Browse entries in the PDBbind-CN Database
HEADER 5TNT_COMPLEX COMPND 5TNT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 235 VAL VAL GLY GLY GLU ASP ALA LYS PRO GLY GLN PHE PRO SEQRES 2 A 235 TRP GLN VAL VAL LEU ASN GLY LYS VAL ASP ALA PHE CYS SEQRES 3 A 235 GLY GLY SER ILE VAL ASN GLU LYS TRP ILE VAL THR ALA SEQRES 4 A 235 ALA HIS CYS VAL GLU THR GLY VAL LYS ILE THR VAL VAL SEQRES 5 A 235 ALA GLY GLU HIS ASN ILE GLU GLU THR GLU HIS THR GLU SEQRES 6 A 235 GLN LYS ARG ASN VAL ILE ARG ILE ILE PRO HIS HIS ASN SEQRES 7 A 235 TYR ASN ALA ALA ILE ASN LYS TYR ASN HIS ASP ILE ALA SEQRES 8 A 235 LEU LEU GLU LEU ASP GLU PRO LEU VAL LEU ASN SER TYR SEQRES 9 A 235 VAL THR PRO ILE CYS ILE ALA ASP LYS GLU TYR THR ASN SEQRES 10 A 235 ILE PHE LEU LYS PHE GLY SER GLY TYR VAL SER GLY TRP SEQRES 11 A 235 GLY ARG VAL PHE HIS LYS GLY ALA SER ALA LEU VAL LEU SEQRES 12 A 235 GLN TYR LEU ARG VAL PRO LEU VAL ASP ARG ALA THR CYS SEQRES 13 A 235 LEU ARG SER THR LYS PHE THR ILE TYR ASN ASN MET PHE SEQRES 14 A 235 CYS ALA GLY PHE HIS GLU GLY GLY ARG ASP SER CYS GLN SEQRES 15 A 235 GLY ASP SER GLY GLY PRO HIS VAL THR GLU VAL GLU GLY SEQRES 16 A 235 THR SER PHE LEU THR GLY ILE ILE SER TRP GLY GLU GLU SEQRES 17 A 235 CYS ALA MET LYS GLY LYS TYR GLY ILE TYR THR LYS VAL SEQRES 18 A 235 SER ARG TYR VAL ASN TRP ILE LYS GLU LYS THR LYS LEU SEQRES 19 A 235 THR SEQRES 1 B 55 ASP VAL THR CYS ASN ILE LYS ASN GLY ARG CYS GLU GLN SEQRES 2 B 55 PHE CYS LYS ASN SER ALA ASP ASN LYS VAL VAL CYS SER SEQRES 3 B 55 CYS THR GLU GLY TYR ARG LEU ALA GLU ASN GLN LYS SER SEQRES 4 B 55 CYS GLU PRO ALA VAL PRO PHE PRO CYS GLY ARG VAL SER SEQRES 5 B 55 VAL SER GLN HET NA A 1 1 HET UNN A 636 54 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 168 CYS A 182 SSBOND 3 CYS A 191 CYS A 220 SSBOND 4 CYS B 88 CYS B 99 SSBOND 5 CYS B 95 CYS B 109 SSBOND 6 CYS B 111 CYS B 124 SSBOND 7 CYS A 122 CYS B 132 ATOM 1 N VAL A 16 -10.021 -26.191 -8.572 1.00 12.81 N ATOM 2 CA VAL A 16 -10.790 -25.799 -7.358 1.00 12.01 C ATOM 3 C VAL A 16 -11.882 -24.831 -7.792 1.00 13.43 C ATOM 4 O VAL A 16 -11.591 -23.823 -8.441 1.00 13.06 O ATOM 5 CB VAL A 16 -9.870 -25.089 -6.336 1.00 13.61 C ATOM 6 CG1 VAL A 16 -10.665 -24.674 -5.089 1.00 13.41 C ATOM 7 CG2 VAL A 16 -8.659 -25.951 -5.944 1.00 13.08 C ATOM 8 HN3 VAL A 16 -9.602 -25.343 -9.004 1.00 0.00 H ATOM 9 HN2 VAL A 16 -10.660 -26.649 -9.253 1.00 0.00 H ATOM 10 HN1 VAL A 16 -9.266 -26.854 -8.304 1.00 0.00 H ATOM 11 N VAL A 17 -13.118 -25.151 -7.438 1.00 12.73 N ATOM 12 CA VAL A 17 -14.284 -24.332 -7.681 1.00 12.38 C ATOM 13 C VAL A 17 -14.591 -23.606 -6.377 1.00 14.09 C ATOM 14 O VAL A 17 -14.616 -24.212 -5.295 1.00 13.90 O ATOM 15 CB VAL A 17 -15.503 -25.185 -8.078 1.00 15.01 C ATOM 16 CG1 VAL A 17 -16.732 -24.305 -8.365 1.00 15.40 C ATOM 17 CG2 VAL A 17 -15.163 -26.088 -9.279 1.00 15.10 C ATOM 18 H VAL A 17 -13.260 -26.058 -6.949 1.00 0.00 H ATOM 19 N GLY A 18 -14.855 -22.314 -6.493 1.00 13.59 N ATOM 20 CA GLY A 18 -15.215 -21.515 -5.320 1.00 13.65 C ATOM 21 C GLY A 18 -14.083 -21.186 -4.399 1.00 16.06 C ATOM 22 O GLY A 18 -14.340 -20.825 -3.235 1.00 15.40 O ATOM 23 H GLY A 18 -14.806 -21.861 -7.428 1.00 0.00 H ATOM 24 N GLY A 19 -12.855 -21.287 -4.896 1.00 13.97 N ATOM 25 CA GLY A 19 -11.672 -20.932 -4.129 1.00 13.77 C ATOM 26 C GLY A 19 -11.241 -19.500 -4.393 1.00 13.85 C ATOM 27 O GLY A 19 -11.939 -18.714 -5.051 1.00 15.24 O ATOM 28 H GLY A 19 -12.736 -21.633 -5.870 1.00 0.00 H ATOM 29 N GLU A 20 -10.049 -19.145 -3.882 1.00 12.33 N ATOM 30 CA GLU A 20 -9.441 -17.848 -4.074 1.00 13.63 C ATOM 31 C GLU A 20 -8.026 -18.016 -4.562 1.00 13.98 C ATOM 32 O GLU A 20 -7.426 -19.083 -4.376 1.00 12.62 O ATOM 33 CB GLU A 20 -9.408 -17.065 -2.747 1.00 15.96 C ATOM 34 CG GLU A 20 -10.768 -16.582 -2.261 1.00 19.62 C ATOM 35 CD GLU A 20 -11.314 -15.296 -2.846 1.00 31.55 C ATOM 36 OE1 GLU A 20 -10.513 -14.477 -3.354 1.00 29.65 O ATOM 37 OE2 GLU A 20 -12.533 -15.052 -2.684 1.00 27.80 O ATOM 38 H GLU A 20 -9.533 -19.847 -3.314 1.00 0.00 H ATOM 39 N ASP A 21 -7.462 -16.964 -5.155 1.00 13.56 N ATOM 40 CA ASP A 21 -6.088 -16.993 -5.582 1.00 13.53 C ATOM 41 C ASP A 21 -5.172 -17.081 -4.359 1.00 14.55 C ATOM 42 O ASP A 21 -5.293 -16.267 -3.415 1.00 15.55 O ATOM 43 CB ASP A 21 -5.688 -15.683 -6.307 1.00 15.16 C ATOM 44 CG ASP A 21 -6.261 -15.469 -7.677 1.00 16.25 C ATOM 45 OD1 ASP A 21 -7.148 -16.258 -8.087 1.00 15.60 O ATOM 46 OD2 ASP A 21 -5.878 -14.468 -8.322 1.00 19.34 O ATOM 47 H ASP A 21 -8.026 -16.105 -5.312 1.00 0.00 H ATOM 48 N ALA A 22 -4.211 -18.012 -4.410 1.00 12.36 N ATOM 49 CA ALA A 22 -3.140 -18.032 -3.406 1.00 12.61 C ATOM 50 C ALA A 22 -2.266 -16.809 -3.636 1.00 14.35 C ATOM 51 O ALA A 22 -2.202 -16.269 -4.758 1.00 15.80 O ATOM 52 CB ALA A 22 -2.286 -19.284 -3.600 1.00 12.62 C ATOM 53 H ALA A 22 -4.223 -18.726 -5.166 1.00 0.00 H ATOM 54 N LYS A 23 -1.568 -16.390 -2.569 1.00 13.40 N ATOM 55 CA LYS A 23 -0.536 -15.405 -2.728 1.00 14.18 C ATOM 56 C LYS A 23 0.748 -16.219 -2.999 1.00 14.43 C ATOM 57 O LYS A 23 0.862 -17.387 -2.592 1.00 13.41 O ATOM 58 CB LYS A 23 -0.334 -14.612 -1.451 1.00 16.98 C ATOM 59 CG LYS A 23 -1.538 -13.692 -1.131 1.00 19.31 C ATOM 60 CD LYS A 23 -1.405 -12.947 0.163 1.00 26.59 C ATOM 61 CE LYS A 23 -2.555 -11.986 0.364 1.00 37.39 C ATOM 62 NZ LYS A 23 -2.880 -11.823 1.811 1.00 54.12 N ATOM 63 HZ1 LYS A 23 -3.145 -12.745 2.211 1.00 0.00 H ATOM 64 HZ2 LYS A 23 -2.048 -11.453 2.312 1.00 0.00 H ATOM 65 HZ3 LYS A 23 -3.673 -11.158 1.914 1.00 0.00 H ATOM 66 H LYS A 23 -1.775 -16.779 -1.627 1.00 0.00 H ATOM 67 N PRO A 24 1.752 -15.630 -3.660 1.00 14.20 N ATOM 68 CA PRO A 24 3.033 -16.344 -3.824 1.00 14.33 C ATOM 69 C PRO A 24 3.594 -16.836 -2.492 1.00 15.30 C ATOM 70 O PRO A 24 3.540 -16.140 -1.485 1.00 16.33 O ATOM 71 CB PRO A 24 3.949 -15.270 -4.443 1.00 15.64 C ATOM 72 CG PRO A 24 2.974 -14.388 -5.221 1.00 18.48 C ATOM 73 CD PRO A 24 1.789 -14.286 -4.280 1.00 15.06 C ATOM 74 N GLY A 25 4.004 -18.100 -2.485 1.00 14.88 N ATOM 75 CA GLY A 25 4.584 -18.729 -1.313 1.00 15.07 C ATOM 76 C GLY A 25 3.591 -19.106 -0.229 1.00 14.44 C ATOM 77 O GLY A 25 4.000 -19.504 0.870 1.00 13.97 O ATOM 78 H GLY A 25 3.905 -18.661 -3.355 1.00 0.00 H ATOM 79 N GLN A 26 2.252 -18.993 -0.480 1.00 12.29 N ATOM 80 CA GLN A 26 1.285 -19.342 0.546 1.00 11.67 C ATOM 81 C GLN A 26 1.174 -20.841 0.755 1.00 12.34 C ATOM 82 O GLN A 26 0.823 -21.282 1.851 1.00 12.37 O ATOM 83 CB GLN A 26 -0.089 -18.752 0.193 1.00 12.94 C ATOM 84 CG GLN A 26 -1.132 -18.876 1.279 1.00 13.21 C ATOM 85 CD GLN A 26 -2.421 -18.207 0.915 1.00 15.63 C ATOM 86 OE1 GLN A 26 -2.532 -17.475 -0.061 1.00 15.16 O ATOM 87 NE2 GLN A 26 -3.434 -18.448 1.739 1.00 18.24 N ATOM 88 HE22 GLN A 26 -3.301 -19.076 2.557 1.00 0.00 H ATOM 89 HE21 GLN A 26 -4.361 -18.009 1.566 1.00 0.00 H ATOM 90 H GLN A 26 1.925 -18.656 -1.408 1.00 0.00 H ATOM 91 N PHE A 27 1.461 -21.638 -0.290 1.00 11.03 N ATOM 92 CA PHE A 27 1.378 -23.106 -0.214 1.00 10.62 C ATOM 93 C PHE A 27 2.672 -23.647 -0.832 1.00 12.11 C ATOM 94 O PHE A 27 2.694 -24.207 -1.948 1.00 11.33 O ATOM 95 CB PHE A 27 0.127 -23.641 -0.974 1.00 11.55 C ATOM 96 CG PHE A 27 -1.147 -23.108 -0.386 1.00 11.22 C ATOM 97 CD1 PHE A 27 -1.724 -23.705 0.732 1.00 13.24 C ATOM 98 CD2 PHE A 27 -1.735 -21.979 -0.903 1.00 11.71 C ATOM 99 CE1 PHE A 27 -2.857 -23.146 1.328 1.00 13.31 C ATOM 100 CE2 PHE A 27 -2.859 -21.425 -0.304 1.00 13.16 C ATOM 101 CZ PHE A 27 -3.407 -22.003 0.809 1.00 11.81 C ATOM 102 H PHE A 27 1.753 -21.200 -1.187 1.00 0.00 H ATOM 103 N PRO A 28 3.816 -23.428 -0.149 1.00 10.52 N ATOM 104 CA PRO A 28 5.122 -23.693 -0.784 1.00 10.63 C ATOM 105 C PRO A 28 5.481 -25.159 -0.969 1.00 11.52 C ATOM 106 O PRO A 28 6.494 -25.489 -1.589 1.00 11.54 O ATOM 107 CB PRO A 28 6.104 -22.954 0.136 1.00 11.28 C ATOM 108 CG PRO A 28 5.430 -23.013 1.495 1.00 11.59 C ATOM 109 CD PRO A 28 3.972 -22.778 1.179 1.00 10.55 C ATOM 110 N TRP A 29 4.632 -26.039 -0.423 1.00 10.17 N ATOM 111 CA TRP A 29 4.728 -27.486 -0.608 1.00 10.75 C ATOM 112 C TRP A 29 3.982 -27.947 -1.840 1.00 11.23 C ATOM 113 O TRP A 29 4.151 -29.089 -2.257 1.00 11.57 O ATOM 114 CB TRP A 29 4.145 -28.224 0.611 1.00 11.33 C ATOM 115 CG TRP A 29 2.842 -27.652 1.097 1.00 11.53 C ATOM 116 CD1 TRP A 29 1.574 -27.931 0.636 1.00 12.77 C ATOM 117 CD2 TRP A 29 2.695 -26.664 2.101 1.00 12.26 C ATOM 118 NE1 TRP A 29 0.651 -27.153 1.302 1.00 13.19 N ATOM 119 CE2 TRP A 29 1.313 -26.334 2.167 1.00 12.16 C ATOM 120 CE3 TRP A 29 3.601 -26.002 2.954 1.00 13.19 C ATOM 121 CZ2 TRP A 29 0.820 -25.421 3.104 1.00 12.75 C ATOM 122 CZ3 TRP A 29 3.086 -25.068 3.868 1.00 13.28 C ATOM 123 CH2 TRP A 29 1.718 -24.781 3.897 1.00 13.09 C ATOM 124 HE1 TRP A 29 -0.380 -27.186 1.167 1.00 0.00 H ATOM 125 H TRP A 29 3.859 -25.671 0.167 1.00 0.00 H ATOM 126 N GLN A 30 3.153 -27.083 -2.466 1.00 10.52 N ATOM 127 CA GLN A 30 2.399 -27.513 -3.650 1.00 10.37 C ATOM 128 C GLN A 30 3.299 -27.692 -4.864 1.00 12.44 C ATOM 129 O GLN A 30 4.148 -26.821 -5.136 1.00 13.21 O ATOM 130 CB GLN A 30 1.343 -26.433 -3.966 1.00 11.15 C ATOM 131 CG GLN A 30 0.507 -26.645 -5.237 1.00 10.86 C ATOM 132 CD GLN A 30 -0.627 -27.591 -5.079 1.00 12.57 C ATOM 133 OE1 GLN A 30 -1.399 -27.489 -4.134 1.00 14.75 O ATOM 134 NE2 GLN A 30 -0.810 -28.534 -5.996 1.00 12.26 N ATOM 135 HE22 GLN A 30 -0.151 -28.616 -6.796 1.00 0.00 H ATOM 136 HE21 GLN A 30 -1.612 -29.191 -5.914 1.00 0.00 H ATOM 137 H GLN A 30 3.049 -26.112 -2.109 1.00 0.00 H ATOM 138 N VAL A 31 3.070 -28.731 -5.629 1.00 11.08 N ATOM 139 CA VAL A 31 3.675 -28.863 -6.943 1.00 12.17 C ATOM 140 C VAL A 31 2.565 -29.101 -7.971 1.00 12.46 C ATOM 141 O VAL A 31 1.472 -29.540 -7.641 1.00 12.65 O ATOM 142 CB VAL A 31 4.811 -29.921 -7.046 1.00 15.16 C ATOM 143 CG1 VAL A 31 5.861 -29.705 -5.968 1.00 14.95 C ATOM 144 CG2 VAL A 31 4.251 -31.337 -6.965 1.00 14.97 C ATOM 145 H VAL A 31 2.438 -29.482 -5.286 1.00 0.00 H ATOM 146 N VAL A 32 2.927 -28.901 -9.228 1.00 12.95 N ATOM 147 CA VAL A 32 2.082 -29.217 -10.361 1.00 13.70 C ATOM 148 C VAL A 32 2.796 -30.279 -11.169 1.00 14.88 C ATOM 149 O VAL A 32 4.031 -30.298 -11.252 1.00 14.76 O ATOM 150 CB VAL A 32 1.721 -27.972 -11.200 1.00 15.23 C ATOM 151 CG1 VAL A 32 2.926 -27.373 -11.905 1.00 15.08 C ATOM 152 CG2 VAL A 32 0.638 -28.322 -12.234 1.00 15.00 C ATOM 153 H VAL A 32 3.867 -28.496 -9.412 1.00 0.00 H ATOM 154 N LEU A 33 1.998 -31.195 -11.735 1.00 16.09 N ATOM 155 CA LEU A 33 2.461 -32.238 -12.660 1.00 17.51 C ATOM 156 C LEU A 33 2.004 -31.883 -14.104 1.00 17.20 C ATOM 157 O LEU A 33 0.834 -31.592 -14.350 1.00 18.65 O ATOM 158 CB LEU A 33 1.968 -33.634 -12.303 1.00 16.54 C ATOM 159 CG LEU A 33 2.109 -34.043 -10.849 1.00 19.01 C ATOM 160 CD1 LEU A 33 1.729 -35.529 -10.645 1.00 19.48 C ATOM 161 CD2 LEU A 33 3.520 -33.864 -10.323 1.00 21.85 C ATOM 162 H LEU A 33 0.984 -31.165 -11.504 1.00 0.00 H ATOM 163 N ASN A 34 2.963 -31.865 -14.998 1.00 19.37 N ATOM 164 CA ASN A 34 2.737 -31.542 -16.403 1.00 21.46 C ATOM 165 C ASN A 34 3.153 -32.703 -17.253 1.00 26.20 C ATOM 166 O ASN A 34 4.124 -33.399 -16.935 1.00 23.89 O ATOM 167 CB ASN A 34 3.535 -30.297 -16.797 1.00 21.33 C ATOM 168 CG ASN A 34 3.137 -29.071 -16.071 1.00 20.40 C ATOM 169 OD1 ASN A 34 1.950 -28.814 -15.786 1.00 21.69 O ATOM 170 ND2 ASN A 34 4.102 -28.192 -15.804 1.00 24.27 N ATOM 171 HD22 ASN A 34 5.089 -28.414 -16.045 1.00 0.00 H ATOM 172 HD21 ASN A 34 3.868 -27.284 -15.355 1.00 0.00 H ATOM 173 H ASN A 34 3.931 -32.092 -14.691 1.00 0.00 H ATOM 174 N GLY A 35 2.394 -32.922 -18.330 1.00 26.72 N ATOM 175 CA GLY A 35 2.627 -34.011 -19.268 1.00 28.14 C ATOM 176 C GLY A 35 2.162 -33.623 -20.653 1.00 33.23 C ATOM 177 O GLY A 35 2.514 -32.543 -21.135 1.00 30.97 O ATOM 178 H GLY A 35 1.595 -32.281 -18.508 1.00 0.00 H ATOM 179 N LYS A 36 1.337 -34.485 -21.288 1.00 32.85 N ATOM 180 CA LYS A 36 0.786 -34.185 -22.614 1.00 33.94 C ATOM 181 C LYS A 36 -0.102 -32.970 -22.501 1.00 37.31 C ATOM 182 O LYS A 36 -0.114 -32.144 -23.399 1.00 38.36 O ATOM 183 CB LYS A 36 0.037 -35.383 -23.213 1.00 39.97 C ATOM 184 CG LYS A 36 0.984 -36.407 -23.842 1.00 71.24 C ATOM 185 CD LYS A 36 0.261 -37.454 -24.687 1.00 94.06 C ATOM 186 CE LYS A 36 1.120 -37.975 -25.817 1.00120.56 C ATOM 187 NZ LYS A 36 1.096 -37.077 -27.007 1.00138.19 N ATOM 188 HZ1 LYS A 36 0.120 -36.992 -27.356 1.00 0.00 H ATOM 189 HZ2 LYS A 36 1.452 -36.138 -26.738 1.00 0.00 H ATOM 190 HZ3 LYS A 36 1.699 -37.477 -27.754 1.00 0.00 H ATOM 191 H LYS A 36 1.087 -35.382 -20.826 1.00 0.00 H ATOM 192 N VAL A 38 -0.765 -32.800 -21.347 1.00 31.93 N ATOM 193 CA VAL A 38 -1.498 -31.577 -21.062 1.00 30.58 C ATOM 194 C VAL A 38 -0.853 -31.046 -19.820 1.00 31.33 C ATOM 195 O VAL A 38 -0.241 -31.819 -19.083 1.00 30.95 O ATOM 196 CB VAL A 38 -3.022 -31.737 -20.900 1.00 34.48 C ATOM 197 CG1 VAL A 38 -3.645 -32.298 -22.173 1.00 35.83 C ATOM 198 CG2 VAL A 38 -3.381 -32.583 -19.695 1.00 33.39 C ATOM 199 H VAL A 38 -0.754 -33.562 -20.639 1.00 0.00 H ATOM 200 N ASP A 39 -0.957 -29.748 -19.601 1.00 27.61 N ATOM 201 CA ASP A 39 -0.399 -29.148 -18.404 1.00 26.98 C ATOM 202 C ASP A 39 -1.367 -29.226 -17.258 1.00 27.29 C ATOM 203 O ASP A 39 -2.582 -29.233 -17.458 1.00 25.57 O ATOM 204 CB ASP A 39 -0.069 -27.662 -18.649 1.00 30.13 C ATOM 205 CG ASP A 39 1.334 -27.420 -19.169 1.00 43.05 C ATOM 206 OD1 ASP A 39 2.013 -28.408 -19.537 1.00 41.26 O ATOM 207 OD2 ASP A 39 1.766 -26.243 -19.181 1.00 55.02 O ATOM 208 H ASP A 39 -1.445 -29.148 -20.296 1.00 0.00 H ATOM 209 N ALA A 40 -0.824 -29.217 -16.009 1.00 23.51 N ATOM 210 CA ALA A 40 -1.622 -29.166 -14.822 1.00 21.91 C ATOM 211 C ALA A 40 -2.653 -30.218 -14.833 1.00 18.09 C ATOM 212 O ALA A 40 -3.823 -30.000 -14.501 1.00 22.15 O ATOM 213 CB ALA A 40 -2.249 -27.782 -14.652 1.00 22.72 C ATOM 214 H ALA A 40 0.211 -29.248 -15.914 1.00 0.00 H ATOM 215 N PHE A 41 -2.194 -31.460 -15.108 1.00 18.51 N ATOM 216 CA PHE A 41 -3.132 -32.561 -15.113 1.00 17.59 C ATOM 217 C PHE A 41 -3.391 -33.101 -13.717 1.00 15.91 C ATOM 218 O PHE A 41 -4.414 -33.731 -13.488 1.00 17.69 O ATOM 219 CB PHE A 41 -2.733 -33.703 -16.072 1.00 19.19 C ATOM 220 CG PHE A 41 -1.526 -34.504 -15.661 1.00 18.64 C ATOM 221 CD1 PHE A 41 -1.646 -35.571 -14.786 1.00 22.19 C ATOM 222 CD2 PHE A 41 -0.272 -34.187 -16.129 1.00 21.81 C ATOM 223 CE1 PHE A 41 -0.520 -36.270 -14.370 1.00 23.13 C ATOM 224 CE2 PHE A 41 0.843 -34.916 -15.738 1.00 22.92 C ATOM 225 CZ PHE A 41 0.718 -35.936 -14.849 1.00 21.89 C ATOM 226 H PHE A 41 -1.187 -31.620 -15.312 1.00 0.00 H ATOM 227 N CYS A 42 -2.467 -32.844 -12.778 1.00 16.14 N ATOM 228 CA CYS A 42 -2.579 -33.262 -11.390 1.00 15.22 C ATOM 229 C CYS A 42 -1.697 -32.365 -10.558 1.00 14.06 C ATOM 230 O CYS A 42 -0.800 -31.686 -11.076 1.00 15.02 O ATOM 231 CB CYS A 42 -2.169 -34.726 -11.193 1.00 15.04 C ATOM 232 SG CYS A 42 -3.479 -35.958 -11.556 1.00 17.84 S ATOM 233 H CYS A 42 -1.619 -32.313 -13.061 1.00 0.00 H ATOM 234 N GLY A 43 -1.888 -32.447 -9.261 1.00 13.26 N ATOM 235 CA GLY A 43 -1.035 -31.803 -8.276 1.00 12.39 C ATOM 236 C GLY A 43 -0.189 -32.827 -7.526 1.00 13.30 C ATOM 237 O GLY A 43 -0.268 -34.045 -7.747 1.00 14.23 O ATOM 238 H GLY A 43 -2.696 -33.005 -8.919 1.00 0.00 H ATOM 239 N GLY A 44 0.583 -32.316 -6.590 1.00 11.95 N ATOM 240 CA GLY A 44 1.400 -33.111 -5.683 1.00 12.22 C ATOM 241 C GLY A 44 1.870 -32.262 -4.538 1.00 12.50 C ATOM 242 O GLY A 44 1.641 -31.040 -4.554 1.00 11.65 O ATOM 243 H GLY A 44 0.611 -31.281 -6.492 1.00 0.00 H ATOM 244 N SER A 45 2.571 -32.878 -3.583 1.00 11.94 N ATOM 245 CA SER A 45 3.134 -32.178 -2.441 1.00 11.37 C ATOM 246 C SER A 45 4.587 -32.580 -2.211 1.00 12.15 C ATOM 247 O SER A 45 4.940 -33.763 -2.379 1.00 13.60 O ATOM 248 CB SER A 45 2.352 -32.470 -1.149 1.00 13.74 C ATOM 249 OG SER A 45 0.986 -32.156 -1.292 1.00 15.78 O ATOM 250 HG SER A 45 0.599 -32.699 -2.024 1.00 0.00 H ATOM 251 H SER A 45 2.721 -33.904 -3.660 1.00 0.00 H ATOM 252 N ILE A 46 5.417 -31.616 -1.813 1.00 11.88 N ATOM 253 CA ILE A 46 6.833 -31.876 -1.540 1.00 11.59 C ATOM 254 C ILE A 46 6.965 -32.607 -0.187 1.00 13.82 C ATOM 255 O ILE A 46 6.591 -32.070 0.869 1.00 12.85 O ATOM 256 CB ILE A 46 7.648 -30.560 -1.448 1.00 12.65 C ATOM 257 CG1 ILE A 46 7.610 -29.811 -2.790 1.00 12.85 C ATOM 258 CG2 ILE A 46 9.111 -30.833 -1.018 1.00 13.08 C ATOM 259 CD1 ILE A 46 8.132 -28.433 -2.729 1.00 13.42 C ATOM 260 H ILE A 46 5.049 -30.651 -1.693 1.00 0.00 H ATOM 261 N VAL A 47 7.549 -33.822 -0.207 1.00 12.90 N ATOM 262 CA VAL A 47 7.893 -34.536 1.018 1.00 13.09 C ATOM 263 C VAL A 47 9.294 -34.086 1.485 1.00 16.21 C ATOM 264 O VAL A 47 9.486 -33.795 2.672 1.00 15.51 O ATOM 265 CB VAL A 47 7.859 -36.059 0.804 1.00 15.62 C ATOM 266 CG1 VAL A 47 8.306 -36.797 2.072 1.00 15.95 C ATOM 267 CG2 VAL A 47 6.467 -36.520 0.406 1.00 14.74 C ATOM 268 H VAL A 47 7.761 -34.264 -1.124 1.00 0.00 H ATOM 269 N ASN A 48 10.241 -34.056 0.571 1.00 15.63 N ATOM 270 CA ASN A 48 11.588 -33.553 0.827 1.00 15.85 C ATOM 271 C ASN A 48 12.194 -33.122 -0.493 1.00 18.62 C ATOM 272 O ASN A 48 11.505 -33.128 -1.522 1.00 17.14 O ATOM 273 CB ASN A 48 12.442 -34.541 1.608 1.00 17.39 C ATOM 274 CG ASN A 48 12.636 -35.842 0.899 1.00 18.43 C ATOM 275 OD1 ASN A 48 12.833 -35.871 -0.307 1.00 18.58 O ATOM 276 ND2 ASN A 48 12.672 -36.941 1.678 1.00 19.70 N ATOM 277 HD22 ASN A 48 12.497 -36.860 2.700 1.00 0.00 H ATOM 278 HD21 ASN A 48 12.875 -37.870 1.257 1.00 0.00 H ATOM 279 H ASN A 48 10.019 -34.408 -0.382 1.00 0.00 H ATOM 280 N GLU A 49 13.463 -32.753 -0.494 1.00 18.20 N ATOM 281 CA GLU A 49 14.101 -32.248 -1.703 1.00 19.18 C ATOM 282 C GLU A 49 14.107 -33.217 -2.892 1.00 20.42 C ATOM 283 O GLU A 49 14.261 -32.776 -4.026 1.00 20.04 O ATOM 284 CB GLU A 49 15.521 -31.745 -1.412 1.00 22.51 C ATOM 285 CG GLU A 49 16.454 -32.739 -0.754 1.00 33.72 C ATOM 286 CD GLU A 49 16.533 -32.533 0.745 1.00 53.23 C ATOM 287 OE1 GLU A 49 15.459 -32.410 1.382 1.00 31.00 O ATOM 288 OE2 GLU A 49 17.663 -32.411 1.268 1.00 46.38 O ATOM 289 H GLU A 49 14.016 -32.824 0.384 1.00 0.00 H ATOM 290 N LYS A 50 13.962 -34.520 -2.655 1.00 18.49 N ATOM 291 CA LYS A 50 14.014 -35.497 -3.747 1.00 19.75 C ATOM 292 C LYS A 50 12.695 -36.210 -4.000 1.00 19.26 C ATOM 293 O LYS A 50 12.621 -36.986 -4.956 1.00 19.95 O ATOM 294 CB LYS A 50 15.121 -36.532 -3.462 1.00 23.07 C ATOM 295 CG LYS A 50 16.522 -36.027 -3.804 1.00 27.64 C ATOM 296 CD LYS A 50 16.881 -36.166 -5.293 1.00 34.36 C ATOM 297 CE LYS A 50 17.375 -37.554 -5.628 1.00 43.10 C ATOM 298 NZ LYS A 50 17.774 -37.673 -7.051 1.00 50.30 N ATOM 299 HZ1 LYS A 50 16.956 -37.464 -7.658 1.00 0.00 H ATOM 300 HZ2 LYS A 50 18.539 -36.998 -7.253 1.00 0.00 H ATOM 301 HZ3 LYS A 50 18.106 -38.641 -7.237 1.00 0.00 H ATOM 302 H LYS A 50 13.810 -34.849 -1.680 1.00 0.00 H ATOM 303 N TRP A 51 11.633 -35.970 -3.199 1.00 18.50 N ATOM 304 CA TRP A 51 10.434 -36.780 -3.265 1.00 17.39 C ATOM 305 C TRP A 51 9.143 -35.974 -3.216 1.00 18.37 C ATOM 306 O TRP A 51 8.998 -35.090 -2.365 1.00 16.58 O ATOM 307 CB TRP A 51 10.409 -37.763 -2.084 1.00 17.93 C ATOM 308 CG TRP A 51 11.430 -38.853 -2.239 1.00 19.40 C ATOM 309 CD1 TRP A 51 12.664 -38.906 -1.661 1.00 22.14 C ATOM 310 CD2 TRP A 51 11.277 -40.066 -2.987 1.00 20.61 C ATOM 311 NE1 TRP A 51 13.320 -40.055 -2.058 1.00 22.67 N ATOM 312 CE2 TRP A 51 12.471 -40.801 -2.836 1.00 23.97 C ATOM 313 CE3 TRP A 51 10.215 -40.641 -3.705 1.00 21.47 C ATOM 314 CZ2 TRP A 51 12.657 -42.048 -3.440 1.00 24.88 C ATOM 315 CZ3 TRP A 51 10.400 -41.874 -4.304 1.00 24.24 C ATOM 316 CH2 TRP A 51 11.605 -42.565 -4.159 1.00 25.58 C ATOM 317 HE1 TRP A 51 14.296 -40.312 -1.808 1.00 0.00 H ATOM 318 H TRP A 51 11.678 -35.185 -2.519 1.00 0.00 H ATOM 319 N ILE A 52 8.193 -36.339 -4.095 1.00 15.79 N ATOM 320 CA ILE A 52 6.847 -35.781 -4.171 1.00 14.16 C ATOM 321 C ILE A 52 5.827 -36.872 -3.853 1.00 14.04 C ATOM 322 O ILE A 52 6.018 -38.026 -4.260 1.00 16.24 O ATOM 323 CB ILE A 52 6.563 -35.272 -5.622 1.00 15.64 C ATOM 324 CG1 ILE A 52 7.630 -34.267 -6.088 1.00 16.93 C ATOM 325 CG2 ILE A 52 5.142 -34.729 -5.796 1.00 15.53 C ATOM 326 CD1 ILE A 52 7.777 -33.049 -5.193 1.00 16.67 C ATOM 327 H ILE A 52 8.439 -37.083 -4.779 1.00 0.00 H ATOM 328 N VAL A 53 4.755 -36.533 -3.138 1.00 13.97 N ATOM 329 CA VAL A 53 3.640 -37.440 -2.949 1.00 12.51 C ATOM 330 C VAL A 53 2.432 -36.946 -3.748 1.00 15.10 C ATOM 331 O VAL A 53 2.147 -35.726 -3.792 1.00 14.76 O ATOM 332 CB VAL A 53 3.314 -37.668 -1.452 1.00 14.08 C ATOM 333 CG1 VAL A 53 2.841 -36.403 -0.740 1.00 13.66 C ATOM 334 CG2 VAL A 53 2.276 -38.772 -1.295 1.00 14.65 C ATOM 335 H VAL A 53 4.717 -35.589 -2.702 1.00 0.00 H ATOM 336 N THR A 54 1.755 -37.857 -4.425 1.00 13.77 N ATOM 337 CA THR A 54 0.630 -37.562 -5.307 1.00 13.75 C ATOM 338 C THR A 54 -0.379 -38.709 -5.271 1.00 15.93 C ATOM 339 O THR A 54 -0.248 -39.611 -4.432 1.00 15.50 O ATOM 340 CB THR A 54 1.150 -37.261 -6.728 1.00 15.14 C ATOM 341 OG1 THR A 54 0.115 -36.781 -7.578 1.00 15.66 O ATOM 342 CG2 THR A 54 1.746 -38.472 -7.397 1.00 16.77 C ATOM 343 HG1 THR A 54 -0.260 -35.946 -7.200 1.00 0.00 H ATOM 344 H THR A 54 2.043 -38.851 -4.322 1.00 0.00 H ATOM 345 N ALA A 55 -1.354 -38.711 -6.198 1.00 14.79 N ATOM 346 CA ALA A 55 -2.319 -39.784 -6.313 1.00 15.00 C ATOM 347 C ALA A 55 -1.760 -40.770 -7.335 1.00 18.97 C ATOM 348 O ALA A 55 -1.268 -40.398 -8.399 1.00 17.13 O ATOM 349 CB ALA A 55 -3.646 -39.253 -6.791 1.00 15.88 C ATOM 350 H ALA A 55 -1.417 -37.910 -6.858 1.00 0.00 H ATOM 351 N ALA A 56 -1.915 -42.066 -7.061 1.00 17.08 N ATOM 352 CA ALA A 56 -1.437 -43.100 -7.972 1.00 17.99 C ATOM 353 C ALA A 56 -2.152 -43.043 -9.296 1.00 21.14 C ATOM 354 O ALA A 56 -1.537 -43.333 -10.321 1.00 20.04 O ATOM 355 CB ALA A 56 -1.632 -44.478 -7.355 1.00 19.48 C ATOM 356 H ALA A 56 -2.387 -42.346 -6.178 1.00 0.00 H ATOM 357 N HIS A 57 -3.441 -42.660 -9.340 1.00 17.94 N ATOM 358 CA HIS A 57 -4.127 -42.626 -10.651 1.00 19.26 C ATOM 359 C HIS A 57 -3.592 -41.534 -11.579 1.00 21.99 C ATOM 360 O HIS A 57 -3.838 -41.586 -12.785 1.00 22.81 O ATOM 361 CB HIS A 57 -5.658 -42.518 -10.504 1.00 19.58 C ATOM 362 CG HIS A 57 -6.191 -41.136 -10.288 1.00 20.42 C ATOM 363 ND1 HIS A 57 -6.456 -40.650 -9.027 1.00 21.27 N ATOM 364 CD2 HIS A 57 -6.521 -40.188 -11.201 1.00 22.85 C ATOM 365 CE1 HIS A 57 -6.953 -39.437 -9.208 1.00 21.15 C ATOM 366 NE2 HIS A 57 -7.015 -39.127 -10.507 1.00 22.88 N ATOM 367 H HIS A 57 -3.945 -42.393 -8.470 1.00 0.00 H ATOM 368 N CYS A 58 -2.860 -40.554 -11.027 1.00 18.84 N ATOM 369 CA CYS A 58 -2.263 -39.494 -11.854 1.00 19.00 C ATOM 370 C CYS A 58 -1.088 -40.014 -12.645 1.00 22.48 C ATOM 371 O CYS A 58 -0.699 -39.356 -13.611 1.00 22.86 O ATOM 372 CB CYS A 58 -1.783 -38.352 -10.964 1.00 17.44 C ATOM 373 SG CYS A 58 -3.095 -37.407 -10.167 1.00 18.34 S ATOM 374 H CYS A 58 -2.712 -40.544 -9.998 1.00 0.00 H ATOM 375 N VAL A 59 -0.446 -41.113 -12.192 1.00 21.22 N ATOM 376 CA VAL A 59 0.843 -41.534 -12.699 1.00 23.23 C ATOM 377 C VAL A 59 0.859 -43.039 -12.998 1.00 35.32 C ATOM 378 O VAL A 59 1.904 -43.660 -12.900 1.00 39.81 O ATOM 379 CB VAL A 59 1.946 -41.079 -11.673 1.00 24.38 C ATOM 380 CG1 VAL A 59 1.948 -39.549 -11.525 1.00 23.41 C ATOM 381 CG2 VAL A 59 1.765 -41.725 -10.296 1.00 24.37 C ATOM 382 H VAL A 59 -0.897 -41.681 -11.447 1.00 0.00 H ATOM 383 N GLU A 60 -0.296 -43.597 -13.404 1.00 35.73 N ATOM 384 CA GLU A 60 -0.465 -45.034 -13.698 