 1636 OE1 GLN A 169 -13.256 22.186 -32.526 1.00 43.87 O ATOM 1637 NE2 GLN A 169 -14.777 22.726 -30.983 1.00 23.75 N ATOM 1638 HE22 GLN A 169 -15.722 22.556 -30.583 1.00 0.00 H ATOM 1639 HE21 GLN A 169 -14.159 23.451 -30.566 1.00 0.00 H ATOM 1640 H GLN A 169 -15.798 20.783 -35.572 1.00 0.00 H ATOM 1641 N GLN A 170 -18.489 22.511 -35.891 1.00 15.77 N ATOM 1642 CA GLN A 170 -19.484 23.469 -36.363 1.00 16.47 C ATOM 1643 C GLN A 170 -20.880 22.935 -36.022 1.00 15.50 C ATOM 1644 O GLN A 170 -21.088 21.714 -36.029 1.00 14.56 O ATOM 1645 CB GLN A 170 -19.396 23.660 -37.869 1.00 17.81 C ATOM 1646 CG GLN A 170 -18.073 24.200 -38.393 1.00 20.32 C ATOM 1647 CD GLN A 170 -18.059 24.230 -39.908 1.00 29.01 C ATOM 1648 OE1 GLN A 170 -18.089 23.180 -40.564 1.00 33.60 O ATOM 1649 NE2 GLN A 170 -18.037 25.431 -40.478 1.00 33.32 N ATOM 1650 HE22 GLN A 170 -18.012 26.287 -39.887 1.00 0.00 H ATOM 1651 HE21 GLN A 170 -18.045 25.515 -41.515 1.00 0.00 H ATOM 1652 H GLN A 170 -17.857 22.048 -36.575 1.00 0.00 H ATOM 1653 N PRO A 170A -21.844 23.837 -35.736 1.00 15.34 N ATOM 1654 CA PRO A 170A -23.222 23.411 -35.456 1.00 15.83 C ATOM 1655 C PRO A 170A -23.830 22.452 -36.488 1.00 17.43 C ATOM 1656 O PRO A 170A -24.563 21.538 -36.101 1.00 19.85 O ATOM 1657 CB PRO A 170A -23.991 24.735 -35.426 1.00 16.25 C ATOM 1658 CG PRO A 170A -22.985 25.725 -34.927 1.00 15.40 C ATOM 1659 CD PRO A 170A -21.654 25.274 -35.469 1.00 15.75 C ATOM 1660 N HIS A 170B -23.537 22.652 -37.772 1.00 16.60 N ATOM 1661 CA HIS A 170B -24.124 21.805 -38.824 1.00 18.87 C ATOM 1662 C HIS A 170B -23.395 20.467 -39.025 1.00 15.66 C ATOM 1663 O HIS A 170B -23.862 19.620 -39.787 1.00 16.06 O ATOM 1664 CB HIS A 170B -24.285 22.554 -40.156 1.00 21.66 C ATOM 1665 CG HIS A 170B -23.002 22.946 -40.808 1.00 25.15 C ATOM 1666 ND1 HIS A 170B -22.283 24.060 -40.430 1.00 29.46 N ATOM 1667 CD2 HIS A 170B -22.324 22.393 -41.841 1.00 30.87 C ATOM 1668 CE1 HIS A 170B -21.206 24.162 -41.188 1.00 33.54 C ATOM 1669 NE2 HIS A 170B -21.206 23.162 -42.051 1.00 36.49 N ATOM 1670 H HIS A 170B -22.884 23.418 -38.035 1.00 0.00 H ATOM 1671 N TYR A 171 -22.264 20.283 -38.350 1.00 14.17 N ATOM 1672 CA TYR A 171 -21.662 18.956 -38.214 1.00 11.97 C ATOM 1673 C TYR A 171 -22.085 18.359 -36.849 1.00 12.14 C ATOM 1674 O TYR A 171 -23.248 17.948 -36.710 1.00 14.42 O ATOM 1675 CB TYR A 171 -20.136 18.994 -38.445 1.00 12.44 C ATOM 1676 CG TYR A 171 -19.710 18.954 -39.915 1.00 13.78 C ATOM 1677 CD1 TYR A 171 -20.282 19.811 -40.862 1.00 19.85 C ATOM 1678 CD2 TYR A 171 -18.728 18.071 -40.347 1.00 13.58 C ATOM 1679 CE1 TYR A 171 -19.884 19.775 -42.195 1.00 20.40 C ATOM 1680 CE2 TYR A 171 -18.327 18.034 -41.673 1.00 14.60 C ATOM 1681 CZ TYR A 171 -18.908 18.881 -42.592 1.00 16.37 C ATOM 1682 OH TYR A 171 -18.498 18.831 -43.910 1.00 17.49 O ATOM 1683 HH TYR A 171 -19.007 19.496 -44.438 1.00 0.00 H ATOM 1684 H TYR A 171 -21.797 21.101 -37.909 1.00 0.00 H ATOM 1685 N TYR A 172 -21.194 18.327 -35.854 1.00 14.37 N ATOM 1686 CA TYR A 172 -21.520 17.755 -34.538 1.00 13.72 C ATOM 1687 C TYR A 172 -21.413 18.702 -33.344 1.00 12.76 C ATOM 1688 O TYR A 172 -21.609 18.276 -32.198 1.00 13.17 O ATOM 1689 CB TYR A 172 -20.655 16.523 -34.251 1.00 12.50 C ATOM 1690 CG TYR A 172 -21.017 15.298 -35.063 1.00 13.24 C ATOM 1691 CD1 TYR A 172 -22.326 14.810 -35.089 1.00 17.70 C ATOM 1692 CD2 TYR A 172 -20.045 14.600 -35.771 1.00 12.49 C ATOM 1693 CE1 TYR A 172 -22.648 13.682 -35.825 1.00 14.65 C ATOM 1694 CE2 TYR A 172 -20.355 13.473 -36.509 1.00 11.56 C ATOM 1695 CZ TYR A 172 -21.658 13.014 -36.539 1.00 11.69 C ATOM 1696 OH TYR A 172 -21.985 11.883 -37.261 1.00 10.21 O ATOM 1697 HH TYR A 172 -21.763 12.026 -38.215 1.00 0.00 H ATOM 1698 H TYR A 172 -20.243 18.717 -36.014 1.00 0.00 H ATOM 1699 N GLY A 173 -21.127 19.977 -33.589 1.00 12.00 N ATOM 1700 CA GLY A 173 -21.069 20.950 -32.508 1.00 14.50 C ATOM 1701 C GLY A 173 -20.242 20.485 -31.322 1.00 14.13 C ATOM 1702 O GLY A 173 -19.092 20.025 -31.479 1.00 15.59 O ATOM 1703 H GLY A 173 -20.942 20.283 -34.566 1.00 0.00 H ATOM 1704 N SER A 174 -20.845 20.551 -30.138 1.00 13.94 N ATOM 1705 CA SER A 174 -20.166 20.227 -28.878 1.00 16.28 C ATOM 1706 C SER A 174 -20.070 18.733 -28.567 1.00 16.14 C ATOM 1707 O SER A 174 -19.463 18.350 -27.569 1.00 17.56 O ATOM 1708 CB SER A 174 -20.860 20.947 -27.711 1.00 14.36 C ATOM 1709 OG SER A 174 -22.274 20.848 -27.814 1.00 16.88 O ATOM 1710 HG SER A 174 -22.539 19.894 -27.800 1.00 0.00 H ATOM 1711 H SER A 174 -21.842 20.845 -30.104 1.00 0.00 H ATOM 1712 N GLU A 175 -20.663 17.892 -29.410 1.00 15.91 N ATOM 1713 CA GLU A 175 -20.612 16.434 -29.221 1.00 16.10 C ATOM 1714 C GLU A 175 -19.236 15.821 -29.496 1.00 16.45 C ATOM 1715 O GLU A 175 -18.929 14.758 -28.954 1.00 18.22 O ATOM 1716 CB GLU A 175 -21.646 15.742 -30.111 1.00 17.34 C ATOM 1717 CG GLU A 175 -23.094 16.069 -29.795 1.00 20.20 C ATOM 1718 CD GLU A 175 -23.544 15.506 -28.467 1.00 20.09 C ATOM 1719 OE1 GLU A 175 -24.245 14.474 -28.462 1.00 21.88 O ATOM 1720 OE2 GLU A 175 -23.194 16.093 -27.425 1.00 23.17 O ATOM 1721 H GLU A 175 -21.178 18.277 -30.227 1.00 0.00 H ATOM 1722 N VAL A 176 -18.431 16.465 -30.347 1.00 15.59 N ATOM 1723 CA VAL A 176 -17.054 16.009 -30.611 1.00 15.67 C ATOM 1724 C VAL A 176 -16.014 16.752 -29.777 1.00 15.61 C ATOM 1725 O VAL A 176 -16.086 17.963 -29.574 1.00 16.49 O ATOM 1726 CB VAL A 176 -16.646 16.073 -32.110 1.00 18.66 C ATOM 1727 CG1 VAL A 176 -17.455 15.073 -32.924 1.00 16.86 C ATOM 1728 CG2 VAL A 176 -16.752 17.485 -32.675 1.00 18.37 C ATOM 1729 H VAL A 176 -18.786 17.311 -30.836 1.00 0.00 H ATOM 1730 N THR A 177 -15.030 16.001 -29.311 1.00 16.41 N ATOM 1731 CA THR A 177 -13.960 16.546 -28.502 1.00 15.38 C ATOM 1732 C THR A 177 -12.613 16.257 -29.150 1.00 14.92 C ATOM 1733 O THR A 177 -12.529 15.537 -30.158 1.00 13.00 O ATOM 1734 CB THR A 177 -13.979 15.922 -27.104 1.00 18.96 C ATOM 1735 OG1 THR A 177 -13.625 14.540 -27.210 1.00 20.91 O ATOM 1736 CG2 THR A 177 -15.367 16.047 -26.473 1.00 17.90 C ATOM 1737 HG1 THR A 177 -13.635 14.128 -26.310 1.00 0.00 H ATOM 1738 H THR A 177 -15.025 14.985 -29.533 1.00 0.00 H ATOM 1739 N THR A 178 -11.560 16.809 -28.553 1.00 16.50 N ATOM 1740 CA THR A 178 -10.196 16.595 -29.052 1.00 16.78 C ATOM 1741 C THR A 178 -9.709 15.160 -28.848 1.00 16.76 C ATOM 1742 O THR A 178 -8.670 14.795 -29.400 1.00 17.26 O ATOM 1743 CB THR A 178 -9.161 17.559 -28.430 1.00 20.38 C ATOM 1744 OG1 THR A 178 -9.174 17.446 -27.005 1.00 18.97 O ATOM 1745 CG2 THR A 178 -9.436 18.996 -28.845 1.00 22.55 C ATOM 1746 HG1 THR A 178 -8.948 16.517 -26.747 1.00 0.00 H ATOM 1747 H THR A 178 -11.706 17.406 -27.714 1.00 0.00 H ATOM 1748 N LYS A 179 -10.439 14.365 -28.057 1.00 15.66 N ATOM 1749 CA LYS A 179 -10.164 12.925 -27.925 1.00 17.93 C ATOM 1750 C LYS A 179 -10.894 12.062 -28.969 1.00 15.51 C ATOM 1751 O LYS A 179 -10.816 10.827 -28.917 1.00 14.49 O ATOM 1752 CB LYS A 179 -10.488 12.432 -26.513 1.00 20.12 C ATOM 1753 CG LYS A 179 -9.665 13.129 -25.438 1.00 24.67 C ATOM 1754 CD LYS A 179 -9.349 12.223 -24.258 1.00 32.35 C ATOM 1755 CE LYS A 179 -10.592 11.825 -23.481 1.00 44.68 C ATOM 1756 NZ LYS A 179 -10.309 11.286 -22.121 1.00 56.59 N ATOM 1757 HZ1 LYS A 179 -9.712 10.438 -22.203 1.00 0.00 H ATOM 1758 HZ2 LYS A 179 -9.813 12.008 -21.560 1.00 0.00 H ATOM 1759 HZ3 LYS A 179 -11.205 11.038 -21.655 1.00 0.00 H ATOM 1760 H LYS A 179 -11.227 14.778 -27.518 1.00 0.00 H ATOM 1761 N MET A 180 -11.578 12.718 -29.910 1.00 13.17 N ATOM 1762 CA MET A 180 -12.223 12.056 -31.044 1.00 11.05 C ATOM 1763 C MET A 180 -11.707 12.598 -32.373 1.00 12.45 C ATOM 1764 O MET A 180 -11.208 13.730 -32.460 1.00 15.98 O ATOM 1765 CB MET A 180 -13.747 12.238 -30.985 1.00 10.86 C ATOM 1766 CG MET A 180 -14.361 12.018 -29.627 1.00 12.11 C ATOM 1767 SD MET A 180 -16.108 12.475 -29.710 1.00 13.75 S ATOM 1768 CE MET A 180 -16.600 12.299 -27.999 1.00 16.80 C ATOM 1769 H MET A 180 -11.656 13.752 -29.833 1.00 0.00 H ATOM 1770 N LEU A 181 -11.796 11.755 -33.397 1.00 14.02 N ATOM 1771 CA LEU A 181 -11.462 12.114 -34.768 1.00 15.29 C ATOM 1772 C LEU A 181 -12.686 11.887 -35.629 1.00 13.90 C ATOM 1773 O LEU A 181 -13.355 10.863 -35.500 1.00 18.22 O ATOM 1774 CB LEU A 181 -10.351 11.220 -35.313 1.00 16.64 C ATOM 1775 CG LEU A 181 -8.930 11.389 -34.793 1.00 19.55 C ATOM 1776 CD1 LEU A 181 -8.037 10.355 -35.453 1.00 21.68 C ATOM 1777 CD2 LEU A 181 -8.414 12.793 -35.057 1.00 21.49 C ATOM 1778 H LEU A 181 -12.122 10.786 -33.208 1.00 0.00 H ATOM 1779 N CYS A 182 -12.972 12.851 -36.493 1.00 14.90 N ATOM 1780 CA CYS A 182 -14.009 12.719 -37.504 1.00 15.36 C ATOM 1781 C CYS A 182 -13.403 12.294 -38.826 1.00 12.89 C ATOM 1782 O CYS A 182 -12.303 12.713 -39.157 1.00 15.17 O ATOM 1783 CB CYS A 182 -14.717 14.051 -37.686 1.00 14.88 C ATOM 1784 SG CYS A 182 -15.665 14.490 -36.223 1.00 18.49 S ATOM 1785 H CYS A 182 -12.432 13.739 -36.446 1.00 0.00 H ATOM 1786 N ALA A 183 -14.110 11.452 -39.573 1.00 11.49 N ATOM 1787 CA ALA A 183 -13.659 11.100 -40.927 1.00 11.98 C ATOM 1788 C ALA A 183 -14.856 10.752 -41.773 1.00 11.82 C ATOM 1789 O ALA A 183 -15.845 10.199 -41.273 1.00 11.80 O ATOM 1790 CB ALA A 183 -12.639 9.959 -40.912 1.00 10.25 C ATOM 1791 H ALA A 183 -14.988 