Browse entries in the PDBbind-CN Database
HEADER 3VBG_COMPLEX COMPND 3VBG_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 84 THR LEU VAL ARG PRO LYS PRO GLU LEU LEU LYS LEU LEU SEQRES 2 A 84 LYS SER VAL GLY ALA GLN LYS ASP THR TYR THR MET LYS SEQRES 3 A 84 GLU VAL LEU PHE TYR LEU GLY GLN TYR ILE MET THR LYS SEQRES 4 A 84 ARG LEU TYR ASP GLU LYS GLN GLN HIS ILE VAL TYR CYS SEQRES 5 A 84 SER ASN ASP LEU LEU GLY ASP LEU PHE GLY VAL PRO SER SEQRES 6 A 84 PHE SER VAL LYS GLU HIS ARG LYS ILE TYR THR MET ILE SEQRES 7 A 84 TYR ARG ASN LEU VAL VAL SEQRES 1 B 85 GLU THR LEU VAL ARG PRO LYS PRO GLU LEU LEU LYS LEU SEQRES 2 B 85 LEU LYS SER VAL GLY ALA GLN LYS ASP THR TYR THR MET SEQRES 3 B 85 LYS GLU VAL LEU PHE TYR LEU GLY GLN TYR ILE MET THR SEQRES 4 B 85 LYS ARG LEU TYR ASP GLU LYS GLN GLN HIS ILE VAL TYR SEQRES 5 B 85 CYS SER ASN ASP LEU LEU GLY ASP LEU PHE GLY VAL PRO SEQRES 6 B 85 SER PHE SER VAL LYS GLU HIS ARG LYS ILE TYR THR MET SEQRES 7 B 85 ILE TYR ARG ASN LEU VAL VAL HET UNN A 181 42 ATOM 1 N THR A 26 0.656 1.427 -16.656 1.00124.61 N ATOM 2 CA THR A 26 1.454 1.262 -17.923 1.00123.54 C ATOM 3 C THR A 26 1.286 -0.116 -18.564 1.00120.37 C ATOM 4 O THR A 26 2.270 -0.694 -19.056 1.00125.37 O ATOM 5 CB THR A 26 2.982 1.508 -17.730 1.00127.71 C ATOM 6 OG1 THR A 26 3.234 2.801 -17.135 1.00123.01 O ATOM 7 CG2 THR A 26 3.704 1.416 -19.093 1.00123.91 C ATOM 8 HA THR A 26 1.043 2.027 -18.582 1.00 0.00 H ATOM 9 HB THR A 26 3.365 0.741 -17.057 1.00 0.00 H ATOM 10 HG1 THR A 26 4.210 2.928 -17.025 1.00 0.00 H ATOM 11 HG23 THR A 26 3.512 0.440 -19.539 1.00 0.00 H ATOM 12 HG21 THR A 26 3.331 2.199 -19.754 1.00 0.00 H ATOM 13 HG22 THR A 26 4.776 1.545 -18.944 1.00 0.00 H ATOM 14 HN3 THR A 26 0.961 0.717 -15.961 1.00 0.00 H ATOM 15 HN2 THR A 26 -0.355 1.298 -16.865 1.00 0.00 H ATOM 16 HN1 THR A 26 0.812 2.380 -16.271 1.00 0.00 H ATOM 17 N LEU A 27 0.045 -0.604 -18.588 1.00105.42 N ATOM 18 CA LEU A 27 -0.352 -1.975 -18.959 1.00108.88 C ATOM 19 C LEU A 27 0.091 -2.491 -20.409 1.00126.03 C ATOM 20 O LEU A 27 0.446 -1.648 -21.253 1.00137.05 O ATOM 21 CB LEU A 27 -1.891 -2.074 -18.735 1.00110.98 C ATOM 22 CG LEU A 27 -2.720 -2.150 -17.364 1.00108.70 C ATOM 23 CD1 LEU A 27 -3.312 -3.532 -17.064 1.00 91.61 C ATOM 24 CD2 LEU A 27 -2.128 -1.593 -16.062 1.00 97.43 C ATOM 25 HA LEU A 27 0.204 -2.659 -18.318 1.00 0.00 H ATOM 26 HB2 LEU A 27 -2.293 -1.198 -19.244 1.00 0.00 H ATOM 27 HB3 LEU A 27 -2.184 -2.974 -19.276 1.00 0.00 H ATOM 28 HG LEU A 27 -3.483 -1.424 -17.644 1.00 0.00 H ATOM 29 HD21 LEU A 27 -1.200 -2.117 -15.833 1.00 0.00 H ATOM 30 HD22 LEU A 27 -1.925 -0.529 -16.183 1.00 0.00 H ATOM 31 HD23 LEU A 27 -2.840 -1.739 -15.249 1.00 0.00 H ATOM 32 HD11 LEU A 27 -3.993 -3.816 -17.866 1.00 0.00 H ATOM 33 HD12 LEU A 27 -2.507 -4.263 -16.993 1.00 0.00 H ATOM 34 HD13 LEU A 27 -3.856 -3.496 -16.120 1.00 0.00 H ATOM 35 H LEU A 27 -0.719 0.048 -18.318 1.00 0.00 H ATOM 36 N VAL A 28 0.107 -3.825 -20.692 1.00113.65 N ATOM 37 CA VAL A 28 0.433 -4.346 -22.075 1.00120.98 C ATOM 38 C VAL A 28 -0.318 -5.623 -22.574 1.00128.82 C ATOM 39 O VAL A 28 -1.254 -6.112 -21.938 1.00120.97 O ATOM 40 CB VAL A 28 1.973 -4.480 -22.418 1.00121.93 C ATOM 41 CG1 VAL A 28 2.188 -4.464 -23.933 1.00125.59 C ATOM 42 CG2 VAL A 28 2.834 -3.376 -21.813 1.00120.41 C ATOM 43 HA VAL A 28 0.019 -3.512 -22.641 1.00 0.00 H ATOM 44 HB VAL A 28 2.283 -5.429 -21.981 1.00 0.00 H ATOM 45 HG11 VAL A 28 1.650 -5.298 -24.384 1.00 0.00 H ATOM 46 HG12 VAL A 28 1.814 -3.525 -24.342 1.00 0.00 H ATOM 47 HG13 VAL A 28 3.252 -4.557 -24.149 1.00 0.00 H ATOM 48 HG21 VAL A 28 2.500 -2.409 -22.189 1.00 0.00 H ATOM 49 HG22 VAL A 28 2.740 -3.397 -20.727 1.00 0.00 H ATOM 50 HG23 VAL A 28 3.876 -3.536 -22.092 1.00 0.00 H ATOM 51 H VAL A 28 -0.111 -4.504 -19.935 1.00 0.00 H ATOM 52 N ARG A 29 0.084 -6.125 -23.749 1.00130.27 N ATOM 53 CA ARG A 29 -0.497 -7.345 -24.346 1.00145.01 C ATOM 54 C ARG A 29 0.528 -8.271 -25.039 1.00144.94 C ATOM 55 O ARG A 29 1.178 -7.898 -26.021 1.00146.26 O ATOM 56 CB ARG A 29 -1.692 -7.051 -25.275 1.00136.12 C ATOM 57 CG ARG A 29 -2.430 -8.299 -25.769 1.00138.68 C ATOM 58 CD ARG A 29 -3.899 -8.062 -26.122 1.00138.29 C ATOM 59 NE ARG A 29 -4.123 -6.727 -26.668 1.00166.83 N ATOM 60 CZ ARG A 29 -4.649 -5.700 -25.990 1.00177.24 C ATOM 61 NH1 ARG A 29 -5.032 -5.842 -24.717 1.00191.42 N ATOM 62 NH2 ARG A 29 -4.787 -4.521 -26.591 1.00161.37 N ATOM 63 HA ARG A 29 -0.871 -7.900 -23.486 1.00 0.00 H ATOM 64 HB2 ARG A 29 -2.402 -6.427 -24.731 1.00 0.00 H ATOM 65 HB3 ARG A 29 -1.323 -6.506 -26.144 1.00 0.00 H ATOM 66 HG2 ARG A 29 -1.920 -8.668 -26.659 1.00 0.00 H ATOM 67 HG3 ARG A 29 -2.384 -9.056 -24.986 1.00 0.00 H ATOM 68 HD2 ARG A 29 -4.501 -8.179 -25.221 1.00 0.00 H ATOM 69 HD3 ARG A 29 -4.207 -8.801 -26.862 1.00 0.00 H ATOM 70 HE ARG A 29 -3.853 -6.561 -27.659 1.00 0.00 H ATOM 71 HH12 ARG A 29 -5.439 -5.035 -24.203 1.00 0.00 H ATOM 72 HH11 ARG A 29 -4.923 -6.760 -24.240 1.00 0.00 H ATOM 73 HH22 ARG A 29 -5.195 -3.717 -26.072 1.00 0.00 H ATOM 74 HH21 ARG A 29 -4.487 -4.403 -27.580 1.00 0.00 H ATOM 75 H ARG A 29 0.841 -5.633 -24.265 1.00 0.00 H ATOM 76 N PRO A 30 0.687 -9.472 -24.476 1.00140.59 N ATOM 77 CA PRO A 30 1.445 -10.622 -24.958 1.00144.74 C ATOM 78 C PRO A 30 0.884 -11.253 -26.230 1.00139.58 C ATOM 79 O PRO A 30 -0.231 -11.759 -26.189 1.00129.09 O ATOM 80 CB PRO A 30 1.282 -11.642 -23.815 1.00135.80 C ATOM 81 CG PRO A 30 0.187 -11.131 -22.950 1.00121.46 C ATOM 82 CD PRO A 30 0.279 -9.650 -23.072 1.00136.02 C ATOM 83 HA PRO A 30 2.465 -10.327 -25.204 1.00 0.00 H ATOM 84 HD3 PRO A 30 -0.684 -9.178 -22.878 1.00 0.00 H ATOM 85 HD2 PRO A 30 1.026 -9.244 -22.390 1.00 0.00 H ATOM 86 HG3 PRO A 30 0.334 -11.443 -21.916 1.00 0.00 H ATOM 87 HG2 PRO A 30 -0.781 -11.488 -23.302 1.00 0.00 H ATOM 88 HB2 PRO A 30 1.020 -12.621 -24.217 1.00 0.00 H ATOM 89 HB3 PRO A 30 2.208 -11.721 -23.245 1.00 0.00 H ATOM 90 N LYS A 31 1.668 -11.273 -27.316 1.00132.61 N ATOM 91 CA LYS A 31 1.286 -11.961 -28.559 1.00127.14 C ATOM 92 C LYS A 31 0.721 -13.346 -28.294 1.00131.74 C ATOM 93 O LYS A 31 1.035 -13.978 -27.295 1.00138.73 O ATOM 94 CB LYS A 31 2.465 -12.064 -29.509 1.00114.23 C ATOM 95 CG LYS A 31 2.734 -10.773 -30.246 1.00118.95 C ATOM 96 CD LYS A 31 4.115 -10.801 -30.842 1.00114.33 C ATOM 97 CE LYS A 31 4.622 -9.410 -31.141 1.00102.98 C ATOM 98 NZ LYS A 31 6.066 -9.658 -31.404 1.00111.02 N ATOM 99 HA LYS A 31 0.504 -11.359 -29.022 1.00 0.00 H ATOM 100 HB2 LYS A 31 3.353 -12.330 -28.936 1.00 0.00 H ATOM 101 HB3 LYS A 31 2.258 -12.846 -30.239 1.00 0.00 H ATOM 102 HG2 LYS A 31 1.999 -10.651 -31.042 1.00 0.00 H ATOM 103 HG3 LYS A 31 2.657 -9.937 -29.551 1.00 0.00 H ATOM 104 HD2 LYS A 31 4.794 -11.281 -30.138 1.00 0.00 H ATOM 105 HD3 LYS A 31 4.089 -11.375 -31.768 1.00 0.00 H ATOM 106 HE2 LYS A 31 4.483 -8.745 -30.288 1.00 0.00 H ATOM 107 HE3 LYS A 31 4.127 -8.987 -32.015 1.00 0.00 H ATOM 108 HZ1 LYS A 31 6.504 -10.079 -30.560 1.00 0.00 H ATOM 109 HZ2 LYS A 31 6.164 -10.310 -32.208 1.00 0.00 H ATOM 110 HZ3 LYS A 31 6.536 -8.758 -31.627 1.00 0.00 H ATOM 111 H LYS A 31 2.584 -10.782 -27.279 1.00 0.00 H ATOM 112 N PRO A 32 -0.094 -13.849 -29.217 1.00144.18 N ATOM 113 CA PRO A 32 -0.945 -14.976 -28.806 1.00137.97 C ATOM 114 C PRO A 32 -0.260 -15.945 -27.821 1.00133.38 C ATOM 115 O PRO A 32 -0.817 -16.285 -26.769 1.00137.88 O ATOM 116 CB PRO A 32 -1.259 -15.684 -30.144 1.00145.35 C ATOM 117 CG PRO A 32 -0.410 -15.013 -31.204 1.00142.52 C ATOM 118 CD PRO A 32 -0.049 -13.657 -30.686 1.00135.28 C ATOM 119 HA PRO A 32 -1.825 -14.632 -28.262 1.00 0.00 H ATOM 120 HD3 PRO A 32 0.948 -13.363 -31.014 1.00 0.00 H ATOM 121 HD2 PRO A 32 -0.772 -12.907 -31.007 1.00 0.00 H ATOM 122 HG3 PRO A 32 -0.974 -14.921 -32.132 1.00 0.00 H ATOM 123 HG2 PRO A 32 0.493 -15.597 -31.385 1.00 0.00 H ATOM 124 HB2 PRO A 32 -1.008 -16.743 -30.077 1.00 0.00 H ATOM 125 HB3 PRO A 32 -2.316 -15.577 -30.386 1.00 0.00 H ATOM 126 N GLU A 33 0.951 -16.363 -28.175 1.00124.72 N ATOM 127 CA GLU A 33 1.660 -17.445 -27.497 1.00117.78 C ATOM 128 C GLU A 33 1.968 -17.127 -26.060 1.00111.98 C ATOM 129 O GLU A 33 1.507 -17.794 -25.151 1.00110.80 O ATOM 130 CB GLU A 33 2.975 -17.684 -28.214 1.00119.18 C ATOM 131 CG GLU A 33 2.810 -18.503 -29.470 1.00131.52 C ATOM 132 CD GLU A 33 2.677 -19.990 -29.168 1.00134.07 C ATOM 133 OE1 GLU A 33 3.647 -20.719 -29.487 1.00123.15 O ATOM 134 OE2 GLU A 33 1.631 -20.420 -28.606 1.00124.28 O ATOM 135 HA GLU A 33 1.013 -18.322 -27.518 1.00 0.00 H ATOM 136 HB2 GLU A 33 3.408 -16.720 -28.480 1.00 0.00 H ATOM 137 HB3 GLU A 33 3.650 -18.211 -27.540 1.00 0.00 H ATOM 138 HG2 GLU A 33 1.914 -18.168 -29.994 1.00 0.00 H ATOM 139 HG3 GLU A 33 3.681 -18.350 -30.108 1.00 0.00 H ATOM 140 H GLU A 33 1.419 -15.895 -28.977 1.00 0.00 H ATOM 141 N LEU A 34 2.787 -16.109 -25.864 1.00104.78 N ATOM 142 CA LEU A 34 2.980 -15.583 -24.539 1.00109.16 C ATOM 143 C LEU A 34 1.666 -15.645 -23.733 1.00117.90 C ATOM 144 O LEU A 34 1.596 -16.305 -22.699 1.00121.87 O ATOM 145 CB LEU A 34 3.533 -14.140 -24.591 1.00 97.40 C ATOM 146 CG LEU A 34 3.901 -13.607 -23.198 1.00 88.51 C ATOM 147 CD1 LEU A 34 4.211 -14.771 -22.286 1.00 82.62 C ATOM 148 CD2 LEU A 34 5.107 -12.677 -23.232 1.00 77.62 C ATOM 149 HA LEU A 34 3.719 -16.203 -24.031 1.00 0.00 H ATOM 150 HB2 LEU A 34 4.424 -14.128 -25.218 1.00 0.00 H ATOM 151 HB3 LEU A 34 2.775 -13.489 -25.027 1.00 0.00 H ATOM 152 HG LEU A 34 3.048 -13.036 -22.831 1.00 0.00 H ATOM 153 HD21 LEU A 34 5.969 -13.216 -23.625 1.00 0.00 H ATOM 154 HD22 LEU A 34 4.888 -11.823 -23.873 1.00 0.00 H ATOM 155 HD23 LEU A 34 5.324 -12.329 -22.222 1.00 0.00 H ATOM 156 HD11 LEU A 34 3.335 -15.416 -22.212 1.00 0.00 H ATOM 157 HD12 LEU A 34 5.048 -15.338 -22.694 1.00 0.00 H ATOM 158 HD13 LEU A 34 4.473 -14.396 -21.297 1.00 0.00 H ATOM 159 H LEU A 34 3.293 -15.687 -26.669 1.00 0.00 H ATOM 160 N LEU A 35 0.617 -15.000 -24.218 1.00114.68 N ATOM 161 CA LEU A 35 -0.567 -14.864 -23.391 1.00126.58 C ATOM 162 C LEU A 35 -1.032 -16.228 -22.949 1.00128.79 C ATOM 163 O LEU A 35 -1.461 -16.395 -21.810 1.00154.50 O ATOM 164 CB LEU A 35 -1.683 -14.079 -24.090 1.00137.63 C ATOM 165 CG LEU A 35 -2.424 -12.976 -23.303 1.00145.68 C ATOM 166 CD1 LEU A 35 -2.820 -11.776 -24.192 1.00137.99 C ATOM 167 CD2 LEU A 35 -3.616 -13.504 -22.484 1.00144.87 C ATOM 168 HA LEU A 35 -0.302 -14.279 -22.510 1.00 0.00 H ATOM 169 HB2 LEU A 35 -1.241 -13.605 -24.966 1.00 0.00 H ATOM 170 HB3 LEU A 35 -2.432 -14.803 -24.409 1.00 0.00 H ATOM 171 HG LEU A 35 -1.700 -12.607 -22.576 1.00 0.00 H ATOM 172 HD21 LEU A 35 -4.338 -13.970 -23.155 1.00 0.00 H ATOM 173 HD22 LEU A 35 -3.262 -14.240 -21.762 1.00 0.00 H ATOM 174 HD23 LEU A 35 -4.089 -12.675 -21.957 1.00 0.00 H ATOM 175 HD11 LEU A 35 -1.922 -11.334 -24.624 1.00 0.00 H ATOM 176 HD12 LEU A 35 -3.479 -12.118 -24.990 1.00 0.00 H ATOM 177 HD13 LEU A 35 -3.337 -11.032 -23.586 1.00 0.00 H ATOM 178 H LEU A 35 0.641 -14.597 -25.177 1.00 0.00 H ATOM 179 N LYS A 36 -0.901 -17.228 -23.810 1.00128.85 N ATOM 180 CA LYS A 36 -1.299 -18.578 -23.389 1.00126.80 C ATOM 181 C LYS A 36 -0.255 -19.113 -22.382 1.00119.38 C ATOM 182 O LYS A 36 -0.498 -20.094 -21.645 1.00118.87 O ATOM 183 CB LYS A 36 -1.516 -19.498 -24.602 1.00122.10 C ATOM 184 CG LYS A 36 -2.543 -20.625 -24.416 1.00119.26 C ATOM 185 CD LYS A 36 -1.948 -22.051 -24.396 1.00112.20 C ATOM 186 CE LYS A 36 -0.635 -22.190 -25.169 1.00113.12 C ATOM 187 NZ LYS A 36 -0.852 -22.169 -26.643 1.00127.20 N ATOM 188 HA LYS A 36 -2.263 -18.548 -22.881 1.00 0.00 H ATOM 189 HB2 LYS A 36 -1.847 -18.879 -25.436 1.00 0.00 H ATOM 190 HB3 LYS A 36 -0.558 -19.956 -24.849 1.00 0.00 H ATOM 191 HG2 LYS A 36 -3.060 -20.460 -23.470 1.00 0.00 H ATOM 192 HG3 LYS A 36 -3.260 -20.569 -25.235 1.00 0.00 H ATOM 193 HD2 LYS A 36 -1.766 -22.332 -23.359 1.00 0.00 H ATOM 194 HD3 LYS A 36 -2.677 -22.733 -24.834 1.00 0.00 H ATOM 195 HE2 LYS A 36 -0.163 -23.134 -24.896 1.00 0.00 H ATOM 196 HE3 LYS A 36 0.023 -21.364 -24.898 1.00 0.00 H ATOM 197 HZ1 LYS A 36 -1.474 -22.958 -26.912 1.00 0.00 H ATOM 198 HZ2 LYS A 36 -1.296 -21.268 -26.914 1.00 0.00 H ATOM 199 HZ3 LYS A 36 0.063 -22.266 -27.128 1.00 0.00 H ATOM 200 H LYS A 36 -0.524 -17.060 -24.765 1.00 0.00 H ATOM 201 N LEU A 37 0.901 -18.456 -22.334 1.00105.41 N ATOM 202 CA LEU A 37 1.922 -18.849 -21.355 1.00112.58 C ATOM 203 C LEU A 37 1.507 -18.296 -19.975 1.00120.56 C ATOM 204 O LEU A 37 1.322 -19.063 -19.015 1.00106.57 O ATOM 205 CB LEU A 37 3.282 -18.336 -21.804 1.00103.96 C ATOM 206 CG LEU A 37 4.548 -18.196 -20.947 1.00100.01 C ATOM 207 CD1 LEU A 37 4.313 -17.574 -19.572 1.00101.66 C ATOM 208 CD2 LEU A 37 5.267 -19.514 -20.860 1.00 92.14 C ATOM 209 HA LEU A 37 2.001 -19.933 -21.279 1.00 0.00 H ATOM 210 HB2 LEU A 37 3.571 -18.990 -22.627 1.00 0.00 H ATOM 211 HB3 LEU A 37 3.091 -17.334 -22.188 1.00 0.00 H ATOM 212 HG LEU A 37 5.189 -17.478 -21.459 1.00 0.00 H ATOM 213 HD21 LEU A 37 4.610 -20.256 -20.407 1.00 0.00 H ATOM 214 HD22 LEU A 37 5.548 -19.840 -21.861 1.00 0.00 H ATOM 215 HD23 LEU A 37 6.162 -19.398 -20.249 1.00 0.00 H ATOM 216 HD11 LEU A 37 3.898 -16.573 -19.693 1.00 0.00 H ATOM 217 HD12 LEU A 37 3.614 -18.193 -19.009 1.00 0.00 H ATOM 218 HD13 LEU A 37 5.260 -17.513 -19.035 1.00 0.00 H ATOM 219 H LEU A 37 1.081 -17.667 -22.987 1.00 0.00 H ATOM 220 N LEU A 38 1.318 -16.974 -19.892 1.00112.39 N ATOM 221 CA LEU A 38 0.890 -16.361 -18.656 1.00102.54 C ATOM 222 C LEU A 38 -0.296 -17.100 -18.174 1.00107.49 C ATOM 223 O LEU A 38 -0.418 -17.428 -16.994 1.00108.73 O ATOM 224 CB LEU A 38 0.444 -14.955 -18.889 1.00 83.39 C ATOM 225 CG LEU A 38 1.488 -14.109 -19.590 1.00 88.53 C ATOM 226 CD1 LEU A 38 1.059 -12.709 -19.255 1.00 86.98 C ATOM 227 CD2 LEU A 38 2.959 -14.225 -19.200 1.00 81.37 C ATOM 228 HA LEU A 38 1.720 -16.379 -17.949 1.00 0.00 H ATOM 229 HB2 LEU A 38 -0.457 -14.974 -19.502 1.00 0.00 H ATOM 230 HB3 LEU A 38 0.217 -14.499 -17.926 1.00 0.00 H ATOM 231 HG LEU A 38 1.500 -14.438 -20.629 1.00 0.00 H ATOM 232 HD21 LEU A 38 3.076 -13.967 -18.148 1.00 0.00 H ATOM 233 HD22 LEU A 38 3.297 -15.248 -19.364 1.00 0.00 H ATOM 234 HD23 LEU A 38 3.550 -13.543 -19.811 1.00 0.00 H ATOM 235 HD11 LEU A 38 0.052 -12.538 -19.636 1.00 0.00 H ATOM 236 HD12 LEU A 38 1.067 -12.577 -18.173 1.00 0.00 H ATOM 237 HD13 LEU A 38 1.748 -12.000 -19.714 1.00 0.00 H ATOM 238 H LEU A 38 1.482 -16.379 -20.729 1.00 0.00 H ATOM 239 N LYS A 39 -1.202 -17.369 -19.087 1.00113.15 N ATOM 240 CA LYS A 39 -2.466 -17.872 -18.604 1.00130.61 C ATOM 241 C LYS A 39 -2.291 -19.306 -18.153 1.00123.92 C ATOM 242 O LYS A 39 -3.074 -19.806 -17.360 1.00130.32 O ATOM 243 CB LYS A 39 -3.610 -17.690 -19.614 1.00137.97 C ATOM 244 CG LYS A 39 -4.453 -16.419 -19.426 1.00125.46 C ATOM 245 CD LYS A 39 -5.905 -16.645 -19.877 1.00127.54 C ATOM 246 CE LYS A 39 -6.424 -15.482 -20.723 1.00139.49 C ATOM 247 NZ LYS A 39 -7.800 -15.682 -21.257 1.00145.94 N ATOM 248 HA LYS A 39 -2.772 -17.276 -17.744 1.00 0.00 H ATOM 249 HB2 LYS A 39 -3.176 -17.663 -20.614 1.00 0.00 H ATOM 250 HB3 LYS A 39 -4.274 -18.551 -19.531 1.00 0.00 H ATOM 251 HG2 LYS A 39 -4.447 -16.140 -18.372 1.00 0.00 H ATOM 252 HG3 LYS A 39 -4.018 -15.613 -20.017 1.00 0.00 H ATOM 253 HD2 LYS A 39 -5.953 -17.560 -20.467 1.00 0.00 H ATOM 254 HD3 LYS A 39 -6.537 -16.749 -18.995 1.00 0.00 H ATOM 255 HE2 LYS A 39 -5.747 -15.343 -21.566 1.00 0.00 H ATOM 256 HE3 LYS A 39 -6.424 -14.583 -20.106 1.00 0.00 H ATOM 257 HZ1 LYS A 39 -7.817 -16.530 -21.859 1.00 0.00 H ATOM 258 HZ2 LYS A 39 -8.463 -15.804 -20.465 1.00 0.00 H ATOM 259 HZ3 LYS A 39 -8.077 -14.851 -21.818 1.00 0.00 H ATOM 260 H LYS A 39 -1.019 -17.227 -20.101 1.00 0.00 H ATOM 261 N SER A 40 -1.236 -19.964 -18.620 1.00129.59 N ATOM 262 CA SER A 40 -0.944 -21.289 -18.090 1.00124.75 C ATOM 263 C SER A 40 -0.719 -21.128 -16.587 1.00126.45 C ATOM 264 O SER A 40 -1.148 -21.952 -15.815 1.00120.03 O ATOM 265 CB SER A 40 0.244 -21.958 -18.802 1.00127.99 C ATOM 266 OG SER A 40 1.513 -21.750 -18.176 1.00115.46 O ATOM 267 HA SER A 40 -1.780 -21.964 -18.272 1.00 0.00 H ATOM 268 HB2 SER A 40 0.297 -21.563 -19.817 1.00 0.00 H ATOM 269 HB3 SER A 40 0.056 -23.031 -18.840 1.00 0.00 H ATOM 270 HG SER A 40 1.709 -20.780 -18.143 1.00 0.00 H ATOM 271 H SER A 40 -0.629 -19.541 -19.351 1.00 0.00 H ATOM 272 N VAL A 41 -0.087 -20.031 -16.171 1.00131.87 N ATOM 273 CA VAL A 41 0.117 -19.778 -14.731 1.00120.29 C ATOM 274 C VAL A 41 -0.847 -18.773 -14.148 1.00118.30 C ATOM 275 O VAL A 41 -0.558 -18.169 -13.121 1.00131.57 O ATOM 276 CB VAL A 41 1.554 -19.364 -14.364 1.00109.51 C ATOM 277 CG1 VAL A 41 2.374 -20.611 -14.096 1.00111.68 C ATOM 278 CG2 VAL A 41 2.180 -18.478 -15.446 1.00 99.39 C ATOM 279 HA VAL A 41 -0.083 -20.752 -14.283 1.00 0.00 H ATOM 280 HB VAL A 41 1.535 -18.759 -13.458 1.00 0.00 H ATOM 281 HG11 VAL A 41 1.929 -21.167 -13.271 1.00 0.00 H ATOM 282 HG12 VAL A 41 2.387 -21.235 -14.990 1.00 0.00 H ATOM 283 HG13 VAL A 41 3.393 -20.325 -13.835 1.00 0.00 H ATOM 284 HG21 VAL A 41 2.209 -19.024 -16.389 1.00 0.00 H ATOM 285 HG22 VAL A 41 1.581 -17.575 -15.566 1.00 0.00 H ATOM 286 HG23 VAL A 41 3.194 -18.207 -15.150 1.00 0.00 H ATOM 287 H VAL A 41 0.266 -19.345 -16.869 1.00 0.00 H ATOM 288 N GLY A 42 -1.986 -18.590 -14.809 1.00117.96 N ATOM 289 CA GLY A 42 -3.183 -18.092 -14.126 1.00107.44 C ATOM 290 C GLY A 42 -3.469 -16.620 -14.303 1.00110.03 C ATOM 291 O GLY A 42 -4.239 -16.055 -13.521 1.00119.50 O ATOM 292 HA3 GLY A 42 -3.066 -18.286 -13.060 1.00 0.00 H ATOM 293 HA2 GLY A 42 -4.041 -18.649 -14.503 1.00 0.00 H ATOM 294 H GLY A 42 -2.028 -18.803 -15.826 1.00 0.00 H ATOM 295 N ALA A 43 -2.877 -15.977 -15.311 1.00 97.05 N ATOM 296 CA ALA A 43 -3.402 -14.689 -15.676 1.00100.19 C ATOM 297 C ALA A 43 -4.783 -14.930 -16.260 1.00120.89 C ATOM 298 O ALA A 43 -5.184 -16.076 -16.562 1.00117.79 O ATOM 299 CB ALA A 43 -2.532 -13.991 -16.682 1.00 90.42 C ATOM 300 HA ALA A 43 -3.440 -14.043 -14.799 1.00 0.00 H ATOM 301 HB1 ALA A 43 -1.537 -13.847 -16.262 1.00 0.00 H ATOM 302 HB2 ALA A 43 -2.462 -14.599 -17.584 1.00 0.00 H ATOM 303 HB3 ALA A 43 -2.968 -13.023 -16.928 1.00 0.00 H ATOM 304 H ALA A 43 -2.066 -16.392 -15.814 1.00 0.00 H ATOM 305 N GLN A 44 -5.499 -13.838 -16.446 1.00134.71 N ATOM 306 CA GLN A 44 -6.849 -13.903 -16.944 1.00145.14 C ATOM 307 C GLN A 44 -7.195 -12.568 -17.596 1.00162.09 C ATOM 308 O GLN A 44 -8.378 -12.230 -17.734 1.00173.68 O ATOM 309 CB GLN A 44 -7.806 -14.217 -15.789 1.00142.81 C ATOM 310 CG GLN A 44 -7.498 -13.477 -14.483 1.00143.34 C ATOM 311 CD GLN A 44 -8.399 -13.926 -13.341 1.00135.60 C ATOM 312 OE1 GLN A 44 -7.938 -14.351 -12.275 1.00122.32 O ATOM 313 NE2 GLN A 44 -9.692 -13.857 -13.575 1.00137.01 N ATOM 314 HA GLN A 44 -6.944 -14.694 -17.687 1.00 0.00 H ATOM 315 HB2 GLN A 44 -8.815 -13.949 -16.102 1.00 0.00 H ATOM 316 HB3 GLN A 44 -7.760 -15.288 -15.592 1.00 0.00 H ATOM 317 HG2 GLN A 44 -6.461 -13.667 -14.208 1.00 0.00 H ATOM 318 HG3 GLN A 44 -7.640 -12.408 -14.643 1.00 0.00 H ATOM 319 HE22 GLN A 44 -10.037 -13.493 -14.486 1.00 0.00 H ATOM 320 HE21 GLN A 44 -10.369 -14.167 -12.849 1.00 0.00 H ATOM 321 H GLN A 44 -5.080 -12.911 -16.229 1.00 0.00 H ATOM 322 N LYS A 45 -6.163 -11.819 -18.007 1.00147.32 N ATOM 323 CA LYS A 45 -6.348 -10.466 -18.557 1.00132.89 C ATOM 324 C LYS A 45 -5.743 -10.342 -20.010 1.00135.14 C ATOM 325 O LYS A 45 -5.733 -11.330 -20.745 1.00151.96 O ATOM 326 CB LYS A 45 -5.830 -9.464 -17.505 1.00133.83 C ATOM 327 CG LYS A 45 -6.378 -9.749 -16.082 1.00122.59 C ATOM 328 CD LYS A 45 -5.572 -9.167 -14.932 1.00107.48 C ATOM 329 CE LYS A 45 -5.058 -7.772 -15.278 1.00117.51 C ATOM 330 NZ LYS A 45 -4.172 -7.105 -14.261 1.00106.94 N ATOM 331 HA LYS A 45 -7.398 -10.229 -18.725 1.00 0.00 H ATOM 332 HB2 LYS A 45 -4.742 -9.520 -17.477 1.00 0.00 H ATOM 333 HB3 LYS A 45 -6.134 -8.460 -17.801 1.00 0.00 H ATOM 334 HG2 LYS A 45 -7.387 -9.340 -16.024 1.00 0.00 H ATOM 335 HG3 LYS A 45 -6.417 -10.830 -15.949 1.00 0.00 H ATOM 336 HD2 LYS A 45 -6.206 -9.105 -14.047 1.00 0.00 H ATOM 337 HD3 LYS A 45 -4.723 -9.819 -14.725 1.00 0.00 H ATOM 338 HE2 LYS A 45 -5.925 -7.130 -15.433 1.00 0.00 H ATOM 339 HE3 LYS A 45 -4.494 -7.849 -16.208 1.00 0.00 H ATOM 340 HZ1 LYS A 45 -4.691 -7.001 -13.366 1.00 0.00 H ATOM 341 HZ2 LYS A 45 -3.325 -7.688 -14.106 1.00 0.00 H ATOM 342 HZ3 LYS A 45 -3.890 -6.167 -14.611 1.00 0.00 H ATOM 343 H LYS A 45 -5.200 -12.206 -17.935 1.00 0.00 H ATOM 344 N ASP A 46 -5.269 -9.171 -20.435 1.00132.79 N ATOM 345 CA ASP A 46 -4.551 -8.993 -21.722 1.00129.98 C ATOM 346 C ASP A 46 -3.598 -7.874 -21.487 1.00130.29 C ATOM 347 O ASP A 46 -2.729 -7.561 -22.317 1.00117.15 O ATOM 348 CB ASP A 46 -5.474 -8.427 -22.791 1.00146.10 C ATOM 349 CG ASP A 46 -6.282 -9.474 -23.471 1.00156.03 C ATOM 350 OD1 ASP A 46 -7.397 -9.142 -23.923 1.00149.55 O ATOM 351 OD2 ASP A 46 -5.808 -10.624 -23.553 1.00164.10 O ATOM 352 HA ASP A 46 -4.123 -9.947 -22.028 1.00 0.00 H ATOM 353 HB2 ASP A 46 -6.152 -7.713 -22.323 1.00 0.00 H ATOM 354 HB3 ASP A 46 -4.868 -7.915 -23.538 1.00 0.00 H ATOM 355 H ASP A 46 -5.410 -8.336 -19.832 1.00 0.00 H ATOM 356 N THR A 47 -3.814 -7.248 -20.340 1.00125.58 N ATOM 357 CA THR A 47 -3.167 -5.992 -19.992 1.00138.91 C ATOM 358 C THR A 47 -2.387 -6.082 -18.600 1.00135.19 C ATOM 359 O THR A 