1.00 38.99 C ATOM 385 C GLU A 60 0.165 -45.467 -15.013 1.00 46.29 C ATOM 386 O GLU A 60 0.702 -46.580 -15.080 1.00 46.97 O ATOM 387 CB GLU A 60 -1.977 -45.415 -13.656 1.00 41.32 C ATOM 388 CG GLU A 60 -2.397 -46.690 -14.397 1.00 56.60 C ATOM 389 CD GLU A 60 -1.837 -47.999 -13.874 1.00 89.09 C ATOM 390 OE1 GLU A 60 -1.876 -48.213 -12.642 1.00 86.02 O ATOM 391 OE2 GLU A 60 -1.414 -48.836 -14.704 1.00 89.37 O ATOM 392 H GLU A 60 -1.123 -42.976 -13.518 1.00 0.00 H ATOM 393 N THR A 60A 0.069 -44.645 -16.064 1.00 45.08 N ATOM 394 CA THR A 60A 0.564 -45.052 -17.383 1.00 47.25 C ATOM 395 C THR A 60A 2.103 -45.099 -17.470 1.00 53.96 C ATOM 396 O THR A 60A 2.619 -45.714 -18.396 1.00 54.88 O ATOM 397 CB THR A 60A -0.059 -44.198 -18.501 1.00 56.24 C ATOM 398 OG1 THR A 60A 0.349 -42.835 -18.374 1.00 54.85 O ATOM 399 CG2 THR A 60A -1.582 -44.282 -18.517 1.00 54.93 C ATOM 400 HG1 THR A 60A -0.060 -42.300 -19.100 1.00 0.00 H ATOM 401 H THR A 60A -0.362 -43.706 -15.944 1.00 0.00 H ATOM 402 N GLY A 61 2.820 -44.497 -16.516 1.00 50.76 N ATOM 403 CA GLY A 61 4.282 -44.517 -16.530 1.00 50.90 C ATOM 404 C GLY A 61 4.901 -43.677 -17.635 1.00 53.42 C ATOM 405 O GLY A 61 6.054 -43.897 -18.014 1.00 53.49 O ATOM 406 H GLY A 61 2.326 -44.003 -15.746 1.00 0.00 H ATOM 407 N VAL A 62 4.142 -42.690 -18.144 1.00 48.71 N ATOM 408 CA VAL A 62 4.589 -41.765 -19.178 1.00 48.33 C ATOM 409 C VAL A 62 5.444 -40.706 -18.464 1.00 47.81 C ATOM 410 O VAL A 62 5.372 -40.601 -17.233 1.00 45.68 O ATOM 411 CB VAL A 62 3.347 -41.170 -19.921 1.00 53.71 C ATOM 412 CG1 VAL A 62 3.724 -40.048 -20.889 1.00 54.28 C ATOM 413 CG2 VAL A 62 2.596 -42.267 -20.675 1.00 55.01 C ATOM 414 H VAL A 62 3.175 -42.580 -17.777 1.00 0.00 H ATOM 415 N LYS A 63 6.275 -39.962 -19.214 1.00 42.76 N ATOM 416 CA LYS A 63 7.134 -38.915 -18.652 1.00 41.38 C ATOM 417 C LYS A 63 6.307 -37.864 -17.893 1.00 39.08 C ATOM 418 O LYS A 63 5.200 -37.520 -18.309 1.00 37.75 O ATOM 419 CB LYS A 63 8.059 -38.275 -19.729 1.00 45.14 C ATOM 420 CG LYS A 63 7.905 -36.765 -19.955 1.00 68.23 C ATOM 421 CD LYS A 63 8.947 -36.232 -20.922 1.00 85.89 C ATOM 422 CE LYS A 63 8.817 -34.742 -21.115 1.00102.98 C ATOM 423 NZ LYS A 63 9.935 -34.185 -21.920 1.00116.56 N ATOM 424 HZ1 LYS A 63 10.836 -34.373 -21.436 1.00 0.00 H ATOM 425 HZ2 LYS A 63 9.943 -34.635 -22.858 1.00 0.00 H ATOM 426 HZ3 LYS A 63 9.805 -33.159 -22.028 1.00 0.00 H ATOM 427 H LYS A 63 6.310 -40.137 -20.239 1.00 0.00 H ATOM 428 N ILE A 64 6.823 -37.419 -16.741 1.00 32.64 N ATOM 429 CA ILE A 64 6.172 -36.408 -15.907 1.00 28.96 C ATOM 430 C ILE A 64 7.206 -35.343 -15.578 1.00 28.44 C ATOM 431 O ILE A 64 8.345 -35.685 -15.271 1.00 28.11 O ATOM 432 CB ILE A 64 5.630 -37.001 -14.573 1.00 30.37 C ATOM 433 CG1 ILE A 64 4.604 -38.118 -14.765 1.00 31.18 C ATOM 434 CG2 ILE A 64 5.002 -35.890 -13.691 1.00 30.40 C ATOM 435 CD1 ILE A 64 4.623 -39.107 -13.575 1.00 37.83 C ATOM 436 H ILE A 64 7.732 -37.811 -16.423 1.00 0.00 H ATOM 437 N THR A 65 6.796 -34.077 -15.645 1.00 24.31 N ATOM 438 CA THR A 65 7.600 -32.947 -15.218 1.00 24.44 C ATOM 439 C THR A 65 6.906 -32.475 -13.926 1.00 24.72 C ATOM 440 O THR A 65 5.694 -32.215 -13.943 1.00 23.67 O ATOM 441 CB THR A 65 7.656 -31.801 -16.260 1.00 24.05 C ATOM 442 OG1 THR A 65 8.264 -32.283 -17.468 1.00 33.59 O ATOM 443 CG2 THR A 65 8.433 -30.578 -15.758 1.00 29.57 C ATOM 444 HG1 THR A 65 7.728 -33.033 -17.829 1.00 0.00 H ATOM 445 H THR A 65 5.846 -33.888 -16.025 1.00 0.00 H ATOM 446 N VAL A 66 7.693 -32.268 -12.857 1.00 20.82 N ATOM 447 CA VAL A 66 7.220 -31.655 -11.611 1.00 17.94 C ATOM 448 C VAL A 66 7.701 -30.204 -11.580 1.00 17.99 C ATOM 449 O VAL A 66 8.890 -29.962 -11.875 1.00 18.24 O ATOM 450 CB VAL A 66 7.801 -32.371 -10.390 1.00 20.60 C ATOM 451 CG1 VAL A 66 7.549 -31.574 -9.097 1.00 19.31 C ATOM 452 CG2 VAL A 66 7.225 -33.781 -10.270 1.00 21.37 C ATOM 453 H VAL A 66 8.690 -32.558 -12.916 1.00 0.00 H ATOM 454 N VAL A 67 6.830 -29.260 -11.235 1.00 15.47 N ATOM 455 CA VAL A 67 7.246 -27.882 -11.049 1.00 14.98 C ATOM 456 C VAL A 67 6.881 -27.474 -9.623 1.00 14.44 C ATOM 457 O VAL A 67 5.686 -27.435 -9.252 1.00 13.90 O ATOM 458 CB VAL A 67 6.672 -26.909 -12.083 1.00 15.49 C ATOM 459 CG1 VAL A 67 7.345 -25.555 -11.949 1.00 15.12 C ATOM 460 CG2 VAL A 67 6.813 -27.455 -13.515 1.00 17.31 C ATOM 461 H VAL A 67 5.831 -29.514 -11.096 1.00 0.00 H ATOM 462 N ALA A 68 7.928 -27.150 -8.833 1.00 14.01 N ATOM 463 CA ALA A 68 7.793 -26.585 -7.489 1.00 13.06 C ATOM 464 C ALA A 68 7.964 -25.082 -7.612 1.00 13.74 C ATOM 465 O ALA A 68 8.489 -24.591 -8.615 1.00 14.19 O ATOM 466 CB ALA A 68 8.850 -27.155 -6.558 1.00 13.80 C ATOM 467 H ALA A 68 8.887 -27.312 -9.201 1.00 0.00 H ATOM 468 N GLY A 69 7.510 -24.336 -6.629 1.00 12.66 N ATOM 469 CA GLY A 69 7.627 -22.886 -6.679 1.00 12.60 C ATOM 470 C GLY A 69 6.782 -22.234 -7.756 1.00 13.11 C ATOM 471 O GLY A 69 7.043 -21.095 -8.142 1.00 14.15 O ATOM 472 H GLY A 69 7.062 -24.787 -5.806 1.00 0.00 H ATOM 473 N GLU A 70 5.741 -22.931 -8.200 1.00 12.91 N ATOM 474 CA GLU A 70 4.836 -22.422 -9.226 1.00 13.18 C ATOM 475 C GLU A 70 3.745 -21.548 -8.628 1.00 13.49 C ATOM 476 O GLU A 70 3.351 -21.731 -7.466 1.00 13.52 O ATOM 477 CB GLU A 70 4.239 -23.595 -9.997 1.00 14.19 C ATOM 478 CG GLU A 70 3.393 -23.300 -11.237 1.00 15.66 C ATOM 479 CD GLU A 70 4.104 -22.467 -12.284 1.00 15.05 C ATOM 480 OE1 GLU A 70 4.243 -21.249 -12.038 1.00 14.91 O ATOM 481 OE2 GLU A 70 4.463 -23.013 -13.356 1.00 19.50 O ATOM 482 H GLU A 70 5.564 -23.875 -7.801 1.00 0.00 H ATOM 483 N HIS A 71 3.238 -20.630 -9.410 1.00 13.18 N ATOM 484 CA HIS A 71 2.205 -19.715 -8.983 1.00 13.41 C ATOM 485 C HIS A 71 1.231 -19.528 -10.113 1.00 16.53 C ATOM 486 O HIS A 71 0.081 -19.959 -10.000 1.00 14.66 O ATOM 487 CB HIS A 71 2.803 -18.400 -8.489 1.00 13.42 C ATOM 488 CG HIS A 71 1.781 -17.473 -7.946 1.00 14.83 C ATOM 489 ND1 HIS A 71 1.027 -17.806 -6.852 1.00 16.36 N ATOM 490 CD2 HIS A 71 1.319 -16.305 -8.452 1.00 15.84 C ATOM 491 CE1 HIS A 71 0.198 -16.799 -6.670 1.00 15.34 C ATOM 492 NE2 HIS A 71 0.335 -15.877 -7.607 1.00 17.63 N ATOM 493 H HIS A 71 3.595 -20.556 -10.384 1.00 0.00 H ATOM 494 N ASN A 72 1.673 -18.908 -11.216 1.00 15.16 N ATOM 495 CA ASN A 72 0.836 -18.697 -12.375 1.00 16.07 C ATOM 496 C ASN A 72 1.401 -19.616 -13.474 1.00 18.68 C ATOM 497 O ASN A 72 2.511 -19.391 -13.950 1.00 18.83 O ATOM 498 CB ASN A 72 0.854 -17.237 -12.803 1.00 16.61 C ATOM 499 CG ASN A 72 -0.057 -16.945 -13.964 1.00 18.58 C ATOM 500 OD1 ASN A 72 -0.246 -17.764 -14.825 1.00 18.89 O ATOM 501 ND2 ASN A 72 -0.643 -15.766 -13.979 1.00 23.25 N ATOM 502 HD22 ASN A 72 -0.456 -15.083 -13.218 1.00 0.00 H ATOM 503 HD21 ASN A 72 -1.293 -15.518 -14.752 1.00 0.00 H ATOM 504 H ASN A 72 2.655 -18.566 -11.239 1.00 0.00 H ATOM 505 N ILE A 73 0.662 -20.658 -13.845 1.00 17.58 N ATOM 506 CA ILE A 73 1.137 -21.648 -14.802 1.00 19.32 C ATOM 507 C ILE A 73 1.272 -21.126 -16.238 1.00 24.11 C ATOM 508 O ILE A 73 1.862 -21.843 -17.048 1.00 24.28 O ATOM 509 CB ILE A 73 0.366 -22.992 -14.770 1.00 22.14 C ATOM 510 CG1 ILE A 73 -1.142 -22.818 -15.058 1.00 23.20 C ATOM 511 CG2 ILE A 73 0.635 -23.729 -13.445 1.00 21.96 C ATOM 512 CD1 ILE A 73 -1.901 -24.164 -15.254 1.00 28.27 C ATOM 513 H ILE A 73 -0.288 -20.770 -13.437 1.00 0.00 H ATOM 514 N GLU A 74 0.790 -19.906 -16.553 1.00 22.13 N ATOM 515 CA GLU A 74 0.951 -19.339 -17.892 1.00 23.29 C ATOM 516 C GLU A 74 1.957 -18.172 -17.906 1.00 27.21 C ATOM 517 O GLU A 74 2.045 -17.449 -18.907 1.00 28.06 O ATOM 518 CB GLU A 74 -0.413 -18.935 -18.479 1.00 25.55 C ATOM 519 CG GLU A 74 -1.074 -20.035 -19.294 1.00 38.46 C ATOM 520 CD GLU A 74 -2.088 -19.509 -20.291 1.00 49.29 C ATOM 521 OE1 GLU A 74 -2.972 -18.728 -19.873 1.00 37.43 O ATOM 522 OE2 GLU A 74 -1.964 -19.824 -21.497 1.00 39.82 O ATOM 523 H GLU A 74 0.291 -19.355 -15.826 1.00 0.00 H ATOM 524 N GLU A 75 2.728 -17.992 -16.828 1.00 23.93 N ATOM 525 CA GLU A 75 3.758 -16.964 -16.727 1.00 23.96 C ATOM 526 C GLU A 75 5.050 -17.585 -16.239 1.00 28.43 C ATOM 527 O GLU A 75 5.065 -18.246 -15.209 1.00 25.53 O ATOM 528 CB GLU A 75 3.333 -15.810 -15.822 1.00 25.74 C ATOM 529 CG GLU A 75 2.101 -15.103 -16.350 1.00 35.21 C ATOM 530 CD GLU A 75 1.751 -13.783 -15.693 1.00 60.89 C ATOM 531 OE1 GLU A 75 0.837 -13.101 -16.211 1.00 51.26 O ATOM 532 OE2 GLU A 75 2.371 -13.434 -14.661 1.00 56.06 O ATOM 533 H GLU A 75 2.585 -18.622 -16.013 1.00 0.00 H ATOM 534 N THR A 76 6.136 -17.436 -17.003 1.00 30.02 N ATOM 535 CA THR A 76 7.427 -17.962 -16.582 1.00 30.42 C ATOM 536 C THR A 76 7.932 -16.978 -15.584 1.00 35.00 C ATOM 537 O THR A 76 8.208 -15.830 -15.943 1.00 40.20 O ATOM 538 CB THR A 76 8.384 -18.046 -17.776 1.00 34.23 C ATOM 539 OG1 THR A 76 7.807 -18.920 -18.734 1.00 42.28 O ATOM 540 CG2 THR A 76 9.754 -18.570 -17.384 1.00 34.87 C ATOM 541 HG1 THR A 76 8.408 -18.992 -19.518 1.00 0.00 H ATOM 542 H THR A 76 6.058 -16.937 -17.912 1.00 0.00 H ATOM 543 N GLU A 77 8.077 -17.402 -14.348 1.00 29.04 N ATOM 544 CA GLU A 77 8.537 -16.497 -13.314 1.00 28.02 C ATOM 545 C GLU A 77 9.940 -16.950 -12.822 1.00 27.24 C ATOM 546 O GLU A 77 10.684 -17.536 -13.609 1.00 30.17 O ATOM 547 CB GLU A 77 7.472 -16.276 -12.251 1.00 30.46 C ATOM 548 CG GLU A 77 6.192 -15.658 -12.808 1.00 46.99 C ATOM 549 CD GLU A 77 5.131 -15.335 -11.770 1.00 76.71 C ATOM 550 OE1 GLU A 77 5.310 -15.716 -10.590 1.00 88.73 O ATOM 551 OE2 GLU A 77 4.086 -14.761 -12.151 1.00 73.36 O ATOM 552 H GLU A 77 7.861 -18.391 -14.111 1.00 0.00 H ATOM 553 N HIS A 78 10.365 -16.624 -11.585 1.00 19.43 N ATOM 554 CA HIS A 78 11.717 -16.977 -11.090 1.00 19.33 C ATOM 555 C HIS A 78 11.768 -17.976 -9.932 1.00 19.01 C ATOM 556 O HIS A 78 12.848 -18.503 -9.632 1.00 19.73 O ATOM 557 CB HIS A 78 12.481 -15.711 -10.693 1.00 21.47 C ATOM 558 CG HIS A 78 12.840 -14.867 -11.857 1.00 25.34 C ATOM 559 ND1 HIS A 78 13.947 -15.149 -12.632 1.00 26.87 N ATOM 560 CD2 HIS A 78 12.216 -13.782 -12.364 1.00 27.83 C ATOM 561 CE1 HIS A 78 13.993 -14.207 -13.548 1.00 27.54 C ATOM 562 NE2 HIS A 78 12.962 -13.371 -13.442 1.00 28.59 N ATOM 563 H HIS A 78 9.720 -16.106 -10.955 1.00 0.00 H ATOM 564 N THR A 79 10.658 -18.240 -9.268 1.00 14.09 N ATOM 565 CA THR A 79 10.695 -19.201 -8.194 1.00 13.08 C ATOM 566 C THR A 79 10.495 -20.648 -8.642 1.00 12.65 C ATOM 567 O THR A 79 10.671 -21.563 -7.850 1.00 13.84 O ATOM 568 CB THR A 79 9.698 -18.795 -7.116 1.00 14.46 C ATOM 569 OG1 THR A 79 8.399 -18.822 -7.671 1.00 17.10 O ATOM 570 CG2 THR A 79 9.987 -17.433 -6.564 1.00 14.50 C ATOM 571 HG1 THR A 79 8.197 -19.737 -7.991 1.00 0.00 H ATOM 572 H THR A 79 9.769 -17.761 -9.516 1.00 0.00 H ATOM 573 N GLU A 80 10.072 -20.862 -9.889 1.00 13.77 N ATOM 574 CA GLU A 80 9.819 -22.214 -10.354 1.00 13.88 C ATOM 575 C GLU A 80 11.078 -23.050 -10.413 1.00 14.84 C ATOM 576 O GLU A 80 12.134 -22.566 -10.874 1.00 16.20 O ATOM 577 CB GLU A 80 9.240 -22.213 -11.768 1.00 16.06 C ATOM 578 CG GLU A 80 7.873 -21.552 -11.909 1.00 17.16 C ATOM 579 CD GLU A 80 7.899 -20.124 -12.381 1.00 30.19 C ATOM 580 OE1 GLU A 80 8.778 -19.388 -11.894 1.00 28.05 O ATOM 581 OE2 GLU A 80 7.159 -19.789 -13.337 1.00 24.41 O ATOM 582 H GLU A 80 9.923 -20.057 -10.531 1.00 0.00 H ATOM 583 N GLN A 81 10.964 -24.292 -9.974 1.00 14.57 N ATOM 584 CA GLN A 81 12.008 -25.300 -10.062 1.00 13.44 C ATOM 585 C GLN A 81 11.427 -26.509 -10.739 1.00 15.34 C ATOM 586 O GLN A 81 10.506 -27.138 -10.203 1.00 16.17 O ATOM 587 CB GLN A 81 12.580 -25.676 -8.696 1.00 14.80 C ATOM 588 CG GLN A 81 13.320 -24.533 -8.024 1.00 15.39 C ATOM 589 CD GLN A 81 13.907 -24.993 -6.712 1.00 17.56 C ATOM 590 OE1 GLN A 81 14.411 -26.119 -6.593 1.00 19.60 O ATOM 591 NE2 GLN A 81 13.962 -24.109 -5.739 1.00 14.69 N ATOM 592 HE22 GLN A 81 13.531 -23.171 -5.864 1.00 0.00 H ATOM 593 HE21 GLN A 81 14.436 -24.349 -4.845 1.00 0.00 H ATOM 594 H GLN A 81 10.063 -24.568 -9.534 1.00 0.00 H ATOM 595 N LYS A 82 11.874 -26.753 -11.963 1.00 16.65 N ATOM 596 CA LYS A 82 11.385 -27.873 -12.749 1.00 17.04 C ATOM 597 C LYS A 82 12.284 -29.060 -12.552 1.00 19.42 C ATOM 598 O LYS A 82 13.504 -28.920 -12.544 1.00 19.48 O ATOM 599 CB LYS A 82 11.363 -27.519 -14.242 1.00 20.58 C ATOM 600 CG LYS A 82 10.536 -26.311 -14.554 1.00 28.34 C ATOM 601 CD LYS A 82 10.416 -26.050 -16.047 1.00 39.74 C ATOM 602 CE LYS A 82 9.163 -25.285 -16.372 1.00 53.24 C ATOM 603 NZ LYS A 82 8.946 -24.122 -15.457 1.00 58.17 N ATOM 604 HZ1 LYS A 82 8.868 -24.463 -14.478 1.00 0.00 H ATOM 605 HZ2 LYS A 82 9.750 -23.467 -15.534 1.00 0.00 H ATOM 606 HZ3 LYS A 82 8.070 -23.630 -15.725 1.00 0.00 H ATOM 607 H LYS A 82 12.595 -26.125 -12.372 1.00 0.00 H ATOM 608 N ARG A 83 11.710 -30.244 -12.379 1.00 18.45 N ATOM 609 CA ARG A 83 12.511 -31.446 -12.236 1.00 20.59 C ATOM 610 C ARG A 83 11.847 -32.588 -13.002 1.00 22.11 C ATOM 611 O ARG A 83 10.632 -32.630 -13.147 1.00 22.65 O ATOM 612 CB ARG A 83 12.644 -31.814 -10.751 1.00 21.82 C ATOM 613 CG ARG A 83 13.430 -30.808 -9.891 1.00 21.61 C ATOM 614 CD ARG A 83 14.913 -30.690 -10.282 1.00 22.43 C ATOM 615 NE ARG A 83 15.670 -29.865 -9.330 1.00 20.17 N ATOM 616 CZ ARG A 83 15.755 -28.537 -9.375 1.00 23.13 C ATOM 617 NH1 ARG A 83 15.165 -27.861 -10.347 1.00 20.74 N ATOM 618 NH2 ARG A 83 16.425 -27.879 -8.438 1.00 21.73 N ATOM 619 HE ARG A 83 16.177 -30.354 -8.565 1.00 0.00 H ATOM 620 HH12 ARG A 83 15.235 -26.824 -10.376 1.00 0.00 H ATOM 621 HH11 ARG A 83 14.631 -28.367 -11.082 1.00 0.00 H ATOM 622 HH22 ARG A 83 16.489 -26.842 -8.476 1.00 0.00 H ATOM 623 HH21 ARG A 83 16.886 -28.400 -7.665 1.00 0.00 H ATOM 624 H ARG A 83 10.673 -30.311 -12.345 1.00 0.00 H ATOM 625 N ASN A 84 12.663 -33.536 -13.463 1.00 24.01 N ATOM 626 CA ASN A 84 12.144 -34.719 -14.121 1.00 24.49 C ATOM 627 C ASN A 84 11.931 -35.829 -13.099 1.00 26.04 C ATOM 628 O ASN A 84 12.687 -35.942 -12.142 1.00 27.97 O ATOM 629 CB ASN A 84 13.150 -35.222 -15.134 1.00 24.09 C ATOM 630 CG ASN A 84 13.511 -34.192 -16.180 1.00 32.58 C ATOM 631 OD1 ASN A 84 12.647 -33.694 -16.905 1.00 40.61 O ATOM 632 ND2 ASN A 84 14.787 -33.828 -16.274 1.00 40.77 N ATOM 633 HD22 ASN A 84 15.499 -34.262 -15.652 1.00 0.00 H ATOM 634 HD21 ASN A 84 15.073 -33.110 -16.970 1.00 0.00 H ATOM 635 H ASN A 84 13.691 -33.425 -13.349 1.00 0.00 H ATOM 636 N VAL A 85 10.899 -36.641 -13.297 1.00 23.59 N ATOM 637 CA VAL A 85 10.619 -37.801 -12.443 1.00 23.19 C ATOM 638 C VAL A 85 11.447 -38.978 -12.963 1.00 26.12 C ATOM 639 O VAL A 85 11.309 -39.348 -14.144 1.00 28.05 O ATOM 640 CB VAL A 85 9.107 -38.117 -12.406 1.00 25.77 C ATOM 641 CG1 VAL A 85 8.825 -39.418 -11.640 1.00 25.78 C ATOM 642 CG2 VAL A 85 8.349 -36.949 -11.782 1.00 23.73 C ATOM 643 H VAL A 85 10.260 -36.446 -14.094 1.00 0.00 H ATOM 644 N ILE A 86 12.323 -39.548 -12.094 1.00 24.01 N ATOM 645 CA ILE A 86 13.173 -40.698 -12.469 1.00 25.67 C ATOM 646 C ILE A 86 12.560 -42.017 -12.029 1.00 28.01 C ATOM 647 O ILE A 86 12.866 -43.038 -12.647 1.00 30.16 O ATOM 648 CB ILE A 86 14.646 -40.565 -12.014 1.00 29.60 C ATOM 649 CG1 ILE A 86 14.815 -40.471 -10.477 1.00 31.05 C ATOM 650 CG2 ILE A 86 15.250 -39.368 -12.733 1.00 32.33 C ATOM 651 CD1 ILE A 86 16.246 -40.639 -9.987 1.00 35.71 C ATOM 652 H ILE A 86 12.398 -39.162 -11.131 1.00 0.00 H ATOM 653 N ARG A 87 11.731 -42.020 -10.973 1.00 24.70 N ATOM 654 CA ARG A 87 11.055 -43.236 -10.519 1.00 25.28 C ATOM 655 C ARG A 87 9.687 -42.921 -9.953 1.00 26.66 C ATOM 656 O ARG A 87 9.518 -41.873 -9.332 1.00 24.16 O ATOM 657 CB ARG A 87 11.884 -43.990 -9.461 1.00 30.60 C ATOM 658 CG ARG A 87 12.976 -44.855 -10.080 1.00 47.43 C ATOM 659 CD ARG A 87 13.782 -45.636 -9.056 1.00 57.25 C ATOM 660 NE ARG A 87 14.841 -44.816 -8.468 1.00 61.11 N ATOM 661 CZ ARG A 87 15.987 -44.479 -9.060 1.00 64.09 C ATOM 662 NH1 ARG A 87 16.263 -44.902 -10.296 1.00 49.34 N ATOM 663 NH2 ARG A 87 16.868 -43.717 -8.425 1.00 42.04 N ATOM 664 HE ARG A 87 14.686 -44.464 -7.502 1.00 0.00 H ATOM 665 HH12 ARG A 87 17.160 -44.634 -10.749 1.00 0.00 H ATOM 666 HH11 ARG A 87 15.581 -45.500 -10.805 1.00 0.00 H ATOM 667 HH22 ARG A 87 17.761 -43.456 -8.890 1.00 0.00 H ATOM 668 HH21 ARG A 87 16.666 -43.380 -7.462 1.00 0.00 H ATOM 669 H ARG A 87 11.564 -41.130 -10.461 1.00 0.00 H ATOM 670 N ILE A 88 8.718 -43.845 -10.172 1.00 23.02 N ATOM 671 CA ILE A 88 7.356 -43.757 -9.668 1.00 21.63 C ATOM 672 C ILE A 88 7.138 -44.952 -8.766 1.00 23.85 C ATOM 673 O ILE A 88 7.353 -46.099 -9.208 1.00 23.96 O ATOM 674 CB ILE A 88 6.302 -43.726 -10.802 1.00 24.90 C ATOM 675 CG1 ILE A 88 6.541 -42.533 -11.750 1.00 26.48 C ATOM 676 CG2 ILE A 88 4.878 -43.699 -10.219 1.00 25.92 C ATOM 677 CD1 ILE A 88 5.813 -42.642 -13.070 1.00 33.00 C ATOM 678 H ILE A 88 8.967 -44.678 -10.743 1.00 0.00 H ATOM 679 N ILE A 89 6.712 -44.706 -7.526 1.00 21.69 N ATOM 680 CA ILE A 89 6.422 -45.765 -6.590 1.00 21.83 C ATOM 681 C ILE A 89 4.969 -45.651 -6.196 1.00 20.44 C ATOM 682 O ILE A 89 4.631 -44.956 -5.224 1.00 20.69 O ATOM 683 CB ILE A 89 7.300 -45.781 -5.304 1.00 25.21 C ATOM 684 CG1 ILE A 89 8.781 -45.688 -5.647 1.00 27.65 C ATOM 685 CG2 ILE A 89 7.018 -47.049 -4.443 1.00 24.64 C ATOM 686 CD1 ILE A 89 9.676 -45.547 -4.393 1.00 31.34 C ATOM 687 H ILE A 89 6.585 -43.719 -7.224 1.00 0.00 H ATOM 688 N PRO A 90 4.091 -46.339 -6.948 1.00 20.29 N ATOM 689 CA PRO A 90 2.712 -46.460 -6.476 1.00 19.60 C ATOM 690 C PRO A 90 2.694 -47.273 -5.185 1.00 23.43 C ATOM 691 O PRO A 90 3.539 -48.156 -5.005 1.00 22.47 O ATOM 692 CB PRO A 90 1.991 -47.235 -7.587 1.00 22.66 C ATOM 693 CG PRO A 90 2.969 -47.394 -8.693 1.00 27.93 C ATOM 694 CD PRO A 90 4.329 -47.225 -8.100 1.00 23.83 C ATOM 695 N HIS A 91 1.730 -47.014 -4.310 1.00 21.63 N ATOM 696 CA HIS A 91 1.639 -47.815 -3.091 1.00 21.70 C ATOM 697 C HIS A 91 1.533 -49.291 -3.485 1.00 25.63 C ATOM 698 O HIS A 91 0.889 -49.609 -4.501 1.00 24.15 O ATOM 699 CB HIS A 91 0.420 -47.393 -2.259 1.00 21.52 C ATOM 700 CG HIS A 91 0.399 -48.008 -0.903 1.00 23.31 C ATOM 701 ND1 HIS A 91 -0.275 -49.196 -0.659 1.00 25.74 N ATOM 702 CD2 HIS A 91 1.043 -47.632 0.222 1.00 24.39 C ATOM 703 CE1 HIS A 91 -0.047 -49.475 0.625 1.00 26.04 C ATOM 704 NE2 HIS A 91 0.743 -48.556 1.190 1.00 24.78 N ATOM 705 H HIS A 91 1.048 -46.250 -4.490 1.00 0.00 H ATOM 706 N HIS A 92 2.154 -50.194 -2.693 1.00 23.85 N ATOM 707 CA HIS A 92 2.154 -51.633 -2.981 1.00 25.32 C ATOM 708 C HIS A 92 0.754 -52.248 -3.048 1.00 26.02 C ATOM 709 O HIS A 92 0.598 -53.258 -3.714 1.00 28.86 O ATOM 710 CB HIS A 92 3.025 -52.425 -1.978 1.00 26.97 C ATOM 711 CG HIS A 92 2.856 -51.987 -0.556 1.00 29.89 C ATOM 712 ND1 HIS A 92 3.536 -50.891 -0.056 1.00 31.03 N ATOM 713 CD2 HIS A 92 2.117 -52.535 0.436 1.00 32.48 C ATOM 714 CE1 HIS A 92 3.162 -50.784 1.210 1.00 30.78 C ATOM 715 NE2 HIS A 92 2.325 -51.766 1.552 1.00 31.71 N ATOM 716 H HIS A 92 2.652 -49.855 -1.845 1.00 0.00 H ATOM 717 N ASN A 93 -0.258 -51.626 -2.414 1.00 25.24 N ATOM 718 CA ASN A 93 -1.627 -52.152 -2.490 1.00 26.30 C ATOM 719 C ASN A 93 -2.452 -51.511 -3.588 1.00 26.86 C ATOM 720 O ASN A 93 -3.595 -51.910 -3.773 1.00 25.69 O ATOM 721 CB ASN A 93 -2.324 -52.008 -1.142 1.00 28.55 C ATOM 722 CG ASN A 93 -1.679 -52.858 -0.081 1.00 33.44 C ATOM 723 OD1 ASN A 93 -1.049 -53.876 -0.363 1.00 34.89 O ATOM 724 ND2 ASN A 93 -1.845 -52.471 1.158 1.00 33.79 N ATOM 725 HD22 ASN A 93 -2.383 -51.605 1.365 1.00 0.00 H ATOM 726 HD21 ASN A 93 -1.439 -53.029 1.936 1.00 0.00 H ATOM 727 H ASN A 93 -0.068 -50.764 -1.865 1.00 0.00 H ATOM 728 N TYR A 94 -1.903 -50.552 -4.366 1.00 22.47 N ATOM 729 CA TYR A 94 -2.637 -49.982 -5.467 1.00 21.47 C ATOM 730 C TYR A 94 -2.715 -50.982 -6.630 1.00 26.02 C ATOM 731 O TYR A 94 -1.703 -51.570 -7.020 1.00 26.70 O ATOM 732 CB TYR A 94 -1.927 -48.720 -5.957 1.00 21.23 C ATOM 733 CG TYR A 94 -2.716 -47.968 -7.004 1.00 20.32 C ATOM 734 CD1 TYR A 94 -3.900 -47.329 -6.679 1.00 21.99 C ATOM 735 CD2 TYR A 94 -2.304 -47.941 -8.327 1.00 22.49 C ATOM 736 CE1 TYR A 94 -4.642 -46.652 -7.627 1.00 23.01 C ATOM 737 CE2 TYR A 94 -3.050 -47.278 -9.298 1.00 22.95 C ATOM 738 CZ TYR A 94 -4.182 -46.568 -8.930 1.00 24.03 C ATOM 739 OH TYR A 94 -4.917 -45.899 -9.884 1.00 24.91 O ATOM 740 HH TYR A 94 -5.685 -45.449 -9.451 1.00 0.00 H ATOM 741 H TYR A 94 -0.937 -50.221 -4.167 1.00 0.00 H ATOM 742 N ASN A 95 -3.909 -51.141 -7.210 1.00 22.95 N ATOM 743 CA ASN A 95 -4.117 -51.996 -8.351 1.00 24.37 C ATOM 744 C ASN A 95 -5.177 -51.340 -9.232 1.00 29.42 C ATOM 745 O ASN A 95 -6.375 -51.479 -9.015 1.00 27.61 O ATOM 746 CB ASN A 95 -4.535 -53.425 -7.931 1.00 25.13 C ATOM 747 CG ASN A 95 -4.666 -54.338 -9.130 1.00 33.23 C ATOM 748 OD1 ASN A 95 -4.776 -53.878 -10.279 1.00 32.30 O ATOM 749 ND2 ASN A 95 -4.594 -55.642 -8.929 1.00 29.41 N ATOM 750 HD22 ASN A 95 -4.502 -56.015 -7.963 1.00 0.00 H ATOM 751 HD21 ASN A 95 -4.629 -56.295 -9.737 1.00 0.00 H ATOM 752 H ASN A 95 -4.724 -50.625 -6.821 1.00 0.00 H ATOM 753 N ALA A 95A -4.733 -50.588 -10.224 1.00 28.62 N ATOM 754 CA ALA A 95A -5.658 -49.882 -11.112 1.00 29.51 C ATOM 755 C ALA A 95A -6.597 -50.768 -11.893 1.00 34.17 C ATOM 756 O ALA A 95A -7.663 -50.303 -12.303 1.00 34.66 O ATOM 757 CB ALA A 95A -4.879 -49.024 -12.096 1.00 30.43 C ATOM 758 H ALA A 95A -3.708 -50.496 -10.376 1.00 0.00 H ATOM 759 N ALA A 95B -6.212 -52.034 -12.129 1.00 30.18 N ATOM 760 CA ALA A 95B -7.051 -52.981 -12.853 1.00 32.37 C ATOM 761 C ALA A 95B -8.320 -53.338 -12.040 1.00 37.10 C ATOM 762 O ALA A 95B -9.301 -53.778 -12.629 1.00 40.58 O ATOM 763 CB ALA A 95B -6.262 -54.247 -13.176 1.00 34.61 C ATOM 764 H ALA A 95B -5.283 -52.349 -11.783 1.00 0.00 H ATOM 765 N ILE A 96 -8.280 -53.198 -10.705 1.00 30.12 N ATOM 766 CA ILE A 96 -9.426 -53.473 -9.834 1.00 30.67 C ATOM 767 C ILE A 96 -10.129 -52.190 -9.455 1.00 33.92 C ATOM 768 O ILE A 96 -11.361 -52.136 -9.488 1.00 34.00 O ATOM 769 CB ILE A 96 -8.973 -54.251 -8.571 1.00 32.41 C ATOM 770 CG1 ILE A 96 -8.330 -55.588 -8.976 1.00 34.57 C ATOM 771 CG2 ILE A 96 -10.142 -54.494 -7.584 1.00 32.59 C ATOM 772 CD1 ILE A 96 -7.596 -56.300 -7.873 1.00 39.57 C ATOM 773 H ILE A 96 -7.392 -52.879 -10.268 1.00 0.00 H ATOM 774 N ASN A 97 -9.370 -51.182 -9.001 1.00 27.94 N ATOM 775 CA ASN A 97 -9.989 -49.966 -8.532 1.00 27.70 C ATOM 776 C ASN A 97 -8.978 -48.845 -8.665 1.00 30.38 C ATOM 777 O ASN A 97 -7.990 -48.809 -7.929 1.00 29.34 O ATOM 778 CB ASN A 97 -10.447 -50.098 -7.085 1.00 28.65 C ATOM 779 CG ASN A 97 -11.217 -48.907 -6.537 1.00 37.53 C ATOM 780 OD1 ASN A 97 -11.019 -47.737 -6.929 1.00 35.56 O ATOM 781 ND2 ASN A 97 -12.062 -49.155 -5.557 1.00 37.10 N ATOM 782 HD22 ASN A 97 -12.218 -50.133 -5.240 1.00 0.00 H ATOM 783 HD21 ASN A 97 -12.573 -48.373 -5.101 1.00 0.00 H ATOM 784 H ASN A 97 -8.334 -51.277 -8.987 1.00 0.00 H ATOM 785 N LYS A 98 -9.230 -47.959 -9.614 1.00 30.27 N ATOM 786 CA LYS A 98 -8.368 -46.820 -9.902 1.00 29.94 C ATOM 787 C LYS A 98 -8.208 -45.870 -8.714 1.00 31.22 C ATOM 788 O LYS A 98 -7.227 -45.126 -8.684 1.00 27.86 O ATOM 789 CB LYS A 98 -8.957 -46.078 -11.132 1.00 35.09 C ATOM 790 CG LYS A 98 -8.265 -44.818 -11.598 1.00 52.80 C ATOM 791 CD LYS A 98 -8.911 -44.347 -12.899 1.00 67.31 C ATOM 792 CE LYS A 98 -8.384 -43.022 -13.388 1.00 82.70 C ATOM 793 NZ LYS A 98 -9.289 -42.396 -14.381 1.00 94.41 N ATOM 794 HZ1 LYS A 98 -9.392 -43.027 -15.201 1.00 0.00 H ATOM 795 HZ2 LYS A 98 -10.220 -42.235 -13.947 1.00 0.00 H ATOM 796 HZ3 LYS A 98 -8.888 -41.488 -14.690 1.00 0.00 H ATOM 797 H