11.040 -39.197 1.00 0.00 H ATOM 1792 N ALA A 184 -14.789 11.096 -43.054 1.00 12.19 N ATOM 1793 CA ALA A 184 -15.909 10.833 -43.942 1.00 11.17 C ATOM 1794 C ALA A 184 -15.473 10.857 -45.387 1.00 11.96 C ATOM 1795 O ALA A 184 -14.357 11.268 -45.729 1.00 13.74 O ATOM 1796 CB ALA A 184 -17.025 11.851 -43.722 1.00 11.61 C ATOM 1797 H ALA A 184 -13.932 11.555 -43.423 1.00 0.00 H ATOM 1798 N ASP A 185 -16.370 10.389 -46.230 1.00 13.36 N ATOM 1799 CA ASP A 185 -16.238 10.504 -47.665 1.00 17.03 C ATOM 1800 C ASP A 185 -16.640 11.932 -48.047 1.00 16.67 C ATOM 1801 O ASP A 185 -17.684 12.404 -47.610 1.00 19.28 O ATOM 1802 CB ASP A 185 -17.183 9.489 -48.307 1.00 17.40 C ATOM 1803 CG ASP A 185 -17.053 9.426 -49.813 1.00 19.25 C ATOM 1804 OD1 ASP A 185 -15.922 9.448 -50.325 1.00 21.21 O ATOM 1805 OD2 ASP A 185 -18.091 9.325 -50.481 1.00 18.74 O ATOM 1806 H ASP A 185 -17.212 9.915 -45.846 1.00 0.00 H ATOM 1807 N PRO A 185A -15.821 12.634 -48.855 1.00 18.03 N ATOM 1808 CA PRO A 185A -16.238 13.955 -49.339 1.00 18.15 C ATOM 1809 C PRO A 185A -17.665 14.010 -49.920 1.00 19.50 C ATOM 1810 O PRO A 185A -18.367 15.014 -49.729 1.00 19.11 O ATOM 1811 CB PRO A 185A -15.194 14.262 -50.411 1.00 18.94 C ATOM 1812 CG PRO A 185A -13.958 13.621 -49.874 1.00 20.21 C ATOM 1813 CD PRO A 185A -14.411 12.353 -49.198 1.00 17.28 C ATOM 1814 N GLN A 185B -18.082 12.941 -50.600 1.00 18.34 N ATOM 1815 CA GLN A 185B -19.437 12.831 -51.182 1.00 18.89 C ATOM 1816 C GLN A 185B -20.443 12.097 -50.289 1.00 15.76 C ATOM 1817 O GLN A 185B -21.618 11.920 -50.659 1.00 15.20 O ATOM 1818 CB GLN A 185B -19.354 12.137 -52.541 1.00 22.41 C ATOM 1819 CG GLN A 185B -18.736 13.014 -53.617 1.00 25.20 C ATOM 1820 CD GLN A 185B -18.608 12.286 -54.937 1.00 32.01 C ATOM 1821 OE1 GLN A 185B -18.035 11.198 -55.000 1.00 40.07 O ATOM 1822 NE2 GLN A 185B -19.132 12.879 -56.000 1.00 33.94 N ATOM 1823 HE22 GLN A 185B -19.607 13.799 -55.901 1.00 0.00 H ATOM 1824 HE21 GLN A 185B -19.068 12.425 -56.933 1.00 0.00 H ATOM 1825 H GLN A 185B -17.423 12.147 -50.727 1.00 0.00 H ATOM 1826 N TRP A 186 -19.988 11.666 -49.117 1.00 15.54 N ATOM 1827 CA TRP A 186 -20.871 11.100 -48.108 1.00 14.66 C ATOM 1828 C TRP A 186 -21.543 9.806 -48.571 1.00 14.60 C ATOM 1829 O TRP A 186 -22.698 9.550 -48.211 1.00 16.05 O ATOM 1830 CB TRP A 186 -21.957 12.118 -47.722 1.00 14.14 C ATOM 1831 CG TRP A 186 -21.440 13.475 -47.359 1.00 14.51 C ATOM 1832 CD1 TRP A 186 -21.475 14.595 -48.126 1.00 13.57 C ATOM 1833 CD2 TRP A 186 -20.823 13.852 -46.128 1.00 12.52 C ATOM 1834 NE1 TRP A 186 -20.931 15.649 -47.447 1.00 15.34 N ATOM 1835 CE2 TRP A 186 -20.525 15.222 -46.214 1.00 13.01 C ATOM 1836 CE3 TRP A 186 -20.516 13.170 -44.952 1.00 11.39 C ATOM 1837 CZ2 TRP A 186 -19.912 15.921 -45.173 1.00 13.51 C ATOM 1838 CZ3 TRP A 186 -19.930 13.866 -43.916 1.00 11.56 C ATOM 1839 CH2 TRP A 186 -19.627 15.221 -44.033 1.00 13.01 C ATOM 1840 HE1 TRP A 186 -20.841 16.619 -47.810 1.00 0.00 H ATOM 1841 H TRP A 186 -18.970 11.735 -48.915 1.00 0.00 H ATOM 1842 N LYS A 187 -20.833 9.002 -49.361 1.00 14.69 N ATOM 1843 CA LYS A 187 -21.381 7.741 -49.886 1.00 15.57 C ATOM 1844 C LYS A 187 -20.746 6.471 -49.317 1.00 16.22 C ATOM 1845 O LYS A 187 -21.245 5.371 -49.569 1.00 17.03 O ATOM 1846 CB LYS A 187 -21.262 7.715 -51.406 1.00 18.34 C ATOM 1847 CG LYS A 187 -22.161 8.709 -52.112 1.00 21.56 C ATOM 1848 CD LYS A 187 -21.857 8.716 -53.601 1.00 26.15 C ATOM 1849 CE LYS A 187 -22.594 9.831 -54.325 1.00 32.08 C ATOM 1850 NZ LYS A 187 -21.875 10.212 -55.572 1.00 33.64 N ATOM 1851 HZ1 LYS A 187 -20.918 10.541 -55.332 1.00 0.00 H ATOM 1852 HZ2 LYS A 187 -21.812 9.386 -56.201 1.00 0.00 H ATOM 1853 HZ3 LYS A 187 -22.395 10.975 -56.051 1.00 0.00 H ATOM 1854 H LYS A 187 -19.862 9.274 -49.615 1.00 0.00 H ATOM 1855 N THR A 188 -19.651 6.609 -48.574 1.00 15.94 N ATOM 1856 CA THR A 188 -18.994 5.462 -47.937 1.00 14.73 C ATOM 1857 C THR A 188 -18.659 5.838 -46.486 1.00 13.94 C ATOM 1858 O THR A 188 -18.376 6.997 -46.196 1.00 15.09 O ATOM 1859 CB THR A 188 -17.766 4.984 -48.749 1.00 14.37 C ATOM 1860 OG1 THR A 188 -17.295 3.738 -48.239 1.00 14.78 O ATOM 1861 CG2 THR A 188 -16.636 5.998 -48.723 1.00 16.07 C ATOM 1862 HG1 THR A 188 -16.510 3.443 -48.766 1.00 0.00 H ATOM 1863 H THR A 188 -19.249 7.559 -48.441 1.00 0.00 H ATOM 1864 N ASP A 189 -18.745 4.876 -45.571 1.00 10.88 N ATOM 1865 CA ASP A 189 -18.688 5.183 -44.137 1.00 11.15 C ATOM 1866 C ASP A 189 -18.635 3.900 -43.341 1.00 9.58 C ATOM 1867 O ASP A 189 -18.868 2.828 -43.873 1.00 9.93 O ATOM 1868 CB ASP A 189 -19.964 5.959 -43.737 1.00 11.23 C ATOM 1869 CG ASP A 189 -19.802 6.824 -42.480 1.00 12.84 C ATOM 1870 OD1 ASP A 189 -18.718 6.890 -41.856 1.00 13.77 O ATOM 1871 OD2 ASP A 189 -20.811 7.461 -42.115 1.00 13.84 O ATOM 1872 H ASP A 189 -18.855 3.888 -45.878 1.00 0.00 H ATOM 1873 N SER A 190 -18.380 4.033 -42.046 1.00 10.20 N ATOM 1874 CA SER A 190 -18.666 2.980 -41.088 1.00 9.32 C ATOM 1875 C SER A 190 -20.170 2.893 -40.900 1.00 10.08 C ATOM 1876 O SER A 190 -20.905 3.812 -41.247 1.00 12.34 O ATOM 1877 CB SER A 190 -18.026 3.275 -39.730 1.00 9.15 C ATOM 1878 OG SER A 190 -16.607 3.212 -39.790 1.00 12.06 O ATOM 1879 HG SER A 190 -16.275 3.879 -40.442 1.00 0.00 H ATOM 1880 H SER A 190 -17.961 4.922 -41.705 1.00 0.00 H ATOM 1881 N CYS A 191 -20.605 1.784 -40.321 1.00 10.54 N ATOM 1882 CA CYS A 191 -21.986 1.628 -39.911 1.00 9.60 C ATOM 1883 C CYS A 191 -22.080 0.697 -38.703 1.00 10.10 C ATOM 1884 O CYS A 191 -21.071 0.188 -38.204 1.00 11.13 O ATOM 1885 CB CYS A 191 -22.828 1.133 -41.085 1.00 10.27 C ATOM 1886 SG CYS A 191 -24.596 1.496 -40.949 1.00 13.73 S ATOM 1887 H CYS A 191 -19.937 1.004 -40.156 1.00 0.00 H ATOM 1888 N GLN A 192 -23.303 0.502 -38.227 1.00 10.57 N ATOM 1889 CA GLN A 192 -23.608 -0.423 -37.139 1.00 9.11 C ATOM 1890 C GLN A 192 -22.966 -1.770 -37.417 1.00 10.12 C ATOM 1891 O GLN A 192 -23.154 -2.325 -38.501 1.00 10.37 O ATOM 1892 CB GLN A 192 -25.137 -0.606 -37.044 1.00 8.89 C ATOM 1893 CG GLN A 192 -25.596 -1.599 -35.990 1.00 11.24 C ATOM 1894 CD GLN A 192 -25.450 -1.091 -34.566 1.00 10.66 C ATOM 1895 OE1 GLN A 192 -25.093 0.071 -34.318 1.00 12.35 O ATOM 1896 NE2 GLN A 192 -25.747 -1.958 -33.615 1.00 12.98 N ATOM 1897 HE22 GLN A 192 -26.042 -2.923 -33.865 1.00 0.00 H ATOM 1898 HE21 GLN A 192 -25.685 -1.675 -32.616 1.00 0.00 H ATOM 1899 H GLN A 192 -24.087 1.037 -38.652 1.00 0.00 H ATOM 1900 N GLY A 193 -22.182 -2.257 -36.442 1.00 10.19 N ATOM 1901 CA GLY A 193 -21.418 -3.494 -36.557 1.00 8.07 C ATOM 1902 C GLY A 193 -19.928 -3.262 -36.781 1.00 9.29 C ATOM 1903 O GLY A 193 -19.113 -4.148 -36.521 1.00 10.90 O ATOM 1904 H GLY A 193 -22.116 -1.721 -35.553 1.00 0.00 H ATOM 1905 N ASP A 194 -19.574 -2.069 -37.260 1.00 9.56 N ATOM 1906 CA ASP A 194 -18.164 -1.695 -37.469 1.00 9.40 C ATOM 1907 C ASP A 194 -17.467 -1.147 -36.225 1.00 9.04 C ATOM 1908 O ASP A 194 -16.220 -0.997 -36.222 1.00 9.82 O ATOM 1909 CB ASP A 194 -18.051 -0.675 -38.603 1.00 11.82 C ATOM 1910 CG ASP A 194 -18.377 -1.268 -39.949 1.00 10.59 C ATOM 1911 OD1 ASP A 194 -17.877 -2.382 -40.254 1.00 11.66 O ATOM 1912 OD2 ASP A 194 -19.139 -0.624 -40.708 1.00 11.85 O ATOM 1913 H ASP A 194 -20.317 -1.380 -37.494 1.00 0.00 H ATOM 1914 N SER A 195 -18.232 -0.863 -35.173 1.00 9.91 N ATOM 1915 CA SER A 195 -17.682 -0.312 -33.932 1.00 8.83 C ATOM 1916 C SER A 195 -16.523 -1.166 -33.409 1.00 9.93 C ATOM 1917 O SER A 195 -16.531 -2.403 -33.521 1.00 9.79 O ATOM 1918 CB SER A 195 -18.740 -0.219 -32.844 1.00 8.22 C ATOM 1919 OG SER A 195 -19.752 0.709 -33.192 1.00 9.88 O ATOM 1920 HG SER A 195 -20.425 0.749 -32.467 1.00 0.00 H ATOM 1921 H SER A 195 -19.255 -1.038 -35.234 1.00 0.00 H ATOM 1922 N GLY A 196 -15.529 -0.493 -32.839 1.00 10.63 N ATOM 1923 CA GLY A 196 -14.396 -1.167 -32.248 1.00 10.25 C ATOM 1924 C GLY A 196 -13.306 -1.437 -33.265 1.00 10.95 C ATOM 1925 O GLY A 196 -12.168 -1.697 -32.891 1.00 12.47 O ATOM 1926 H GLY A 196 -15.568 0.546 -32.818 1.00 0.00 H ATOM 1927 N GLY A 197 -13.656 -1.374 -34.546 1.00 10.82 N ATOM 1928 CA GLY A 197 -12.722 -1.629 -35.617 1.00 10.68 C ATOM 1929 C GLY A 197 -11.708 -0.517 -35.849 1.00 10.97 C ATOM 1930 O GLY A 197 -11.827 0.586 -35.307 1.00 10.89 O ATOM 1931 H GLY A 197 -14.639 -1.132 -34.785 1.00 0.00 H ATOM 1932 N PRO A 198 -10.718 -0.795 -36.697 1.00 10.82 N ATOM 1933 CA PRO A 198 -9.618 0.143 -36.909 1.00 10.15 C ATOM 1934 C PRO A 198 -9.831 1.192 -37.999 1.00 10.65 C ATOM 1935 O PRO A 198 -10.328 0.889 -39.081 1.00 10.95 O ATOM 1936 CB PRO A 198 -8.479 -0.778 -37.317 1.00 11.23 C ATOM 1937 CG PRO A 198 -9.153 -1.889 -38.044 1.00 10.15 C ATOM 1938 CD PRO A 198 -10.502 -2.064 -37.419 1.00 11.00 C ATOM 1939 N LEU A 199 -9.420 2.419 -37.683 1.00 10.41 N ATOM 1940 CA LEU A 199 -9.183 3.459 -38.654 1.00 11.06 C ATOM 1941 C LEU A 199 -7.659 3.526 -38.766 1.00 12.03 C ATOM 1942 O LEU A 199 -6.984 3.858 -37.793 1.00 13.72 O ATOM 1943 CB LEU A 199 -9.718 4.800 -38.160 1.00 15.42 C ATOM 1944 CG LEU A 199 -9.368 6.037 -38.995 1.00 17.68 C ATOM 1945 CD1 LEU A 199 -10.265 6.136 -40.213 1.00 19.03 C ATOM 1946 CD2 LEU A 199 -9.483 7.301 -38.154 1.00 19.70 C ATOM 1947 H LEU A 199 -9.261 2.640 -36.679 1.00 0.00 H ATOM 1948 N VAL A 200 -7.142 3.168 -39.935 