47 -2.990 -6.483 -17.570 1.00133.28 O ATOM 360 CB THR A 47 -4.145 -4.754 -20.239 1.00141.78 C ATOM 361 OG1 THR A 47 -5.503 -5.175 -20.566 1.00125.93 O ATOM 362 CG2 THR A 47 -3.619 -3.923 -21.405 1.00133.80 C ATOM 363 HA THR A 47 -2.347 -5.784 -20.680 1.00 0.00 H ATOM 364 HB THR A 47 -4.174 -4.178 -19.314 1.00 0.00 H ATOM 365 HG1 THR A 47 -6.069 -4.376 -20.710 1.00 0.00 H ATOM 366 HG23 THR A 47 -2.603 -3.595 -21.186 1.00 0.00 H ATOM 367 HG21 THR A 47 -3.619 -4.529 -22.311 1.00 0.00 H ATOM 368 HG22 THR A 47 -4.260 -3.053 -21.548 1.00 0.00 H ATOM 369 H THR A 47 -4.475 -7.673 -19.658 1.00 0.00 H ATOM 370 N TYR A 48 -1.074 -5.723 -18.604 1.00118.00 N ATOM 371 CA TYR A 48 -0.069 -6.067 -17.552 1.00109.60 C ATOM 372 C TYR A 48 1.076 -5.041 -17.472 1.00114.75 C ATOM 373 O TYR A 48 1.625 -4.687 -18.510 1.00129.25 O ATOM 374 CB TYR A 48 0.625 -7.389 -17.933 1.00115.52 C ATOM 375 CG TYR A 48 -0.303 -8.567 -18.232 1.00118.20 C ATOM 376 CD1 TYR A 48 -0.701 -8.891 -19.543 1.00111.75 C ATOM 377 CD2 TYR A 48 -0.787 -9.359 -17.190 1.00118.58 C ATOM 378 CE1 TYR A 48 -1.574 -9.968 -19.781 1.00121.50 C ATOM 379 CE2 TYR A 48 -1.635 -10.439 -17.425 1.00117.36 C ATOM 380 CZ TYR A 48 -2.042 -10.744 -18.706 1.00117.43 C ATOM 381 OH TYR A 48 -2.904 -11.831 -18.866 1.00119.84 O ATOM 382 HA TYR A 48 -0.616 -6.107 -16.610 1.00 0.00 H ATOM 383 HB3 TYR A 48 1.274 -7.676 -17.106 1.00 0.00 H ATOM 384 HB2 TYR A 48 1.230 -7.206 -18.821 1.00 0.00 H ATOM 385 HD2 TYR A 48 -0.494 -9.127 -16.166 1.00 0.00 H ATOM 386 HE2 TYR A 48 -1.979 -11.048 -16.589 1.00 0.00 H ATOM 387 HE1 TYR A 48 -1.888 -10.201 -20.799 1.00 0.00 H ATOM 388 HD1 TYR A 48 -0.329 -8.302 -20.381 1.00 0.00 H ATOM 389 HH TYR A 48 -3.118 -11.942 -19.826 1.00 0.00 H ATOM 390 H TYR A 48 -0.740 -5.159 -19.411 1.00 0.00 H ATOM 391 N THR A 49 1.519 -4.600 -16.295 1.00108.52 N ATOM 392 CA THR A 49 2.741 -3.796 -16.334 1.00114.74 C ATOM 393 C THR A 49 3.786 -4.818 -16.426 1.00118.48 C ATOM 394 O THR A 49 3.594 -5.944 -15.973 1.00113.77 O ATOM 395 CB THR A 49 3.100 -3.021 -15.043 1.00122.33 C ATOM 396 OG1 THR A 49 2.912 -3.874 -13.890 1.00108.59 O ATOM 397 CG2 THR A 49 2.296 -1.698 -14.948 1.00111.38 C ATOM 398 HA THR A 49 2.631 -3.055 -17.126 1.00 0.00 H ATOM 399 HB THR A 49 4.152 -2.737 -15.072 1.00 0.00 H ATOM 400 HG1 THR A 49 3.498 -4.668 -13.969 1.00 0.00 H ATOM 401 HG23 THR A 49 2.477 -1.100 -15.841 1.00 0.00 H ATOM 402 HG21 THR A 49 1.233 -1.925 -14.870 1.00 0.00 H ATOM 403 HG22 THR A 49 2.615 -1.143 -14.066 1.00 0.00 H ATOM 404 H THR A 49 1.027 -4.814 -15.404 1.00 0.00 H ATOM 405 N MET A 50 4.914 -4.432 -16.995 1.00121.98 N ATOM 406 CA MET A 50 6.083 -5.256 -16.889 1.00114.11 C ATOM 407 C MET A 50 6.111 -5.853 -15.502 1.00121.43 C ATOM 408 O MET A 50 5.869 -7.059 -15.337 1.00115.02 O ATOM 409 CB MET A 50 7.311 -4.426 -17.141 1.00115.69 C ATOM 410 CG MET A 50 7.399 -4.132 -18.619 1.00128.91 C ATOM 411 SD MET A 50 7.470 -5.683 -19.556 1.00131.72 S ATOM 412 CE MET A 50 9.249 -5.887 -19.441 1.00110.95 C ATOM 413 HA MET A 50 6.061 -6.056 -17.629 1.00 0.00 H ATOM 414 HB2 MET A 50 7.244 -3.492 -16.584 1.00 0.00 H ATOM 415 HB3 MET A 50 8.197 -4.975 -16.822 1.00 0.00 H ATOM 416 HG2 MET A 50 8.297 -3.548 -18.818 1.00 0.00 H ATOM 417 HG3 MET A 50 6.522 -3.563 -18.927 1.00 0.00 H ATOM 418 HE1 MET A 50 9.742 -5.031 -19.902 1.00 0.00 H ATOM 419 HE2 MET A 50 9.539 -5.953 -18.392 1.00 0.00 H ATOM 420 HE3 MET A 50 9.543 -6.800 -19.959 1.00 0.00 H ATOM 421 H MET A 50 4.954 -3.534 -17.518 1.00 0.00 H ATOM 422 N LYS A 51 6.349 -5.015 -14.494 1.00118.54 N ATOM 423 CA LYS A 51 6.544 -5.560 -13.155 1.00108.19 C ATOM 424 C LYS A 51 5.484 -6.636 -12.922 1.00102.71 C ATOM 425 O LYS A 51 5.785 -7.720 -12.422 1.00117.95 O ATOM 426 CB LYS A 51 6.600 -4.447 -12.088 1.00105.44 C ATOM 427 CG LYS A 51 6.201 -4.820 -10.673 1.00 97.33 C ATOM 428 CD LYS A 51 6.641 -3.682 -9.747 1.00104.42 C ATOM 429 CE LYS A 51 6.356 -3.956 -8.256 1.00 98.56 C ATOM 430 NZ LYS A 51 7.171 -2.976 -7.524 1.00 86.36 N ATOM 431 HA LYS A 51 7.518 -6.041 -13.064 1.00 0.00 H ATOM 432 HB2 LYS A 51 7.625 -4.078 -12.053 1.00 0.00 H ATOM 433 HB3 LYS A 51 5.937 -3.646 -12.415 1.00 0.00 H ATOM 434 HG2 LYS A 51 5.120 -4.950 -10.614 1.00 0.00 H ATOM 435 HG3 LYS A 51 6.693 -5.748 -10.381 1.00 0.00 H ATOM 436 HD2 LYS A 51 7.713 -3.531 -9.871 1.00 0.00 H ATOM 437 HD3 LYS A 51 6.111 -2.775 -10.039 1.00 0.00 H ATOM 438 HE2 LYS A 51 6.648 -4.972 -7.991 1.00 0.00 H ATOM 439 HE3 LYS A 51 5.298 -3.815 -8.036 1.00 0.00 H ATOM 440 HZ1 LYS A 51 8.175 -3.120 -7.755 1.00 0.00 H ATOM 441 HZ2 LYS A 51 6.885 -2.015 -7.799 1.00 0.00 H ATOM 442 HZ3 LYS A 51 7.028 -3.103 -6.502 1.00 0.00 H ATOM 443 H LYS A 51 6.395 -3.989 -14.659 1.00 0.00 H ATOM 444 N GLU A 52 4.279 -6.387 -13.399 1.00110.28 N ATOM 445 CA GLU A 52 3.156 -7.324 -13.217 1.00114.05 C ATOM 446 C GLU A 52 3.297 -8.552 -14.090 1.00113.92 C ATOM 447 O GLU A 52 2.766 -9.626 -13.777 1.00127.08 O ATOM 448 CB GLU A 52 1.848 -6.619 -13.569 1.00124.05 C ATOM 449 CG GLU A 52 0.612 -7.458 -13.347 1.00133.38 C ATOM 450 CD GLU A 52 -0.622 -6.599 -13.275 1.00150.34 C ATOM 451 OE1 GLU A 52 -0.563 -5.433 -13.751 1.00153.20 O ATOM 452 OE2 GLU A 52 -1.636 -7.096 -12.748 1.00145.54 O ATOM 453 HA GLU A 52 3.158 -7.644 -12.175 1.00 0.00 H ATOM 454 HB2 GLU A 52 1.767 -5.722 -12.955 1.00 0.00 H ATOM 455 HB3 GLU A 52 1.885 -6.336 -14.621 1.00 0.00 H ATOM 456 HG2 GLU A 52 0.507 -8.163 -14.172 1.00 0.00 H ATOM 457 HG3 GLU A 52 0.718 -8.008 -12.412 1.00 0.00 H ATOM 458 H GLU A 52 4.117 -5.502 -13.920 1.00 0.00 H ATOM 459 N VAL A 53 3.994 -8.415 -15.212 1.00 97.03 N ATOM 460 CA VAL A 53 4.078 -9.584 -16.055 1.00 95.01 C ATOM 461 C VAL A 53 5.143 -10.463 -15.512 1.00 95.22 C ATOM 462 O VAL A 53 4.931 -11.666 -15.371 1.00113.98 O ATOM 463 CB VAL A 53 4.316 -9.287 -17.566 1.00 99.10 C ATOM 464 CG1 VAL A 53 5.791 -9.276 -17.981 1.00 83.75 C ATOM 465 CG2 VAL A 53 3.653 -10.376 -18.365 1.00101.77 C ATOM 466 HA VAL A 53 3.104 -10.073 -16.031 1.00 0.00 H ATOM 467 HB VAL A 53 3.911 -8.292 -17.750 1.00 0.00 H ATOM 468 HG11 VAL A 53 6.320 -8.508 -17.417 1.00 0.00 H ATOM 469 HG12 VAL A 53 6.233 -10.250 -17.773 1.00 0.00 H ATOM 470 HG13 VAL A 53 5.866 -9.062 -19.047 1.00 0.00 H ATOM 471 HG21 VAL A 53 4.089 -11.338 -18.097 1.00 0.00 H ATOM 472 HG22 VAL A 53 2.585 -10.386 -18.147 1.00 0.00 H ATOM 473 HG23 VAL A 53 3.806 -10.190 -19.428 1.00 0.00 H ATOM 474 H VAL A 53 4.453 -7.518 -15.469 1.00 0.00 H ATOM 475 N LEU A 54 6.297 -9.865 -15.209 1.00 84.64 N ATOM 476 CA LEU A 54 7.430 -10.659 -14.799 1.00 83.36 C ATOM 477 C LEU A 54 6.980 -11.549 -13.620 1.00 84.69 C ATOM 478 O LEU A 54 7.501 -12.661 -13.411 1.00 87.87 O ATOM 479 CB LEU A 54 8.549 -9.773 -14.330 1.00 79.06 C ATOM 480 CG LEU A 54 9.275 -8.850 -15.265 1.00 83.44 C ATOM 481 CD1 LEU A 54 10.355 -7.963 -14.550 1.00 77.66 C ATOM 482 CD2 LEU A 54 9.877 -9.771 -16.320 1.00 77.78 C ATOM 483 HA LEU A 54 7.782 -11.257 -15.639 1.00 0.00 H ATOM 484 HB2 LEU A 54 8.132 -9.145 -13.543 1.00 0.00 H ATOM 485 HB3 LEU A 54 9.304 -10.434 -13.905 1.00 0.00 H ATOM 486 HG LEU A 54 8.600 -8.113 -15.700 1.00 0.00 H ATOM 487 HD21 LEU A 54 10.553 -10.478 -15.840 1.00 0.00 H ATOM 488 HD22 LEU A 54 9.078 -10.315 -16.824 1.00 0.00 H ATOM 489 HD23 LEU A 54 10.429 -9.176 -17.048 1.00 0.00 H ATOM 490 HD11 LEU A 54 9.873 -7.348 -13.790 1.00 0.00 H ATOM 491 HD12 LEU A 54 11.099 -8.607 -14.080 1.00 0.00 H ATOM 492 HD13 LEU A 54 10.840 -7.321 -15.285 1.00 0.00 H ATOM 493 H LEU A 54 6.379 -8.830 -15.268 1.00 0.00 H ATOM 494 N PHE A 55 6.008 -11.069 -12.858 1.00 79.17 N ATOM 495 CA PHE A 55 5.604 -11.858 -11.722 1.00 99.66 C ATOM 496 C PHE A 55 5.178 -13.210 -12.239 1.00 99.70 C ATOM 497 O PHE A 55 5.600 -14.261 -11.755 1.00111.12 O ATOM 498 CB PHE A 55 4.463 -11.210 -10.937 1.00102.01 C ATOM 499 CG PHE A 55 3.754 -12.168 -10.025 1.00 96.71 C ATOM 500 CD1 PHE A 55 4.207 -12.414 -8.696 1.00112.13 C ATOM 501 CD2 PHE A 55 2.667 -12.852 -10.495 1.00 94.66 C ATOM 502 CE1 PHE A 55 3.539 -13.321 -7.874 1.00105.62 C ATOM 503 CE2 PHE A 55 1.982 -13.748 -9.691 1.00 98.44 C ATOM 504 CZ PHE A 55 2.417 -13.994 -8.385 1.00 98.83 C ATOM 505 HA PHE A 55 6.442 -11.942 -11.030 1.00 0.00 H ATOM 506 HB2 PHE A 55 4.873 -10.398 -10.336 1.00 0.00 H ATOM 507 HB3 PHE A 55 3.740 -10.806 -11.646 1.00 0.00 H ATOM 508 HD2 PHE A 55 2.334 -12.689 -11.520 1.00 0.00 H ATOM 509 HE2 PHE A 55 1.102 -14.262 -10.077 1.00 0.00 H ATOM 510 HZ PHE A 55 1.883 -14.711 -7.761 1.00 0.00 H ATOM 511 HE1 PHE A 55 3.881 -13.504 -6.855 1.00 0.00 H ATOM 512 HD1 PHE A 55 5.084 -11.888 -8.319 1.00 0.00 H ATOM 513 H PHE A 55 5.554 -10.158 -13.072 1.00 0.00 H ATOM 514 N TYR A 56 4.345 -13.160 -13.260 1.00113.23 N ATOM 515 CA TYR A 56 3.818 -14.360 -13.869 1.00106.43 C ATOM 516 C TYR A 56 4.924 -15.201 -14.511 1.00105.71 C ATOM 517 O TYR A 56 4.917 -16.444 -14.365 1.00102.17 O ATOM 518 CB TYR A 56 2.758 -13.966 -14.853 1.00107.19 C ATOM 519 CG TYR A 56 1.386 -13.769 -14.218 1.00110.03 C ATOM 520 CD1 TYR A 56 0.778 -14.825 -13.540 1.00103.71 C ATOM 521 CD2 TYR A 56 0.678 -12.541 -14.335 1.00109.22 C ATOM 522 CE1 TYR A 56 -0.488 -14.711 -13.003 1.00118.89 C ATOM 523 CE2 TYR A 56 -0.601 -12.398 -13.799 1.00109.05 C ATOM 524 CZ TYR A 56 -1.190 -13.496 -13.126 1.00128.94 C ATOM 525 OH TYR A 56 -2.461 -13.437 -12.545 1.00115.86 O ATOM 526 HA TYR A 56 3.373 -14.996 -13.103 1.00 0.00 H ATOM 527 HB3 TYR A 56 2.680 -14.747 -15.609 1.00 0.00 H ATOM 528 HB2 TYR A 56 3.057 -13.031 -15.328 1.00 0.00 H ATOM 529 HD2 TYR A 56 1.142 -11.700 -14.851 1.00 0.00 H ATOM 530 HE2 TYR A 56 -1.139 -11.455 -13.896 1.00 0.00 H ATOM 531 HE1 TYR A 56 -0.942 -15.557 -12.486 1.00 0.00 H ATOM 532 HD1 TYR A 56 1.317 -15.766 -13.431 1.00 0.00 H ATOM 533 HH TYR A 56 -2.674 -14.311 -12.131 1.00 0.00 H ATOM 534 H TYR A 56 4.060 -12.233 -13.637 1.00 0.00 H ATOM 535 N LEU A 57 5.913 -14.573 -15.149 1.00 84.26 N ATOM 536 CA LEU A 57 7.001 -15.446 -15.594 1.00 86.47 C ATOM 537 C LEU A 57 7.564 -16.312 -14.501 1.00 91.24 C ATOM 538 O LEU A 57 7.664 -17.544 -14.704 1.00 84.86 O ATOM 539 CB LEU A 57 8.149 -14.710 -16.228 1.00 90.03 C ATOM 540 CG LEU A 57 7.666 -14.036 -17.497 1.00 89.49 C ATOM 541 CD1 LEU A 57 8.684 -12.970 -17.840 1.00 83.76 C ATOM 542 CD2 LEU A 57 7.503 -15.062 -18.624 1.00 89.99 C ATOM 543 HA LEU A 57 6.516 -16.072 -16.343 1.00 0.00 H ATOM 544 HB2 LEU A 57 8.527 -13.958 -15.536 1.00 0.00 H ATOM 545 HB3 LEU A 57 8.946 -15.414 -16.469 1.00 0.00 H ATOM 546 HG LEU A 57 6.685 -13.582 -17.359 1.00 0.00 H ATOM 547 HD21 LEU A 57 8.463 -15.540 -18.820 1.00 0.00 H ATOM 548 HD22 LEU A 57 6.775 -15.816 -18.325 1.00 0.00 H ATOM 549 HD23 LEU A 57 7.156 -14.557 -19.526 1.00 0.00 H ATOM 550 HD11 LEU A 57 8.748 -12.254 -17.021 1.00 0.00 H ATOM 551 HD12 LEU A 57 9.657 -13.435 -17.995 1.00 0.00 H ATOM 552 HD13 LEU A 57 8.377 -12.456 -18.751 1.00 0.00 H ATOM 553 H LEU A 57 5.911 -13.547 -15.317 1.00 0.00 H ATOM 554 N GLY A 58 7.974 -15.677 -13.377 1.00 99.94 N ATOM 555 CA GLY A 58 8.462 -16.398 -12.142 1.00 76.43 C ATOM 556 C GLY A 58 7.551 -17.573 -12.009 1.00 70.30 C ATOM 557 O GLY A 58 8.002 -18.724 -12.067 1.00 72.46 O ATOM 558 HA3 GLY A 58 8.390 -15.754 -11.266 1.00 0.00 H ATOM 559 HA2 GLY A 58 9.495 -16.723 -12.268 1.00 0.00 H ATOM 560 H GLY A 58 7.952 -14.637 -13.363 1.00 0.00 H ATOM 561 N GLN A 59 6.247 -17.354 -11.957 1.00 69.00 N ATOM 562 CA GLN A 59 5.378 -18.554 -11.703 1.00 76.28 C ATOM 563 C GLN A 59 5.828 -19.665 -12.669 1.00 83.63 C ATOM 564 O GLN A 59 6.428 -20.675 -12.235 1.00 85.88 O ATOM 565 CB GLN A 59 3.890 -18.218 -11.857 1.00 85.36 C ATOM 566 CG GLN A 59 3.058 -18.144 -10.589 1.00 93.41 C ATOM 567 CD GLN A 59 3.869 -17.699 -9.385 1.00 99.28 C ATOM 568 OE1 GLN A 59 4.703 -18.458 -8.870 1.00 98.55 O ATOM 569 NE2 GLN A 59 3.647 -16.471 -8.946 1.00 81.81 N ATOM 570 HA GLN A 59 5.493 -18.893 -10.674 1.00 0.00 H ATOM 571 HB2 GLN A 59 3.822 -17.248 -12.350 1.00 0.00 H ATOM 572 HB3 GLN A 59 3.446 -18.981 -12.496 1.00 0.00 H ATOM 573 HG2 GLN A 59 2.245 -17.434 -10.745 1.00 0.00 H ATOM 574 HG3 GLN A 59 2.643 -19.131 -10.385 1.00 0.00 H ATOM 575 HE22 GLN A 59 2.936 -15.873 -9.413 1.00 0.00 H ATOM 576 HE21 GLN A 59 4.184 -16.104 -8.134 1.00 0.00 H ATOM 577 H GLN A 59 5.845 -16.403 -12.085 1.00 0.00 H ATOM 578 N TYR A 60 5.641 -19.444 -13.982 1.00 84.67 N ATOM 579 CA TYR A 60 6.101 -20.419 -15.018 1.00 87.38 C ATOM 580 C TYR A 60 7.481 -21.056 -14.671 1.00 93.08 C ATOM 581 O TYR A 60 7.616 -22.282 -14.504 1.00108.54 O ATOM 582 CB TYR A 60 6.099 -19.780 -16.444 1.00 95.60 C ATOM 583 CG TYR A 60 6.111 -20.749 -17.674 1.00 99.52 C ATOM 584 CD1 TYR A 60 5.047 -21.647 -17.915 1.00 91.70 C ATOM 585 CD2 TYR A 60 7.177 -20.727 -18.612 1.00101.33 C ATOM 586 CE1 TYR A 60 5.079 -22.501 -18.974 1.00 92.38 C ATOM 587 CE2 TYR A 60 7.202 -21.571 -19.702 1.00 92.34 C ATOM 588 CZ TYR A 60 6.151 -22.458 -19.883 1.00104.33 C ATOM 589 OH TYR A 60 6.144 -23.329 -20.966 1.00108.26 O ATOM 590 HA TYR A 60 5.379 -21.236 -15.022 1.00 0.00 H ATOM 591 HB3 TYR A 60 6.983 -19.147 -16.519 1.00 0.00 H ATOM 592 HB2 TYR A 60 5.204 -19.163 -16.524 1.00 0.00 H ATOM 593 HD2 TYR A 60 7.997 -20.024 -18.466 1.00 0.00 H ATOM 594 HE2 TYR A 60 8.032 -21.542 -20.408 1.00 0.00 H ATOM 595 HE1 TYR A 60 4.272 -23.220 -19.118 1.00 0.00 H ATOM 596 HD1 TYR A 60 4.189 -21.656 -17.243 1.00 0.00 H ATOM 597 HH TYR A 60 6.942 -23.914 -20.923 1.00 0.00 H ATOM 598 H TYR A 60 5.163 -18.571 -14.285 1.00 0.00 H ATOM 599 N ILE A 61 8.509 -20.248 -14.498 1.00 83.96 N ATOM 600 CA ILE A 61 9.788 -20.822 -14.083 1.00 79.36 C ATOM 601 C ILE A 61 9.841 -21.566 -12.726 1.00 92.79 C ATOM 602 O ILE A 61 10.521 -22.630 -12.637 1.00 99.85 O ATOM 603 CB ILE A 61 10.832 -19.733 -14.047 1.00 81.54 C ATOM 604 CG1 ILE A 61 11.020 -19.159 -15.463 1.00 81.31 C ATOM 605 CG2 ILE A 61 12.087 -20.273 -13.395 1.00 75.91 C ATOM 606 CD1 ILE A 61 11.677 -17.809 -15.506 1.00 78.99 C ATOM 607 HA ILE A 61 9.969 -21.593 -14.832 1.00 0.00 H ATOM 608 HB ILE A 61 10.521 -18.888 -13.433 1.00 0.00 H ATOM 609 HG12 ILE A 61 11.634 -19.855 -16.034 1.00 0.00 H ATOM 610 HG13 ILE A 61 10.039 -19.075 -15.930 1.00 0.00 H ATOM 611 HD11 ILE A 61 11.070 -17.093 -14.951 1.00 0.00 H ATOM 612 HD12 ILE A 61 12.667 -17.874 -15.056 1.00 0.00 H ATOM 613 HD13 ILE A 61 11.768 -17.484 -16.542 1.00 0.00 H ATOM 614 HG21 ILE A 61 11.857 -20.596 -12.380 1.00 0.00 H ATOM 615 HG22 ILE A 61 12.459 -21.120 -13.972 1.00 0.00 H ATOM 616 HG23 ILE A 61 12.845 -19.491 -13.366 1.00 0.00 H ATOM 617 H ILE A 61 8.412 -19.224 -14.653 1.00 0.00 H ATOM 618 N MET A 62 9.151 -21.049 -11.686 1.00 87.73 N ATOM 619 CA MET A 62 9.018 -21.832 -10.421 1.00 90.73 C ATOM 620 C MET A 62 8.268 -23.141 -10.611 1.00 88.51 C ATOM 621 O MET A 62 8.804 -24.185 -10.369 1.00 82.60 O ATOM 622 CB MET A 62 8.343 -21.069 -9.293 1.00 93.17 C ATOM 623 CG MET A 62 9.001 -21.311 -7.935 1.00 91.60 C ATOM 624 SD MET A 62 8.041 -20.415 -6.707 1.00115.92 S ATOM 625 CE MET A 62 6.867 -21.667 -6.109 1.00 80.12 C ATOM 626 HA MET A 62 10.052 -22.034 -10.141 1.00 0.00 H ATOM 627 HB2 MET A 62 8.389 -20.003 -9.517 1.00 0.00 H ATOM 628 HB3 MET A 62 7.301 -21.382 -9.236 1.00 0.00 H ATOM 629 HG2 MET A 62 10.027 -20.944 -7.947 1.00 0.00 H ATOM 630 HG3 MET A 62 9.000 -22.376 -7.705 1.00 0.00 H ATOM 631 HE1 MET A 62 6.258 -22.019 -6.942 1.00 0.00 H ATOM 632 HE2 MET A 62 7.418 -22.504 -5.681 1.00 0.00 H ATOM 633 HE3 MET A 62 6.224 -21.226 -5.348 1.00 0.00 H ATOM 634 H MET A 62 8.714 -20.109 -11.766 1.00 0.00 H ATOM 635 N THR A 63 7.029 -23.119 -11.069 1.00 87.13 N ATOM 636 CA THR A 63 6.323 -24.391 -11.161 1.00 85.47 C ATOM 637 C THR A 63 7.023 -25.355 -12.070 1.00 95.02 C ATOM 638 O THR A 63 6.745 -26.520 -11.986 1.00112.25 O ATOM 639 CB THR A 63 4.903 -24.183 -11.637 1.00 84.92 C ATOM 640 OG1 THR A 63 4.840 -22.879 -12.275 1.00 84.08 O ATOM 641 CG2 THR A 63 3.904 -24.200 -10.436 1.00 95.26 C ATOM 642 HA THR A 63 6.309 -24.819 -10.159 1.00 0.00 H ATOM 643 HB THR A 63 4.629 -24.983 -12.325 1.00 0.00 H ATOM 644 HG1 THR A 63 5.091 -22.180 -11.620 1.00 0.00 H ATOM 645 HG23 THR A 63 3.941 -25.174 -9.948 1.00 0.00 H ATOM 646 HG21 THR A 63 4.182 -23.424 -9.723 1.00 0.00 H ATOM 647 HG22 THR A 63 2.894 -24.014 -10.802 1.00 0.00 H ATOM 648 H THR A 63 6.574 -22.228 -11.353 1.00 0.00 H ATOM 649 N LYS A 64 7.939 -24.893 -12.936 1.00101.84 N ATOM 650 CA LYS A 64 8.536 -25.765 -13.962 1.00 98.05 C ATOM 651 C LYS A 64 10.041 -26.055 -13.732 1.00108.45 C ATOM 652 O LYS A 64 10.771 -26.387 -14.671 1.00119.18 O ATOM 653 CB LYS A 64 8.386 -25.120 -15.365 1.00 95.44 C ATOM 654 CG LYS A 64 6.971 -24.980 -15.883 1.00 92.09 C ATOM 655 CD LYS A 64 6.862 -25.087 -17.424 1.00100.48 C ATOM 656 CE LYS A 64 6.431 -26.480 -17.910 1.00105.96 C ATOM 657 NZ LYS A 64 6.357 -26.586 -19.396 1.00116.64 N ATOM 658 HA LYS A 64 7.996 -26.709 -13.894 1.00 0.00 H ATOM 659 HB2 LYS A 64 8.826 -24.124 -15.323 1.00 0.00 H ATOM 660 HB3 LYS A 64 8.942 -25.732 -16.075 1.00 0.00 H ATOM 661 HG2 LYS A 64 6.362 -25.767 -15.439 1.00 0.00 H ATOM 662 HG3 LYS A 64 6.586 -24.007 -15.577 1.00 0.00 H ATOM 663 HD2 LYS A 64 6.129 -24.358 -17.770 1.00 0.00 H ATOM 664 HD3 LYS A 64 7.835 -24.856 -17.856 1.00 0.00 H ATOM 665 HE2 LYS A 64 5.447 -26.702 -17.497 1.00 0.00 H ATOM 666 HE3 LYS A 64 7.151 -27.213 -17.545 1.00 0.00 H ATOM 667 HZ1 LYS A 64 5.666 -25.898 -19.757 1.00 0.00 H ATOM 668 HZ2 LYS A 64 7.293 -26.386 -19.804 1.00 0.00 H ATOM 669 HZ3 LYS A 64 6.061 -27.548 -19.659 1.00 0.00 H ATOM 670 H LYS A 64 8.234 -23.897 -12.881 1.00 0.00 H ATOM 671 N ARG A 65 10.538 -25.923 -12.515 1.00100.80 N ATOM 672 CA ARG A 65 11.974 -26.039 -12.307 1.00 92.01 C ATOM 673 C ARG A 65 12.794 -25.739 -13.564 1.00 90.39 C ATOM 674 O ARG A 65 13.701 -26.481 -13.934 1.00 90.50 O ATOM 675 CB ARG A 65 12.347 -27.410 -11.782 1.00 92.01 C ATOM 676 CG ARG A 65 11.421 -27.943 -10.706 1.00101.44 C ATOM 677 CD ARG A 65 11.579 -27.207 -9.384 1.00 93.98 C ATOM 678 NE ARG A 65 10.272 -27.115 -8.737 1.00 91.64 N ATOM 679 CZ ARG A 65 9.880 -26.137 -7.889 1.00 92.98 C ATOM 680 NH1 ARG A 65 10.713 -25.124 -7.529 1.00 71.00 N ATOM 681 NH2 ARG A 65 8.616 -26.161 -7.405 1.00 82.32 N ATOM 682 HA ARG A 65 12.220 -25.281 -11.563 1.00 0.00 H ATOM 683 HB2 ARG A 65 12.337 -28.110 -12.618 1.00 0.00 H ATOM 684 HB3 ARG A 65 13.354 -27.354 -11.368 1.00 0.00 H ATOM 685 HG2 ARG A 65 10.391 -27.835 -11.046 1.00 0.00 H ATOM 686 HG3 ARG A 65 11.641 -28.999 -10.547 1.00 0.00 H ATOM 687 HD2 ARG A 65 11.969 -26.206 -9.566 1.00 0.00 H ATOM 688 HD3 ARG A 65 12.269 -27.753 -8.741 1.00 0.00 H ATOM 689 HE ARG A 65 9.584 -27.866 -8.947 1.00 0.00 H ATOM 690 HH12 ARG A 65 10.382 -24.386 -6.875 1.00 0.00 H ATOM 691 HH11 ARG A 65 11.681 -25.087 -7.908 1.00 0.00 H ATOM 692 HH22 ARG A 65 8.295 -25.418 -6.752 1.00 0.00 H ATOM 693 HH21 ARG A 65 7.966 -26.922 -7.686 1.00 0.00 H ATOM 694 H ARG A 65 9.907 -25.737 -11.710 1.00 0.00 H ATOM 695 N LEU A 66 12.536 -24.609 -14.198 1.00 82.47 N ATOM 696 CA LEU A 66 13.421 -24.261 -15.289 1.00 72.66 C ATOM 697 C LEU A 66 14.670 -23.573 -14.817 1.00 77.45 C ATOM 698 O LEU A 66 15.554 -23.233 -15.691 1.00 73.18 O ATOM 699 CB LEU A 66 12.715 -23.407 -16.307 1.00 69.66 C ATOM 700 CG LEU A 66 11.565 -24.175 -17.029 1.00 78.34 C ATOM 701 CD1 LEU A 66 11.029 -23.390 -18.248 1.00 80.48 C ATOM 702 CD2 LEU A 66 12.039 -25.533 -17.491 1.00 77.66 C ATOM 703 HA LEU A 66 13.719 -25.199 -15.757 1.00 0.00 H ATOM 704 HB2 LEU A 66 12.294 -22.537 -15.803 1.00 0.00 H ATOM 705 HB3 LEU A 66 13.439 -23.078 -17.052 1.00 0.00 H ATOM 706 HG LEU A 66 10.758 -24.291 -16.305 1.00 0.00 H ATOM 707 HD21 LEU A 66 12.871 -25.410 -18.184 1.00 0.00 H ATOM 708 HD22 LEU A 66 12.366 -26.115 -16.629 1.00 0.00 H ATOM 709 HD23 LEU A 66 11.221 -26.051 -17.992 1.00 0.00 H ATOM 710 HD11 LEU A 66 10.643 -22.426 -17.917 1.00 0.00 H ATOM 711 HD12 LEU A 66 11.838 -23.233 -18.962 1.00 0.00 H ATOM 712 HD13 LEU A 66 10.230 -23.959 -18.722 1.00 0.00 H ATOM 713 H LEU A 66 11.737 -24.000 -13.927 1.00 0.00 H ATOM 714 N TYR A 67 14.794 -23.299 -13.496 1.00 73.93 N ATOM 715 CA TYR A 67 16.109 -22.697 -13.088 1.00 76.93 C ATOM 716 C TYR A 67 16.970 -23.923 -12.935 1.00 78.87 C ATOM 717 O TYR A 67 16.455 -25.028 -12.889 1.00 81.82 O ATOM 718 CB TYR A 67 16.080 -21.972 -11.756 1.00 75.95 C ATOM 719 CG TYR A 67 15.358 -22.753 -10.680 1.00 89.30 C ATOM 720 CD1 TYR A 67 16.065 -23.530 -9.694 1.00 88.96 C ATOM 721 CD2 TYR A 67 13.977 -22.758 -10.645 1.00 84.77 C ATOM 722 CE1 TYR A 67 15.372 -24.241 -8.686 1.00 77.69 C ATOM 723 CE2 TYR A 67 13.304 -23.441 -9.667 1.00 88.97 C ATOM 724 CZ TYR A 67 13.981 -24.193 -8.703 1.00 88.19 C ATOM 725 OH TYR A 67 13.184 -24.839 -7.750 1.00 91.23 O ATOM 726 HA TYR A 67 16.437 -21.948 -13.808 1.00 0.00 H ATOM 727 HB3 TYR A 67 15.575 -21.015 -11.891 1.00 0.00 H ATOM 728 HB2 TYR A 67 17.106 -21.798 -11.431 1.00 0.00 H ATOM 729 HD2 TYR A 67 13.417 -22.212 -11.404 1.00 0.00 H ATOM 730 HE2 TYR A 67 12.215 -23.397 -9.640 1.00 0.00 H ATOM 731 HE1 TYR A 67 15.908 -24.806 -7.924 1.00 0.00 H ATOM 732 HD1 TYR A 67 17.154 -23.571 -9.725 1.00 0.00 H ATOM 733 HH TYR A 67 13.763 -25.339 -7.121 1.00 0.00 H ATOM 734 H TYR A 67 14.034 -23.492 -12.813 1.00 0.00 H ATOM 735 N ASP A 68 18.268 -23.706 -12.922 1.00 82.41 N ATOM 736 CA ASP A 68 19.278 -24.684 -12.607 1.00 84.40 C ATOM 737 C ASP A 68 19.253 -24.727 -11.085 1.00 93.98 C ATOM 738 O ASP A 68 18.900 -23.705 -10.446 1.00 98.20 O ATOM 739 CB ASP A 68 20.617 -24.151 -13.120 1.00 83.09 C ATOM 740 CG ASP A 68 21.802 -25.004 -12.700 1.00102.91 C ATOM 741 OD1 ASP A 68 22.106 -24.901 -11.498 1.00106.63 O ATOM 742 OD2 ASP A 68 22.436 -25.748 -13.541 1.00 94.48 O ATOM 743 HA ASP A 68 19.122 -25.669 -13.046 1.00 0.00 H ATOM 744 HB2 ASP A 68 20.583 -24.118 -14.209 1.00 0.00 H ATOM 745 HB3 ASP A 68 20.761 -23.143 -12.731 1.00 0.00 H ATOM 746 H ASP A 68 18.592 -22.747 -13.159 1.00 0.00 H ATOM 747 N GLU A 69 19.589 -25.888 -10.489 1.00 98.99 N ATOM 748 CA GLU A 69 19.502 -26.010 -9.017 1.00 96.98 C ATOM 749 C GLU A 69 20.827 -25.591 -8.441 1.00100.62 C ATOM 750 O GLU A 69 20.877 -25.001 -7.380 1.00101.06 O ATOM 751 CB GLU A 69 19.111 -27.403 -8.542 1.00 98.42 C ATOM 752 CG GLU A 69 18.942 -27.505 -7.027 1.00105.29 C ATOM 753 CD GLU A 69 17.469 -27.540 -6.546 1.00113.45 C ATOM 754 OE1 GLU A 69 17.250 -27.467 -5.307 1.00 98.39 O ATOM 755 OE2 GLU A 69 16.515 -27.623 -7.383 1.00110.56 O ATOM 756 HA GLU A 69 18.701 -25.360 -8.665 1.00 0.00 H ATOM 757 HB2 GLU A 69 18.167 -27.677 -9.014 1.00 0.00 H ATOM 758 HB3 GLU A 69 19.887 -28.104 -8.851 1.00 0.00 H ATOM 759 HG2 GLU A 69 19.432 -28.418 -6.690 1.00 0.00 H ATOM 760 HG3 GLU A 69 19.429 -26.643 -6.571 1.00 0.00 H ATOM 761 H GLU A 69 19.908 -26.695 -11.062 1.00 0.00 H ATOM 762 N LYS A 70 21.910 -25.852 -9.165 1.00106.26 N ATOM 763 CA LYS A 70 23.226 -25.400 -8.704 1.00101.54 C ATOM 764 C LYS A 70 23.379 -23.924 -8.951 1.00 98.60 C ATOM 765 O LYS A 70 23.424 -23.176 -7.996 1.00 97.31 O ATOM 766 CB LYS A 70 24.327 -26.273 -9.285 1.00 94.66 C ATOM 767 CG LYS A 70 23.863 -27.742 -9.304 1.00 97.14 C ATOM 768 CD LYS A 70 24.962 -28.738 -8.884 1.00107.47 C ATOM 769 CE LYS A 70 24.357 -30.108 -8.623 1.00105.43 C ATOM 770 NZ LYS A 70 25.399 -31.115 -8.257 1.00124.65 N ATOM 771 HA LYS A 70 23.316 -25.524 -7.625 1.00 0.00 H ATOM 772 HB2 LYS A 70 24.549 -25.949 -10.302 1.00 0.00 H ATOM 773 HB3 LYS A 70 25.224 -26.183 -8.672 1.00 0.00 H ATOM 774 HG2 LYS A 70 23.021 -27.847 -8.620 1.00 0.00 H ATOM 775 HG3 LYS A 70 23.541 -27.989 -10.315 1.00 0.00 H ATOM 776 HD2 LYS A 70 25.701 -28.816 -9.681 1.00 0.00 H ATOM 777 HD3 LYS A 70 25.446 -28.379 -7.976 1.00 0.00 H ATOM 778 HE2 LYS A 70 23.842 -30.444 -9.523 1.00 0.00 H ATOM 779 HE3 LYS A 70 23.641 -30.028 -7.805 1.00 0.00 H ATOM 780 HZ1 LYS A 70 26.083 -31.203 -9.035 1.00 0.00 H ATOM 781 HZ2 LYS A 70 25.891 -30.805 -7.395 1.00 0.00 H ATOM 782 HZ3 LYS A 70 24.945 -32.035 -8.087 1.00 0.00 H ATOM 783 H LYS A 70 21.824 -26.377 -10.059 1.00 0.00 H ATOM 784 N GLN A 71 23.404 -23.494 -10.223 1.00110.51 N ATOM 785 CA GLN A 71 23.368 -22.045 -10.600 1.00103.16 C ATOM 786 C GLN A 71 21.967 -21.489 -10.499 1.00108.79 C ATOM 787 O GLN A 71 21.225 -21.490 -11.491 1.00 99.34 O ATOM 788 CB GLN A 71 23.792 -21.849 -12.040 1.00 99.10 C ATOM 789 CG GLN A 71 25.150 -22.420 -12.369 1.00115.75 C ATOM 790 CD GLN A 71 26.270 -21.684 -11.692 1.00116.82 C ATOM 791 OE1 GLN A 71 26.237 -21.405 -10.482 1.00112.36 O ATOM 792 NE2 GLN A 71 27.287 -21.376 -12.465 1.00118.31 N ATOM 793 HA GLN A 71 24.044 -21.535 -9.914 1.00 0.00 H ATOM 794 HB2 GLN A 71 23.054 -22.330 -12.682 1.00 0.00 H ATOM 795 HB3 GLN A 71 23.811 -20.779 -12.248 1.00 0.00 H ATOM 796 HG2 GLN A 71 25.176 -23.462 -12.052 1.00 0.00 H ATOM 797 HG3 GLN A 71 25.299 -22.366 -13.447 1.00 0.00 H ATOM 798 HE22 GLN A 71 27.270 -21.630 -13.473 1.00 0.00 H ATOM 799 HE21 GLN A 71 28.109 -20.878 -12.069 1.00 0.00 H ATOM 800 H GLN A 71 23.451 -24.202 -10.983 1.00 0.00 H ATOM 801 N GLN A 72 21.592 -21.013 -9.318 1.00 99.23 N ATOM 802 CA GLN A 72 20.174 -20.754 -9.084 1.00 89.79 C ATOM 803 C GLN A 72 19.625 -19.437 -9.694 1.00 82.83 C ATOM 804 O GLN A 72 18.389 -19.159 -9.653 1.00 83.42 O ATOM 805 CB GLN A 72 19.925 -20.840 -7.578 1.00100.97 C ATOM 806 CG GLN A 72 18.473 -20.815 -7.135 1.00 89.93 C ATOM 807 CD GLN A 72 18.041 -22.117 -6.632 1.00 84.81 C ATOM 808 OE1 GLN A 72 16.839 -22.420 -6.492 1.00 83.77 O ATOM 809 NE2 GLN A 72 19.017 -22.921 -6.344 1.00 93.25 N ATOM 810 HA GLN A 72 19.610 -21.517 -9.620 1.00 0.00 H ATOM 811 HB2 GLN A 72 20.366 -21.771 -7.221 1.00 0.00 H ATOM 812 HB3 GLN A 72 20.431 -19.996 -7.109 1.00 0.00 H ATOM 813 HG2 GLN A 72 18.357 -20.074 -6.344 1.00 0.00 H ATOM 814 HG3 GLN A 72 17.848 -20.539 -7.985 1.00 0.00 H ATOM 815 HE22 GLN A 72 20.001 -22.614 -6.481 1.00 0.00 H ATOM 816 HE21 GLN A 72 18.815 -23.873 -5.976 1.00 0.00 H ATOM 817 H GLN A 72 22.294 -20.828 -8.574 1.00 0.00 H ATOM 818 N HIS A 73 20.490 -18.631 -10.319 1.00 90.52 N ATOM 819 CA HIS A 73 19.992 -17.430 -11.086 1.00 91.29 C ATOM 820 C HIS A 73 19.913 -17.673 -12.570 1.00 97.89 C ATOM 821 O HIS A 73 19.484 -16.801 -13.315 1.00 98.04 O ATOM 822 CB HIS A 73 20.892 -16.281 -10.911 1.00 85.92 C ATOM 823 CG HIS A 73 22.276 -16.604 -11.295 1.00 99.89 C ATOM 824 ND1 HIS A 73 22.626 -16.839 -12.573 1.00103.27 N ATOM 825 CD2 HIS A 73 23.411 -16.793 -10.527 1.00 97.29 C ATOM 826 CE1 HIS A 73 23.945 -17.111 -12.626 1.00102.28 C ATOM 827 NE2 HIS A 73 24.417 -17.088 -11.374 1.00107.03 N ATOM 828 HA HIS A 73 18.997 -17.234 -10.685 1.00 0.00 H ATOM 829 HB2 HIS A 73 20.537 -15.457 -11.531 1.00 0.00 H ATOM 830 HB3 HIS A 73 20.878 -15.978 -9.864 1.00 0.00 H ATOM 831 HD2 HIS A 73 23.479 -16.718 -9.442 1.00 0.00 H ATOM 832 HE1 HIS A 73 24.524 -17.313 -13.527 1.00 0.00 H ATOM 833 H HIS A 73 21.509 -18.832 -10.276 1.00 0.00 H ATOM 834 N ILE A 74 20.363 -18.844 -13.014 1.00 97.11 N ATOM 835 CA ILE A 74 20.359 -19.178 -14.419 1.00 88.25 C ATOM 836 C ILE A 74 19.104 -19.929 -14.703 1.00 84.91 C ATOM 837 O ILE A 74 18.695 -20.744 -13.867 1.00 85.41 O ATOM 838 CB ILE A 74 21.472 -20.154 -14.761 1.00 85.98 C ATOM 839 CG1 ILE A 74 22.828 -19.544 -14.477 1.00 93.79 C ATOM 840 CG2 ILE A 74 21.387 -20.514 -16.213 1.00 93.83 C ATOM 841 CD1 ILE A 74 23.221 -18.468 -15.440 1.00 93.18 C ATOM 842 HA ILE A 74 20.467 -18.252 -14.983 1.00 0.00 H ATOM 843 HB ILE A 74 21.354 -21.045 -14.145 1.00 0.00 H ATOM 844 HG12 ILE A 74 22.810 -19.118 -13.474 1.00 0.00 H ATOM 845 HG13 ILE A 74 23.577 -20.335 -14.521 1.00 0.00 H ATOM 846 HD11 ILE A 74 23.256 -18.880 -16.449 1.00 0.00 H ATOM 847 HD12 ILE A 74 22.489 -17.662 -15.401 1.00 0.00 H ATOM 848 HD13 ILE A 74 24.204 -18.081 -15.170 1.00 0.00 H ATOM 849 HG21 ILE A 74 20.421 -20.976 -16.415 1.00 0.00 H ATOM 850 HG22 ILE A 74 21.493 -19.612 -16.816 1.00 0.00 H ATOM 851 HG23 ILE A 74 22.185 -21.214 -16.460 1.00 0.00 H ATOM 852 H ILE A 74 20.728 -19.538 -12.330 1.00 0.00 H ATOM 853 N VAL A 75 18.534 -19.690 -15.899 1.00 81.96 N ATOM 854 CA VAL A 75 17.305 -20.329 -16.337 1.00 79.96 C ATOM 855 C VAL A 75 17.617 -21.120 -17.575 1.00 89.75 C ATOM 856 O VAL A 75 18.567 -20.740 -18.276 1.00 93.45 O ATOM 857 CB VAL A 75 16.179 -19.347 -16.671 1.00 78.14 C ATOM 858 CG1 VAL A 75 14.788 -20.003 -16.454 1.00 74.85 C ATOM 859 CG2 VAL A 75 16.268 -18.130 -15.805 1.00 75.53 C ATOM 860 HA VAL A 75 16.951 -20.947 -15.512 1.00 0.00 H ATOM 861 HB VAL A 75 16.292 -19.067 -17.718 1.00 0.00 H ATOM 862 HG11 VAL A 75 14.695 -20.876 -17.100 1.00 0.00 H ATOM 863 HG12 VAL A 75 14.690 -20.308 -15.412 1.00 0.00 H ATOM 864 HG13 VAL A 75 14.006 -19.284 -16.699 1.00 0.00 H ATOM 865 HG21 VAL A 75 16.183 -18.423 -14.759 1.00 0.00 H ATOM 866 HG22 VAL A 75 17.227 -17.638 -15.969 1.00 0.00 H ATOM 867 HG23 VAL A 75 15.459 -17.445 -16.059 1.00 0.00 H ATOM 868 H VAL A 75 18.996 -19.015 -16.541 1.00 0.00 H ATOM 869 N TYR A 76 16.834 -22.203 -17.816 1.00 82.76 N ATOM 870 CA TYR A 76 17.137 -23.228 -18.824 1.00 85.12 C ATOM 871 C TYR A 76 15.864 -23.579 -19.553 1.00 88.39 C ATOM 872 O TYR A 76 14.951 -24.209 -18.903 1.00 79.58 O ATOM 873 CB TYR A 76 17.776 -24.523 -18.192 1.00 94.83 C ATOM 874 CG TYR A 76 19.275 -24.368 -18.080 1.00 86.81 C ATOM 875 CD1 TYR A 76 20.077 -24.341 -19.243 1.00 86.95 C ATOM 876 CD2 TYR A 76 19.865 -24.146 -16.847 1.00 76.41 C ATOM 877 CE1 TYR A 76 21.433 -24.101 -19.176 1.00 84.00 C ATOM 878 CE2 TYR A 76 21.213 -23.914 -16.765 1.00 78.91 C ATOM 879 CZ TYR A 76 21.971 -23.862 -17.947 1.00 82.97 C ATOM 880 OH TYR A 76 23.301 -23.623 -17.908 1.00 91.32 O ATOM 881 HA TYR A 76 17.875 -22.820 -19.515 1.00 0.00 H ATOM 882 HB3 TYR A 76 17.549 -25.381 -18.824 1.00 0.00 H ATOM 883 HB2 TYR A 76 17.356 -24.684 -17.199 1.00 0.00 H ATOM 884 HD2 TYR A 76 19.257 -24.156 -15.942 1.00 0.00 H ATOM 885 HE2 TYR A 76 21.691 -23.772 -15.796 1.00 0.00 H ATOM 886 HE1 TYR A 76 22.052 -24.102 -20.073 1.00 0.00 H ATOM 887 HD1 TYR A 76 19.614 -24.514 -20.214 1.00 0.00 H ATOM 888 HH TYR A 76 23.662 -23.623 -18.830 1.00 0.00 H ATOM 889 H TYR A 76 15.967 -22.314 -17.253 1.00 0.00 H ATOM 890 N CYS A 77 15.820 -23.232 -20.873 1.00 83.36 N ATOM 891 CA CYS A 77 14.544 -23.156 -21.667 1.00 83.59 C ATOM 892 C CYS A 77 14.372 -24.018 -22.988 1.00 97.49 C ATOM 893 O CYS A 77 13.210 -24.438 -23.317 1.00 86.63 O ATOM 894 CB CYS A 77 14.011 -21.690 -21.816 1.00 76.81 C ATOM 895 SG CYS A 77 15.320 -20.410 -21.976 1.00 96.58 S ATOM 896 HA CYS A 77 13.885 -23.720 -21.007 1.00 0.00 H ATOM 897 HB2 CYS A 77 13.412 -21.455 -20.936 1.00 0.00 H ATOM 898 HB3 CYS A 77 13.382 -21.646 -22.705 1.00 0.00 H ATOM 899 HG CYS A 77 14.733 -19.167 -22.100 1.00 0.00 H ATOM 900 H CYS A 77 16.714 -23.009 -21.354 1.00 0.00 H ATOM 901 N SER A 78 15.463 -24.323 -23.718 1.00 96.53 N ATOM 902 CA SER A 78 15.297 -25.314 -24.833 1.00 89.79 C ATOM 903 C SER A 78 14.631 -26.483 -24.174 1.00 94.19 C ATOM 904 O SER A 78 15.017 -26.895 -23.054 1.00 97.70 O ATOM 905 CB SER A 78 16.587 -25.738 -25.532 1.00 95.51 C ATOM 906 OG SER A 78 17.676 -25.962 -24.625 1.00109.51 O ATOM 907 HA SER A 78 14.724 -24.868 -25.646 1.00 0.00 H ATOM 908 HB2 SER A 78 16.875 -24.954 -26.232 1.00 0.00 H ATOM 909 HB3 SER A 78 16.397 -26.661 -26.080 1.00 0.00 H ATOM 910 HG SER A 78 17.431 -26.679 -23.988 1.00 0.00 H ATOM 911 H SER A 78 16.386 -23.888 -23.516 1.00 0.00 H ATOM 912 N ASN A 79 13.580 -26.942 -24.844 1.00100.01 N ATOM 913 CA ASN A 79 12.692 -28.021 -24.417 1.00 98.75 C ATOM 914 C ASN A 79 11.364 -27.356 -24.044 1.00113.38 C ATOM 915 O ASN A 79 10.257 -27.897 -24.252 1.00108.10 O ATOM 916 CB ASN A 79 13.267 -28.869 -23.258 1.00 95.93 C ATOM 917 CG ASN A 79 14.580 -29.599 -23.627 1.00 98.59 C ATOM 918 OD1 ASN A 79 14.799 -30.018 -24.789 1.00112.65 O ATOM 919 ND2 ASN A 79 15.450 -29.765 -22.638 1.00 86.73 N ATOM 920 HA ASN A 79 12.563 -28.741 -25.225 1.00 0.00 H ATOM 921 HB2 ASN A 79 13.463 -28.211 -22.411 1.00 0.00 H ATOM 922 HB3 ASN A 79 12.525 -29.614 -22.973 1.00 0.00 H ATOM 923 HD22 ASN A 79 15.232 -29.403 -21.688 1.00 0.00 H ATOM 924 HD21 ASN A 79 16.349 -30.257 -22.814 1.00 0.00 H ATOM 925 H ASN A 79 13.370 -26.492 -25.757 1.00 0.00 H ATOM 926 N ASP A 80 11.460 -26.143 -23.527 1.00109.26 N ATOM 927 CA ASP A 80 10.241 -25.490 -23.102 1.00107.14 C ATOM 928 C ASP A 80 9.591 -24.500 -24.105 1.00104.50 C ATOM 929 O ASP A 80 10.211 -23.893 -25.049 1.00 88.23 O ATOM 930 CB ASP A 80 10.473 -24.813 -21.763 1.00107.55 C ATOM 931 CG ASP A 80 9.333 -25.036 -20.811 1.00113.13 C ATOM 932 OD1 ASP A 80 9.487 -25.866 -19.892 1.00 99.91 O ATOM 933 OD2 ASP A 80 8.275 -24.397 -20.986 1.00116.16 O ATOM 934 HA ASP A 80 9.508 -26.294 -23.028 1.00 0.00 H ATOM 935 HB2 ASP A 80 11.385 -25.214 -21.320 1.00 0.00 H ATOM 936 HB3 ASP A 80 10.590 -23.742 -21.926 1.00 0.00 H ATOM 937 H ASP A 80 12.383 -25.673 -23.429 1.00 0.00 H ATOM 938 N LEU A 81 8.306 -24.311 -23.892 1.00 94.81 N ATOM 939 CA LEU A 81 7.691 -23.279 -24.674 1.00106.75 C ATOM 940 C LEU A 81 8.566 -21.995 -24.531 1.00112.63 C ATOM 941 O LEU A 81 9.114 -21.462 -25.522 1.00115.32 O ATOM 942 CB LEU A 81 6.210 -23.119 -24.295 1.00102.88 C ATOM 943 CG LEU A 81 5.513 -21.811 -24.661 1.00105.27 C ATOM 944 CD1 LEU A 81 6.170 -21.190 -25.893 1.00 97.21 C ATOM 945 CD2 LEU A 81 3.981 -21.948 -24.800 1.00101.61 C ATOM 946 HA LEU A 81 7.659 -23.528 -25.735 1.00 0.00 H ATOM 947 HB2 LEU A 81 5.662 -23.926 -24.782 1.00 0.00 H ATOM 948 HB3 LEU A 81 6.138 -23.233 -23.213 1.00 0.00 H ATOM 949 HG LEU A 81 5.647 -21.125 -23.825 1.00 0.00 H ATOM 950 HD21 LEU A 81 3.752 -22.671 -25.583 1.00 0.00 H ATOM 951 HD22 LEU A 81 3.561 -22.289 -23.854 1.00 0.00 H ATOM 952 HD23 LEU A 81 3.553 -20.980 -25.061 1.00 0.00 H ATOM 953 HD11 LEU A 81 7.220 -20.988 -25.681 1.00 0.00 H ATOM 954 HD12 LEU A 81 6.094 -21.882 -26.731 1.00 0.00 H ATOM 955 HD13 LEU A 81 5.663 -20.258 -26.143 1.00 0.00 H ATOM 956 H LEU A 81 7.771 -24.874 -23.201 1.00 0.00 H ATOM 957 N LEU A 82 8.753 -21.550 -23.290 1.00 93.98 N ATOM 958 CA LEU A 82 9.548 -20.348 -23.015 1.00 83.53 C ATOM 959 C LEU A 82 10.824 -20.227 -23.812 1.00 82.60 C ATOM 960 O LEU A 82 11.345 -19.141 -24.021 1.00 93.65 O ATOM 961 CB LEU A 82 9.901 -20.301 -21.500 1.00 77.16 C ATOM 962 CG LEU A 82 10.814 -19.144 -21.059 1.00 76.86 C ATOM 963 CD1 LEU A 82 10.174 -17.803 -21.417 1.00 81.48 C ATOM 964 CD2 LEU A 82 11.268 -19.081 -19.601 1.00 67.37 C ATOM 965 HA LEU A 82 8.921 -19.510 -23.320 1.00 0.00 H ATOM 966 HB2 LEU A 82 8.968 -20.222 -20.942 1.00 0.00 H ATOM 967 HB3 LEU A 82 10.399 -21.236 -21.243 1.00 0.00 H ATOM 968 HG LEU A 82 11.728 -19.357 -21.613 1.00 0.00 H ATOM 969 HD21 LEU A 82 10.395 -19.007 -18.953 1.00 0.00 H ATOM 970 HD22 LEU A 82 11.828 -19.984 -19.357 1.00 0.00 H ATOM 971 HD23 LEU A 82 11.904 -18.208 -19.457 1.00 0.00 H ATOM 972 HD11 LEU A 82 10.024 -17.750 -22.495 1.00 0.00 H ATOM 973 HD12 LEU A 82 9.213 -17.714 -20.910 1.00 0.00 H ATOM 974 HD13 LEU A 82 10.830 -16.992 -21.100 1.00 0.00 H ATOM 975 H LEU A 82 8.325 -22.067 -22.496 1.00 0.00 H ATOM 976 N GLY A 83 11.362 -21.360 -24.203 1.00 91.87 N ATOM 977 CA GLY A 83 12.674 -21.387 -24.816 1.00103.40 C ATOM 978 C GLY A 83 12.481 -20.606 -26.074 1.00107.37 C ATOM 979 O GLY A 83 13.236 -19.658 -26.375 1.00105.05 O ATOM 980 HA3 GLY A 83 12.983 -22.409 -25.034 1.00 0.00 H ATOM 981 HA2 GLY A 83 13.416 -20.914 -24.172 1.00 0.00 H ATOM 982 H GLY A 83 10.839 -22.249 -24.071 1.00 0.00 H ATOM 983 N ASP A 84 11.404 -20.993 -26.751 1.00100.63 N ATOM 984 CA ASP A 84 11.115 -20.533 -28.083 1.00102.47 C ATOM 985 C ASP A 84 11.017 -19.073 -27.912 1.00111.05 C ATOM 986 O ASP A 84 11.799 -18.345 -28.519 1.00131.90 O ATOM 987 CB ASP A 84 9.766 -21.036 -28.611 1.00 98.59 C ATOM 988 CG ASP A 84 9.555 -22.508 -28.361 1.00119.26 C ATOM 989 OD1 ASP A 84 10.482 -23.362 -28.575 1.00113.89 O ATOM 990 OD2 ASP A 84 8.422 -22.804 -27.949 1.00129.38 O ATOM 991 HA ASP A 84 11.869 -20.880 -28.789 1.00 0.00 H ATOM 992 HB2 ASP A 84 8.969 -20.480 -28.117 1.00 0.00 H ATOM 993 HB3 ASP A 84 9.722 -20.855 -29.685 1.00 0.00 H ATOM 994 H ASP A 84 10.743 -21.656 -26.299 1.00 0.00 H ATOM 995 N LEU A 85 10.086 -18.636 -27.056 1.00103.76 N ATOM 996 CA LEU A 85 9.744 -17.223 -27.006 1.00 91.99 C ATOM 997 C LEU A 85 10.989 -16.361 -26.885 1.00 93.33 C ATOM 998 O LEU A 85 11.072 -15.289 -27.497 1.00102.15 O ATOM 999 CB LEU A 85 8.736 -16.930 -25.919 1.00 92.12 C ATOM 1000 CG LEU A 85 7.634 -18.001 -25.852 1.00105.23 C ATOM 1001 CD1 LEU A 85 6.901 -17.900 -24.501 1.00110.94 C ATOM 1002 CD2 LEU A 85 6.658 -17.964 -27.028 1.00 81.19 C ATOM 1003 HA LEU A 85 9.265 -16.964 -27.950 1.00 0.00 H ATOM 1004 HB2 LEU A 85 9.252 -16.895 -24.960 1.00 0.00 H ATOM 1005 HB3 LEU A 85 8.275 -15.962 -26.117 1.00 0.00 H ATOM 1006 HG LEU A 85 8.125 -18.971 -25.931 1.00 0.00 H ATOM 1007 HD21 LEU A 85 6.163 -16.993 -27.057 1.00 0.00 H ATOM 1008 HD22 LEU A 85 7.205 -18.122 -27.958 1.00 0.00 H ATOM 1009 HD23 LEU A 85 5.913 -18.750 -26.905 1.00 0.00 H ATOM 1010 HD11 LEU A 85 7.612 -18.059 -23.690 1.00 0.00 H ATOM 1011 HD12 LEU A 85 6.453 -16.911 -24.405 1.00 0.00 H ATOM 1012 HD13 LEU A 85 6.120 -18.659 -24.455 1.00 0.00 H ATOM 1013 H LEU A 85 9.606 -19.308 -26.425 1.00 0.00 H ATOM 1014 N PHE A 86 11.997 -16.821 -26.174 1.00 85.81 N ATOM 1015 CA PHE A 86 13.183 -15.986 -26.117 1.00 97.52 C ATOM 1016 C PHE A 86 14.167 -16.226 -27.259 1.00 99.05 C ATOM 1017 O PHE A 86 15.152 -15.512 -27.389 1.00101.93 O ATOM 1018 CB PHE A 86 13.904 -16.180 -24.790 1.00106.75 C ATOM 1019 CG PHE A 86 13.185 -15.584 -23.620 1.00125.68 C ATOM 1020 CD1 PHE A 86 11.861 -15.908 -23.357 1.00125.93 C ATOM 1021 CD2 PHE A 86 13.844 -14.714 -22.750 1.00127.84 C ATOM 1022 CE1 PHE A 86 11.207 -15.342 -22.271 1.00122.46 C ATOM 1023 CE2 PHE A 86 13.202 -14.159 -21.648 1.00121.94 C ATOM 1024 CZ PHE A 86 11.878 -14.482 -21.406 1.00119.35 C ATOM 1025 HA PHE A 86 12.824 -14.962 -26.217 1.00 0.00 H ATOM 1026 HB2 PHE A 86 14.020 -17.250 -24.614 1.00 0.00 H ATOM 1027 HB3 PHE A 86 14.888 -15.716 -24.862 1.00 0.00 H ATOM 1028 HD2 PHE A 86 14.888 -14.463 -22.939 1.00 0.00 H ATOM 1029 HE2 PHE A 86 13.735 -13.479 -20.984 1.00 0.00 H ATOM 1030 HZ PHE A 86 11.363 -14.064 -20.541 1.00 0.00 H ATOM 1031 HE1 PHE A 86 10.157 -15.573 -22.094 1.00 0.00 H ATOM 1032 HD1 PHE A 86 11.334 -16.608 -24.005 1.00 0.00 H ATOM 1033 H PHE A 86 11.946 -17.734 -25.679 1.00 0.00 H ATOM 1034 N GLY A 87 13.952 -17.238 -28.077 1.00 94.36 N ATOM 1035 CA GLY A 87 15.082 -17.746 -28.851 1.00 99.71 C ATOM 1036 C GLY A 87 16.350 -17.724 -27.996 1.00102.38 C ATOM 1037 O GLY A 87 17.305 -17.004 -28.277 1.00101.88 O ATOM 1038 HA3 GLY A 87 15.228 -17.120 -29.731 1.00 0.00 H ATOM 1039 HA2 GLY A 87 14.875 -18.769 -29.165 1.00 0.00 H ATOM 1040 H GLY A 87 13.007 -17.662 -28.168 1.00 0.00 H ATOM 1041 N VAL A 88 16.326 -18.420 -26.872 1.00100.25 N ATOM 1042 CA VAL A 88 17.580 -18.836 -26.219 1.00 93.77 C ATOM 1043 C VAL A 88 17.091 -20.127 -25.700 1.00 88.54 C ATOM 1044 O VAL A 88 15.860 -20.400 -25.745 1.00 87.26 O ATOM 1045 CB VAL A 88 18.136 -17.939 -25.042 1.00100.99 C ATOM 1046 CG1 VAL A 88 19.487 -17.281 -25.377 1.00 93.49 C ATOM 1047 CG2 VAL A 88 17.154 -16.869 -24.569 1.00 95.56 C ATOM 1048 HA VAL A 88 18.437 -18.810 -26.893 1.00 0.00 H ATOM 1049 HB VAL A 88 18.283 -18.643 -24.223 1.00 0.00 H ATOM 1050 HG11 VAL A 88 20.226 -18.056 -25.583 1.00 0.00 H ATOM 1051 HG12 VAL A 88 19.372 -16.645 -26.254 1.00 0.00 H ATOM 1052 HG13 VAL A 88 19.816 -16.679 -24.530 1.00 0.00 H ATOM 1053 HG21 VAL A 88 16.915 -16.204 -25.399 1.00 0.00 H ATOM 1054 HG22 VAL A 88 16.242 -17.347 -24.211 1.00 0.00 H ATOM 1055 HG23 VAL A 88 17.606 -16.294 -23.761 1.00 0.00 H ATOM 1056 H VAL A 88 15.413 -18.676 -26.445 1.00 0.00 H ATOM 1057 N PRO A 89 18.032 -20.967 -25.326 1.00 86.53 N ATOM 1058 CA PRO A 89 17.842 -22.225 -24.657 1.00 83.32 C ATOM 1059 C PRO A 89 18.464 -22.051 -23.202 1.00 91.26 C ATOM 1060 O PRO A 89 18.525 -22.979 -22.371 1.00 90.43 O ATOM 1061 CB PRO A 89 18.684 -23.111 -25.543 1.00 88.80 C ATOM 1062 CG PRO A 89 19.946 -22.274 -25.706 1.00 86.46 C ATOM 1063 CD PRO A 89 19.422 -20.842 -25.806 1.00 89.19 C ATOM 1064 HA PRO A 89 16.826 -22.599 -24.527 1.00 0.00 H ATOM 1065 HD3 PRO A 89 19.998 -20.168 -25.172 1.00 0.00 H ATOM 1066 HD2 PRO A 89 19.451 -20.484 -26.835 1.00 0.00 H ATOM 1067 HG3 PRO A 89 20.485 -22.555 -26.611 1.00 0.00 H ATOM 1068 HG2 PRO A 89 20.603 -22.388 -24.843 1.00 0.00 H ATOM 1069 HB2 PRO A 89 18.899 -24.065 -25.062 1.00 0.00 H ATOM 1070 HB3 PRO A 89 18.199 -23.290 -26.503 1.00 0.00 H ATOM 1071 N SER A 90 18.912 -20.829 -22.907 1.00 91.73 N ATOM 1072 CA SER A 90 19.332 -20.511 -21.583 1.00 80.94 C ATOM 1073 C SER A 90 19.509 -19.038 -21.372 1.00 84.87 C ATOM 1074 O SER A 90 19.802 -18.316 -22.288 1.00 89.03 O ATOM 1075 CB SER A 90 20.676 -21.092 -21.392 1.00 77.06 C ATOM 1076 OG SER A 90 21.474 -20.051 -20.864 1.00 69.02 O ATOM 1077 HA SER A 90 18.572 -20.891 -20.900 1.00 0.00 H ATOM 1078 HB2 SER A 90 21.080 -21.435 -22.344 1.00 0.00 H ATOM 1079 HB3 SER A 90 20.633 -21.929 -20.695 1.00 0.00 H ATOM 1080 HG SER A 90 21.496 -19.296 -21.504 1.00 0.00 H ATOM 1081 H SER A 90 18.955 -20.102 -23.650 1.00 0.00 H ATOM 1082 N PHE A 91 19.403 -18.606 -20.127 1.00 91.63 N ATOM 1083 CA PHE A 91 19.721 -17.218 -19.760 1.00 97.01 C ATOM 1084 C PHE A 91 19.784 -17.103 -18.247 1.00103.07 C ATOM 1085 O PHE A 91 19.465 -18.080 -17.532 1.00 99.05 O ATOM 1086 CB PHE A 91 18.708 -16.203 -20.300 1.00 80.64 C ATOM 1087 CG PHE A 91 17.288 -16.426 -19.819 1.00 75.58 C ATOM 1088 CD1 PHE A 91 16.774 -15.714 -18.778 1.00 76.46 C ATOM 1089 CD2 PHE A 91 16.429 -17.305 -20.487 1.00 85.72 C ATOM 1090 CE1 PHE A 91 15.459 -15.911 -18.347 1.00 70.06 C ATOM 1091 CE2 PHE A 91 15.097 -17.496 -20.078 1.00 77.66 C ATOM 1092 CZ PHE A 91 14.638 -16.797 -18.971 1.00 75.18 C ATOM 1093 HA PHE A 91 20.683 -16.981 -20.214 1.00 0.00 H ATOM 1094 HB2 PHE A 91 19.022 -15.207 -19.988 1.00 0.00 H ATOM 1095 HB3 PHE A 91 18.713 -16.260 -21.388 1.00 0.00 H ATOM 1096 HD2 PHE A 91 16.803 -17.858 -21.349 1.00 0.00 H ATOM 1097 HE2 PHE A 91 14.440 -18.178 -20.618 1.00 0.00 H ATOM 1098 HZ PHE A 91 13.624 -16.957 -18.603 1.00 0.00 H ATOM 1099 HE1 PHE A 91 15.085 -15.344 -17.495 1.00 0.00 H ATOM 1100 HD1 PHE A 91 17.399 -14.978 -18.272 1.00 0.00 H ATOM 1101 H PHE A 91 19.086 -19.265 -19.388 1.00 0.00 H ATOM 1102 N SER A 92 20.200 -15.904 -17.801 1.00 94.26 N ATOM 1103 CA SER A 92 20.350 -15.548 -16.388 1.00 84.22 C ATOM 1104 C SER A 92 19.495 -14.368 -16.077 1.00 