LYS A 98 -10.090 -48.082 -10.186 1.00 0.00 H ATOM 798 N TYR A 99 -9.110 -45.895 -7.718 1.00 28.80 N ATOM 799 CA TYR A 99 -9.067 -44.915 -6.637 1.00 28.45 C ATOM 800 C TYR A 99 -8.877 -45.472 -5.190 1.00 29.11 C ATOM 801 O TYR A 99 -9.033 -44.722 -4.221 1.00 29.70 O ATOM 802 CB TYR A 99 -10.353 -44.087 -6.742 1.00 30.34 C ATOM 803 CG TYR A 99 -10.523 -43.461 -8.105 1.00 33.65 C ATOM 804 CD1 TYR A 99 -9.824 -42.309 -8.457 1.00 33.57 C ATOM 805 CD2 TYR A 99 -11.319 -44.059 -9.076 1.00 36.42 C ATOM 806 CE1 TYR A 99 -9.940 -41.753 -9.726 1.00 32.94 C ATOM 807 CE2 TYR A 99 -11.439 -43.514 -10.353 1.00 37.82 C ATOM 808 CZ TYR A 99 -10.758 -42.353 -10.672 1.00 41.86 C ATOM 809 OH TYR A 99 -10.886 -41.822 -11.937 1.00 45.24 O ATOM 810 HH TYR A 99 -10.341 -40.998 -12.005 1.00 0.00 H ATOM 811 H TYR A 99 -9.851 -46.625 -7.717 1.00 0.00 H ATOM 812 N ASN A 100 -8.489 -46.771 -5.028 1.00 25.97 N ATOM 813 CA ASN A 100 -8.263 -47.348 -3.712 1.00 24.76 C ATOM 814 C ASN A 100 -6.774 -47.426 -3.500 1.00 27.05 C ATOM 815 O ASN A 100 -6.071 -47.883 -4.390 1.00 24.78 O ATOM 816 CB ASN A 100 -8.893 -48.756 -3.632 1.00 25.92 C ATOM 817 CG ASN A 100 -8.776 -49.446 -2.269 1.00 39.78 C ATOM 818 OD1 ASN A 100 -8.690 -48.795 -1.222 1.00 41.73 O ATOM 819 ND2 ASN A 100 -8.726 -50.788 -2.259 1.00 40.35 N ATOM 820 HD22 ASN A 100 -8.800 -51.318 -3.151 1.00 0.00 H ATOM 821 HD21 ASN A 100 -8.613 -51.297 -1.359 1.00 0.00 H ATOM 822 H ASN A 100 -8.351 -47.365 -5.870 1.00 0.00 H ATOM 823 N HIS A 101 -6.273 -46.928 -2.361 1.00 21.17 N ATOM 824 CA HIS A 101 -4.830 -46.839 -2.051 1.00 21.46 C ATOM 825 C HIS A 101 -4.265 -45.904 -3.099 1.00 21.78 C ATOM 826 O HIS A 101 -3.170 -46.149 -3.599 1.00 22.12 O ATOM 827 CB HIS A 101 -4.106 -48.205 -2.045 1.00 23.34 C ATOM 828 CG HIS A 101 -4.691 -49.179 -1.095 1.00 25.12 C ATOM 829 ND1 HIS A 101 -4.696 -48.957 0.279 1.00 25.22 N ATOM 830 CD2 HIS A 101 -5.273 -50.367 -1.350 1.00 26.24 C ATOM 831 CE1 HIS A 101 -5.279 -50.026 0.805 1.00 25.32 C ATOM 832 NE2 HIS A 101 -5.619 -50.904 -0.131 1.00 26.44 N ATOM 833 H HIS A 101 -6.945 -46.581 -1.647 1.00 0.00 H ATOM 834 N ASP A 102 -4.973 -44.782 -3.347 1.00 20.70 N ATOM 835 CA ASP A 102 -4.625 -43.859 -4.408 1.00 19.53 C ATOM 836 C ASP A 102 -3.543 -42.903 -3.993 1.00 19.40 C ATOM 837 O ASP A 102 -3.776 -41.707 -3.754 1.00 20.52 O ATOM 838 CB ASP A 102 -5.898 -43.158 -4.887 1.00 19.58 C ATOM 839 CG ASP A 102 -5.732 -42.393 -6.179 1.00 21.30 C ATOM 840 OD1 ASP A 102 -4.734 -42.629 -6.881 1.00 20.16 O ATOM 841 OD2 ASP A 102 -6.622 -41.582 -6.504 1.00 21.51 O ATOM 842 H ASP A 102 -5.801 -44.572 -2.753 1.00 0.00 H ATOM 843 N ILE A 103 -2.334 -43.413 -3.877 1.00 17.17 N ATOM 844 CA ILE A 103 -1.207 -42.616 -3.433 1.00 15.67 C ATOM 845 C ILE A 103 0.086 -43.167 -4.059 1.00 17.62 C ATOM 846 O ILE A 103 0.250 -44.396 -4.224 1.00 18.66 O ATOM 847 CB ILE A 103 -1.167 -42.589 -1.887 1.00 16.98 C ATOM 848 CG1 ILE A 103 -0.177 -41.533 -1.362 1.00 15.67 C ATOM 849 CG2 ILE A 103 -0.900 -44.002 -1.282 1.00 18.50 C ATOM 850 CD1 ILE A 103 -0.277 -41.362 0.130 1.00 17.04 C ATOM 851 H ILE A 103 -2.184 -44.415 -4.110 1.00 0.00 H ATOM 852 N ALA A 104 0.993 -42.261 -4.443 1.00 16.93 N ATOM 853 CA ALA A 104 2.241 -42.629 -5.097 1.00 16.79 C ATOM 854 C ALA A 104 3.315 -41.642 -4.757 1.00 18.06 C ATOM 855 O ALA A 104 3.015 -40.463 -4.451 1.00 17.33 O ATOM 856 CB ALA A 104 2.051 -42.665 -6.611 1.00 17.63 C ATOM 857 H ALA A 104 0.799 -41.254 -4.267 1.00 0.00 H ATOM 858 N LEU A 105 4.569 -42.102 -4.850 1.00 17.43 N ATOM 859 CA LEU A 105 5.735 -41.265 -4.609 1.00 18.17 C ATOM 860 C LEU A 105 6.512 -41.107 -5.892 1.00 18.98 C ATOM 861 O LEU A 105 6.671 -42.070 -6.655 1.00 19.62 O ATOM 862 CB LEU A 105 6.623 -41.870 -3.526 1.00 17.72 C ATOM 863 CG LEU A 105 5.951 -41.989 -2.170 1.00 19.01 C ATOM 864 CD1 LEU A 105 6.700 -42.956 -1.270 1.00 20.54 C ATOM 865 CD2 LEU A 105 5.789 -40.624 -1.497 1.00 20.42 C ATOM 866 H LEU A 105 4.716 -43.099 -5.105 1.00 0.00 H ATOM 867 N LEU A 106 6.985 -39.893 -6.135 1.00 18.49 N ATOM 868 CA LEU A 106 7.778 -39.554 -7.314 1.00 17.47 C ATOM 869 C LEU A 106 9.166 -39.160 -6.860 1.00 20.61 C ATOM 870 O LEU A 106 9.294 -38.216 -6.076 1.00 18.70 O ATOM 871 CB LEU A 106 7.140 -38.382 -8.090 1.00 16.28 C ATOM 872 CG LEU A 106 5.637 -38.452 -8.318 1.00 18.12 C ATOM 873 CD1 LEU A 106 5.133 -37.202 -9.071 1.00 19.17 C ATOM 874 CD2 LEU A 106 5.239 -39.701 -9.075 1.00 22.89 C ATOM 875 H LEU A 106 6.780 -39.140 -5.448 1.00 0.00 H ATOM 876 N GLU A 107 10.207 -39.818 -7.413 1.00 19.23 N ATOM 877 CA GLU A 107 11.597 -39.461 -7.149 1.00 20.86 C ATOM 878 C GLU A 107 12.027 -38.498 -8.222 1.00 23.41 C ATOM 879 O GLU A 107 11.856 -38.783 -9.428 1.00 22.34 O ATOM 880 CB GLU A 107 12.522 -40.678 -7.152 1.00 23.34 C ATOM 881 CG GLU A 107 13.885 -40.363 -6.564 1.00 27.39 C ATOM 882 CD GLU A 107 14.834 -41.533 -6.431 1.00 37.64 C ATOM 883 OE1 GLU A 107 14.457 -42.668 -6.802 1.00 31.65 O ATOM 884 OE2 GLU A 107 15.965 -41.308 -5.947 1.00 35.41 O ATOM 885 H GLU A 107 10.010 -40.613 -8.054 1.00 0.00 H ATOM 886 N LEU A 108 12.650 -37.379 -7.807 1.00 21.13 N ATOM 887 CA LEU A 108 13.128 -36.366 -8.741 1.00 21.82 C ATOM 888 C LEU A 108 14.549 -36.669 -9.209 1.00 25.83 C ATOM 889 O LEU A 108 15.344 -37.225 -8.455 1.00 25.09 O ATOM 890 CB LEU A 108 13.077 -34.995 -8.072 1.00 20.11 C ATOM 891 CG LEU A 108 11.698 -34.602 -7.551 1.00 21.82 C ATOM 892 CD1 LEU A 108 11.738 -33.209 -6.917 1.00 20.32 C ATOM 893 CD2 LEU A 108 10.613 -34.672 -8.655 1.00 21.89 C ATOM 894 H LEU A 108 12.795 -37.232 -6.788 1.00 0.00 H ATOM 895 N ASP A 109 14.874 -36.228 -10.414 1.00 24.91 N ATOM 896 CA ASP A 109 16.205 -36.468 -10.980 1.00 26.99 C ATOM 897 C ASP A 109 17.314 -35.788 -10.166 1.00 31.17 C ATOM 898 O ASP A 109 18.345 -36.402 -9.866 1.00 30.94 O ATOM 899 CB ASP A 109 16.271 -36.053 -12.478 1.00 28.74 C ATOM 900 CG ASP A 109 16.080 -34.588 -12.852 1.00 37.20 C ATOM 901 OD1 ASP A 109 15.315 -33.880 -12.150 1.00 35.09 O ATOM 902 OD2 ASP A 109 16.556 -34.191 -13.936 1.00 44.90 O ATOM 903 H ASP A 109 14.171 -35.701 -10.970 1.00 0.00 H ATOM 904 N GLU A 110 17.078 -34.520 -9.805 1.00 25.17 N ATOM 905 CA GLU A 110 18.031 -33.693 -9.076 1.00 23.79 C ATOM 906 C GLU A 110 17.263 -32.996 -7.950 1.00 23.20 C ATOM 907 O GLU A 110 16.087 -32.673 -8.117 1.00 22.17 O ATOM 908 CB GLU A 110 18.642 -32.653 -10.009 1.00 25.63 C ATOM 909 CG GLU A 110 19.451 -33.260 -11.132 1.00 27.83 C ATOM 910 CD GLU A 110 20.750 -33.890 -10.692 1.00 40.11 C ATOM 911 OE1 GLU A 110 21.196 -33.602 -9.559 1.00 31.88 O ATOM 912 OE2 GLU A 110 21.359 -34.623 -11.509 1.00 36.45 O ATOM 913 H GLU A 110 16.161 -34.101 -10.060 1.00 0.00 H ATOM 914 N PRO A 111 17.890 -32.807 -6.796 1.00 22.81 N ATOM 915 CA PRO A 111 17.156 -32.226 -5.669 1.00 21.84 C ATOM 916 C PRO A 111 16.636 -30.841 -5.900 1.00 21.98 C ATOM 917 O PRO A 111 17.238 -30.024 -6.602 1.00 22.15 O ATOM 918 CB PRO A 111 18.162 -32.269 -4.509 1.00 25.23 C ATOM 919 CG PRO A 111 19.476 -32.481 -5.122 1.00 31.88 C ATOM 920 CD PRO A 111 19.284 -33.138 -6.437 1.00 27.45 C ATOM 921 N LEU A 112 15.462 -30.585 -5.293 1.00 18.61 N ATOM 922 CA LEU A 112 14.932 -29.248 -5.209 1.00 16.33 C ATOM 923 C LEU A 112 15.869 -28.490 -4.273 1.00 17.06 C ATOM 924 O LEU A 112 16.510 -29.089 -3.384 1.00 20.12 O ATOM 925 CB LEU A 112 13.544 -29.290 -4.602 1.00 15.37 C ATOM 926 CG LEU A 112 12.475 -29.942 -5.458 1.00 17.42 C ATOM 927 CD1 LEU A 112 11.165 -30.166 -4.673 1.00 17.48 C ATOM 928 CD2 LEU A 112 12.192 -29.115 -6.726 1.00 18.78 C ATOM 929 H LEU A 112 14.925 -31.371 -4.875 1.00 0.00 H ATOM 930 N VAL A 113 15.910 -27.163 -4.424 1.00 17.22 N ATOM 931 CA VAL A 113 16.634 -26.264 -3.525 1.00 15.87 C ATOM 932 C VAL A 113 15.535 -25.677 -2.668 1.00 16.48 C ATOM 933 O VAL A 113 14.669 -24.944 -3.144 1.00 15.32 O ATOM 934 CB VAL A 113 17.401 -25.162 -4.303 1.00 18.60 C ATOM 935 CG1 VAL A 113 17.913 -24.085 -3.346 1.00 19.09 C ATOM 936 CG2 VAL A 113 18.560 -25.769 -5.081 1.00 19.90 C ATOM 937 H VAL A 113 15.398 -26.745 -5.227 1.00 0.00 H ATOM 938 N LEU A 114 15.538 -26.030 -1.383 1.00 15.05 N ATOM 939 CA LEU A 114 14.496 -25.543 -0.502 1.00 13.91 C ATOM 940 C LEU A 114 14.665 -24.065 -0.210 1.00 15.11 C ATOM 941 O LEU A 114 15.791 -23.581 -0.039 1.00 16.83 O ATOM 942 CB LEU A 114 14.398 -26.337 0.819 1.00 14.99 C ATOM 943 CG LEU A 114 14.235 -27.851 0.668 1.00 15.64 C ATOM 944 CD1 LEU A 114 14.111 -28.541 2.052 1.00 17.26 C ATOM 945 CD2 LEU A 114 13.056 -28.249 -0.205 1.00 18.20 C ATOM 946 H LEU A 114 16.285 -26.652 -1.014 1.00 0.00 H ATOM 947 N ASN A 115 13.549 -23.334 -0.218 1.00 12.93 N ATOM 948 CA ASN A 115 13.519 -21.916 0.049 1.00 13.55 C ATOM 949 C ASN A 115 12.096 -21.514 0.445 1.00 13.75 C ATOM 950 O ASN A 115 11.245 -22.389 0.621 1.00 14.60 O ATOM 951 CB ASN A 115 14.076 -21.141 -1.142 1.00 13.74 C ATOM 952 CG ASN A 115 13.275 -21.300 -2.415 1.00 14.47 C ATOM 953 OD1 ASN A 115 12.054 -21.399 -2.383 1.00 13.25 O ATOM 954 ND2 ASN A 115 13.951 -21.267 -3.563 1.00 14.04 N ATOM 955 HD22 ASN A 115 14.988 -21.182 -3.554 1.00 0.00 H ATOM 956 HD21 ASN A 115 13.442 -21.326 -4.468 1.00 0.00 H ATOM 957 H ASN A 115 12.650 -23.813 -0.428 1.00 0.00 H ATOM 958 N SER A 116 11.841 -20.236 0.571 1.00 14.13 N ATOM 959 CA SER A 116 10.525 -19.777 1.021 1.00 13.16 C ATOM 960 C SER A 116 9.386 -20.170 0.079 1.00 15.25 C ATOM 961 O SER A 116 8.234 -20.191 0.496 1.00 15.42 O ATOM 962 CB SER A 116 10.539 -18.269 1.226 1.00 17.32 C ATOM 963 OG SER A 116 11.316 -17.931 2.372 1.00 19.01 O ATOM 964 HG SER A 116 10.926 -18.362 3.173 1.00 0.00 H ATOM 965 H SER A 116 12.581 -19.539 0.349 1.00 0.00 H ATOM 966 N TYR A 117 9.688 -20.462 -1.201 1.00 12.53 N ATOM 967 CA TYR A 117 8.699 -20.839 -2.207 1.00 12.02 C ATOM 968 C TYR A 117 8.634 -22.338 -2.449 1.00 11.59 C ATOM 969 O TYR A 117 7.719 -22.802 -3.154 1.00 13.03 O ATOM 970 CB TYR A 117 9.024 -20.135 -3.533 1.00 11.88 C ATOM 971 CG TYR A 117 8.995 -18.632 -3.380 1.00 13.34 C ATOM 972 CD1 TYR A 117 7.814 -17.922 -3.544 1.00 13.45 C ATOM 973 CD2 TYR A 117 10.141 -17.922 -3.029 1.00 14.40 C ATOM 974 CE1 TYR A 117 7.777 -16.544 -3.397 1.00 16.39 C ATOM 975 CE2 TYR A 117 10.112 -16.546 -2.859 1.00 14.73 C ATOM 976 CZ TYR A 117 8.922 -15.864 -3.024 1.00 15.67 C ATOM 977 OH TYR A 117 8.884 -14.501 -2.847 1.00 20.46 O ATOM 978 HH TYR A 117 7.962 -14.175 -3.002 1.00 0.00 H ATOM 979 H TYR A 117 10.686 -20.416 -1.490 1.00 0.00 H ATOM 980 N VAL A 118 9.617 -23.101 -1.934 1.00 12.21 N ATOM 981 CA VAL A 118 9.788 -24.533 -2.174 1.00 11.27 C ATOM 982 C VAL A 118 10.119 -25.139 -0.815 1.00 13.05 C ATOM 983 O VAL A 118 11.286 -25.168 -0.386 1.00 13.75 O ATOM 984 CB VAL A 118 10.935 -24.732 -3.205 1.00 12.92 C ATOM 985 CG1 VAL A 118 11.200 -26.211 -3.459 1.00 12.85 C ATOM 986 CG2 VAL A 118 10.610 -24.014 -4.530 1.00 12.82 C ATOM 987 H VAL A 118 10.310 -22.634 -1.316 1.00 0.00 H ATOM 988 N THR A 119 9.064 -25.556 -0.108 1.00 12.52 N ATOM 989 CA THR A 119 9.161 -25.995 1.288 1.00 12.78 C ATOM 990 C THR A 119 8.383 -27.271 1.459 1.00 12.68 C ATOM 991 O THR A 119 7.261 -27.360 0.980 1.00 12.66 O ATOM 992 CB THR A 119 8.571 -24.919 2.201 1.00 13.33 C ATOM 993 OG1 THR A 119 9.234 -23.657 2.066 1.00 16.51 O ATOM 994 CG2 THR A 119 8.571 -25.281 3.684 1.00 13.25 C ATOM 995 HG1 THR A 119 8.816 -22.999 2.676 1.00 0.00 H ATOM 996 H THR A 119 8.132 -25.570 -0.569 1.00 0.00 H ATOM 997 N PRO A 120 8.913 -28.273 2.145 1.00 12.50 N ATOM 998 CA PRO A 120 8.130 -29.501 2.343 1.00 10.90 C ATOM 999 C PRO A 120 6.866 -29.309 3.191 1.00 11.33 C ATOM 1000 O PRO A 120 6.796 -28.393 3.984 1.00 11.59 O ATOM 1001 CB PRO A 120 9.108 -30.430 3.101 1.00 12.88 C ATOM 1002 CG PRO A 120 10.489 -29.844 2.797 1.00 15.82 C ATOM 1003 CD PRO A 120 10.248 -28.365 2.748 1.00 13.29 C ATOM 1004 N ILE A 121 5.906 -30.208 3.023 1.00 11.00 N ATOM 1005 CA ILE A 121 4.755 -30.285 3.925 1.00 10.90 C ATOM 1006 C ILE A 121 5.176 -31.165 5.075 1.00 11.99 C ATOM 1007 O ILE A 121 5.881 -32.157 4.871 1.00 12.85 O ATOM 1008 CB ILE A 121 3.486 -30.829 3.197 1.00 11.29 C ATOM 1009 CG1 ILE A 121 2.230 -30.713 4.091 1.00 10.73 C ATOM 1010 CG2 ILE A 121 3.645 -32.260 2.678 1.00 12.27 C ATOM 1011 CD1 ILE A 121 1.851 -29.306 4.492 1.00 11.06 C ATOM 1012 H ILE A 121 5.972 -30.877 2.229 1.00 0.00 H ATOM 1013 N CYS A 122 4.707 -30.860 6.300 1.00 11.17 N ATOM 1014 CA CYS A 122 5.040 -31.753 7.425 1.00 10.94 C ATOM 1015 C CYS A 122 4.194 -32.998 7.363 1.00 12.22 C ATOM 1016 O CYS A 122 3.031 -32.929 6.928 1.00 12.53 O ATOM 1017 CB CYS A 122 4.826 -31.063 8.774 1.00 11.48 C ATOM 1018 SG CYS A 122 5.752 -29.549 9.005 1.00 12.75 S ATOM 1019 H CYS A 122 4.123 -30.013 6.449 1.00 0.00 H ATOM 1020 N ILE A 123 4.739 -34.118 7.823 1.00 12.51 N ATOM 1021 CA ILE A 123 3.972 -35.356 7.903 1.00 11.87 C ATOM 1022 C ILE A 123 4.164 -35.928 9.310 1.00 14.43 C ATOM 1023 O ILE A 123 5.270 -36.308 9.714 1.00 15.15 O ATOM 1024 CB ILE A 123 4.378 -36.349 6.812 1.00 14.93 C ATOM 1025 CG1 ILE A 123 4.224 -35.688 5.434 1.00 14.06 C ATOM 1026 CG2 ILE A 123 3.489 -37.595 6.929 1.00 15.80 C ATOM 1027 CD1 ILE A 123 4.592 -36.593 4.288 1.00 17.40 C ATOM 1028 H ILE A 123 5.732 -34.112 8.132 1.00 0.00 H ATOM 1029 N ALA A 124 3.057 -35.919 10.073 1.00 12.84 N ATOM 1030 CA ALA A 124 3.058 -36.437 11.439 1.00 13.48 C ATOM 1031 C ALA A 124 3.018 -37.952 11.411 1.00 16.86 C ATOM 1032 O ALA A 124 2.889 -38.559 10.349 1.00 16.00 O ATOM 1033 CB ALA A 124 1.850 -35.907 12.224 1.00 13.43 C ATOM 1034 H ALA A 124 2.175 -35.532 9.680 1.00 0.00 H ATOM 1035 N ASP A 125 3.119 -38.596 12.585 1.00 15.47 N ATOM 1036 CA ASP A 125 2.975 -40.030 12.667 1.00 16.28 C ATOM 1037 C ASP A 125 1.513 -40.408 12.377 1.00 16.09 C ATOM 1038 O ASP A 125 0.641 -39.546 12.164 1.00 15.50 O ATOM 1039 CB ASP A 125 3.474 -40.547 14.018 1.00 18.50 C ATOM 1040 CG ASP A 125 2.623 -40.285 15.259 1.00 21.91 C ATOM 1041 OD1 ASP A 125 1.510 -39.760 15.127 1.00 19.40 O ATOM 1042 OD2 ASP A 125 3.104 -40.576 16.374 1.00 23.40 O ATOM 1043 H ASP A 125 3.304 -38.051 13.451 1.00 0.00 H ATOM 1044 N LYS A 126 1.231 -41.693 12.324 1.00 17.41 N ATOM 1045 CA LYS A 126 -0.108 -42.142 11.974 1.00 16.55 C ATOM 1046 C LYS A 126 -1.181 -41.612 12.946 1.00 17.65 C ATOM 1047 O LYS A 126 -2.236 -41.121 12.519 1.00 17.94 O ATOM 1048 CB LYS A 126 -0.097 -43.682 11.964 1.00 19.95 C ATOM 1049 CG LYS A 126 -1.449 -44.342 11.732 1.00 24.93 C ATOM 1050 CD LYS A 126 -1.295 -45.889 11.658 1.00 29.22 C ATOM 1051 CE LYS A 126 -2.636 -46.524 11.409 1.00 48.64 C ATOM 1052 NZ LYS A 126 -2.558 -48.008 11.457 1.00 63.18 N ATOM 1053 HZ1 LYS A 126 -1.896 -48.343 10.728 1.00 0.00 H ATOM 1054 HZ2 LYS A 126 -2.223 -48.306 12.395 1.00 0.00 H ATOM 1055 HZ3 LYS A 126 -3.501 -48.409 11.281 1.00 0.00 H ATOM 1056 H LYS A 126 1.971 -42.393 12.534 1.00 0.00 H ATOM 1057 N GLU A 127 -0.892 -41.669 14.245 1.00 16.44 N ATOM 1058 CA GLU A 127 -1.854 -41.237 15.252 1.00 16.92 C ATOM 1059 C GLU A 127 -2.165 -39.754 15.151 1.00 16.51 C ATOM 1060 O GLU A 127 -3.333 -39.364 15.127 1.00 16.56 O ATOM 1061 CB GLU A 127 -1.363 -41.594 16.666 1.00 19.65 C ATOM 1062 CG GLU A 127 -2.236 -41.026 17.762 1.00 26.88 C ATOM 1063 CD GLU A 127 -1.791 -41.365 19.168 1.00 52.89 C ATOM 1064 OE1 GLU A 127 -2.671 -41.435 20.055 1.00 35.22 O ATOM 1065 OE2 GLU A 127 -0.563 -41.447 19.404 1.00 46.36 O ATOM 1066 H GLU A 127 0.036 -42.028 14.546 1.00 0.00 H ATOM 1067 N TYR A 128 -1.119 -38.915 15.062 1.00 14.17 N ATOM 1068 CA TYR A 128 -1.368 -37.481 14.969 1.00 13.76 C ATOM 1069 C TYR A 128 -1.912 -37.059 13.636 1.00 14.80 C ATOM 1070 O TYR A 128 -2.694 -36.098 13.586 1.00 13.69 O ATOM 1071 CB TYR A 128 -0.134 -36.670 15.360 1.00 13.75 C ATOM 1072 CG TYR A 128 -0.194 -36.243 16.812 1.00 12.90 C ATOM 1073 CD1 TYR A 128 -1.019 -35.198 17.208 1.00 12.86 C ATOM 1074 CD2 TYR A 128 0.491 -36.941 17.793 1.00 14.14 C ATOM 1075 CE1 TYR A 128 -1.110 -34.815 18.526 1.00 12.77 C ATOM 1076 CE2 TYR A 128 0.361 -36.610 19.134 1.00 13.74 C ATOM 1077 CZ TYR A 128 -0.398 -35.502 19.490 1.00 12.99 C ATOM 1078 OH TYR A 128 -0.442 -35.156 20.798 1.00 15.06 O ATOM 1079 HH TYR A 128 -1.014 -34.356 20.907 1.00 0.00 H ATOM 1080 H TYR A 128 -0.146 -39.283 15.059 1.00 0.00 H ATOM 1081 N THR A 129 -1.557 -37.735 12.516 1.00 13.06 N ATOM 1082 CA THR A 129 -2.161 -37.354 11.240 1.00 12.91 C ATOM 1083 C THR A 129 -3.680 -37.547 11.351 1.00 12.95 C ATOM 1084 O THR A 129 -4.448 -36.712 10.859 1.00 13.38 O ATOM 1085 CB THR A 129 -1.582 -38.188 10.088 1.00 12.65 C ATOM 1086 OG1 THR A 129 -0.161 -37.942 10.000 1.00 13.78 O ATOM 1087 CG2 THR A 129 -2.243 -37.852 8.758 1.00 13.02 C ATOM 1088 HG1 THR A 129 -0.004 -36.980 9.829 1.00 0.00 H ATOM 1089 H THR A 129 -0.867 -38.511 12.563 1.00 0.00 H ATOM 1090 N ASN A 129A -4.110 -38.648 11.982 1.00 14.37 N ATOM 1091 CA ASN A 129A -5.541 -38.895 12.178 1.00 15.13 C ATOM 1092 C ASN A 129A -6.184 -37.884 13.154 1.00 16.20 C ATOM 1093 O ASN A 129A -7.253 -37.366 12.847 1.00 15.02 O ATOM 1094 CB ASN A 129A -5.733 -40.342 12.615 1.00 18.29 C ATOM 1095 CG ASN A 129A -7.146 -40.813 12.707 1.00 24.02 C ATOM 1096 OD1 ASN A 129A -7.507 -41.507 13.666 1.00 27.83 O ATOM 1097 ND2 ASN A 129A -7.950 -40.533 11.679 1.00 19.35 N ATOM 1098 HD22 ASN A 129A -7.604 -39.945 10.894 1.00 0.00 H ATOM 1099 HD21 ASN A 129A -8.922 -40.903 11.663 1.00 0.00 H ATOM 1100 H ASN A 129A -3.418 -39.338 12.338 1.00 0.00 H ATOM 1101 N ILE A 129B -5.503 -37.518 14.244 1.00 13.92 N ATOM 1102 CA ILE A 129B -6.021 -36.464 15.131 1.00 13.08 C ATOM 1103 C ILE A 129B -6.221 -35.164 14.352 1.00 14.12 C ATOM 1104 O ILE A 129B -7.227 -34.482 14.494 1.00 14.45 O ATOM 1105 CB ILE A 129B -5.090 -36.263 16.331 1.00 15.48 C ATOM 1106 CG1 ILE A 129B -5.201 -37.458 17.295 1.00 16.73 C ATOM 1107 CG2 ILE A 129B -5.401 -34.952 17.060 1.00 15.82 C ATOM 1108 CD1 ILE A 129B -4.078 -37.519 18.337 1.00 17.61 C ATOM 1109 H ILE A 129B -4.599 -37.982 14.467 1.00 0.00 H ATOM 1110 N PHE A 130 -5.254 -34.800 13.524 1.00 12.92 N ATOM 1111 CA PHE A 130 -5.346 -33.549 12.767 1.00 11.81 C ATOM 1112 C PHE A 130 -6.486 -33.598 11.774 1.00 12.98 C ATOM 1113 O PHE A 130 -7.202 -32.612 11.644 1.00 12.60 O ATOM 1114 CB PHE A 130 -4.006 -33.216 12.084 1.00 11.90 C ATOM 1115 CG PHE A 130 -2.837 -32.985 13.014 1.00 12.21 C ATOM 1116 CD1 PHE A 130 -3.031 -32.555 14.315 1.00 12.97 C ATOM 1117 CD2 PHE A 130 -1.531 -33.135 12.561 1.00 12.46 C ATOM 1118 CE1 PHE A 130 -1.951 -32.289 15.157 1.00 13.50 C ATOM 1119 CE2 PHE A 130 -0.459 -32.836 13.391 1.00 13.68 C ATOM 1120 CZ PHE A 130 -0.670 -32.422 14.683 1.00 13.86 C ATOM 1121 H PHE A 130 -4.419 -35.409 13.410 1.00 0.00 H ATOM 1122 N LEU A 131 -6.734 -34.751 11.129 1.00 12.46 N ATOM 1123 CA LEU A 131 -7.902 -34.828 10.253 1.00 12.89 C ATOM 1124 C LEU A 131 -9.199 -34.633 11.076 1.00 13.57 C ATOM 1125 O LEU A 131 -10.135 -33.938 10.612 1.00 14.38 O ATOM 1126 CB LEU A 131 -7.970 -36.215 9.598 1.00 13.76 C ATOM 1127 CG LEU A 131 -9.071 -36.378 8.560 1.00 14.74 C ATOM 1128 CD1 LEU A 131 -8.847 -35.492 7.348 1.00 14.67 C ATOM 1129 CD2 LEU A 131 -9.209 -37.871 8.141 1.00 16.51 C ATOM 1130 H LEU A 131 -6.107 -35.572 11.251 1.00 0.00 H ATOM 1131 N LYS A 132 -9.225 -35.112 12.298 1.00 12.89 N ATOM 1132 CA LYS A 132 -10.382 -34.959 13.183 1.00 13.76 C ATOM 1133 C LYS A 132 -10.649 -33.522 13.610 1.00 15.14 C ATOM 1134 O LYS A 132 -11.754 -33.216 14.061 1.00 15.15 O ATOM 1135 CB LYS A 132 -10.274 -35.857 14.414 1.00 16.79 C ATOM 1136 CG LYS A 132 -10.349 -37.301 14.031 1.00 22.50 C ATOM 1137 CD LYS A 132 -10.186 -38.262 15.133 1.00 28.51 C ATOM 1138 CE LYS A 132 -10.481 -39.629 14.531 1.00 31.14 C ATOM 1139 NZ LYS A 132 -10.208 -40.672 15.494 1.00 33.35 N ATOM 1140 HZ1 LYS A 132 -9.207 -40.632 15.772 1.00 0.00 H ATOM 1141 HZ2 LYS A 132 -10.807 -40.534 16.332 1.00 0.00 H ATOM 1142 HZ3 LYS A 132 -10.414 -41.598 15.068 1.00 0.00 H ATOM 1143 H LYS A 132 -8.390 -35.621 12.652 1.00 0.00 H ATOM 1144 N PHE A 133 -9.674 -32.610 13.465 1.00 13.09 N ATOM 1145 CA PHE A 133 -9.934 -31.189 13.697 1.00 13.51 C ATOM 1146 C PHE A 133 -11.105 -30.722 12.817 1.00 15.48 C ATOM 1147 O PHE A 133 -11.821 -29.809 13.220 1.00 16.30 O ATOM 1148 CB PHE A 133 -8.719 -30.331 13.364 1.00 14.72 C ATOM 1149 CG PHE A 133 -7.517 -30.342 14.275 1.00 16.25 C ATOM 1150 CD1 PHE A 133 -7.420 -31.235 15.324 1.00 19.55 C ATOM 1151 CD2 PHE A 133 -6.507 -29.414 14.108 1.00 18.04 C ATOM 1152 CE1 PHE A 133 -6.313 -31.203 16.189 1.00 20.72 C ATOM 1153 CE2 PHE A 133 -5.442 -29.353 15.002 1.00 20.70 C ATOM 1154 CZ PHE A 133 -5.325 -30.270 15.990 1.00 19.65 C ATOM 1155 H PHE A 133 -8.721 -32.918 13.184 1.00 0.00 H ATOM 1156 N GLY A 134 -11.278 -31.309 11.638 1.00 13.81 N ATOM 1157 CA GLY A 134 -12.455 -31.058 10.821 1.00 13.90 C ATOM 1158 C GLY A 134 -12.366 -29.989 9.767 1.00 15.64 C ATOM 1159 O GLY A 134 -13.397 -29.736 9.139 1.00 15.84 O ATOM 1160 H GLY A 134 -10.552 -31.966 11.289 1.00 0.00 H ATOM 1161 N SER A 135 -11.195 -29.414 9.528 1.00 15.11 N ATOM 1162 CA SER A 135 -11.066 -28.322 8.562 1.00 14.91 C ATOM 1163 C SER A 135 -9.687 -28.337 7.961 1.00 15.84 C ATOM 1164 O SER A 135 -8.698 -28.200 8.682 1.00 16.65 O ATOM 1165 CB SER A 135 -11.308 -26.986 9.261 1.00 17.71 C ATOM 1166 OG SER A 135 -11.207 -25.881 8.357 1.00 22.14 O ATOM 1167 HG SER A 135 -11.370 -25.038 8.849 1.00 0.00 H ATOM 1168 H SER A 135 -10.351 -29.746 10.037 1.00 0.00 H ATOM 1169 N GLY A 136 -9.630 -28.505 6.647 1.00 14.35 N ATOM 1170 CA GLY A 136 -8.354 -28.515 5.962 1.00 13.41 C ATOM 1171 C GLY A 136 -8.360 -27.591 4.773 1.00 14.16 C ATOM 1172 O GLY A 136 -9.425 -27.110 4.338 1.00 16.78 O ATOM 1173 H GLY A 136 -10.508 -28.631 6.104 1.00 0.00 H ATOM 1174 N TYR A 137 -7.193 -27.367 4.236 1.00 11.89 N ATOM 1175 CA TYR A 137 -7.019 -26.561 3.035 1.00 11.79 C ATOM 1176 C TYR A 137 -6.621 -27.442 1.882 1.00 12.63 C ATOM 1177 O TYR A 137 -5.681 -28.222 2.002 1.00 14.10 O ATOM 1178 CB TYR A 137 -5.943 -25.473 3.224 1.00 14.57 C ATOM 1179 CG TYR A 137 -6.467 -24.309 4.034 1.00 19.91 C ATOM 1180 CD1 TYR A 137 -6.640 -24.412 5.413 1.00 21.62 C ATOM 1181 CD2 TYR A 137 -7.012 -23.200 3.404 1.00 21.26 C ATOM 1182 CE1 TYR A 137 -7.218 -23.364 6.154 1.00 25.68 C ATOM 1183 CE2 TYR A 137 -7.581 -22.149 4.124 1.00 23.33 C ATOM 1184 CZ TYR A 137 -7.692 -22.239 5.495 1.00 28.93 C ATOM 1185 OH TYR A 137 -8.262 -21.162 6.160 1.00 36.94 O ATOM 1186 HH TYR A 137 -8.284 -21.350 7.132 1.00 0.00 H ATOM 1187 H TYR A 137 -6.351 -27.781 4.684 1.00 0.00 H ATOM 1188 N VAL A 138 -7.273 -27.246 0.732 1.00 11.07 N ATOM 1189 CA VAL A 138 -6.931 -27.893 -0.529 1.00 11.64 C ATOM 1190 C VAL A 138 -6.481 -26.835 -1.511 1.00 11.16 C ATOM 1191 O VAL A 138 -6.904 -25.670 -1.419 1.00 11.63 O ATOM 1192 CB VAL A 138 -8.071 -28.745 -1.100 1.00 13.49 C ATOM 1193 CG1 VAL A 138 -8.468 -29.835 -0.125 1.00 14.31 C ATOM 1194 CG2 VAL A 138 -9.284 -27.900 -1.496 1.00 14.01 C ATOM 1195 H VAL A 138 -8.078 -26.588 0.737 1.00 0.00 H ATOM 1196 N SER A 139 -5.616 -27.199 -2.429 1.00 11.09 N ATOM 1197 CA SER A 139 -5.094 -26.236 -3.373 1.00 11.55 C ATOM 1198 C SER A 139 -4.774 -26.929 -4.671 1.00 11.85 C ATOM 1199 O SER A 139 -4.499 -28.140 -4.703 1.00 11.60 O ATOM 1200 CB SER A 139 -3.866 -25.533 -2.796 1.00 12.25 C ATOM 1201 OG SER A 139 -2.914 -26.417 -2.219 1.00 12.27 O ATOM 1202 HG SER A 139 -2.593 -27.050 -2.909 1.00 0.00 H ATOM 1203 H SER A 139 -5.303 -28.190 -2.478 1.00 0.00 H ATOM 1204 N GLY A 140 -4.796 -26.161 -5.750 1.00 10.82 N ATOM 1205 CA GLY A 140 -4.433 -26.718 -7.043 1.00 11.07 C ATOM 1206 C GLY A 140 -4.771 -25.839 -8.215 1.00 11.99 C ATOM 1207 O GLY A 140 -5.345 -24.748 -8.040 1.00 12.01 O ATOM 1208 H GLY A 140 -5.072 -25.161 -5.672 1.00 0.00 H ATOM 1209 N TRP A 141 -4.364 -26.309 -9.395 1.00 11.53 N ATOM 1210 CA TRP A 141 -4.601 -25.618 -10.673 1.00 11.86 C ATOM 1211 C TRP A 141 -5.695 -26.325 -11.489 1.00 13.75 C ATOM 1212 O TRP A 141 -5.784 -26.095 -12.707 1.00 14.40 O ATOM 1213 CB TRP A 141 -3.295 -25.501 -11.483 1.00 12.39 C ATOM 1214 CG TRP A 141 -2.294 -24.532 -10.931 1.00 12.74 C ATOM 1215 CD1 TRP A 141 -2.229 -23.204 -11.199 1.00 14.46 C ATOM 1216 CD2 TRP A 141 -1.225 -24.814 -10.008 1.00 12.03 C ATOM 1217 NE1 TRP A 141 -1.152 -22.636 -10.546 1.00 13.50 N ATOM 1218 CE2 TRP A 141 -0.498 -23.618 -9.834 1.00 12.90 C ATOM 1219 CE3 TRP A 141 -0.722 -25.988 -9.432 1.00 12.29 C ATOM 1220 CZ2 TRP A 141 0.631 -23.542 -9.011 1.00 13.36 C ATOM 1221 CZ3 TRP A 141 0.371 -25.903 -8.582 1.00 12.53 C ATOM 1222 CH2 TRP A 141 1.042 -24.703 -8.389 1.00 13.12 C ATOM 1223 HE1 TRP A 141 -0.880 -21.633 -10.585 1.00 0.00 H ATOM 1224 H TRP A 141 -3.851 -27.213 -9.413 1.00 0.00 H ATOM 1225 N GLY A 142 -6.556 -27.084 -10.832 1.00 12.34 N ATOM 1226 CA GLY A 142 -7.671 -27.740 -11.480 1.00 12.84 C ATOM 1227 C GLY A 142 -8.724 -26.791 -11.984 1.00 13.25 C ATOM 1228 O GLY A 142 -8.622 -25.562 -11.827 1.00 13.39 O ATOM 1229 H GLY A 142 -6.426 -27.215 -9.808 1.00 0.00 H ATOM 1230 N ARG A 143 -9.731 -27.373 -12.579 1.00 13.52 N ATOM 1231 CA ARG A 143 -10.798 -26.589 -13.182 1.00 13.59 C ATOM 1232 C ARG A 143 -11.442 -25.699 -12.122 1.00 12.97 C ATOM 1233 O ARG A 143 -11.628 -26.101 -10.981 1.00 14.06 O ATOM 1234 CB ARG A 143 -11.859 -27.488 -13.792 1.00 15.87 C ATOM 1235 CG ARG A 143 -11.337 -28.369 -14.933 1.00 17.19 C ATOM 1236 CD ARG A 143 -12.510 -29.127 -15.533 1.00 20.26 C ATOM 1237 NE ARG A 143 -12.111 -30.101 -16.542 1.00 23.20 N ATOM 1238 CZ ARG A 143 -12.145 -29.932 -17.857 1.00 38.44 C ATOM 1239 NH1 ARG A 143 -12.510 -28.766 -18.378 1.00 31.80 N ATOM 1240 NH2 ARG A 143 -11.801 -30.928 -18.667 1.00 33.20 N ATOM 1241 HE ARG A 143 -11.766 -31.019 -16.196 1.00 0.00 H ATOM 1242 HH12 ARG A 143 -12.534 -28.642 -19.410 1.00 0.00 H ATOM 1243 HH11 ARG A 143 -12.772 -27.977 -17.754 1.00 0.00 H ATOM 1244 HH22 ARG A 143 -11.828 -30.793 -19.698 1.00 0.00 H ATOM 1245 HH21 ARG A 143 -11.504 -31.842 -18.270 1.00 0.00 H ATOM 1246 H ARG A 143 -9.770 -28.411 -12.622 1.00 0.00 H ATOM 1247 N VAL A 144 -11.833 -24.471 -12.567 1.00 13.81 N ATOM 1248 CA VAL A 144 -12.458 -23.488 -11.682 1.00 13.76 C ATOM 1249 C VAL A 144 -13.964 -23.519 -11.760 1.00 16.95 C ATOM 1250 O VAL A 144 -14.608 -22.888 -10.927 1.00 17.32 O ATOM 1251 CB VAL A 144 -11.892 -22.063 -11.871 1.00 15.77 C ATOM 1252 CG1 VAL A 144 -10.389 -22.070 -11.618 1.00 15.38 C ATOM 1253 CG2 VAL A 144 -12.223 -21.484 -13.242 1.00 16.80 C ATOM 1254 H VAL A 144 -11.682 -24.226 -13.566 1.00 0.00 H ATOM 1255 N PHE A 145 -14.518 -24.304 -12.674 1.00 16.03 N ATOM 1256 CA PHE A 145 -15.936 -24.640 -12.719 1.00 16.70 C ATOM 1257 C PHE A 145 -15.998 -26.059 -13.218 1.00 20.29 C ATOM 1258 O PHE A 145 -15.098 -26.467 -13.949 1.00 18.51 O ATOM 1259 CB PHE A 145 -16.733 -23.797 -13.710 1.00 20.08 C ATOM 1260 CG PHE A 145 -16.792 -22.327 -13.393 1.00 20.59 C ATOM 1261 CD1 PHE A 145 -17.496 -21.870 -12.285 1.00 23.87 C ATOM 1262 CD2 PHE A 145 -16.128 -21.406 -14.181 1.00 22.26 C ATOM 1263 CE1 PHE A 145 -17.588 -20.505 -12.019 1.00 23.40 C ATOM 1264 CE2 PHE A 145 -16.197 -20.047 -13.894 1.00 26.69 C ATOM 1265 CZ PHE A 145 -16.931 -19.606 -12.813 1.00 24.84 C ATOM 1266 H PHE A 145 -13.900 -24.707 -13.407 1.00 0.00 H ATOM 1267 N HIS A 147 -17.072 -26.776 -12.904 1.00 20.51 N ATOM 1268 CA HIS A 147 -17.264 -28.119 -13.473 1.00 21.66 C ATOM 1269 C HIS A 147 -17.287 -27.993 -15.008 1.00 22.34 C ATOM 1270 O HIS A 147 -18.029 -27.173 -15.570 1.00 23.37 O ATOM 1271 CB HIS A 147 -18.563 -28.759 -12.967 1.00 23.35 C ATOM 1272 CG HIS A 147 -18.870 -30.094 -13.575 1.00 26.75 C ATOM 1273 ND1 HIS A 147 -18.010 -31.176 -13.439 1.00 26.65 N ATOM 1274 CD2 HIS A 147 -19.933 -30.475 -14.325 1.00 30.97 C ATOM 1275 CE1 HIS A 147 -18.593 -32.177 -14.091 1.00 28.65 C ATOM 1276 NE2 HIS A 147 -19.735 -31.795 -14.648 1.00 30.76 N ATOM 1277 H HIS A 147 -17.781 -26.385 -12.252 1.00 0.00 H ATOM 1278 N LYS A 148 -16.418 -28.769 -15.670 1.00 22.54 N ATOM 1279 CA LYS A 148 -16.202 -28.792 -17.122 1.00 23.35 C ATOM 1280 C LYS A 148 -15.735 -27.441 -17.645 1.00 23.21 C ATOM 1281 O LYS A 148 -15.847 -27.177 -18.820 1.00 24.39 O ATOM 1282 CB LYS A 148 -17.440 -29.286 -17.889 1.00 27.78 C ATOM 1283 CG LYS A 148 -17.823 -30.717 -17.507 1.00 29.69 C ATOM 1284 CD LYS A 148 -18.992 -31.191 -18.355 1.00 38.20 C ATOM 1285 CE LYS A 148 -19.198 -32.685 -18.265 1.00 59.79 C ATOM 1286 NZ LYS A 148 -20.384 -33.127 -19.047 1.00 75.13 N ATOM 1287 HZ1 LYS A 148 -21.235 -32.657 -18.679 1.00 0.00 H ATOM 1288 HZ2 LYS A 148 -20.252 -32.875 -20.047 1.00 0.00 H ATOM 1289 HZ3 LYS A 148 -20.491 -34.158 -18.960 1.00 0.00 H ATOM 1290 H LYS A 148 -15.840 -29.419 -15.099 1.00 0.00 H ATOM 1291 N GLY A 149 -15.160 -26.631 -16.760 1.00 19.31 N ATOM 1292 CA GLY A 149 -14.709 -25.297 -17.098 1.00 20.28 C ATOM 1293 C GLY A 149 -13.209 -25.232 -17.268 1.00 21.02 C ATOM 1294 O GLY A 149 -12.514 -26.259 -17.247 1.00 20.27 O ATOM 1295 H GLY A 149 -15.029 -26.970 -15.785 1.00 0.00 H ATOM 1296 N ALA A 150 -12.698 -24.040 -17.415 1.00 17.27 N ATOM 1297 CA ALA A 150 -11.259 -23.869 -17.609 1.00 16.22 C ATOM 1298 C ALA A 150 -10.456 -24.175 -16.366 1.00 16.10 C ATOM 1299 O ALA A 150 -10.922 -23.972 -15.241 1.00 15.61 O ATOM 1300 CB ALA A 150 -10.965 -22.442 -18.021 1.00 17.09 C ATOM 1301 H ALA A 150 -13.319 -23.206 -17.394 1.00 0.00 H ATOM 1302 N SER A 151 -9.204 -24.559 -16.572 1.00 16.08 N ATOM 1303 CA SER A 151 -8.215 -24.720 -15.518 1.00 15.05 C ATOM 1304 C SER A 151 -7.828 -23.348 -14.969 1.00 14.45 C ATOM 1305 O SER A 151 -7.937 -22.323 -15.652 1.00 15.54 O ATOM 1306 CB SER A 151 -6.939 -25.357 -16.085 1.00 20.91 C ATOM 1307 OG SER A 151 -7.192 -26.685 -16.501 1.00 32.57 O ATOM 1308 HG SER A 151 -7.502 -27.219 -15.727 1.00 0.00 H ATOM 1309 H SER A 151 -8.910 -24.758 -17.550 1.00 0.00 H ATOM 1310 N ALA A 152 -7.318 -23.344 -13.749 1.00 13.79 N ATOM 1311 CA ALA A 152 -6.820 -22.109 -13.169 1.00 13.37 C ATOM 1312 C ALA A 152 -5.499 -21.692 -13.788 1.00 17.86 C ATOM 1313 O ALA A 152 -4.743 -22.544 -14.236 1.00 19.32 O ATOM 1314 CB ALA A 152 -6.571 -22.324 -11.681 1.00 14.32 C ATOM 1315 H ALA A 152 -7.273 -24.228 -13.203 1.00 0.00 H ATOM 1316 N LEU A 153 -5.166 -20.409 -13.727 1.00 15.86 N ATOM 1317 CA LEU A 153 -3.816 -19.952 -14.079 1.00 15.32 C ATOM 1318 C LEU A 153 -3.050 -19.712 -12.786 1.00 14.48 C ATOM 1319 O LEU A 153 -2.006 -20.337 -12.565 1.00 15.12 O ATOM 1320 CB LEU A 153 -3.801 -18.676 -14.910 1.00 16.31 C ATOM 1321 CG LEU A 153 -4.517 -18.699 -16.259 1.00 19.86 C ATOM 1322 CD1 LEU A 153 -4.151 -17.482 -17.083 1.00 20.39 C ATOM 1323 CD2 LEU A 153 -4.210 -19.933 -17.035 1.00 21.55 C ATOM 1324 H LEU A 153 -5.876 -19.713 -13.423 1.00 0.00 H ATOM 1325 N VAL A 154 -3.627 -18.917 -11.867 1.00 14.43 N ATOM 1326 CA VAL A 154 -3.048 -18.704 -10.547 1.00 14.07 C ATOM 1327 C VAL A 154 -3.545 -19.829 -9.617 1.00 13.94 C ATOM 1328 O VAL A 154 -4.734 -20.157 -9.586 1.00 13.37 O ATOM 1329 CB VAL A 154 -3.394 -17.310 -9.985 1.00 16.38 C ATOM 1330 CG1 VAL A 154 -2.915 -17.132 -8.547 1.00 16.62 C ATOM 1331 CG2 VAL A 154 -2.795 -16.213 -10.877 1.00 18.24 C ATOM 1332 H VAL A 154 -4.518 -18.437 -12.107 1.00 0.00 H ATOM 1333 N LEU A 155 -2.621 -20.394 -8.832 1.00 12.74 N ATOM 1334 CA LEU A 155 -2.966 -21.435 -7.841 1.00 11.19 C ATOM 1335 C LEU A 155 -4.186 -21.009 -7.035 1.00 11.94 C ATOM 1336 O LEU A 155 -4.226 -19.896 -6.522 1.00 11.98 O ATOM 1337 CB LEU A 155 -1.763 -21.632 -6.909 1.00 11.27 C ATOM 1338 CG LEU A 155 -1.912 -22.680 -5.816 1.00 12.63 C ATOM 1339 CD1 LEU A 155 -2.141 -24.061 -6.383 1.00 12.92 C ATOM 1340 CD2 LEU A 155 -0.676 -22.674 -4.901 1.00 11.88 C ATOM 1341 H LEU A 155 -1.630 -20.092 -8.922 1.00 0.00 H ATOM 1342 N GLN A 156 -5.150 -21.953 -6.871 1.00 11.23 N ATOM 1343 CA GLN A 156 -6.350 -21.691 -6.090 1.00 11.20 C ATOM 1344 C GLN A 156 -6.282 -22.438 -4.777 1.00 12.09 C ATOM 1345 O GLN A 156 -5.678 -23.514 -4.712 1.00 11.60 O ATOM 1346 CB GLN A 156 -7.577 -22.192 -6.853 1.00 12.04 C ATOM 1347 CG GLN A 156 -7.799 -21.494 -8.190 1.00 12.31 C ATOM 1348 CD GLN A 156 -8.132 -20.043 -8.025 1.00 13.75 C ATOM 1349 OE1 GLN A 156 -9.201 -19.711 -7.533 1.00 14.33 O ATOM 1350 NE2 GLN A 156 -7.189 -19.162 -8.315 1.00 13.54 N ATOM 1351 HE22 GLN A 156 -6.291 -19.480 -8.733 1.00 0.00 H ATOM 1352 HE21 GLN A 156 -7.345 -18.152 -8.125 1.00 0.00 H ATOM 1353 H GLN A 156 -5.027 -22.886 -7.315 1.00 0.00 H ATOM 1354 N TYR A 157 -6.947 -21.909 -3.744 1.00 11.47 N ATOM 1355 CA TYR A 157 -7.059 -22.627 -2.481 1.00 10.96 C ATOM 1356 C TYR A 157 -8.446 -22.477 -1.890 1.00 11.79 C ATOM 1357 O TYR A 157 -9.179 -21.524 -2.178 1.00 12.66 O ATOM 1358 CB TYR A 157 -5.988 -22.218 -1.454 1.00 11.75 C ATOM 1359 CG TYR A 157 -6.271 -20.871 -0.811 1.00 12.93 C ATOM 1360 CD1 TYR A 157 -5.933 -19.691 -1.446 1.00 13.58 C ATOM 1361 CD2 TYR A 157 -6.873 -20.785 0.444 1.00 13.28 C ATOM 1362 CE1 TYR A 157 -6.183 -18.450 -0.848 1.00 16.03 C ATOM 1363 CE2 TYR A 157 -7.133 -19.555 1.040 1.00 15.23 C ATOM 1364 CZ TYR A 157 -6.765 -18.394 0.394 1.00 19.27 C ATOM 1365 OH TYR A 157 -7.000 -17.149 0.954 1.00 23.07 O ATOM 1366 HH TYR A 157 -7.973 -17.031 1.096 1.00 0.00 H ATOM 1367 H TYR A 157 -7.390 -20.973 -3.844 1.00 0.00 H ATOM 1368 N LEU A 158 -8.791 -23.434 -1.017 1.00 11.45 N ATOM 1369 CA LEU A 158 -10.093 -23.491 -0.416 1.00 11.81 C ATOM 1370 C LEU A 158 -10.038 -24.272 0.904 1.00 12.69 C ATOM 1371 O LEU A 158 -9.455 -25.352 0.963 1.00 12.65 O ATOM 1372 CB LEU A 158 -11.039 -24.226 -1.400 1.00 12.88 C ATOM 1373 CG LEU A 158 -12.437 -24.510 -0.910 1.00 14.70 C ATOM 1374 CD1 LEU A 158 -13.202 -23.202 -0.724 1.00 14.14 C ATOM 1375 CD2 LEU A 158 -13.164 -25.437 -1.879 1.00 15.11 C ATOM 1376 H LEU A 158 -8.091 -24.161 -0.766 1.00 0.00 H ATOM 1377 N ARG A 159 -10.707 -23.727 1.935 1.00 13.37 N ATOM 1378 CA ARG A 159 -10.886 -24.423 3.195 1.00 13.18 C ATOM 1379 C ARG A 159 -12.121 -25.311 3.042 1.00 15.58 C ATOM 1380 O ARG A 159 -13.186 -24.837 2.629 1.00 17.42 O ATOM 1381 CB ARG A 159 -11.122 -23.411 4.306 1.00 16.23 C ATOM 1382 CG ARG A 159 -11.258 -24.054 5.681 1.00 20.01 C ATOM 1383 CD ARG A 159 -11.805 -23.086 6.710 1.00 25.18 C ATOM 1384 NE ARG A 159 -13.263 -22.971 6.567 1.00 38.71 N ATOM 1385 CZ ARG A 159 -14.170 -23.841 7.029 1.00 51.48 C ATOM 1386 NH1 ARG A 159 -13.787 -24.923 7.709 1.00 33.57 N ATOM 1387 NH2 ARG A 159 -15.464 -23.636 6.816 1.00 43.75 N ATOM 1388 HE ARG A 159 -13.624 -22.137 6.060 1.00 0.00 H ATOM 1389 HH12 ARG A 159 -14.499 -25.593 8.064 1.00 0.00 H ATOM 1390 HH11 ARG A 159 -12.777 -25.096 7.884 1.00 0.00 H ATOM 1391 HH22 ARG A 159 -16.164 -24.315 7.177 1.00 0.00 H ATOM 1392 HH21 ARG A 159 -15.778 -22.797 6.288 1.00 0.00 H ATOM 1393 H ARG A 159 -11.110 -22.774 1.825 1.00 0.00 H ATOM 1394 N VAL A 160 -11.984 -26.600 3.342 1.00 13.62 N ATOM 1395 CA VAL A 160 -13.077 -27.567 3.249 1.00 13.92 C ATOM 1396 C VAL A 160 -13.288 -28.268 4.587 1.00 16.08 C ATOM 1397 O VAL A 160 -12.332 -28.814 5.170 1.00 15.67 O ATOM 1398 CB VAL A 160 -12.884 -28.618 2.138 1.00 15.42 C ATOM 1399 CG1 VAL A 160 -13.005 -27.977 0.763 1.00 15.55 C ATOM 1400 CG2 VAL A 160 -11.570 -29.394 2.251 1.00 15.61 C ATOM 1401 H VAL A 160 -11.052 -26.937 3.659 1.00 0.00 H ATOM 1402 N PRO A 161 -14.546 -28.369 5.034 1.00 14.63 N ATOM 1403 CA PRO A 161 -14.827 -29.061 6.290 1.00 14.43 C ATOM 1404 C PRO A 161 -14.981 -30.544 6.039 1.00 17.21 C ATOM 1405 O PRO A 161 -15.487 -30.974 5.001 1.00 17.01 O ATOM 1406 CB PRO A 161 -16.155 -28.445 6.739 1.00 16.19 C ATOM 1407 CG PRO A 161 -16.804 -28.027 5.551 1.00 21.95 C ATOM 1408 CD PRO A 161 -15.747 -27.693 4.521 1.00 16.49 C ATOM 1409 N LEU A 162 -14.623 -31.334 7.052 1.00 16.80 N ATOM 1410 CA LEU A 162 -14.792 -32.759 7.020 1.00 17.72 C ATOM 1411 C LEU A 162 -16.302 -33.055 7.044 1.00 20.58 C ATOM 1412 O LEU A 162 -17.053 -32.397 7.789 1.00 21.05 O ATOM 1413 CB LEU A 162 -14.115 -33.333 8.278 1.00 17.60 C ATOM 1414 CG LEU A 162 -14.106 -34.813 8.449 1.00 20.83 C ATOM 1415 CD1 LEU A 162 -13.316 -35.496 7.333 1.00 20.47 C ATOM 1416 CD2 LEU A 162 -13.562 -35.176 9.821 1.00 17.45 C ATOM 1417 H LEU A 162 -14.204 -30.900 7.899 1.00 0.00 H ATOM 1418 N VAL A 163 -16.756 -34.013 6.223 1.00 20.52 N ATOM 1419 CA VAL A 163 -18.157 -34.393 6.148 1.00 22.56 C ATOM 1420 C VAL A 163 -18.331 -35.747 6.825 1.00 29.31 C ATOM 1421 O VAL A 163 -17.504 -36.624 6.642 1.00 30.01 O ATOM 1422 CB VAL A 163 -18.599 -34.410 4.674 1.00 24.55 C ATOM 1423 CG1 VAL A 163 -19.992 -35.036 4.522 1.00 25.69 C ATOM 1424 CG2 VAL A 163 -18.583 -32.987 4.127 1.00 23.56 C ATOM 1425 H VAL A 163 -16.075 -34.507 5.612 1.00 0.00 H ATOM 1426 N ASP A 164 -19.397 -35.921 7.597 1.00 28.74 N ATOM 1427 CA ASP A 164 -19.600 -37.205 8.277 1.00 30.63 C ATOM 1428 C ASP A 164 -19.838 -38.331 7.259 1.00 33.13 C ATOM 1429 O ASP A 164 -20.431 -38.133 6.197 1.00 31.44 O ATOM 1430 CB ASP A 164 -20.707 -37.122 9.335 1.00 34.56 C ATOM 1431 CG ASP A 164 -22.097 -37.164 8.769 1.00 50.75 C ATOM 1432 OD1 ASP A 164 -22.598 -36.096 8.365 1.00 53.18 O ATOM 1433 OD2 ASP A 164 -22.692 -38.267 8.742 1.00 58.40 O ATOM 1434 H ASP A 164 -20.085 -35.151 7.719 1.00 0.00 H ATOM 1435 N ARG A 165 -19.311 -39.504 7.585 1.00 32.82 N ATOM 1436 CA ARG A 165 -19.316 -40.701 6.748 1.00 32.81 C ATOM 1437 C ARG A 165 -20.676 -41.101 6.169 1.00 33.23 C ATOM 1438 O ARG A 165 -20.756 -41.417 4.989 1.00 33.21 O ATOM 1439 CB ARG A 165 -18.747 -41.867 7.562 1.00 35.18 C ATOM 1440 CG ARG A 165 -18.638 -43.177 6.810 1.00 46.99 C ATOM 1441 CD ARG A 165 -18.046 -44.232 7.717 1.00 50.31 C ATOM 1442 NE ARG A 165 -18.254 -45.577 7.189 1.00 59.20 N ATOM 1443 CZ ARG A 165 -19.388 -46.274 7.274 1.00 67.95 C ATOM 1444 NH1 ARG A 165 -20.462 -45.750 7.866 1.00 47.70 N ATOM 1445 NH2 ARG A 165 -19.461 -47.495 6.762 1.00 50.05 N ATOM 1446 HE ARG A 165 -17.451 -46.029 6.707 1.00 0.00 H ATOM 1447 HH12 ARG A 165 -21.342 -46.300 7.928 1.00 0.00 H ATOM 1448 HH11 ARG A 165 -20.419 -44.791 8.266 1.00 0.00 H ATOM 1449 HH22 ARG A 165 -20.347 -48.035 6.830 1.00 0.00 H ATOM 1450 HH21 ARG A 165 -18.632 -47.912 6.292 1.00 0.00 H ATOM 1451 H ARG A 165 -18.855 -39.578 8.517 1.00 0.00 H ATOM 1452 N ALA A 166 -21.724 -41.153 6.997 1.00 34.05 N ATOM 1453 CA ALA A 166 -23.041 -41.569 6.500 1.00 34.91 C ATOM 1454 C ALA A 166 -23.561 -40.625 5.415 1.00 37.36 C ATOM 1455 O ALA A 166 -24.088 -41.096 4.414 1.00 35.72 O ATOM 1456 CB ALA A 166 -24.044 -41.665 7.649 1.00 36.50 C ATOM 1457 H ALA A 166 -21.606 -40.897 7.998 1.00 0.00 H ATOM 1458 N THR A 167 -23.340 -39.301 5.575 1.00 35.35 N ATOM 1459 CA THR A 167 -23.760 -38.284 4.608 1.00 34.38 C ATOM 1460 C THR A 167 -23.045 -38.497 3.299 1.00 36.21 C ATOM 1461 O THR A 167 -23.656 -38.435 2.243 1.00 36.48 O ATOM 1462 CB THR A 167 -23.494 -36.890 5.185 1.00 37.67 C ATOM 1463 OG1 THR A 167 -24.249 -36.792 6.393 1.00 35.99 O ATOM 1464 CG2 THR A 167 -23.862 -35.763 4.219 1.00 35.87 C ATOM 1465 HG1 THR A 167 -23.954 -37.496 7.023 1.00 0.00 H ATOM 1466 H THR A 167 -22.844 -38.987 6.433 1.00 0.00 H ATOM 1467 N CYS A 168 -21.753 -38.765 3.363 1.00 31.95 N ATOM 1468 CA CYS A 168 -21.034 -39.014 2.138 1.00 32.48 C ATOM 1469 C CYS A 168 -21.448 -40.279 1.424 1.00 38.69 C ATOM 1470 O CYS A 168 -21.563 -40.265 0.204 1.00 38.86 O ATOM 1471 CB CYS A 168 -19.549 -39.015 2.370 1.00 32.09 C ATOM 1472 SG CYS A 168 -18.643 -39.038 0.825 1.00 35.41 S ATOM 1473 H CYS A 168 -21.263 -38.796 4.280 1.00 0.00 H ATOM 1474 N LEU A 169 -21.623 -41.392 2.155 1.00 38.11 N ATOM 1475 CA LEU A 169 -22.071 -42.647 1.526 1.00 39.92 C ATOM 1476 C LEU A 169 -23.367 -42.445 0.711 1.00 43.55 C ATOM 1477 O LEU A 169 -23.439 -42.885 -0.434 1.00 42.40 O ATOM 1478 CB LEU A 169 -22.266 -43.747 2.577 1.00 41.44 C ATOM 1479 CG LEU A 169 -21.115 -44.738 2.741 1.00 46.91 C ATOM 1480 CD1 LEU A 169 -19.824 -44.057 3.142 1.00 46.03 C ATOM 1481 CD2 LEU A 169 -21.463 -45.775 3.783 1.00 49.61 C ATOM 1482 H LEU A 169 -21.440 -41.368 3.178 1.00 0.00 H ATOM 1483 N ARG A 170 -24.363 -41.749 1.283 1.00 41.46 N ATOM 1484 CA ARG A 170 -25.626 -41.455 0.580 1.00 43.50 C ATOM 1485 C ARG A 170 -25.456 -40.546 -0.646 1.00 47.55 C ATOM 1486 O ARG A 170 -26.297 -40.587 -1.543 1.00 49.84 O ATOM 1487 CB ARG A 170 -26.653 -40.804 1.526 1.00 46.52 C ATOM 1488 CG ARG A 170 -27.362 -41.789 2.432 1.00 67.77 C ATOM 1489 CD ARG A 170 -28.587 -41.182 3.098 1.00 90.83 C ATOM 1490 NE ARG A 170 -28.288 -39.921 3.780 1.00107.81 N ATOM 1491 CZ ARG A 170 -27.636 -39.804 4.937 1.00126.15 C ATOM 1492 NH1 ARG A 170 -27.184 -40.884 5.569 1.00116.56 N ATOM 1493 NH2 ARG A 170 -27.419 -38.605 5.465 1.00113.73 N ATOM 1494 HE ARG A 170 -28.611 -39.044 3.324 1.00 0.00 H ATOM 1495 HH12 ARG A 170 -26.676 -40.784 6.471 1.00 0.00 H ATOM 1496 HH11 ARG A 170 -27.338 -41.828 5.161 1.00 0.00 H ATOM 1497 HH22 ARG A 170 -26.910 -38.519 6.368 1.00 0.00 H ATOM 1498 HH21 ARG A 170 -27.758 -37.752 4.976 1.00 0.00 H ATOM 1499 H ARG A 170 -24.239 -41.405 2.257 1.00 0.00 H ATOM 1500 N SER A 171 -24.414 -39.696 -0.662 1.00 41.96 N ATOM 1501 CA SER A 171 -24.161 -38.763 -1.759 1.00 40.45 C ATOM 1502 C SER A 171 -23.675 -39.399 -3.059 1.00 45.20 C ATOM 1503 O SER A 171 -23.725 -38.722 -4.083 1.00 46.05 O ATOM 1504 CB SER A 171 -23.152 -37.700 -1.324 1.00 39.24 C ATOM 1505 OG SER A 171 -21.806 -38.139 -1.381 1.00 38.08 O ATOM 1506 HG SER A 171 -21.689 -38.920 -0.784 1.00 0.00 H ATOM 1507 H SER A 171 -23.757 -39.703 0.144 1.00 0.00 H ATOM 1508 N THR A 172 -23.157 -40.650 -3.034 1.00 41.56 N ATOM 1509 CA THR A 172 -22.611 -41.297 -4.240 1.00 41.41 C ATOM 1510 C THR A 172 -22.988 -42.766 -4.352 1.00 44.55 C ATOM 1511 O THR A 172 -23.143 -43.431 -3.335 1.00 43.35 O ATOM 1512 CB THR A 172 -21.076 -41.147 -4.259 1.00 45.25 C ATOM 1513 OG1 THR A 172 -20.518 -41.856 -5.365 1.00 44.94 O ATOM 1514 CG2 THR A 172 -20.414 -41.640 -2.998 1.00 40.94 C ATOM 1515 HG1 THR A 172 -20.888 -41.493 -6.209 1.00 0.00 H ATOM 1516 H THR A 172 -23.144 -41.171 -2.134 1.00 0.00 H ATOM 1517 N LYS A 173 -23.075 -43.277 -5.594 1.00 42.25 N ATOM 1518 CA LYS A 173 -23.353 -44.693 -5.854 1.00 44.04 C ATOM 1519 C LYS A 173 -22.090 -45.555 -5.657 1.00 48.34 C ATOM 1520 O LYS A 173 -22.207 -46.749 -5.360 1.00 48.22 O ATOM 1521 CB LYS A 173 -23.944 -44.899 -7.266 1.00 48.94 C ATOM 1522 CG LYS A 173 -22.962 -44.720 -8.431 1.00 78.85 C ATOM 1523 CD LYS A 173 -23.683 -44.630 -9.769 1.00100.73 C ATOM 1524 CE LYS A 173 -22.741 -44.291 -10.897 1.00123.35 C ATOM 1525 NZ LYS A 173 -23.459 -44.135 -12.188 1.00140.70 N ATOM 1526 HZ1 LYS A 173 -23.944 -45.024 -12.423 1.00 0.00 H ATOM 1527 HZ2 LYS A 173 -24.158 -43.369 -12.104 1.00 0.00 H ATOM 1528 HZ3 LYS A 173 -22.776 -43.902 -12.937 1.00 0.00 H ATOM 1529 H LYS A 173 -22.939 -42.640 -6.405 1.00 0.00 H ATOM 1530 N PHE A 174 -20.889 -44.948 -5.803 1.00 44.30 N ATOM 1531 CA PHE A 174 -19.615 -45.658 -5.648 1.00 43.78 C ATOM 1532 C PHE A 174 -19.315 -45.921 -4.175 1.00 48.18 C ATOM 1533 O PHE A 174 -19.850 -45.232 -3.308 1.00 48.55 O ATOM 1534 CB PHE A 174 -18.471 -44.888 -6.328 1.00 43.86 C ATOM 1535 CG PHE A 174 -18.705 -44.648 -7.802 1.00 45.48 C ATOM 1536 CD1 PHE A 174 -18.642 -45.696 -8.711 1.00 48.84 C ATOM 1537 CD2 PHE A 174 -19.088 -43.398 -8.267 1.00 45.82 C ATOM 1538 CE1 PHE A 174 -18.903 -45.483 -10.064 1.00 50.41 C ATOM 1539 CE2 PHE A 174 -19.338 -43.187 -9.621 1.00 49.27 C ATOM 1540 CZ PHE A 174 -19.278 -44.237 -10.506 1.00 48.32 C ATOM 1541 H PHE A 174 -20.869 -43.934 -6.035 1.00 0.00 H ATOM 1542 N THR A 175 -18.489 -46.942 -3.887 1.00 44.65 N ATOM 1543 CA THR A 175 -18.179 -47.325 -2.507 1.00 43.57 C ATOM 1544 C THR A 175 -17.059 -46.448 -1.938 1.00 43.19 C ATOM 1545 O THR A 175 -16.090 -46.146 -2.638 1.00 45.06 O ATOM 1546 CB THR A 175 -17.815 -48.813 -2.417 1.00 57.69 C ATOM 1547 OG1 THR A 175 -18.840 -49.582 -3.049 1.00 59.46 O ATOM 1548 CG2 THR A 175 -17.635 -49.277 -0.972 1.00 57.71 C ATOM 1549 HG1 THR A 175 -18.611 -50.544 -2.994 1.00 0.00 H ATOM 1550 H THR A 175 -18.057 -47.476 -4.668 1.00 0.00 H ATOM 1551 N ILE A 176 -17.210 -46.026 -0.682 1.00 35.05 N ATOM 1552 CA ILE A 176 -16.216 -45.195 0.014 1.00 31.48 C ATOM 1553 C ILE A 176 -15.647 -46.047 1.151 1.00 32.85 C ATOM 1554 O ILE A 176 -16.349 -46.276 2.125 1.00 33.80 O ATOM 1555 CB ILE A 176 -16.857 -43.879 0.572 1.00 32.86 C ATOM 1556 CG1 ILE A 176 -17.621 -43.086 -0.511 1.00 33.35 C ATOM 1557 CG2 ILE A 176 -15.818 -42.985 1.290 1.00 31.57 C ATOM 1558 CD1 ILE A 176 -16.872 -42.713 -1.656 1.00 32.74 C ATOM 1559 H ILE A 176 -18.073 -46.298 -0.169 1.00 0.00 H ATOM 1560 N TYR A 177 -14.369 -46.467 1.058 1.00 28.73 N ATOM 1561 CA TYR A 177 -13.764 -47.271 2.116 1.00 27.87 C ATOM 1562 C TYR A 177 -13.220 -46.360 3.228 1.00 27.88 C ATOM 1563 O TYR A 177 -13.120 -45.136 3.063 1.00 24.27 O ATOM 1564 CB TYR A 177 -12.639 -48.162 1.573 1.00 30.15 C ATOM 1565 CG TYR A 177 -13.029 -49.098 0.452 1.00 33.01 C ATOM 1566 CD1 TYR A 177 -14.152 -49.903 0.550 1.00 35.08 C ATOM 1567 CD2 TYR A 177 -12.264 -49.183 -0.702 1.00 34.65 C ATOM 1568 CE1 TYR A 177 -14.499 -50.784 -0.473 1.00 35.25 C ATOM 1569 CE2 TYR A 177 -12.616 -50.027 -1.743 1.00 36.57 C ATOM 1570 CZ TYR A 177 -13.730 -50.834 -1.623 1.00 38.88 C ATOM 1571 OH TYR A 177 -14.019 -51.675 -2.664 1.00 41.70 O ATOM 1572 HH TYR A 177 -14.835 -52.193 -2.451 1.00 0.00 H ATOM 1573 H TYR A 177 -13.806 -46.215 0.221 1.00 0.00 H ATOM 1574 N ASN A 178 -12.862 -46.969 4.351 1.00 25.76 N ATOM 1575 CA ASN A 178 -12.377 -46.300 5.549 1.00 25.60 C ATOM 1576 C ASN A 178 -11.058 -45.614 5.361 1.00 25.54 C ATOM 1577 O ASN A 178 -10.745 -44.768 6.210 1.00 26.21 O ATOM 1578 CB ASN A 178 -12.305 -47.279 6.734 1.00 30.15 C ATOM 1579 CG ASN A 178 -13.656 -47.738 7.262 1.00 53.16 C ATOM 1580 OD1 ASN A 178 -14.683 -47.061 7.127 1.00 40.84 O ATOM 1581 ND2 ASN A 178 -13.685 -48.891 7.917 1.00 51.68 N ATOM 1582 HD22 ASN A 178 -12.815 -49.451 8.024 1.00 0.00 H ATOM 1583 HD21 ASN A 178 -14.578 -49.235 8.324 1.00 0.00 H ATOM 1584 H ASN A 178 -12.934 -48.006 4.377 1.00 0.00 H ATOM 1585 N ASN A 179 -10.288 -45.928 4.288 1.00 22.67 N ATOM 1586 CA ASN A 179 -9.050 -45.191 3.950 1.00 23.03 C ATOM 1587 C ASN A 179 -9.330 -43.904 3.160 1.00 25.25 C ATOM 1588 O ASN A 179 -8.364 -43.251 2.724 1.00 26.20 O ATOM 1589 CB ASN A 179 -8.038 -46.075 3.202 1.00 26.67 C ATOM 1590 CG ASN A 179 -8.495 -46.603 1.850 1.00 47.33 C ATOM 1591 OD1 ASN A 179 -9.663 -46.534 1.485 1.00 32.93 O ATOM 1592 ND2 ASN A 179 -7.585 -47.160 1.078 1.00 44.05 N ATOM 1593 HD22 ASN A 179 -6.596 -47.214 1.396 1.00 0.00 H ATOM 1594 HD21 ASN A 179 -7.855 -47.546 0.151 1.00 0.00 H ATOM 1595 H ASN A 179 -10.580 -46.719 3.679 1.00 0.00 H ATOM 1596 N MET A 180 -10.611 -43.553 2.938 1.00 21.91 N ATOM 1597 CA MET A 180 -11.004 -42.332 2.242 1.00 