1.00 12.26 N ATOM 1949 CA VAL A 200 -5.698 3.025 -40.160 1.00 11.92 C ATOM 1950 C VAL A 200 -5.209 4.063 -41.146 1.00 13.43 C ATOM 1951 O VAL A 200 -5.720 4.142 -42.267 1.00 13.81 O ATOM 1952 CB VAL A 200 -5.372 1.636 -40.749 1.00 11.72 C ATOM 1953 CG1 VAL A 200 -3.887 1.518 -41.115 1.00 9.69 C ATOM 1954 CG2 VAL A 200 -5.781 0.548 -39.777 1.00 16.26 C ATOM 1955 H VAL A 200 -7.789 2.980 -40.727 1.00 0.00 H ATOM 1956 N CYS A 201 -4.186 4.823 -40.744 1.00 15.18 N ATOM 1957 CA CYS A 201 -3.536 5.764 -41.647 1.00 14.85 C ATOM 1958 C CYS A 201 -2.080 5.371 -41.844 1.00 16.96 C ATOM 1959 O CYS A 201 -1.469 4.746 -40.974 1.00 18.98 O ATOM 1960 CB CYS A 201 -3.617 7.197 -41.117 1.00 20.27 C ATOM 1961 SG CYS A 201 -5.262 7.714 -40.583 1.00 23.02 S ATOM 1962 H CYS A 201 -3.846 4.741 -39.765 1.00 0.00 H ATOM 1963 N SER A 202 -1.550 5.741 -43.006 1.00 19.01 N ATOM 1964 CA SER A 202 -0.165 5.492 -43.353 1.00 20.43 C ATOM 1965 C SER A 202 0.683 6.690 -42.954 1.00 22.15 C ATOM 1966 O SER A 202 0.539 7.766 -43.520 1.00 24.20 O ATOM 1967 CB SER A 202 -0.024 5.253 -44.851 1.00 21.66 C ATOM 1968 OG SER A 202 1.312 4.906 -45.169 1.00 25.79 O ATOM 1969 HG SER A 202 1.916 5.643 -44.900 1.00 0.00 H ATOM 1970 H SER A 202 -2.155 6.230 -43.696 1.00 0.00 H ATOM 1971 N LEU A 203 1.566 6.500 -41.980 1.00 22.57 N ATOM 1972 CA LEU A 203 2.466 7.566 -41.562 1.00 33.61 C ATOM 1973 C LEU A 203 3.911 7.133 -41.781 1.00 28.28 C ATOM 1974 O LEU A 203 4.333 6.086 -41.296 1.00 27.94 O ATOM 1975 CB LEU A 203 2.199 7.964 -40.109 1.00 45.18 C ATOM 1976 CG LEU A 203 0.913 8.793 -39.935 1.00 37.17 C ATOM 1977 CD1 LEU A 203 -0.228 7.969 -39.360 1.00 36.82 C ATOM 1978 CD2 LEU A 203 1.162 10.012 -39.063 1.00 39.07 C ATOM 1979 H LEU A 203 1.615 5.575 -41.508 1.00 0.00 H ATOM 1980 N GLN A 204 4.649 7.940 -42.542 1.00 27.23 N ATOM 1981 CA GLN A 204 6.003 7.599 -42.990 1.00 26.89 C ATOM 1982 C GLN A 204 6.052 6.182 -43.578 1.00 29.38 C ATOM 1983 O GLN A 204 6.990 5.425 -43.333 1.00 33.53 O ATOM 1984 CB GLN A 204 7.018 7.745 -41.850 1.00 28.36 C ATOM 1985 CG GLN A 204 7.140 9.156 -41.272 1.00 29.96 C ATOM 1986 CD GLN A 204 6.126 9.469 -40.175 1.00 30.21 C ATOM 1987 OE1 GLN A 204 5.708 10.617 -40.019 1.00 27.09 O ATOM 1988 NE2 GLN A 204 5.744 8.457 -39.397 1.00 32.50 N ATOM 1989 HE22 GLN A 204 6.121 7.502 -39.563 1.00 0.00 H ATOM 1990 HE21 GLN A 204 5.068 8.622 -38.624 1.00 0.00 H ATOM 1991 H GLN A 204 4.246 8.854 -42.832 1.00 0.00 H ATOM 1992 N GLY A 205 5.024 5.826 -44.344 1.00 30.06 N ATOM 1993 CA GLY A 205 4.951 4.509 -44.972 1.00 32.41 C ATOM 1994 C GLY A 205 4.474 3.369 -44.082 1.00 27.47 C ATOM 1995 O GLY A 205 4.369 2.235 -44.548 1.00 29.11 O ATOM 1996 H GLY A 205 4.251 6.504 -44.500 1.00 0.00 H ATOM 1997 N ARG A 206 4.177 3.654 -42.815 1.00 25.00 N ATOM 1998 CA ARG A 206 3.778 2.620 -41.853 1.00 24.38 C ATOM 1999 C ARG A 206 2.275 2.653 -41.549 1.00 24.28 C ATOM 2000 O ARG A 206 1.715 3.704 -41.244 1.00 22.81 O ATOM 2001 CB ARG A 206 4.553 2.797 -40.550 1.00 29.82 C ATOM 2002 CG ARG A 206 4.497 1.593 -39.618 1.00 36.96 C ATOM 2003 CD ARG A 206 4.976 1.952 -38.219 1.00 40.07 C ATOM 2004 NE ARG A 206 6.267 2.642 -38.235 1.00 51.68 N ATOM 2005 CZ ARG A 206 7.457 2.046 -38.162 1.00 47.92 C ATOM 2006 NH1 ARG A 206 7.557 0.725 -38.060 1.00 60.13 N ATOM 2007 NH2 ARG A 206 8.561 2.781 -38.188 1.00 58.63 N ATOM 2008 HE ARG A 206 6.255 3.679 -38.309 1.00 0.00 H ATOM 2009 HH12 ARG A 206 8.494 0.277 -38.004 1.00 0.00 H ATOM 2010 HH11 ARG A 206 6.698 0.139 -38.036 1.00 0.00 H ATOM 2011 HH22 ARG A 206 9.493 2.322 -38.131 1.00 0.00 H ATOM 2012 HH21 ARG A 206 8.495 3.816 -38.265 1.00 0.00 H ATOM 2013 H ARG A 206 4.230 4.643 -42.497 1.00 0.00 H ATOM 2014 N MET A 207 1.637 1.489 -41.608 1.00 24.09 N ATOM 2015 CA MET A 207 0.246 1.347 -41.170 1.00 24.16 C ATOM 2016 C MET A 207 0.175 1.582 -39.659 1.00 20.40 C ATOM 2017 O MET A 207 0.860 0.909 -38.891 1.00 22.82 O ATOM 2018 CB MET A 207 -0.287 -0.045 -41.503 1.00 27.72 C ATOM 2019 CG MET A 207 -0.379 -0.346 -42.993 1.00 30.82 C ATOM 2020 SD MET A 207 -1.666 0.591 -43.833 1.00 34.61 S ATOM 2021 CE MET A 207 -1.584 -0.120 -45.473 1.00 33.87 C ATOM 2022 H MET A 207 2.139 0.655 -41.975 1.00 0.00 H ATOM 2023 N THR A 208 -0.651 2.536 -39.242 1.00 17.32 N ATOM 2024 CA THR A 208 -0.713 2.972 -37.846 1.00 14.75 C ATOM 2025 C THR A 208 -2.183 3.057 -37.389 1.00 14.93 C ATOM 2026 O THR A 208 -3.009 3.584 -38.114 1.00 14.43 O ATOM 2027 CB THR A 208 -0.053 4.358 -37.703 1.00 17.39 C ATOM 2028 OG1 THR A 208 1.236 4.355 -38.346 1.00 21.88 O ATOM 2029 CG2 THR A 208 0.088 4.754 -36.240 1.00 19.45 C ATOM 2030 HG1 THR A 208 1.124 4.143 -39.307 1.00 0.00 H ATOM 2031 H THR A 208 -1.279 2.991 -39.935 1.00 0.00 H ATOM 2032 N LEU A 209 -2.487 2.536 -36.201 1.00 13.60 N ATOM 2033 CA LEU A 209 -3.849 2.589 -35.635 1.00 13.50 C ATOM 2034 C LEU A 209 -4.188 3.994 -35.121 1.00 14.34 C ATOM 2035 O LEU A 209 -3.865 4.358 -33.991 1.00 16.79 O ATOM 2036 CB LEU A 209 -4.018 1.561 -34.502 1.00 14.06 C ATOM 2037 CG LEU A 209 -5.439 1.459 -33.927 1.00 14.87 C ATOM 2038 CD1 LEU A 209 -6.355 0.825 -34.956 1.00 16.49 C ATOM 2039 CD2 LEU A 209 -5.478 0.665 -32.629 1.00 16.52 C ATOM 2040 H LEU A 209 -1.735 2.074 -35.651 1.00 0.00 H ATOM 2041 N THR A 210 -4.883 4.765 -35.944 1.00 12.39 N ATOM 2042 CA THR A 210 -5.147 6.161 -35.644 1.00 12.12 C ATOM 2043 C THR A 210 -6.469 6.335 -34.898 1.00 12.06 C ATOM 2044 O THR A 210 -6.598 7.201 -34.045 1.00 13.04 O ATOM 2045 CB THR A 210 -5.148 6.989 -36.938 1.00 13.34 C ATOM 2046 OG1 THR A 210 -3.872 6.860 -37.597 1.00 16.20 O ATOM 2047 CG2 THR A 210 -5.408 8.458 -36.655 1.00 15.23 C ATOM 2048 HG1 THR A 210 -3.157 7.189 -36.996 1.00 0.00 H ATOM 2049 H THR A 210 -5.249 4.360 -36.829 1.00 0.00 H ATOM 2050 N GLY A 211 -7.438 5.494 -35.214 1.00 10.49 N ATOM 2051 CA GLY A 211 -8.769 5.612 -34.612 1.00 9.68 C ATOM 2052 C GLY A 211 -9.420 4.268 -34.355 1.00 11.13 C ATOM 2053 O GLY A 211 -9.022 3.247 -34.920 1.00 12.04 O ATOM 2054 H GLY A 211 -7.253 4.736 -35.901 1.00 0.00 H ATOM 2055 N ILE A 212 -10.445 4.293 -33.505 1.00 10.58 N ATOM 2056 CA ILE A 212 -11.281 3.143 -33.231 1.00 9.59 C ATOM 2057 C ILE A 212 -12.703 3.582 -33.531 1.00 9.27 C ATOM 2058 O ILE A 212 -13.139 4.606 -33.024 1.00 9.96 O ATOM 2059 CB ILE A 212 -11.182 2.706 -31.753 1.00 11.72 C ATOM 2060 CG1 ILE A 212 -9.765 2.222 -31.435 1.00 12.88 C ATOM 2061 CG2 ILE A 212 -12.187 1.604 -31.436 1.00 12.37 C ATOM 2062 CD1 ILE A 212 -9.493 2.049 -29.959 1.00 15.39 C ATOM 2063 H ILE A 212 -10.656 5.185 -33.013 1.00 0.00 H ATOM 2064 N VAL A 213 -13.412 2.813 -34.357 1.00 9.40 N ATOM 2065 CA VAL A 213 -14.771 3.180 -34.792 1.00 8.35 C ATOM 2066 C VAL A 213 -15.657 3.328 -33.542 1.00 9.99 C ATOM 2067 O VAL A 213 -15.757 2.392 -32.764 1.00 10.87 O ATOM 2068 CB VAL A 213 -15.402 2.122 -35.727 1.00 8.09 C ATOM 2069 CG1 VAL A 213 -16.817 2.540 -36.133 1.00 7.22 C ATOM 2070 CG2 VAL A 213 -14.565 1.881 -36.978 1.00 10.69 C ATOM 2071 H VAL A 213 -12.993 1.927 -34.705 1.00 0.00 H ATOM 2072 N SER A 214 -16.297 4.488 -33.364 1.00 9.10 N ATOM 2073 CA SER A 214 -17.033 4.785 -32.108 1.00 8.61 C ATOM 2074 C SER A 214 -18.524 5.132 -32.261 1.00 9.20 C ATOM 2075 O SER A 214 -19.367 4.485 -31.666 1.00 9.52 O ATOM 2076 CB SER A 214 -16.334 5.913 -31.355 1.00 9.70 C ATOM 2077 OG SER A 214 -16.960 6.170 -30.111 1.00 10.32 O ATOM 2078 HG SER A 214 -16.930 5.353 -29.553 1.00 0.00 H ATOM 2079 H SER A 214 -16.279 5.199 -34.123 1.00 0.00 H ATOM 2080 N TRP A 215 -18.840 6.168 -33.026 1.00 9.44 N ATOM 2081 CA TRP A 215 -20.228 6.576 -33.215 1.00 8.88 C ATOM 2082 C TRP A 215 -20.427 7.471 -34.427 1.00 9.07 C ATOM 2083 O TRP A 215 -19.477 7.988 -35.010 1.00 9.71 O ATOM 2084 CB TRP A 215 -20.746 7.289 -31.966 1.00 10.02 C ATOM 2085 CG TRP A 215 -20.031 8.576 -31.626 1.00 10.68 C ATOM 2086 CD1 TRP A 215 -18.860 8.711 -30.921 1.00 11.60 C ATOM 2087 CD2 TRP A 215 -20.437 9.906 -31.973 1.00 11.90 C ATOM 2088 NE1 TRP A 215 -18.528 10.037 -30.801 1.00 12.33 N ATOM 2089 CE2 TRP A 215 -19.481 10.792 -31.434 1.00 12.67 C ATOM 2090 CE3 TRP A 215 -21.516 10.437 -32.680 1.00 12.10 C ATOM 2091 CZ2 TRP A 215 -19.573 12.180 -31.588 1.00 12.88 C ATOM 2092 CZ3 TRP A 215 -21.603 11.817 -32.832 1.00 12.81 C ATOM 2093 CH2 TRP A 215 -20.640 12.669 -32.282 1.00 12.80 C ATOM 2094 HE1 TRP A 215 -17.690 10.409 -30.310 1.00 0.00 H ATOM 2095 H TRP A 215 -18.083 6.700 -33.501 1.00 0.00 H ATOM 2096 N GLY A 216 -21.695 7.629 -34.798 1.00 8.43 N ATOM 2097 CA GLY A 216 -22.096 8.569 -35.814 1.00 7.11 C ATOM 2098 C GLY A 216 -23.591 8.761 -35.688 1.00 8.72 C ATOM 2099 O GLY A 216 -24.279 7.955 -35.052 1.00 9.06 O ATOM 2100 H GLY A 216 -22.426 7.051 -34.336 1.00 0.00 H ATOM 2101 N ARG A 217 -24.090 9.838 -36.279 1.00 8.89 N ATOM 2102 CA ARG A 217 -25.535 10.044 -36.353 1.00 8.24 C ATOM 2103 C ARG A 217 -26.200 9.022 -37.271 1.00 10.09 C ATOM 2104 O ARG A 217 -27.371 8.645 -37.058 1.00 11.02 O ATOM 2105 CB ARG A 217 -25.848 11.469 -36.816 1.00 7.71 C ATOM 2106 CG ARG A 217 -27.347 11.794 -36.939 1.00 6.92 C ATOM 2107 CD ARG A 217 -28.079 11.616 -35.623 1.00 7.62 C ATOM 2108 NE ARG A 217 -29.497 11.931 -35.750 1.00 10.03 N ATOM 2109 CZ ARG A 217 -30.432 11.098 -36.203 1.00 11.95 C ATOM 