86.06 C ATOM 1105 O SER A 92 19.616 -13.327 -16.721 1.00 90.80 O ATOM 1106 CB SER A 92 21.764 -15.080 -16.066 1.00 86.08 C ATOM 1107 OG SER A 92 21.713 -13.734 -15.533 1.00 76.16 O ATOM 1108 HA SER A 92 20.088 -16.441 -15.820 1.00 0.00 H ATOM 1109 HB2 SER A 92 22.367 -15.090 -16.974 1.00 0.00 H ATOM 1110 HB3 SER A 92 22.210 -15.747 -15.328 1.00 0.00 H ATOM 1111 HG SER A 92 21.308 -13.130 -16.204 1.00 0.00 H ATOM 1112 H SER A 92 20.431 -15.179 -18.509 1.00 0.00 H ATOM 1113 N VAL A 93 18.676 -14.495 -15.048 1.00 87.37 N ATOM 1114 CA VAL A 93 17.810 -13.388 -14.668 1.00 90.45 C ATOM 1115 C VAL A 93 18.586 -12.128 -14.322 1.00 91.57 C ATOM 1116 O VAL A 93 18.087 -11.010 -14.571 1.00105.42 O ATOM 1117 CB VAL A 93 16.905 -13.789 -13.505 1.00 89.04 C ATOM 1118 CG1 VAL A 93 16.155 -15.047 -13.912 1.00 74.51 C ATOM 1119 CG2 VAL A 93 17.739 -13.980 -12.216 1.00 73.61 C ATOM 1120 HA VAL A 93 17.197 -13.156 -15.539 1.00 0.00 H ATOM 1121 HB VAL A 93 16.180 -13.007 -13.282 1.00 0.00 H ATOM 1122 HG11 VAL A 93 15.560 -14.842 -14.802 1.00 0.00 H ATOM 1123 HG12 VAL A 93 16.870 -15.841 -14.127 1.00 0.00 H ATOM 1124 HG13 VAL A 93 15.499 -15.357 -13.098 1.00 0.00 H ATOM 1125 HG21 VAL A 93 18.480 -14.763 -12.377 1.00 0.00 H ATOM 1126 HG22 VAL A 93 18.243 -13.046 -11.969 1.00 0.00 H ATOM 1127 HG23 VAL A 93 17.079 -14.266 -11.397 1.00 0.00 H ATOM 1128 H VAL A 93 18.650 -15.385 -14.510 1.00 0.00 H ATOM 1129 N LYS A 94 19.795 -12.315 -13.769 1.00 92.07 N ATOM 1130 CA LYS A 94 20.635 -11.200 -13.296 1.00 93.18 C ATOM 1131 C LYS A 94 20.592 -10.000 -14.232 1.00105.54 C ATOM 1132 O LYS A 94 20.201 -8.893 -13.796 1.00106.24 O ATOM 1133 CB LYS A 94 22.060 -11.672 -13.008 1.00 90.58 C ATOM 1134 CG LYS A 94 22.239 -12.005 -11.517 1.00 98.50 C ATOM 1135 CD LYS A 94 23.700 -12.189 -11.139 1.00 98.47 C ATOM 1136 CE LYS A 94 23.880 -12.898 -9.802 1.00101.19 C ATOM 1137 NZ LYS A 94 25.340 -13.074 -9.461 1.00110.27 N ATOM 1138 HA LYS A 94 20.214 -10.851 -12.353 1.00 0.00 H ATOM 1139 HB2 LYS A 94 22.267 -12.563 -13.600 1.00 0.00 H ATOM 1140 HB3 LYS A 94 22.760 -10.883 -13.284 1.00 0.00 H ATOM 1141 HG2 LYS A 94 21.823 -11.191 -10.923 1.00 0.00 H ATOM 1142 HG3 LYS A 94 21.701 -12.927 -11.296 1.00 0.00 H ATOM 1143 HD2 LYS A 94 24.189 -12.778 -11.915 1.00 0.00 H ATOM 1144 HD3 LYS A 94 24.171 -11.208 -11.079 1.00 0.00 H ATOM 1145 HE2 LYS A 94 23.408 -13.879 -9.855 1.00 0.00 H ATOM 1146 HE3 LYS A 94 23.402 -12.307 -9.020 1.00 0.00 H ATOM 1147 HZ1 LYS A 94 25.801 -13.642 -10.200 1.00 0.00 H ATOM 1148 HZ2 LYS A 94 25.796 -12.141 -9.404 1.00 0.00 H ATOM 1149 HZ3 LYS A 94 25.425 -13.560 -8.545 1.00 0.00 H ATOM 1150 H LYS A 94 20.153 -13.286 -13.670 1.00 0.00 H ATOM 1151 N GLU A 95 20.885 -10.265 -15.524 1.00113.98 N ATOM 1152 CA GLU A 95 20.972 -9.271 -16.629 1.00109.41 C ATOM 1153 C GLU A 95 19.678 -8.795 -17.323 1.00111.41 C ATOM 1154 O GLU A 95 19.101 -9.466 -18.188 1.00107.81 O ATOM 1155 CB GLU A 95 21.953 -9.767 -17.664 1.00113.17 C ATOM 1156 CG GLU A 95 21.629 -11.141 -18.219 1.00106.39 C ATOM 1157 CD GLU A 95 22.867 -11.796 -18.801 1.00113.22 C ATOM 1158 OE1 GLU A 95 22.751 -12.968 -19.270 1.00101.70 O ATOM 1159 OE2 GLU A 95 23.958 -11.131 -18.782 1.00102.84 O ATOM 1160 HA GLU A 95 21.296 -8.367 -16.113 1.00 0.00 H ATOM 1161 HB2 GLU A 95 21.965 -9.058 -18.492 1.00 0.00 H ATOM 1162 HB3 GLU A 95 22.942 -9.807 -17.207 1.00 0.00 H ATOM 1163 HG2 GLU A 95 21.237 -11.767 -17.417 1.00 0.00 H ATOM 1164 HG3 GLU A 95 20.876 -11.042 -19.001 1.00 0.00 H ATOM 1165 H GLU A 95 21.067 -11.259 -15.770 1.00 0.00 H ATOM 1166 N HIS A 96 19.278 -7.582 -16.958 1.00120.84 N ATOM 1167 CA HIS A 96 17.958 -7.047 -17.251 1.00111.91 C ATOM 1168 C HIS A 96 17.974 -6.481 -18.620 1.00117.41 C ATOM 1169 O HIS A 96 16.956 -6.429 -19.310 1.00112.63 O ATOM 1170 CB HIS A 96 17.648 -5.979 -16.202 1.00113.24 C ATOM 1171 CG HIS A 96 17.431 -6.551 -14.789 1.00129.29 C ATOM 1172 ND1 HIS A 96 18.453 -6.754 -13.902 1.00120.86 N ATOM 1173 CD2 HIS A 96 16.258 -6.984 -14.141 1.00116.67 C ATOM 1174 CE1 HIS A 96 17.949 -7.267 -12.761 1.00110.67 C ATOM 1175 NE2 HIS A 96 16.610 -7.402 -12.909 1.00114.56 N ATOM 1176 HA HIS A 96 17.186 -7.816 -17.212 1.00 0.00 H ATOM 1177 HB2 HIS A 96 18.482 -5.278 -16.166 1.00 0.00 H ATOM 1178 HB3 HIS A 96 16.743 -5.451 -16.504 1.00 0.00 H ATOM 1179 HD2 HIS A 96 15.251 -6.982 -14.559 1.00 0.00 H ATOM 1180 HE1 HIS A 96 18.522 -7.528 -11.871 1.00 0.00 H ATOM 1181 H HIS A 96 19.946 -6.982 -16.434 1.00 0.00 H ATOM 1182 N ARG A 97 19.182 -6.100 -19.028 1.00128.73 N ATOM 1183 CA ARG A 97 19.443 -5.315 -20.221 1.00124.73 C ATOM 1184 C ARG A 97 18.816 -6.026 -21.364 1.00123.51 C ATOM 1185 O ARG A 97 18.414 -5.402 -22.313 1.00146.95 O ATOM 1186 CB ARG A 97 20.960 -5.150 -20.474 1.00129.79 C ATOM 1187 CG ARG A 97 21.877 -5.463 -19.290 1.00135.03 C ATOM 1188 CD ARG A 97 21.219 -5.194 -17.918 1.00125.44 C ATOM 1189 NE ARG A 97 22.137 -4.812 -16.840 1.00124.90 N ATOM 1190 CZ ARG A 97 23.241 -5.485 -16.515 1.00116.66 C ATOM 1191 NH1 ARG A 97 23.578 -6.571 -17.217 1.00114.31 N ATOM 1192 NH2 ARG A 97 24.016 -5.066 -15.509 1.00 95.81 N ATOM 1193 HA ARG A 97 19.028 -4.315 -20.099 1.00 0.00 H ATOM 1194 HB2 ARG A 97 21.235 -5.814 -21.294 1.00 0.00 H ATOM 1195 HB3 ARG A 97 21.138 -4.116 -20.770 1.00 0.00 H ATOM 1196 HG2 ARG A 97 22.158 -6.515 -19.339 1.00 0.00 H ATOM 1197 HG3 ARG A 97 22.771 -4.845 -19.372 1.00 0.00 H ATOM 1198 HD2 ARG A 97 20.700 -6.102 -17.611 1.00 0.00 H ATOM 1199 HD3 ARG A 97 20.496 -4.388 -18.045 1.00 0.00 H ATOM 1200 HE ARG A 97 21.911 -3.958 -16.292 1.00 0.00 H ATOM 1201 HH12 ARG A 97 24.437 -7.103 -16.971 1.00 0.00 H ATOM 1202 HH11 ARG A 97 22.981 -6.884 -18.009 1.00 0.00 H ATOM 1203 HH22 ARG A 97 24.876 -5.595 -15.260 1.00 0.00 H ATOM 1204 HH21 ARG A 97 23.759 -4.211 -14.976 1.00 0.00 H ATOM 1205 H ARG A 97 19.998 -6.385 -18.450 1.00 0.00 H ATOM 1206 N LYS A 98 18.698 -7.342 -21.243 1.00131.25 N ATOM 1207 CA LYS A 98 18.286 -8.228 -22.339 1.00118.23 C ATOM 1208 C LYS A 98 17.068 -9.042 -21.999 1.00121.06 C ATOM 1209 O LYS A 98 16.436 -9.639 -22.883 1.00115.05 O ATOM 1210 CB LYS A 98 19.411 -9.225 -22.636 1.00115.45 C ATOM 1211 CG LYS A 98 20.561 -9.160 -21.627 1.00120.71 C ATOM 1212 CD LYS A 98 21.734 -10.000 -22.079 1.00116.82 C ATOM 1213 CE LYS A 98 22.322 -9.498 -23.393 1.00125.14 C ATOM 1214 NZ LYS A 98 23.418 -10.404 -23.855 1.00113.86 N ATOM 1215 HA LYS A 98 18.062 -7.585 -23.190 1.00 0.00 H ATOM 1216 HB2 LYS A 98 18.994 -10.232 -22.621 1.00 0.00 H ATOM 1217 HB3 LYS A 98 19.809 -9.013 -23.628 1.00 0.00 H ATOM 1218 HG2 LYS A 98 20.884 -8.124 -21.522 1.00 0.00 H ATOM 1219 HG3 LYS A 98 20.210 -9.529 -20.663 1.00 0.00 H ATOM 1220 HD2 LYS A 98 22.507 -9.967 -21.312 1.00 0.00 H ATOM 1221 HD3 LYS A 98 21.400 -11.029 -22.213 1.00 0.00 H ATOM 1222 HE2 LYS A 98 22.723 -8.495 -23.247 1.00 0.00 H ATOM 1223 HE3 LYS A 98 21.538 -9.468 -24.149 1.00 0.00 H ATOM 1224 HZ1 LYS A 98 24.169 -10.432 -23.136 1.00 0.00 H ATOM 1225 HZ2 LYS A 98 23.038 -11.361 -23.998 1.00 0.00 H ATOM 1226 HZ3 LYS A 98 23.807 -10.047 -24.751 1.00 0.00 H ATOM 1227 H LYS A 98 18.909 -7.770 -20.319 1.00 0.00 H ATOM 1228 N ILE A 99 16.765 -9.144 -20.709 1.00117.87 N ATOM 1229 CA ILE A 99 15.620 -9.954 -20.341 1.00102.28 C ATOM 1230 C ILE A 99 14.422 -9.215 -20.876 1.00100.83 C ATOM 1231 O ILE A 99 13.541 -9.825 -21.413 1.00 99.26 O ATOM 1232 CB ILE A 99 15.499 -10.197 -18.821 1.00 96.28 C ATOM 1233 CG1 ILE A 99 16.656 -11.047 -18.314 1.00 81.12 C ATOM 1234 CG2 ILE A 99 14.147 -10.831 -18.497 1.00 80.45 C ATOM 1235 CD1 ILE A 99 16.244 -12.433 -17.813 1.00 82.19 C ATOM 1236 HA ILE A 99 15.715 -10.955 -20.762 1.00 0.00 H ATOM 1237 HB ILE A 99 15.554 -9.239 -18.305 1.00 0.00 H ATOM 1238 HG12 ILE A 99 17.369 -11.176 -19.129 1.00 0.00 H ATOM 1239 HG13 ILE A 99 17.137 -10.515 -17.493 1.00 0.00 H ATOM 1240 HD11 ILE A 99 15.540 -12.325 -16.988 1.00 0.00 H ATOM 1241 HD12 ILE A 99 15.772 -12.986 -18.625 1.00 0.00 H ATOM 1242 HD13 ILE A 99 17.128 -12.972 -17.470 1.00 0.00 H ATOM 1243 HG21 ILE A 99 13.348 -10.163 -18.818 1.00 0.00 H ATOM 1244 HG22 ILE A 99 14.059 -11.783 -19.020 1.00 0.00 H ATOM 1245 HG23 ILE A 99 14.073 -10.998 -17.422 1.00 0.00 H ATOM 1246 H ILE A 99 17.332 -8.658 -19.985 1.00 0.00 H ATOM 1247 N TYR A 100 14.402 -7.896 -20.767 1.00103.75 N ATOM 1248 CA TYR A 100 13.345 -7.123 -21.453 1.00114.29 C ATOM 1249 C TYR A 100 13.244 -7.351 -22.962 1.00112.22 C ATOM 1250 O TYR A 100 12.173 -7.707 -23.461 1.00109.31 O ATOM 1251 CB TYR A 100 13.525 -5.648 -21.179 1.00120.75 C ATOM 1252 CG TYR A 100 13.505 -5.454 -19.722 1.00128.53 C ATOM 1253 CD1 TYR A 100 14.685 -5.479 -18.988 1.00131.55 C ATOM 1254 CD2 TYR A 100 12.300 -5.345 -19.052 1.00125.38 C ATOM 1255 CE1 TYR A 100 14.663 -5.349 -17.613 1.00137.46 C ATOM 1256 CE2 TYR A 100 12.257 -5.213 -17.681 1.00130.64 C ATOM 1257 CZ TYR A 100 13.440 -5.216 -16.960 1.00136.50 C ATOM 1258 OH TYR A 100 13.393 -5.073 -15.587 1.00138.94 O ATOM 1259 HA TYR A 100 12.408 -7.494 -21.037 1.00 0.00 H ATOM 1260 HB3 TYR A 100 12.714 -5.084 -21.639 1.00 0.00 H ATOM 1261 HB2 TYR A 100 14.478 -5.309 -21.585 1.00 0.00 H ATOM 1262 HD2 TYR A 100 11.369 -5.364 -19.618 1.00 0.00 H ATOM 1263 HE2 TYR A 100 11.301 -5.107 -17.168 1.00 0.00 H ATOM 1264 HE1 TYR A 100 15.593 -5.350 -17.045 1.00 0.00 H ATOM 1265 HD1 TYR A 100 15.638 -5.602 -19.503 1.00 0.00 H ATOM 1266 HH TYR A 100 14.313 -5.095 -15.222 1.00 0.00 H ATOM 1267 H TYR A 100 15.125 -7.407 -20.202 1.00 0.00 H ATOM 1268 N THR A 101 14.350 -7.140 -23.681 1.00 98.91 N ATOM 1269 CA THR A 101 14.339 -7.305 -25.122 1.00100.04 C ATOM 1270 C THR A 101 13.376 -8.424 -25.466 1.00100.17 C ATOM 1271 O THR A 101 12.322 -8.224 -26.132 1.00 96.39 O ATOM 1272 CB THR A 101 15.737 -7.649 -25.609 1.00103.20 C ATOM 1273 OG1 THR A 101 16.666 -6.814 -24.910 1.00119.17 O ATOM 1274 CG2 THR A 101 15.871 -7.396 -27.059 1.00107.49 C ATOM 1275 HA THR A 101 14.022 -6.381 -25.606 1.00 0.00 H ATOM 1276 HB THR A 101 15.931 -8.705 -25.423 1.00 0.00 H ATOM 1277 HG1 THR A 101 17.586 -7.021 -25.212 1.00 0.00 H ATOM 1278 HG23 THR A 101 15.168 -8.027 -27.603 1.00 0.00 H ATOM 1279 HG21 THR A 101 15.655 -6.348 -27.265 1.00 0.00 H ATOM 1280 HG22 THR A 101 16.888 -7.628 -27.374 1.00 0.00 H ATOM 1281 H THR A 101 15.228 -6.854 -23.202 1.00 0.00 H ATOM 1282 N MET A 102 13.712 -9.588 -24.922 1.00 97.82 N ATOM 1283 CA MET A 102 13.132 -10.863 -25.324 1.00 90.90 C ATOM 1284 C MET A 102 11.658 -10.825 -25.121 1.00 99.20 C ATOM 1285 O MET A 102 10.884 -11.418 -25.894 1.00106.28 O ATOM 1286 CB MET A 102 13.739 -11.994 -24.484 1.00 92.36 C ATOM 1287 CG MET A 102 15.250 -11.838 -24.180 1.00 90.94 C ATOM 1288 SD MET A 102 16.016 -13.427 -23.669 1.00 87.93 S ATOM 1289 CE MET A 102 17.780 -12.935 -23.697 1.00 73.14 C ATOM 1290 HA MET A 102 13.348 -11.042 -26.377 1.00 0.00 H ATOM 1291 HB2 MET A 102 13.204 -12.036 -23.535 1.00 0.00 H ATOM 1292 HB3 MET A 102 13.596 -12.931 -25.022 1.00 0.00 H ATOM 1293 HG2 MET A 102 15.375 -11.112 -23.376 1.00 0.00 H ATOM 1294 HG3 MET A 102 15.754 -11.476 -25.076 1.00 0.00 H ATOM 1295 HE1 MET A 102 18.050 -12.611 -24.702 1.00 0.00 H ATOM 1296 HE2 MET A 102 17.939 -12.116 -22.995 1.00 0.00 H ATOM 1297 HE3 MET A 102 18.398 -13.786 -23.410 1.00 0.00 H ATOM 1298 H MET A 102 14.428 -9.590 -24.168 1.00 0.00 H ATOM 1299 N ILE A 103 11.266 -10.125 -24.063 1.00102.88 N ATOM 1300 CA ILE A 103 9.856 -9.961 -23.741 1.00114.22 C ATOM 1301 C ILE A 103 9.139 -8.982 -24.680 1.00124.66 C ATOM 1302 O ILE A 103 7.994 -9.255 -25.087 1.00134.79 O ATOM 1303 CB ILE A 103 9.696 -9.441 -22.318 1.00125.84 C ATOM 1304 CG1 ILE A 103 10.938 -9.814 -21.490 1.00129.85 C ATOM 1305 CG2 ILE A 103 8.382 -9.934 -21.729 1.00124.49 C ATOM 1306 CD1 ILE A 103 10.888 -9.449 -20.019 1.00122.95 C ATOM 1307 HA ILE A 103 9.405 -10.947 -23.856 1.00 0.00 H ATOM 1308 HB ILE A 103 9.637 -8.353 -22.307 1.00 0.00 H ATOM 1309 HG12 ILE A 103 11.076 -10.893 -21.562 1.00 0.00 H ATOM 1310 HG13 ILE A 103 11.797 -9.309 -21.931 1.00 0.00 H ATOM 1311 HD11 ILE A 103 10.767 -8.370 -19.917 1.00 0.00 H ATOM 1312 HD12 ILE A 103 10.045 -9.956 -19.549 1.00 0.00 H ATOM 1313 HD13 ILE A 103 11.815 -9.759 -19.537 1.00 0.00 H ATOM 1314 HG21 ILE A 103 7.554 -9.573 -22.339 1.00 0.00 H ATOM 1315 HG22 ILE A 103 8.377 -11.024 -21.716 1.00 0.00 H ATOM 1316 HG23 ILE A 103 8.277 -9.557 -20.712 1.00 0.00 H ATOM 1317 H ILE A 103 11.982 -9.684 -23.451 1.00 0.00 H ATOM 1318 N TYR A 104 9.769 -7.850 -25.022 1.00114.90 N ATOM 1319 CA TYR A 104 9.130 -6.962 -26.011 1.00121.03 C ATOM 1320 C TYR A 104 8.779 -7.792 -27.227 1.00129.34 C ATOM 1321 O TYR A 104 7.689 -7.649 -27.793 1.00134.41 O ATOM 1322 CB TYR A 104 10.013 -5.788 -26.429 1.00112.35 C ATOM 1323 CG TYR A 104 10.267 -4.868 -25.276 1.00118.29 C ATOM 1324 CD1 TYR A 104 11.488 -4.173 -25.148 1.00118.42 C ATOM 1325 CD2 TYR A 104 9.305 -4.719 -24.272 1.00113.77 C ATOM 1326 CE1 TYR A 104 11.736 -3.347 -24.050 1.00112.79 C ATOM 1327 CE2 TYR A 104 9.552 -3.921 -23.165 1.00114.09 C ATOM 1328 CZ TYR A 104 10.756 -3.232 -23.065 1.00114.47 C ATOM 1329 OH TYR A 104 10.977 -2.432 -21.982 1.00124.55 O ATOM 1330 HA TYR A 104 8.244 -6.528 -25.549 1.00 0.00 H ATOM 1331 HB3 TYR A 104 9.515 -5.233 -27.225 1.00 0.00 H ATOM 1332 HB2 TYR A 104 10.965 -6.171 -26.796 1.00 0.00 H ATOM 1333 HD2 TYR A 104 8.350 -5.236 -24.361 1.00 0.00 H ATOM 1334 HE2 TYR A 104 8.805 -3.834 -22.376 1.00 0.00 H ATOM 1335 HE1 TYR A 104 12.677 -2.803 -23.965 1.00 0.00 H ATOM 1336 HD1 TYR A 104 12.250 -4.283 -25.919 1.00 0.00 H ATOM 1337 HH TYR A 104 11.872 -2.015 -22.058 1.00 0.00 H ATOM 1338 H TYR A 104 10.687 -7.603 -24.600 1.00 0.00 H ATOM 1339 N ARG A 105 9.679 -8.704 -27.576 1.00107.33 N ATOM 1340 CA ARG A 105 9.572 -9.376 -28.819 1.00109.45 C ATOM 1341 C ARG A 105 8.400 -10.282 -28.770 1.00115.60 C ATOM 1342 O ARG A 105 8.184 -11.077 -29.691 1.00120.98 O ATOM 1343 CB ARG A 105 10.836 -10.157 -29.093 1.00119.08 C ATOM 1344 CG ARG A 105 12.067 -9.301 -28.922 1.00119.58 C ATOM 1345 CD ARG A 105 12.995 -9.633 -30.054 1.00130.49 C ATOM 1346 NE ARG A 105 14.344 -9.909 -29.589 1.00130.03 N ATOM 1347 CZ ARG A 105 14.734 -11.066 -29.052 1.00134.02 C ATOM 1348 NH1 ARG A 105 13.878 -12.089 -28.870 1.00127.16 N ATOM 1349 NH2 ARG A 105 16.000 -11.195 -28.689 1.00131.31 N ATOM 1350 HA ARG A 105 9.438 -8.654 -29.624 1.00 0.00 H ATOM 1351 HB2 ARG A 105 10.890 -10.997 -28.400 1.00 0.00 H ATOM 1352 HB3 ARG A 105 10.805 -10.532 -30.116 1.00 0.00 H ATOM 1353 HG2 ARG A 105 11.797 -8.246 -28.957 1.00 0.00 H ATOM 1354 HG3 ARG A 105 12.546 -9.521 -27.968 1.00 0.00 H ATOM 1355 HD2 ARG A 105 13.026 -8.789 -30.743 1.00 0.00 H ATOM 1356 HD3 ARG A 105 12.615 -10.512 -30.575 1.00 0.00 H ATOM 1357 HE ARG A 105 15.053 -9.154 -29.681 1.00 0.00 H ATOM 1358 HH12 ARG A 105 14.213 -12.979 -28.448 1.00 0.00 H ATOM 1359 HH11 ARG A 105 12.882 -11.990 -29.151 1.00 0.00 H ATOM 1360 HH22 ARG A 105 16.332 -12.086 -28.268 1.00 0.00 H ATOM 1361 HH21 ARG A 105 16.663 -10.405 -28.825 1.00 0.00 H ATOM 1362 H ARG A 105 10.466 -8.926 -26.934 1.00 0.00 H ATOM 1363 N ASN A 106 7.622 -10.163 -27.696 1.00112.88 N ATOM 1364 CA ASN A 106 6.408 -10.970 -27.570 1.00104.80 C ATOM 1365 C ASN A 106 5.196 -10.120 -27.388 1.00118.77 C ATOM 1366 O ASN A 106 4.039 -10.580 -27.468 1.00123.10 O ATOM 1367 CB ASN A 106 6.522 -11.899 -26.405 1.00 87.76 C ATOM 1368 CG ASN A 106 6.931 -13.244 -26.827 1.00 96.02 C ATOM 1369 OD1 ASN A 106 6.054 -14.115 -27.133 1.00103.81 O ATOM 1370 ND2 ASN A 106 8.279 -13.444 -26.934 1.00 82.83 N ATOM 1371 HA ASN A 106 6.302 -11.537 -28.495 1.00 0.00 H ATOM 1372 HB2 ASN A 106 7.263 -11.505 -25.709 1.00 0.00 H ATOM 1373 HB3 ASN A 106 5.555 -11.963 -25.907 1.00 0.00 H ATOM 1374 HD22 ASN A 106 8.940 -12.687 -26.666 1.00 0.00 H ATOM 1375 HD21 ASN A 106 8.644 -14.353 -27.284 1.00 0.00 H ATOM 1376 H ASN A 106 7.878 -9.493 -26.943 1.00 0.00 H ATOM 1377 N LEU A 107 5.454 -8.855 -27.138 1.00111.97 N ATOM 1378 CA LEU A 107 4.347 -7.991 -26.920 1.00113.15 C ATOM 1379 C LEU A 107 4.005 -7.463 -28.251 1.00129.79 C ATOM 1380 O LEU A 107 4.897 -7.148 -29.051 1.00147.75 O ATOM 1381 CB LEU A 107 4.741 -6.891 -25.940 1.00106.04 C ATOM 1382 CG LEU A 107 5.052 -7.661 -24.631 1.00 91.34 C ATOM 1383 CD1 LEU A 107 5.948 -6.871 -23.730 1.00 78.79 C ATOM 1384 CD2 LEU A 107 3.732 -8.028 -23.990 1.00 87.95 C ATOM 1385 HA LEU A 107 3.488 -8.495 -26.477 1.00 0.00 H ATOM 1386 HB2 LEU A 107 5.620 -6.352 -26.293 1.00 0.00 H ATOM 1387 HB3 LEU A 107 3.921 -6.189 -25.793 1.00 0.00 H ATOM 1388 HG LEU A 107 5.607 -8.575 -24.843 1.00 0.00 H ATOM 1389 HD21 LEU A 107 3.170 -7.120 -23.772 1.00 0.00 H ATOM 1390 HD22 LEU A 107 3.160 -8.656 -24.673 1.00 0.00 H ATOM 1391 HD23 LEU A 107 3.918 -8.572 -23.064 1.00 0.00 H ATOM 1392 HD11 LEU A 107 6.888 -6.667 -24.243 1.00 0.00 H ATOM 1393 HD12 LEU A 107 5.462 -5.930 -23.471 1.00 0.00 H ATOM 1394 HD13 LEU A 107 6.144 -7.442 -22.823 1.00 0.00 H ATOM 1395 H LEU A 107 6.431 -8.500 -27.101 1.00 0.00 H ATOM 1396 N VAL A 108 2.708 -7.397 -28.518 1.00136.55 N ATOM 1397 CA VAL A 108 2.212 -6.559 -29.606 1.00125.12 C ATOM 1398 C VAL A 108 2.877 -5.157 -29.563 1.00133.11 C ATOM 1399 O VAL A 108 2.760 -4.411 -30.532 1.00139.73 O ATOM 1400 CB VAL A 108 0.657 -6.520 -29.625 1.00121.83 C ATOM 1401 CG1 VAL A 108 0.077 -7.890 -29.988 1.00113.77 C ATOM 1402 CG2 VAL A 108 0.089 -6.075 -28.282 1.00123.81 C ATOM 1403 HA VAL A 108 2.502 -7.003 -30.558 1.00 0.00 H ATOM 1404 HB VAL A 108 0.370 -5.793 -30.385 1.00 0.00 H ATOM 1405 HG11 VAL A 108 0.432 -8.183 -30.976 1.00 0.00 H ATOM 1406 HG12 VAL A 108 0.399 -8.626 -29.252 1.00 0.00 H ATOM 1407 HG13 VAL A 108 -1.011 -7.832 -29.994 1.00 0.00 H ATOM 1408 HG21 VAL A 108 0.406 -6.772 -27.506 1.00 0.00 H ATOM 1409 HG22 VAL A 108 0.456 -5.076 -28.047 1.00 0.00 H ATOM 1410 HG23 VAL A 108 -1.000 -6.061 -28.336 1.00 0.00 H ATOM 1411 H VAL A 108 2.037 -7.948 -27.946 1.00 0.00 H ATOM 1412 N VAL A 109 3.587 -4.832 -28.448 1.00149.92 N ATOM 1413 CA VAL A 109 4.393 -3.564 -28.229 1.00136.20 C ATOM 1414 C VAL A 109 5.066 -3.094 -29.508 1.00151.04 C ATOM 1415 O VAL A 109 5.121 -1.901 -29.801 1.00158.48 O ATOM 1416 CB VAL A 109 5.478 -3.641 -27.067 1.00109.96 C ATOM 1417 CG1 VAL A 109 6.752 -2.832 -27.408 1.00 88.68 C ATOM 1418 CG2 VAL A 109 4.896 -3.226 -25.698 1.00 93.29 C ATOM 1419 HA VAL A 109 3.645 -2.840 -27.907 1.00 0.00 H ATOM 1420 OXT VAL A 109 5.570 -3.921 -30.269 1.00165.15 O ATOM 1421 HB VAL A 109 5.771 -4.688 -26.987 1.00 0.00 H ATOM 1422 HG11 VAL A 109 7.200 -3.229 -28.319 1.00 0.00 H ATOM 1423 HG12 VAL A 109 6.487 -1.785 -27.558 1.00 0.00 H ATOM 1424 HG13 VAL A 109 7.464 -2.914 -26.586 1.00 0.00 H ATOM 1425 HG21 VAL A 109 4.532 -2.200 -25.755 1.00 0.00 H ATOM 1426 HG22 VAL A 109 4.072 -3.891 -25.438 1.00 0.00 H ATOM 1427 HG23 VAL A 109 5.674 -3.295 -24.938 1.00 0.00 H ATOM 1428 H VAL A 109 3.576 -5.521 -27.669 1.00 0.00 H TER 1429 VAL A 109 ATOM 1430 N GLU B 25 2.430 -40.954 -1.521 1.00103.45 N ATOM 1431 CA GLU B 25 2.105 -39.678 -0.845 1.00111.84 C ATOM 1432 C GLU B 25 2.317 -39.923 0.624 1.00125.28 C ATOM 1433 O GLU B 25 2.187 -41.072 1.092 1.00126.18 O ATOM 1434 CB GLU B 25 0.653 -39.305 -1.071 1.00103.41 C ATOM 1435 CG GLU B 25 0.361 -37.834 -0.872 1.00113.69 C ATOM 1436 CD GLU B 25 -0.993 -37.615 -0.216 1.00123.56 C ATOM 1437 OE1 GLU B 25 -1.215 -38.091 0.936 1.00121.71 O ATOM 1438 OE2 GLU B 25 -1.844 -36.960 -0.849 1.00122.97 O ATOM 1439 HA GLU B 25 2.725 -38.869 -1.230 1.00 0.00 H ATOM 1440 HB2 GLU B 25 0.384 -39.574 -2.093 1.00 0.00 H ATOM 1441 HB3 GLU B 25 0.039 -39.875 -0.373 1.00 0.00 H ATOM 1442 HG2 GLU B 25 1.135 -37.402 -0.238 1.00 0.00 H ATOM 1443 HG3 GLU B 25 0.369 -37.337 -1.842 1.00 0.00 H ATOM 1444 HN3 GLU B 25 1.799 -41.702 -1.169 1.00 0.00 H ATOM 1445 HN2 GLU B 25 3.418 -41.209 -1.320 1.00 0.00 H ATOM 1446 HN1 GLU B 25 2.301 -40.844 -2.547 1.00 0.00 H ATOM 1447 N THR B 26 2.640 -38.848 1.347 1.00129.32 N ATOM 1448 CA THR B 26 2.766 -38.878 2.812 1.00136.60 C ATOM 1449 C THR B 26 2.543 -37.500 3.438 1.00135.75 C ATOM 1450 O THR B 26 3.502 -36.734 3.659 1.00128.76 O ATOM 1451 CB THR B 26 4.139 -39.436 3.238 1.00146.53 C ATOM 1452 OG1 THR B 26 4.291 -40.770 2.723 1.00137.93 O ATOM 1453 CG2 THR B 26 4.294 -39.426 4.775 1.00141.03 C ATOM 1454 HA THR B 26 1.984 -39.542 3.181 1.00 0.00 H ATOM 1455 HB THR B 26 4.920 -38.797 2.826 1.00 0.00 H ATOM 1456 HG1 THR B 26 4.233 -40.750 1.735 1.00 0.00 H ATOM 1457 HG23 THR B 26 4.175 -38.407 5.144 1.00 0.00 H ATOM 1458 HG21 THR B 26 3.532 -40.066 5.220 1.00 0.00 H ATOM 1459 HG22 THR B 26 5.283 -39.798 5.042 1.00 0.00 H ATOM 1460 H THR B 26 2.810 -37.949 0.852 1.00 0.00 H ATOM 1461 N LEU B 27 1.276 -37.195 3.719 1.00135.38 N ATOM 1462 CA LEU B 27 0.906 -35.941 4.366 1.00134.23 C ATOM 1463 C LEU B 27 1.638 -35.760 5.700 1.00148.55 C ATOM 1464 O LEU B 27 2.240 -36.712 6.217 1.00158.57 O ATOM 1465 CB LEU B 27 -0.582 -35.901 4.659 1.00124.60 C ATOM 1466 CG LEU B 27 -1.671 -36.229 3.655 1.00139.19 C ATOM 1467 CD1 LEU B 27 -3.017 -36.158 4.381 1.00127.15 C ATOM 1468 CD2 LEU B 27 -1.630 -35.303 2.438 1.00146.85 C ATOM 1469 HA LEU B 27 1.184 -35.145 3.675 1.00 0.00 H ATOM 1470 HB2 LEU B 27 -0.734 -36.589 5.490 1.00 0.00 H ATOM 1471 HB3 LEU B 27 -0.787 -34.883 4.990 1.00 0.00 H ATOM 1472 HG LEU B 27 -1.515 -37.233 3.261 1.00 0.00 H ATOM 1473 HD21 LEU B 27 -1.767 -34.272 2.763 1.00 0.00 H ATOM 1474 HD22 LEU B 27 -0.666 -35.403 1.939 1.00 0.00 H ATOM 1475 HD23 LEU B 27 -2.428 -35.577 1.748 1.00 0.00 H ATOM 1476 HD11 LEU B 27 -3.026 -36.880 5.198 1.00 0.00 H ATOM 1477 HD12 LEU B 27 -3.161 -35.154 4.780 1.00 0.00 H ATOM 1478 HD13 LEU B 27 -3.819 -36.390 3.680 1.00 0.00 H ATOM 1479 H LEU B 27 0.528 -37.873 3.469 1.00 0.00 H ATOM 1480 N VAL B 28 1.555 -34.542 6.256 1.00139.06 N ATOM 1481 CA VAL B 28 2.222 -34.169 7.504 1.00125.96 C ATOM 1482 C VAL B 28 1.459 -33.033 8.146 1.00127.82 C ATOM 1483 O VAL B 28 0.799 -32.249 7.437 1.00118.56 O ATOM 1484 CB VAL B 28 3.673 -33.683 7.268 1.00116.63 C ATOM 1485 CG1 VAL B 28 4.567 -34.820 6.788 1.00105.09 C ATOM 1486 CG2 VAL B 28 3.704 -32.517 6.292 1.00112.19 C ATOM 1487 HA VAL B 28 2.248 -35.055 8.138 1.00 0.00 H ATOM 1488 HB VAL B 28 4.065 -33.335 8.223 1.00 0.00 H ATOM 1489 HG11 VAL B 28 4.583 -35.610 7.539 1.00 0.00 H ATOM 1490 HG12 VAL B 28 4.177 -35.216 5.851 1.00 0.00 H ATOM 1491 HG13 VAL B 28 5.578 -34.444 6.632 1.00 0.00 H ATOM 1492 HG21 VAL B 28 3.280 -32.832 5.338 1.00 0.00 H ATOM 1493 HG22 VAL B 28 3.119 -31.691 6.696 1.00 0.00 H ATOM 1494 HG23 VAL B 28 4.735 -32.196 6.144 1.00 0.00 H ATOM 1495 H VAL B 28 0.983 -33.821 5.772 1.00 0.00 H ATOM 1496 N ARG B 29 1.581 -32.937 9.476 1.00130.05 N ATOM 1497 CA ARG B 29 0.748 -32.036 10.257 1.00124.53 C ATOM 1498 C ARG B 29 1.528 -30.884 10.800 1.00137.23 C ATOM 1499 O ARG B 29 2.409 -31.099 11.623 1.00138.65 O ATOM 1500 CB ARG B 29 0.063 -32.750 11.408 1.00132.09 C ATOM 1501 CG ARG B 29 -0.800 -31.814 12.268 1.00134.68 C ATOM 1502 CD ARG B 29 -1.656 -32.556 13.292 1.00136.97 C ATOM 1503 NE ARG B 29 -2.924 -33.044 12.754 1.00130.25 N ATOM 1504 CZ ARG B 29 -3.963 -32.260 12.489 1.00130.20 C ATOM 1505 NH1 ARG B 29 -3.888 -30.934 12.703 1.00129.63 N ATOM 1506 NH2 ARG B 29 -5.070 -32.805 12.000 1.00123.20 N ATOM 1507 HA ARG B 29 -0.009 -31.661 9.569 1.00 0.00 H ATOM 1508 HB2 ARG B 29 -0.575 -33.534 11.000 1.00 0.00 H ATOM 1509 HB3 ARG B 29 0.827 -33.199 12.043 1.00 0.00 H ATOM 1510 HG2 ARG B 29 -0.142 -31.126 12.799 1.00 0.00 H ATOM 1511 HG3 ARG B 29 -1.459 -31.248 11.610 1.00 0.00 H ATOM 1512 HD2 ARG B 29 -1.870 -31.878 14.118 1.00 0.00 H ATOM 1513 HD3 ARG B 29 -1.088 -33.409 13.662 1.00 0.00 H ATOM 1514 HE ARG B 29 -3.018 -34.063 12.568 1.00 0.00 H ATOM 1515 HH12 ARG B 29 -4.706 -30.326 12.493 1.00 0.00 H ATOM 1516 HH11 ARG B 29 -3.012 -30.517 13.078 1.00 0.00 H ATOM 1517 HH22 ARG B 29 -5.894 -32.207 11.786 1.00 0.00 H ATOM 1518 HH21 ARG B 29 -5.114 -33.830 11.830 1.00 0.00 H ATOM 1519 H ARG B 29 2.290 -33.522 9.963 1.00 0.00 H ATOM 1520 N PRO B 30 1.177 -29.649 10.364 1.00145.89 N ATOM 1521 CA PRO B 30 1.980 -28.448 10.605 1.00141.62 C ATOM 1522 C PRO B 30 1.559 -27.711 11.884 1.00146.16 C ATOM 1523 O PRO B 30 0.415 -27.842 12.300 1.00148.47 O ATOM 1524 CB PRO B 30 1.690 -27.597 9.354 1.00133.92 C ATOM 1525 CG PRO B 30 0.497 -28.234 8.663 1.00122.72 C ATOM 1526 CD PRO B 30 -0.011 -29.330 9.544 1.00136.44 C ATOM 1527 HA PRO B 30 3.037 -28.670 10.755 1.00 0.00 H ATOM 1528 HD3 PRO B 30 -0.839 -28.987 10.164 1.00 0.00 H ATOM 1529 HD2 PRO B 30 -0.330 -30.192 8.958 1.00 0.00 H ATOM 1530 HG3 PRO B 30 0.801 -28.643 7.700 1.00 0.00 H ATOM 1531 HG2 PRO B 30 -0.284 -27.489 8.510 1.00 0.00 H ATOM 1532 HB2 PRO B 30 1.455 -26.572 9.642 1.00 0.00 H ATOM 1533 HB3 PRO B 30 2.554 -27.598 8.690 1.00 0.00 H ATOM 1534 N LYS B 31 2.456 -26.937 12.491 1.00138.75 N ATOM 1535 CA LYS B 31 2.120 -26.208 13.720 1.00137.27 C ATOM 1536 C LYS B 31 1.166 -25.021 13.521 1.00141.51 C ATOM 1537 O LYS B 31 0.800 -24.702 12.391 1.00135.96 O ATOM 1538 CB LYS B 31 3.390 -25.785 14.457 1.00135.60 C ATOM 1539 CG LYS B 31 3.796 -26.831 15.474 1.00132.12 C ATOM 1540 CD LYS B 31 5.016 -26.413 16.259 1.00130.80 C ATOM 1541 CE LYS B 31 5.357 -27.472 17.293 1.00123.82 C ATOM 1542 NZ LYS B 31 5.918 -28.664 16.603 1.00114.72 N ATOM 1543 HA LYS B 31 1.561 -26.912 14.337 1.00 0.00 H ATOM 1544 HB2 LYS B 31 4.196 -25.656 13.735 1.00 0.00 H ATOM 1545 HB3 LYS B 31 3.208 -24.840 14.969 1.00 0.00 H ATOM 1546 HG2 LYS B 31 2.969 -26.989 16.166 1.00 0.00 H ATOM 1547 HG3 LYS B 31 4.015 -27.763 14.953 1.00 0.00 H ATOM 1548 HD2 LYS B 31 5.858 -26.288 15.578 1.00 0.00 H ATOM 1549 HD3 LYS B 31 4.815 -25.468 16.763 1.00 0.00 H ATOM 1550 HE2 LYS B 31 4.456 -27.755 17.837 1.00 0.00 H ATOM 1551 HE3 LYS B 31 6.092 -27.075 17.993 1.00 0.00 H ATOM 1552 HZ1 LYS B 31 5.214 -29.040 15.936 1.00 0.00 H ATOM 1553 HZ2 LYS B 31 6.777 -28.391 16.085 1.00 0.00 H ATOM 1554 HZ3 LYS B 31 6.153 -29.392 17.307 1.00 0.00 H ATOM 1555 H LYS B 31 3.410 -26.847 12.088 1.00 0.00 H ATOM 1556 N PRO B 32 0.717 -24.379 14.621 1.00150.83 N ATOM 1557 CA PRO B 32 -0.139 -23.210 14.373 1.00144.08 C ATOM 1558 C PRO B 32 0.591 -22.072 13.681 1.00129.90 C ATOM 1559 O PRO B 32 -0.056 -21.205 13.105 1.00142.34 O ATOM 1560 CB PRO B 32 -0.581 -22.772 15.788 1.00152.42 C ATOM 1561 CG PRO B 32 0.237 -23.561 16.759 1.00147.30 C ATOM 1562 CD PRO B 32 0.697 -24.796 16.040 1.00145.63 C ATOM 1563 HA PRO B 32 -0.964 -23.462 13.706 1.00 0.00 H ATOM 1564 HD3 PRO B 32 1.691 -25.094 16.373 1.00 0.00 H ATOM 1565 HD2 PRO B 32 0.001 -25.620 16.195 1.00 0.00 H ATOM 1566 HG3 PRO B 32 -0.368 -23.834 17.624 1.00 0.00 H ATOM 1567 HG2 PRO B 32 1.096 -22.976 17.088 1.00 0.00 H ATOM 1568 HB2 PRO B 32 -0.401 -21.706 15.925 1.00 0.00 H ATOM 1569 HB3 PRO B 32 -1.641 -22.982 15.932 1.00 0.00 H ATOM 1570 N GLU B 33 1.921 -22.095 13.743 1.00122.07 N ATOM 1571 CA GLU B 33 2.794 -20.987 13.309 1.00126.02 C ATOM 1572 C GLU B 33 2.827 -20.884 11.809 1.00123.69 C ATOM 1573 O GLU B 33 2.217 -20.016 11.143 1.00104.84 O ATOM 1574 CB GLU B 33 4.235 -21.295 13.728 1.00123.44 C ATOM 1575 CG GLU B 33 4.400 -21.797 15.151 1.00140.74 C ATOM 1576 CD GLU B 33 3.539 -21.015 16.103 1.00134.07 C ATOM 1577 OE1 GLU B 33 3.724 -19.790 16.157 1.00135.66 O ATOM 1578 OE2 GLU B 33 2.655 -21.620 16.742 1.00140.30 O ATOM 1579 HA GLU B 33 2.409 -20.070 13.755 1.00 0.00 H ATOM 1580 HB2 GLU B 33 4.627 -22.056 13.054 1.00 0.00 H ATOM 1581 HB3 GLU B 33 4.820 -20.381 13.622 1.00 0.00 H ATOM 1582 HG2 GLU B 33 4.115 -22.848 15.194 1.00 0.00 H ATOM 1583 HG3 GLU B 33 5.444 -21.693 15.447 1.00 0.00 H ATOM 1584 H GLU B 33 2.375 -22.950 14.122 1.00 0.00 H ATOM 1585 N LEU B 34 3.618 -21.804 11.291 1.00132.07 N ATOM 1586 CA LEU B 34 3.629 -22.107 9.896 1.00125.74 C ATOM 1587 C LEU B 34 2.283 -21.724 9.283 1.00117.80 C ATOM 1588 O LEU B 34 2.096 -20.619 8.742 1.00112.21 O ATOM 1589 CB LEU B 34 3.910 -23.601 9.758 1.00110.90 C ATOM 1590 CG LEU B 34 3.895 -24.161 8.336 1.00121.81 C ATOM 1591 CD1 LEU B 34 4.272 -23.095 7.323 1.00114.43 C ATOM 1592 CD2 LEU B 34 4.784 -25.394 8.196 1.00117.86 C ATOM 1593 HA LEU B 34 4.398 -21.544 9.366 1.00 0.00 H ATOM 1594 HB2 LEU B 34 4.895 -23.795 10.182 1.00 0.00 H ATOM 1595 HB3 LEU B 34 3.156 -24.136 10.335 1.00 0.00 H ATOM 1596 HG LEU B 34 2.873 -24.478 8.128 1.00 0.00 H ATOM 1597 HD21 LEU B 34 5.811 -25.130 8.447 1.00 0.00 H ATOM 1598 HD22 LEU B 34 4.432 -26.173 8.872 1.00 0.00 H ATOM 1599 HD23 LEU B 34 4.741 -25.756 7.169 1.00 0.00 H ATOM 1600 HD11 LEU B 34 3.560 -22.272 7.381 1.00 0.00 H ATOM 1601 HD12 LEU B 34 5.274 -22.726 7.542 1.00 0.00 H ATOM 1602 HD13 LEU B 34 4.252 -23.524 6.321 1.00 0.00 H ATOM 1603 H LEU B 34 4.257 -22.328 11.922 1.00 0.00 H ATOM 1604 N LEU B 35 1.338 -22.626 9.451 1.00113.88 N ATOM 1605 CA LEU B 35 0.036 -22.540 8.825 1.00124.17 C ATOM 1606 C LEU B 35 -0.423 -21.124 8.577 1.00119.96 C ATOM 1607 O LEU B 35 -0.851 -20.802 7.474 1.00130.95 O ATOM 1608 CB LEU B 35 -0.992 -23.285 9.670 1.00139.15 C ATOM 1609 CG LEU B 35 -1.966 -24.255 8.995 1.00130.13 C ATOM 1610 CD1 LEU B 35 -2.574 -23.674 7.714 1.00118.79 C ATOM 1611 CD2 LEU B 35 -1.239 -25.568 8.765 1.00126.20 C ATOM 1612 HA LEU B 35 0.130 -23.006 7.844 1.00 0.00 H ATOM 1613 HB2 LEU B 35 -0.436 -23.859 10.412 1.00 0.00 H ATOM 1614 HB3 LEU B 35 -1.595 -22.530 10.174 1.00 0.00 H ATOM 1615 HG LEU B 35 -2.822 -24.431 9.647 1.00 0.00 H ATOM 1616 HD21 LEU B 35 -0.374 -25.396 8.124 1.00 0.00 H ATOM 1617 HD22 LEU B 35 -0.909 -25.971 9.722 1.00 0.00 H ATOM 1618 HD23 LEU B 35 -1.914 -26.276 8.284 1.00 0.00 H ATOM 1619 HD11 LEU B 35 -3.119 -22.761 7.954 1.00 0.00 H ATOM 1620 HD12 LEU B 35 -1.777 -23.448 7.005 1.00 0.00 H ATOM 1621 HD13 LEU B 35 -3.257 -24.401 7.275 1.00 0.00 H ATOM 1622 H LEU B 35 1.538 -23.442 10.065 1.00 0.00 H ATOM 1623 N LYS B 36 -0.324 -20.255 9.571 1.00119.88 N ATOM 1624 CA LYS B 36 -0.752 -18.886 9.315 1.00124.62 C ATOM 1625 C LYS B 36 -0.184 -18.526 7.928 1.00115.31 C ATOM 1626 O LYS B 36 -0.909 -18.090 7.013 1.00110.11 O ATOM 1627 CB LYS B 36 -0.243 -17.919 10.402 1.00126.16 C ATOM 1628 CG LYS B 36 -0.496 -18.361 11.842 1.00119.96 C ATOM 1629 CD LYS B 36 -1.109 -17.237 12.690 1.00123.64 C ATOM 1630 CE LYS B 36 -0.147 -16.096 12.921 1.00116.50 C ATOM 1631 NZ LYS B 36 1.114 -16.620 13.516 1.00110.39 N ATOM 1632 HA LYS B 36 -1.838 -18.800 9.336 1.00 0.00 H ATOM 1633 HB2 LYS B 36 0.832 -17.800 10.270 1.00 0.00 H ATOM 1634 HB3 LYS B 36 -0.734 -16.957 10.254 1.00 0.00 H ATOM 1635 HG2 LYS B 36 -1.180 -19.210 11.835 1.00 0.00 H ATOM 1636 HG3 LYS B 36 0.451 -18.663 12.289 1.00 0.00 H ATOM 1637 HD2 LYS B 36 -1.991 -16.853 12.177 1.00 0.00 H ATOM 1638 HD3 LYS B 36 -1.403 -17.648 13.656 1.00 0.00 H ATOM 1639 HE2 LYS B 36 -0.597 -15.373 13.602 1.00 0.00 H ATOM 1640 HE3 LYS B 36 0.074 -15.609 11.971 1.00 0.00 H ATOM 1641 HZ1 LYS B 36 0.902 -17.083 14.423 1.00 0.00 H ATOM 1642 HZ2 LYS B 36 1.543 -17.309 12.865 1.00 0.00 H ATOM 1643 HZ3 LYS B 36 1.775 -15.833 13.674 1.00 0.00 H ATOM 1644 H LYS B 36 0.046 -20.539 10.501 1.00 0.00 H ATOM 1645 N LEU B 37 1.107 -18.806 7.780 1.00 97.54 N ATOM 1646 CA LEU B 37 1.917 -18.250 6.700 1.00107.99 C ATOM 1647 C LEU B 37 1.430 -18.707 5.320 1.00111.93 C ATOM 1648 O LEU B 37 0.968 -17.883 4.482 1.00109.89 O ATOM 1649 CB LEU B 37 3.366 -18.637 6.978 1.00113.83 C ATOM 1650 CG LEU B 37 4.559 -18.640 6.041 1.00109.35 C ATOM 1651 CD1 LEU B 37 4.493 -19.850 5.118 1.00 97.76 C ATOM 1652 CD2 LEU B 37 4.536 -17.316 5.326 1.00106.96 C ATOM 1653 HA LEU B 37 1.827 -17.164 6.675 1.00 0.00 H ATOM 1654 HB2 LEU B 37 3.667 -17.982 7.795 1.00 0.00 H ATOM 1655 HB3 LEU B 37 3.306 -19.663 7.340 1.00 0.00 H ATOM 1656 HG LEU B 37 5.511 -18.738 6.563 1.00 0.00 H ATOM 1657 HD21 LEU B 37 3.602 -17.220 4.772 1.00 0.00 H ATOM 1658 HD22 LEU B 37 4.612 -16.509 6.055 1.00 0.00 H ATOM 1659 HD23 LEU B 37 5.377 -17.263 4.635 1.00 0.00 H ATOM 1660 HD11 LEU B 37 4.503 -20.762 5.715 1.00 0.00 H ATOM 1661 HD12 LEU B 37 3.575 -19.808 4.531 1.00 0.00 H ATOM 1662 HD13 LEU B 37 5.354 -19.843 4.449 1.00 0.00 H ATOM 1663 H LEU B 37 1.559 -19.448 8.462 1.00 0.00 H ATOM 1664 N LEU B 38 1.507 -20.019 5.104 1.00 95.38 N ATOM 1665 CA LEU B 38 0.823 -20.658 3.985 1.00 97.46 C ATOM 1666 C LEU B 38 -0.454 -19.933 3.641 1.00105.20 C ATOM 1667 O LEU B 38 -0.643 -19.454 2.527 1.00114.38 O ATOM 1668 CB LEU B 38 0.500 -22.081 4.334 1.00 84.56 C ATOM 1669 CG LEU B 38 1.703 -22.804 4.961 1.00 89.14 C ATOM 1670 CD1 LEU B 38 1.276 -24.219 5.289 1.00106.03 C ATOM 1671 CD2 LEU B 38 2.950 -22.931 4.127 1.00 83.00 C ATOM 1672 HA LEU B 38 1.487 -20.625 3.121 1.00 0.00 H ATOM 1673 HB2 LEU B 38 -0.327 -22.091 5.044 1.00 0.00 H ATOM 1674 HB3 LEU B 38 0.205 -22.608 3.427 1.00 0.00 H ATOM 1675 HG LEU B 38 1.973 -22.178 5.811 1.00 0.00 H ATOM 1676 HD21 LEU B 38 2.722 -23.486 3.217 1.00 0.00 H ATOM 1677 HD22 LEU B 38 3.314 -21.937 3.867 1.00 0.00 H ATOM 1678 HD23 LEU B 38 3.714 -23.462 4.696 1.00 0.00 H ATOM 1679 HD11 LEU B 38 0.443 -24.192 5.991 1.00 0.00 H ATOM 1680 HD12 LEU B 38 0.966 -24.725 4.375 1.00 0.00 H ATOM 1681 HD13 LEU B 38 2.113 -24.755 5.736 1.00 0.00 H ATOM 1682 H LEU B 38 2.071 -20.605 5.752 1.00 0.00 H ATOM 1683 N LYS B 39 -1.320 -19.799 4.623 1.00120.44 N ATOM 1684 CA LYS B 39 -2.591 -19.152 4.373 1.00132.85 C ATOM 1685 C LYS B 39 -2.379 -17.786 3.720 1.00131.16 C ATOM 1686 O LYS B 39 -3.282 -17.288 3.045 1.00123.33 O ATOM 1687 CB LYS B 39 -3.393 -19.041 5.675 1.00143.50 C ATOM 1688 CG LYS B 39 -3.897 -20.382 6.217 1.00141.94 C ATOM 1689 CD LYS B 39 -5.389 -20.636 5.962 1.00138.93 C ATOM 1690 CE LYS B 39 -5.889 -21.820 6.793 1.00143.70 C ATOM 1691 NZ LYS B 39 -7.297 -22.224 6.533 1.00142.39 N ATOM 1692 HA LYS B 39 -3.169 -19.760 3.677 1.00 0.00 H ATOM 1693 HB2 LYS B 39 -2.756 -18.584 6.432 1.00 0.00 H ATOM 1694 HB3 LYS B 39 -4.255 -18.400 5.492 1.00 0.00 H ATOM 1695 HG2 LYS B 39 -3.327 -21.180 5.742 1.00 0.00 H ATOM 1696 HG3 LYS B 39 -3.724 -20.404 7.293 1.00 0.00 H ATOM 1697 HD2 LYS B 39 -5.955 -19.745 6.233 1.00 0.00 H ATOM 1698 HD3 LYS B 39 -5.539 -20.853 4.904 1.00 0.00 H ATOM 1699 HE2 LYS B 39 -5.803 -21.554 7.846 1.00 0.00 H ATOM 1700 HE3 LYS B 39 -5.248 -22.676 6.582 1.00 0.00 H ATOM 1701 HZ1 LYS B 39 -7.930 -21.426 6.742 1.00 0.00 H ATOM 1702 HZ2 LYS B 39 -7.399 -22.497 5.535 1.00 0.00 H ATOM 1703 HZ3 LYS B 39 -7.543 -23.031 7.141 1.00 0.00 H ATOM 1704 H LYS B 39 -1.093 -20.156 5.573 1.00 0.00 H ATOM 1705 N SER B 40 -1.195 -17.180 3.910 1.00121.93 N ATOM 1706 CA SER B 40 -0.964 -15.871 3.305 1.00112.83 C ATOM 1707 C SER B 40 -0.683 -16.011 1.818 1.00116.64 C ATOM 1708 O SER B 40 -0.978 -15.120 1.046 1.00111.88 O ATOM 1709 CB SER B 40 0.186 -15.124 3.942 1.00111.70 C ATOM 1710 OG SER B 40 0.711 -14.128 3.032 1.00 98.67 O ATOM 1711 HA SER B 40 -1.876 -15.298 3.471 1.00 0.00 H ATOM 1712 HB2 SER B 40 0.976 -15.831 4.195 1.00 0.00 H ATOM 1713 HB3 SER B 40 -0.164 -14.632 4.849 1.00 0.00 H ATOM 1714 HG SER B 40 1.033 -14.573 2.208 1.00 0.00 H ATOM 1715 H SER B 40 -0.454 -17.636 4.479 1.00 0.00 H ATOM 1716 N VAL B 41 -0.070 -17.108 1.404 1.00111.27 N ATOM 1717 CA VAL B 41 0.205 -17.247 -0.025 1.00105.19 C ATOM 1718 C VAL B 41 -0.728 -18.265 -0.692 1.00113.16 C ATOM 1719 O VAL B 41 -0.318 -18.972 -1.598 1.00120.73 O ATOM 1720 CB VAL B 41 1.690 -17.529 -0.295 1.00 96.00 C ATOM 1721 CG1 VAL B 41 2.497 -16.230 -0.134 1.00 84.87 C ATOM 1722 CG2 VAL B 41 2.196 -18.635 0.618 1.00 92.94 C ATOM 1723 HA VAL B 41 -0.013 -16.287 -0.493 1.00 0.00 H ATOM 1724 HB VAL B 41 1.817 -17.879 -1.319 1.00 0.00 H ATOM 1725 HG11 VAL B 41 2.133 -15.487 -0.844 1.00 0.00 H ATOM 1726 HG12 VAL B 41 2.377 -15.853 0.882 1.00 0.00 H ATOM 1727 HG13 VAL B 41 3.551 -16.432 -0.326 1.00 0.00 H ATOM 1728 HG21 VAL B 41 2.076 -18.330 1.657 1.00 0.00 H ATOM 1729 HG22 VAL B 41 1.623 -19.545 0.437 1.00 0.00 H ATOM 1730 HG23 VAL B 41 3.250 -18.821 0.412 1.00 0.00 H ATOM 1731 H VAL B 41 0.208 -17.851 2.077 1.00 0.00 H ATOM 1732 N GLY B 42 -1.967 -18.343 -0.193 1.00108.25 N ATOM 1733 CA GLY B 42 -3.045 -19.070 -0.812 1.00100.36 C ATOM 1734 C GLY B 42 -3.567 -20.251 -0.012 1.00108.44 C ATOM 1735 O GLY B 42 -4.761 -20.291 0.332 1.00106.39 O ATOM 1736 HA3 GLY B 42 -2.693 -19.442 -1.774 1.00 0.00 H ATOM 1737 HA2 GLY B 42 -3.872 -18.378 -0.972 1.00 0.00 H ATOM 1738 H GLY B 42 -2.164 -17.847 0.699 1.00 0.00 H ATOM 1739 N ALA B 43 -2.682 -21.205 0.288 1.00 97.64 N ATOM 1740 CA ALA B 43 -3.074 -22.558 0.711 1.00 98.85 C ATOM 1741 C ALA B 43 -4.329 -22.745 1.570 1.00119.38 C ATOM 1742 O ALA B 43 -4.793 -21.809 2.227 1.00135.91 O ATOM 1743 CB ALA B 43 -1.912 -23.237 1.366 1.00 99.03 C ATOM 1744 HA ALA B 43 -3.371 -23.015 -0.233 1.00 0.00 H ATOM 1745 HB1 ALA B 43 -1.086 -23.304 0.658 1.00 0.00 H ATOM 1746 HB2 ALA B 43 -1.600 -22.661 2.237 1.00 0.00 H ATOM 1747 HB3 ALA B 43 -2.207 -24.239 1.678 1.00 0.00 H ATOM 1748 H ALA B 43 -1.669 -20.981 0.219 1.00 0.00 H ATOM 1749 N GLN B 44 -4.842 -23.981 1.591 1.00126.59 N ATOM 1750 CA GLN B 44 -6.186 -24.259 2.102 1.00124.78 C ATOM 1751 C GLN B 44 -6.221 -25.371 3.134 1.00127.00 C ATOM 1752 O GLN B 44 -6.550 -25.141 4.296 1.00136.79 O ATOM 1753 CB GLN B 44 -7.140 -24.610 0.943 1.00112.26 C ATOM 1754 CG GLN B 44 -8.483 -23.889 0.967 1.00111.69 C ATOM 1755 CD GLN B 44 -8.348 -22.373 1.038 1.00110.84 C ATOM 1756 OE1 GLN B 44 -9.305 -21.669 1.405 1.00112.41 O ATOM 1757 NE2 GLN B 44 -7.156 -21.862 0.706 1.00 97.24 N ATOM 1758 HA GLN B 44 -6.513 -23.346 2.600 1.00 0.00 H ATOM 1759 HB2 GLN B 44 -6.640 -24.361 0.007 1.00 0.00 H ATOM 1760 HB3 GLN B 44 -7.332 -25.682 0.977 1.00 0.00 H ATOM 1761 HG2 GLN B 44 -9.031 -24.146 0.061 1.00 0.00 H ATOM 1762 HG3 GLN B 44 -9.044 -24.229 1.838 1.00 0.00 H ATOM 1763 HE22 GLN B 44 -6.386 -22.492 0.405 1.00 0.00 H ATOM 1764 HE21 GLN B 44 -7.000 -20.835 0.749 1.00 0.00 H ATOM 1765 H GLN B 44 -4.267 -24.770 1.233 1.00 0.00 H ATOM 1766 N LYS B 45 -5.915 -26.579 2.697 1.00115.61 N ATOM 1767 CA LYS B 45 -5.895 -27.725 3.583 1.00123.00 C ATOM 1768 C LYS B 45 -5.366 -27.375 4.987 1.00128.87 C ATOM 1769 O LYS B 45 -4.609 -26.440 5.162 1.00149.42 O ATOM 1770 CB LYS B 45 -5.044 -28.814 2.930 1.00114.28 C ATOM 1771 CG LYS B 45 -5.710 -29.485 1.728 1.00115.67 C ATOM 1772 CD LYS B 45 -5.810 -28.550 0.503 1.00123.76 C ATOM 1773 CE LYS B 45 -4.494 -28.356 -0.261 1.00118.20 C ATOM 1774 NZ LYS B 45 -4.015 -29.604 -0.943 1.00110.64 N ATOM 1775 HA LYS B 45 -6.916 -28.077 3.730 1.00 0.00 H ATOM 1776 HB2 LYS B 45 -4.108 -28.365 2.598 1.00 0.00 H ATOM 1777 HB3 LYS B 45 -4.833 -29.579 3.677 1.00 0.00 H ATOM 1778 HG2 LYS B 45 -5.126 -30.363 1.450 1.00 0.00 H ATOM 1779 HG3 LYS B 45 -6.715 -29.794 2.014 1.00 0.00 H ATOM 1780 HD2 LYS B 45 -6.545 -28.968 -0.185 1.00 0.00 H ATOM 1781 HD3 LYS B 45 -6.151 -27.574 0.847 1.00 0.00 H ATOM 1782 HE2 LYS B 45 -3.729 -28.031 0.444 1.00 0.00 H ATOM 1783 HE3 LYS B 45 -4.642 -27.584 -1.016 1.00 0.00 H ATOM 1784 HZ1 LYS B 45 -3.859 -30.348 -0.233 1.00 0.00 H ATOM 1785 HZ2 LYS B 45 -4.732 -29.921 -1.627 1.00 0.00 H ATOM 1786 HZ3 LYS B 45 -3.123 -29.406 -1.440 1.00 0.00 H ATOM 1787 H LYS B 45 -5.683 -26.711 1.692 1.00 0.00 H ATOM 1788 N ASP B 46 -5.781 -28.089 6.009 1.00133.95 N ATOM 1789 CA ASP B 46 -5.064 -28.007 7.265 1.00129.91 C ATOM 1790 C ASP B 46 -4.307 -29.322 7.218 1.00132.00 C ATOM 1791 O ASP B 46 -3.961 -29.930 8.239 1.00131.82 O ATOM 1792 CB ASP B 46 -6.034 -27.959 8.448 1.00138.52 C ATOM 1793 CG ASP B 46 -7.047 -26.817 8.345 1.00139.39 C ATOM 1794 OD1 ASP B 46 -7.565 -26.565 7.242 1.00135.15 O ATOM 1795 OD2 ASP B 46 -7.347 -26.180 9.382 1.00140.97 O ATOM 1796 HA ASP B 46 -4.439 -27.123 7.389 1.00 0.00 H ATOM 1797 HB2 ASP B 46 -6.577 -28.903 8.490 1.00 0.00 H ATOM 1798 HB3 ASP B 46 -5.458 -27.831 9.365 1.00 0.00 H ATOM 1799 H ASP B 46 -6.614 -28.705 5.917 1.00 0.00 H ATOM 1800 N THR B 47 -4.085 -29.769 5.990 1.00119.61 N ATOM 1801 CA THR B 47 -3.377 -31.017 5.748 1.00137.61 C ATOM 1802 C THR B 47 -2.553 -30.960 4.427 1.00129.57 C ATOM 1803 O THR B 47 -3.111 -30.663 3.368 1.00129.90 O ATOM 1804 CB THR B 47 -4.317 -32.269 5.825 1.00138.30 C ATOM 1805 OG1 THR B 47 -5.635 -31.933 6.334 1.00127.99 O ATOM 1806 CG2 THR B 47 -3.656 -33.294 6.723 1.00130.79 C ATOM 1807 HA THR B 47 -2.661 -31.140 6.561 1.00 0.00 H ATOM 1808 HB THR B 47 -4.461 -32.666 4.820 1.00 0.00 H ATOM 1809 HG1 THR B 47 -5.549 -31.555 7.245 1.00 0.00 H ATOM 1810 HG23 THR B 47 -2.669 -33.537 6.330 1.00 0.00 H ATOM 1811 HG21 THR B 47 -3.557 -32.885 7.728 1.00 0.00 H ATOM 1812 HG22 THR B 47 -4.268 -34.196 6.755 1.00 0.00 H ATOM 1813 H THR B 47 -4.425 -29.214 5.179 1.00 0.00 H ATOM 1814 N TYR B 48 -1.244 -31.258 4.507 1.00124.93 N ATOM 1815 CA TYR B 48 -0.250 -30.956 3.445 1.00112.66 C ATOM 1816 C TYR B 48 0.925 -31.948 3.402 1.00118.58 C ATOM 1817 O TYR B 48 1.399 -32.354 4.466 1.00120.60 O ATOM 1818 CB TYR B 48 0.375 -29.582 3.733 1.00105.01 C ATOM 1819 CG TYR B 48 -0.576 -28.387 3.661 1.00 97.30 C ATOM 1820 CD1 TYR B 48 -1.171 -27.851 4.799 1.00101.44 C ATOM 1821 CD2 TYR B 48 -0.873 -27.795 2.444 1.00102.43 C ATOM 1822 CE1 TYR B 48 -2.042 -26.756 4.718 1.00103.29 C ATOM 1823 CE2 TYR B 48 -1.726 -26.707 2.338 1.00105.16 C ATOM 1824 CZ TYR B 48 -2.326 -26.171 3.460 1.00112.31 C ATOM 1825 OH TYR B 48 -3.207 -25.068 3.287 1.00109.26 O ATOM 1826 HA TYR B 48 -0.792 -31.006 2.500 1.00 0.00 H ATOM 1827 HB3 TYR B 48 1.172 -29.419 3.008 1.00 0.00 H ATOM 1828 HB2 TYR B 48 0.799 -29.612 4.737 1.00 0.00 H ATOM 1829 HD2 TYR B 48 -0.420 -28.199 1.538 1.00 0.00 H ATOM 1830 HE2 TYR B 48 -1.925 -26.271 1.359 1.00 0.00 H ATOM 1831 HE1 TYR B 48 -2.500 -26.355 5.622 1.00 0.00 H ATOM 1832 HD1 TYR B 48 -0.955 -28.291 5.772 1.00 0.00 H ATOM 1833 HH TYR B 48 -3.562 -24.789 4.168 1.00 0.00 H ATOM 1834 H TYR B 48 -0.905 -31.731 5.369 1.00 0.00 H ATOM 1835 N THR B 49 1.407 -32.305 2.203 1.00106.52 N ATOM 1836 CA THR B 49 2.652 -33.062 2.043 1.00103.06 C ATOM 1837 C THR B 49 3.865 -32.157 2.163 1.00102.12 C ATOM 1838 O THR B 49 3.764 -30.924 2.069 1.00100.42 O ATOM 1839 CB THR B 49 2.812 -33.602 0.608 1.00112.55 C ATOM 1840 OG1 THR B 49 2.394 -32.572 -0.314 1.00 96.37 O ATOM 1841 CG2 THR B 49 2.027 -34.950 0.376 1.00116.65 C ATOM 1842 HA THR B 49 2.597 -33.842 2.803 1.00 0.00 H ATOM 1843 HB THR B 49 3.860 -33.848 0.437 1.00 0.00 H ATOM 1844 HG1 THR B 49 1.447 -32.341 -0.142 1.00 0.00 H ATOM 1845 HG23 THR B 49 2.372 -35.698 1.090 1.00 0.00 H ATOM 1846 HG21 THR B 49 0.960 -34.777 0.517 1.00 0.00 H ATOM 1847 HG22 THR B 49 2.208 -35.304 -0.639 1.00 0.00 H ATOM 