21.70 C ATOM 1598 C MET A 180 -11.889 -41.495 3.160 1.00 23.41 C ATOM 1599 O MET A 180 -12.557 -42.029 4.052 1.00 24.40 O ATOM 1600 CB MET A 180 -11.811 -42.667 0.974 1.00 24.82 C ATOM 1601 CG MET A 180 -11.025 -43.393 -0.084 1.00 29.12 C ATOM 1602 SD MET A 180 -12.036 -44.529 -1.069 1.00 34.72 S ATOM 1603 CE MET A 180 -13.121 -43.550 -1.686 1.00 31.40 C ATOM 1604 H MET A 180 -11.361 -44.186 3.281 1.00 0.00 H ATOM 1605 N PHE A 181 -11.916 -40.179 2.927 1.00 18.67 N ATOM 1606 CA PHE A 181 -12.807 -39.300 3.641 1.00 18.16 C ATOM 1607 C PHE A 181 -13.411 -38.356 2.623 1.00 20.64 C ATOM 1608 O PHE A 181 -12.905 -38.220 1.500 1.00 18.74 O ATOM 1609 CB PHE A 181 -12.134 -38.550 4.790 1.00 17.23 C ATOM 1610 CG PHE A 181 -11.109 -37.519 4.376 1.00 15.81 C ATOM 1611 CD1 PHE A 181 -9.773 -37.861 4.234 1.00 16.36 C ATOM 1612 CD2 PHE A 181 -11.463 -36.189 4.224 1.00 16.75 C ATOM 1613 CE1 PHE A 181 -8.807 -36.884 3.978 1.00 15.96 C ATOM 1614 CE2 PHE A 181 -10.504 -35.230 3.884 1.00 16.17 C ATOM 1615 CZ PHE A 181 -9.184 -35.581 3.785 1.00 14.02 C ATOM 1616 H PHE A 181 -11.277 -39.779 2.211 1.00 0.00 H ATOM 1617 N CYS A 182 -14.495 -37.723 3.010 1.00 20.57 N ATOM 1618 CA CYS A 182 -15.186 -36.721 2.221 1.00 22.45 C ATOM 1619 C CYS A 182 -15.079 -35.363 2.889 1.00 20.47 C ATOM 1620 O CYS A 182 -15.068 -35.260 4.118 1.00 19.50 O ATOM 1621 CB CYS A 182 -16.632 -37.147 2.063 1.00 26.49 C ATOM 1622 SG CYS A 182 -16.783 -38.886 1.575 1.00 32.89 S ATOM 1623 H CYS A 182 -14.884 -37.956 3.946 1.00 0.00 H ATOM 1624 N ALA A 183 -15.011 -34.314 2.074 1.00 17.34 N ATOM 1625 CA ALA A 183 -14.949 -32.949 2.584 1.00 17.57 C ATOM 1626 C ALA A 183 -15.635 -32.039 1.587 1.00 18.67 C ATOM 1627 O ALA A 183 -15.690 -32.355 0.384 1.00 18.50 O ATOM 1628 CB ALA A 183 -13.517 -32.505 2.831 1.00 18.54 C ATOM 1629 H ALA A 183 -15.002 -34.471 1.046 1.00 0.00 H ATOM 1630 N GLY A 184 -16.180 -30.931 2.080 1.00 17.58 N ATOM 1631 CA GLY A 184 -16.889 -30.001 1.226 1.00 17.98 C ATOM 1632 C GLY A 184 -18.136 -29.464 1.875 1.00 20.82 C ATOM 1633 O GLY A 184 -18.261 -29.498 3.103 1.00 20.86 O ATOM 1634 H GLY A 184 -16.096 -30.729 3.097 1.00 0.00 H ATOM 1635 N PHE A 184A -19.026 -28.923 1.064 1.00 21.52 N ATOM 1636 CA PHE A 184A -20.188 -28.183 1.540 1.00 22.36 C ATOM 1637 C PHE A 184A -21.479 -28.752 1.050 1.00 29.72 C ATOM 1638 O PHE A 184A -21.565 -29.138 -0.105 1.00 29.51 O ATOM 1639 CB PHE A 184A -20.057 -26.740 1.070 1.00 23.26 C ATOM 1640 CG PHE A 184A -18.887 -26.052 1.706 1.00 22.00 C ATOM 1641 CD1 PHE A 184A -17.621 -26.128 1.140 1.00 19.61 C ATOM 1642 CD2 PHE A 184A -19.032 -25.345 2.887 1.00 22.31 C ATOM 1643 CE1 PHE A 184A -16.530 -25.522 1.748 1.00 19.98 C ATOM 1644 CE2 PHE A 184A -17.938 -24.723 3.480 1.00 24.33 C ATOM 1645 CZ PHE A 184A -16.700 -24.792 2.888 1.00 20.83 C ATOM 1646 H PHE A 184A -18.892 -29.030 0.038 1.00 0.00 H ATOM 1647 N HIS A 185 -22.497 -28.788 1.928 1.00 29.98 N ATOM 1648 CA HIS A 185 -23.825 -29.311 1.589 1.00 32.88 C ATOM 1649 C HIS A 185 -24.464 -28.502 0.453 1.00 36.36 C ATOM 1650 O HIS A 185 -25.088 -29.087 -0.424 1.00 37.88 O ATOM 1651 CB HIS A 185 -24.746 -29.323 2.830 1.00 35.96 C ATOM 1652 CG HIS A 185 -24.143 -29.972 4.047 1.00 40.72 C ATOM 1653 ND1 HIS A 185 -23.530 -31.213 3.980 1.00 43.22 N ATOM 1654 CD2 HIS A 185 -24.068 -29.519 5.323 1.00 43.93 C ATOM 1655 CE1 HIS A 185 -23.083 -31.467 5.203 1.00 43.11 C ATOM 1656 NE2 HIS A 185 -23.406 -30.487 6.050 1.00 43.69 N ATOM 1657 H HIS A 185 -22.336 -28.429 2.891 1.00 0.00 H ATOM 1658 N GLU A 186 -24.258 -27.180 0.434 1.00 30.11 N ATOM 1659 CA GLU A 186 -24.817 -26.313 -0.610 1.00 29.80 C ATOM 1660 C GLU A 186 -24.105 -26.402 -1.960 1.00 32.46 C ATOM 1661 O GLU A 186 -24.640 -25.875 -2.942 1.00 33.83 O ATOM 1662 CB GLU A 186 -24.890 -24.838 -0.138 1.00 31.34 C ATOM 1663 CG GLU A 186 -23.555 -24.096 -0.084 1.00 42.53 C ATOM 1664 CD GLU A 186 -23.604 -22.659 0.406 1.00 71.90 C ATOM 1665 OE1 GLU A 186 -24.594 -22.282 1.075 1.00 71.75 O ATOM 1666 OE2 GLU A 186 -22.670 -21.893 0.072 1.00 68.85 O ATOM 1667 H GLU A 186 -23.681 -26.752 1.186 1.00 0.00 H ATOM 1668 N GLY A 187 -22.927 -27.032 -2.012 1.00 28.52 N ATOM 1669 CA GLY A 187 -22.147 -27.108 -3.241 1.00 29.17 C ATOM 1670 C GLY A 187 -21.426 -25.785 -3.441 1.00 31.66 C ATOM 1671 O GLY A 187 -21.272 -25.038 -2.467 1.00 31.43 O ATOM 1672 H GLY A 187 -22.556 -27.481 -1.150 1.00 0.00 H ATOM 1673 N GLY A 188 -20.994 -25.504 -4.685 1.00 25.85 N ATOM 1674 CA GLY A 188 -20.287 -24.273 -5.067 1.00 23.48 C ATOM 1675 C GLY A 188 -18.825 -24.132 -4.653 1.00 21.75 C ATOM 1676 O GLY A 188 -18.135 -23.221 -5.117 1.00 17.78 O ATOM 1677 H GLY A 188 -21.173 -26.208 -5.429 1.00 0.00 H ATOM 1678 N ARG A 188A -18.304 -25.050 -3.835 1.00 18.58 N ATOM 1679 CA ARG A 188A -16.961 -25.037 -3.296 1.00 17.08 C ATOM 1680 C ARG A 188A -16.426 -26.457 -3.237 1.00 20.49 C ATOM 1681 O ARG A 188A -16.926 -27.260 -2.437 1.00 21.52 O ATOM 1682 CB ARG A 188A -16.977 -24.444 -1.900 1.00 18.67 C ATOM 1683 CG ARG A 188A -16.939 -22.925 -1.885 1.00 20.24 C ATOM 1684 CD ARG A 188A -16.921 -22.386 -0.462 1.00 21.33 C ATOM 1685 NE ARG A 188A -18.257 -22.437 0.132 1.00 21.30 N ATOM 1686 CZ ARG A 188A -18.543 -22.025 1.368 1.00 23.32 C ATOM 1687 NH1 ARG A 188A -17.587 -21.549 2.153 1.00 22.20 N ATOM 1688 NH2 ARG A 188A -19.791 -22.074 1.817 1.00 25.06 N ATOM 1689 HE ARG A 188A -19.033 -22.819 -0.446 1.00 0.00 H ATOM 1690 HH12 ARG A 188A -17.816 -21.229 3.116 1.00 0.00 H ATOM 1691 HH11 ARG A 188A -16.608 -21.495 1.806 1.00 0.00 H ATOM 1692 HH22 ARG A 188A -20.010 -21.752 2.781 1.00 0.00 H ATOM 1693 HH21 ARG A 188A -20.550 -22.435 1.205 1.00 0.00 H ATOM 1694 H ARG A 188A -18.917 -25.844 -3.561 1.00 0.00 H ATOM 1695 N ASP A 189 -15.431 -26.786 -4.041 1.00 15.78 N ATOM 1696 CA ASP A 189 -14.910 -28.144 -4.080 1.00 15.74 C ATOM 1697 C ASP A 189 -13.598 -28.190 -4.825 1.00 14.97 C ATOM 1698 O ASP A 189 -13.225 -27.256 -5.530 1.00 14.17 O ATOM 1699 CB ASP A 189 -15.927 -29.020 -4.857 1.00 17.87 C ATOM 1700 CG ASP A 189 -15.834 -30.523 -4.745 1.00 21.56 C ATOM 1701 OD1 ASP A 189 -15.077 -31.006 -3.873 1.00 21.06 O ATOM 1702 OD2 ASP A 189 -16.545 -31.212 -5.530 1.00 27.43 O ATOM 1703 H ASP A 189 -15.012 -26.061 -4.658 1.00 0.00 H ATOM 1704 N SER A 190 -12.926 -29.340 -4.731 1.00 14.85 N ATOM 1705 CA SER A 190 -11.817 -29.692 -5.622 1.00 14.88 C ATOM 1706 C SER A 190 -12.451 -30.063 -6.974 1.00 16.90 C ATOM 1707 O SER A 190 -13.671 -30.176 -7.127 1.00 17.33 O ATOM 1708 CB SER A 190 -11.065 -30.904 -5.083 1.00 17.27 C ATOM 1709 OG SER A 190 -12.005 -31.943 -4.870 1.00 22.35 O ATOM 1710 HG SER A 190 -11.538 -32.742 -4.519 1.00 0.00 H ATOM 1711 H SER A 190 -13.202 -30.017 -3.991 1.00 0.00 H ATOM 1712 N CYS A 191 -11.629 -30.156 -8.009 1.00 14.46 N ATOM 1713 CA CYS A 191 -12.118 -30.520 -9.327 1.00 14.73 C ATOM 1714 C CYS A 191 -11.025 -31.212 -10.132 1.00 16.44 C ATOM 1715 O CYS A 191 -9.899 -31.347 -9.666 1.00 15.66 O ATOM 1716 CB CYS A 191 -12.675 -29.287 -10.049 1.00 15.94 C ATOM 1717 SG CYS A 191 -13.819 -29.642 -11.444 1.00 19.91 S ATOM 1718 H CYS A 191 -10.616 -29.965 -7.875 1.00 0.00 H ATOM 1719 N GLN A 192 -11.374 -31.674 -11.307 1.00 16.70 N ATOM 1720 CA GLN A 192 -10.432 -32.321 -12.212 1.00 16.48 C ATOM 1721 C GLN A 192 -9.204 -31.421 -12.433 1.00 16.61 C ATOM 1722 O GLN A 192 -9.326 -30.219 -12.661 1.00 16.65 O ATOM 1723 CB GLN A 192 -11.138 -32.615 -13.532 1.00 18.46 C ATOM 1724 CG GLN A 192 -10.323 -33.474 -14.501 1.00 20.10 C ATOM 1725 CD GLN A 192 -11.111 -33.765 -15.738 1.00 26.36 C ATOM 1726 OE1 GLN A 192 -11.775 -32.891 -16.294 1.00 24.94 O ATOM 1727 NE2 GLN A 192 -11.023 -34.992 -16.244 1.00 39.16 N ATOM 1728 HE22 GLN A 192 -10.456 -35.716 -15.758 1.00 0.00 H ATOM 1729 HE21 GLN A 192 -11.521 -35.228 -17.126 1.00 0.00 H ATOM 1730 H GLN A 192 -12.365 -31.575 -11.607 1.00 0.00 H ATOM 1731 N GLY A 193 -8.030 -32.010 -12.304 1.00 15.22 N ATOM 1732 CA GLY A 193 -6.754 -31.317 -12.386 1.00 14.20 C ATOM 1733 C GLY A 193 -6.157 -31.094 -11.001 1.00 14.85 C ATOM 1734 O GLY A 193 -4.960 -30.829 -10.864 1.00 15.93 O ATOM 1735 H GLY A 193 -8.016 -33.036 -12.133 1.00 0.00 H ATOM 1736 N ASP A 194 -6.993 -31.110 -9.927 1.00 14.10 N ATOM 1737 CA ASP A 194 -6.497 -30.970 -8.561 1.00 11.72 C ATOM 1738 C ASP A 194 -6.049 -32.279 -7.972 1.00 13.91 C ATOM 1739 O ASP A 194 -5.323 -32.256 -6.964 1.00 12.61 O ATOM 1740 CB ASP A 194 -7.563 -30.366 -7.648 1.00 13.59 C ATOM 1741 CG ASP A 194 -7.957 -28.954 -7.995 1.00 14.07 C ATOM 1742 OD1 ASP A 194 -7.063 -28.156 -8.333 1.00 12.76 O ATOM 1743 OD2 ASP A 194 -9.181 -28.663 -7.929 1.00 13.83 O ATOM 1744 H ASP A 194 -8.015 -31.225 -10.084 1.00 0.00 H ATOM 1745 N SER A 195 -6.485 -33.431 -8.522 1.00 14.06 N ATOM 1746 CA SER A 195 -6.099 -34.715 -7.962 1.00 13.23 C ATOM 1747 C SER A 195 -4.619 -34.839 -7.736 1.00 13.48 C ATOM 1748 O SER A 195 -3.820 -34.358 -8.537 1.00 13.75 O ATOM 1749 CB SER A 195 -6.504 -35.869 -8.865 1.00 18.67 C ATOM 1750 OG SER A 195 -7.893 -35.877 -9.114 1.00 20.98 O ATOM 1751 HG SER A 195 -8.380 -35.966 -8.257 1.00 0.00 H ATOM 1752 H SER A 195 -7.105 -33.400 -9.357 1.00 0.00 H ATOM 1753 N GLY A 196 -4.262 -35.488 -6.633 1.00 12.69 N ATOM 1754 CA GLY A 196 -2.871 -35.674 -6.263 1.00 13.09 C ATOM 1755 C GLY A 196 -2.324 -34.600 -5.375 1.00 13.21 C ATOM 1756 O GLY A 196 -1.322 -34.790 -4.716 1.00 13.31 O ATOM 1757 H GLY A 196 -5.003 -35.875 -6.015 1.00 0.00 H ATOM 1758 N GLY A 197 -2.978 -33.432 -5.356 1.00 12.20 N ATOM 1759 CA GLY A 197 -2.549 -32.342 -4.520 1.00 10.76 C ATOM 1760 C GLY A 197 -2.871 -32.563 -3.066 1.00 12.45 C ATOM 1761 O GLY A 197 -3.479 -33.573 -2.671 1.00 12.26 O ATOM 1762 H GLY A 197 -3.816 -33.309 -5.960 1.00 0.00 H ATOM 1763 N PRO A 198 -2.490 -31.560 -2.265 1.00 11.37 N ATOM 1764 CA PRO A 198 -2.612 -31.671 -0.815 1.00 11.62 C ATOM 1765 C PRO A 198 -3.957 -31.291 -0.215 1.00 12.71 C ATOM 1766 O PRO A 198 -4.575 -30.315 -0.646 1.00 12.62 O ATOM 1767 CB PRO A 198 -1.597 -30.603 -0.348 1.00 13.77 C ATOM 1768 CG PRO A 198 -1.544 -29.595 -1.417 1.00 15.35 C ATOM 1769 CD PRO A 198 -1.751 -30.350 -2.678 1.00 12.46 C ATOM 1770 N HIS A 199 -4.346 -32.019 0.854 1.00 11.91 N ATOM 1771 CA HIS A 199 -5.313 -31.601 1.851 1.00 11.28 C ATOM 1772 C HIS A 199 -4.471 -31.451 3.121 1.00 10.72 C ATOM 1773 O HIS A 199 -3.836 -32.415 3.549 1.00 11.15 O ATOM 1774 CB HIS A 199 -6.430 -32.606 2.011 1.00 11.01 C ATOM 1775 CG HIS A 199 -7.371 -32.337 3.132 1.00 12.28 C ATOM 1776 ND1 HIS A 199 -7.034 -32.564 4.445 1.00 12.25 N ATOM 1777 CD2 HIS A 199 -8.654 -31.920 3.082 1.00 12.36 C ATOM 1778 CE1 HIS A 199 -8.113 -32.287 5.150 1.00 12.84 C ATOM 1779 NE2 HIS A 199 -9.117 -31.907 4.360 1.00 13.21 N ATOM 1780 H HIS A 199 -3.916 -32.958 0.972 1.00 0.00 H ATOM 1781 N VAL A 200 -4.375 -30.230 3.652 1.00 10.73 N ATOM 1782 CA VAL A 200 -3.507 -29.959 4.804 1.00 10.84 C ATOM 1783 C VAL A 200 -4.287 -29.350 5.942 1.00 12.20 C ATOM 1784 O VAL A 200 -5.272 -28.645 5.727 1.00 11.89 O ATOM 1785 CB VAL A 200 -2.297 -29.046 4.419 1.00 13.71 C ATOM 1786 CG1 VAL A 200 -1.484 -29.635 3.276 1.00 12.73 C ATOM 1787 CG2 VAL A 200 -2.694 -27.593 4.173 1.00 15.38 C ATOM 1788 H VAL A 200 -4.929 -29.452 3.239 1.00 0.00 H ATOM 1789 N THR A 201 -3.829 -29.634 7.147 1.00 10.65 N ATOM 1790 CA THR A 201 -4.428 -29.101 8.354 1.00 10.88 C ATOM 1791 C THR A 201 -3.366 -28.234 9.046 1.00 11.48 C ATOM 1792 O THR A 201 -2.242 -28.691 9.279 1.00 12.01 O ATOM 1793 CB THR A 201 -4.903 -30.234 9.263 1.00 11.46 C ATOM 1794 OG1 THR A 201 -5.916 -30.969 8.564 1.00 12.16 O ATOM 1795 CG2 THR A 201 -5.493 -29.747 10.554 1.00 12.59 C ATOM 1796 HG1 THR A 201 -5.536 -31.338 7.727 1.00 0.00 H ATOM 1797 H THR A 201 -3.007 -30.265 7.233 1.00 0.00 H ATOM 1798 N GLU A 202 -3.734 -26.998 9.360 1.00 12.63 N ATOM 1799 CA GLU A 202 -2.850 -26.046 10.023 1.00 13.72 C ATOM 1800 C GLU A 202 -2.915 -26.258 11.528 1.00 16.22 C ATOM 1801 O GLU A 202 -3.990 -26.186 12.149 1.00 18.99 O ATOM 1802 CB GLU A 202 -3.235 -24.607 9.700 1.00 17.26 C ATOM 1803 CG GLU A 202 -3.300 -24.299 8.239 1.00 26.14 C ATOM 1804 CD GLU A 202 -3.586 -22.850 7.901 1.00 49.36 C ATOM 1805 OE1 GLU A 202 -4.067 -22.120 8.798 1.00 44.92 O ATOM 1806 OE2 GLU A 202 -3.388 -22.464 6.723 1.00 35.82 O ATOM 1807 H GLU A 202 -4.699 -26.694 9.122 1.00 0.00 H ATOM 1808 N VAL A 203 -1.764 -26.481 12.153 1.00 12.47 N ATOM 1809 CA VAL A 203 -1.639 -26.775 13.577 1.00 14.80 C ATOM 1810 C VAL A 203 -0.739 -25.705 14.134 1.00 16.21 C ATOM 1811 O VAL A 203 0.485 -25.740 13.983 1.00 15.49 O ATOM 1812 CB VAL A 203 -1.041 -28.187 13.779 1.00 15.99 C ATOM 1813 CG1 VAL A 203 -0.869 -28.544 15.271 1.00 17.22 C ATOM 1814 CG2 VAL A 203 -1.872 -29.254 13.035 1.00 16.14 C ATOM 1815 H VAL A 203 -0.892 -26.443 11.588 1.00 0.00 H ATOM 1816 N GLU A 204 -1.332 -24.724 14.806 1.00 18.37 N ATOM 1817 CA GLU A 204 -0.563 -23.623 15.397 1.00 18.11 C ATOM 1818 C GLU A 204 0.472 -23.022 14.421 1.00 19.95 C ATOM 1819 O GLU A 204 1.639 -22.846 14.757 1.00 21.82 O ATOM 1820 CB GLU A 204 0.069 -24.059 16.737 1.00 19.17 C ATOM 1821 CG GLU A 204 -0.955 -24.506 17.759 1.00 22.85 C ATOM 1822 CD GLU A 204 -1.926 -23.415 18.158 1.00 48.80 C ATOM 1823 OE1 GLU A 204 -1.462 -22.297 18.476 1.00 47.71 O ATOM 1824 OE2 GLU A 204 -3.152 -23.660 18.099 1.00 51.50 O ATOM 1825 H GLU A 204 -2.366 -24.737 14.916 1.00 0.00 H ATOM 1826 N GLY A 205 0.059 -22.786 13.177 1.00 18.39 N ATOM 1827 CA GLY A 205 0.927 -22.170 12.176 1.00 18.80 C ATOM 1828 C GLY A 205 1.847 -23.093 11.382 1.00 22.09 C ATOM 1829 O GLY A 205 2.680 -22.619 10.588 1.00 24.72 O ATOM 1830 H GLY A 205 -0.911 -23.048 12.910 1.00 0.00 H ATOM 1831 N THR A 206 1.729 -24.414 11.586 1.00 14.81 N ATOM 1832 CA THR A 206 2.491 -25.394 10.843 1.00 13.36 C ATOM 1833 C THR A 206 1.505 -26.303 10.141 1.00 12.60 C ATOM 1834 O THR A 206 0.627 -26.895 10.807 1.00 13.24 O ATOM 1835 CB THR A 206 3.407 -26.207 11.752 1.00 13.88 C ATOM 1836 OG1 THR A 206 4.245 -25.288 12.471 1.00 15.66 O ATOM 1837 CG2 THR A 206 4.231 -27.193 11.002 1.00 15.07 C ATOM 1838 HG1 THR A 206 4.781 -24.760 11.828 1.00 0.00 H ATOM 1839 H THR A 206 1.061 -24.748 12.310 1.00 0.00 H ATOM 1840 N SER A 207 1.638 -26.447 8.832 1.00 11.88 N ATOM 1841 CA SER A 207 0.739 -27.300 8.068 1.00 10.45 C ATOM 1842 C SER A 207 1.222 -28.723 7.981 1.00 10.93 C ATOM 1843 O SER A 207 2.416 -28.993 7.738 1.00 11.96 O ATOM 1844 CB SER A 207 0.525 -26.731 6.677 1.00 11.96 C ATOM 1845 OG SER A 207 -0.259 -25.538 6.750 1.00 12.98 O ATOM 1846 HG SER A 207 0.212 -24.868 7.307 1.00 0.00 H ATOM 1847 H SER A 207 2.401 -25.940 8.339 1.00 0.00 H ATOM 1848 N PHE A 208 0.280 -29.672 8.172 1.00 11.48 N ATOM 1849 CA PHE A 208 0.516 -31.081 8.117 1.00 9.59 C ATOM 1850 C PHE A 208 -0.343 -31.727 7.044 1.00 11.40 C ATOM 1851 O PHE A 208 -1.530 -31.361 6.903 1.00 11.60 O ATOM 1852 CB PHE A 208 0.171 -31.722 9.475 1.00 10.87 C ATOM 1853 CG PHE A 208 1.225 -31.476 10.527 1.00 10.84 C ATOM 1854 CD1 PHE A 208 1.228 -30.313 11.269 1.00 11.74 C ATOM 1855 CD2 PHE A 208 2.269 -32.368 10.706 1.00 12.47 C ATOM 1856 CE1 PHE A 208 2.234 -30.084 12.232 1.00 12.23 C ATOM 1857 CE2 PHE A 208 3.227 -32.170 11.697 1.00 13.92 C ATOM 1858 CZ PHE A 208 3.224 -31.012 12.415 1.00 12.40 C ATOM 1859 H PHE A 208 -0.689 -29.354 8.374 1.00 0.00 H ATOM 1860 N LEU A 209 0.201 -32.674 6.336 1.00 11.24 N ATOM 1861 CA LEU A 209 -0.567 -33.364 5.281 1.00 11.26 C ATOM 1862 C LEU A 209 -1.538 -34.373 5.920 1.00 12.27 C ATOM 1863 O LEU A 209 -1.150 -35.284 6.656 1.00 13.25 O ATOM 1864 CB LEU A 209 0.412 -34.090 4.375 1.00 11.60 C ATOM 1865 CG LEU A 209 -0.155 -34.686 3.100 1.00 13.39 C ATOM 1866 CD1 LEU A 209 -0.658 -33.646 2.137 1.00 14.48 C ATOM 1867 CD2 LEU A 209 0.881 -35.615 2.448 1.00 14.70 C ATOM 1868 H LEU A 209 1.188 -32.948 6.516 1.00 0.00 H ATOM 1869 N THR A 210 -2.830 -34.142 5.641 1.00 10.83 N ATOM 1870 CA THR A 210 -3.897 -34.964 6.181 1.00 10.93 C ATOM 1871 C THR A 210 -4.599 -35.759 5.075 1.00 12.52 C ATOM 1872 O THR A 210 -5.245 -36.776 5.401 1.00 13.21 O ATOM 1873 CB THR A 210 -4.856 -34.158 7.051 1.00 11.79 C ATOM 1874 OG1 THR A 210 -5.134 -32.876 6.495 1.00 11.87 O ATOM 1875 CG2 THR A 210 -4.282 -33.945 8.434 1.00 12.08 C ATOM 1876 HG1 THR A 210 -5.546 -32.987 5.602 1.00 0.00 H ATOM 1877 H THR A 210 -3.075 -33.347 5.017 1.00 0.00 H ATOM 1878 N GLY A 211 -4.526 -35.326 3.831 1.00 12.25 N ATOM 1879 CA GLY A 211 -5.160 -36.085 2.769 1.00 12.56 C ATOM 1880 C GLY A 211 -4.515 -35.844 1.444 1.00 12.83 C ATOM 1881 O GLY A 211 -3.748 -34.890 1.268 1.00 12.50 O ATOM 1882 H GLY A 211 -4.017 -34.446 3.613 1.00 0.00 H ATOM 1883 N ILE A 212 -4.843 -36.720 0.491 1.00 12.79 N ATOM 1884 CA ILE A 212 -4.468 -36.529 -0.900 1.00 12.23 C ATOM 1885 C ILE A 212 -5.793 -36.286 -1.637 1.00 14.04 C ATOM 1886 O ILE A 212 -6.728 -37.081 -1.532 1.00 14.53 O ATOM 1887 CB ILE A 212 -3.772 -37.761 -1.534 1.00 13.95 C ATOM 1888 CG1 ILE A 212 -2.598 -38.277 -0.704 1.00 15.75 C ATOM 1889 CG2 ILE A 212 -3.306 -37.459 -2.964 1.00 12.81 C ATOM 1890 CD1 ILE A 212 -1.489 -37.265 -0.437 1.00 14.96 C ATOM 1891 H ILE A 212 -5.385 -37.568 0.753 1.00 0.00 H ATOM 1892 N ILE A 213 -5.863 -35.236 -2.439 1.00 12.79 N ATOM 1893 CA ILE A 213 -7.045 -34.971 -3.271 1.00 13.14 C ATOM 1894 C ILE A 213 -7.165 -36.157 -4.245 1.00 15.50 C ATOM 1895 O ILE A 213 -6.195 -36.522 -4.910 1.00 14.84 O ATOM 1896 CB ILE A 213 -6.859 -33.657 -4.014 1.00 14.05 C ATOM 1897 CG1 ILE A 213 -6.654 -32.461 -3.072 1.00 13.45 C ATOM 1898 CG2 ILE A 213 -8.084 -33.361 -4.927 1.00 14.50 C ATOM 1899 CD1 ILE A 213 -6.263 -31.166 -3.722 1.00 12.90 C ATOM 1900 H ILE A 213 -5.058 -34.579 -2.482 1.00 0.00 H ATOM 1901 N SER A 214 -8.344 -36.793 -4.284 1.00 15.54 N ATOM 1902 CA SER A 214 -8.463 -38.022 -5.094 1.00 16.22 C ATOM 1903 C SER A 214 -9.464 -37.839 -6.192 1.00 19.17 C ATOM 1904 O SER A 214 -9.074 -37.698 -7.372 1.00 19.78 O ATOM 1905 CB SER A 214 -8.792 -39.227 -4.210 1.00 18.53 C ATOM 1906 OG SER A 214 -8.715 -40.442 -4.941 1.00 22.26 O ATOM 1907 HG SER A 214 -7.798 -40.554 -5.297 1.00 0.00 H ATOM 1908 H SER A 214 -9.160 -36.428 -3.753 1.00 0.00 H ATOM 1909 N TRP A 215 -10.757 -37.781 -5.867 1.00 19.05 N ATOM 1910 CA TRP A 215 -11.770 -37.748 -6.925 1.00 19.85 C ATOM 1911 C TRP A 215 -13.076 -37.175 -6.471 1.00 23.40 C ATOM 1912 O TRP A 215 -13.228 -36.755 -5.338 1.00 23.27 O ATOM 1913 CB TRP A 215 -11.995 -39.205 -7.459 1.00 19.66 C ATOM 1914 CG TRP A 215 -12.567 -40.169 -6.460 1.00 19.74 C ATOM 1915 CD1 TRP A 215 -11.870 -40.895 -5.546 1.00 21.81 C ATOM 1916 CD2 TRP A 215 -13.947 -40.556 -6.303 1.00 21.00 C ATOM 1917 NE1 TRP A 215 -12.714 -41.718 -4.849 1.00 22.95 N ATOM 1918 CE2 TRP A 215 -13.997 -41.505 -5.265 1.00 24.02 C ATOM 1919 CE3 TRP A 215 -15.139 -40.196 -6.943 1.00 23.12 C ATOM 1920 CZ2 TRP A 215 -15.191 -42.117 -4.866 1.00 24.65 C ATOM 1921 CZ3 TRP A 215 -16.320 -40.787 -6.533 1.00 24.95 C ATOM 1922 CH2 TRP A 215 -16.338 -41.727 -5.503 1.00 25.50 C ATOM 1923 HE1 TRP A 215 -12.423 -42.398 -4.118 1.00 0.00 H ATOM 1924 H TRP A 215 -11.044 -37.759 -4.868 1.00 0.00 H ATOM 1925 N GLY A 216 -13.977 -37.054 -7.422 1.00 22.72 N ATOM 1926 CA GLY A 216 -15.363 -36.662 -7.210 1.00 23.76 C ATOM 1927 C GLY A 216 -16.127 -36.943 -8.497 1.00 30.72 C ATOM 1928 O GLY A 216 -15.507 -37.345 -9.483 1.00 28.27 O ATOM 1929 H GLY A 216 -13.677 -37.253 -8.398 1.00 0.00 H ATOM 1930 N GLU A 217 -17.458 -36.755 -8.505 1.00 33.28 N ATOM 1931 CA GLU A 217 -18.317 -37.052 -9.681 1.00 35.34 C ATOM 1932 C GLU A 217 -18.731 -35.853 -10.529 1.00 38.75 C ATOM 1933 O GLU A 217 -18.794 -35.985 -11.752 1.00 39.49 O ATOM 1934 CB GLU A 217 -19.565 -37.803 -9.237 1.00 38.01 C ATOM 1935 CG GLU A 217 -19.337 -39.295 -9.118 1.00 44.80 C ATOM 1936 CD GLU A 217 -20.332 -39.964 -8.202 1.00 61.30 C ATOM 1937 OE1 GLU A 217 -20.238 -39.739 -6.976 1.00 46.30 O ATOM 1938 OE2 GLU A 217 -21.259 -40.633 -8.708 1.00 54.70 O ATOM 1939 H GLU A 217 -17.909 -36.383 -7.645 1.00 0.00 H ATOM 1940 N GLU A 219 -19.112 -34.739 -9.897 1.00 31.09 N ATOM 1941 CA GLU A 219 -19.523 -33.492 -10.550 1.00 30.16 C ATOM 1942 C GLU A 219 -19.025 -32.383 -9.628 1.00 31.05 C ATOM 1943 O GLU A 219 -19.455 -32.331 -8.475 1.00 33.00 O ATOM 1944 CB GLU A 219 -21.045 -33.432 -10.702 1.00 33.20 C ATOM 1945 CG GLU A 219 -21.501 -32.358 -11.667 1.00 46.86 C ATOM 1946 CD GLU A 219 -22.905 -32.470 -12.225 1.00 76.17 C ATOM 1947 OE1 GLU A 219 -23.509 -33.562 -12.127 1.00 70.82 O ATOM 1948 OE2 GLU A 219 -23.362 -31.486 -12.850 1.00 79.97 O ATOM 1949 H GLU A 219 -19.117 -34.758 -8.857 1.00 0.00 H ATOM 1950 N CYS A 220 -18.050 -31.571 -10.069 1.00 24.54 N ATOM 1951 CA CYS A 220 -17.418 -30.630 -9.146 1.00 21.62 C ATOM 1952 C CYS A 220 -18.360 -29.640 -8.600 1.00 24.47 C ATOM 1953 O CYS A 220 -19.052 -28.974 -9.371 1.00 25.70 O ATOM 1954 CB CYS A 220 -16.254 -29.908 -9.812 1.00 21.11 C ATOM 1955 SG CYS A 220 -15.134 -30.999 -10.696 1.00 22.17 S ATOM 1956 H CYS A 220 -17.746 -31.612 -11.063 1.00 0.00 H ATOM 1957 N ALA A 221 -18.384 -29.522 -7.272 1.00 20.73 N ATOM 1958 CA ALA A 221 -19.133 -28.489 -6.579 1.00 20.95 C ATOM 1959 C ALA A 221 -20.640 -28.539 -6.785 1.00 24.57 C ATOM 1960 O ALA A 221 -21.321 -27.547 -6.527 1.00 25.27 O ATOM 1961 CB ALA A 221 -18.570 -27.112 -6.951 1.00 22.11 C ATOM 1962 H ALA A 221 -17.840 -30.203 -6.705 1.00 0.00 H ATOM 1963 N MET A 221A -21.186 -29.695 -7.198 1.00 24.13 N ATOM 1964 CA MET A 221A -22.630 -29.828 -7.353 1.00 26.15 C ATOM 1965 C MET A 221A -23.232 -30.031 -5.965 1.00 27.37 C ATOM 1966 O MET A 221A -22.685 -30.778 -5.146 1.00 25.03 O ATOM 1967 CB MET A 221A -22.972 -31.014 -8.265 1.00 30.21 C ATOM 1968 CG MET A 221A -24.462 -31.158 -8.540 1.00 36.54 C ATOM 1969 SD MET A 221A -24.895 -32.734 -9.303 1.00 42.69 S ATOM 1970 CE MET A 221A -26.616 -32.429 -9.696 1.00 41.15 C ATOM 1971 H MET A 221A -20.571 -30.506 -7.410 1.00 0.00 H ATOM 1972 N LYS A 222 -24.360 -29.351 -5.699 1.00 26.14 N ATOM 1973 CA LYS A 222 -25.075 -29.462 -4.430 1.00 27.59 C ATOM 1974 C LYS A 222 -25.442 -30.949 -4.217 1.00 31.77 C ATOM 1975 O LYS A 222 -25.942 -31.598 -5.144 1.00 32.43 O ATOM 1976 CB LYS A 222 -26.362 -28.598 -4.445 1.00 32.32 C ATOM 1977 CG LYS A 222 -27.128 -28.630 -3.122 1.00 51.46 C ATOM 1978 CD LYS A 222 -28.279 -27.643 -3.069 1.00 70.81 C ATOM 1979 CE LYS A 222 -29.094 -27.843 -1.812 1.00 94.06 C ATOM 1980 NZ LYS A 222 -30.014 -26.707 -1.550 1.00110.75 N ATOM 1981 HZ1 LYS A 222 -29.461 -25.833 -1.440 1.00 0.00 H ATOM 1982 HZ2 LYS A 222 -30.672 -26.604 -2.349 1.00 0.00 H ATOM 1983 HZ3 LYS A 222 -30.550 -26.891 -0.678 1.00 0.00 H ATOM 1984 H LYS A 222 -24.741 -28.717 -6.430 1.00 0.00 H ATOM 1985 N GLY A 223 -25.085 -31.463 -3.056 1.00 29.43 N ATOM 1986 CA GLY A 223 -25.330 -32.847 -2.674 1.00 30.70 C ATOM 1987 C GLY A 223 -24.209 -33.815 -2.988 1.00 34.35 C ATOM 1988 O GLY A 223 -24.367 -35.013 -2.742 1.00 35.04 O ATOM 1989 H GLY A 223 -24.601 -30.845 -2.374 1.00 0.00 H ATOM 1990 N LYS A 224 -23.099 -33.327 -3.569 1.00 28.78 N ATOM 1991 CA LYS A 224 -21.918 -34.123 -3.905 1.00 27.54 C ATOM 1992 C LYS A 224 -20.746 -33.555 -3.100 1.00 27.49 C ATOM 1993 O LYS A 224 -20.773 -32.382 -2.695 1.00 26.06 O ATOM 1994 CB LYS A 224 -21.597 -34.025 -5.404 1.00 31.16 C ATOM 1995 CG LYS A 224 -22.773 -34.364 -6.329 1.00 41.08 C ATOM 1996 CD