2110 NH1 ARG A 217 -31.696 11.504 -36.248 1.00 13.49 N ATOM 2111 NH2 ARG A 217 -30.125 9.872 -36.612 1.00 15.01 N ATOM 2112 HE ARG A 217 -29.803 12.883 -35.464 1.00 0.00 H ATOM 2113 HH12 ARG A 217 -32.436 10.863 -36.600 1.00 0.00 H ATOM 2114 HH11 ARG A 217 -31.946 12.463 -35.932 1.00 0.00 H ATOM 2115 HH22 ARG A 217 -30.872 9.238 -36.962 1.00 0.00 H ATOM 2116 HH21 ARG A 217 -29.138 9.546 -36.582 1.00 0.00 H ATOM 2117 H ARG A 217 -23.447 10.543 -36.694 1.00 0.00 H ATOM 2118 N GLY A 218 -25.472 8.590 -38.292 1.00 12.12 N ATOM 2119 CA GLY A 218 -25.983 7.648 -39.278 1.00 12.40 C ATOM 2120 C GLY A 218 -24.849 6.930 -39.965 1.00 13.16 C ATOM 2121 O GLY A 218 -23.780 6.773 -39.389 1.00 13.80 O ATOM 2122 H GLY A 218 -24.497 8.938 -38.392 1.00 0.00 H ATOM 2123 N CYS A 220 -25.101 6.476 -41.189 1.00 14.81 N ATOM 2124 CA CYS A 220 -24.105 5.798 -41.998 1.00 13.78 C ATOM 2125 C CYS A 220 -24.133 6.444 -43.376 1.00 12.77 C ATOM 2126 O CYS A 220 -25.148 6.400 -44.054 1.00 16.08 O ATOM 2127 CB CYS A 220 -24.418 4.303 -42.089 1.00 14.66 C ATOM 2128 SG CYS A 220 -24.669 3.494 -40.488 1.00 13.93 S ATOM 2129 H CYS A 220 -26.053 6.613 -41.584 1.00 0.00 H ATOM 2130 N ALA A 221 -23.029 7.079 -43.770 1.00 11.06 N ATOM 2131 CA ALA A 221 -22.940 7.779 -45.056 1.00 11.61 C ATOM 2132 C ALA A 221 -24.051 8.823 -45.148 1.00 11.31 C ATOM 2133 O ALA A 221 -24.993 8.708 -45.955 1.00 12.91 O ATOM 2134 CB ALA A 221 -22.982 6.796 -46.221 1.00 11.78 C ATOM 2135 H ALA A 221 -22.200 7.078 -43.142 1.00 0.00 H ATOM 2136 N LEU A 222 -23.925 9.818 -44.276 1.00 12.33 N ATOM 2137 CA LEU A 222 -24.966 10.804 -44.012 1.00 12.86 C ATOM 2138 C LEU A 222 -24.353 12.201 -44.116 1.00 14.15 C ATOM 2139 O LEU A 222 -23.413 12.530 -43.397 1.00 13.18 O ATOM 2140 CB LEU A 222 -25.554 10.578 -42.607 1.00 13.26 C ATOM 2141 CG LEU A 222 -26.628 11.545 -42.101 1.00 12.58 C ATOM 2142 CD1 LEU A 222 -27.818 11.532 -43.048 1.00 12.95 C ATOM 2143 CD2 LEU A 222 -27.053 11.215 -40.671 1.00 12.49 C ATOM 2144 H LEU A 222 -23.031 9.898 -43.751 1.00 0.00 H ATOM 2145 N LYS A 223 -24.903 13.011 -45.015 1.00 15.62 N ATOM 2146 CA LYS A 223 -24.415 14.362 -45.272 1.00 15.91 C ATOM 2147 C LYS A 223 -24.223 15.181 -43.990 1.00 13.46 C ATOM 2148 O LYS A 223 -25.130 15.261 -43.141 1.00 13.67 O ATOM 2149 CB LYS A 223 -25.381 15.072 -46.218 1.00 18.23 C ATOM 2150 CG LYS A 223 -24.952 16.443 -46.700 1.00 21.83 C ATOM 2151 CD LYS A 223 -25.717 16.801 -47.974 1.00 25.91 C ATOM 2152 CE LYS A 223 -26.144 18.257 -48.001 1.00 23.17 C ATOM 2153 NZ LYS A 223 -25.000 19.198 -48.113 1.00 32.74 N ATOM 2154 HZ1 LYS A 223 -24.366 19.070 -47.298 1.00 0.00 H ATOM 2155 HZ2 LYS A 223 -24.479 19.006 -48.992 1.00 0.00 H ATOM 2156 HZ3 LYS A 223 -25.356 20.175 -48.126 1.00 0.00 H ATOM 2157 H LYS A 223 -25.719 12.666 -45.560 1.00 0.00 H ATOM 2158 N ASP A 223A -23.024 15.764 -43.867 1.00 12.73 N ATOM 2159 CA ASP A 223A -22.635 16.644 -42.757 1.00 12.46 C ATOM 2160 C ASP A 223A -22.640 15.946 -41.395 1.00 12.21 C ATOM 2161 O ASP A 223A -22.721 16.599 -40.353 1.00 13.22 O ATOM 2162 CB ASP A 223A -23.528 17.901 -42.725 1.00 14.26 C ATOM 2163 CG ASP A 223A -23.339 18.787 -43.940 1.00 17.38 C ATOM 2164 OD1 ASP A 223A -22.335 18.623 -44.669 1.00 16.42 O ATOM 2165 OD2 ASP A 223A -24.201 19.664 -44.165 1.00 25.26 O ATOM 2166 H ASP A 223A -22.319 15.581 -44.609 1.00 0.00 H ATOM 2167 N LYS A 224 -22.553 14.618 -41.419 1.00 10.22 N ATOM 2168 CA LYS A 224 -22.504 13.806 -40.207 1.00 10.64 C ATOM 2169 C LYS A 224 -21.418 12.737 -40.391 1.00 11.33 C ATOM 2170 O LYS A 224 -21.696 11.603 -40.757 1.00 11.53 O ATOM 2171 CB LYS A 224 -23.871 13.176 -39.908 1.00 10.20 C ATOM 2172 CG LYS A 224 -25.002 14.180 -39.668 1.00 11.60 C ATOM 2173 CD LYS A 224 -24.848 14.919 -38.343 1.00 12.86 C ATOM 2174 CE LYS A 224 -25.839 16.057 -38.195 1.00 13.50 C ATOM 2175 NZ LYS A 224 -25.468 17.253 -38.991 1.00 13.17 N ATOM 2176 HZ1 LYS A 224 -24.538 17.600 -38.681 1.00 0.00 H ATOM 2177 HZ2 LYS A 224 -25.426 16.998 -39.998 1.00 0.00 H ATOM 2178 HZ3 LYS A 224 -26.181 17.997 -38.850 1.00 0.00 H ATOM 2179 H LYS A 224 -22.518 14.138 -42.341 1.00 0.00 H ATOM 2180 N PRO A 225 -20.157 13.113 -40.148 1.00 11.68 N ATOM 2181 CA PRO A 225 -19.054 12.159 -40.286 1.00 12.31 C ATOM 2182 C PRO A 225 -19.134 10.949 -39.364 1.00 12.90 C ATOM 2183 O PRO A 225 -19.906 10.942 -38.401 1.00 13.28 O ATOM 2184 CB PRO A 225 -17.815 12.992 -39.924 1.00 12.50 C ATOM 2185 CG PRO A 225 -18.209 14.404 -40.162 1.00 13.01 C ATOM 2186 CD PRO A 225 -19.685 14.489 -39.914 1.00 13.12 C ATOM 2187 N GLY A 226 -18.350 9.924 -39.689 1.00 11.48 N ATOM 2188 CA GLY A 226 -18.009 8.894 -38.733 1.00 12.40 C ATOM 2189 C GLY A 226 -17.113 9.503 -37.674 1.00 10.76 C ATOM 2190 O GLY A 226 -16.311 10.399 -37.971 1.00 11.05 O ATOM 2191 H GLY A 226 -17.973 9.862 -40.656 1.00 0.00 H ATOM 2192 N VAL A 227 -17.281 9.046 -36.437 1.00 10.87 N ATOM 2193 CA VAL A 227 -16.502 9.535 -35.305 1.00 10.86 C ATOM 2194 C VAL A 227 -15.755 8.373 -34.673 1.00 10.83 C ATOM 2195 O VAL A 227 -16.310 7.299 -34.428 1.00 10.63 O ATOM 2196 CB VAL A 227 -17.352 10.250 -34.237 1.00 11.79 C ATOM 2197 CG1 VAL A 227 -16.436 10.963 -33.246 1.00 11.93 C ATOM 2198 CG2 VAL A 227 -18.277 11.254 -34.897 1.00 12.47 C ATOM 2199 H VAL A 227 -17.997 8.310 -36.270 1.00 0.00 H ATOM 2200 N TYR A 228 -14.478 8.625 -34.424 1.00 11.35 N ATOM 2201 CA TYR A 228 -13.522 7.612 -34.011 1.00 11.27 C ATOM 2202 C TYR A 228 -12.831 8.065 -32.735 1.00 11.13 C ATOM 2203 O TYR A 228 -12.547 9.255 -32.556 1.00 12.69 O ATOM 2204 CB TYR A 228 -12.499 7.402 -35.125 1.00 11.66 C ATOM 2205 CG TYR A 228 -13.121 6.975 -36.432 1.00 11.29 C ATOM 2206 CD1 TYR A 228 -13.746 7.904 -37.271 1.00 11.50 C ATOM 2207 CD2 TYR A 228 -13.133 5.640 -36.815 1.00 12.43 C ATOM 2208 CE1 TYR A 228 -14.335 7.514 -38.462 1.00 11.58 C ATOM 2209 CE2 TYR A 228 -13.729 5.241 -37.998 1.00 12.91 C ATOM 2210 CZ TYR A 228 -14.332 6.180 -38.815 1.00 12.75 C ATOM 2211 OH TYR A 228 -14.929 5.786 -39.984 1.00 15.03 O ATOM 2212 HH TYR A 228 -15.308 6.577 -40.443 1.00 0.00 H ATOM 2213 H TYR A 228 -14.141 9.603 -34.530 1.00 0.00 H ATOM 2214 N THR A 229 -12.576 7.119 -31.844 1.00 10.37 N ATOM 2215 CA THR A 229 -11.769 7.391 -30.667 1.00 11.19 C ATOM 2216 C THR A 229 -10.346 7.685 -31.167 1.00 11.92 C ATOM 2217 O THR A 229 -9.790 6.926 -31.963 1.00 12.86 O ATOM 2218 CB THR A 229 -11.828 6.219 -29.667 1.00 10.96 C ATOM 2219 OG1 THR A 229 -13.191 6.036 -29.231 1.00 12.82 O ATOM 2220 CG2 THR A 229 -10.949 6.491 -28.461 1.00 14.24 C ATOM 2221 HG1 THR A 229 -13.233 5.284 -28.589 1.00 0.00 H ATOM 2222 H THR A 229 -12.961 6.164 -31.990 1.00 0.00 H ATOM 2223 N ARG A 230 -9.785 8.808 -30.731 1.00 15.98 N ATOM 2224 CA ARG A 230 -8.438 9.217 -31.157 1.00 13.40 C ATOM 2225 C ARG A 230 -7.380 8.504 -30.303 1.00 13.55 C ATOM 2226 O ARG A 230 -7.094 8.908 -29.177 1.00 12.60 O ATOM 2227 CB ARG A 230 -8.299 10.734 -31.046 1.00 14.23 C ATOM 2228 CG ARG A 230 -7.041 11.326 -31.663 1.00 15.64 C ATOM 2229 CD ARG A 230 -7.045 12.837 -31.441 1.00 20.00 C ATOM 2230 NE ARG A 230 -6.022 13.538 -32.208 1.00 24.91 N ATOM 2231 CZ ARG A 230 -5.864 14.860 -32.218 1.00 31.75 C ATOM 2232 NH1 ARG A 230 -6.659 15.643 -31.494 1.00 35.16 N ATOM 2233 NH2 ARG A 230 -4.903 15.402 -32.953 1.00 43.13 N ATOM 2234 HE ARG A 230 -5.372 12.967 -32.786 1.00 0.00 H ATOM 2235 HH12 ARG A 230 -6.527 16.674 -31.509 1.00 0.00 H ATOM 2236 HH11 ARG A 230 -7.413 15.224 -30.913 1.00 0.00 H ATOM 2237 HH22 ARG A 230 -4.776 16.434 -32.964 1.00 0.00 H ATOM 2238 HH21 ARG A 230 -4.276 14.795 -33.519 1.00 0.00 H ATOM 2239 H ARG A 230 -10.313 9.414 -30.071 1.00 0.00 H ATOM 2240 N VAL A 231 -6.813 7.433 -30.847 1.00 12.26 N ATOM 2241 CA VAL A 231 -5.960 6.519 -30.072 1.00 12.82 C ATOM 2242 C VAL A 231 -4.734 7.214 -29.453 1.00 13.85 C ATOM 2243 O VAL A 231 -4.311 6.883 -28.332 1.00 13.57 O ATOM 2244 CB VAL A 231 -5.533 5.318 -30.954 1.00 11.92 C ATOM 2245 CG1 VAL A 231 -4.541 4.416 -30.244 1.00 14.79 C ATOM 2246 CG2 VAL A 231 -6.769 4.519 -31.377 1.00 9.39 C ATOM 2247 H VAL A 231 -6.978 7.234 -31.854 1.00 0.00 H ATOM 2248 N SER A 232 -4.192 8.202 -30.153 1.00 13.06 N ATOM 2249 CA SER A 232 -2.969 8.876 -29.676 1.00 15.28 C ATOM 2250 C SER A 232 -3.219 9.688 -28.407 1.00 16.30 C ATOM 2251 O SER A 232 -2.271 10.074 -27.730 1.00 22.01 O ATOM 2252 CB SER A 232 -2.333 9.743 -30.774 1.00 16.87 C ATOM 2253 OG SER A 232 -3.120 10.871 -31.096 1.00 17.56 O ATOM 2254 HG SER A 232 -4.007 10.572 -31.418 1.00 0.00 H ATOM 2255 H SER A 232 -4.633 8.504 -31.045 1.00 0.00 H ATOM 2256 N HIS A 233 -4.490 9.927 -28.071 1.00 15.95 N ATOM 2257 CA HIS A 233 -4.822 10.630 -26.844 1.00 14.96 C ATOM 2258 C HIS A 233 -5.159 9.694 -25.685 1.00 15.26 C ATOM 2259 O HIS A 233 -5.586 10.154 -24.625 1.00 19.82 O ATOM 2260 CB HIS A 233 -5.926 11.668 -27.115 1.00 17.47 C ATOM 2261 CG HIS A 233 -5.436 12.852 -27.893 1.00 21.34 C ATOM 2262 ND1 HIS A 233 -5.626 14.152 -27.479 1.00 25.93 N ATOM 2263 CD2 HIS A 233 -4.695 12.925 -29.025 1.00 26.47 C ATOM 2264 CE1 HIS A 233 -5.061 14.977 -28.342 1.00 30.97 C ATOM 2265 NE2 HIS A 233 -4.488 14.258 -29.291 1.00 31.71 N ATOM 2266 H HIS A 233 -5.254 9.604 -28.698 1.00 0.00 H ATOM 2267 N PHE A 234 -4.919 8.391 -25.870 1.00 13.06 N ATOM 2268 CA PHE A 234 -5.136 7.387 -24.819 1.00 12.61 C ATOM 2269 C PHE A 234 -3.914 6.505 -24.558 1.00 13.94 C ATOM 2270 O PHE A 234 -4.031 5.427 -23.964 1.00 14.42 O ATOM 2271 CB PHE A 234 -6.349 6.495 -25.157 1.00 9.44 C ATOM 2272 CG PHE A 234 -7.665 7.215 -25.093 1.00 11.05 C ATOM 2273 CD1 PHE A 234 -8.164 7.855 -26.209 1.00 11.28 C ATOM 2274 CD2 PHE A 234 -8.393 7.262 -23.911 1.00 11.07 C ATOM 2275 CE1 PHE A 234 -9.378 8.527 -26.163 1.00 13.23 C ATOM 2276 CE2 PHE A 234 -9.607 7.945 -23.851 1.00 12.15 C ATOM 2277 CZ PHE A 234 -10.097 8.571 -24.983 1.00 15.50 C ATOM 2278 H PHE A 234 -4.564 8.076 -26.795 1.00 0.00 H ATOM 2279 N LEU A 235 -2.733 6.950 -24.973 1.00 15.15 N ATOM 2280 CA LEU A 235 -1.551 6.107 -24.840 1.00 16.98 C ATOM 2281 C LEU A 235 -1.233 5.775 -23.380 1.00 16.38 C ATOM 2282 O LEU A 235 -0.897 4.633 -23.080 1.00 19.41 O ATOM 2283 CB LEU A 235 -0.350 6.712 -25.578 1.00 19.21 C ATOM 2284 CG LEU A 235 -0.535 6.750 -27.102 1.00 20.98 C ATOM 2285 CD1 LEU A 235 0.567 7.569 -27.760 1.00 23.67 C ATOM 2286 CD2 LEU A 235 -0.590 5.353 -27.706 1.00 20.39 C ATOM 2287 H LEU A 235 -2.652 7.898 -25.392 1.00 0.00 H ATOM 2288 N PRO A 236 -1.350 6.755 -22.468 1.00 17.38 N ATOM 2289 CA PRO A 236 -1.093 6.403 -21.071 1.00 20.27 C ATOM 2290 C PRO A 236 -2.057 5.361 -20.531 1.00 18.12 C ATOM 2291 O PRO A 236 -1.629 4.453 -19.820 1.00 17.11 O ATOM 2292 CB PRO A 236 -1.247 7.738 -20.333 1.00 22.09 C ATOM 2293 CG PRO A 236 -0.903 8.765 -21.356 1.00 22.47 C ATOM 2294 CD PRO A 236 -1.415 8.217 -22.660 1.00 20.54 C ATOM 2295 N TRP A 237 -3.343 5.505 -20.864 1.00 15.97 N ATOM 2296 CA TRP A 237 -4.361 4.545 -20.466 1.00 15.94 C ATOM 2297 C TRP A 237 -4.033 3.152 -20.984 1.00 15.17 C ATOM 2298 O TRP A 237 -4.100 2.175 -20.238 1.00 16.27 O ATOM 2299 CB TRP A 237 -5.736 4.975 -20.982 1.00 16.40 C ATOM 2300 CG TRP A 237 -6.828 4.092 -20.488 1.00 16.98 C ATOM 2301 CD1 TRP A 237 -7.437 4.153 -19.270 1.00 18.39 C ATOM 2302 CD2 TRP A 237 -7.425 2.985 -21.182 1.00 16.75 C ATOM 2303 NE1 TRP A 237 -8.390 3.168 -19.170 1.00 18.72 N ATOM 2304 CE2 TRP A 237 -8.395 2.432 -20.326 1.00 15.97 C ATOM 2305 CE3 TRP A 237 -7.230 2.406 -22.443 1.00 16.75 C ATOM 2306 CZ2 TRP A 237 -9.174 1.331 -20.689 1.00 15.16 C ATOM 2307 CZ3 TRP A 237 -8.014 1.315 -22.806 1.00 15.10 C ATOM 2308 CH2 TRP A 237 -8.968 0.792 -21.932 1.00 14.63 C ATOM 2309 HE1 TRP A 237 -9.008 3.007 -18.349 1.00 0.00 H ATOM 2310 H TRP A 237 -3.626 6.332 -21.427 1.00 0.00 H ATOM 2311 N ILE A 238 -3.679 3.084 -22.267 1.00 13.57 N ATOM 2312 CA ILE A 238 -3.321 1.827 -22.922 1.00 15.26 C ATOM 2313 C ILE A 238 -2.108 1.187 -22.255 1.00 15.16 C ATOM 2314 O ILE A 238 -2.140 0.007 -21.912 1.00 15.78 O ATOM 2315 CB ILE A 238 -3.057 2.027 -24.433 1.00 15.77 C ATOM 2316 CG1 ILE A 238 -4.372 2.373 -25.155 1.00 16.29 C ATOM 2317 CG2 ILE A 238 -2.439 0.772 -25.043 1.00 18.28 C ATOM 2318 CD1 ILE A 238 -4.200 2.889 -26.571 1.00 16.85 C ATOM 2319 H ILE A 238 -3.656 3.961 -22.825 1.00 0.00 H ATOM 2320 N ARG A 239 -1.043 1.962 -22.064 1.00 15.77 N ATOM 2321 CA ARG A 239 0.167 1.420 -21.440 1.00 16.22 C ATOM 2322 C ARG A 239 -0.054 0.983 -19.986 1.00 17.27 C ATOM 2323 O ARG A 239 0.519 -0.013 -19.543 1.00 18.83 O ATOM 2324 CB ARG A 239 1.325 2.410 -21.550 1.00 19.44 C ATOM 2325 CG ARG A 239 1.797 2.569 -22.983 1.00 23.67 C ATOM 2326 CD ARG A 239 3.045 3.424 -23.076 1.00 28.62 C ATOM 2327 NE ARG A 239 2.730 4.839 -22.899 1.00 32.55 N ATOM 2328 CZ ARG A 239 2.852 5.788 -23.828 1.00 34.04 C ATOM 2329 NH1 ARG A 239 3.286 5.513 -25.058 1.00 31.17 N ATOM 2330 NH2 ARG A 239 2.522 7.038 -23.520 1.00 40.09 N ATOM 2331 HE ARG A 239 2.379 5.133 -21.965 1.00 0.00 H ATOM 2332 HH12 ARG A 239 3.371 6.274 -25.762 1.00 0.00 H ATOM 2333 HH11 ARG A 239 3.540 4.537 -25.314 1.00 0.00 H ATOM 2334 HH22 ARG A 239 2.611 7.790 -24.233 1.00 0.00 H ATOM 2335 HH21 ARG A 239 2.175 7.264 -22.566 1.00 0.00 H ATOM 2336 H ARG A 239 -1.070 2.959 -22.360 1.00 0.00 H ATOM 2337 N SER A 240 -0.890 1.708 -19.253 1.00 17.06 N ATOM 2338 CA SER A 240 -1.179 1.356 -17.866 1.00 20.66 C ATOM 2339 C SER A 240 -1.865 -0.007 -17.778 1.00 19.04 C ATOM 2340 O SER A 240 -1.597 -0.796 -16.871 1.00 23.11 O ATOM 2341 CB SER A 240 -2.027 2.438 -17.182 1.00 21.58 C ATOM 2342 OG SER A 240 -3.387 2.369 -17.581 1.00 26.76 O ATOM 2343 HG SER A 240 -3.449 2.497 -18.561 1.00 0.00 H ATOM 2344 H SER A 240 -1.347 2.542 -19.674 1.00 0.00 H ATOM 2345 N HIS A 241 -2.731 -0.299 -18.740 1.00 19.32 N ATOM 2346 CA HIS A 241 -3.556 -1.500 -18.655 1.00 23.83 C ATOM 2347 C HIS A 241 -2.991 -2.726 -19.370 1.00 27.70 C ATOM 2348 O HIS A 241 -3.388 -3.846 -19.045 1.00 33.87 O ATOM 2349 CB HIS A 241 -4.982 -1.188 -19.114 1.00 24.87 C ATOM 2350 CG HIS A 241 -5.759 -0.390 -18.114 1.00 23.71 C ATOM 2351 ND1 HIS A 241 -6.048 0.945 -18.283 1.00 25.83 N ATOM 2352 CD2 HIS A 241 -6.263 -0.734 -16.907 1.00 23.30 C ATOM 2353 CE1 HIS A 241 -6.722 1.384 -17.236 1.00 24.88 C ATOM 2354 NE2 HIS A 241 -6.869 0.384 -16.389 1.00 24.90 N ATOM 2355 H HIS A 241 -2.823 0.333 -19.561 1.00 0.00 H ATOM 2356 N THR A 242 -2.058 -2.537 -20.305 1.00 26.51 N ATOM 2357 CA THR A 242 -1.524 -3.664 -21.083 1.00 29.59 C ATOM 2358 C THR A 242 -0.309 -4.296 -20.415 1.00 37.71 C ATOM 2359 O THR A 242 -0.190 -4.261 -19.196 1.00 46.99 O ATOM 2360 CB THR A 242 -1.165 -3.256 -22.529 1.00 28.64 C ATOM 2361 OG1 THR A 242 -0.425 -2.034 -22.523 1.00 25.87 O ATOM 2362 CG2 THR A 242 -2.421 -3.067 -23.349 1.00 24.58 C ATOM 2363 OXT THR A 242 0.569 -4.866 -21.065 1.00 36.82 O ATOM 2364 HG1 THR A 242 -0.972 -1.320 -22.109 1.00 0.00 H ATOM 2365 H THR A 242 -1.703 -1.576 -20.486 1.00 0.00 H TER 2366 THR A 242 HETATM 2367 O HOH 1 -22.713 -10.960 -47.763 1.00 27.31 O HETATM 2368 O HOH 2 -25.311 -19.043 -33.494 1.00 25.83 O HETATM 2369 O HOH 3 -25.450 -5.649 -44.470 1.00 12.76 O HETATM 2370 O HOH 4 -22.742 -0.822 -49.174 1.00 20.16 O HETATM 2371 O HOH 5 -9.869 -20.157 -46.203 1.00 24.15 O HETATM 2372 O HOH 6 -31.996 -2.998 -46.674 1.00 13.45 O HETATM 2373 O HOH 7 -24.045 -9.626 -30.202 1.00 22.74 O HETATM 2374 O HOH 8 -29.480 6.916 -37.750 1.00 14.37 O HETATM 2375 O HOH 9 -13.931 -15.434 -23.215 1.00 16.82 O HETATM 2376 O HOH 10 2.027 -16.946 -25.718 1.00 28.34 O HETATM 2377 O HOH 11 -29.860 -21.056 -29.052 1.00 14.09 O HETATM 2378 O HOH 12 -4.685 8.743 -32.853 1.00 18.83 O HETATM 2379 O HOH 13 -6.267 -11.022 -37.502 1.00 16.01 O HETATM 2380 O HOH 14 -26.578 -4.655 -34.801 1.00 25.69 O HETATM 2381 O HOH 15 -14.952 -3.098 -37.451 1.00 11.41 O HETATM 2382 O HOH 16 -9.424 -1.339 -33.004 1.00 15.38 O HETATM 2383 O HOH 17 1.441 -9.009 -25.739 1.00 23.66 O HETATM 2384 O HOH 18 -30.017 -7.904 -44.496 1.00 22.97 O HETATM 2385 O HOH 19 -2.291 -17.864 -38.810 1.00 15.36 O HETATM 2386 O HOH 20 1.934 -1.467 -38.195 1.00 21.03 O HETATM 2387 O HOH 21 -21.587 -7.173 -26.087 1.00 19.77 O HETATM 2388 O HOH 22 -27.890 9.251 -45.828 1.00 17.61 O HETATM 2389 O HOH 23 -24.702 7.066 -31.730 1.00 18.03 O HETATM 2390 O HOH 24 -28.660 -19.283 -27.364 1.00 15.76 O HETATM 2391 O HOH 25 -16.730 -5.146 -37.461 1.00 9.51 O HETATM 2392 O HOH 26 -22.489 -4.480 -28.643 1.00 26.66 O HETATM 2393 O HOH 27 -10.149 -11.782 -37.710 1.00 15.50 O HETATM 2394 O HOH 28 -2.559 -17.017 -33.387 1.00 24.25 O HETATM 2395 O HOH 29 -17.916 8.035 -52.998 1.00 24.44 O HETATM 2396 O HOH 30 -21.570 -22.131 -28.432 1.00 14.39 O HETATM 2397 O HOH 31 -13.572 8.727 -48.976 1.00 23.64 O HETATM 2398 O HOH 32 1.383 -2.151 -31.490 1.00 20.37 O HETATM 2399 O HOH 33 -7.008 15.530 -25.473 1.00 35.75 O HETATM 2400 O HOH 34 -19.725 -15.844 -43.697 1.00 16.90 O HETATM 2401 O HOH 35 -4.864 8.217 -21.464 1.00 21.47 O HETATM 2402 O HOH 36 -1.814 9.996 -25.165 1.00 22.81 O HETATM 2403 O HOH 37 -19.096 -4.304 -43.600 1.00 12.69 O HETATM 2404 O HOH 38 -2.266 -21.590 -28.690 1.00 25.36 O HETATM 2405 O HOH 39 -21.234 10.003 -43.131 1.00 15.67 O HETATM 2406 O HOH 40 -1.795 -17.414 -42.304 1.00 26.75 O HETATM 2407 O HOH 41 -26.162 -10.740 -39.236 1.00 23.68 O HETATM 2408 O HOH 42 -10.268 2.811 -16.934 1.00 24.98 O HETATM 2409 O HOH 43 -5.841 -16.745 -41.490 1.00 18.67 O HETATM 2410 O HOH 44 -25.557 -9.339 -33.598 1.00 25.74 O HETATM 2411 O HOH 45 -27.059 -4.346 -48.739 1.00 22.30 O HETATM 2412 O HOH 46 -23.202 7.668 -19.700 1.00 27.65 O HETATM 2413 O HOH 47 -11.296 19.357 -42.506 1.00 32.76 O HETATM 2414 O HOH 48 -12.025 -17.192 -45.854 1.00 20.12 O HETATM 2415 O HOH 49 -22.647 -3.271 -24.876 1.00 29.86 O HETATM 2416 O HOH 50 -25.015 -7.517 -46.522 1.00 17.91 O HETATM 2417 O HOH 51 -19.245 9.543 -45.263 1.00 16.90 O HETATM 2418 O HOH 52 -18.256 -13.903 -49.419 1.00 24.95 O HETATM 2419 O HOH 53 -7.680 8.015 -20.467 1.00 20.63 O HETATM 2420 O HOH 54 -25.438 15.755 -24.254 1.00 22.31 O HETATM 2421 O HOH 55 -14.360 7.914 -27.642 1.00 22.23 O HETATM 2422 O HOH 56 -7.994 -21.670 -32.889 1.00 24.62 O HETATM 2423 O HOH 57 1.331 -3.904 -39.469 1.00 34.29 O HETATM 2424 O HOH 58 -2.785 10.196 -34.545 1.00 26.70 O HETATM 2425 O HOH 59 -29.453 -5.264 -36.285 1.00 27.82 O HETATM 2426 O HOH 60 -21.107 7.437 -39.520 1.00 12.59 O HETATM 2427 O HOH 61 -11.774 15.452 -36.089 1.00 26.83 O HETATM 2428 O HOH 62 -26.964 -6.974 -38.391 1.00 19.88 O