Browse entries in the PDBbind-CN Database
HEADER 1YND_COMPLEX COMPND 1YND_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 164 VAL ASN PRO THR VAL PHE PHE ASP ILE ALA VAL ASP GLY SEQRES 2 A 164 GLU PRO LEU GLY ARG VAL SER PHE GLU LEU PHE ALA ASP SEQRES 3 A 164 LYS VAL PRO LYS THR ALA GLU ASN PHE ARG ALA LEU SER SEQRES 4 A 164 THR GLY GLU LYS GLY PHE GLY TYR LYS GLY SER CYS PHE SEQRES 5 A 164 HIS ARG ILE ILE PRO GLY PHE MET CYS GLN GLY GLY ASP SEQRES 6 A 164 PHE THR ARG HIS ASN GLY THR GLY GLY LYS SER ILE TYR SEQRES 7 A 164 GLY GLU LYS PHE GLU ASP GLU ASN PHE ILE LEU LYS HIS SEQRES 8 A 164 THR GLY PRO GLY ILE LEU SER MET ALA ASN ALA GLY PRO SEQRES 9 A 164 ASN THR ASN GLY SER GLN PHE PHE ILE CYS THR ALA LYS SEQRES 10 A 164 THR GLU TRP LEU ASP GLY LYS HIS VAL VAL PHE GLY LYS SEQRES 11 A 164 VAL LYS GLU GLY MET ASN ILE VAL GLU ALA MET GLU ARG SEQRES 12 A 164 PHE GLY SER ARG ASN GLY LYS THR SER LYS LYS ILE THR SEQRES 13 A 164 ILE ALA ASP CYS GLY GLN LEU GLU HET SFA A 353 170 ATOM 1 N VAL A 2 34.437 20.971 52.781 1.00 22.28 N ATOM 2 CA VAL A 2 35.912 21.162 52.858 1.00 21.33 C ATOM 3 C VAL A 2 36.261 22.544 52.294 1.00 19.95 C ATOM 4 O VAL A 2 35.598 23.032 51.377 1.00 20.14 O ATOM 5 CB VAL A 2 36.671 20.031 52.114 1.00 21.85 C ATOM 6 CG1 VAL A 2 36.775 20.302 50.623 1.00 22.24 C ATOM 7 CG2 VAL A 2 38.042 19.821 52.713 1.00 23.58 C ATOM 8 HA VAL A 2 36.229 21.110 53.900 1.00 0.00 H ATOM 9 HB VAL A 2 36.091 19.117 52.240 1.00 0.00 H ATOM 10 HG11 VAL A 2 35.774 20.378 50.198 1.00 0.00 H ATOM 11 HG12 VAL A 2 37.312 21.237 50.461 1.00 0.00 H ATOM 12 HG13 VAL A 2 37.314 19.485 50.143 1.00 0.00 H ATOM 13 HG21 VAL A 2 38.617 20.743 52.632 1.00 0.00 H ATOM 14 HG22 VAL A 2 37.940 19.545 53.763 1.00 0.00 H ATOM 15 HG23 VAL A 2 38.554 19.024 52.175 1.00 0.00 H ATOM 16 HN3 VAL A 2 34.132 21.035 51.789 1.00 0.00 H ATOM 17 HN2 VAL A 2 33.963 21.710 53.339 1.00 0.00 H ATOM 18 HN1 VAL A 2 34.189 20.035 53.162 1.00 0.00 H ATOM 19 N ASN A 3 37.205 23.230 52.926 1.00 18.46 N ATOM 20 CA ASN A 3 37.734 24.482 52.379 1.00 17.02 C ATOM 21 C ASN A 3 38.168 24.332 50.916 1.00 16.15 C ATOM 22 O ASN A 3 38.906 23.402 50.558 1.00 15.54 O ATOM 23 CB ASN A 3 38.928 24.974 53.202 1.00 16.97 C ATOM 24 CG ASN A 3 38.537 25.540 54.559 1.00 