LYS A 224 -23.341 -35.762 -6.141 1.00 50.97 C ATOM 1997 CE LYS A 224 -22.378 -36.855 -6.511 1.00 62.92 C ATOM 1998 NZ LYS A 224 -23.078 -38.155 -6.657 1.00 74.77 N ATOM 1999 HZ1 LYS A 224 -23.536 -38.404 -5.757 1.00 0.00 H ATOM 2000 HZ2 LYS A 224 -23.798 -38.078 -7.404 1.00 0.00 H ATOM 2001 HZ3 LYS A 224 -22.389 -38.891 -6.913 1.00 0.00 H ATOM 2002 H LYS A 224 -23.078 -32.312 -3.796 1.00 0.00 H ATOM 2003 N TYR A 225 -19.725 -34.396 -2.841 1.00 24.16 N ATOM 2004 CA TYR A 225 -18.543 -34.001 -2.077 1.00 21.68 C ATOM 2005 C TYR A 225 -17.310 -34.487 -2.743 1.00 23.11 C ATOM 2006 O TYR A 225 -17.347 -35.489 -3.457 1.00 23.59 O ATOM 2007 CB TYR A 225 -18.575 -34.634 -0.684 1.00 22.17 C ATOM 2008 CG TYR A 225 -19.786 -34.228 0.105 1.00 24.38 C ATOM 2009 CD1 TYR A 225 -19.831 -33.006 0.764 1.00 25.64 C ATOM 2010 CD2 TYR A 225 -20.910 -35.040 0.155 1.00 26.76 C ATOM 2011 CE1 TYR A 225 -20.970 -32.599 1.450 1.00 25.31 C ATOM 2012 CE2 TYR A 225 -22.051 -34.651 0.844 1.00 28.36 C ATOM 2013 CZ TYR A 225 -22.088 -33.418 1.466 1.00 35.35 C ATOM 2014 OH TYR A 225 -23.247 -33.059 2.089 1.00 36.98 O ATOM 2015 HH TYR A 225 -23.140 -32.160 2.491 1.00 0.00 H ATOM 2016 H TYR A 225 -19.781 -35.370 -3.201 1.00 0.00 H ATOM 2017 N GLY A 226 -16.199 -33.828 -2.442 1.00 20.74 N ATOM 2018 CA GLY A 226 -14.894 -34.275 -2.868 1.00 19.50 C ATOM 2019 C GLY A 226 -14.476 -35.455 -2.004 1.00 20.45 C ATOM 2020 O GLY A 226 -14.755 -35.506 -0.797 1.00 20.18 O ATOM 2021 H GLY A 226 -16.271 -32.957 -1.878 1.00 0.00 H ATOM 2022 N ILE A 227 -13.797 -36.421 -2.631 1.00 18.20 N ATOM 2023 CA ILE A 227 -13.326 -37.625 -1.972 1.00 16.95 C ATOM 2024 C ILE A 227 -11.822 -37.579 -1.922 1.00 18.52 C ATOM 2025 O ILE A 227 -11.160 -37.182 -2.884 1.00 18.50 O ATOM 2026 CB ILE A 227 -13.835 -38.900 -2.684 1.00 20.24 C ATOM 2027 CG1 ILE A 227 -15.327 -38.780 -3.072 1.00 22.41 C ATOM 2028 CG2 ILE A 227 -13.587 -40.138 -1.838 1.00 20.78 C ATOM 2029 CD1 ILE A 227 -16.287 -38.638 -1.953 1.00 25.52 C ATOM 2030 H ILE A 227 -13.596 -36.303 -3.645 1.00 0.00 H ATOM 2031 N TYR A 228 -11.277 -37.897 -0.743 1.00 16.47 N ATOM 2032 CA TYR A 228 -9.876 -37.759 -0.446 1.00 15.76 C ATOM 2033 C TYR A 228 -9.302 -39.032 0.126 1.00 16.12 C ATOM 2034 O TYR A 228 -10.006 -39.745 0.857 1.00 18.34 O ATOM 2035 CB TYR A 228 -9.720 -36.628 0.606 1.00 15.67 C ATOM 2036 CG TYR A 228 -10.172 -35.274 0.128 1.00 14.71 C ATOM 2037 CD1 TYR A 228 -11.521 -34.925 0.118 1.00 14.59 C ATOM 2038 CD2 TYR A 228 -9.259 -34.348 -0.348 1.00 16.25 C ATOM 2039 CE1 TYR A 228 -11.949 -33.689 -0.366 1.00 16.16 C ATOM 2040 CE2 TYR A 228 -9.674 -33.121 -0.851 1.00 16.81 C ATOM 2041 CZ TYR A 228 -11.017 -32.806 -0.895 1.00 16.47 C ATOM 2042 OH TYR A 228 -11.447 -31.583 -1.383 1.00 18.60 O ATOM 2043 HH TYR A 228 -12.435 -31.539 -1.336 1.00 0.00 H ATOM 2044 H TYR A 228 -11.902 -38.265 0.002 1.00 0.00 H ATOM 2045 N THR A 229 -8.010 -39.266 -0.097 1.00 15.45 N ATOM 2046 CA THR A 229 -7.318 -40.384 0.532 1.00 15.61 C ATOM 2047 C THR A 229 -6.822 -39.969 1.922 1.00 16.08 C ATOM 2048 O THR A 229 -6.154 -38.924 2.032 1.00 14.93 O ATOM 2049 CB THR A 229 -6.151 -40.805 -0.291 1.00 17.17 C ATOM 2050 OG1 THR A 229 -6.649 -41.217 -1.581 1.00 20.10 O ATOM 2051 CG2 THR A 229 -5.377 -41.940 0.317 1.00 17.89 C ATOM 2052 HG1 THR A 229 -7.279 -41.972 -1.465 1.00 0.00 H ATOM 2053 H THR A 229 -7.483 -38.636 -0.735 1.00 0.00 H ATOM 2054 N LYS A 230 -7.104 -40.769 2.964 1.00 16.33 N ATOM 2055 CA LYS A 230 -6.570 -40.496 4.304 1.00 14.93 C ATOM 2056 C LYS A 230 -5.090 -40.803 4.325 1.00 17.76 C ATOM 2057 O LYS A 230 -4.694 -41.950 4.229 1.00 19.66 O ATOM 2058 CB LYS A 230 -7.207 -41.397 5.381 1.00 19.47 C ATOM 2059 CG LYS A 230 -8.546 -40.985 5.879 1.00 21.40 C ATOM 2060 CD LYS A 230 -9.094 -41.957 6.933 1.00 19.69 C ATOM 2061 CE LYS A 230 -10.527 -41.606 7.146 1.00 22.08 C ATOM 2062 NZ LYS A 230 -11.151 -42.538 8.122 1.00 25.99 N ATOM 2063 HZ1 LYS A 230 -11.091 -43.510 7.758 1.00 0.00 H ATOM 2064 HZ2 LYS A 230 -10.648 -42.475 9.030 1.00 0.00 H ATOM 2065 HZ3 LYS A 230 -12.149 -42.279 8.258 1.00 0.00 H ATOM 2066 H LYS A 230 -7.713 -41.599 2.818 1.00 0.00 H ATOM 2067 N VAL A 231 -4.280 -39.799 4.548 1.00 14.04 N ATOM 2068 CA VAL A 231 -2.821 -39.972 4.601 1.00 14.05 C ATOM 2069 C VAL A 231 -2.381 -40.773 5.818 1.00 16.43 C ATOM 2070 O VAL A 231 -1.374 -41.460 5.719 1.00 15.71 O ATOM 2071 CB VAL A 231 -2.117 -38.582 4.529 1.00 15.89 C ATOM 2072 CG1 VAL A 231 -0.634 -38.623 4.946 1.00 16.10 C ATOM 2073 CG2 VAL A 231 -2.256 -38.027 3.117 1.00 16.32 C ATOM 2074 H VAL A 231 -4.681 -38.850 4.692 1.00 0.00 H ATOM 2075 N SER A 232 -3.117 -40.724 6.945 1.00 15.47 N ATOM 2076 CA SER A 232 -2.683 -41.402 8.150 1.00 15.82 C ATOM 2077 C SER A 232 -2.316 -42.871 7.910 1.00 20.31 C ATOM 2078 O SER A 232 -1.325 -43.362 8.436 1.00 19.13 O ATOM 2079 CB SER A 232 -3.736 -41.287 9.238 1.00 17.23 C ATOM 2080 OG SER A 232 -4.944 -41.947 8.890 1.00 21.71 O ATOM 2081 HG SER A 232 -5.598 -41.846 9.626 1.00 0.00 H ATOM 2082 H SER A 232 -4.010 -40.192 6.950 1.00 0.00 H ATOM 2083 N ARG A 233 -3.076 -43.544 7.045 1.00 19.24 N ATOM 2084 CA ARG A 233 -2.841 -44.962 6.736 1.00 22.17 C ATOM 2085 C ARG A 233 -1.495 -45.244 6.034 1.00 24.82 C ATOM 2086 O ARG A 233 -1.049 -46.402 6.012 1.00 24.68 O ATOM 2087 CB ARG A 233 -3.953 -45.442 5.779 1.00 23.68 C ATOM 2088 CG ARG A 233 -5.384 -45.417 6.322 1.00 39.14 C ATOM 2089 CD ARG A 233 -5.590 -46.317 7.524 1.00 56.75 C ATOM 2090 NE ARG A 233 -7.003 -46.667 7.694 1.00 73.63 N ATOM 2091 CZ ARG A 233 -7.664 -47.588 6.991 1.00 92.52 C ATOM 2092 NH1 ARG A 233 -7.047 -48.283 6.037 1.00 80.34 N ATOM 2093 NH2 ARG A 233 -8.950 -47.817 7.230 1.00 83.50 N ATOM 2094 HE ARG A 233 -7.536 -46.154 8.425 1.00 0.00 H ATOM 2095 HH12 ARG A 233 -7.571 -48.999 5.494 1.00 0.00 H ATOM 2096 HH11 ARG A 233 -6.042 -48.110 5.835 1.00 0.00 H ATOM 2097 HH22 ARG A 233 -9.461 -48.536 6.679 1.00 0.00 H ATOM 2098 HH21 ARG A 233 -9.446 -47.277 7.968 1.00 0.00 H ATOM 2099 H ARG A 233 -3.860 -43.050 6.574 1.00 0.00 H ATOM 2100 N TYR A 234 -0.916 -44.224 5.398 1.00 18.17 N ATOM 2101 CA TYR A 234 0.292 -44.333 4.581 1.00 16.96 C ATOM 2102 C TYR A 234 1.510 -43.629 5.069 1.00 19.69 C ATOM 2103 O TYR A 234 2.533 -43.712 4.424 1.00 19.01 O ATOM 2104 CB TYR A 234 -0.065 -43.780 3.199 1.00 17.91 C ATOM 2105 CG TYR A 234 -1.278 -44.485 2.652 1.00 16.86 C ATOM 2106 CD1 TYR A 234 -1.192 -45.787 2.186 1.00 19.88 C ATOM 2107 CD2 TYR A 234 -2.512 -43.857 2.612 1.00 18.58 C ATOM 2108 CE1 TYR A 234 -2.324 -46.474 1.758 1.00 20.81 C ATOM 2109 CE2 TYR A 234 -3.650 -44.528 2.187 1.00 19.30 C ATOM 2110 CZ TYR A 234 -3.541 -45.819 1.707 1.00 23.55 C ATOM 2111 OH TYR A 234 -4.686 -46.463 1.316 1.00 22.89 O ATOM 2112 HH TYR A 234 -4.459 -47.372 0.997 1.00 0.00 H ATOM 2113 H TYR A 234 -1.355 -43.285 5.490 1.00 0.00 H ATOM 2114 N VAL A 235 1.443 -43.057 6.284 1.00 16.52 N ATOM 2115 CA VAL A 235 2.548 -42.288 6.836 1.00 17.22 C ATOM 2116 C VAL A 235 3.827 -43.096 6.893 1.00 20.10 C ATOM 2117 O VAL A 235 4.883 -42.600 6.519 1.00 20.44 O ATOM 2118 CB VAL A 235 2.170 -41.739 8.227 1.00 19.86 C ATOM 2119 CG1 VAL A 235 3.402 -41.288 9.002 1.00 20.14 C ATOM 2120 CG2 VAL A 235 1.166 -40.604 8.093 1.00 18.50 C ATOM 2121 H VAL A 235 0.575 -43.168 6.846 1.00 0.00 H ATOM 2122 N ASN A 236 3.755 -44.280 7.470 1.00 20.92 N ATOM 2123 CA ASN A 236 4.942 -45.117 7.682 1.00 21.57 C ATOM 2124 C ASN A 236 5.620 -45.459 6.377 1.00 24.04 C ATOM 2125 O ASN A 236 6.838 -45.336 6.263 1.00 24.35 O ATOM 2126 CB ASN A 236 4.587 -46.387 8.445 1.00 23.32 C ATOM 2127 CG ASN A 236 4.150 -46.137 9.867 1.00 42.33 C ATOM 2128 OD1 ASN A 236 4.543 -45.149 10.479 1.00 33.83 O ATOM 2129 ND2 ASN A 236 3.350 -47.042 10.432 1.00 37.75 N ATOM 2130 HD22 ASN A 236 3.034 -47.869 9.887 1.00 0.00 H ATOM 2131 HD21 ASN A 236 3.042 -46.921 11.418 1.00 0.00 H ATOM 2132 H ASN A 236 2.828 -44.631 7.785 1.00 0.00 H ATOM 2133 N TRP A 237 4.834 -45.792 5.369 1.00 20.87 N ATOM 2134 CA TRP A 237 5.346 -46.069 4.033 1.00 22.48 C ATOM 2135 C TRP A 237 5.978 -44.797 3.400 1.00 22.65 C ATOM 2136 O TRP A 237 7.071 -44.887 2.839 1.00 21.61 O ATOM 2137 CB TRP A 237 4.199 -46.631 3.167 1.00 21.14 C ATOM 2138 CG TRP A 237 4.486 -46.725 1.698 1.00 21.74 C ATOM 2139 CD1 TRP A 237 5.141 -47.734 1.044 1.00 24.78 C ATOM 2140 CD2 TRP A 237 4.039 -45.819 0.700 1.00 21.30 C ATOM 2141 NE1 TRP A 237 5.159 -47.478 -0.308 1.00 24.38 N ATOM 2142 CE2 TRP A 237 4.462 -46.324 -0.552 1.00 25.00 C ATOM 2143 CE3 TRP A 237 3.347 -44.602 0.745 1.00 21.33 C ATOM 2144 CZ2 TRP A 237 4.199 -45.643 -1.750 1.00 25.14 C ATOM 2145 CZ3 TRP A 237 3.019 -43.973 -0.442 1.00 21.68 C ATOM 2146 CH2 TRP A 237 3.419 -44.512 -1.672 1.00 23.18 C ATOM 2147 HE1 TRP A 237 5.626 -48.065 -1.028 1.00 0.00 H ATOM 2148 H TRP A 237 3.810 -45.859 5.535 1.00 0.00 H ATOM 2149 N ILE A 238 5.330 -43.621 3.494 1.00 19.04 N ATOM 2150 CA ILE A 238 5.965 -42.421 2.989 1.00 17.59 C ATOM 2151 C ILE A 238 7.332 -42.216 3.622 1.00 20.16 C ATOM 2152 O ILE A 238 8.301 -41.946 2.921 1.00 20.57 O ATOM 2153 CB ILE A 238 5.085 -41.167 3.239 1.00 19.14 C ATOM 2154 CG1 ILE A 238 3.772 -41.280 2.469 1.00 17.29 C ATOM 2155 CG2 ILE A 238 5.817 -39.864 2.861 1.00 18.28 C ATOM 2156 CD1 ILE A 238 2.714 -40.190 2.836 1.00 17.10 C ATOM 2157 H ILE A 238 4.384 -43.574 3.924 1.00 0.00 H ATOM 2158 N LYS A 239 7.396 -42.288 4.957 1.00 19.92 N ATOM 2159 CA LYS A 239 8.634 -41.986 5.673 1.00 21.14 C ATOM 2160 C LYS A 239 9.721 -42.977 5.281 1.00 23.63 C ATOM 2161 O LYS A 239 10.859 -42.582 5.034 1.00 25.33 O ATOM 2162 CB LYS A 239 8.376 -42.012 7.182 1.00 22.88 C ATOM 2163 CG LYS A 239 7.405 -40.897 7.690 1.00 25.95 C ATOM 2164 CD LYS A 239 8.092 -39.605 8.102 1.00 33.69 C ATOM 2165 CE LYS A 239 7.111 -38.580 8.661 1.00 24.36 C ATOM 2166 NZ LYS A 239 7.645 -37.173 8.561 1.00 27.85 N ATOM 2167 HZ1 LYS A 239 8.532 -37.101 9.099 1.00 0.00 H ATOM 2168 HZ2 LYS A 239 7.824 -36.941 7.563 1.00 0.00 H ATOM 2169 HZ3 LYS A 239 6.946 -36.510 8.952 1.00 0.00 H ATOM 2170 H LYS A 239 6.550 -42.564 5.495 1.00 0.00 H ATOM 2171 N GLU A 240 9.362 -44.234 5.142 1.00 23.28 N ATOM 2172 CA GLU A 240 10.354 -45.252 4.768 1.00 25.48 C ATOM 2173 C GLU A 240 10.903 -45.074 3.358 1.00 28.10 C ATOM 2174 O GLU A 240 12.110 -45.113 3.133 1.00 28.26 O ATOM 2175 CB GLU A 240 9.752 -46.674 4.865 1.00 28.34 C ATOM 2176 CG GLU A 240 9.651 -47.219 6.268 1.00 43.03 C ATOM 2177 CD GLU A 240 9.216 -48.671 6.339 1.00 67.44 C ATOM 2178 OE1 GLU A 240 9.017 -49.296 5.269 1.00 48.11 O ATOM 2179 OE2 GLU A 240 9.064 -49.182 7.472 1.00 65.82 O ATOM 2180 H GLU A 240 8.371 -44.509 5.297 1.00 0.00 H ATOM 2181 N LYS A 241 10.006 -44.869 2.390 1.00 22.79 N ATOM 2182 CA LYS A 241 10.397 -44.754 0.996 1.00 21.78 C ATOM 2183 C LYS A 241 11.152 -43.502 0.636 1.00 24.62 C ATOM 2184 O LYS A 241 11.922 -43.530 -0.326 1.00 25.84 O ATOM 2185 CB LYS A 241 9.180 -44.906 0.089 1.00 23.83 C ATOM 2186 CG LYS A 241 8.452 -46.251 0.171 1.00 32.61 C ATOM 2187 CD LYS A 241 9.351 -47.443 0.055 1.00 36.42 C ATOM 2188 CE LYS A 241 8.586 -48.733 -0.063 1.00 42.88 C ATOM 2189 NZ LYS A 241 9.503 -49.906 -0.127 1.00 60.15 N ATOM 2190 HZ1 LYS A 241 10.125 -49.814 -0.956 1.00 0.00 H ATOM 2191 HZ2 LYS A 241 10.079 -49.942 0.738 1.00 0.00 H ATOM 2192 HZ3 LYS A 241 8.943 -50.778 -0.208 1.00 0.00 H ATOM 2193 H LYS A 241 9.000 -44.790 2.641 1.00 0.00 H ATOM 2194 N THR A 242 10.854 -42.372 1.328 1.00 21.31 N ATOM 2195 CA THR A 242 11.464 -41.071 1.047 1.00 20.73 C ATOM 2196 C THR A 242 12.618 -40.706 1.943 1.00 26.35 C ATOM 2197 O THR A 242 13.230 -39.669 1.703 1.00 25.35 O ATOM 2198 CB THR A 242 10.388 -39.989 1.156 1.00 20.24 C ATOM 2199 OG1 THR A 242 9.944 -39.876 2.504 1.00 20.81 O ATOM 2200 CG2 THR A 242 9.200 -40.240 0.228 1.00 18.75 C ATOM 2201 HG1 THR A 242 9.566 -40.742 2.799 1.00 0.00 H ATOM 2202 H THR A 242 10.157 -42.434 2.097 1.00 0.00 H ATOM 2203 N LYS A 243 13.003 -41.584 2.928 1.00 28.64 N ATOM 2204 CA LYS A 243 14.126 -41.314 3.839 1.00 28.56 C ATOM 2205 C LYS A 243 15.413 -41.061 3.054 1.00 30.05 C ATOM 2206 O LYS A 243 15.736 -41.833 2.148 1.00 30.92 O ATOM 2207 CB LYS A 243 14.329 -42.485 4.825 1.00 31.99 C ATOM 2208 CG LYS A 243 15.013 -42.081 6.122 1.00 45.57 C ATOM 2209 CD LYS A 243 15.078 -43.256 7.104 1.00 56.55 C ATOM 2210 CE LYS A 243 15.537 -42.892 8.499 1.00 76.17 C ATOM 2211 NZ LYS A 243 16.686 -41.945 8.517 1.00 89.98 N ATOM 2212 HZ1 LYS A 243 17.495 -42.374 8.024 1.00 0.00 H ATOM 2213 HZ2 LYS A 243 16.414 -41.063 8.038 1.00 0.00 H ATOM 2214 HZ3 LYS A 243 16.948 -41.739 9.502 1.00 0.00 H ATOM 2215 H LYS A 243 12.479 -42.476 3.034 1.00 0.00 H ATOM 2216 N LEU A 244 16.099 -39.938 3.333 1.00 29.06 N ATOM 2217 CA LEU A 244 17.338 -39.577 2.652 1.00 31.32 C ATOM 2218 C LEU A 244 18.584 -39.937 3.466 1.00 38.44 C ATOM 2219 O LEU A 244 19.655 -39.990 2.887 1.00 38.69 O ATOM 2220 CB LEU A 244 17.353 -38.088 2.307 1.00 30.76 C ATOM 2221 CG LEU A 244 16.195 -37.614 1.409 1.00 33.45 C ATOM 2222 CD1 LEU A 244 16.238 -36.119 1.229 1.00 33.65 C ATOM 2223 CD2 LEU A 244 16.205 -38.296 0.059 1.00 37.58 C ATOM 2224 H LEU A 244 15.730 -39.299 4.066 1.00 0.00 H ATOM 2225 N THR A 245 18.449 -40.166 4.776 1.00 38.22 N ATOM 2226 CA THR A 245 19.570 -40.521 5.665 1.00 42.55 C ATOM 2227 C THR A 245 19.510 -41.999 6.083 1.00 39.52 C ATOM 2228 O THR A 245 20.417 -42.452 6.816 1.00 45.62 O ATOM 2229 CB THR A 245 19.542 -39.621 6.899 1.00 51.95 C ATOM 2230 OG1 THR A 245 18.325 -39.854 7.606 1.00 53.14 O ATOM 2231 CG2 THR A 245 19.663 -38.144 6.544 1.00 51.52 C ATOM 2232 OXT THR A 245 18.530 -42.690 5.733 1.00 35.03 O ATOM 2233 HG1 THR A 245 18.295 -39.276 8.409 1.00 0.00 H ATOM 2234 H THR A 245 17.499 -40.089 5.192 1.00 0.00 H TER 2235 THR A 245 ATOM 2236 N ASP B 85 -4.875 -32.201 36.108 1.00 48.12 N ATOM 2237 CA ASP B 85 -5.482 -31.643 34.900 1.00 46.25 C ATOM 2238 C ASP B 85 -4.447 -31.392 33.775 1.00 42.61 C ATOM 2239 O ASP B 85 -4.675 -30.527 32.919 1.00 42.54 O ATOM 2240 CB ASP B 85 -6.241 -30.347 35.260 1.00 49.86 C ATOM 2241 CG ASP B 85 -7.400 -30.539 36.227 1.00 67.78 C ATOM 2242 OD1 ASP B 85 -7.706 -31.707 36.570 1.00 70.15 O ATOM 2243 OD2 ASP B 85 -8.059 -29.531 36.571 1.00 74.61 O ATOM 2244 HN3 ASP B 85 -4.160 -31.539 36.473 1.00 0.00 H ATOM 2245 HN2 ASP B 85 -4.424 -33.110 35.880 1.00 0.00 H ATOM 2246 HN1 ASP B 85 -5.611 -32.349 36.828 1.00 0.00 H ATOM 2247 N VAL B 86 -3.337 -32.184 33.742 1.00 34.62 N ATOM 2248 CA VAL B 86 -2.296 -32.080 32.697 1.00 31.15 C ATOM 2249 C VAL B 86 -2.123 -33.436 32.022 1.00 27.25 C ATOM 2250 O VAL B 86 -1.439 -34.333 32.536 1.00 26.79 O ATOM 2251 CB VAL B 86 -0.954 -31.546 33.251 1.00 35.73 C ATOM 2252 CG1 VAL B 86 0.119 -31.505 32.160 1.00 35.19 C ATOM 2253 CG2 VAL B 86 -1.138 -30.156 33.869 1.00 35.82 C ATOM 2254 H VAL B 86 -3.217 -32.897 34.490 1.00 0.00 H ATOM 2255 N THR B 87 -2.794 -33.600 30.866 1.00 21.13 N ATOM 2256 CA THR B 87 -2.746 -34.843 30.100 1.00 19.30 C ATOM 2257 C THR B 87 -2.773 -34.462 28.654 1.00 18.36 C ATOM 2258 O THR B 87 -3.237 -33.388 28.275 1.00 18.01 O ATOM 2259 CB THR B 87 -3.951 -35.778 30.380 1.00 20.31 C ATOM 2260 OG1 THR B 87 -5.109 -35.293 29.674 1.00 23.32 O ATOM 2261 CG2 THR B 87 -4.253 -35.918 31.845 1.00 24.32 C ATOM 2262 HG1 THR B 87 -5.878 -35.891 29.853 1.00 0.00 H ATOM 2263 H THR B 87 -3.368 -32.812 30.505 1.00 0.00 H ATOM 2264 N CYS B 88 -2.374 -35.387 27.798 1.00 15.88 N ATOM 2265 CA CYS B 88 -2.406 -35.120 26.379 1.00 14.77 C ATOM 2266 C CYS B 88 -3.807 -35.014 25.814 1.00 16.50 C ATOM 2267 O CYS B 88 -3.967 -34.514 24.711 1.00 18.32 O ATOM 2268 CB CYS B 88 -1.607 -36.168 25.631 1.00 14.91 C ATOM 2269 SG CYS B 88 0.159 -36.168 26.046 1.00 16.30 S ATOM 2270 H CYS B 88 -2.037 -36.307 28.146 1.00 0.00 H ATOM 2271 N ASN B 89 -4.802 -35.520 26.526 1.00 17.50 N ATOM 2272 CA ASN B 89 -6.152 -35.411 26.013 1.00 16.37 C ATOM 2273 C ASN B 89 -6.804 -34.087 26.358 1.00 16.89 C ATOM 2274 O ASN B 89 -7.838 -33.780 25.792 1.00 16.91 O ATOM 2275 CB ASN B 89 -7.015 -36.580 26.423 1.00 21.93 C ATOM 2276 CG ASN B 89 -6.768 -37.798 25.549 1.00 28.10 C ATOM 2277 OD1 ASN B 89 -5.674 -38.009 25.007 1.00 30.43 O ATOM 2278 ND2 ASN B 89 -7.799 -38.563 25.292 1.00 21.65 N ATOM 2279 HD22 ASN B 89 -8.713 -38.377 25.753 1.00 0.00 H ATOM 2280 HD21 ASN B 89 -7.704 -39.357 24.627 1.00 0.00 H ATOM 2281 H ASN B 89 -4.618 -35.987 27.437 1.00 0.00 H ATOM 2282 N ILE B 90 -6.197 -33.284 27.229 1.00 16.03 N ATOM 2283 CA ILE B 90 -6.732 -31.966 27.568 1.00 15.58 C ATOM 2284 C ILE B 90 -5.870 -30.897 26.869 1.00 16.96 C ATOM 2285 O ILE B 90 -4.715 -30.720 27.262 1.00 16.23 O ATOM 2286 CB ILE B 90 -6.749 -31.788 29.106 1.00 18.52 C ATOM 2287 CG1 ILE B 90 -7.643 -32.871 29.761 1.00 17.72 C ATOM 2288 CG2 ILE B 90 -7.233 -30.376 29.460 1.00 20.52 C ATOM 2289 CD1 ILE B 90 -7.460 -32.984 31.247 1.00 21.06 C ATOM 2290 H ILE B 90 -5.317 -33.603 27.682 1.00 0.00 H ATOM 2291 N LYS B 91 -6.389 -30.251 25.842 1.00 15.80 N ATOM 2292 CA LYS B 91 -5.651 -29.199 25.116 1.00 15.31 C ATOM 2293 C LYS B 91 -4.279 -29.683 24.659 1.00 16.19 C ATOM 2294 O LYS B 91 -3.292 -28.928 24.646 1.00 15.55 O ATOM 2295 CB LYS B 91 -5.491 -27.937 25.999 1.00 19.11 C ATOM 2296 CG LYS B 91 -6.824 -27.332 26.432 1.00 22.24 C ATOM 2297 CD LYS B 91 -6.609 -26.093 27.330 1.00 27.40 C ATOM 2298 CE LYS B 91 -6.081 -24.869 26.621 1.00 46.16 C ATOM 2299 NZ LYS B 91 -6.957 -24.421 25.504 1.00 57.75 N ATOM 2300 HZ1 LYS B 91 -7.038 -25.184 24.801 1.00 0.00 H ATOM 2301 HZ2 LYS B 91 -7.900 -24.189 25.876 1.00 0.00 H ATOM 2302 HZ3 LYS B 91 -6.543 -23.578 25.057 1.00 0.00 H ATOM 2303 H LYS B 91 -7.352 -30.492 25.533 1.00 0.00 H ATOM 2304 N ASN B 92 -4.193 -30.950 24.270 1.00 14.54 N ATOM 2305 CA ASN B 92 -2.935 -31.539 23.770 1.00 13.26 C ATOM 2306 C ASN B 92 -1.791 -31.402 24.787 1.00 13.69 C ATOM 2307 O ASN B 92 -0.635 -31.277 24.387 1.00 13.20 O ATOM 2308 CB ASN B 92 -2.568 -30.951 22.414 1.00 13.05 C ATOM 2309 CG ASN B 92 -1.630 -31.842 21.643 1.00 14.03 C ATOM 2310 OD1 ASN B 92 -1.866 -33.043 21.507 1.00 14.53 O ATOM 2311 ND2 ASN B 92 -0.545 -31.280 21.097 1.00 14.00 N ATOM 2312 HD22 ASN B 92 -0.366 -30.264 21.225 1.00 0.00 H ATOM 2313 HD21 ASN B 92 0.119 -31.860 20.545 1.00 0.00 H ATOM 2314 H ASN B 92 -5.042 -31.548 24.319 1.00 0.00 H ATOM 2315 N GLY B 93 -2.095 -31.380 26.070 1.00 13.26 N ATOM 2316 CA GLY B 93 -1.058 -31.174 27.078 1.00 13.97 C ATOM 2317 C GLY B 93 -0.388 -29.813 27.014 1.00 15.73 C ATOM 2318 O GLY B 93 0.684 -29.635 27.600 1.00 15.41 O ATOM 2319 H GLY B 93 -3.083 -31.511 26.367 1.00 0.00 H ATOM 2320 N ARG B 94 -1.006 -28.862 26.315 1.00 14.06 N ATOM 2321 CA ARG B 94 -0.496 -27.532 26.005 1.00 15.20 C ATOM 2322 C ARG B 94 0.701 -27.607 25.069 1.00 15.46 C ATOM 2323 O ARG B 94 1.340 -26.590 24.798 1.00 17.44 O ATOM 2324 CB ARG B 94 -0.244 -26.657 27.225 1.00 18.52 C ATOM 2325 CG ARG B 94 -1.560 -26.399 27.973 1.00 24.21 C ATOM 2326 CD ARG B 94 -1.447 -25.337 29.064 1.00 35.93 C ATOM 2327 NE ARG B 94 -2.712 -24.614 29.259 1.00 45.02 N ATOM 2328 CZ ARG B 94 -3.811 -25.105 29.834 1.00 60.56 C ATOM 2329 NH1 ARG B 94 -3.837 -26.357 30.287 1.00 41.02 N ATOM 2330 NH2 ARG B 94 -4.900 -24.351 29.951 1.00 55.37 N ATOM 2331 HE ARG B 94 -2.754 -23.632 28.918 1.00 0.00 H ATOM 2332 HH12 ARG B 94 -4.699 -26.731 30.734 1.00 0.00 H ATOM 2333 HH11 ARG B 94 -2.996 -26.961 30.194 1.00 0.00 H ATOM 2334 HH22 ARG B 94 -5.755 -24.738 30.400 1.00 0.00 H ATOM 2335 HH21 ARG B 94 -4.897 -23.374 29.594 1.00 0.00 H ATOM 2336 H ARG B 94 -1.953 -29.093 25.952 1.00 0.00 H ATOM 2337 N CYS B 95 0.917 -28.773 24.441 1.00 13.79 N ATOM 2338 CA CYS B 95 1.995 -28.949 23.464 1.00 12.39 C ATOM 2339 C CYS B 95 1.579 -28.315 22.136 1.00 14.40 C ATOM 2340 O CYS B 95 0.457 -28.575 21.659 1.00 14.97 O ATOM 2341 CB CYS B 95 2.287 -30.427 23.258 1.00 12.25 C ATOM 2342 SG CYS B 95 2.742 -31.311 24.761 1.00 13.72 S ATOM 2343 H CYS B 95 0.297 -29.580 24.655 1.00 0.00 H ATOM 2344 N GLU B 96 2.489 -27.602 21.494 1.00 13.09 N ATOM 2345 CA GLU B 96 2.153 -26.993 20.203 1.00 12.99 C ATOM 2346 C GLU B 96 1.872 -28.042 19.126 1.00 14.18 C ATOM 2347 O GLU B 96 0.972 -27.840 18.297 1.00 14.10 O ATOM 2348 CB GLU B 96 3.289 -26.073 19.772 1.00 14.09 C ATOM 2349 CG GLU B 96 3.021 -25.334 18.479 1.00 14.98 C ATOM 2350 CD GLU B 96 4.148 -24.422 18.057 1.00 16.71 C ATOM 2351 OE1 GLU B 96 4.833 -23.851 18.923 1.00 16.75 O ATOM 2352 OE2 GLU B 96 4.237 -24.130 16.848 1.00 20.57 O ATOM 2353 H GLU B 96 3.437 -27.474 21.902 1.00 0.00 H ATOM 2354 N GLN B 97 2.689 -29.111 19.051 1.00 12.68 N ATOM 2355 CA GLN B 97 2.538 -30.146 18.036 1.00 11.69 C ATOM 2356 C GLN B 97 2.144 -31.458 18.689 1.00 12.59 C ATOM 2357 O GLN B 97 0.964 -31.786 18.709 1.00 13.20 O ATOM 2358 CB GLN B 97 3.790 -30.247 17.150 1.00 12.95 C ATOM 2359 CG GLN B 97 3.925 -29.024 16.271 1.00 14.28 C ATOM 2360 CD GLN B 97 5.113 -29.044 15.370 1.00 15.85 C ATOM 2361 OE1 GLN B 97 5.824 -30.049 15.259 1.00 14.24 O ATOM 2362 NE2 GLN B 97 5.327 -27.900 14.671 1.00 16.03 N ATOM 2363 HE22 GLN B 97 4.696 -27.084 14.804 1.00 0.00 H ATOM 2364 HE21 GLN B 97 6.121 -27.840 14.003 1.00 0.00 H ATOM 2365 H GLN B 97 3.458 -29.201 19.745 1.00 0.00 H ATOM 2366 N PHE B 98 3.100 -32.235 19.191 1.00 12.14 N ATOM 2367 CA PHE B 98 2.795 -33.562 19.722 1.00 12.06 C ATOM 2368 C PHE B 98 2.956 -33.672 21.230 1.00 13.43 C ATOM 2369 O PHE B 98 3.786 -33.003 21.803 1.00 13.62 O ATOM 2370 CB PHE B 98 3.706 -34.594 19.058 1.00 12.54 C ATOM 2371 CG PHE B 98 3.843 -34.445 17.555 1.00 11.27 C ATOM 2372 CD1 PHE B 98 2.733 -34.199 16.754 1.00 11.86 C ATOM 2373 CD2 PHE B 98 5.094 -34.503 16.954 1.00 12.96 C ATOM 2374 CE1 PHE B 98 2.893 -34.036 15.376 1.00 12.47 C ATOM 2375 CE2 PHE B 98 5.235 -34.364 15.575 1.00 14.47 C ATOM 2376 CZ PHE B 98 4.135 -34.172 14.802 1.00 13.49 C ATOM 2377 H PHE B 98 4.082 -31.892 19.206 1.00 0.00 H ATOM 2378 N CYS B 99 2.219 -34.584 21.823 1.00 12.64 N ATOM 2379 CA CYS B 99 2.204 -34.778 23.273 1.00 12.31 C ATOM 2380 C CYS B 99 2.291 -36.267 23.559 1.00 14.24 C ATOM 2381 O CYS B 99 1.647 -37.071 22.870 1.00 14.58 O ATOM 2382 CB CYS B 99 0.905 -34.202 23.820 1.00 11.98 C ATOM 2383 SG CYS B 99 0.755 -34.250 25.626 1.00 14.26 S ATOM 2384 H CYS B 99 1.619 -35.196 21.234 1.00 0.00 H ATOM 2385 N LYS B 100 3.039 -36.632 24.607 1.00 13.28 N ATOM 2386 CA LYS B 100 3.130 -37.982 25.133 1.00 15.00 C ATOM 2387 C LYS B 100 2.936 -37.914 26.653 1.00 15.25 C ATOM 2388 O LYS B 100 3.541 -37.072 27.306 1.00 14.87 O ATOM 2389 CB LYS B 100 4.513 -38.560 24.824 1.00 17.75 C ATOM 2390 CG LYS B 100 4.781 -39.943 25.378 1.00 22.32 C ATOM 2391 CD LYS B 100 6.221 -40.348 25.082 1.00 27.51 C ATOM 2392 CE LYS B 100 6.599 -41.635 25.768 1.00 29.40 C ATOM 2393 NZ LYS B 100 5.761 -42.776 25.307 1.00 36.92 N ATOM 2394 HZ1 LYS B 100 4.762 -42.577 25.515 1.00 0.00 H ATOM 2395 HZ2 LYS B 100 5.885 -42.904 24.282 1.00 0.00 H ATOM 2396 HZ3 LYS B 100 6.053 -43.642 25.803 1.00 0.00 H ATOM 2397 H LYS B 100 3.597 -35.893 25.080 1.00 0.00 H ATOM 2398 N ASN B 101 2.065 -38.746 27.209 1.00 16.02 N ATOM 2399 CA ASN B 101 1.853 -38.778 28.658 1.00 16.72 C ATOM 2400 C ASN B 101 3.112 -39.361 29.295 1.00 20.12 C ATOM 2401 O ASN B 101 3.688 -40.317 28.757 1.00 19.83 O ATOM 2402 CB ASN B 101 0.612 -39.578 29.015 1.00 18.76 C ATOM 2403 CG ASN B 101 -0.649 -38.824 