HETATM 2429 O HOH 63 -29.841 -24.235 -25.475 1.00 23.75 O HETATM 2430 O HOH 64 -2.032 14.229 -30.545 1.00 59.08 O HETATM 2431 O HOH 65 -23.894 5.130 -50.409 1.00 44.76 O HETATM 2432 O HOH 66 -23.558 -7.354 -50.873 1.00 35.99 O HETATM 2433 O HOH 67 -13.207 -2.857 -17.003 1.00 22.27 O HETATM 2434 O HOH 68 0.789 8.627 -35.105 1.00 28.82 O HETATM 2435 O HOH 69 -12.285 19.217 -26.782 1.00 36.37 O HETATM 2436 O HOH 70 -22.933 18.634 -26.469 1.00 25.17 O HETATM 2437 O HOH 71 -26.426 -13.667 -22.195 1.00 36.16 O HETATM 2438 O HOH 72 -16.125 7.434 -41.563 1.00 14.64 O HETATM 2439 O HOH 73 -17.512 17.168 -48.017 1.00 26.42 O HETATM 2440 O HOH 74 -14.276 14.097 -46.117 1.00 26.14 O HETATM 2441 O HOH 75 -25.066 -12.152 -41.654 1.00 31.74 O HETATM 2442 O HOH 76 -8.916 -0.357 -41.715 1.00 20.08 O HETATM 2443 O HOH 77 -23.100 25.796 -38.722 1.00 40.13 O HETATM 2444 O HOH 78 -13.063 15.881 -33.606 1.00 24.72 O HETATM 2445 O HOH 79 3.039 -0.141 -31.326 1.00 29.27 O HETATM 2446 O HOH 80 3.527 -18.083 -37.884 1.00 30.84 O HETATM 2447 O HOH 81 -13.504 -16.685 -41.890 1.00 23.98 O HETATM 2448 O HOH 82 -23.193 -6.510 -33.274 1.00 17.97 O HETATM 2449 O HOH 83 -9.158 5.203 -15.575 1.00 42.63 O HETATM 2450 O HOH 84 -11.609 -1.059 -51.260 1.00 36.98 O HETATM 2451 O HOH 85 -19.119 -21.650 -29.507 1.00 25.63 O HETATM 2452 O HOH 86 0.571 5.103 -18.400 1.00 25.41 O HETATM 2453 O HOH 87 -12.867 -15.790 -19.695 1.00 32.97 O HETATM 2454 O HOH 88 -1.846 8.340 -36.193 1.00 26.53 O HETATM 2455 O HOH 89 -30.928 -12.493 -35.653 1.00 21.31 O HETATM 2456 O HOH 90 -22.219 14.528 -25.100 1.00 27.20 O HETATM 2457 O HOH 91 3.010 -8.894 -35.816 1.00 21.37 O HETATM 2458 O HOH 92 -13.902 -17.857 -21.639 1.00 39.08 O HETATM 2459 O HOH 93 -23.669 -8.187 -27.731 1.00 32.65 O HETATM 2460 O HOH 94 -26.140 19.358 -37.108 1.00 25.78 O HETATM 2461 O HOH 95 3.353 -14.415 -29.521 1.00 26.28 O HETATM 2462 O HOH 96 2.643 7.541 -45.477 1.00 39.82 O HETATM 2463 O HOH 97 -17.130 10.794 -19.783 1.00 34.08 O HETATM 2464 O HOH 98 -23.412 -5.597 -30.683 1.00 34.08 O HETATM 2465 O HOH 99 -23.041 9.705 -39.185 1.00 14.45 O HETATM 2466 O HOH 100 -22.477 -14.589 -36.703 1.00 28.80 O HETATM 2467 O HOH 101 -8.516 -14.703 -46.242 1.00 23.71 O HETATM 2468 O HOH 102 -17.158 1.605 -18.265 1.00 38.28 O HETATM 2469 O HOH 103 -16.679 14.595 -45.981 1.00 19.97 O HETATM 2470 O HOH 104 -19.292 -18.808 -22.766 1.00 29.65 O HETATM 2471 O HOH 105 -28.138 -9.578 -46.125 1.00 29.71 O HETATM 2472 O HOH 106 -19.654 20.526 -45.507 1.00 39.41 O HETATM 2473 O HOH 107 -3.915 10.567 -47.681 1.00 26.61 O HETATM 2474 O HOH 108 -17.407 3.267 -52.166 1.00 26.89 O HETATM 2475 O HOH 109 -8.813 -21.301 -28.526 1.00 30.47 O HETATM 2476 O HOH 110 -10.976 -5.598 -15.928 1.00 37.64 O HETATM 2477 O HOH 111 3.206 5.011 -29.236 1.00 31.86 O HETATM 2478 O HOH 112 -10.606 -0.025 -16.345 1.00 38.73 O HETATM 2479 O HOH 113 -1.218 -6.474 -45.562 1.00 44.58 O HETATM 2480 O HOH 114 -12.058 -8.533 -16.717 1.00 38.37 O HETATM 2481 O HOH 115 -1.637 8.956 -46.762 1.00 39.30 O HETATM 2482 O HOH 116 -2.493 -16.098 -46.615 1.00 39.71 O HETATM 2483 O HOH 117 -26.158 5.017 -46.110 1.00 23.58 O HETATM 2484 O HOH 118 -32.438 -2.391 -49.368 1.00 30.45 O HETATM 2485 O HOH 119 -26.875 6.272 -30.307 1.00 30.02 O HETATM 2486 O HOH 120 -19.919 -1.977 -51.253 1.00 25.16 O HETATM 2487 O HOH 121 -10.953 -1.861 -55.919 1.00 23.42 O HETATM 2488 O HOH 122 -24.888 -13.799 -39.456 1.00 41.64 O HETATM 2489 O HOH 123 -2.691 11.758 -23.134 1.00 30.55 O HETATM 2490 O HOH 124 -9.467 15.848 -34.240 1.00 33.25 O HETATM 2491 O HOH 125 -20.449 -2.385 -17.842 1.00 44.11 O HETATM 2492 O HOH 126 3.717 5.071 -37.246 1.00 30.59 O HETATM 2493 O HOH 127 -12.747 9.843 -26.736 1.00 25.89 O HETATM 2494 O HOH 128 -1.204 -17.886 -36.067 1.00 24.34 O HETATM 2495 O HOH 129 5.690 5.548 -39.020 1.00 28.80 O HETATM 2496 O HOH 130 -25.878 -10.700 -45.317 1.00 26.39 O HETATM 2497 O HOH 131 -5.286 14.299 -36.514 1.00 40.60 O HETATM 2498 O HOH 132 -29.826 -8.025 -36.198 1.00 40.63 O HETATM 2499 O HOH 133 -21.279 3.953 -52.185 1.00 45.80 O HETATM 2500 O HOH 134 -17.264 -21.208 -48.957 1.00 36.85 O HETATM 2501 O HOH 135 -18.001 -18.575 -33.039 1.00 31.92 O HETATM 2502 O HOH 136 -11.026 -24.540 -30.572 1.00 43.05 O HETATM 2503 O HOH 137 -6.809 -22.421 -38.737 1.00 47.25 O HETATM 2504 O HOH 138 -3.238 -18.787 -31.502 1.00 35.09 O HETATM 2505 O HOH 139 -21.745 -0.040 -16.422 1.00 45.32 O HETATM 2506 O HOH 140 -11.647 10.209 -50.437 1.00 37.37 O HETATM 2507 O HOH 141 -2.950 -14.094 -22.460 1.00 32.48 O HETATM 2508 O HOH 142 -9.231 -17.497 -20.516 1.00 43.37 O HETATM 2509 O HOH 143 -7.358 10.625 -22.501 1.00 41.84 O HETATM 2510 O HOH 144 -18.598 22.742 -44.209 1.00 46.13 O HETATM 2511 O HOH 145 -17.548 -23.920 -29.198 1.00 30.29 O HETATM 2512 O HOH 146 -26.119 19.833 -41.564 1.00 41.70 O HETATM 2513 O HOH 147 -19.630 16.371 -25.426 1.00 34.06 O HETATM 2514 O HOH 148 -8.727 -23.223 -30.489 1.00 36.57 O HETATM 2515 O HOH 149 -31.621 12.845 -28.112 1.00 36.23 O HETATM 2516 O HOH 150 -4.411 -8.029 -17.416 1.00 37.00 O HETATM 2517 O HOH 151 -23.117 -2.303 -51.490 1.00 42.48 O HETATM 2518 O HOH 152 -12.583 16.136 -46.167 1.00 33.30 O HETATM 2519 O HOH 153 -5.706 -20.084 -30.813 1.00 31.38 O HETATM 2520 O HOH 154 4.361 -10.460 -37.858 1.00 27.56 O HETATM 2521 O HOH 155 -16.131 11.357 -52.199 1.00 28.48 O HETATM 2522 O HOH 156 -4.224 16.552 -46.372 1.00 34.75 O HETATM 2523 O HOH 157 -6.582 3.979 -15.271 1.00 47.03 O HETATM 2524 O HOH 158 -22.938 -2.035 -29.566 1.00 20.42 O HETATM 2525 O HOH 159 -28.827 -12.847 -37.641 1.00 23.08 O HETATM 2526 O HOH 160 -29.866 -11.921 -47.086 1.00 26.16 O HETATM 2527 O HOH 161 -18.468 27.022 -36.654 1.00 45.75 O HETATM 2528 O HOH 162 0.081 12.193 -22.091 1.00 47.27 O HETATM 2529 O HOH 163 -19.369 27.443 -34.059 1.00 39.70 O HETATM 2530 O HOH 164 -21.695 28.952 -35.260 1.00 23.47 O HETATM 2531 O HOH 165 -28.603 -11.887 -33.938 1.00 23.58 O HETATM 2532 O HOH 166 -12.738 11.806 -19.457 1.00 43.77 O HETATM 2533 O HOH 167 -28.148 -9.974 -32.041 1.00 34.38 O HETATM 2534 O HOH 168 -3.012 7.451 -44.771 1.00 34.72 O HETATM 2535 O HOH 169 -11.266 -13.120 -13.242 1.00 45.97 O HETATM 2536 O HOH 170 -29.374 -5.917 -48.815 1.00 35.11 O HETATM 2537 O HOH 171 -16.152 25.552 -36.144 1.00 48.12 O HETATM 2538 O HOH 172 -24.861 -7.795 -18.382 1.00 36.37 O HETATM 2539 O HOH 173 -17.347 19.547 -26.388 1.00 32.35 O HETATM 2540 O HOH 174 -8.865 -4.633 -49.584 1.00 31.37 O HETATM 2541 O HOH 175 -28.501 -9.625 -37.758 1.00 31.11 O HETATM 2542 O HOH 176 -6.518 -16.524 -45.023 1.00 35.19 O HETATM 2543 O HOH 177 -22.269 -16.893 -35.094 1.00 26.54 O HETATM 2544 O HOH 178 4.151 2.316 -32.355 1.00 36.04 O HETATM 2545 O HOH 179 -1.025 -19.348 -29.798 1.00 33.63 O HETATM 2546 O HOH 180 3.178 7.149 -35.329 1.00 24.90 O HETATM 2547 O HOH 181 -20.374 12.783 -20.696 1.00 43.21 O HETATM 2548 O HOH 182 2.258 5.723 -47.862 1.00 41.49 O HETATM 2549 O HOH 183 -2.119 -7.481 -48.920 1.00 39.79 O HETATM 2550 O HOH 184 -10.816 -22.461 -37.119 1.00 47.91 O HETATM 2551 O HOH 185 2.632 -1.122 -42.180 1.00 41.97 O HETATM 2552 O HOH 186 -26.996 -8.051 -35.777 1.00 38.44 O HETATM 2553 O HOH 187 -8.585 -21.864 -35.594 1.00 37.79 O HETATM 2554 O HOH 188 -4.583 12.495 -34.495 1.00 33.42 O HETATM 2555 O HOH 189 -16.975 17.257 -45.140 1.00 31.84 O HETATM 2556 O HOH 190 6.766 16.674 -24.775 1.00 50.67 O HETATM 2557 O HOH 191 -10.480 10.263 -18.345 1.00 41.87 O HETATM 2558 O HOH 192 -15.806 4.286 -13.229 1.00 42.68 O HETATM 2559 O HOH 193 -14.668 18.573 -45.574 1.00 39.45 O HETATM 2560 O HOH 194 -26.714 6.559 -22.625 1.00 53.89 O HETATM 2561 O HOH 195 -22.414 -9.688 -18.974 1.00 41.34 O HETATM 2562 O HOH 196 -9.775 -22.530 -40.228 1.00 39.95 O HETATM 2563 O HOH 197 5.238 -0.277 -33.163 1.00 52.86 O HETATM 2564 O HOH 198 -28.522 10.046 -22.964 1.00 43.52 O HETATM 2565 O HOH 199 -23.507 -12.138 -19.420 1.00 42.42 O HETATM 2566 O HOH 200 -26.484 -12.347 -19.635 1.00 39.87 O HETATM 2567 O HOH 201 -28.878 -10.074 -25.957 1.00 34.86 O HETATM 2568 O HOH 202 0.573 -21.085 -31.296 1.00 26.37 O HETATM 2569 O HOH 203 -5.578 17.962 -30.029 1.00 34.35 O HETATM 2570 O HOH 204 -18.866 -18.081 -35.977 1.00 44.05 O HETATM 2571 O HOH 205 -31.627 1.359 -47.970 1.00 30.78 O HETATM 2572 O HOH 206 3.650 9.304 -27.906 1.00 39.05 O HETATM 2573 O HOH 207 -10.686 17.199 -44.435 1.00 29.44 O HETATM 2574 O HOH 208 -15.288 -22.426 -47.502 1.00 43.11 O HETATM 2575 O HOH 209 -16.354 -22.740 -43.195 1.00 38.26 O HETATM 2576 O HOH 210 -26.376 -13.672 -45.493 1.00 40.72 O HETATM 2577 O HOH 211 4.083 10.453 -43.441 1.00 34.52 O HETATM 2578 O HOH 212 8.716 4.100 -41.334 1.00 43.89 O HETATM 2579 O HOH 213 1.415 15.811 -34.417 1.00 34.77 O HETATM 2580 O HOH 214 -15.050 -18.242 -25.401 1.00 31.52 O HETATM 2581 O HOH 215 -14.410 3.356 -51.446 1.00 39.83 O HETATM 2582 O HOH 216 -15.852 8.743 -29.310 1.00 22.21 O HETATM 2583 O HOH 217 -8.452 23.964 -37.675 1.00 39.47 O HETATM 2584 O HOH 218 -14.856 25.058 -40.400 1.00 39.21 O HETATM 2585 O HOH 219 -10.109 23.078 -40.890 1.00 36.63 O HETATM 2586 O HOH 220 -37.695 -2.182 -38.658 1.00 18.21 O HETATM 2587 O HOH 221 -36.118 2.444 -43.499 1.00 15.78 O HETATM 