1848 H THR B 49 0.876 -32.034 1.351 1.00 0.00 H ATOM 1849 N MET B 50 5.024 -32.795 2.288 1.00 96.72 N ATOM 1850 CA MET B 50 6.286 -32.137 2.105 1.00101.62 C ATOM 1851 C MET B 50 6.268 -31.361 0.820 1.00116.02 C ATOM 1852 O MET B 50 6.244 -30.125 0.881 1.00126.45 O ATOM 1853 CB MET B 50 7.451 -33.121 2.095 1.00105.66 C ATOM 1854 CG MET B 50 8.150 -33.257 3.440 1.00121.70 C ATOM 1855 SD MET B 50 8.148 -31.768 4.507 1.00131.30 S ATOM 1856 CE MET B 50 9.680 -32.026 5.412 1.00105.82 C ATOM 1857 HA MET B 50 6.432 -31.463 2.949 1.00 0.00 H ATOM 1858 HB2 MET B 50 7.072 -34.100 1.804 1.00 0.00 H ATOM 1859 HB3 MET B 50 8.181 -32.782 1.360 1.00 0.00 H ATOM 1860 HG2 MET B 50 9.188 -33.529 3.250 1.00 0.00 H ATOM 1861 HG3 MET B 50 7.661 -34.061 3.990 1.00 0.00 H ATOM 1862 HE1 MET B 50 9.622 -32.965 5.963 1.00 0.00 H ATOM 1863 HE2 MET B 50 10.513 -32.066 4.710 1.00 0.00 H ATOM 1864 HE3 MET B 50 9.831 -31.203 6.110 1.00 0.00 H ATOM 1865 H MET B 50 5.016 -33.807 2.527 1.00 0.00 H ATOM 1866 N LYS B 51 6.264 -32.064 -0.329 1.00115.37 N ATOM 1867 CA LYS B 51 6.279 -31.376 -1.619 1.00108.87 C ATOM 1868 C LYS B 51 5.177 -30.297 -1.654 1.00114.65 C ATOM 1869 O LYS B 51 5.253 -29.378 -2.461 1.00130.17 O ATOM 1870 CB LYS B 51 6.249 -32.311 -2.874 1.00118.97 C ATOM 1871 CG LYS B 51 6.916 -31.675 -4.137 1.00127.40 C ATOM 1872 CD LYS B 51 6.679 -32.306 -5.528 1.00124.93 C ATOM 1873 CE LYS B 51 7.312 -31.460 -6.665 1.00115.69 C ATOM 1874 NZ LYS B 51 6.818 -31.695 -8.073 1.00101.92 N ATOM 1875 HA LYS B 51 7.253 -30.893 -1.695 1.00 0.00 H ATOM 1876 HB2 LYS B 51 6.777 -33.233 -2.631 1.00 0.00 H ATOM 1877 HB3 LYS B 51 5.210 -32.540 -3.110 1.00 0.00 H ATOM 1878 HG2 LYS B 51 6.567 -30.644 -4.194 1.00 0.00 H ATOM 1879 HG3 LYS B 51 7.992 -31.684 -3.965 1.00 0.00 H ATOM 1880 HD2 LYS B 51 7.120 -33.302 -5.543 1.00 0.00 H ATOM 1881 HD3 LYS B 51 5.606 -32.383 -5.702 1.00 0.00 H ATOM 1882 HE2 LYS B 51 8.384 -31.656 -6.659 1.00 0.00 H ATOM 1883 HE3 LYS B 51 7.134 -30.411 -6.428 1.00 0.00 H ATOM 1884 HZ1 LYS B 51 6.992 -32.685 -8.339 1.00 0.00 H ATOM 1885 HZ2 LYS B 51 5.798 -31.496 -8.119 1.00 0.00 H ATOM 1886 HZ3 LYS B 51 7.325 -31.065 -8.727 1.00 0.00 H ATOM 1887 H LYS B 51 6.250 -33.103 -0.298 1.00 0.00 H ATOM 1888 N GLU B 52 4.189 -30.361 -0.758 1.00102.34 N ATOM 1889 CA GLU B 52 3.175 -29.295 -0.732 1.00106.61 C ATOM 1890 C GLU B 52 3.581 -28.057 0.025 1.00107.84 C ATOM 1891 O GLU B 52 3.060 -26.963 -0.237 1.00106.53 O ATOM 1892 CB GLU B 52 1.894 -29.752 -0.066 1.00109.41 C ATOM 1893 CG GLU B 52 0.674 -29.823 -0.948 1.00101.33 C ATOM 1894 CD GLU B 52 -0.261 -30.854 -0.376 1.00114.84 C ATOM 1895 OE1 GLU B 52 0.265 -31.960 0.017 1.00 95.93 O ATOM 1896 OE2 GLU B 52 -1.486 -30.533 -0.291 1.00115.68 O ATOM 1897 HA GLU B 52 3.046 -29.061 -1.789 1.00 0.00 H ATOM 1898 HB2 GLU B 52 2.068 -30.748 0.342 1.00 0.00 H ATOM 1899 HB3 GLU B 52 1.677 -29.060 0.748 1.00 0.00 H ATOM 1900 HG2 GLU B 52 0.181 -28.851 -0.975 1.00 0.00 H ATOM 1901 HG3 GLU B 52 0.965 -30.109 -1.959 1.00 0.00 H ATOM 1902 H GLU B 52 4.137 -31.154 -0.087 1.00 0.00 H ATOM 1903 N VAL B 53 4.428 -28.214 1.031 1.00 94.56 N ATOM 1904 CA VAL B 53 4.658 -27.052 1.881 1.00 88.92 C ATOM 1905 C VAL B 53 5.821 -26.286 1.325 1.00 84.63 C ATOM 1906 O VAL B 53 5.787 -25.029 1.262 1.00 82.56 O ATOM 1907 CB VAL B 53 5.003 -27.415 3.326 1.00 98.01 C ATOM 1908 CG1 VAL B 53 5.209 -26.122 4.106 1.00101.69 C ATOM 1909 CG2 VAL B 53 3.897 -28.264 3.950 1.00105.52 C ATOM 1910 HA VAL B 53 3.732 -26.477 1.891 1.00 0.00 H ATOM 1911 HB VAL B 53 5.916 -28.009 3.354 1.00 0.00 H ATOM 1912 HG11 VAL B 53 6.024 -25.554 3.657 1.00 0.00 H ATOM 1913 HG12 VAL B 53 4.293 -25.531 4.076 1.00 0.00 H ATOM 1914 HG13 VAL B 53 5.456 -26.359 5.141 1.00 0.00 H ATOM 1915 HG21 VAL B 53 2.962 -27.704 3.941 1.00 0.00 H ATOM 1916 HG22 VAL B 53 3.777 -29.182 3.375 1.00 0.00 H ATOM 1917 HG23 VAL B 53 4.165 -28.510 4.978 1.00 0.00 H ATOM 1918 H VAL B 53 4.905 -29.121 1.206 1.00 0.00 H ATOM 1919 N LEU B 54 6.873 -27.028 0.938 1.00 76.98 N ATOM 1920 CA LEU B 54 7.915 -26.381 0.166 1.00 73.83 C ATOM 1921 C LEU B 54 7.230 -25.617 -1.037 1.00 75.11 C ATOM 1922 O LEU B 54 7.671 -24.506 -1.413 1.00 70.97 O ATOM 1923 CB LEU B 54 8.934 -27.313 -0.326 1.00 64.36 C ATOM 1924 CG LEU B 54 9.727 -28.415 0.315 1.00 69.94 C ATOM 1925 CD1 LEU B 54 9.960 -29.591 -0.678 1.00 65.65 C ATOM 1926 CD2 LEU B 54 11.080 -27.895 0.776 1.00 65.16 C ATOM 1927 HA LEU B 54 8.444 -25.687 0.819 1.00 0.00 H ATOM 1928 HB2 LEU B 54 8.431 -27.817 -1.151 1.00 0.00 H ATOM 1929 HB3 LEU B 54 9.704 -26.651 -0.722 1.00 0.00 H ATOM 1930 HG LEU B 54 9.154 -28.774 1.170 1.00 0.00 H ATOM 1931 HD21 LEU B 54 11.632 -27.512 -0.082 1.00 0.00 H ATOM 1932 HD22 LEU B 54 10.932 -27.095 1.501 1.00 0.00 H ATOM 1933 HD23 LEU B 54 11.642 -28.707 1.238 1.00 0.00 H ATOM 1934 HD11 LEU B 54 8.998 -29.993 -0.995 1.00 0.00 H ATOM 1935 HD12 LEU B 54 10.508 -29.228 -1.547 1.00 0.00 H ATOM 1936 HD13 LEU B 54 10.537 -30.373 -0.184 1.00 0.00 H ATOM 1937 H LEU B 54 6.937 -28.036 1.185 1.00 0.00 H ATOM 1938 N PHE B 55 6.080 -26.104 -1.504 1.00 70.20 N ATOM 1939 CA PHE B 55 5.440 -25.348 -2.594 1.00 91.42 C ATOM 1940 C PHE B 55 5.052 -23.920 -2.220 1.00 89.03 C ATOM 1941 O PHE B 55 5.081 -22.983 -3.038 1.00109.62 O ATOM 1942 CB PHE B 55 4.242 -26.080 -3.267 1.00 85.06 C ATOM 1943 CG PHE B 55 3.466 -25.179 -4.207 1.00 81.87 C ATOM 1944 CD1 PHE B 55 3.875 -24.994 -5.530 1.00 93.74 C ATOM 1945 CD2 PHE B 55 2.378 -24.465 -3.759 1.00 81.45 C ATOM 1946 CE1 PHE B 55 3.185 -24.137 -6.403 1.00 88.72 C ATOM 1947 CE2 PHE B 55 1.659 -23.612 -4.626 1.00 93.08 C ATOM 1948 CZ PHE B 55 2.083 -23.420 -5.949 1.00 86.58 C ATOM 1949 HA PHE B 55 6.233 -25.284 -3.339 1.00 0.00 H ATOM 1950 HB2 PHE B 55 4.624 -26.930 -3.833 1.00 0.00 H ATOM 1951 HB3 PHE B 55 3.568 -26.437 -2.488 1.00 0.00 H ATOM 1952 HD2 PHE B 55 2.066 -24.559 -2.719 1.00 0.00 H ATOM 1953 HE2 PHE B 55 0.768 -23.099 -4.264 1.00 0.00 H ATOM 1954 HZ PHE B 55 1.561 -22.725 -6.606 1.00 0.00 H ATOM 1955 HE1 PHE B 55 3.513 -24.034 -7.437 1.00 0.00 H ATOM 1956 HD1 PHE B 55 4.752 -25.529 -5.894 1.00 0.00 H ATOM 1957 H PHE B 55 5.657 -26.972 -1.119 1.00 0.00 H ATOM 1958 N TYR B 56 4.664 -23.756 -0.980 1.00 97.58 N ATOM 1959 CA TYR B 56 4.107 -22.485 -0.565 1.00101.94 C ATOM 1960 C TYR B 56 5.197 -21.612 0.061 1.00104.84 C ATOM 1961 O TYR B 56 5.329 -20.397 -0.260 1.00104.80 O ATOM 1962 CB TYR B 56 2.976 -22.762 0.374 1.00 98.91 C ATOM 1963 CG TYR B 56 1.700 -23.160 -0.345 1.00108.54 C ATOM 1964 CD1 TYR B 56 0.940 -22.198 -1.021 1.00117.47 C ATOM 1965 CD2 TYR B 56 1.235 -24.474 -0.328 1.00102.86 C ATOM 1966 CE1 TYR B 56 -0.241 -22.522 -1.650 1.00109.10 C ATOM 1967 CE2 TYR B 56 0.050 -24.806 -0.944 1.00100.48 C ATOM 1968 CZ TYR B 56 -0.686 -23.819 -1.602 1.00115.42 C ATOM 1969 OH TYR B 56 -1.881 -24.113 -2.256 1.00140.85 O ATOM 1970 HA TYR B 56 3.720 -21.926 -1.417 1.00 0.00 H ATOM 1971 HB3 TYR B 56 2.781 -21.864 0.959 1.00 0.00 H ATOM 1972 HB2 TYR B 56 3.268 -23.573 1.042 1.00 0.00 H ATOM 1973 HD2 TYR B 56 1.815 -25.246 0.178 1.00 0.00 H ATOM 1974 HE2 TYR B 56 -0.312 -25.834 -0.918 1.00 0.00 H ATOM 1975 HE1 TYR B 56 -0.814 -21.760 -2.178 1.00 0.00 H ATOM 1976 HD1 TYR B 56 1.292 -21.167 -1.050 1.00 0.00 H ATOM 1977 HH TYR B 56 -2.248 -23.286 -2.657 1.00 0.00 H ATOM 1978 H TYR B 56 4.755 -24.535 -0.297 1.00 0.00 H ATOM 1979 N LEU B 57 6.012 -22.221 0.918 1.00 85.92 N ATOM 1980 CA LEU B 57 7.283 -21.572 1.244 1.00 88.46 C ATOM 1981 C LEU B 57 7.850 -20.910 -0.022 1.00 87.87 C ATOM 1982 O LEU B 57 8.058 -19.689 -0.045 1.00 81.31 O ATOM 1983 CB LEU B 57 8.292 -22.587 1.821 1.00 89.49 C ATOM 1984 CG LEU B 57 7.746 -23.374 3.049 1.00 91.50 C ATOM 1985 CD1 LEU B 57 8.826 -24.212 3.755 1.00 75.68 C ATOM 1986 CD2 LEU B 57 7.004 -22.425 4.025 1.00 80.56 C ATOM 1987 HA LEU B 57 7.108 -20.812 2.006 1.00 0.00 H ATOM 1988 HB2 LEU B 57 8.549 -23.302 1.039 1.00 0.00 H ATOM 1989 HB3 LEU B 57 9.188 -22.047 2.127 1.00 0.00 H ATOM 1990 HG LEU B 57 7.022 -24.096 2.671 1.00 0.00 H ATOM 1991 HD21 LEU B 57 7.693 -21.657 4.377 1.00 0.00 H ATOM 1992 HD22 LEU B 57 6.168 -21.955 3.508 1.00 0.00 H ATOM 1993 HD23 LEU B 57 6.632 -22.998 4.874 1.00 0.00 H ATOM 1994 HD11 LEU B 57 9.238 -24.937 3.053 1.00 0.00 H ATOM 1995 HD12 LEU B 57 9.620 -23.555 4.109 1.00 0.00 H ATOM 1996 HD13 LEU B 57 8.382 -24.736 4.602 1.00 0.00 H ATOM 1997 H LEU B 57 5.753 -23.133 1.345 1.00 0.00 H ATOM 1998 N GLY B 58 8.029 -21.734 -1.069 1.00 87.35 N ATOM 1999 CA GLY B 58 8.468 -21.314 -2.395 1.00 78.90 C ATOM 2000 C GLY B 58 7.776 -20.040 -2.784 1.00 77.40 C ATOM 2001 O GLY B 58 8.434 -18.992 -3.008 1.00 80.99 O ATOM 2002 HA3 GLY B 58 8.227 -22.092 -3.119 1.00 0.00 H ATOM 2003 HA2 GLY B 58 9.546 -21.151 -2.384 1.00 0.00 H ATOM 2004 H GLY B 58 7.840 -22.746 -0.923 1.00 0.00 H ATOM 2005 N GLN B 59 6.455 -20.084 -2.823 1.00 69.02 N ATOM 2006 CA GLN B 59 5.706 -18.865 -3.248 1.00 75.05 C ATOM 2007 C GLN B 59 5.991 -17.686 -2.338 1.00 83.74 C ATOM 2008 O GLN B 59 5.992 -16.523 -2.775 1.00 95.93 O ATOM 2009 CB GLN B 59 4.192 -19.111 -3.257 1.00 85.81 C ATOM 2010 CG GLN B 59 3.689 -20.080 -4.308 1.00 88.32 C ATOM 2011 CD GLN B 59 3.676 -19.390 -5.674 1.00110.11 C ATOM 2012 OE1 GLN B 59 4.441 -19.755 -6.581 1.00108.18 O ATOM 2013 NE2 GLN B 59 2.853 -18.341 -5.804 1.00108.68 N ATOM 2014 HA GLN B 59 6.047 -18.636 -4.257 1.00 0.00 H ATOM 2015 HB2 GLN B 59 3.910 -19.501 -2.279 1.00 0.00 H ATOM 2016 HB3 GLN B 59 3.698 -18.153 -3.421 1.00 0.00 H ATOM 2017 HG2 GLN B 59 4.346 -20.949 -4.346 1.00 0.00 H ATOM 2018 HG3 GLN B 59 2.679 -20.401 -4.053 1.00 0.00 H ATOM 2019 HE22 GLN B 59 2.228 -18.070 -5.018 1.00 0.00 H ATOM 2020 HE21 GLN B 59 2.839 -17.798 -6.691 1.00 0.00 H ATOM 2021 H GLN B 59 5.947 -20.953 -2.562 1.00 0.00 H ATOM 2022 N TYR B 60 6.186 -17.950 -1.045 1.00 89.52 N ATOM 2023 CA TYR B 60 6.227 -16.810 -0.060 1.00 85.42 C ATOM 2024 C TYR B 60 7.520 -16.086 -0.260 1.00 77.91 C ATOM 2025 O TYR B 60 7.541 -14.906 -0.724 1.00 77.09 O ATOM 2026 CB TYR B 60 6.060 -17.327 1.355 1.00 86.74 C ATOM 2027 CG TYR B 60 6.344 -16.395 2.517 1.00100.75 C ATOM 2028 CD1 TYR B 60 5.291 -15.769 3.208 1.00105.82 C ATOM 2029 CD2 TYR B 60 7.646 -16.216 3.013 1.00101.24 C ATOM 2030 CE1 TYR B 60 5.524 -14.970 4.315 1.00 94.09 C ATOM 2031 CE2 TYR B 60 7.877 -15.414 4.127 1.00 96.34 C ATOM 2032 CZ TYR B 60 6.803 -14.808 4.774 1.00100.43 C ATOM 2033 OH TYR B 60 6.990 -14.013 5.875 1.00106.94 O ATOM 2034 HA TYR B 60 5.403 -16.115 -0.226 1.00 0.00 H ATOM 2035 HB3 TYR B 60 6.725 -18.184 1.463 1.00 0.00 H ATOM 2036 HB2 TYR B 60 5.026 -17.656 1.455 1.00 0.00 H ATOM 2037 HD2 TYR B 60 8.484 -16.710 2.521 1.00 0.00 H ATOM 2038 HE2 TYR B 60 8.893 -15.261 4.491 1.00 0.00 H ATOM 2039 HE1 TYR B 60 4.694 -14.473 4.817 1.00 0.00 H ATOM 2040 HD1 TYR B 60 4.267 -15.916 2.864 1.00 0.00 H ATOM 2041 HH TYR B 60 7.571 -13.249 5.634 1.00 0.00 H ATOM 2042 H TYR B 60 6.308 -18.931 -0.721 1.00 0.00 H ATOM 2043 N ILE B 61 8.601 -16.807 0.023 1.00 67.65 N ATOM 2044 CA ILE B 61 9.930 -16.396 -0.410 1.00 66.97 C ATOM 2045 C ILE B 61 9.945 -15.664 -1.780 1.00 73.41 C ATOM 2046 O ILE B 61 10.701 -14.707 -1.953 1.00 84.21 O ATOM 2047 CB ILE B 61 10.765 -17.661 -0.553 1.00 71.61 C ATOM 2048 CG1 ILE B 61 10.782 -18.491 0.743 1.00 76.73 C ATOM 2049 CG2 ILE B 61 12.165 -17.350 -0.965 1.00 76.12 C ATOM 2050 CD1 ILE B 61 12.160 -19.122 0.938 1.00 82.12 C ATOM 2051 HA ILE B 61 10.316 -15.696 0.331 1.00 0.00 H ATOM 2052 HB ILE B 61 10.290 -18.254 -1.335 1.00 0.00 H ATOM 2053 HG12 ILE B 61 10.557 -17.843 1.590 1.00 0.00 H ATOM 2054 HG13 ILE B 61 10.030 -19.277 0.679 1.00 0.00 H ATOM 2055 HD11 ILE B 61 12.384 -19.771 0.091 1.00 0.00 H ATOM 2056 HD12 ILE B 61 12.912 -18.336 1.004 1.00 0.00 H ATOM 2057 HD13 ILE B 61 12.163 -19.708 1.857 1.00 0.00 H ATOM 2058 HG21 ILE B 61 12.154 -16.834 -1.925 1.00 0.00 H ATOM 2059 HG22 ILE B 61 12.630 -16.712 -0.213 1.00 0.00 H ATOM 2060 HG23 ILE B 61 12.730 -18.278 -1.057 1.00 0.00 H ATOM 2061 H ILE B 61 8.495 -17.687 0.567 1.00 0.00 H ATOM 2062 N MET B 62 9.116 -16.074 -2.755 1.00 70.60 N ATOM 2063 CA MET B 62 9.131 -15.356 -4.013 1.00 80.10 C ATOM 2064 C MET B 62 8.442 -14.011 -3.974 1.00 85.75 C ATOM 2065 O MET B 62 9.076 -12.993 -4.127 1.00 87.01 O ATOM 2066 CB MET B 62 8.485 -16.124 -5.129 1.00 86.00 C ATOM 2067 CG MET B 62 8.682 -15.370 -6.409 1.00 85.60 C ATOM 2068 SD MET B 62 8.729 -16.463 -7.814 1.00102.60 S ATOM 2069 CE MET B 62 8.318 -15.214 -9.064 1.00106.33 C ATOM 2070 HA MET B 62 10.197 -15.216 -4.192 1.00 0.00 H ATOM 2071 HB2 MET B 62 8.943 -17.110 -5.209 1.00 0.00 H ATOM 2072 HB3 MET B 62 7.419 -16.235 -4.929 1.00 0.00 H ATOM 2073 HG2 MET B 62 9.623 -14.822 -6.356 1.00 0.00 H ATOM 2074 HG3 MET B 62 7.859 -14.666 -6.535 1.00 0.00 H ATOM 2075 HE1 MET B 62 7.343 -14.783 -8.838 1.00 0.00 H ATOM 2076 HE2 MET B 62 9.075 -14.430 -9.055 1.00 0.00 H ATOM 2077 HE3 MET B 62 8.290 -15.682 -10.048 1.00 0.00 H ATOM 2078 H MET B 62 8.481 -16.885 -2.610 1.00 0.00 H ATOM 2079 N THR B 63 7.121 -14.009 -3.873 1.00 90.48 N ATOM 2080 CA THR B 63 6.354 -12.760 -3.656 1.00 91.42 C ATOM 2081 C THR B 63 6.936 -11.722 -2.661 1.00 94.64 C ATOM 2082 O THR B 63 7.085 -10.576 -3.033 1.00112.59 O ATOM 2083 CB THR B 63 4.964 -13.133 -3.203 1.00105.66 C ATOM 2084 OG1 THR B 63 5.105 -13.921 -2.005 1.00117.28 O ATOM 2085 CG2 THR B 63 4.261 -14.014 -4.330 1.00117.12 C ATOM 2086 HA THR B 63 6.388 -12.250 -4.619 1.00 0.00 H ATOM 2087 HB THR B 63 4.361 -12.244 -3.020 1.00 0.00 H ATOM 2088 HG1 THR B 63 5.636 -14.732 -2.205 1.00 0.00 H ATOM 2089 HG23 THR B 63 4.153 -13.421 -5.238 1.00 0.00 H ATOM 2090 HG21 THR B 63 4.873 -14.891 -4.538 1.00 0.00 H ATOM 2091 HG22 THR B 63 3.278 -14.330 -3.982 1.00 0.00 H ATOM 2092 H THR B 63 6.607 -14.910 -3.948 1.00 0.00 H ATOM 2093 N LYS B 64 7.245 -12.076 -1.407 1.00 89.42 N ATOM 2094 CA LYS B 64 7.899 -11.139 -0.488 1.00 77.35 C ATOM 2095 C LYS B 64 9.430 -11.021 -0.721 1.00 87.16 C ATOM 2096 O LYS B 64 10.182 -10.858 0.254 1.00 91.08 O ATOM 2097 CB LYS B 64 7.698 -11.701 0.894 1.00 78.96 C ATOM 2098 CG LYS B 64 6.506 -11.125 1.654 1.00 88.87 C ATOM 2099 CD LYS B 64 6.249 -11.944 2.929 1.00 97.98 C ATOM 2100 CE LYS B 64 6.205 -11.127 4.219 1.00100.38 C ATOM 2101 NZ LYS B 64 7.398 -10.260 4.420 1.00108.12 N ATOM 2102 HA LYS B 64 7.469 -10.149 -0.637 1.00 0.00 H ATOM 2103 HB2 LYS B 64 7.555 -12.778 0.805 1.00 0.00 H ATOM 2104 HB3 LYS B 64 8.599 -11.502 1.475 1.00 0.00 H ATOM 2105 HG2 LYS B 64 6.717 -10.091 1.926 1.00 0.00 H ATOM 2106 HG3 LYS B 64 5.621 -11.160 1.018 1.00 0.00 H ATOM 2107 HD2 LYS B 64 5.292 -12.454 2.818 1.00 0.00 H ATOM 2108 HD3 LYS B 64 7.044 -12.684 3.023 1.00 0.00 H ATOM 2109 HE2 LYS B 64 6.134 -11.816 5.061 1.00 0.00 H ATOM 2110 HE3 LYS B 64 5.319 -10.493 4.195 1.00 0.00 H ATOM 2111 HZ1 LYS B 64 8.253 -10.851 4.457 1.00 0.00 H ATOM 2112 HZ2 LYS B 64 7.474 -9.588 3.630 1.00 0.00 H ATOM 2113 HZ3 LYS B 64 7.298 -9.737 5.313 1.00 0.00 H ATOM 2114 H LYS B 64 7.016 -13.036 -1.078 1.00 0.00 H ATOM 2115 N ARG B 65 9.903 -11.136 -1.969 1.00 80.56 N ATOM 2116 CA ARG B 65 11.323 -11.183 -2.307 1.00 80.03 C ATOM 2117 C ARG B 65 12.335 -11.303 -1.167 1.00 82.38 C ATOM 2118 O ARG B 65 12.951 -10.299 -0.741 1.00 79.10 O ATOM 2119 CB ARG B 65 11.716 -9.959 -3.105 1.00 84.44 C ATOM 2120 CG ARG B 65 10.558 -9.128 -3.650 1.00100.77 C ATOM 2121 CD ARG B 65 10.701 -8.736 -5.148 1.00103.64 C ATOM 2122 NE ARG B 65 9.777 -9.582 -5.913 1.00 95.62 N ATOM 2123 CZ ARG B 65 10.015 -10.842 -6.305 1.00 96.21 C ATOM 2124 NH1 ARG B 65 11.211 -11.447 -6.135 1.00 76.01 N ATOM 2125 NH2 ARG B 65 9.035 -11.495 -6.931 1.00102.27 N ATOM 2126 HA ARG B 65 11.385 -12.120 -2.860 1.00 0.00 H ATOM 2127 HB2 ARG B 65 12.316 -9.317 -2.461 1.00 0.00 H ATOM 2128 HB3 ARG B 65 12.320 -10.289 -3.951 1.00 0.00 H ATOM 2129 HG2 ARG B 65 9.640 -9.704 -3.534 1.00 0.00 H ATOM 2130 HG3 ARG B 65 10.488 -8.213 -3.062 1.00 0.00 H ATOM 2131 HD2 ARG B 65 11.725 -8.905 -5.482 1.00 0.00 H ATOM 2132 HD3 ARG B 65 10.445 -7.685 -5.285 1.00 0.00 H ATOM 2133 HE ARG B 65 8.859 -9.169 -6.173 1.00 0.00 H ATOM 2134 HH12 ARG B 65 11.348 -12.427 -6.456 1.00 0.00 H ATOM 2135 HH11 ARG B 65 11.994 -10.933 -5.684 1.00 0.00 H ATOM 2136 HH22 ARG B 65 9.183 -12.474 -7.250 1.00 0.00 H ATOM 2137 HH21 ARG B 65 8.123 -11.025 -7.101 1.00 0.00 H ATOM 2138 H ARG B 65 9.215 -11.196 -2.747 1.00 0.00 H ATOM 2139 N LEU B 66 12.575 -12.519 -0.723 1.00 76.17 N ATOM 2140 CA LEU B 66 13.526 -12.745 0.358 1.00 75.78 C ATOM 2141 C LEU B 66 14.814 -13.396 0.007 1.00 81.53 C ATOM 2142 O LEU B 66 15.657 -13.578 0.899 1.00103.07 O ATOM 2143 CB LEU B 66 12.900 -13.617 1.411 1.00 69.97 C ATOM 2144 CG LEU B 66 11.590 -12.987 1.825 1.00 73.50 C ATOM 2145 CD1 LEU B 66 10.842 -14.081 2.575 1.00 78.50 C ATOM 2146 CD2 LEU B 66 12.017 -11.844 2.701 1.00 77.05 C ATOM 2147 HA LEU B 66 13.763 -11.732 0.684 1.00 0.00 H ATOM 2148 HB2 LEU B 66 12.720 -14.613 1.007 1.00 0.00 H ATOM 2149 HB3 LEU B 66 13.564 -13.690 2.273 1.00 0.00 H ATOM 2150 HG LEU B 66 10.938 -12.617 1.033 1.00 0.00 H ATOM 2151 HD21 LEU B 66 12.581 -12.230 3.550 1.00 0.00 H ATOM 2152 HD22 LEU B 66 12.644 -11.162 2.127 1.00 0.00 H ATOM 2153 HD23 LEU B 66 11.135 -11.313 3.060 1.00 0.00 H ATOM 2154 HD11 LEU B 66 10.687 -14.933 1.913 1.00 0.00 H ATOM 2155 HD12 LEU B 66 11.428 -14.393 3.439 1.00 0.00 H ATOM 2156 HD13 LEU B 66 9.878 -13.697 2.908 1.00 0.00 H ATOM 2157 H LEU B 66 12.080 -13.328 -1.149 1.00 0.00 H ATOM 2158 N TYR B 67 15.004 -13.808 -1.233 1.00 80.33 N ATOM 2159 CA TYR B 67 16.294 -14.453 -1.559 1.00 81.00 C ATOM 2160 C TYR B 67 17.204 -13.305 -1.811 1.00 84.59 C ATOM 2161 O TYR B 67 16.775 -12.184 -1.627 1.00 99.73 O ATOM 2162 CB TYR B 67 16.133 -15.304 -2.795 1.00 79.98 C ATOM 2163 CG TYR B 67 15.382 -14.594 -3.878 1.00 84.41 C ATOM 2164 CD1 TYR B 67 16.056 -14.104 -5.026 1.00 84.43 C ATOM 2165 CD2 TYR B 67 13.984 -14.401 -3.773 1.00 86.64 C ATOM 2166 CE1 TYR B 67 15.345 -13.435 -6.047 1.00 85.45 C ATOM 2167 CE2 TYR B 67 13.281 -13.757 -4.775 1.00 87.43 C ATOM 2168 CZ TYR B 67 13.960 -13.282 -5.911 1.00 87.92 C ATOM 2169 OH TYR B 67 13.245 -12.620 -6.887 1.00 87.14 O ATOM 2170 HA TYR B 67 16.669 -15.111 -0.775 1.00 0.00 H ATOM 2171 HB3 TYR B 67 15.591 -16.211 -2.528 1.00 0.00 H ATOM 2172 HB2 TYR B 67 17.122 -15.570 -3.169 1.00 0.00 H ATOM 2173 HD2 TYR B 67 13.455 -14.764 -2.892 1.00 0.00 H ATOM 2174 HE2 TYR B 67 12.204 -13.618 -4.684 1.00 0.00 H ATOM 2175 HE1 TYR B 67 15.864 -13.046 -6.923 1.00 0.00 H ATOM 2176 HD1 TYR B 67 17.133 -14.245 -5.121 1.00 0.00 H ATOM 2177 HH TYR B 67 13.857 -12.349 -7.617 1.00 0.00 H ATOM 2178 H TYR B 67 14.269 -13.683 -1.958 1.00 0.00 H ATOM 2179 N ASP B 68 18.444 -13.535 -2.222 1.00 91.58 N ATOM 2180 CA ASP B 68 19.341 -12.425 -2.509 1.00 88.89 C ATOM 2181 C ASP B 68 19.400 -12.173 -3.987 1.00105.71 C ATOM 2182 O ASP B 68 19.319 -13.113 -4.784 1.00113.10 O ATOM 2183 CB ASP B 68 20.751 -12.681 -2.022 1.00 88.72 C ATOM 2184 CG ASP B 68 21.454 -11.380 -1.647 1.00100.84 C ATOM 2185 OD1 ASP B 68 22.713 -11.293 -1.553 1.00 96.88 O ATOM 2186 OD2 ASP B 68 20.700 -10.409 -1.473 1.00 99.75 O ATOM 2187 HA ASP B 68 18.939 -11.560 -1.981 1.00 0.00 H ATOM 2188 HB2 ASP B 68 20.712 -13.329 -1.146 1.00 0.00 H ATOM 2189 HB3 ASP B 68 21.316 -13.175 -2.813 1.00 0.00 H ATOM 2190 H ASP B 68 18.777 -14.513 -2.340 1.00 0.00 H ATOM 2191 N GLU B 69 19.571 -10.912 -4.377 1.00113.92 N ATOM 2192 CA GLU B 69 19.645 -10.646 -5.787 1.00115.74 C ATOM 2193 C GLU B 69 20.910 -11.307 -6.351 1.00118.13 C ATOM 2194 O GLU B 69 20.866 -11.946 -7.394 1.00120.33 O ATOM 2195 CB GLU B 69 19.568 -9.155 -6.102 1.00133.42 C ATOM 2196 CG GLU B 69 19.690 -8.822 -7.605 1.00147.10 C ATOM 2197 CD GLU B 69 18.478 -9.258 -8.448 1.00150.79 C ATOM 2198 OE1 GLU B 69 18.619 -9.459 -9.679 1.00124.73 O ATOM 2199 OE2 GLU B 69 17.362 -9.396 -7.892 1.00164.95 O ATOM 2200 HA GLU B 69 18.775 -11.081 -6.278 1.00 0.00 H ATOM 2201 HB2 GLU B 69 18.610 -8.778 -5.744 1.00 0.00 H ATOM 2202 HB3 GLU B 69 20.376 -8.651 -5.572 1.00 0.00 H ATOM 2203 HG2 GLU B 69 19.808 -7.743 -7.708 1.00 0.00 H ATOM 2204 HG3 GLU B 69 20.576 -9.322 -7.995 1.00 0.00 H ATOM 2205 H GLU B 69 19.649 -10.142 -3.682 1.00 0.00 H ATOM 2206 N LYS B 70 22.034 -11.191 -5.664 1.00118.11 N ATOM 2207 CA LYS B 70 23.234 -11.819 -6.213 1.00113.16 C ATOM 2208 C LYS B 70 23.363 -13.245 -5.863 1.00113.56 C ATOM 2209 O LYS B 70 23.829 -14.014 -6.690 1.00117.49 O ATOM 2210 CB LYS B 70 24.502 -11.067 -5.870 1.00105.20 C ATOM 2211 CG LYS B 70 24.690 -9.888 -6.835 1.00118.46 C ATOM 2212 CD LYS B 70 25.617 -10.191 -8.027 1.00116.44 C ATOM 2213 CE LYS B 70 25.378 -9.191 -9.114 1.00117.06 C ATOM 2214 NZ LYS B 70 25.767 -7.837 -8.633 1.00121.94 N ATOM 2215 HA LYS B 70 23.100 -11.766 -7.293 1.00 0.00 H ATOM 2216 HB2 LYS B 70 24.434 -10.691 -4.849 1.00 0.00 H ATOM 2217 HB3 LYS B 70 25.355 -11.741 -5.952 1.00 0.00 H ATOM 2218 HG2 LYS B 70 23.712 -9.605 -7.225 1.00 0.00 H ATOM 2219 HG3 LYS B 70 25.112 -9.053 -6.277 1.00 0.00 H ATOM 2220 HD2 LYS B 70 26.656 -10.134 -7.703 1.00 0.00 H ATOM 2221 HD3 LYS B 70 25.410 -11.193 -8.403 1.00 0.00 H ATOM 2222 HE2 LYS B 70 24.322 -9.192 -9.384 1.00 0.00 H ATOM 2223 HE3 LYS B 70 25.975 -9.453 -9.987 1.00 0.00 H ATOM 