28.673 1.00 24.83 C ATOM 2404 OD1 ASN B 101 -0.807 -37.663 29.050 1.00 20.43 O ATOM 2405 ND2 ASN B 101 -1.615 -39.457 28.010 1.00 31.12 N ATOM 2406 HD22 ASN B 101 -1.473 -40.438 27.695 1.00 0.00 H ATOM 2407 HD21 ASN B 101 -2.511 -38.970 27.807 1.00 0.00 H ATOM 2408 H ASN B 101 1.520 -39.391 26.602 1.00 0.00 H ATOM 2409 N SER B 102 3.565 -38.769 30.401 1.00 19.47 N ATOM 2410 CA SER B 102 4.769 -39.229 31.075 1.00 19.66 C ATOM 2411 C SER B 102 4.511 -39.417 32.563 1.00 24.45 C ATOM 2412 O SER B 102 3.396 -39.210 33.049 1.00 23.57 O ATOM 2413 CB SER B 102 5.928 -38.279 30.780 1.00 21.23 C ATOM 2414 OG SER B 102 5.751 -37.013 31.387 1.00 26.16 O ATOM 2415 HG SER B 102 6.523 -36.433 31.169 1.00 0.00 H ATOM 2416 H SER B 102 3.044 -37.958 30.791 1.00 0.00 H ATOM 2417 N ALA B 103 5.537 -39.825 33.295 1.00 23.02 N ATOM 2418 CA ALA B 103 5.390 -40.162 34.707 1.00 23.94 C ATOM 2419 C ALA B 103 4.949 -39.015 35.571 1.00 27.36 C ATOM 2420 O ALA B 103 5.137 -37.853 35.244 1.00 25.10 O ATOM 2421 CB ALA B 103 6.696 -40.740 35.253 1.00 26.78 C ATOM 2422 H ALA B 103 6.474 -39.907 32.851 1.00 0.00 H ATOM 2423 N ASP B 104 4.347 -39.354 36.728 1.00 27.05 N ATOM 2424 CA ASP B 104 3.913 -38.369 37.723 1.00 27.41 C ATOM 2425 C ASP B 104 2.944 -37.305 37.194 1.00 29.32 C ATOM 2426 O ASP B 104 3.091 -36.127 37.517 1.00 28.59 O ATOM 2427 CB ASP B 104 5.146 -37.711 38.381 1.00 28.80 C ATOM 2428 CG ASP B 104 6.083 -38.730 38.996 1.00 42.85 C ATOM 2429 OD1 ASP B 104 5.623 -39.513 39.861 1.00 45.57 O ATOM 2430 OD2 ASP B 104 7.277 -38.754 38.605 1.00 39.92 O ATOM 2431 H ASP B 104 4.183 -40.362 36.924 1.00 0.00 H ATOM 2432 N ASN B 105 1.973 -37.709 36.342 1.00 28.64 N ATOM 2433 CA ASN B 105 0.943 -36.806 35.823 1.00 28.59 C ATOM 2434 C ASN B 105 1.520 -35.602 35.034 1.00 29.71 C ATOM 2435 O ASN B 105 1.036 -34.461 35.113 1.00 29.43 O ATOM 2436 CB ASN B 105 0.003 -36.361 36.950 1.00 34.04 C ATOM 2437 CG ASN B 105 -0.607 -37.537 37.686 1.00 61.84 C ATOM 2438 OD1 ASN B 105 -1.141 -38.466 37.069 1.00 53.39 O ATOM 2439 ND2 ASN B 105 -0.524 -37.551 39.014 1.00 58.75 N ATOM 2440 HD22 ASN B 105 -0.071 -36.760 39.515 1.00 0.00 H ATOM 2441 HD21 ASN B 105 -0.912 -38.353 39.551 1.00 0.00 H ATOM 2442 H ASN B 105 1.958 -38.705 36.043 1.00 0.00 H ATOM 2443 N LYS B 106 2.579 -35.876 34.276 1.00 22.77 N ATOM 2444 CA LYS B 106 3.234 -34.864 33.460 1.00 19.36 C ATOM 2445 C LYS B 106 3.100 -35.293 32.011 1.00 17.36 C ATOM 2446 O LYS B 106 2.670 -36.402 31.710 1.00 18.18 O ATOM 2447 CB LYS B 106 4.726 -34.778 33.813 1.00 21.67 C ATOM 2448 CG LYS B 106 5.030 -34.409 35.274 1.00 26.18 C ATOM 2449 CD LYS B 106 4.647 -32.982 35.596 1.00 32.23 C ATOM 2450 CE LYS B 106 4.767 -32.746 37.092 1.00 51.79 C ATOM 2451 NZ LYS B 106 4.829 -31.301 37.427 1.00 64.38 N ATOM 2452 HZ1 LYS B 106 5.657 -30.874 36.964 1.00 0.00 H ATOM 2453 HZ2 LYS B 106 3.963 -30.832 37.093 1.00 0.00 H ATOM 2454 HZ3 LYS B 106 4.910 -31.189 38.458 1.00 0.00 H ATOM 2455 H LYS B 106 2.952 -36.847 34.266 1.00 0.00 H ATOM 2456 N VAL B 107 3.488 -34.408 31.116 1.00 15.36 N ATOM 2457 CA VAL B 107 3.535 -34.709 29.689 1.00 13.44 C ATOM 2458 C VAL B 107 4.888 -34.352 29.164 1.00 13.82 C ATOM 2459 O VAL B 107 5.584 -33.483 29.697 1.00 15.12 O ATOM 2460 CB VAL B 107 2.418 -34.016 28.842 1.00 15.26 C ATOM 2461 CG1 VAL B 107 1.012 -34.402 29.335 1.00 15.85 C ATOM 2462 CG2 VAL B 107 2.568 -32.494 28.795 1.00 15.97 C ATOM 2463 H VAL B 107 3.771 -33.460 31.438 1.00 0.00 H ATOM 2464 N VAL B 108 5.233 -34.963 28.025 1.00 13.86 N ATOM 2465 CA VAL B 108 6.434 -34.626 27.252 1.00 12.41 C ATOM 2466 C VAL B 108 5.975 -34.197 25.886 1.00 13.84 C ATOM 2467 O VAL B 108 5.362 -35.000 25.163 1.00 14.09 O ATOM 2468 CB VAL B 108 7.421 -35.806 27.158 1.00 14.67 C ATOM 2469 CG1 VAL B 108 8.533 -35.527 26.138 1.00 14.52 C ATOM 2470 CG2 VAL B 108 8.022 -36.068 28.522 1.00 14.32 C ATOM 2471 H VAL B 108 4.615 -35.719 27.667 1.00 0.00 H ATOM 2472 N CYS B 109 6.253 -32.948 25.520 1.00 12.56 N ATOM 2473 CA CYS B 109 5.903 -32.460 24.205 1.00 12.05 C ATOM 2474 C CYS B 109 6.997 -32.804 23.227 1.00 13.94 C ATOM 2475 O CYS B 109 8.150 -33.037 23.604 1.00 14.24 O ATOM 2476 CB CYS B 109 5.712 -30.942 24.238 1.00 12.29 C ATOM 2477 SG CYS B 109 4.432 -30.361 25.383 1.00 14.24 S ATOM 2478 H CYS B 109 6.730 -32.313 26.191 1.00 0.00 H ATOM 2479 N SER B 110 6.672 -32.697 21.955 1.00 12.37 N ATOM 2480 CA SER B 110 7.654 -32.889 20.905 1.00 11.48 C ATOM 2481 C SER B 110 7.174 -32.234 19.627 1.00 11.54 C ATOM 2482 O SER B 110 6.103 -31.612 19.597 1.00 11.48 O ATOM 2483 CB SER B 110 7.950 -34.371 20.695 1.00 13.46 C ATOM 2484 OG SER B 110 6.804 -35.026 20.190 1.00 13.46 O ATOM 2485 HG SER B 110 7.006 -35.986 20.057 1.00 0.00 H ATOM 2486 H SER B 110 5.690 -32.470 21.698 1.00 0.00 H ATOM 2487 N CYS B 111 8.018 -32.305 18.596 1.00 12.22 N ATOM 2488 CA CYS B 111 7.799 -31.585 17.357 1.00 12.57 C ATOM 2489 C CYS B 111 8.170 -32.454 16.184 1.00 13.52 C ATOM 2490 O CYS B 111 8.866 -33.456 16.325 1.00 13.92 O ATOM 2491 CB CYS B 111 8.633 -30.308 17.337 1.00 13.78 C ATOM 2492 SG CYS B 111 8.489 -29.248 18.826 1.00 17.43 S ATOM 2493 H CYS B 111 8.866 -32.900 18.685 1.00 0.00 H ATOM 2494 N THR B 112 7.753 -32.042 14.991 1.00 12.45 N ATOM 2495 CA THR B 112 8.115 -32.747 13.766 1.00 13.28 C ATOM 2496 C THR B 112 9.558 -32.453 13.377 1.00 14.65 C ATOM 2497 O THR B 112 10.213 -31.588 13.952 1.00 15.13 O ATOM 2498 CB THR B 112 7.073 -32.429 12.701 1.00 15.09 C ATOM 2499 OG1 THR B 112 7.210 -33.369 11.647 1.00 16.83 O ATOM 2500 CG2 THR B 112 7.221 -31.027 12.127 1.00 14.02 C ATOM 2501 HG1 THR B 112 7.066 -34.283 12.000 1.00 0.00 H ATOM 2502 H THR B 112 7.153 -31.195 14.929 1.00 0.00 H ATOM 2503 N GLU B 113 10.057 -33.172 12.368 1.00 16.72 N ATOM 2504 CA GLU B 113 11.423 -33.004 11.839 1.00 18.84 C ATOM 2505 C GLU B 113 11.654 -31.533 11.460 1.00 17.25 C ATOM 2506 O GLU B 113 10.785 -30.904 10.863 1.00 16.76 O ATOM 2507 CB GLU B 113 11.538 -33.871 10.581 1.00 22.89 C ATOM 2508 CG GLU B 113 12.907 -33.864 9.906 1.00 40.39 C ATOM 2509 CD GLU B 113 14.036 -34.531 10.670 1.00 66.96 C ATOM 2510 OE1 GLU B 113 13.760 -35.451 11.474 1.00 66.75 O ATOM 2511 OE2 GLU B 113 15.209 -34.175 10.411 1.00 61.81 O ATOM 2512 H GLU B 113 9.447 -33.892 11.930 1.00 0.00 H ATOM 2513 N GLY B 114 12.822 -31.016 11.798 1.00 17.05 N ATOM 2514 CA GLY B 114 13.181 -29.649 11.458 1.00 17.56 C ATOM 2515 C GLY B 114 12.849 -28.612 12.495 1.00 17.04 C ATOM 2516 O GLY B 114 13.157 -27.429 12.295 1.00 17.58 O ATOM 2517 H GLY B 114 13.503 -31.603 12.321 1.00 0.00 H ATOM 2518 N TYR B 115 12.201 -29.026 13.586 1.00 16.09 N ATOM 2519 CA TYR B 115 11.873 -28.161 14.695 1.00 14.80 C ATOM 2520 C TYR B 115 12.518 -28.692 15.954 1.00 17.80 C ATOM 2521 O TYR B 115 12.838 -29.882 16.036 1.00 18.86 O ATOM 2522 CB TYR B 115 10.358 -28.150 14.928 1.00 14.34 C ATOM 2523 CG TYR B 115 9.559 -27.482 13.835 1.00 13.82 C ATOM 2524 CD1 TYR B 115 9.199 -28.173 12.685 1.00 14.67 C ATOM 2525 CD2 TYR B 115 9.245 -26.128 13.904 1.00 14.95 C ATOM 2526 CE1 TYR B 115 8.522 -27.536 11.641 1.00 13.77 C ATOM 2527 CE2 TYR B 115 8.563 -25.487 12.881 1.00 16.08 C ATOM 2528 CZ TYR B 115 8.214 -26.191 11.746 1.00 14.02 C ATOM 2529 OH TYR B 115 7.602 -25.496 10.745 1.00 15.24 O ATOM 2530 HH TYR B 115 7.404 -26.108 9.993 1.00 0.00 H ATOM 2531 H TYR B 115 11.917 -30.025 13.640 1.00 0.00 H ATOM 2532 N ARG B 116 12.695 -27.829 16.938 1.00 16.12 N ATOM 2533 CA ARG B 116 13.234 -28.212 18.249 1.00 15.61 C ATOM 2534 C ARG B 116 12.197 -27.833 19.281 1.00 18.44 C ATOM 2535 O ARG B 116 11.463 -26.863 19.104 1.00 16.64 O ATOM 2536 CB ARG B 116 14.594 -27.492 18.504 1.00 17.15 C ATOM 2537 CG ARG B 116 14.895 -27.019 19.926 1.00 25.18 C ATOM 2538 CD ARG B 116 16.148 -26.155 19.976 1.00 19.94 C ATOM 2539 NE ARG B 116 15.895 -24.807 19.446 1.00 25.96 N ATOM 2540 CZ ARG B 116 15.385 -23.780 20.131 1.00 33.98 C ATOM 2541 NH1 ARG B 116 15.085 -23.910 21.422 1.00 29.70 N ATOM 2542 NH2 ARG B 116 15.190 -22.611 19.535 1.00 27.84 N ATOM 2543 HE ARG B 116 16.135 -24.638 18.448 1.00 0.00 H ATOM 2544 HH12 ARG B 116 14.688 -23.105 21.947 1.00 0.00 H ATOM 2545 HH11 ARG B 116 15.247 -24.817 21.905 1.00 0.00 H ATOM 2546 HH22 ARG B 116 14.793 -21.814 20.072 1.00 0.00 H ATOM 2547 HH21 ARG B 116 15.434 -22.492 18.531 1.00 0.00 H ATOM 2548 H ARG B 116 12.441 -26.833 16.777 1.00 0.00 H ATOM 2549 N LEU B 117 12.137 -28.590 20.363 1.00 16.19 N ATOM 2550 CA LEU B 117 11.249 -28.283 21.472 1.00 14.62 C ATOM 2551 C LEU B 117 11.895 -27.104 22.208 1.00 18.67 C ATOM 2552 O LEU B 117 13.063 -27.181 22.566 1.00 19.14 O ATOM 2553 CB LEU B 117 11.098 -29.490 22.421 1.00 14.82 C ATOM 2554 CG LEU B 117 10.150 -29.249 23.570 1.00 17.24 C ATOM 2555 CD1 LEU B 117 8.710 -29.124 23.096 1.00 16.56 C ATOM 2556 CD2 LEU B 117 10.264 -30.365 24.611 1.00 17.48 C ATOM 2557 H LEU B 117 12.744 -29.432 20.423 1.00 0.00 H ATOM 2558 N ALA B 118 11.131 -26.026 22.388 1.00 16.49 N ATOM 2559 CA ALA B 118 11.575 -24.787 22.996 1.00 17.02 C ATOM 2560 C ALA B 118 11.760 -24.880 24.490 1.00 18.77 C ATOM 2561 O ALA B 118 11.279 -25.803 25.149 1.00 17.89 O ATOM 2562 CB ALA B 118 10.571 -23.681 22.666 1.00 19.03 C ATOM 2563 H ALA B 118 10.143 -26.078 22.068 1.00 0.00 H ATOM 2564 N GLU B 119 12.476 -23.884 25.035 1.00 18.49 N ATOM 2565 CA GLU B 119 12.748 -23.795 26.456 1.00 19.61 C ATOM 2566 C GLU B 119 11.487 -23.764 27.323 1.00 20.36 C ATOM 2567 O GLU B 119 11.548 -24.237 28.445 1.00 21.26 O ATOM 2568 CB GLU B 119 13.602 -22.564 26.758 1.00 22.33 C ATOM 2569 CG GLU B 119 15.046 -22.780 26.389 1.00 36.56 C ATOM 2570 CD GLU B 119 15.969 -21.681 26.879 1.00 55.07 C ATOM 2571 OE1 GLU B 119 16.658 -21.060 26.039 1.00 51.30 O ATOM 2572 OE2 GLU B 119 16.004 -21.446 28.108 1.00 48.46 O ATOM 2573 H GLU B 119 12.852 -23.143 24.410 1.00 0.00 H ATOM 2574 N ASN B 120 10.336 -23.270 26.796 1.00 18.75 N ATOM 2575 CA ASN B 120 9.105 -23.284 27.576 1.00 18.40 C ATOM 2576 C ASN B 120 8.490 -24.676 27.663 1.00 19.06 C ATOM 2577 O ASN B 120 7.465 -24.857 28.306 1.00 18.62 O ATOM 2578 CB ASN B 120 8.096 -22.282 27.036 1.00 18.71 C ATOM 2579 CG ASN B 120 7.533 -22.620 25.683 1.00 20.57 C ATOM 2580 OD1 ASN B 120 7.751 -23.720 25.129 1.00 18.71 O ATOM 2581 ND2 ASN B 120 6.827 -21.673 25.080 1.00 23.47 N ATOM 2582 HD22 ASN B 120 6.658 -20.766 25.559 1.00 0.00 H ATOM 2583 HD21 ASN B 120 6.442 -21.838 24.128 1.00 0.00 H ATOM 2584 H ASN B 120 10.334 -22.880 25.832 1.00 0.00 H ATOM 2585 N GLN B 121 9.145 -25.673 27.024 1.00 17.34 N ATOM 2586 CA GLN B 121 8.767 -27.083 27.076 1.00 16.26 C ATOM 2587 C GLN B 121 7.517 -27.426 26.279 1.00 16.34 C ATOM 2588 O GLN B 121 7.101 -28.586 26.303 1.00 16.27 O ATOM 2589 CB GLN B 121 8.637 -27.572 28.519 1.00 18.00 C ATOM 2590 CG GLN B 121 9.783 -27.047 29.375 1.00 17.86 C ATOM 2591 CD GLN B 121 10.041 -27.858 30.590 1.00 23.57 C ATOM 2592 OE1 GLN B 121 9.204 -28.662 31.031 1.00 22.36 O ATOM 2593 NE2 GLN B 121 11.202 -27.600 31.214 1.00 25.68 N ATOM 2594 HE22 GLN B 121 11.872 -26.918 30.805 1.00 0.00 H ATOM 2595 HE21 GLN B 121 11.431 -28.083 32.106 1.00 0.00 H ATOM 2596 H GLN B 121 9.977 -25.417 26.455 1.00 0.00 H ATOM 2597 N LYS B 122 6.955 -26.476 25.524 1.00 15.35 N ATOM 2598 CA LYS B 122 5.692 -26.686 24.820 1.00 14.86 C ATOM 2599 C LYS B 122 5.767 -26.333 23.372 1.00 15.99 C ATOM 2600 O LYS B 122 5.152 -27.014 22.556 1.00 15.37 O ATOM 2601 CB LYS B 122 4.595 -25.807 25.446 1.00 15.75 C ATOM 2602 CG LYS B 122 4.314 -26.064 26.919 1.00 18.38 C ATOM 2603 CD LYS B 122 3.903 -27.509 27.278 1.00 17.49 C ATOM 2604 CE LYS B 122 3.500 -27.636 28.714 1.00 17.97 C ATOM 2605 NZ LYS B 122 3.031 -29.019 29.027 1.00 17.97 N ATOM 2606 HZ1 LYS B 122 2.210 -29.248 28.431 1.00 0.00 H ATOM 2607 HZ2 LYS B 122 3.798 -29.695 28.837 1.00 0.00 H ATOM 2608 HZ3 LYS B 122 2.759 -29.073 30.029 1.00 0.00 H ATOM 2609 H LYS B 122 7.433 -25.557 25.435 1.00 0.00 H ATOM 2610 N SER B 123 6.468 -25.224 23.029 1.00 14.47 N ATOM 2611 CA SER B 123 6.496 -24.695 21.679 1.00 16.02 C ATOM 2612 C SER B 123 7.522 -25.389 20.798 1.00 16.48 C ATOM 2613 O SER B 123 8.455 -26.054 21.297 1.00 15.91 O ATOM 2614 CB SER B 123 6.775 -23.198 21.705 1.00 18.40 C ATOM 2615 OG SER B 123 5.825 -22.500 22.500 1.00 19.84 O ATOM 2616 HG SER B 123 4.918 -22.642 22.129 1.00 0.00 H ATOM 2617 H SER B 123 7.010 -24.731 23.767 1.00 0.00 H ATOM 2618 N CYS B 124 7.364 -25.209 19.487 1.00 15.51 N ATOM 2619 CA CYS B 124 8.236 -25.795 18.466 1.00 16.07 C ATOM 2620 C CYS B 124 8.903 -24.684 17.708 1.00 19.60 C ATOM 2621 O CYS B 124 8.200 -23.861 17.107 1.00 21.03 O ATOM 2622 CB CYS B 124 7.460 -26.714 17.541 1.00 15.62 C ATOM 2623 SG CYS B 124 6.747 -28.139 18.386 1.00 17.31 S ATOM 2624 H CYS B 124 6.572 -24.615 19.169 1.00 0.00 H ATOM 2625 N GLU B 125 10.221 -24.662 17.721 1.00 16.30 N ATOM 2626 CA GLU B 125 10.990 -23.607 17.080 1.00 18.73 C ATOM 2627 C GLU B 125 11.733 -24.176 15.876 1.00 19.75 C ATOM 2628 O GLU B 125 12.304 -25.256 15.953 1.00 17.71 O ATOM 2629 CB GLU B 125 11.988 -22.958 18.051 1.00 21.64 C ATOM 2630 CG GLU B 125 11.322 -22.242 19.214 1.00 29.68 C ATOM 2631 CD GLU B 125 10.394 -21.103 18.839 1.00 59.12 C ATOM 2632 OE1 GLU B 125 9.350 -20.945 19.512 1.00 67.78 O ATOM 2633 OE2 GLU B 125 10.676 -20.409 17.835 1.00 51.97 O ATOM 2634 H GLU B 125 10.730 -25.427 18.208 1.00 0.00 H ATOM 2635 N PRO B 126 11.837 -23.448 14.759 1.00 18.03 N ATOM 2636 CA PRO B 126 12.640 -23.937 13.643 1.00 17.47 C ATOM 2637 C PRO B 126 14.088 -24.249 14.016 1.00 20.44 C ATOM 2638 O PRO B 126 14.745 -23.489 14.762 1.00 20.88 O ATOM 2639 CB PRO B 126 12.617 -22.758 12.682 1.00 19.96 C ATOM 2640 CG PRO B 126 11.315 -22.120 12.927 1.00 24.16 C ATOM 2641 CD PRO B 126 11.221 -22.152 14.438 1.00 21.12 C ATOM 2642 N ALA B 127 14.580 -25.376 13.516 1.00 18.24 N ATOM 2643 CA ALA B 127 15.961 -25.828 13.737 1.00 19.87 C ATOM 2644 C ALA B 127 16.712 -25.995 12.433 1.00 20.73 C ATOM 2645 O ALA B 127 17.849 -26.463 12.432 1.00 22.25 O ATOM 2646 CB ALA B 127 15.946 -27.142 14.506 1.00 21.88 C ATOM 2647 H ALA B 127 13.954 -25.971 12.937 1.00 0.00 H ATOM 2648 N VAL B 128 16.093 -25.608 11.296 1.00 17.56 N ATOM 2649 CA VAL B 128 16.687 -25.683 9.968 1.00 18.87 C ATOM 2650 C VAL B 128 16.269 -24.433 9.229 1.00 20.12 C ATOM 2651 O VAL B 128 15.322 -23.778 9.666 1.00 18.91 O ATOM 2652 CB VAL B 128 16.237 -26.961 9.202 1.00 20.62 C ATOM 2653 CG1 VAL B 128 16.691 -28.231 9.937 1.00 20.89 C ATOM 2654 CG2 VAL B 128 14.717 -26.974 8.975 1.00 18.68 C ATOM 2655 H VAL B 128 15.127 -25.231 11.374 1.00 0.00 H ATOM 2656 N PRO B 129 16.917 -24.102 8.093 1.00 20.75 N ATOM 2657 CA PRO B 129 16.560 -22.873 7.390 1.00 19.53 C ATOM 2658 C PRO B 129 15.125 -22.803 6.852 1.00 19.64 C ATOM 2659 O PRO B 129 14.498 -21.746 6.903 1.00 20.92 O ATOM 2660 CB PRO B 129 17.579 -22.841 6.246 1.00 20.68 C ATOM 2661 CG PRO B 129 18.765 -23.624 6.764 1.00 27.10 C ATOM 2662 CD PRO B 129 18.147 -24.713 7.543 1.00 22.50 C ATOM 2663 N PHE B 130 14.614 -23.899 6.324 1.00 16.88 N ATOM 2664 CA PHE B 130 13.283 -23.919 5.703 1.00 15.92 C ATOM 2665 C PHE B 130 12.475 -25.096 6.275 1.00 18.20 C ATOM 2666 O PHE B 130 12.334 -26.143 5.636 1.00 17.66 O ATOM 2667 CB PHE B 130 13.365 -24.008 4.183 1.00 16.85 C ATOM 2668 CG PHE B 130 14.033 -22.767 3.645 1.00 16.04 C ATOM 2669 CD1 PHE B 130 13.360 -21.551 3.621 1.00 16.20 C ATOM 2670 CD2 PHE B 130 15.373 -22.782 3.276 1.00 18.46 C ATOM 2671 CE1 PHE B 130 14.017 -20.379 3.296 1.00 18.35 C ATOM 2672 CE2 PHE B 130 16.020 -21.599 2.905 1.00 20.04 C ATOM 2673 CZ PHE B 130 15.332 -20.410 2.907 1.00 18.07 C ATOM 2674 H PHE B 130 15.171 -24.777 6.348 1.00 0.00 H ATOM 2675 N PRO B 131 12.039 -24.997 7.540 1.00 16.52 N ATOM 2676 CA PRO B 131 11.264 -26.079 8.131 1.00 15.85 C ATOM 2677 C PRO B 131 9.950 -26.351 7.419 1.00 16.62 C ATOM 2678 O PRO B 131 9.316 -25.459 6.829 1.00 15.21 O ATOM 2679 CB PRO B 131 11.048 -25.573 9.553 1.00 17.09 C ATOM 2680 CG PRO B 131 10.981 -24.143 9.446 1.00 21.56 C ATOM 2681 CD PRO B 131 12.075 -23.822 8.430 1.00 17.02 C ATOM 2682 N CYS B 132 9.548 -27.619 7.477 1.00 13.97 N ATOM 2683 CA CYS B 132 8.306 -28.017 6.821 1.00 13.61 C ATOM 2684 C CYS B 132 7.097 -27.247 7.288 1.00 13.02 C ATOM 2685 O CYS B 132 7.019 -26.800 8.448 1.00 13.30 O ATOM 2686 CB CYS B 132 8.066 -29.518 6.970 1.00 12.77 C ATOM 2687 SG CYS B 132 7.716 -30.064 8.668 1.00 14.55 S ATOM 2688 H CYS B 132 10.117 -28.324 7.988 1.00 0.00 H ATOM 2689 N GLY B 133 6.123 -27.114 6.393 1.00 11.35 N ATOM 2690 CA GLY B 133 4.797 -26.623 6.758 1.00 10.98 C ATOM 2691 C GLY B 133 4.681 -25.192 7.174 1.00 12.75 C ATOM 2692 O GLY B 133 3.610 -24.784 7.639 1.00 12.54 O ATOM 2693 H GLY B 133 6.311 -27.368 5.402 1.00 0.00 H ATOM 2694 N ARG B 134 5.712 -24.396 6.962 1.00 13.09 N ATOM 2695 CA ARG B 134 5.722 -23.007 7.382 1.00 14.26 C ATOM 2696 C ARG B 134 5.635 -22.086 6.195 1.00 14.46 C ATOM 2697 O ARG B 134 6.342 -22.306 5.190 1.00 15.65 O ATOM 2698 CB ARG B 134 7.050 -22.783 8.106 1.00 19.34 C ATOM 2699 CG ARG B 134 7.199 -21.474 8.816 1.00 26.01 C ATOM 2700 CD ARG B 134 8.382 -21.586 9.772 1.00 34.30 C ATOM 2701 NE ARG B 134 8.614 -20.388 10.587 1.00 42.94 N ATOM 2702 CZ ARG B 134 8.260 -20.232 11.864 1.00 55.45 C ATOM 2703 NH1 ARG B 134 7.608 -21.201 12.511 1.00 38.37 N ATOM 2704 NH2 ARG B 134 8.542 -19.102 12.503 1.00 48.86 N ATOM 2705 HE ARG B 134 9.097 -19.589 10.128 1.00 0.00 H ATOM 2706 HH12 ARG B 134 7.336 -21.070 13.506 1.00 0.00 H ATOM 2707 HH11 ARG B 134 7.372 -22.087 12.020 1.00 0.00 H ATOM 2708 HH22 ARG B 134 8.264 -18.984 13.498 1.00 0.00 H ATOM 2709 HH21 ARG B 134 9.040 -18.335 12.008 1.00 0.00 H ATOM 2710 H ARG B 134 6.548 -24.778 6.476 1.00 0.00 H ATOM 2711 N VAL B 135 4.794 -21.063 6.262 1.00 13.38 N ATOM 2712 CA VAL B 135 4.729 -20.007 5.298 1.00 13.58 C ATOM 2713 C VAL B 135 5.723 -18.937 5.745 1.00 16.46 C ATOM 2714 O VAL B 135 5.590 -18.378 6.846 1.00 17.25 O ATOM 2715 CB VAL B 135 3.324 -19.413 5.184 1.00 16.86 C ATOM 2716 CG1 VAL B 135 3.306 -18.189 4.267 1.00 17.65 C ATOM 2717 CG2 VAL B 135 2.331 -20.467 4.744 1.00 17.71 C ATOM 2718 H VAL B 135 4.138 -21.025 7.068 1.00 0.00 H ATOM 2719 N SER B 136 6.740 -18.639 4.924 1.00 15.54 N ATOM 2720 CA SER B 136 7.777 -17.683 5.251 1.00 17.02 C ATOM 2721 C SER B 136 7.751 -16.453 4.341 1.00 21.02 C ATOM 2722 O SER B 136 8.254 -15.397 4.741 1.00 24.25 O ATOM 2723 CB SER B 136 9.147 -18.368 5.283 1.00 18.87 C ATOM 2724 OG SER B 136 9.433 -18.991 4.034 1.00 18.49 O ATOM 2725 HG SER B 136 8.741 -19.671 3.840 1.00 0.00 H ATOM 2726 H SER B 136 6.787 -19.120 4.003 1.00 0.00 H ATOM 2727 N VAL B 137 7.134 -16.531 3.142 1.00 19.38 N ATOM 2728 CA VAL B 137 7.031 -15.384 2.248 1.00 21.20 C ATOM 2729 C VAL B 137 6.025 -14.429 2.884 1.00 24.91 C ATOM 2730 O VAL B 137 4.959 -14.879 3.294 1.00 24.51 O ATOM 2731 CB VAL B 137 6.577 -15.754 0.799 1.00 23.23 C ATOM 2732 CG1 VAL B 137 6.384 -14.500 -0.066 1.00 23.59 C ATOM 2733 CG2 VAL B 137 7.559 -16.698 0.143 1.00 23.02 C ATOM 2734 H VAL B 137 6.719 -17.438 2.847 1.00 0.00 H ATOM 2735 N SER B 138 6.308 -13.108 2.857 1.00 27.50 N ATOM 2736 CA SER B 138 5.364 -12.121 3.372 1.00 28.12 C ATOM 2737 C SER B 138 4.022 -12.277 2.664 1.00 31.20 C ATOM 2738 O SER B 138 3.978 -12.405 1.441 1.00 30.26 O ATOM 2739 CB SER B 138 5.889 -10.706 3.154 1.00 32.97 C ATOM 2740 OG SER B 138 4.929 -9.758 3.593 1.00 42.92 O ATOM 2741 HG SER B 138 5.279 -8.844 3.447 1.00 0.00 H ATOM 2742 H SER B 138 7.215 -12.789 2.462 1.00 0.00 H ATOM 2743 N GLN B 139 2.953 -12.329 3.443 1.00 28.96 N ATOM 2744 CA GLN B 139 1.593 -12.463 2.945 1.00 28.79 C ATOM 2745 C GLN B 139 0.869 -11.130 3.078 1.00 36.12 C ATOM 2746 O GLN B 139 -0.160 -10.963 2.434 1.00 38.13 O ATOM 2747 CB GLN B 139 0.852 -13.532 3.737 1.00 28.41 C ATOM 2748 CG GLN B 139 1.516 -14.909 3.684 1.00 23.93 C ATOM 2749 CD GLN B 139 1.437 -15.523 2.318 1.00 26.22 C ATOM 2750 OE1 GLN B 139 0.348 -15.751 1.804 1.00 27.34 O ATOM 2751 NE2 GLN B 139 2.570 -15.753 1.661 1.00 22.66 N ATOM 2752 HE22 GLN B 139 3.484 -15.553 2.115 1.00 0.00 H ATOM 2753 HE21 GLN B 139 2.542 -16.133 0.693 1.00 0.00 H ATOM 2754 H GLN B 139 3.094 -12.271 4.472 1.00 0.00 H TER 2755 GLN B 139 HETATM 2756 NA NA A 1 4.747 -19.554 -13.448 1.00 18.69 NA HETATM 2757 O HOH 2 -5.770 -39.915 -3.679 1.00 24.05 O HETATM 2758 O HOH 3 5.618 -21.458 -15.131 1.00 27.63 O HETATM 2759 O HOH 4 -9.980 -42.872 14.074 1.00 28.51 O HETATM 2760 O HOH 5 -4.661 -54.186 -2.989 1.00 35.10 O HETATM 2761 O HOH 6 5.174 -42.223 16.432 1.00 37.54 O HETATM 2762 O HOH 7 3.410 -43.566 12.280 1.00 27.47 O HETATM 2763 O HOH 8 -19.759 -30.222 -3.865 1.00 36.52 O HETATM 2764 O HOH 9 -7.296 -34.474 -11.629 1.00 36.31 O HETATM 2765 O HOH 10 -16.607 -52.232 -2.420 1.00 35.24 O HETATM 2766 O HOH 11 -11.880 -28.426 15.490 1.00 35.91 O HETATM 2767 O HOH 12 -14.024 -30.927 -1.365 1.00 21.32 O HETATM 2768 O HOH 13 -5.166 -43.419 -14.184 1.00 45.21 O HETATM 2769 O HOH 14 -6.627 -25.773 12.025 1.00 33.37 O HETATM 2770 O HOH 15 -6.291 -14.113 -2.177 1.00 44.81 O HETATM 2771 O HOH 16 -7.345 -36.988 -12.086 1.00 30.78 O HETATM 2772 O HOH 17 -18.671 -35.858 -6.290 1.00 41.55 O HETATM 2773 O HOH 18 -20.500 -22.674 -1.465 1.00 33.83 O HETATM 2774 O HOH 19 1.574 -26.163 -15.642 1.00 31.91 O HETATM 2775 O HOH 20 -22.802 -30.992 -1.596 1.00 36.79 O HETATM 2776 O HOH 21 6.850 -13.088 -3.880 1.00 34.14 O HETATM 2777 O HOH 22 6.348 -19.312 2.191 1.00 14.87 O HETATM 2778 O HOH 23 18.906 -29.050 -2.174 1.00 32.58 O HETATM 2779 O HOH 24 -24.550 -45.026 -1.697 1.00 54.72 O HETATM 2780 O HOH 25 -3.589 -13.159 -7.808 1.00 24.81 O HETATM 2781 O HOH 26 -8.881 -14.475 -5.488 1.00 23.81 O HETATM 2782 O HOH 27 0.215 -47.996 -10.967 1.00 35.59 O HETATM 2783 O HOH 28 -16.729 -27.781 -21.289 1.00 28.92 O HETATM 2784 O HOH 29 -14.479 -20.959 -9.051 1.00 18.61 O HETATM 2785 O HOH 30 -5.246 -44.068 10.532 1.00 34.65 O HETATM 2786 O HOH 31 -20.109 -29.411 5.069 1.00 31.11 O HETATM 2787 O HOH 32 7.880 -34.083 4.828 1.00 18.94 O HETATM 2788 O HOH 33 -4.794 -40.010 20.937 1.00 45.38 O HETATM 2789 O HOH 34 5.527 -21.325 -3.728 1.00 17.04 O HETATM 2790 O HOH 35 -13.661 -53.536 -9.229 1.00 45.90 O HETATM 2791 O HOH 36 -6.414 -49.997 -6.073 1.00 25.82 O HETATM 2792 O HOH 37 8.347 -21.496 -15.150 1.00 60.09 O HETATM 2793 O HOH 38 -26.833 -31.059 0.226 1.00 43.82 O HETATM 2794 O HOH 39 7.576 -51.751 -0.638 1.00 39.51 O HETATM 2795 O HOH 40 -20.283 -37.209 -3.430 1.00 37.99 O HETATM 2796 O HOH 41 -6.000 -28.163 -14.457 1.00 25.85 O HETATM 2797 O HOH 42 4.343 -18.051 -11.590 1.00 18.90 O HETATM 2798 O HOH 43 -18.424 -33.173 -5.690 1.00 34.71 O HETATM 2799 O HOH 44 -18.505 -38.428 -5.338 1.00 51.44 O HETATM 2800 O HOH 45 -1.508 -14.612 -16.598 1.00 36.84 O HETATM 2801 O HOH 46 1.094 -23.370 7.688 1.00 21.62 O HETATM 2802 O HOH 47 -9.309 -21.291 8.670 1.00 53.53 O HETATM 2803 O HOH 48 15.322 -29.159 -14.558 1.00 24.05 O HETATM 2804 O HOH 49 4.100 -25.273 -14.833 1.00 22.95 O HETATM 2805 O HOH 50 1.428 -29.590 -21.925 1.00 47.78 O HETATM 2806 O HOH 51 -5.845 -14.390 -11.049 1.00 28.14 O HETATM 2807 O HOH 52 -25.833 -33.401 1.289 1.00 45.86 O HETATM 2808 O HOH 53 10.115 -38.329 4.745 1.00 23.45 O HETATM 2809 O HOH 54 4.256 -13.889 -8.859 1.00 44.47 O HETATM 2810 O HOH 55 6.496 -33.180 -19.345 1.00 42.79 O HETATM 2811 O