2588 O HOH 222 -32.812 -6.438 -44.367 1.00 20.05 O HETATM 2589 O HOH 223 -25.522 -2.221 -30.786 1.00 17.09 O HETATM 2590 O HOH 224 -25.388 4.678 -28.516 1.00 25.64 O HETATM 2591 O HOH 225 -39.057 -0.588 -42.646 1.00 29.46 O HETATM 2592 O HOH 226 -33.691 5.851 -34.073 1.00 28.28 O HETATM 2593 O HOH 227 -38.708 2.039 -43.791 1.00 27.35 O HETATM 2594 O HOH 228 -33.357 8.611 -34.714 1.00 32.95 O HETATM 2595 O HOH 229 -34.195 6.210 -38.640 1.00 30.84 O HETATM 2596 O HOH 230 -26.867 -2.694 -27.083 1.00 48.17 O HETATM 2597 O HOH 231 -28.832 4.702 -30.190 1.00 31.80 O HETATM 2598 O HOH 232 -36.181 4.451 -35.740 1.00 52.48 O HETATM 2599 O HOH 233 -32.959 3.431 -29.852 1.00 43.77 O HETATM 2600 O HOH 234 -39.031 -4.775 -46.160 1.00 26.73 O HETATM 2601 O HOH 235 -34.836 -7.394 -48.002 1.00 34.53 O HETATM 2602 O HOH 236 -29.297 5.989 -26.220 1.00 42.34 O HETATM 2603 N GLY A 237 -31.500 -4.615 -26.185 1.00 0.24 N HETATM 2604 CA GLY A 237 -32.272 -3.698 -27.071 1.00 0.05 C HETATM 2605 C GLY A 237 -31.354 -2.882 -27.955 1.00 0.22 C HETATM 2606 O GLY A 237 -30.269 -3.339 -28.320 1.00 -0.39 O HETATM 2607 N GLY A 237 -31.782 -1.671 -28.295 1.00 -0.26 N HETATM 2608 CA GLY A 237 -30.993 -0.794 -29.152 1.00 0.14 C HETATM 2609 C GLY A 237 -30.822 0.595 -28.546 1.00 0.20 C HETATM 2610 O GLY A 237 -31.007 1.609 -29.222 1.00 -0.39 O HETATM 2611 N GLY A 237 -30.440 0.626 -27.271 1.00 -0.26 N HETATM 2612 CA GLY A 237 -30.084 1.878 -26.599 1.00 0.13 C HETATM 2613 C GLY A 237 -28.598 2.178 -26.790 1.00 0.20 C HETATM 2614 O GLY A 237 -28.180 3.333 -26.747 1.00 -0.39 O HETATM 2615 N GLY A 237 -27.797 1.136 -26.981 1.00 -0.26 N HETATM 2616 CA GLY A 237 -26.380 1.324 -27.300 1.00 0.13 C HETATM 2617 C GLY A 237 -26.109 0.825 -28.724 1.00 0.20 C HETATM 2618 O GLY A 237 -26.344 -0.341 -29.049 1.00 -0.39 O HETATM 2619 N GLY A 237 -25.661 1.746 -29.571 1.00 -0.26 N HETATM 2620 CA GLY A 237 -25.353 1.471 -30.973 1.00 0.15 C HETATM 2621 C GLY A 237 -24.186 2.318 -31.445 1.00 0.21 C HETATM 2622 O GLY A 237 -23.785 3.262 -30.771 1.00 -0.39 O HETATM 2623 N GLY A 237 -23.674 1.993 -32.630 1.00 -0.26 N HETATM 2624 CA GLY A 237 -22.832 2.915 -33.375 1.00 0.14 C HETATM 2625 C GLY A 237 -23.634 4.175 -33.685 1.00 0.21 C HETATM 2626 O GLY A 237 -23.166 5.292 -33.459 1.00 -0.39 O HETATM 2627 N GLY A 237 -24.841 3.979 -34.213 1.00 -0.26 N HETATM 2628 CA GLY A 237 -25.693 5.091 -34.639 1.00 0.14 C HETATM 2629 C GLY A 237 -27.145 4.721 -34.403 1.00 0.21 C HETATM 2630 O GLY A 237 -27.483 3.540 -34.471 1.00 -0.39 O HETATM 2631 N GLY A 237 -28.001 5.717 -34.103 1.00 -0.25 N HETATM 2632 CA GLY A 237 -29.431 5.444 -33.863 1.00 0.13 C HETATM 2633 C GLY A 237 -30.090 4.500 -34.873 1.00 0.21 C HETATM 2634 O GLY A 237 -29.922 4.666 -36.081 1.00 -0.39 O HETATM 2635 N GLY A 237 -30.854 3.512 -34.382 1.00 -0.25 N HETATM 2636 CA GLY A 237 -31.453 2.526 -35.280 1.00 0.13 C HETATM 2637 C GLY A 237 -32.300 3.114 -36.408 1.00 0.20 C HETATM 2638 O GLY A 237 -32.973 4.139 -36.231 1.00 -0.39 O HETATM 2639 N GLY A 237 -32.226 2.451 -37.554 1.00 -0.26 N HETATM 2640 CA GLY A 237 -32.998 2.770 -38.745 1.00 0.13 C HETATM 2641 C GLY A 237 -33.935 1.584 -39.056 1.00 0.21 C HETATM 2642 O GLY A 237 -33.516 0.427 -38.994 1.00 -0.39 O HETATM 2643 N GLY A 237 -35.230 1.853 -39.340 1.00 -0.25 N HETATM 2644 CA GLY A 237 -36.089 0.720 -39.680 1.00 0.13 C HETATM 2645 C GLY A 237 -35.587 -0.114 -40.862 1.00 0.20 C HETATM 2646 O GLY A 237 -35.103 0.430 -41.863 1.00 -0.39 O HETATM 2647 N GLY A 237 -35.696 -1.430 -40.729 1.00 -0.26 N HETATM 2648 CA GLY A 237 -35.150 -2.351 -41.720 1.00 0.14 C HETATM 2649 C GLY A 237 -36.017 -2.487 -42.979 1.00 0.20 C HETATM 2650 O GLY A 237 -37.269 -2.396 -42.926 1.00 -0.39 O HETATM 2651 N GLY A 237 -35.341 -2.720 -44.101 1.00 -0.26 N HETATM 2652 CA GLY A 237 -35.971 -3.061 -45.376 1.00 0.13 C HETATM 2653 C GLY A 237 -35.420 -4.372 -45.916 1.00 0.20 C HETATM 2654 O GLY A 237 -36.179 -5.213 -46.411 1.00 -0.39 O HETATM 2655 N GLY A 237 -34.100 -4.545 -45.824 1.00 -0.30 N HETATM 2656 H GLY A 237 -33.681 -5.388 -46.163 1.00 0.18 H HETATM 2657 H GLY A 237 -33.529 -3.832 -45.416 1.00 0.18 H HETATM 2658 CB GLY A 237 -35.739 -1.965 -46.420 1.00 -0.01 C HETATM 2659 CG GLY A 237 -36.335 -0.588 -46.150 1.00 -0.04 C HETATM 2660 CD1 GLY A 237 -35.861 0.404 -47.204 1.00 -0.06 C HETATM 2661 H GLY A 237 -36.297 1.393 -46.999 1.00 0.02 H HETATM 2662 H GLY A 237 -36.180 0.062 -48.200 1.00 0.02 H HETATM 2663 H GLY A 237 -34.764 0.474 -47.175 1.00 0.02 H HETATM 2664 CD2 GLY A 237 -37.853 -0.643 -46.112 1.00 -0.06 C HETATM 2665 H GLY A 237 -38.175 -1.364 -45.346 1.00 0.02 H HETATM 2666 H GLY A 237 -38.233 -0.958 -47.095 1.00 0.02 H HETATM 2667 H GLY A 237 -38.250 0.353 -45.868 1.00 0.02 H HETATM 2668 H GLY A 237 -35.980 -0.246 -45.167 1.00 0.03 H HETATM 2669 H GLY A 237 -36.160 -2.324 -47.371 1.00 0.03 H HETATM 2670 H GLY A 237 -34.652 -1.837 -46.525 1.00 0.03 H HETATM 2671 H GLY A 237 -37.053 -3.170 -45.211 1.00 0.08 H HETATM 2672 H GLY A 237 -34.343 -2.658 -44.071 1.00 0.19 H HETATM 2673 CB GLY A 237 -34.913 -3.728 -41.089 1.00 0.03 C HETATM 2674 SG GLY A 237 -33.960 -3.719 -39.545 1.00 -0.17 S HETATM 2675 H GLY A 237 -33.857 -4.664 -39.209 1.00 0.10 H HETATM 2676 H GLY A 237 -34.372 -4.348 -41.819 1.00 0.04 H HETATM 2677 H GLY A 237 -35.894 -4.180 -40.880 1.00 0.04 H HETATM 2678 H GLY A 237 -34.175 -1.950 -42.036 1.00 0.08 H HETATM 2679 H GLY A 237 -36.165 -1.800 -39.927 1.00 0.19 H HETATM 2680 CB GLY A 237 -37.432 1.389 -40.009 1.00 -0.01 C HETATM 2681 CG GLY A 237 -37.428 2.630 -39.192 1.00 -0.03 C HETATM 2682 CD GLY A 237 -36.006 3.100 -39.192 1.00 0.04 C HETATM 2683 H GLY A 237 -35.818 3.782 -40.034 1.00 0.05 H HETATM 2684 H GLY A 237 -35.760 3.607 -38.247 1.00 0.05 H HETATM 2685 H GLY A 237 -37.763 2.417 -38.166 1.00 0.03 H HETATM 2686 H GLY A 237 -38.084 3.389 -39.642 1.00 0.03 H HETATM 2687 H GLY A 237 -38.272 0.738 -39.726 1.00 0.03 H HETATM 2688 H GLY A 237 -37.497 1.627 -41.081 1.00 0.03 H HETATM 2689 H GLY A 237 -36.193 0.056 -38.809 1.00 0.08 H HETATM 2690 CB GLY A 237 -32.032 3.051 -39.913 1.00 -0.01 C HETATM 2691 CG1 GLY A 237 -32.765 3.139 -41.244 1.00 -0.06 C HETATM 2692 H GLY A 237 -32.042 3.340 -42.048 1.00 0.02 H HETATM 2693 H GLY A 237 -33.503 3.953 -41.203 1.00 0.02 H HETATM 2694 H GLY A 237 -33.280 2.187 -41.443 1.00 0.02 H HETATM 2695 CG2 GLY A 237 -31.258 4.330 -39.636 1.00 -0.06 C HETATM 2696 H GLY A 237 -30.738 4.242 -38.671 1.00 0.02 H HETATM 2697 H GLY A 237 -31.955 5.180 -39.601 1.00 0.02 H HETATM 2698 H GLY A 237 -30.521 4.493 -40.436 1.00 0.02 H HETATM 2699 H GLY A 237 -31.316 2.218 -39.975 1.00 0.03 H HETATM 2700 H GLY A 237 -33.605 3.668 -38.560 1.00 0.08 H HETATM 2701 H GLY A 237 -31.595 1.677 -37.603 1.00 0.19 H HETATM 2702 CB GLY A 237 -32.301 1.670 -34.348 1.00 -0.01 C HETATM 2703 CG GLY A 237 -31.620 1.777 -33.038 1.00 -0.03 C HETATM 2704 CD GLY A 237 -31.088 3.175 -32.968 1.00 0.04 C HETATM 2705 H GLY A 237 -31.824 3.856 -32.516 1.00 0.05 H HETATM 2706 H GLY A 237 -30.151 3.213 -32.392 1.00 0.05 H HETATM 2707 H GLY A 237 -30.797 1.050 -32.974 1.00 0.03 H HETATM 2708 H GLY A 237 -32.333 1.597 -32.220 1.00 0.03 H HETATM 2709 H GLY A 237 -32.325 0.625 -34.691 1.00 0.03 H HETATM 2710 H GLY A 237 -33.328 2.059 -34.287 1.00 0.03 H HETATM 2711 H GLY A 237 -30.658 1.917 -35.736 1.00 0.08 H HETATM 2712 CB GLY A 237 -30.055 6.836 -33.943 1.00 -0.01 C HETATM 2713 CG GLY A 237 -29.007 7.709 -33.371 1.00 -0.03 C HETATM 2714 CD GLY A 237 -27.690 7.139 -33.867 1.00 0.04 C HETATM 2715 H GLY A 237 -27.373 7.632 -34.798 1.00 0.05 H HETATM 2716 H GLY A 237 -26.902 7.249 -33.107 1.00 0.05 H HETATM 2717 H GLY A 237 -29.046 7.687 -32.272 1.00 0.03 H HETATM 2718 H GLY A 237 -29.135 8.744 -33.722 1.00 0.03 H HETATM 2719 H GLY A 237 -30.980 6.889 -33.349 1.00 0.03 H HETATM 2720 H GLY A 237 -30.272 7.112 -34.986 1.00 0.03 H HETATM 2721 H GLY A 237 -29.563 5.017 -32.858 1.00 0.08 H HETATM 2722 CB GLY A 237 -25.472 5.417 -36.131 1.00 0.03 C HETATM 2723 SG GLY A 237 -25.533 4.015 -37.286 1.00 -0.17 S HETATM 2724 H GLY A 237 -25.376 4.347 -38.225 1.00 0.10 H HETATM 2725 H GLY A 237 -24.482 5.886 -36.227 1.00 0.04 H HETATM 2726 H GLY A 237 -26.249 6.134 -36.435 1.00 0.04 H HETATM 2727 H GLY A 237 -25.445 5.981 -34.041 1.00 0.08 H HETATM 2728 H GLY A 237 -25.176 3.043 -34.322 1.00 0.19 H HETATM 2729 CB GLY A 237 -22.327 2.287 -34.689 1.00 0.02 C HETATM 2730 CG GLY A 237 -21.551 3.262 -35.545 1.00 -0.05 C HETATM 2731 CD1 GLY A 237 -20.289 3.712 -35.162 1.00 -0.07 C HETATM 2732 CE1 GLY A 237 -19.597 4.628 -35.940 1.00 -0.04 C HETATM 2733 CZ GLY A 237 -20.157 5.096 -37.123 1.00 0.08 C HETATM 2734 CE2 GLY A 237 -21.401 4.655 -37.526 1.00 -0.04 C HETATM 2735 CD2 GLY A 237 -22.086 3.750 -36.740 1.00 -0.07 C HETATM 2736 H GLY A 237 -23.064 3.409 -37.058 1.00 0.05 H HETATM 2737 H GLY A 237 -21.836 5.016 -38.451 1.00 0.05 H HETATM 2738 OH GLY A 237 -19.489 6.008 -37.915 1.00 -0.34 O HETATM 2739 H GLY A 237 -20.011 6.798 -37.996 1.00 0.25 H HETATM 2740 H GLY A 237 -18.620 4.979 -35.626 1.00 0.05 H HETATM 2741 H GLY A 237 -19.843 3.342 -34.246 1.00 0.05 H HETATM 2742 H GLY A 237 -23.194 1.929 -35.263 1.00 0.05 H HETATM 2743 H GLY A 