2224 HZ1 LYS B 70 25.196 -7.589 -7.800 1.00 0.00 H ATOM 2225 HZ2 LYS B 70 26.775 -7.838 -8.376 1.00 0.00 H ATOM 2226 HZ3 LYS B 70 25.601 -7.141 -9.388 1.00 0.00 H ATOM 2227 H LYS B 70 22.063 -10.671 -4.764 1.00 0.00 H ATOM 2228 N GLN B 71 22.945 -13.613 -4.649 1.00117.68 N ATOM 2229 CA GLN B 71 23.065 -15.006 -4.203 1.00112.00 C ATOM 2230 C GLN B 71 21.690 -15.690 -4.171 1.00111.54 C ATOM 2231 O GLN B 71 20.888 -15.492 -3.253 1.00109.94 O ATOM 2232 CB GLN B 71 23.742 -15.036 -2.848 1.00111.50 C ATOM 2233 CG GLN B 71 25.208 -14.655 -2.901 1.00125.83 C ATOM 2234 CD GLN B 71 26.036 -15.669 -3.655 1.00132.20 C ATOM 2235 OE1 GLN B 71 26.143 -15.613 -4.875 1.00119.25 O ATOM 2236 NE2 GLN B 71 26.613 -16.624 -2.926 1.00142.85 N ATOM 2237 HA GLN B 71 23.678 -15.566 -4.910 1.00 0.00 H ATOM 2238 HB2 GLN B 71 23.227 -14.338 -2.188 1.00 0.00 H ATOM 2239 HB3 GLN B 71 23.661 -16.045 -2.443 1.00 0.00 H ATOM 2240 HG2 GLN B 71 25.302 -13.688 -3.395 1.00 0.00 H ATOM 2241 HG3 GLN B 71 25.588 -14.579 -1.882 1.00 0.00 H ATOM 2242 HE22 GLN B 71 26.495 -16.632 -1.893 1.00 0.00 H ATOM 2243 HE21 GLN B 71 27.181 -17.361 -3.390 1.00 0.00 H ATOM 2244 H GLN B 71 22.529 -12.904 -4.012 1.00 0.00 H ATOM 2245 N GLN B 72 21.391 -16.463 -5.201 1.00109.48 N ATOM 2246 CA GLN B 72 19.987 -16.869 -5.436 1.00101.49 C ATOM 2247 C GLN B 72 19.492 -18.002 -4.562 1.00 98.38 C ATOM 2248 O GLN B 72 18.278 -18.079 -4.283 1.00100.00 O ATOM 2249 CB GLN B 72 19.762 -17.254 -6.899 1.00106.35 C ATOM 2250 CG GLN B 72 18.452 -16.752 -7.516 1.00107.36 C ATOM 2251 CD GLN B 72 18.555 -15.396 -8.202 1.00 96.49 C ATOM 2252 OE1 GLN B 72 17.586 -14.911 -8.816 1.00 92.43 O ATOM 2253 NE2 GLN B 72 19.711 -14.770 -8.070 1.00 92.32 N ATOM 2254 HA GLN B 72 19.409 -15.985 -5.167 1.00 0.00 H ATOM 2255 HB2 GLN B 72 20.587 -16.849 -7.485 1.00 0.00 H ATOM 2256 HB3 GLN B 72 19.771 -18.342 -6.966 1.00 0.00 H ATOM 2257 HG2 GLN B 72 18.121 -17.483 -8.254 1.00 0.00 H ATOM 2258 HG3 GLN B 72 17.709 -16.677 -6.722 1.00 0.00 H ATOM 2259 HE22 GLN B 72 20.489 -15.220 -7.547 1.00 0.00 H ATOM 2260 HE21 GLN B 72 19.843 -13.827 -8.489 1.00 0.00 H ATOM 2261 H GLN B 72 22.141 -16.785 -5.845 1.00 0.00 H ATOM 2262 N HIS B 73 20.407 -18.902 -4.171 1.00 98.78 N ATOM 2263 CA HIS B 73 20.136 -19.999 -3.193 1.00 89.84 C ATOM 2264 C HIS B 73 20.039 -19.565 -1.737 1.00 97.45 C ATOM 2265 O HIS B 73 19.494 -20.288 -0.908 1.00101.27 O ATOM 2266 CB HIS B 73 21.210 -21.045 -3.263 1.00 87.76 C ATOM 2267 CG HIS B 73 22.578 -20.468 -3.277 1.00102.27 C ATOM 2268 ND1 HIS B 73 23.269 -20.254 -2.153 1.00107.96 N ATOM 2269 CD2 HIS B 73 23.362 -19.982 -4.331 1.00104.62 C ATOM 2270 CE1 HIS B 73 24.454 -19.691 -2.454 1.00109.68 C ATOM 2271 NE2 HIS B 73 24.503 -19.516 -3.792 1.00120.19 N ATOM 2272 HA HIS B 73 19.158 -20.377 -3.493 1.00 0.00 H ATOM 2273 HB2 HIS B 73 21.117 -21.698 -2.396 1.00 0.00 H ATOM 2274 HB3 HIS B 73 21.069 -21.629 -4.173 1.00 0.00 H ATOM 2275 HD2 HIS B 73 23.098 -19.981 -5.388 1.00 0.00 H ATOM 2276 HE1 HIS B 73 25.236 -19.424 -1.743 1.00 0.00 H ATOM 2277 H HIS B 73 21.364 -18.832 -4.573 1.00 0.00 H ATOM 2278 N ILE B 74 20.584 -18.401 -1.399 1.00 99.30 N ATOM 2279 CA ILE B 74 20.627 -17.939 -0.034 1.00 91.33 C ATOM 2280 C ILE B 74 19.399 -17.100 0.199 1.00 93.86 C ATOM 2281 O ILE B 74 19.043 -16.317 -0.697 1.00 99.43 O ATOM 2282 CB ILE B 74 21.822 -17.023 0.168 1.00 92.25 C ATOM 2283 CG1 ILE B 74 23.106 -17.690 -0.297 1.00 95.74 C ATOM 2284 CG2 ILE B 74 22.031 -16.729 1.648 1.00100.25 C ATOM 2285 CD1 ILE B 74 23.760 -18.558 0.762 1.00 88.90 C ATOM 2286 HA ILE B 74 20.687 -18.795 0.638 1.00 0.00 H ATOM 2287 HB ILE B 74 21.613 -16.117 -0.401 1.00 0.00 H ATOM 2288 HG12 ILE B 74 22.877 -18.314 -1.161 1.00 0.00 H ATOM 2289 HG13 ILE B 74 23.812 -16.913 -0.589 1.00 0.00 H ATOM 2290 HD11 ILE B 74 24.007 -17.946 1.630 1.00 0.00 H ATOM 2291 HD12 ILE B 74 23.071 -19.349 1.058 1.00 0.00 H ATOM 2292 HD13 ILE B 74 24.670 -19.000 0.357 1.00 0.00 H ATOM 2293 HG21 ILE B 74 21.142 -16.243 2.050 1.00 0.00 H ATOM 2294 HG22 ILE B 74 22.208 -17.663 2.181 1.00 0.00 H ATOM 2295 HG23 ILE B 74 22.892 -16.071 1.768 1.00 0.00 H ATOM 2296 H ILE B 74 20.994 -17.803 -2.145 1.00 0.00 H ATOM 2297 N VAL B 75 18.785 -17.223 1.394 1.00 83.60 N ATOM 2298 CA VAL B 75 17.482 -16.621 1.659 1.00 84.45 C ATOM 2299 C VAL B 75 17.405 -15.917 3.016 1.00103.56 C ATOM 2300 O VAL B 75 17.499 -16.558 4.073 1.00118.83 O ATOM 2301 CB VAL B 75 16.395 -17.708 1.645 1.00 85.08 C ATOM 2302 CG1 VAL B 75 15.001 -17.158 1.948 1.00 84.75 C ATOM 2303 CG2 VAL B 75 16.372 -18.401 0.315 1.00 83.64 C ATOM 2304 HA VAL B 75 17.330 -15.879 0.876 1.00 0.00 H ATOM 2305 HB VAL B 75 16.651 -18.412 2.436 1.00 0.00 H ATOM 2306 HG11 VAL B 75 15.000 -16.699 2.937 1.00 0.00 H ATOM 2307 HG12 VAL B 75 14.735 -16.412 1.199 1.00 0.00 H ATOM 2308 HG13 VAL B 75 14.277 -17.973 1.924 1.00 0.00 H ATOM 2309 HG21 VAL B 75 16.160 -17.674 -0.469 1.00 0.00 H ATOM 2310 HG22 VAL B 75 17.342 -18.863 0.131 1.00 0.00 H ATOM 2311 HG23 VAL B 75 15.598 -19.168 0.320 1.00 0.00 H ATOM 2312 H VAL B 75 19.254 -17.763 2.149 1.00 0.00 H ATOM 2313 N TYR B 76 17.190 -14.605 2.999 1.00103.04 N ATOM 2314 CA TYR B 76 17.257 -13.859 4.218 1.00 93.47 C ATOM 2315 C TYR B 76 15.908 -13.704 4.718 1.00 98.25 C ATOM 2316 O TYR B 76 15.094 -13.069 4.028 1.00105.05 O ATOM 2317 CB TYR B 76 17.878 -12.521 3.973 1.00 98.60 C ATOM 2318 CG TYR B 76 19.278 -12.727 3.509 1.00103.20 C ATOM 2319 CD1 TYR B 76 20.270 -13.160 4.395 1.00 99.98 C ATOM 2320 CD2 TYR B 76 19.600 -12.560 2.173 1.00102.16 C ATOM 2321 CE1 TYR B 76 21.557 -13.377 3.963 1.00 96.17 C ATOM 2322 CE2 TYR B 76 20.876 -12.767 1.726 1.00104.81 C ATOM 2323 CZ TYR B 76 21.854 -13.181 2.614 1.00104.28 C ATOM 2324 OH TYR B 76 23.125 -13.358 2.097 1.00 97.69 O ATOM 2325 HA TYR B 76 17.872 -14.383 4.949 1.00 0.00 H ATOM 2326 HB3 TYR B 76 17.878 -11.941 4.896 1.00 0.00 H ATOM 2327 HB2 TYR B 76 17.312 -11.987 3.210 1.00 0.00 H ATOM 2328 HD2 TYR B 76 18.826 -12.259 1.467 1.00 0.00 H ATOM 2329 HE2 TYR B 76 21.122 -12.607 0.676 1.00 0.00 H ATOM 2330 HE1 TYR B 76 22.331 -13.696 4.661 1.00 0.00 H ATOM 2331 HD1 TYR B 76 20.019 -13.328 5.442 1.00 0.00 H ATOM 2332 HH TYR B 76 23.735 -13.653 2.819 1.00 0.00 H ATOM 2333 H TYR B 76 16.974 -14.123 2.103 1.00 0.00 H ATOM 2334 N CYS B 77 15.675 -14.327 5.891 1.00 97.09 N ATOM 2335 CA CYS B 77 14.400 -14.270 6.662 1.00 96.55 C ATOM 2336 C CYS B 77 14.547 -13.403 7.905 1.00104.42 C ATOM 2337 O CYS B 77 13.564 -13.268 8.696 1.00104.59 O ATOM 2338 CB CYS B 77 13.859 -15.675 7.061 1.00 86.50 C ATOM 2339 SG CYS B 77 15.241 -16.804 7.230 1.00 97.03 S ATOM 2340 HA CYS B 77 13.669 -13.821 5.990 1.00 0.00 H ATOM 2341 HB2 CYS B 77 13.181 -16.039 6.289 1.00 0.00 H ATOM 2342 HB3 CYS B 77 13.325 -15.606 8.009 1.00 0.00 H ATOM 2343 HG CYS B 77 15.915 -16.887 6.028 1.00 0.00 H ATOM 2344 H CYS B 77 16.449 -14.895 6.291 1.00 0.00 H ATOM 2345 N SER B 78 15.730 -12.785 8.065 1.00 97.40 N ATOM 2346 CA SER B 78 15.895 -11.817 9.173 1.00105.93 C ATOM 2347 C SER B 78 14.645 -10.938 9.151 1.00105.18 C ATOM 2348 O SER B 78 14.130 -10.583 8.076 1.00113.24 O ATOM 2349 CB SER B 78 17.185 -11.001 9.039 1.00101.07 C ATOM 2350 OG SER B 78 18.114 -11.652 8.170 1.00106.38 O ATOM 2351 HA SER B 78 15.994 -12.328 10.131 1.00 0.00 H ATOM 2352 HB2 SER B 78 17.638 -10.885 10.024 1.00 0.00 H ATOM 2353 HB3 SER B 78 16.945 -10.018 8.633 1.00 0.00 H ATOM 2354 HG SER B 78 18.338 -12.544 8.537 1.00 0.00 H ATOM 2355 H SER B 78 16.520 -12.984 7.418 1.00 0.00 H ATOM 2356 N ASN B 79 14.088 -10.644 10.308 1.00108.99 N ATOM 2357 CA ASN B 79 13.002 -9.637 10.327 1.00119.46 C ATOM 2358 C ASN B 79 11.564 -10.208 10.177 1.00121.20 C ATOM 2359 O ASN B 79 10.591 -9.622 10.661 1.00116.52 O ATOM 2360 CB ASN B 79 13.238 -8.512 9.240 1.00109.63 C ATOM 2361 CG ASN B 79 14.507 -7.612 9.497 1.00114.16 C ATOM 2362 OD1 ASN B 79 14.874 -7.287 10.642 1.00105.03 O ATOM 2363 ND2 ASN B 79 15.145 -7.174 8.393 1.00108.25 N ATOM 2364 HA ASN B 79 13.056 -9.214 11.330 1.00 0.00 H ATOM 2365 HB2 ASN B 79 13.353 -8.994 8.269 1.00 0.00 H ATOM 2366 HB3 ASN B 79 12.360 -7.866 9.221 1.00 0.00 H ATOM 2367 HD22 ASN B 79 14.813 -7.464 7.451 1.00 0.00 H ATOM 2368 HD21 ASN B 79 15.969 -6.546 8.483 1.00 0.00 H ATOM 2369 H ASN B 79 14.402 -11.107 11.185 1.00 0.00 H ATOM 2370 N ASP B 80 11.435 -11.333 9.479 1.00123.12 N ATOM 2371 CA ASP B 80 10.159 -11.738 8.844 1.00108.84 C ATOM 2372 C ASP B 80 9.464 -12.828 9.625 1.00107.00 C ATOM 2373 O ASP B 80 10.102 -13.532 10.423 1.00109.22 O ATOM 2374 CB ASP B 80 10.498 -12.254 7.460 1.00105.09 C ATOM 2375 CG ASP B 80 9.327 -12.858 6.760 1.00112.16 C ATOM 2376 OD1 ASP B 80 8.432 -12.122 6.293 1.00119.18 O ATOM 2377 OD2 ASP B 80 9.291 -14.095 6.658 1.00108.88 O ATOM 2378 HA ASP B 80 9.483 -10.884 8.809 1.00 0.00 H ATOM 2379 HB2 ASP B 80 10.871 -11.423 6.861 1.00 0.00 H ATOM 2380 HB3 ASP B 80 11.276 -13.011 7.552 1.00 0.00 H ATOM 2381 H ASP B 80 12.263 -11.953 9.375 1.00 0.00 H ATOM 2382 N LEU B 81 8.161 -13.010 9.426 1.00107.93 N ATOM 2383 CA LEU B 81 7.492 -14.079 10.210 1.00103.78 C ATOM 2384 C LEU B 81 8.201 -15.416 9.985 1.00106.79 C ATOM 2385 O LEU B 81 8.446 -16.170 10.933 1.00109.86 O ATOM 2386 CB LEU B 81 5.986 -14.167 9.954 1.00106.35 C ATOM 2387 CG LEU B 81 5.337 -15.587 9.948 1.00124.15 C ATOM 2388 CD1 LEU B 81 5.572 -16.302 11.280 1.00107.39 C ATOM 2389 CD2 LEU B 81 3.843 -15.654 9.538 1.00106.68 C ATOM 2390 HA LEU B 81 7.580 -13.814 11.264 1.00 0.00 H ATOM 2391 HB2 LEU B 81 5.488 -13.584 10.729 1.00 0.00 H ATOM 2392 HB3 LEU B 81 5.793 -13.716 8.981 1.00 0.00 H ATOM 2393 HG LEU B 81 5.855 -16.112 9.146 1.00 0.00 H ATOM 2394 HD21 LEU B 81 3.251 -15.054 10.229 1.00 0.00 H ATOM 2395 HD22 LEU B 81 3.727 -15.265 8.526 1.00 0.00 H ATOM 2396 HD23 LEU B 81 3.504 -16.690 9.571 1.00 0.00 H ATOM 2397 HD11 LEU B 81 6.643 -16.407 11.450 1.00 0.00 H ATOM 2398 HD12 LEU B 81 5.130 -15.718 12.087 1.00 0.00 H ATOM 2399 HD13 LEU B 81 5.109 -17.288 11.248 1.00 0.00 H ATOM 2400 H LEU B 81 7.632 -12.426 8.748 1.00 0.00 H ATOM 2401 N LEU B 82 8.556 -15.693 8.735 1.00 97.53 N ATOM 2402 CA LEU B 82 9.318 -16.900 8.431 1.00 92.49 C ATOM 2403 C LEU B 82 10.565 -17.089 9.292 1.00 95.42 C ATOM 2404 O LEU B 82 10.650 -18.045 10.031 1.00106.03 O ATOM 2405 CB LEU B 82 9.688 -16.931 6.944 1.00 83.82 C ATOM 2406 CG LEU B 82 10.421 -18.166 6.435 1.00 82.30 C ATOM 2407 CD1 LEU B 82 9.462 -19.368 6.421 1.00 80.18 C ATOM 2408 CD2 LEU B 82 11.119 -17.929 5.072 1.00 73.89 C ATOM 2409 HA LEU B 82 8.662 -17.736 8.673 1.00 0.00 H ATOM 2410 HB2 LEU B 82 8.764 -16.840 6.374 1.00 0.00 H ATOM 2411 HB3 LEU B 82 10.323 -16.067 6.746 1.00 0.00 H ATOM 2412 HG LEU B 82 11.234 -18.392 7.125 1.00 0.00 H ATOM 2413 HD21 LEU B 82 10.373 -17.652 4.327 1.00 0.00 H ATOM 2414 HD22 LEU B 82 11.849 -17.126 5.174 1.00 0.00 H ATOM 2415 HD23 LEU B 82 11.624 -18.843 4.760 1.00 0.00 H ATOM 2416 HD11 LEU B 82 9.099 -19.553 7.432 1.00 0.00 H ATOM 2417 HD12 LEU B 82 8.619 -19.151 5.765 1.00 0.00 H ATOM 2418 HD13 LEU B 82 9.991 -20.249 6.056 1.00 0.00 H ATOM 2419 H LEU B 82 8.289 -15.045 7.967 1.00 0.00 H ATOM 2420 N GLY B 83 11.556 -16.220 9.174 1.00 98.59 N ATOM 2421 CA GLY B 83 12.710 -16.343 10.055 1.00108.62 C ATOM 2422 C GLY B 83 12.351 -16.490 11.541 1.00108.04 C ATOM 2423 O GLY B 83 12.965 -17.293 12.258 1.00 99.54 O ATOM 2424 HA3 GLY B 83 13.327 -15.452 9.938 1.00 0.00 H ATOM 2425 HA2 GLY B 83 13.281 -17.221 9.752 1.00 0.00 H ATOM 2426 H GLY B 83 11.512 -15.461 8.464 1.00 0.00 H ATOM 2427 N ASP B 84 11.377 -15.718 12.025 1.00104.57 N ATOM 2428 CA ASP B 84 10.986 -15.853 13.441 1.00107.94 C ATOM 2429 C ASP B 84 10.380 -17.252 13.637 1.00110.09 C ATOM 2430 O ASP B 84 10.419 -17.787 14.761 1.00121.53 O ATOM 2431 CB ASP B 84 9.998 -14.767 13.934 1.00108.67 C ATOM 2432 CG ASP B 84 10.618 -13.358 14.044 1.00109.17 C ATOM 2433 OD1 ASP B 84 11.825 -13.186 13.762 1.00109.84 O ATOM 2434 OD2 ASP B 84 9.879 -12.389 14.395 1.00105.17 O ATOM 2435 HA ASP B 84 11.884 -15.716 14.043 1.00 0.00 H ATOM 2436 HB2 ASP B 84 9.163 -14.721 13.235 1.00 0.00 H ATOM 2437 HB3 ASP B 84 9.631 -15.058 14.918 1.00 0.00 H ATOM 2438 H ASP B 84 10.898 -15.028 11.411 1.00 0.00 H ATOM 2439 N LEU B 85 9.844 -17.860 12.570 1.00 94.14 N ATOM 2440 CA LEU B 85 9.467 -19.274 12.688 1.00 93.86 C ATOM 2441 C LEU B 85 10.404 -20.342 12.170 1.00 93.37 C ATOM 2442 O LEU B 85 10.110 -21.526 12.303 1.00100.42 O ATOM 2443 CB LEU B 85 8.034 -19.586 12.305 1.00 92.47 C ATOM 2444 CG LEU B 85 7.295 -18.791 11.277 1.00 99.41 C ATOM 2445 CD1 LEU B 85 7.563 -19.431 9.908 1.00107.31 C ATOM 2446 CD2 LEU B 85 5.832 -18.907 11.650 1.00 94.00 C ATOM 2447 HA LEU B 85 9.577 -19.356 13.769 1.00 0.00 H ATOM 2448 HB2 LEU B 85 8.030 -20.618 11.953 1.00 0.00 H ATOM 2449 HB3 LEU B 85 7.451 -19.514 13.223 1.00 0.00 H ATOM 2450 HG LEU B 85 7.598 -17.745 11.234 1.00 0.00 H ATOM 2451 HD21 LEU B 85 5.536 -19.956 11.631 1.00 0.00 H ATOM 2452 HD22 LEU B 85 5.680 -18.503 12.651 1.00 0.00 H ATOM 2453 HD23 LEU B 85 5.230 -18.345 10.935 1.00 0.00 H ATOM 2454 HD11 LEU B 85 8.633 -19.413 9.703 1.00 0.00 H ATOM 2455 HD12 LEU B 85 7.210 -20.462 9.915 1.00 0.00 H ATOM 2456 HD13 LEU B 85 7.035 -18.870 9.137 1.00 0.00 H ATOM 2457 H LEU B 85 9.699 -17.343 11.680 1.00 0.00 H ATOM 2458 N PHE B 86 11.553 -19.955 11.643 1.00 92.12 N ATOM 2459 CA PHE B 86 12.599 -20.920 11.450 1.00 90.41 C ATOM 2460 C PHE B 86 13.581 -20.687 12.525 1.00 96.54 C ATOM 2461 O PHE B 86 14.518 -21.470 12.690 1.00102.47 O ATOM 2462 CB PHE B 86 13.329 -20.670 10.155 1.00 88.20 C ATOM 2463 CG PHE B 86 12.865 -21.537 9.020 1.00 99.43 C ATOM 2464 CD1 PHE B 86 11.540 -21.989 8.942 1.00 91.56 C ATOM 2465 CD2 PHE B 86 13.736 -21.857 7.978 1.00100.95 C ATOM 2466 CE1 PHE B 86 11.111 -22.748 7.860 1.00 94.90 C ATOM 2467 CE2 PHE B 86 13.314 -22.619 6.879 1.00 93.87 C ATOM 2468 CZ PHE B 86 12.008 -23.064 6.807 1.00 94.55 C ATOM 2469 HA PHE B 86 12.174 -21.924 11.446 1.00 0.00 H ATOM 2470 HB2 PHE B 86 13.182 -19.627 9.873 1.00 0.00 H ATOM 2471 HB3 PHE B 86 14.391 -20.855 10.317 1.00 0.00 H ATOM 2472 HD2 PHE B 86 14.767 -21.507 8.019 1.00 0.00 H ATOM 2473 HE2 PHE B 86 14.017 -22.860 6.081 1.00 0.00 H ATOM 2474 HZ PHE B 86 11.671 -23.650 5.952 1.00 0.00 H ATOM 2475 HE1 PHE B 86 10.081 -23.102 7.820 1.00 0.00 H ATOM 2476 HD1 PHE B 86 10.839 -21.742 9.739 1.00 0.00 H ATOM 2477 H PHE B 86 11.698 -18.962 11.371 1.00 0.00 H ATOM 2478 N GLY B 87 13.380 -19.577 13.228 1.00 97.69 N ATOM 2479 CA GLY B 87 14.384 -19.012 14.128 1.00105.64 C ATOM 2480 C GLY B 87 15.678 -18.975 13.374 1.00 99.85 C ATOM 2481 O GLY B 87 16.539 -19.850 13.541 1.00103.37 O ATOM 2482 HA3 GLY B 87 14.485 -19.637 15.015 1.00 0.00 H ATOM 2483 HA2 GLY B 87 14.095 -18.004 14.426 1.00 0.00 H ATOM 2484 H GLY B 87 12.467 -19.088 13.134 1.00 0.00 H ATOM 2485 N VAL B 88 15.772 -18.026 12.453 1.00 96.78 N ATOM 2486 CA VAL B 88 17.071 -17.701 11.830 1.00 98.15 C ATOM 2487 C VAL B 88 16.958 -16.355 11.203 1.00100.59 C ATOM 2488 O VAL B 88 15.861 -15.763 11.173 1.00 91.67 O ATOM 2489 CB VAL B 88 17.568 -18.714 10.782 1.00 90.80 C ATOM 2490 CG1 VAL B 88 18.444 -19.796 11.415 1.00 86.44 C ATOM 2491 CG2 VAL B 88 16.382 -19.374 10.125 1.00 98.43 C ATOM 2492 HA VAL B 88 17.813 -17.732 12.628 1.00 0.00 H ATOM 2493 HB VAL B 88 18.165 -18.172 10.049 1.00 0.00 H ATOM 2494 HG11 VAL B 88 19.312 -19.331 11.883 1.00 0.00 H ATOM 2495 HG12 VAL B 88 17.868 -20.334 12.168 1.00 0.00 H ATOM 2496 HG13 VAL B 88 18.775 -20.491 10.643 1.00 0.00 H ATOM 2497 HG21 VAL B 88 15.790 -19.891 10.881 1.00 0.00 H ATOM 2498 HG22 VAL B 88 15.769 -18.615 9.638 1.00 0.00 H ATOM 2499 HG23 VAL B 88 16.732 -20.091 9.383 1.00 0.00 H ATOM 2500 H VAL B 88 14.920 -17.504 12.165 1.00 0.00 H ATOM 2501 N PRO B 89 18.109 -15.845 10.754 1.00104.06 N ATOM 2502 CA PRO B 89 18.244 -14.650 9.925 1.00 99.82 C ATOM 2503 C PRO B 89 18.230 -14.998 8.420 1.00105.90 C ATOM 2504 O PRO B 89 17.721 -14.216 7.614 1.00114.24 O ATOM 2505 CB PRO B 89 19.642 -14.155 10.283 1.00105.81 C ATOM 2506 CG PRO B 89 20.417 -15.391 10.598 1.00101.15 C ATOM 2507 CD PRO B 89 19.419 -16.415 11.131 1.00 97.88 C ATOM 2508 HA PRO B 89 17.437 -13.938 10.095 1.00 0.00 H ATOM 2509 HD3 PRO B 89 19.571 -17.388 10.663 1.00 0.00 H ATOM 2510 HD2 PRO B 89 19.504 -16.516 12.213 1.00 0.00 H ATOM 2511 HG3 PRO B 89 21.174 -15.177 11.352 1.00 0.00 H ATOM 2512 HG2 PRO B 89 20.900 -15.771 9.698 1.00 0.00 H ATOM 2513 HB2 PRO B 89 20.089 -13.625 9.442 1.00 0.00 H ATOM 2514 HB3 PRO B 89 19.605 -13.494 11.149 1.00 0.00 H ATOM 2515 N SER B 90 18.781 -16.155 8.049 1.00 95.55 N ATOM 2516 CA SER B 90 18.987 -16.438 6.674 1.00 92.53 C ATOM 2517 C SER B 90 19.147 -17.926 6.542 1.00103.34 C ATOM 2518 O SER B 90 19.185 -18.616 7.552 1.00123.36 O ATOM 2519 CB SER B 90 20.302 -15.855 6.290 1.00 89.04 C ATOM 2520 OG SER B 90 21.256 -16.902 6.312 1.00 96.55 O ATOM 2521 HA SER B 90 18.167 -16.050 6.069 1.00 0.00 H ATOM 2522 HB2 SER B 90 20.586 -15.078 6.999 1.00 0.00 H ATOM 2523 HB3 SER B 90 20.242 -15.427 5.289 1.00 0.00 H ATOM 2524 HG SER B 90 21.301 -17.287 7.223 1.00 0.00 H ATOM 2525 H SER B 90 19.060 -16.851 8.769 1.00 0.00 H ATOM 2526 N PHE B 91 19.320 -18.418 5.314 1.00 98.81 N ATOM 2527 CA PHE B 91 19.591 -19.833 5.102 1.00102.61 C ATOM 2528 C PHE B 91 19.685 -20.286 3.657 1.00100.21 C ATOM 2529 O PHE B 91 19.113 -19.642 2.781 1.00110.15 O ATOM 2530 CB PHE B 91 18.505 -20.626 5.756 1.00105.88 C ATOM 2531 CG PHE B 91 17.272 -20.811 4.912 1.00 96.90 C ATOM 2532 CD1 PHE B 91 17.192 -21.819 3.951 1.00 98.87 C ATOM 2533 CD2 PHE B 91 16.158 -20.055 5.162 1.00 96.82 C ATOM 2534 CE1 PHE B 91 16.018 -22.010 3.229 1.00 98.61 C ATOM 2535 CE2 PHE B 91 14.982 -20.232 4.445 1.00 97.67 C ATOM 2536 CZ PHE B 91 14.898 -21.209 3.476 1.00 84.02 C ATOM 2537 HA PHE B 91 20.579 -19.999 5.531 1.00 0.00 H ATOM 2538 HB2 PHE B 91 18.902 -21.611 6.000 1.00 0.00 H ATOM 2539 HB3 PHE B 91 18.216 -20.115 6.674 1.00 0.00 H ATOM 2540 HD2 PHE B 91 16.195 -19.296 5.943 1.00 0.00 H ATOM 2541 HE2 PHE B 91 14.121 -19.595 4.649 1.00 0.00 H ATOM 2542 HZ PHE B 91 13.976 -21.355 2.913 1.00 0.00 H ATOM 2543 HE1 PHE B 91 15.971 -22.788 2.467 1.00 0.00 H ATOM 2544 HD1 PHE B 91 18.054 -22.460 3.765 1.00 0.00 H ATOM 2545 H PHE B 91 19.260 -17.780 4.495 1.00 0.00 H ATOM 2546 N SER B 92 20.385 -21.392 3.408 1.00 92.13 N ATOM 2547 CA SER B 92 20.675 -21.795 2.015 1.00 99.12 C ATOM 2548 C SER B 92 19.758 -22.886 1.611 1.00102.45 C ATOM 2549 O SER B 92 19.568 -23.831 2.382 1.00108.97 O ATOM 2550 CB SER B 92 22.089 -22.332 1.812 1.00100.41 C ATOM 2551 OG SER B 92 22.107 -23.235 0.711 1.00 99.69 O ATOM 2552 HA SER B 92 20.551 -20.890 1.420 1.00 0.00 H ATOM 2553 HB2 SER B 92 22.412 -22.853 2.713 1.00 0.00 H ATOM 2554 HB3 SER B 92 22.767 -21.502 1.611 1.00 0.00 H ATOM 2555 HG SER B 92 21.492 -23.989 0.894 1.00 0.00 H ATOM 2556 H SER B 92 20.729 -21.975 4.197 1.00 0.00 H ATOM 2557 N VAL B 93 19.208 -22.772 0.393 1.00100.64 N ATOM 2558 CA VAL B 93 18.340 -23.829 -0.132 1.00 91.59 C ATOM 2559 C VAL B 93 19.143 -25.032 -0.564 1.00 88.82 C ATOM 2560 O VAL B 93 18.574 -26.110 -0.670 1.00 88.18 O ATOM 2561 CB VAL B 93 17.394 -23.381 -1.228 1.00 85.28 C ATOM 2562 CG1 VAL B 93 16.365 -22.397 -0.687 1.00 74.37 C ATOM 2563 CG2 VAL B 93 18.199 -22.854 -2.408 1.00 83.00 C ATOM 2564 HA VAL B 93 17.699 -24.111 0.703 1.00 0.00 H ATOM 2565 HB VAL B 93 16.814 -24.227 -1.597 1.00 0.00 H ATOM 2566 HG11 VAL B 93 15.786 -22.876 0.103 1.00 0.00 H ATOM 2567 HG12 VAL B 93 16.877 -21.523 -0.285 1.00 0.00 H ATOM 2568 HG13 VAL B 93 15.698 -22.091 -1.493 1.00 0.00 H ATOM 2569 HG21 VAL B 93 18.807 -22.009 -2.083 1.00 0.00 H ATOM 2570 HG22 VAL B 93 18.847 -23.645 -2.787 1.00 0.00 H ATOM 2571 HG23 VAL B 93 17.518 -22.532 -3.196 1.00 0.00 H ATOM 2572 H VAL B 93 19.399 -21.927 -0.183 1.00 0.00 H ATOM 2573 N LYS B 94 20.465 -24.846 -0.718 1.00 97.10 N ATOM 2574 CA LYS B 94 21.388 -25.965 -0.933 1.00103.19 C ATOM 2575 C LYS B 94 21.276 -27.042 0.167 1.00104.54 C ATOM 2576 O LYS B 94 20.737 -28.133 -0.093 1.00115.05 O ATOM 2577 CB LYS B 94 22.823 -25.473 -1.116 1.00113.94 C ATOM 2578 CG LYS B 94 23.115 -24.891 -2.493 1.00129.33 C ATOM 2579 CD LYS B 94 24.466 -25.347 -3.047 1.00134.59 C ATOM 2580 CE LYS B 94 24.683 -24.815 -4.461 1.00144.79 C ATOM 2581 NZ LYS B 94 26.126 -24.704 -4.849 1.00151.31 N ATOM 2582 HA LYS B 94 21.090 -26.451 -1.862 1.00 0.00 H ATOM 2583 HB2 LYS B 94 23.017 -24.702 -0.371 1.00 0.00 H ATOM 2584 HB3 LYS B 94 23.496 -26.314 -0.951 1.00 0.00 H ATOM 2585 HG2 LYS B 94 22.330 -25.207 -3.180 1.00 0.00 H ATOM 2586 HG3 LYS B 94 23.116 -23.803 -2.420 1.00 0.00 H ATOM 2587 HD2 LYS B 94 25.261 -24.976 -2.400 1.00 0.00 H ATOM 2588 HD3 LYS B 94 24.494 -26.436 -3.067 1.00 0.00 H ATOM 2589 HE2 LYS B 94 24.231 -23.826 -4.530 1.00 0.00 H ATOM 2590 HE3 LYS B 94 24.189 -25.488 -5.162 1.00 0.00 H ATOM 2591 HZ1 LYS B 94 26.610 -24.055 -4.196 1.00 0.00 H ATOM 2592 HZ2 LYS B 94 26.570 -25.643 -4.800 1.00 0.00 H ATOM 2593 HZ3 LYS B 94 26.195 -24.337 -5.820 1.00 0.00 H ATOM 2594 H LYS B 94 20.845 -23.879 -0.684 1.00 0.00 H ATOM 2595 N GLU B 95 21.752 -26.732 1.379 1.00109.91 N ATOM 2596 CA GLU B 95 21.692 -27.652 2.551 1.00105.54 C ATOM 2597 C GLU B 95 20.352 -28.365 2.704 