16.38 C ATOM 25 OD1 ASN A 3 39.378 25.663 55.449 1.00 19.22 O ATOM 26 ND2 ASN A 3 37.281 25.910 54.717 1.00 16.68 N ATOM 27 HA ASN A 3 36.924 25.210 52.429 1.00 0.00 H ATOM 28 HB2 ASN A 3 39.607 24.136 53.360 1.00 0.00 H ATOM 29 HB3 ASN A 3 39.439 25.753 52.637 1.00 0.00 H ATOM 30 HD22 ASN A 3 36.601 25.789 53.939 1.00 0.00 H ATOM 31 HD21 ASN A 3 36.970 26.323 55.619 1.00 0.00 H ATOM 32 H ASN A 3 37.577 22.871 53.829 1.00 0.00 H ATOM 33 N PRO A 4 37.727 25.239 50.054 1.00 15.24 N ATOM 34 CA PRO A 4 38.097 25.159 48.645 1.00 15.02 C ATOM 35 C PRO A 4 39.560 25.498 48.415 1.00 14.50 C ATOM 36 O PRO A 4 40.186 26.172 49.234 1.00 14.17 O ATOM 37 CB PRO A 4 37.182 26.196 47.990 1.00 15.42 C ATOM 38 CG PRO A 4 36.928 27.154 49.042 1.00 16.15 C ATOM 39 CD PRO A 4 36.816 26.366 50.310 1.00 15.55 C ATOM 40 HA PRO A 4 37.980 24.154 48.239 1.00 0.00 H ATOM 41 HD3 PRO A 4 37.142 26.951 51.170 1.00 0.00 H ATOM 42 HD2 PRO A 4 35.795 26.021 50.473 1.00 0.00 H ATOM 43 HG3 PRO A 4 36.000 27.691 48.848 1.00 0.00 H ATOM 44 HG2 PRO A 4 37.750 27.866 49.111 1.00 0.00 H ATOM 45 HB2 PRO A 4 37.678 26.672 47.144 1.00 0.00 H ATOM 46 HB3 PRO A 4 36.253 25.736 47.653 1.00 0.00 H ATOM 47 N THR A 5 40.083 24.986 47.311 1.00 14.30 N ATOM 48 CA THR A 5 41.425 25.247 46.856 1.00 14.50 C ATOM 49 C THR A 5 41.333 25.924 45.506 1.00 14.39 C ATOM 50 O THR A 5 40.620 25.464 44.617 1.00 14.39 O ATOM 51 CB THR A 5 42.186 23.929 46.687 1.00 15.15 C ATOM 52 OG1 THR A 5 42.167 23.198 47.918 1.00 16.13 O ATOM 53 CG2 THR A 5 43.657 24.183 46.398 1.00 15.82 C ATOM 54 HA THR A 5 41.947 25.873 47.580 1.00 0.00 H ATOM 55 HB THR A 5 41.708 23.388 45.871 1.00 0.00 H ATOM 56 HG1 THR A 5 41.230 23.006 48.172 1.00 0.00 H ATOM 57 HG23 THR A 5 43.752 24.741 45.466 1.00 0.00 H ATOM 58 HG21 THR A 5 44.092 24.760 47.214 1.00 0.00 H ATOM 59 HG22 THR A 5 44.178 23.230 46.307 1.00 0.00 H ATOM 60 H THR A 5 39.488 24.356 46.736 1.00 0.00 H ATOM 61 N VAL A 6 42.025 27.046 45.346 1.00 13.85 N ATOM 62 CA VAL A 6 42.049 27.711 44.054 1.00 14.27 C ATOM 63 C VAL A 6 43.493 27.879 43.617 1.00 13.78 C ATOM 64 O VAL A 6 44.406 27.825 44.435 1.00 14.08 O ATOM 65 CB VAL A 6 41.314 29.062 44.083 1.00 14.98 C ATOM 66 CG1 VAL A 6 39.878 28.856 44.507 1.00 15.09 C ATOM 67 CG2 VAL A 6 