237 -21.673 1.437 -34.444 1.00 0.05 H HETATM 2744 H GLY A 237 -21.963 3.182 -32.755 1.00 0.08 H HETATM 2745 H GLY A 237 -23.873 1.093 -33.017 1.00 0.19 H HETATM 2746 CB GLY A 237 -26.533 1.848 -31.861 1.00 0.08 C HETATM 2747 CG GLY A 237 -27.803 1.147 -31.477 1.00 0.18 C HETATM 2748 OD1 GLY A 237 -28.021 -0.015 -31.832 1.00 -0.40 O HETATM 2749 ND2 GLY A 237 -28.667 1.859 -30.757 1.00 -0.30 N HETATM 2750 H GLY A 237 -29.533 1.451 -30.468 1.00 0.18 H HETATM 2751 H GLY A 237 -28.450 2.802 -30.505 1.00 0.18 H HETATM 2752 H GLY A 237 -26.288 1.585 -32.901 1.00 0.06 H HETATM 2753 H GLY A 237 -26.695 2.933 -31.786 1.00 0.06 H HETATM 2754 H GLY A 237 -25.116 0.403 -31.089 1.00 0.08 H HETATM 2755 H GLY A 237 -25.527 2.677 -29.231 1.00 0.19 H HETATM 2756 CB GLY A 237 -25.464 0.644 -26.263 1.00 -0.01 C HETATM 2757 CG1 GLY A 237 -23.992 0.919 -26.577 1.00 -0.06 C HETATM 2758 H GLY A 237 -23.358 0.425 -25.826 1.00 0.02 H HETATM 2759 H GLY A 237 -23.809 2.003 -26.555 1.00 0.02 H HETATM 2760 H GLY A 237 -23.750 0.526 -27.576 1.00 0.02 H HETATM 2761 CG2 GLY A 237 -25.802 1.153 -24.864 1.00 -0.06 C HETATM 2762 H GLY A 237 -26.861 0.951 -24.646 1.00 0.02 H HETATM 2763 H GLY A 237 -25.617 2.236 -24.813 1.00 0.02 H HETATM 2764 H GLY A 237 -25.171 0.638 -24.124 1.00 0.02 H HETATM 2765 H GLY A 237 -25.635 -0.442 -26.298 1.00 0.03 H HETATM 2766 H GLY A 237 -26.166 2.403 -27.273 1.00 0.08 H HETATM 2767 H GLY A 237 -28.167 0.210 -26.906 1.00 0.19 H HETATM 2768 CB GLY A 237 -30.406 1.807 -25.103 1.00 0.00 C HETATM 2769 CG GLY A 237 -31.042 3.079 -24.549 1.00 0.04 C HETATM 2770 CD GLY A 237 -32.431 3.390 -25.103 1.00 0.17 C HETATM 2771 OE1 GLY A 237 -32.937 4.495 -24.903 1.00 -0.40 O HETATM 2772 NE2 GLY A 237 -33.057 2.429 -25.790 1.00 -0.30 N HETATM 2773 H GLY A 237 -33.968 2.597 -26.168 1.00 0.18 H HETATM 2774 H GLY A 237 -32.615 1.543 -25.926 1.00 0.18 H HETATM 2775 H GLY A 237 -30.381 3.925 -24.787 1.00 0.05 H HETATM 2776 H GLY A 237 -31.124 2.974 -23.457 1.00 0.05 H HETATM 2777 H GLY A 237 -29.471 1.620 -24.555 1.00 0.03 H HETATM 2778 H GLY A 237 -31.101 0.971 -24.937 1.00 0.03 H HETATM 2779 H GLY A 237 -30.670 2.694 -27.047 1.00 0.08 H HETATM 2780 H GLY A 237 -30.395 -0.231 -26.757 1.00 0.19 H HETATM 2781 CB GLY A 237 -31.619 -0.730 -30.542 1.00 0.03 C HETATM 2782 SG GLY A 237 -31.211 -2.180 -31.540 1.00 -0.17 S HETATM 2783 H GLY A 237 -31.644 -2.095 -32.446 1.00 0.10 H HETATM 2784 H GLY A 237 -31.250 0.170 -31.056 1.00 0.04 H HETATM 2785 H GLY A 237 -32.712 -0.669 -30.436 1.00 0.04 H HETATM 2786 H GLY A 237 -29.991 -1.235 -29.253 1.00 0.08 H HETATM 2787 H GLY A 237 -32.667 -1.353 -27.955 1.00 0.19 H HETATM 2788 H GLY A 237 -32.868 -3.015 -26.447 1.00 0.11 H HETATM 2789 H GLY A 237 -32.943 -4.295 -27.706 1.00 0.11 H HETATM 2790 H GLY A 237 -32.138 -5.143 -25.610 1.00 0.20 H HETATM 2791 H GLY A 237 -30.886 -4.075 -25.596 1.00 0.20 H HETATM 2792 H GLY A 237 -30.954 -5.247 -26.750 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 307 306 439 CONECT 365 364 1079 CONECT 439 307 438 CONECT 1079 365 1078 CONECT 1310 1309 1961 CONECT 1627 1626 1784 CONECT 1784 1627 1783 CONECT 1886 1885 2128 CONECT 1961 1310 1960 CONECT 2128 1886 2127 CONECT 2603 2604 2790 2791 2792 CONECT 2604 2603 2605 2788 2789 CONECT 2605 2604 2606 2607 CONECT 2606 2605 CONECT 2607 2605 2608 2787 CONECT 2608 2607 2609 2781 2786 CONECT 2609 2608 2610 2611 CONECT 2610 2609 CONECT 2611 2609 2612 2780 CONECT 2612 2611 2613 2768 2779 CONECT 2613 2612 2614 2615 CONECT 2614 2613 CONECT 2615 2613 2616 2767 CONECT 2616 2615 2617 2756 2766 CONECT 2617 2616 2618 2619 CONECT 2618 2617 CONECT 2619 2617 2620 2755 CONECT 2620 2619 2621 2746 2754 CONECT 2621 2620 2622 2623 CONECT 2622 2621 CONECT 2623 2621 2624 2745 CONECT 2624 2623 2625 2729 2744 CONECT 2625 2624 2626 2627 CONECT 2626 2625 CONECT 2627 2625 2628 2728 CONECT 2628 2627 2629 2722 2727 CONECT 2629 2628 2630 2631 CONECT 2630 2629 CONECT 2631 2629 2632 2714 CONECT 2632 2631 2633 2712 2721 CONECT 2633 2632 2634 2635 CONECT 2634 2633 CONECT 2635 2633 2636 2704 CONECT 2636 2635 2637 2702 2711 CONECT 2637 2636 2638 2639 CONECT 2638 2637 CONECT 2639 2637 2640 2701 CONECT 2640 2639 2641 2690 2700 CONECT 2641 2640 2642 2643 CONECT 2642 2641 CONECT 2643 2641 2644 2682 CONECT 2644 2643 2645 2680 2689 CONECT 2645 2644 2646 2647 CONECT 2646 2645 CONECT 2647 2645 2648 2679 CONECT 2648 2647 2649 2673 2678 CONECT 2649 2648 2650 2651 CONECT 2650 2649 CONECT 2651 2649 2652 2672 CONECT 2652 2651 2653 2658 2671 CONECT 2653 2652 2654 2655 CONECT 2654 2653 CONECT 2655 2653 2656 2657 CONECT 2656 2655 CONECT 2657 2655 CONECT 2658 2652 2659 2669 2670 CONECT 2659 2658 2660 2664 2668 CONECT 2660 2659 2661 2662 2663 CONECT 2661 2660 CONECT 2662 2660 CONECT 2663 2660 CONECT 2664 2659 2665 2666 2667 CONECT 2665 2664 CONECT 2666 2664 CONECT 2667 2664 CONECT 2668 2659 CONECT 2669 2658 CONECT 2670 2658 CONECT 2671 2652 CONECT 2672 2651 CONECT 2673 2648 2674 2676 2677 CONECT 2674 2673 2675 CONECT 2675 2674 CONECT 2676 2673 CONECT 2677 2673 CONECT 2678 2648 CONECT 2679 2647 CONECT 2680 2644 2681 2687 2688 CONECT 2681 2680 2682 2685 2686 CONECT 2682 2643 2681 2683 2684 CONECT 2683 2682 CONECT 2684 2682 CONECT 2685 2681 CONECT 2686 2681 CONECT 2687 2680 CONECT 2688 2680 CONECT 2689 2644 CONECT 2690 2640 2691 2695 2699 CONECT 2691 2690 2692 2693 2694 CONECT 2692 2691 CONECT 2693 2691 CONECT 2694 2691 CONECT 2695 2690 2696 2697 2698 CONECT 2696 2695 CONECT 2697 2695 CONECT 2698 2695 CONECT 2699 2690 CONECT 2700 2640 CONECT 2701 2639 CONECT 2702 2636 2703 2709 2710 CONECT 2703 2702 2704 2707 2708 CONECT 2704 2635 2703 2705 2706 CONECT 2705 2704 CONECT 2706 2704 CONECT 2707 2703 CONECT 2708 2703 CONECT 2709 2702 CONECT 2710 2702 CONECT 2711 2636 CONECT 2712 2632 2713 2719 2720 CONECT 2713 2712 2714 2717 2718 CONECT 2714 2631 2713 2715 2716 CONECT 2715 2714 CONECT 2716 2714 CONECT 2717 2713 CONECT 2718 2713 CONECT 2719 2712 CONECT 2720 2712 CONECT 2721 2632 CONECT 2722 2628 2723 2725 2726 CONECT 2723 2722 2724 CONECT 2724 2723 CONECT 2725 2722 CONECT 2726 2722 CONECT 2727 2628 CONECT 2728 2627 CONECT 2729 2624 2730 2742 2743 CONECT 2730 2729 2731 2735 CONECT 2731 2730 2732 2741 CONECT 2732 2731 2733 2740 CONECT 2733 2732 2734 2738 CONECT 2734 2733 2735 2737 CONECT 2735 2730 2734 2736 CONECT 2736 2735 CONECT 2737 2734 CONECT 2738 2733 2739 CONECT 2739 2738 CONECT 2740 2732 CONECT 2741 2731 CONECT 2742 2729 CONECT 2743 2729 CONECT 2744 2624 CONECT 2745 2623 CONECT 2746 2620 2747 2752 2753 CONECT 2747 2746 2748 2749 CONECT 2748 2747 CONECT 2749 2747 2750 2751 CONECT 2750 2749 CONECT 2751 2749 CONECT 2752 2746 CONECT 2753 2746 CONECT 2754 2620 CONECT 2755 2619 CONECT 2756 2616 2757 2761 2765 CONECT 2757 2756 2758 2759 2760 CONECT 2758 2757 CONECT 2759 2757 CONECT 2760 2757 CONECT 2761 2756 2762 2763 2764 CONECT 2762 2761 CONECT 2763 2761 CONECT 2764 2761 CONECT 2765 2756 CONECT 2766 2616 CONECT 2767 2615 CONECT 2768 2612 2769 2777 2778 CONECT 2769 2768 2770 2775 2776 CONECT 2770 2769 2771 2772 CONECT 2771 2770 CONECT 2772 2770 2773 2774 CONECT 2773 2772 CONECT 2774 2772 CONECT 2775 2769 CONECT 2776 2769 CONECT 2777 2768 CONECT 2778 2768 CONECT 2779 2612 CONECT 2780 2611 CONECT 2781 2608 2782 2784 2785 CONECT 2782 2781 2783 CONECT 2783 2782 CONECT 2784 2781 CONECT 2785 2781 CONECT 2786 2608 CONECT 2787 2607 CONECT 2788 2604 CONECT 2789 2604 CONECT 2790 2603 CONECT 2791 2603 CONECT 2792 2603 MASTER 0 0 0 0 0 0 0 0 2791 1 204 19 END
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Entry Information
PDB ID
4mny
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
urokinase-type plasminogen activator (uPA)
Ligand Name
14-mer
EC.Number
E.C.3.4.21.73
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Ki=1.96uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Angew.Chem.Int.Ed.Engl. Vol. 53: pp. 1602-1606
Ligand Properties
Formula
C
6
0
H
9
5
N
1
6
O
1
6
S
3
Molecular Weight
1392.690
Exact Mass
1391.630
No. of atoms
190
No. of bonds
193
Polar Surface Area
616.37
LOGP Value
-2.33 (
Computed with XLOGP3
)
-0.28 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 14
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 52
No. of Nitrogen and Oxygen Atoms: 32
No. of Rings: 4
Canonical SMILES
[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)CS)C(C)C)CS)Cc1ccc(cc1)O)CC(=O)N)C(C)C)CCC(=O)N)CS
InChI String
InChI=1S/C60H94N16O16S3/c1-29(2)22-35(49(64)81)67-54(86)39(27-94)70-55(87)41-10-8-20-75(41)60(92)48(31(5)6)73-56(88)42-11-7-19-74(42)59(91)43-12-9-21-76(43)58(90)40(28-95)71-51(83)36(23-32-13-15-33(77)16-14-32)68-52(84)37(24-45(63)79)69-57(89)47(30(3)4)72-50(82)34(17-18-44(62)78)66-53(85)38(26-93)65-46(80)25-61/h13-16,29-31,34-43,47-48,77,93-95H,7-12,17-28,61H2,1-6H3,(H2,62,78)(H2,63,79)(H2,64,81)(H,65,80)(H,66,85)(H,67,86)(H,68,84)(H,69,89)(H,70,87)(H,71,83)(H,72,82)(H,73,88)/p+1/t34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,47-,48-/m0/s1
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UniProtKB AC
UniProt accession number (AC):
P00749
Entrez Gene ID
NCBI Entrez Gene ID:
5328
ASD
Information of known allosteric effects of PDB entries
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