HOH 56 -20.916 -27.072 -9.974 1.00 39.40 O HETATM 2812 O HOH 57 3.245 -20.748 8.679 1.00 22.00 O HETATM 2813 O HOH 58 -0.103 -34.474 -2.247 1.00 14.86 O HETATM 2814 O HOH 59 -12.484 -51.922 -4.914 1.00 38.24 O HETATM 2815 O HOH 60 13.221 -39.263 -16.099 1.00 44.34 O HETATM 2816 O HOH 61 14.471 -42.562 -0.560 1.00 38.97 O HETATM 2817 O HOH 62 11.482 -32.873 4.306 1.00 34.05 O HETATM 2818 O HOH 63 1.064 -51.195 -6.731 1.00 27.63 O HETATM 2819 O HOH 64 -10.369 -41.014 10.480 1.00 38.97 O HETATM 2820 O HOH 65 -14.815 -21.405 4.934 1.00 37.63 O HETATM 2821 O HOH 66 -14.851 -42.851 5.313 1.00 29.10 O HETATM 2822 O HOH 67 11.594 -40.166 6.108 1.00 26.58 O HETATM 2823 O HOH 68 5.878 -24.820 -4.399 1.00 10.56 O HETATM 2824 O HOH 69 -15.641 -38.415 5.711 1.00 25.15 O HETATM 2825 O HOH 70 -14.415 -22.382 2.493 1.00 25.49 O HETATM 2826 O HOH 71 -4.487 -27.466 -18.362 1.00 51.29 O HETATM 2827 O HOH 72 3.034 -21.393 16.631 1.00 36.08 O HETATM 2828 O HOH 73 -11.544 -21.239 -7.497 1.00 19.49 O HETATM 2829 O HOH 74 -2.756 -54.395 -12.077 1.00 59.21 O HETATM 2830 O HOH 75 12.959 -21.443 -6.323 1.00 14.10 O HETATM 2831 O HOH 76 14.830 -22.457 -10.322 1.00 17.43 O HETATM 2832 O HOH 77 6.539 -47.591 -11.377 1.00 44.94 O HETATM 2833 O HOH 78 -2.603 -13.590 -5.266 1.00 26.65 O HETATM 2834 O HOH 79 -25.870 -35.526 -0.488 1.00 41.30 O HETATM 2835 O HOH 80 -13.352 -19.268 -1.184 1.00 18.89 O HETATM 2836 O HOH 81 -0.935 -54.294 -5.762 1.00 52.00 O HETATM 2837 O HOH 82 -4.505 -15.543 -0.082 1.00 28.72 O HETATM 2838 O HOH 83 -17.788 -24.559 7.991 1.00 51.36 O HETATM 2839 O HOH 84 -6.996 -40.060 9.129 1.00 19.42 O HETATM 2840 O HOH 85 -25.122 -43.659 4.338 1.00 49.39 O HETATM 2841 O HOH 86 -0.771 -21.864 4.034 1.00 16.95 O HETATM 2842 O HOH 87 -9.689 -23.873 9.501 1.00 43.51 O HETATM 2843 O HOH 88 1.741 -40.043 18.761 1.00 32.64 O HETATM 2844 O HOH 89 0.462 -35.456 8.910 1.00 14.99 O HETATM 2845 O HOH 90 17.492 -21.430 -0.509 1.00 18.98 O HETATM 2846 O HOH 91 -7.908 -24.478 -9.365 1.00 12.78 O HETATM 2847 O HOH 92 -3.634 -29.976 -6.613 1.00 12.66 O HETATM 2848 O HOH 93 4.525 -25.447 -7.536 1.00 17.40 O HETATM 2849 O HOH 94 -13.683 -49.613 4.708 1.00 33.48 O HETATM 2850 O HOH 95 6.112 -17.481 -6.797 1.00 17.37 O HETATM 2851 O HOH 96 -26.390 -34.311 -5.658 1.00 46.37 O HETATM 2852 O HOH 97 5.742 -49.945 -1.493 1.00 30.77 O HETATM 2853 O HOH 98 4.559 -21.344 -17.612 1.00 40.92 O HETATM 2854 O HOH 99 -17.942 -29.799 -1.829 1.00 33.84 O HETATM 2855 O HOH 100 13.753 -16.680 2.969 1.00 24.82 O HETATM 2856 O HOH 101 -5.306 -38.748 7.395 1.00 15.72 O HETATM 2857 O HOH 102 -10.842 -14.395 -12.012 1.00 37.08 O HETATM 2858 O HOH 103 -4.693 -56.671 -6.314 1.00 37.97 O HETATM 2859 O HOH 104 -7.822 -40.354 16.967 1.00 37.07 O HETATM 2860 O HOH 105 -11.553 -31.480 5.723 1.00 15.48 O HETATM 2861 O HOH 106 -7.174 -21.827 -18.326 1.00 29.92 O HETATM 2862 O HOH 107 8.161 -36.705 5.821 1.00 21.61 O HETATM 2863 O HOH 108 13.973 -46.468 4.774 1.00 37.95 O HETATM 2864 O HOH 109 -5.411 -41.105 15.938 1.00 25.13 O HETATM 2865 O HOH 110 1.479 -48.725 3.919 1.00 29.98 O HETATM 2866 O HOH 111 1.035 -39.566 -15.843 1.00 30.34 O HETATM 2867 O HOH 112 -13.102 -27.364 12.567 1.00 48.33 O HETATM 2868 O HOH 113 -8.554 -31.120 9.596 1.00 14.23 O HETATM 2869 O HOH 114 -15.210 -30.988 -14.379 1.00 23.86 O HETATM 2870 O HOH 115 2.187 -20.081 -5.471 1.00 17.63 O HETATM 2871 O HOH 116 12.393 -20.350 -12.629 1.00 24.35 O HETATM 2872 O HOH 117 -19.368 -30.795 7.418 1.00 34.18 O HETATM 2873 O HOH 118 13.948 -25.239 -13.180 1.00 19.07 O HETATM 2874 O HOH 119 1.714 -47.071 6.073 1.00 29.58 O HETATM 2875 O HOH 120 -6.058 -35.152 -15.322 1.00 42.72 O HETATM 2876 O HOH 121 4.244 -22.384 13.705 1.00 41.29 O HETATM 2877 O HOH 122 -4.944 -45.601 -12.716 1.00 39.52 O HETATM 2878 O HOH 123 -1.902 -24.212 4.838 1.00 18.01 O HETATM 2879 O HOH 124 -8.144 -24.367 -19.213 1.00 31.87 O HETATM 2880 O HOH 125 -21.302 -33.646 7.677 1.00 36.79 O HETATM 2881 O HOH 126 -21.680 -33.546 -15.791 1.00 45.13 O HETATM 2882 O HOH 127 -8.557 -27.465 11.444 1.00 25.69 O HETATM 2883 O HOH 128 3.182 -41.215 -15.496 1.00 35.83 O HETATM 2884 O HOH 129 -11.162 -34.477 -3.819 1.00 25.41 O HETATM 2885 O HOH 130 -7.312 -43.995 -1.767 1.00 26.06 O HETATM 2886 O HOH 131 -25.276 -27.274 -7.446 1.00 46.95 O HETATM 2887 O HOH 132 2.234 -21.380 -3.037 1.00 15.74 O HETATM 2888 O HOH 133 -2.355 -27.060 0.518 1.00 16.03 O HETATM 2889 O HOH 134 8.337 -45.358 8.707 1.00 40.32 O HETATM 2890 O HOH 135 -3.079 -28.871 -9.231 1.00 14.94 O HETATM 2891 O HOH 136 4.718 -30.896 -20.315 1.00 48.52 O HETATM 2892 O HOH 137 0.470 -45.390 -10.313 1.00 29.60 O HETATM 2893 O HOH 138 4.676 -19.163 -5.071 1.00 17.94 O HETATM 2894 O HOH 139 -1.029 -13.560 -8.645 1.00 36.85 O HETATM 2895 O HOH 140 -5.282 -57.650 -10.879 1.00 39.80 O HETATM 2896 O HOH 141 3.704 -23.106 -4.953 1.00 16.99 O HETATM 2897 O HOH 142 1.855 -42.570 18.054 1.00 40.46 O HETATM 2898 O HOH 143 1.175 -43.228 15.532 1.00 26.69 O HETATM 2899 O HOH 144 -6.500 -26.316 8.842 1.00 17.63 O HETATM 2900 O HOH 145 9.514 -38.526 -16.268 1.00 38.99 O HETATM 2901 O HOH 146 17.729 -27.521 -0.198 1.00 25.54 O HETATM 2902 O HOH 147 -15.326 -26.045 9.901 1.00 32.22 O HETATM 2903 O HOH 148 3.765 -37.349 15.134 1.00 23.55 O HETATM 2904 O HOH 149 9.445 -45.931 -12.072 1.00 35.07 O HETATM 2905 O HOH 150 5.948 -15.581 -19.245 1.00 36.43 O HETATM 2906 O HOH 151 -19.158 -25.398 -11.402 1.00 32.64 O HETATM 2907 O HOH 152 6.425 -28.218 -17.571 1.00 37.54 O HETATM 2908 O HOH 153 -17.587 -51.254 -5.088 1.00 43.88 O HETATM 2909 O HOH 154 -10.710 -19.742 -0.442 1.00 17.54 O HETATM 2910 O HOH 155 -5.742 -53.798 -0.530 1.00 40.65 O HETATM 2911 O HOH 156 -15.972 -45.322 4.865 1.00 44.87 O HETATM 2912 O HOH 157 -10.584 -32.307 8.222 1.00 16.25 O HETATM 2913 O HOH 158 -2.813 -20.014 4.134 1.00 22.74 O HETATM 2914 O HOH 159 -4.448 -22.974 -17.122 1.00 38.91 O HETATM 2915 O HOH 160 -11.342 -20.863 1.991 1.00 19.09 O HETATM 2916 O HOH 161 -4.192 -25.102 15.763 1.00 42.16 O HETATM 2917 O HOH 162 6.323 -18.749 -9.755 1.00 26.34 O HETATM 2918 O HOH 163 -10.153 -36.823 -12.589 1.00 35.63 O HETATM 2919 O HOH 164 -2.806 -22.304 12.721 1.00 35.81 O HETATM 2920 O HOH 165 12.373 -36.755 4.604 1.00 28.69 O HETATM 2921 O HOH 166 16.400 -40.329 -3.198 1.00 43.89 O HETATM 2922 O HOH 167 -8.825 -14.219 -9.415 1.00 37.38 O HETATM 2923 O HOH 168 16.796 -20.614 -3.063 1.00 18.27 O HETATM 2924 O HOH 169 18.857 -40.440 -6.986 1.00 62.43 O HETATM 2925 O HOH 170 -14.676 -32.432 -16.763 1.00 40.63 O HETATM 2926 O HOH 171 -13.633 -46.251 -5.269 1.00 43.21 O HETATM 2927 O HOH 172 1.117 -45.181 8.540 1.00 27.83 O HETATM 2928 O HOH 173 10.991 -50.049 3.158 1.00 49.30 O HETATM 2929 O HOH 174 -12.705 -39.559 16.701 1.00 24.64 O HETATM 2930 O HOH 175 14.961 -37.882 5.183 1.00 34.93 O HETATM 2931 O HOH 176 -11.771 -48.120 -11.196 1.00 44.61 O HETATM 2932 O HOH 177 -1.805 -50.676 -10.872 1.00 33.55 O HETATM 2933 O HOH 178 10.520 -52.508 0.978 1.00 43.97 O HETATM 2934 O HOH 179 10.745 -36.290 -16.980 1.00 42.37 O HETATM 2935 O HOH 180 -7.649 -39.892 -14.711 1.00 43.30 O HETATM 2936 O HOH 181 -1.296 -37.675 22.239 1.00 31.18 O HETATM 2937 O HOH 182 -14.116 -41.943 8.039 1.00 33.32 O HETATM 2938 O HOH 183 -21.926 -25.029 -8.092 1.00 45.69 O HETATM 2939 O HOH 184 -0.135 -13.826 -11.705 1.00 30.08 O HETATM 2940 O HOH 185 -21.774 -43.756 9.767 1.00 37.13 O HETATM 2941 O HOH 186 1.701 -37.250 -20.046 1.00 43.89 O HETATM 2942 O HOH 187 -17.933 -48.255 3.848 1.00 40.09 O HETATM 2943 O HOH 188 17.567 -32.833 -17.192 1.00 44.33 O HETATM 2944 O HOH 189 -23.197 -25.651 2.919 1.00 45.20 O HETATM 2945 O HOH 190 2.543 -55.648 -4.201 1.00 42.16 O HETATM 2946 O HOH 191 -0.489 -21.216 6.649 1.00 27.90 O HETATM 2947 O HOH 192 2.185 -37.378 -17.355 1.00 40.05 O HETATM 2948 O HOH 193 12.433 -23.147 -13.977 1.00 35.64 O HETATM 2949 O HOH 194 -0.456 -48.032 8.695 1.00 37.50 O HETATM 2950 O HOH 195 -10.194 -19.522 4.121 1.00 30.62 O HETATM 2951 O HOH 196 -9.992 -53.112 -4.225 1.00 41.56 O HETATM 2952 O HOH 197 -2.816 -27.468 -21.100 1.00 41.16 O HETATM 2953 O HOH 198 -0.837 -36.444 -19.759 1.00 45.84 O HETATM 2954 O HOH 199 -10.293 -17.354 0.812 1.00 29.07 O HETATM 2955 O HOH 200 6.007 -25.156 -16.852 1.00 39.08 O HETATM 2956 O HOH 201 -21.777 -27.050 4.797 1.00 52.24 O HETATM 2957 O HOH 202 3.618 -50.357 4.410 1.00 44.05 O HETATM 2958 O HOH 203 -16.061 -37.535 9.798 1.00 39.68 O HETATM 2959 O HOH 204 -10.581 -26.373 12.875 1.00 41.84 O HETATM 2960 O HOH 205 -4.168 -27.174 17.749 1.00 36.36 O HETATM 2961 O HOH 206 -7.042 -23.853 10.130 1.00 38.47 O HETATM 2962 O HOH 207 0.812 -50.390 -9.466 1.00 33.63 O HETATM 2963 O HOH 208 6.234 -14.788 -7.127 1.00 35.44 O HETATM 2964 O HOH 209 -1.753 -17.624 4.934 1.00 34.51 O HETATM 2965 O HOH 210 17.820 -28.825 2.180 1.00 40.94 O HETATM 2966 O HOH 211 15.843 -37.364 -15.880 1.00 46.16 O HETATM 2967 O HOH 212 -7.919 -30.982 -16.017 1.00 38.73 O HETATM 2968 O HOH 213 -7.670 -52.361 -5.494 1.00 33.90 O HETATM 2969 O HOH 214 -6.494 -17.388 -19.754 1.00 42.10 O HETATM 2970 O HOH 215 11.056 -44.594 8.492 1.00 41.05 O HETATM 2971 O HOH 216 6.326 -37.715 14.451 1.00 40.87 O HETATM 2972 O HOH 217 -16.427 -40.781 4.514 1.00 33.24 O HETATM 2973 O HOH 218 -7.032 -12.150 -5.325 1.00 45.03 O HETATM 2974 O HOH 219 -10.717 -26.024 -20.770 1.00 42.45 O HETATM 2975 O HOH 220 0.881 -11.953 -7.341 1.00 48.08 O HETATM 2976 O HOH 221 -4.545 -12.359 -3.336 1.00 52.62 O HETATM 2977 O HOH 222 -5.832 -37.929 -14.208 1.00 45.03 O HETATM 2978 O HOH 223 8.653 -42.669 -15.023 1.00 48.27 O HETATM 2979 O HOH 224 -3.355 -44.999 15.133 1.00 49.94 O HETATM 2980 O HOH 225 -14.470 -39.121 8.229 1.00 37.13 O HETATM 2981 O HOH 226 -20.447 -48.717 2.786 1.00 38.75 O HETATM 2982 O HOH 227 -6.362 -54.992 -4.919 1.00 31.22 O HETATM 2983 O HOH 228 3.366 -44.572 14.730 1.00 32.62 O HETATM 2984 O HOH 229 9.405 -33.388 7.072 1.00 26.88 O HETATM 2985 O HOH 230 -8.132 -13.036 -11.787 1.00 45.26 O HETATM 2986 O HOH 231 -4.099 -10.451 -7.939 1.00 43.41 O HETATM 2987 O HOH 232 0.789 -19.388 8.240 1.00 30.70 O HETATM 2988 O HOH 233 -4.091 -12.598 -12.119 1.00 42.16 O HETATM 2989 O HOH 234 8.612 -42.924 10.902 1.00 45.93 O HETATM 2990 O HOH 235 11.527 -35.245 6.825 1.00 52.11 O HETATM 2991 O HOH 236 -18.315 -28.288 9.811 1.00 44.11 O HETATM 2992 O HOH 237 -0.663 -11.754 -5.062 1.00 39.31 O HETATM 2993 O HOH 238 19.797 -22.565 2.914 1.00 38.98 O HETATM 2994 O HOH 239 -2.840 -37.162 -18.056 1.00 48.81 O HETATM 2995 O HOH 240 -8.792 -56.014 -4.270 1.00 33.52 O HETATM 2996 O HOH 241 -16.194 -13.698 -9.370 1.00 40.39 O HETATM 2997 O HOH 242 9.831 -35.207 17.617 1.00 18.96 O HETATM 2998 O HOH 243 6.194 -22.834 15.858 1.00 28.52 O HETATM 2999 O HOH 244 3.321 -25.746 14.988 1.00 16.53 O HETATM 3000 O HOH 245 -1.916 -15.571 3.164 1.00 35.81 O HETATM 3001 O HOH 246 6.361 -35.805 12.246 1.00 20.18 O HETATM 3002 O HOH 247 8.577 -36.996 37.089 1.00 32.98 O HETATM 3003 O HOH 248 6.575 -29.012 31.297 1.00 25.37 O HETATM 3004 O HOH 249 13.180 -25.761 29.907 1.00 24.67 O HETATM 3005 O HOH 250 1.310 -23.919 24.920 1.00 36.49 O HETATM 3006 O HOH 251 11.195 -29.722 8.469 1.00 22.36 O HETATM 3007 O HOH 252 12.546 -19.902 6.584 1.00 36.86 O HETATM 3008 O HOH 253 3.548 -42.402 27.037 1.00 40.36 O HETATM 3009 O HOH 254 2.630 -28.901 31.707 1.00 31.84 O HETATM 3010 O HOH 255 8.407 -41.221 38.765 1.00 31.79 O HETATM 3011 O HOH 256 3.578 -22.481 20.911 1.00 29.54 O HETATM 3012 O HOH 257 9.218 -20.511 22.200 1.00 39.13 O HETATM 3013 O HOH 258 15.686 -31.644 9.513 1.00 43.98 O HETATM 3014 O HOH 259 5.475 -23.350 29.406 1.00 42.25 O HETATM 3015 O HOH 260 8.668 -21.623 3.939 1.00 16.63 O HETATM 3016 O HOH 261 14.737 -21.165 10.195 1.00 31.72 O HETATM 3017 O HOH 262 8.627 -18.397 8.716 1.00 47.56 O HETATM 3018 O HOH 263 11.833 -32.412 16.275 1.00 19.42 O HETATM 3019 O HOH 264 7.294 -31.080 27.411 1.00 15.76 O HETATM 3020 O HOH 265 10.421 -34.498 23.107 1.00 15.45 O HETATM 3021 O HOH 266 -7.345 -36.714 30.433 1.00 23.67 O HETATM 3022 O HOH 267 4.913 -29.545 20.980 1.00 13.61 O HETATM 3023 O HOH 268 -1.740 -28.060 18.757 1.00 25.15 O HETATM 3024 O HOH 269 7.789 -33.430 31.378 1.00 18.02 O HETATM 3025 O HOH 270 -1.866 -27.134 21.191 1.00 28.33 O HETATM 3026 O HOH 271 15.283 -25.729 23.507 1.00 29.01 O HETATM 3027 O HOH 272 -1.246 -30.285 17.913 1.00 18.04 O HETATM 3028 O HOH 273 -3.035 -26.392 23.510 1.00 39.64 O HETATM 3029 O HOH 274 5.891 -23.358 11.293 1.00 30.37 O HETATM 3030 O HOH 275 3.120 -12.178 6.228 1.00 41.95 O HETATM 3031 O HOH 276 3.057 -13.369 -1.016 1.00 22.10 O HETATM 3032 O HOH 277 6.221 -21.516 18.237 1.00 28.97 O HETATM 3033 O HOH 278 7.449 -33.890 8.900 1.00 15.98 O HETATM 3034 O HOH 279 15.462 -30.877 16.213 1.00 22.39 O HETATM 3035 O HOH 280 -4.520 -33.858 21.022 1.00 23.61 O HETATM 3036 O HOH 281 8.024 -12.847 5.929 1.00 47.19 O HETATM 3037 O HOH 282 14.493 -20.963 16.007 1.00 49.33 O HETATM 3038 O HOH 283 15.956 -19.419 6.196 1.00 39.31 O HETATM 3039 O HOH 284 -8.688 -32.765 23.277 1.00 19.32 O HETATM 3040 O HOH 285 10.113 -22.842 6.050 1.00 20.24 O HETATM 3041 O HOH 286 -3.429 -30.581 29.807 1.00 24.46 O HETATM 3042 O HOH 287 -6.145 -32.195 22.581 1.00 23.08 O HETATM 3043 O HOH 288 0.849 -40.639 25.431 1.00 29.03 O HETATM 3044 O HOH 289 10.809 -32.981 18.761 1.00 18.37 O HETATM 3045 O HOH 290 -3.634 -39.865 25.829 1.00 48.70 O HETATM 3046 O HOH 291 12.468 -29.409 33.064 1.00 25.50 O HETATM 3047 O HOH 292 3.975 -18.184 9.224 1.00 52.19 O HETATM 3048 O HOH 293 -9.030 -30.317 24.684 1.00 17.63 O HETATM 3049 O HOH 294 8.583 -36.051 32.025 1.00 17.16 O HETATM 3050 O HOH 295 4.764 -14.877 6.174 1.00 41.76 O HETATM 3051 O HOH 296 14.741 -32.214 13.591 1.00 31.40 O HETATM 3052 O HOH 297 13.734 -21.961 23.270 1.00 28.23 O HETATM 3053 O HOH 298 5.441 -30.579 29.421 1.00 18.79 O HETATM 3054 O HOH 299 8.752 -12.095 1.574 1.00 42.94 O HETATM 3055 O HOH 300 -4.239 -38.141 27.813 1.00 28.84 O HETATM 3056 O HOH 301 15.895 -26.444 5.569 1.00 28.32 O HETATM 3057 O HOH 302 13.774 -31.055 20.519 1.00 16.46 O HETATM 3058 O HOH 303 4.185 -31.747 32.221 1.00 24.27 O HETATM 3059 O HOH 304 -0.211 -37.005 32.157 1.00 31.90 O HETATM 3060 O HOH 305 7.746 -43.184 23.118 1.00 38.51 O HETATM 3061 O HOH 306 13.932 -28.680 5.581 1.00 34.70 O HETATM 3062 O HOH 307 6.587 -19.070 26.598 1.00 40.98 O HETATM 3063 O HOH 308 7.136 -41.662 31.502 1.00 38.05 O HETATM 3064 O HOH 309 10.478 -21.020 24.780 1.00 28.76 O HETATM 3065 O HOH 310 -9.840 -40.161 23.662 1.00 18.36 O HETATM 3066 O HOH 311 9.547 -36.194 12.673 1.00 38.87 O HETATM 3067 O HOH 312 -6.610 -41.126 24.034 1.00 38.61 O HETATM 3068 O HOH 313 -6.496 -26.172 22.945 1.00 47.81 O HETATM 3069 O HOH 314 16.852 -23.932 29.971 1.00 38.38 O HETATM 3070 O HOH 315 11.027 -35.606 15.230 1.00 42.53 O HETATM 3071 O HOH 316 -0.849 -42.569 27.492 1.00 46.70 O HETATM 3072 O HOH 317 15.962 -19.819 21.069 1.00 65.08 O HETATM 3073 O HOH 318 18.696 -23.058 10.735 1.00 42.48 O HETATM 3074 O HOH 319 10.312 -20.562 7.688 1.00 32.63 O HETATM 3075 O HOH 320 2.901 -16.385 7.458 1.00 46.22 O HETATM 3076 O HOH 321 8.195 -37.002 17.214 1.00 30.63 O HETATM 3077 O HOH 322 18.955 -27.109 17.554 1.00 50.14 O HETATM 3078 O HOH 323 7.799 -30.884 35.623 1.00 35.09 O HETATM 3079 O HOH 324 12.066 -20.343 9.864 1.00 45.52 O HETATM 3080 O HOH 325 6.524 -10.750 -0.588 1.00 43.49 O HETATM 3081 O HOH 326 -6.313 -29.583 21.625 1.00 37.74 O HETATM 3082 O HOH 327 -4.317 -31.915 18.989 1.00 26.20 O HETATM 3083 O HOH 328 16.472 -19.190 8.869 1.00 51.14 O HETATM 3084 O HOH 329 -1.569 -39.781 24.112 1.00 37.72 O HETATM 3085 O HOH 330 4.896 -11.931 -2.443 1.00 34.39 O HETATM 3086 O HOH 331 13.363 -24.303 32.176 1.00 39.70 O HETATM 3087 O HOH 332 13.698 -30.465 7.874 1.00 30.68 O HETATM 3088 O HOH 333 20.757 -24.807 10.112 1.00 45.01 O HETATM 3089 O HOH 334 10.925 -31.257 6.250 1.00 30.42 O HETATM 3090 O HOH 335 6.785 -31.481 33.115 1.00 26.67 O HETATM 3091 O HOH 336 4.788 -27.333 32.423 1.00 38.36 O HETATM 3092 O HOH 337 1.358 -11.280 -1.640 1.00 44.96 O HETATM 3093 O HOH 338 -8.407 -35.370 34.556 1.00 40.75 O HETATM 3094 O HOH 339 -8.762 -28.287 22.891 1.00 31.63 O HETATM 3095 O HOH 340 1.496 -24.896 30.317 1.00 44.78 O HETATM 3096 O HOH 341 4.071 -24.866 31.307 1.00 34.13 O HETATM 3097 O HOH 342 -7.528 -37.696 32.993 1.00 34.40 O HETATM 3098 O HOH 343 17.612 -26.478 3.501 1.00 27.88 O HETATM 3099 O HOH 344 0.517 -17.335 6.528 1.00 36.42 O HETATM 3100 O HOH 345 -10.347 -34.819 32.821 1.00 27.06 O HETATM 3101 CL1 UNN A 346 -10.615 -34.017 -7.281 1.00 -0.08 CL HETATM 3102 C19 UNN A 346 -11.716 -34.347 -8.596 1.00 0.05 C HETATM 3103 C18 UNN A 346 -13.088 -34.055 -8.534 1.00 0.07 C HETATM 3104 C21 UNN A 346 -14.109 -33.499 -7.646 1.00 0.13 C HETATM 3105 N7 UNN A 346 -13.960 -33.174 -6.356 1.00 -0.33 N HETATM 3106 H1 UNN A 346 -14.755 -32.788 -5.827 1.00 0.17 H HETATM 3107 H2 UNN A 346 -13.050 -33.310 -5.892 1.00 0.17 H HETATM 3108 N6 UNN A 346 -15.278 -33.500 -8.225 1.00 -0.14 N HETATM 3109 O1 UNN A 346 -15.139 -34.101 -9.507 1.00 -0.18 O HETATM 3110 C17 UNN A 346 -13.831 -34.412 -9.672 1.00 0.20 C HETATM 3111 C16 UNN A 346 -13.271 -35.030 -10.805 1.00 0.15 C HETATM 3112 N5 UNN A 346 -11.958 -35.298 -10.841 1.00 -0.30 N HETATM 3113 C20 UNN A 346 -11.242 -34.950 -9.764 1.00 -0.01 C HETATM 3114 H3 UNN A 346 -10.179 -35.159 -9.803 1.00 0.07 H HETATM 3115 N4 UNN A 346 -13.987 -35.430 -11.953 1.00 -0.29 N HETATM 3116 C15 UNN A 346 -13.312 -36.086 -13.135 1.00 0.03 C HETATM 3117 C11 UNN A 346 -14.490 -36.334 -14.076 1.00 0.00 C HETATM 3118 C12 UNN A 346 -14.726 -34.888 -14.542 1.00 -0.04 C HETATM 3119 C13 UNN A 346 -15.272 -34.171 -13.275 1.00 -0.03 C HETATM 3120 C14 UNN A 346 -15.427 -35.284 -12.226 1.00 0.06 C HETATM 3121 C10 UNN A 346 -15.641 -36.530 -13.098 1.00 0.07 C HETATM 3122 N3 UNN A 346 -15.524 -37.736 -12.288 1.00 -0.28 N HETATM 3123 C9 UNN A 346 -15.530 -38.972 -12.813 1.00 0.20 C HETATM 3124 O UNN A 346 -15.670 -39.181 -14.020 1.00 -0.39 O HETATM 3125 C6 UNN A 346 -15.364 -40.115 -11.858 1.00 0.06 C HETATM 3126 C5 UNN A 346 -16.327 -41.121 -11.863 1.00 -0.05 C HETATM 3127 C4 UNN A 346 -16.199 -42.235 -11.059 1.00 -0.02 C HETATM 3128 C3 UNN A 346 -15.111 -42.375 -10.203 1.00 0.12 C HETATM 3129 C8 UNN A 346 -14.130 -41.374 -10.187 1.00 -0.01 C HETATM 3130 C7 UNN A 346 -14.260 -40.270 -11.015 1.00 0.06 C HETATM 3131 CL UNN A 346 -12.944 -39.128 -11.072 1.00 -0.07 CL HETATM 3132 H16 UNN A 346 -13.273 -41.463 -9.530 1.00 0.06 H HETATM 3133 N1 UNN A 346 -15.019 -43.538 -9.368 1.00 -0.14 N HETATM 3134 C2 UNN A 346 -14.666 -43.671 -8.081 1.00 0.14 C HETATM 3135 N UNN A 346 -14.777 -44.919 -7.670 1.00 -0.28 N HETATM 3136 C1 UNN A 346 -15.201 -45.538 -8.822 1.00 0.07 C HETATM 3137 N2 UNN A 346 -15.377 -44.759 -9.870 1.00 -0.19 N HETATM 3138 C UNN A 346 -15.399 -47.012 -8.890 1.00 -0.01 C HETATM 3139 H18 UNN A 346 -15.198 -47.455 -7.903 1.00 0.04 H HETATM 3140 H19 UNN A 346 -14.709 -47.441 -9.632 1.00 0.04 H HETATM 3141 H20 UNN A 346 -16.436 -47.230 -9.185 1.00 0.04 H HETATM 3142 H17 UNN A 346 -14.329 -42.849 -7.452 1.00 0.14 H HETATM 3143 H15 UNN A 346 -16.955 -43.011 -11.095 1.00 0.06 H HETATM 3144 H14 UNN A 346 -17.192 -41.027 -12.510 1.00 0.07 H HETATM 3145 H13 UNN A 346 -15.435 -37.639 -11.297 1.00 0.18 H HETATM 3146 H12 UNN A 346 -16.615 -36.523 -13.609 1.00 0.06 H HETATM 3147 H7 UNN A 346 -16.119 -35.121 -11.386 1.00 0.06 H HETATM 3148 H8 UNN A 346 -14.562 -33.407 -12.926 1.00 0.03 H HETATM 3149 H9 UNN A 346 -16.243 -33.700 -13.486 1.00 0.03 H HETATM 3150 H10 UNN A 346 -15.463 -34.855 -15.358 1.00 0.03 H HETATM 3151 H11 UNN A 346 -13.786 -34.427 -14.878 1.00 0.03 H HETATM 3152 H6 UNN A 346 -14.363 -37.103 -14.852 1.00 0.03 H HETATM 3153 H4 UNN A 346 -12.827 -37.029 -12.845 1.00 0.05 H HETATM 3154 H5 UNN A 346 -12.569 -35.417 -13.593 1.00 0.05 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 232 231 373 CONECT 373 232 372 CONECT 480 479 2756 CONECT 497 496 2756 CONECT 527 526 2756 CONECT 581 579 2756 CONECT 1018 1017 2687 CONECT 1472 1471 1622 CONECT 1622 1472 1621 CONECT 1717 1716 1955 CONECT 1955 1717 1954 CONECT 2236 2237 2244 2245 2246 CONECT 2244 2236 CONECT 2245 2236 CONECT 2246 2236 CONECT 2269 2268 2383 CONECT 2342 2341 2477 CONECT 2383 2269 2382 CONECT 2477 2342 2476 CONECT 2492 2491 2623 CONECT 2623 2492 2622 CONECT 2687 1018 2686 CONECT 2756 480 497 527 581 CONECT 3101 3102 CONECT 3102 3101 3103 3113 CONECT 3103 3102 3104 3110 CONECT 3104 3103 3105 3108 CONECT 3105 3104 3106 3107 CONECT 3106 3105 CONECT 3107 3105 CONECT 3108 3104 3109 CONECT 3109 3108 3110 CONECT 3110 3103 3109 3111 CONECT 3111 3110 3112 3115 CONECT 3112 3111 3113 CONECT 3113 3102 3112 3114 CONECT 3114 3113 CONECT 3115 3111 3116 3120 CONECT 3116 3115 3117 3153 3154 CONECT 3117 3116 3118 3121 3152 CONECT 3118 3117 3119 3150 3151 CONECT 3119 3118 3120 3148 3149 CONECT 3120 3115 3119 3121 3147 CONECT 3121 3117 3120 3122 3146 CONECT 3122 3121 3123 3145 CONECT 3123 3122 3124 3125 CONECT 3124 3123 CONECT 3125 3123 3126 3130 CONECT 3126 3125 3127 3144 CONECT 3127 3126 3128 3143 CONECT 3128 3127 3129 3133 CONECT 3129 3128 3130 3132 CONECT 3130 3125 3129 3131 CONECT 3131 3130 CONECT 3132 3129 CONECT 3133 3128 3134 3137 CONECT 3134 3133 3135 3142 CONECT 3135 3134 3136 CONECT 3136 3135 3137 3138 CONECT 3137 3133 3136 CONECT 3138 3136 3139 3140 3141 CONECT 3139 3138 CONECT 3140 3138 CONECT 3141 3138 CONECT 3142 3134 CONECT 3143 3127 CONECT 3144 3126 CONECT 3145 3122 CONECT 3146 3121 CONECT 3147 3120 CONECT 3148 3119 CONECT 3149 3119 CONECT 3150 3118 CONECT 3151 3118 CONECT 3152 3117 CONECT 3153 3116 CONECT 3154 3116 MASTER 0 0 0 0 0 0 0 0 3152 2 81 24 END
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Related entries of code: 5tnt
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Protein Sequence Similarity
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PDBbind
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PDBbind
62aa, >4Z0K_2|Chain... at 100%
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PDBbind
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RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5tnt
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Coagulation factor IX
Ligand Name
7GQ
EC.Number
E.C.-.-.-.-
Resolution
1.4(Å)
Affinity (Kd/Ki/IC50)
IC50=4.9nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Bioorg. Med. Chem. Lett. Vol. 27: pp. 2622-2628
Ligand Properties
Formula
C
2
2
H
2
0
Cl
2
N
8
O
2
Molecular Weight
499.353
Exact Mass
498.109
No. of atoms
54
No. of bonds
59
Polar Surface Area
127.99
LOGP Value
3.77 (
Computed with XLOGP3
)
4.44 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 6
Canonical SMILES
Cc1ncn(n1)c1ccc(c(c1)Cl)C(=O)N[C@@H]1[C@H]2CC[C@@H]1N(C2)c1ncc(c2c1onc2N)Cl
InChI String
InChI=1S/C22H20Cl2N8O2/c1-10-27-9-32(29-10)12-3-4-13(14(23)6-12)22(33)28-18-11-2-5-16(18)31(8-11)21-19-17(15(24)7-26-21)20(25)30-34-19/h3-4,6-7,9,11,16,18H,2,5,8H2,1H3,(H2,25,30)(H,28,33)/t11-,16-,18+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00740
Entrez Gene ID
NCBI Entrez Gene ID:
2158
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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