41.996 30.019 44.992 1.00 16.12 C ATOM 68 HA VAL A 6 41.517 27.092 43.332 1.00 0.00 H ATOM 69 HB VAL A 6 41.329 29.487 43.080 1.00 0.00 H ATOM 70 HG11 VAL A 6 39.383 28.191 43.799 1.00 0.00 H ATOM 71 HG12 VAL A 6 39.854 28.411 45.502 1.00 0.00 H ATOM 72 HG13 VAL A 6 39.364 29.817 44.525 1.00 0.00 H ATOM 73 HG21 VAL A 6 42.015 29.609 46.002 1.00 0.00 H ATOM 74 HG22 VAL A 6 43.017 30.183 44.646 1.00 0.00 H ATOM 75 HG23 VAL A 6 41.455 30.965 44.993 1.00 0.00 H ATOM 76 H VAL A 6 42.551 27.450 46.147 1.00 0.00 H ATOM 77 N PHE A 7 43.699 28.066 42.322 1.00 13.71 N ATOM 78 CA PHE A 7 45.053 28.238 41.810 1.00 13.61 C ATOM 79 C PHE A 7 45.145 29.437 40.881 1.00 13.29 C ATOM 80 O PHE A 7 44.152 29.834 40.260 1.00 13.35 O ATOM 81 CB PHE A 7 45.507 26.988 41.057 1.00 13.95 C ATOM 82 CG PHE A 7 44.869 26.835 39.717 1.00 15.06 C ATOM 83 CD1 PHE A 7 43.675 26.144 39.591 1.00 17.35 C ATOM 84 CD2 PHE A 7 45.438 27.401 38.588 1.00 17.36 C ATOM 85 CE1 PHE A 7 43.065 26.005 38.367 1.00 17.65 C ATOM 86 CE2 PHE A 7 44.819 27.275 37.357 1.00 18.19 C ATOM 87 CZ PHE A 7 43.632 26.567 37.251 1.00 17.54 C ATOM 88 HA PHE A 7 45.704 28.405 42.668 1.00 0.00 H ATOM 89 HB2 PHE A 7 46.587 27.040 40.921 1.00 0.00 H ATOM 90 HB3 PHE A 7 45.260 26.114 41.659 1.00 0.00 H ATOM 91 HD2 PHE A 7 46.377 27.948 38.670 1.00 0.00 H ATOM 92 HE2 PHE A 7 45.264 27.731 36.473 1.00 0.00 H ATOM 93 HZ PHE A 7 43.149 26.457 36.280 1.00 0.00 H ATOM 94 HE1 PHE A 7 42.131 25.449 38.283 1.00 0.00 H ATOM 95 HD1 PHE A 7 43.213 25.704 40.475 1.00 0.00 H ATOM 96 H PHE A 7 42.891 28.090 41.668 1.00 0.00 H ATOM 97 N PHE A 8 46.351 30.010 40.820 1.00 13.11 N ATOM 98 CA PHE A 8 46.714 31.058 39.883 1.00 13.58 C ATOM 99 C PHE A 8 47.910 30.533 39.094 1.00 14.49 C ATOM 100 O PHE A 8 48.847 30.000 39.681 1.00 14.64 O ATOM 101 CB PHE A 8 47.242 32.301 40.600 1.00 13.16 C ATOM 102 CG PHE A 8 46.200 33.164 41.258 1.00 13.46 C ATOM 103 CD1 PHE A 8 46.615 34.257 42.016 1.00 14.32 C ATOM 104 CD2 PHE A 8 44.846 32.923 41.134 1.00 13.75 C ATOM 105 CE1 PHE A 8 45.708 35.082 42.630 1.00 15.02 C ATOM 106 CE2 PHE A 8 43.930 33.756 41.758 1.00 14.04 C ATOM 107 CZ PHE A 8 44.363 34.840 42.492 1.00 14.77 C ATOM 108 HA PHE A 8 45.837 31.310 39.287 1.00 0.00 H ATOM 109 HB2 PHE A 8 47.941 31.973 