1.00110.24 C ATOM 2598 O GLU B 95 19.348 -27.749 3.086 1.00104.33 O ATOM 2599 CB GLU B 95 22.115 -26.950 3.847 1.00 93.96 C ATOM 2600 CG GLU B 95 21.299 -25.760 4.331 1.00 92.21 C ATOM 2601 CD GLU B 95 22.194 -24.570 4.763 1.00107.93 C ATOM 2602 OE1 GLU B 95 23.373 -24.537 4.306 1.00108.72 O ATOM 2603 OE2 GLU B 95 21.753 -23.647 5.535 1.00104.86 O ATOM 2604 HA GLU B 95 22.419 -28.437 2.345 1.00 0.00 H ATOM 2605 HB2 GLU B 95 22.094 -27.698 4.640 1.00 0.00 H ATOM 2606 HB3 GLU B 95 23.138 -26.602 3.705 1.00 0.00 H ATOM 2607 HG2 GLU B 95 20.644 -25.432 3.524 1.00 0.00 H ATOM 2608 HG3 GLU B 95 20.695 -26.072 5.183 1.00 0.00 H ATOM 2609 H GLU B 95 22.188 -25.797 1.511 1.00 0.00 H ATOM 2610 N HIS B 96 20.358 -29.667 2.387 1.00122.05 N ATOM 2611 CA HIS B 96 19.119 -30.414 2.119 1.00117.23 C ATOM 2612 C HIS B 96 18.501 -30.989 3.321 1.00115.96 C ATOM 2613 O HIS B 96 17.381 -30.631 3.654 1.00102.68 O ATOM 2614 CB HIS B 96 19.319 -31.440 1.013 1.00112.18 C ATOM 2615 CG HIS B 96 18.876 -30.915 -0.300 1.00114.59 C ATOM 2616 ND1 HIS B 96 19.723 -30.343 -1.178 1.00103.64 N ATOM 2617 CD2 HIS B 96 17.593 -30.749 -0.823 1.00125.00 C ATOM 2618 CE1 HIS B 96 19.029 -29.892 -2.246 1.00101.30 C ATOM 2619 NE2 HIS B 96 17.727 -30.150 -2.034 1.00119.75 N ATOM 2620 HA HIS B 96 18.395 -29.683 1.760 1.00 0.00 H ATOM 2621 HB2 HIS B 96 20.377 -31.696 0.954 1.00 0.00 H ATOM 2622 HB3 HIS B 96 18.743 -32.334 1.250 1.00 0.00 H ATOM 2623 HD2 HIS B 96 16.658 -31.045 -0.348 1.00 0.00 H ATOM 2624 HE1 HIS B 96 19.451 -29.405 -3.125 1.00 0.00 H ATOM 2625 H HIS B 96 21.269 -30.166 2.328 1.00 0.00 H ATOM 2626 N ARG B 97 19.243 -31.897 3.955 1.00128.64 N ATOM 2627 CA ARG B 97 19.027 -32.329 5.336 1.00136.73 C ATOM 2628 C ARG B 97 18.712 -31.052 6.136 1.00129.95 C ATOM 2629 O ARG B 97 17.618 -30.892 6.744 1.00107.10 O ATOM 2630 CB ARG B 97 20.288 -33.082 5.885 1.00148.36 C ATOM 2631 CG ARG B 97 21.654 -32.656 5.295 1.00157.04 C ATOM 2632 CD ARG B 97 21.739 -32.884 3.769 1.00157.32 C ATOM 2633 NE ARG B 97 22.455 -31.849 2.992 1.00140.91 N ATOM 2634 CZ ARG B 97 23.745 -31.924 2.665 1.00127.69 C ATOM 2635 NH1 ARG B 97 24.464 -32.953 3.060 1.00128.06 N ATOM 2636 NH2 ARG B 97 24.330 -30.979 1.960 1.00124.67 N ATOM 2637 HA ARG B 97 18.204 -33.039 5.418 1.00 0.00 H ATOM 2638 HB2 ARG B 97 20.327 -32.922 6.962 1.00 0.00 H ATOM 2639 HB3 ARG B 97 20.155 -34.145 5.681 1.00 0.00 H ATOM 2640 HG2 ARG B 97 21.808 -31.596 5.499 1.00 0.00 H ATOM 2641 HG3 ARG B 97 22.440 -33.236 5.779 1.00 0.00 H ATOM 2642 HD2 ARG B 97 20.721 -32.944 3.384 1.00 0.00 H ATOM 2643 HD3 ARG B 97 22.245 -33.835 3.602 1.00 0.00 H ATOM 2644 HE ARG B 97 21.920 -31.013 2.682 1.00 0.00 H ATOM 2645 HH12 ARG B 97 25.471 -33.012 2.805 1.00 0.00 H ATOM 2646 HH11 ARG B 97 24.026 -33.707 3.627 1.00 0.00 H ATOM 2647 HH22 ARG B 97 25.338 -31.060 1.717 1.00 0.00 H ATOM 2648 HH21 ARG B 97 23.784 -30.151 1.646 1.00 0.00 H ATOM 2649 H ARG B 97 20.031 -32.329 3.431 1.00 0.00 H ATOM 2650 N LYS B 98 19.645 -30.103 6.070 1.00127.13 N ATOM 2651 CA LYS B 98 19.507 -28.907 6.892 1.00126.04 C ATOM 2652 C LYS B 98 18.139 -28.165 6.763 1.00122.02 C ATOM 2653 O LYS B 98 17.558 -27.760 7.779 1.00120.18 O ATOM 2654 CB LYS B 98 20.746 -28.011 6.798 1.00118.55 C ATOM 2655 CG LYS B 98 20.760 -26.892 7.842 1.00122.58 C ATOM 2656 CD LYS B 98 22.128 -26.703 8.519 1.00121.46 C ATOM 2657 CE LYS B 98 22.318 -25.299 9.124 1.00131.61 C ATOM 2658 NZ LYS B 98 21.222 -24.693 9.963 1.00110.78 N ATOM 2659 HA LYS B 98 19.467 -29.256 7.924 1.00 0.00 H ATOM 2660 HB2 LYS B 98 21.633 -28.629 6.940 1.00 0.00 H ATOM 2661 HB3 LYS B 98 20.774 -27.560 5.806 1.00 0.00 H ATOM 2662 HG2 LYS B 98 20.485 -25.958 7.351 1.00 0.00 H ATOM 2663 HG3 LYS B 98 20.024 -27.127 8.611 1.00 0.00 H ATOM 2664 HD2 LYS B 98 22.225 -27.440 9.316 1.00 0.00 H ATOM 2665 HD3 LYS B 98 22.908 -26.869 7.776 1.00 0.00 H ATOM 2666 HE2 LYS B 98 22.493 -24.617 8.292 1.00 0.00 H ATOM 2667 HE3 LYS B 98 23.209 -25.342 9.751 1.00 0.00 H ATOM 2668 HZ1 LYS B 98 20.356 -24.610 9.393 1.00 0.00 H ATOM 2669 HZ2 LYS B 98 21.040 -25.303 10.786 1.00 0.00 H ATOM 2670 HZ3 LYS B 98 21.517 -23.750 10.287 1.00 0.00 H ATOM 2671 H LYS B 98 20.464 -30.214 5.438 1.00 0.00 H ATOM 2672 N ILE B 99 17.574 -28.029 5.565 1.00107.70 N ATOM 2673 CA ILE B 99 16.254 -27.390 5.564 1.00113.30 C ATOM 2674 C ILE B 99 15.210 -28.271 6.250 1.00110.98 C ATOM 2675 O ILE B 99 14.166 -27.802 6.687 1.00108.68 O ATOM 2676 CB ILE B 99 15.725 -27.045 4.159 1.00116.43 C ATOM 2677 CG1 ILE B 99 16.815 -26.451 3.255 1.00112.82 C ATOM 2678 CG2 ILE B 99 14.522 -26.116 4.292 1.00 94.62 C ATOM 2679 CD1 ILE B 99 16.450 -26.429 1.768 1.00105.21 C ATOM 2680 HA ILE B 99 16.403 -26.459 6.111 1.00 0.00 H ATOM 2681 HB ILE B 99 15.409 -27.966 3.669 1.00 0.00 H ATOM 2682 HG12 ILE B 99 17.006 -25.427 3.576 1.00 0.00 H ATOM 2683 HG13 ILE B 99 17.722 -27.044 3.377 1.00 0.00 H ATOM 2684 HD11 ILE B 99 16.267 -27.447 1.425 1.00 0.00 H ATOM 2685 HD12 ILE B 99 15.551 -25.829 1.625 1.00 0.00 H ATOM 2686 HD13 ILE B 99 17.273 -25.995 1.200 1.00 0.00 H ATOM 2687 HG21 ILE B 99 13.741 -26.615 4.866 1.00 0.00 H ATOM 2688 HG22 ILE B 99 14.825 -25.203 4.805 1.00 0.00 H ATOM 2689 HG23 ILE B 99 14.144 -25.869 3.300 1.00 0.00 H ATOM 2690 H ILE B 99 18.036 -28.353 4.692 1.00 0.00 H ATOM 2691 N TYR B 100 15.496 -29.557 6.323 1.00106.08 N ATOM 2692 CA TYR B 100 14.544 -30.477 6.868 1.00118.20 C ATOM 2693 C TYR B 100 14.357 -30.330 8.380 1.00116.33 C ATOM 2694 O TYR B 100 13.224 -30.188 8.873 1.00101.88 O ATOM 2695 CB TYR B 100 14.922 -31.891 6.455 1.00131.96 C ATOM 2696 CG TYR B 100 14.411 -32.120 5.075 1.00146.91 C ATOM 2697 CD1 TYR B 100 15.255 -32.042 3.961 1.00147.50 C ATOM 2698 CD2 TYR B 100 13.053 -32.326 4.867 1.00148.23 C ATOM 2699 CE1 TYR B 100 14.755 -32.219 2.677 1.00140.66 C ATOM 2700 CE2 TYR B 100 12.543 -32.501 3.597 1.00142.18 C ATOM 2701 CZ TYR B 100 13.390 -32.448 2.512 1.00137.02 C ATOM 2702 OH TYR B 100 12.835 -32.638 1.274 1.00140.39 O ATOM 2703 HA TYR B 100 13.564 -30.240 6.453 1.00 0.00 H ATOM 2704 HB3 TYR B 100 14.472 -32.609 7.140 1.00 0.00 H ATOM 2705 HB2 TYR B 100 16.006 -32.004 6.472 1.00 0.00 H ATOM 2706 HD2 TYR B 100 12.378 -32.350 5.723 1.00 0.00 H ATOM 2707 HE2 TYR B 100 11.477 -32.680 3.453 1.00 0.00 H ATOM 2708 HE1 TYR B 100 15.419 -32.179 1.813 1.00 0.00 H ATOM 2709 HD1 TYR B 100 16.317 -31.840 4.103 1.00 0.00 H ATOM 2710 HH TYR B 100 13.542 -32.577 0.584 1.00 0.00 H ATOM 2711 H TYR B 100 16.416 -29.903 5.984 1.00 0.00 H ATOM 2712 N THR B 101 15.469 -30.345 9.105 1.00110.49 N ATOM 2713 CA THR B 101 15.477 -29.908 10.494 1.00110.12 C ATOM 2714 C THR B 101 14.437 -28.800 10.697 1.00107.67 C ATOM 2715 O THR B 101 13.467 -28.952 11.465 1.00112.26 O ATOM 2716 CB THR B 101 16.858 -29.326 10.846 1.00118.24 C ATOM 2717 OG1 THR B 101 17.896 -30.224 10.413 1.00124.73 O ATOM 2718 CG2 THR B 101 16.980 -29.108 12.324 1.00126.65 C ATOM 2719 HA THR B 101 15.249 -30.765 11.128 1.00 0.00 H ATOM 2720 HB THR B 101 16.964 -28.369 10.336 1.00 0.00 H ATOM 2721 HG1 THR B 101 18.779 -29.841 10.644 1.00 0.00 H ATOM 2722 HG23 THR B 101 16.195 -28.428 12.656 1.00 0.00 H ATOM 2723 HG21 THR B 101 16.878 -30.062 12.840 1.00 0.00 H ATOM 2724 HG22 THR B 101 17.955 -28.675 12.547 1.00 0.00 H ATOM 2725 H THR B 101 16.354 -30.676 8.671 1.00 0.00 H ATOM 2726 N MET B 102 14.611 -27.696 9.971 1.00102.16 N ATOM 2727 CA MET B 102 13.872 -26.470 10.294 1.00103.92 C ATOM 2728 C MET B 102 12.426 -26.662 10.038 1.00111.51 C ATOM 2729 O MET B 102 11.560 -26.329 10.879 1.00105.57 O ATOM 2730 CB MET B 102 14.310 -25.290 9.464 1.00 91.14 C ATOM 2731 CG MET B 102 15.772 -25.310 9.174 1.00101.60 C ATOM 2732 SD MET B 102 16.317 -23.598 9.000 1.00108.58 S ATOM 2733 CE MET B 102 18.005 -23.931 8.459 1.00101.02 C ATOM 2734 HA MET B 102 14.075 -26.267 11.345 1.00 0.00 H ATOM 2735 HB2 MET B 102 13.765 -25.304 8.520 1.00 0.00 H ATOM 2736 HB3 MET B 102 14.073 -24.374 10.005 1.00 0.00 H ATOM 2737 HG2 MET B 102 15.961 -25.856 8.250 1.00 0.00 H ATOM 2738 HG3 MET B 102 16.307 -25.789 9.994 1.00 0.00 H ATOM 2739 HE1 MET B 102 18.525 -24.503 9.227 1.00 0.00 H ATOM 2740 HE2 MET B 102 17.982 -24.503 7.531 1.00 0.00 H ATOM 2741 HE3 MET B 102 18.525 -22.987 8.293 1.00 0.00 H ATOM 2742 H MET B 102 15.275 -27.703 9.170 1.00 0.00 H ATOM 2743 N ILE B 103 12.177 -27.181 8.846 1.00103.53 N ATOM 2744 CA ILE B 103 10.832 -27.549 8.508 1.00117.22 C ATOM 2745 C ILE B 103 10.103 -28.222 9.686 1.00114.50 C ATOM 2746 O ILE B 103 8.972 -27.833 10.021 1.00115.22 O ATOM 2747 CB ILE B 103 10.818 -28.455 7.269 1.00114.48 C ATOM 2748 CG1 ILE B 103 11.876 -27.986 6.246 1.00112.48 C ATOM 2749 CG2 ILE B 103 9.425 -28.430 6.652 1.00108.63 C ATOM 2750 CD1 ILE B 103 11.326 -27.186 5.056 1.00 99.11 C ATOM 2751 HA ILE B 103 10.290 -26.631 8.278 1.00 0.00 H ATOM 2752 HB ILE B 103 11.065 -29.476 7.561 1.00 0.00 H ATOM 2753 HG12 ILE B 103 12.597 -27.359 6.770 1.00 0.00 H ATOM 2754 HG13 ILE B 103 12.381 -28.869 5.854 1.00 0.00 H ATOM 2755 HD11 ILE B 103 10.612 -27.800 4.506 1.00 0.00 H ATOM 2756 HD12 ILE B 103 10.828 -26.288 5.422 1.00 0.00 H ATOM 2757 HD13 ILE B 103 12.148 -26.905 4.398 1.00 0.00 H ATOM 2758 HG21 ILE B 103 8.700 -28.792 7.381 1.00 0.00 H ATOM 2759 HG22 ILE B 103 9.175 -27.409 6.364 1.00 0.00 H ATOM 2760 HG23 ILE B 103 9.408 -29.072 5.771 1.00 0.00 H ATOM 2761 H ILE B 103 12.948 -27.320 8.162 1.00 0.00 H ATOM 2762 N TYR B 104 10.775 -29.179 10.336 1.00121.56 N ATOM 2763 CA TYR B 104 10.105 -30.010 11.342 1.00127.91 C ATOM 2764 C TYR B 104 9.586 -29.202 12.473 1.00119.77 C ATOM 2765 O TYR B 104 8.365 -29.155 12.667 1.00108.67 O ATOM 2766 CB TYR B 104 10.944 -31.194 11.820 1.00124.37 C ATOM 2767 CG TYR B 104 11.068 -32.228 10.717 1.00146.50 C ATOM 2768 CD1 TYR B 104 12.284 -32.888 10.472 1.00154.14 C ATOM 2769 CD2 TYR B 104 9.973 -32.524 9.877 1.00143.31 C ATOM 2770 CE1 TYR B 104 12.407 -33.821 9.439 1.00146.50 C ATOM 2771 CE2 TYR B 104 10.088 -33.448 8.840 1.00138.30 C ATOM 2772 CZ TYR B 104 11.307 -34.087 8.625 1.00141.23 C ATOM 2773 OH TYR B 104 11.436 -34.991 7.608 1.00127.61 O ATOM 2774 HA TYR B 104 9.247 -30.450 10.833 1.00 0.00 H ATOM 2775 HB3 TYR B 104 10.465 -31.648 12.687 1.00 0.00 H ATOM 2776 HB2 TYR B 104 11.938 -30.843 12.098 1.00 0.00 H ATOM 2777 HD2 TYR B 104 9.020 -32.021 10.042 1.00 0.00 H ATOM 2778 HE2 TYR B 104 9.232 -33.669 8.203 1.00 0.00 H ATOM 2779 HE1 TYR B 104 13.353 -34.335 9.271 1.00 0.00 H ATOM 2780 HD1 TYR B 104 13.148 -32.668 11.100 1.00 0.00 H ATOM 2781 HH TYR B 104 12.360 -35.346 7.599 1.00 0.00 H ATOM 2782 H TYR B 104 11.782 -29.335 10.126 1.00 0.00 H ATOM 2783 N ARG B 105 10.484 -28.495 13.151 1.00109.58 N ATOM 2784 CA ARG B 105 10.051 -27.688 14.271 1.00109.45 C ATOM 2785 C ARG B 105 8.666 -27.115 14.033 1.00110.09 C ATOM 2786 O ARG B 105 7.997 -26.736 15.005 1.00120.98 O ATOM 2787 CB ARG B 105 10.980 -26.527 14.567 1.00107.30 C ATOM 2788 CG ARG B 105 12.396 -26.884 14.904 1.00118.08 C ATOM 2789 CD ARG B 105 13.272 -25.660 14.651 1.00119.80 C ATOM 2790 NE ARG B 105 14.682 -26.027 14.492 1.00122.19 N ATOM 2791 CZ ARG B 105 15.640 -25.187 14.083 1.00136.01 C ATOM 2792 NH1 ARG B 105 15.350 -23.921 13.788 1.00126.11 N ATOM 2793 NH2 ARG B 105 16.898 -25.611 13.955 1.00141.22 N ATOM 2794 HA ARG B 105 10.052 -28.367 15.124 1.00 0.00 H ATOM 2795 HB2 ARG B 105 10.999 -25.883 13.688 1.00 0.00 H ATOM 2796 HB3 ARG B 105 10.566 -25.975 15.411 1.00 0.00 H ATOM 2797 HG2 ARG B 105 12.463 -27.176 15.952 1.00 0.00 H ATOM 2798 HG3 ARG B 105 12.727 -27.711 14.276 1.00 0.00 H ATOM 2799 HD2 ARG B 105 13.177 -24.977 15.495 1.00 0.00 H ATOM 2800 HD3 ARG B 105 12.931 -25.163 13.743 1.00 0.00 H ATOM 2801 HE ARG B 105 14.956 -27.006 14.712 1.00 0.00 H ATOM 2802 HH12 ARG B 105 16.101 -23.276 13.471 1.00 0.00 H ATOM 2803 HH11 ARG B 105 14.372 -23.578 13.875 1.00 0.00 H ATOM 2804 HH22 ARG B 105 17.638 -24.954 13.637 1.00 0.00 H ATOM 2805 HH21 ARG B 105 17.139 -26.599 14.173 1.00 0.00 H ATOM 2806 H ARG B 105 11.488 -28.522 12.879 1.00 0.00 H ATOM 2807 N ASN B 106 8.211 -27.046 12.776 1.00112.15 N ATOM 2808 CA ASN B 106 6.825 -26.543 12.511 1.00121.93 C ATOM 2809 C ASN B 106 5.738 -27.536 12.156 1.00125.60 C ATOM 2810 O ASN B 106 4.756 -27.183 11.505 1.00122.15 O ATOM 2811 CB ASN B 106 6.781 -25.364 11.563 1.00105.94 C ATOM 2812 CG ASN B 106 6.933 -24.055 12.301 1.00115.67 C ATOM 2813 OD1 ASN B 106 5.927 -23.348 12.608 1.00114.63 O ATOM 2814 ND2 ASN B 106 8.203 -23.722 12.635 1.00 95.49 N ATOM 2815 HA ASN B 106 6.562 -26.229 13.521 1.00 0.00 H ATOM 2816 HB2 ASN B 106 7.591 -25.460 10.840 1.00 0.00 H ATOM 2817 HB3 ASN B 106 5.826 -25.366 11.038 1.00 0.00 H ATOM 2818 HD22 ASN B 106 8.993 -24.339 12.357 1.00 0.00 H ATOM 2819 HD21 ASN B 106 8.388 -22.849 13.169 1.00 0.00 H ATOM 2820 H ASN B 106 8.818 -27.341 11.985 1.00 0.00 H ATOM 2821 N LEU B 107 5.892 -28.756 12.658 1.00131.27 N ATOM 2822 CA LEU B 107 4.924 -29.818 12.419 1.00138.46 C ATOM 2823 C LEU B 107 4.385 -30.417 13.712 1.00147.69 C ATOM 2824 O LEU B 107 5.144 -31.057 14.445 1.00154.78 O ATOM 2825 CB LEU B 107 5.596 -30.934 11.613 1.00130.91 C ATOM 2826 CG LEU B 107 6.328 -30.453 10.363 1.00122.25 C ATOM 2827 CD1 LEU B 107 7.220 -31.576 9.858 1.00117.33 C ATOM 2828 CD2 LEU B 107 5.298 -29.987 9.335 1.00102.54 C ATOM 2829 HA LEU B 107 4.087 -29.380 11.876 1.00 0.00 H ATOM 2830 HB2 LEU B 107 6.316 -31.436 12.259 1.00 0.00 H ATOM 2831 HB3 LEU B 107 4.828 -31.644 11.307 1.00 0.00 H ATOM 2832 HG LEU B 107 6.973 -29.601 10.575 1.00 0.00 H ATOM 2833 HD21 LEU B 107 4.639 -30.817 9.080 1.00 0.00 H ATOM 2834 HD22 LEU B 107 4.710 -29.171 9.756 1.00 0.00 H ATOM 2835 HD23 LEU B 107 5.812 -29.641 8.438 1.00 0.00 H ATOM 2836 HD11 LEU B 107 7.941 -31.841 10.631 1.00 0.00 H ATOM 2837 HD12 LEU B 107 6.607 -32.445 9.618 1.00 0.00 H ATOM 2838 HD13 LEU B 107 7.749 -31.244 8.964 1.00 0.00 H ATOM 2839 H LEU B 107 6.730 -28.959 13.240 1.00 0.00 H ATOM 2840 N VAL B 108 3.094 -30.233 14.000 1.00138.91 N ATOM 2841 CA VAL B 108 2.487 -30.981 15.114 1.00138.71 C ATOM 2842 C VAL B 108 2.170 -32.447 14.744 1.00143.68 C ATOM 2843 O VAL B 108 1.021 -32.844 14.903 1.00145.60 O ATOM 2844 CB VAL B 108 1.195 -30.311 15.703 1.00141.60 C ATOM 2845 CG1 VAL B 108 1.514 -29.451 16.923 1.00151.88 C ATOM 2846 CG2 VAL B 108 0.398 -29.514 14.674 1.00132.58 C ATOM 2847 HA VAL B 108 3.255 -30.963 15.888 1.00 0.00 H ATOM 2848 HB VAL B 108 0.556 -31.137 16.016 1.00 0.00 H ATOM 2849 HG11 VAL B 108 1.963 -30.073 17.697 1.00 0.00 H ATOM 2850 HG12 VAL B 108 2.211 -28.663 16.638 1.00 0.00 H ATOM 2851 HG13 VAL B 108 0.595 -29.005 17.302 1.00 0.00 H ATOM 2852 HG21 VAL B 108 1.023 -28.718 14.269 1.00 0.00 H ATOM 2853 HG22 VAL B 108 0.084 -30.176 13.867 1.00 0.00 H ATOM 2854 HG23 VAL B 108 -0.480 -29.080 15.153 1.00 0.00 H ATOM 2855 H VAL B 108 2.522 -29.567 13.442 1.00 0.00 H ATOM 2856 N VAL B 109 3.155 -33.239 14.253 1.00135.47 N ATOM 2857 CA VAL B 109 2.942 -34.671 13.792 1.00116.95 C ATOM 2858 C VAL B 109 4.113 -35.640 13.958 1.00118.95 C ATOM 2859 O VAL B 109 4.060 -36.786 13.499 1.00107.14 O ATOM 2860 CB VAL B 109 2.465 -34.817 12.322 1.00118.19 C ATOM 2861 CG1 VAL B 109 3.640 -34.707 11.285 1.00105.17 C ATOM 2862 CG2 VAL B 109 1.646 -36.111 12.206 1.00108.22 C ATOM 2863 HA VAL B 109 2.157 -34.953 14.494 1.00 0.00 H ATOM 2864 OXT VAL B 109 5.118 -35.315 14.579 1.00130.06 O ATOM 2865 HB VAL B 109 1.820 -33.978 12.061 1.00 0.00 H ATOM 2866 HG11 VAL B 109 4.120 -33.734 11.384 1.00 0.00 H ATOM 2867 HG12 VAL B 109 4.368 -35.494 11.478 1.00 0.00 H ATOM 2868 HG13 VAL B 109 3.244 -34.817 10.276 1.00 0.00 H ATOM 2869 HG21 VAL B 109 2.270 -36.961 12.483 1.00 0.00 H ATOM 2870 HG22 VAL B 109 0.787 -36.057 12.874 1.00 0.00 H ATOM 2871 HG23 VAL B 109 1.302 -36.231 11.179 1.00 0.00 H ATOM 2872 H VAL B 109 4.114 -32.842 14.188 1.00 0.00 H TER 2873 VAL B 109 HETATM 2874 O HOH 1 14.973 -23.514 -27.744 1.00 89.52 O HETATM 2875 O HOH 2 10.663 -27.950 -18.885 1.00 96.14 O HETATM 2876 O HOH 3 13.535 -8.382 -10.703 1.00 96.23 O HETATM 2877 O HOH 4 0.755 -21.576 -10.026 1.00111.06 O HETATM 2878 O HOH 5 6.038 -28.784 -20.741 1.00115.34 O HETATM 2879 O HOH 6 8.611 -31.215 -19.828 1.00113.66 O HETATM 2880 O HOH 7 12.728 -8.041 13.094 1.00109.21 O HETATM 2881 O HOH 8 14.436 -28.325 -0.883 1.00103.41 O HETATM 2882 O HOH 9 2.722 -12.907 1.500 1.00 99.48 O HETATM 2883 O HOH 10 24.026 -18.515 4.524 1.00108.94 O HETATM 2884 O HOH 11 6.756 -7.408 6.056 1.00117.75 O HETATM 2885 C4 UNN A 12 12.019 -19.031 -9.174 1.00 -0.08 C HETATM 2886 C8 UNN A 12 13.285 -19.468 -8.905 1.00 -0.03 C HETATM 2887 C7 UNN A 12 13.713 -20.384 -7.966 1.00 -0.04 C HETATM 2888 C6 UNN A 12 15.081 -20.642 -8.075 1.00 0.02 C HETATM 2889 N5 UNN A 12 15.499 -19.778 -9.102 1.00 -0.28 N HETATM 2890 C9 UNN A 12 14.412 -19.063 -9.626 1.00 0.07 C HETATM 2891 C3 UNN A 12 14.241 -18.106 -10.651 1.00 -0.01 C HETATM 2892 C2 UNN A 12 12.973 -17.641 -10.910 1.00 0.03 C HETATM 2893 C1 UNN A 12 11.896 -18.109 -10.193 1.00 -0.07 C HETATM 2894 H UNN A 12 10.902 -17.735 -10.441 1.00 0.05 H HETATM 2895 CL UNN A 12 12.607 -16.385 -12.164 1.00 -0.09 CL HETATM 2896 C27 UNN A 12 15.403 -17.549 -11.470 1.00 -0.03 C HETATM 2897 H UNN A 12 16.111 -17.055 -10.805 1.00 0.04 H HETATM 2898 H UNN A 12 15.902 -18.365 -11.992 1.00 0.04 H HETATM 2899 H UNN A 12 15.023 -16.830 -12.196 1.00 0.04 H HETATM 2900 H UNN A 12 16.463 -19.684 -9.423 1.00 0.23 H HETATM 2901 H UNN A 12 15.682 -21.346 -7.500 1.00 0.09 H HETATM 2902 C10 UNN A 12 12.721 -21.089 -7.114 1.00 -0.05 C HETATM 2903 C11 UNN A 12 13.138 -22.167 -6.206 1.00 0.13 C HETATM 2904 N12 UNN A 12 14.420 -22.613 -5.977 1.00 -0.21 N HETATM 2905 C13 UNN A 12 14.174 -23.638 -5.092 1.00 0.32 C HETATM 2906 N14 UNN A 12 12.936 -23.854 -4.772 1.00 -0.15 N HETATM 2907 C15 UNN A 12 12.232 -22.943 -5.430 1.00 0.25 C HETATM 2908 O17 UNN A 12 10.958 -22.777 -5.409 1.00 -0.38 O HETATM 2909 C18 UNN A 12 12.497 -24.860 -3.832 1.00 0.09 C HETATM 2910 C19 UNN A 12 12.173 -24.364 -2.460 1.00 -0.02 C HETATM 2911 C20 UNN A 12 10.869 -23.977 -2.065 1.00 -0.06 C HETATM 2912 C21 UNN A 12 10.724 -23.579 -0.752 1.00 -0.04 C HETATM 2913 C22 UNN A 12 11.870 -23.575 0.079 1.00 0.16 C HETATM 2914 C23 UNN A 12 13.106 -23.943 -0.335 1.00 0.16 C HETATM 2915 C24 UNN A 12 13.280 -24.372 -1.626 1.00 -0.03 C HETATM 2916 H UNN A 12 14.254 -24.707 -1.983 1.00 0.05 H HETATM 2917 F25 UNN A 12 14.144 -23.912 0.499 1.00 -0.19 F HETATM 2918 F26 UNN A 12 11.814 -23.223 1.337 1.00 -0.19 F HETATM 2919 H UNN A 12 9.752 -23.275 -0.364 1.00 0.06 H HETATM 2920 H UNN A 12 10.028 -23.993 -2.759 1.00 0.05 H HETATM 2921 H UNN A 12 13.324 -25.561 -3.720 1.00 0.07 H HETATM 2922 H UNN A 12 11.575 -25.279 -4.235 1.00 0.07 H HETATM 2923 O16 UNN A 12 15.022 -24.411 -4.492 1.00 -0.38 O HETATM 2924 H UNN A 12 15.305 -22.277 -6.357 1.00 0.23 H HETATM 2925 H UNN A 12 11.670 -20.803 -7.163 1.00 0.04 H HETATM 2926 H UNN A 12 11.155 -19.390 -8.615 1.00 0.05 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 1430 1431 1444 1445 1446 CONECT 1444 1430 CONECT 1445 1430 CONECT 1446 1430 CONECT 2885 2886 2893 2926 CONECT 2886 2885 2887 2890 CONECT 2887 2886 2888 2902 CONECT 2888 2887 2889 2901 CONECT 2889 2888 2890 2900 CONECT 2890 2886 2889 2891 CONECT 2891 2890 2892 2896 CONECT 2892 2891 2893 2895 CONECT 2893 2885 2892 2894 CONECT 2894 2893 CONECT 2895 2892 CONECT 2896 2891 2897 2898 2899 CONECT 2897 2896 CONECT 2898 2896 CONECT 2899 2896 CONECT 2900 2889 CONECT 2901 2888 CONECT 2902 2887 2903 2925 CONECT 2903 2902 2904 2907 CONECT 2904 2903 2905 2924 CONECT 2905 2904 2906 2923 CONECT 2906 2905 2907 2909 CONECT 2907 2903 2906 2908 CONECT 2908 2907 CONECT 2909 2906 2910 2921 2922 CONECT 2910 2909 2911 2915 CONECT 2911 2910 2912 2920 CONECT 2912 2911 2913 2919 CONECT 2913 2912 2914 2918 CONECT 2914 2913 2915 2917 CONECT 2915 2910 2914 2916 CONECT 2916 2915 CONECT 2917 2914 CONECT 2918 2913 CONECT 2919 2912 CONECT 2920 2911 CONECT 2921 2909 CONECT 2922 2909 CONECT 2923 2905 CONECT 2924 2904 CONECT 2925 2902 CONECT 2926 2885 MASTER 0 0 0 0 0 0 0 0 2924 2 50 14 END
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RCSB PDB
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3u15
RCSB PDB
PDBbind
03M
Entry Information
PDB ID
3vbg
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
E3 ubiquitin-protein ligase Mdm2
Ligand Name
03M
EC.Number
E.C.6.3.2
Resolution
2.8(Å)
Affinity (Kd/Ki/IC50)
IC50=33nM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Proc.Natl.Acad.Sci.USA Vol. 109: pp. 11788-11793
Ligand Properties
Formula
C
2
0
H
1
4
ClF
2
N
3
O
2
Molecular Weight
401.794
Exact Mass
401.074
No. of atoms
42
No. of bonds
45
Polar Surface Area
65.2
LOGP Value
4.08 (
Computed with XLOGP3
)
4.77 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 4
Canonical SMILES
O=C1N/C(=C\c2c[nH]c3c2ccc(c3C)Cl)/C(=O)N1Cc1ccc(c(c1)F)F
InChI String
InChI=1S/C20H14ClF2N3O2/c1-10-14(21)4-3-13-12(8-24-18(10)13)7-17-19(27)26(20(28)25-17)9-11-2-5-15(22)16(23)6-11/h2-8,24H,9H2,1H3,(H,25,28)/b17-7-
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):
Q00987
Entrez Gene ID
NCBI Entrez Gene ID:
4193
ASD
Information of known allosteric effects of PDB entries
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