41.369 1.00 0.00 H ATOM 110 HB3 PHE A 8 47.770 32.912 39.868 1.00 0.00 H ATOM 111 HD2 PHE A 8 44.496 32.076 40.544 1.00 0.00 H ATOM 112 HE2 PHE A 8 42.863 33.553 41.668 1.00 0.00 H ATOM 113 HZ PHE A 8 43.638 35.505 42.962 1.00 0.00 H ATOM 114 HE1 PHE A 8 46.053 35.927 43.226 1.00 0.00 H ATOM 115 HD1 PHE A 8 47.681 34.460 42.123 1.00 0.00 H ATOM 116 H PHE A 8 47.078 29.683 41.488 1.00 0.00 H ATOM 117 N ASP A 9 47.868 30.657 37.774 1.00 15.53 N ATOM 118 CA ASP A 9 49.048 30.366 36.961 1.00 16.21 C ATOM 119 C ASP A 9 49.624 31.739 36.651 1.00 16.22 C ATOM 120 O ASP A 9 48.969 32.557 36.019 1.00 16.62 O ATOM 121 CB ASP A 9 48.687 29.608 35.681 1.00 16.72 C ATOM 122 CG ASP A 9 48.429 28.134 35.931 1.00 18.60 C ATOM 123 OD1 ASP A 9 49.113 27.533 36.780 1.00 20.18 O ATOM 124 OD2 ASP A 9 47.558 27.483 35.316 1.00 22.85 O ATOM 125 HA ASP A 9 49.757 29.719 37.478 1.00 0.00 H ATOM 126 HB2 ASP A 9 47.789 30.053 35.253 1.00 0.00 H ATOM 127 HB3 ASP A 9 49.511 29.704 34.974 1.00 0.00 H ATOM 128 H ASP A 9 46.988 30.964 37.313 1.00 0.00 H ATOM 129 N ILE A 10 50.832 32.004 37.139 1.00 16.87 N ATOM 130 CA ILE A 10 51.454 33.312 36.993 1.00 17.84 C ATOM 131 C ILE A 10 52.365 33.371 35.770 1.00 18.31 C ATOM 132 O ILE A 10 53.097 32.419 35.485 1.00 18.50 O ATOM 133 CB ILE A 10 52.268 33.628 38.270 1.00 17.63 C ATOM 134 CG1 ILE A 10 51.362 33.573 39.507 1.00 18.65 C ATOM 135 CG2 ILE A 10 52.988 34.975 38.152 1.00 18.15 C ATOM 136 CD1 ILE A 10 50.315 34.628 39.540 1.00 19.32 C ATOM 137 HA ILE A 10 50.667 34.053 36.852 1.00 0.00 H ATOM 138 HB ILE A 10 53.039 32.866 38.385 1.00 0.00 H ATOM 139 HG12 ILE A 10 50.870 32.601 39.528 1.00 0.00 H ATOM 140 HG13 ILE A 10 51.986 33.682 40.394 1.00 0.00 H ATOM 141 HD11 ILE A 10 50.789 35.609 39.532 1.00 0.00 H ATOM 142 HD12 ILE A 10 49.672 34.527 38.666 1.00 0.00 H ATOM 143 HD13 ILE A 10 49.719 34.518 40.446 1.00 0.00 H ATOM 144 HG21 ILE A 10 53.671 34.947 37.303 1.00 0.00 H ATOM 145 HG22 ILE A 10 52.253 35.766 38.004 1.00 0.00 H ATOM 146 HG23 ILE A 10 53.550 35.166 39.066 1.00 0.00 H ATOM 147 H ILE A 10 51.349 31.254 37.641 1.00 0.00 H ATOM 148 N ALA A 11 52.306 34.490 35.054 1.00 19.34 N ATOM 149 CA ALA A 11 53.165 34.718 33.896 1.00 20.44 C ATOM 150 C ALA A 11 53.914 36.025 34.074 1.00 21.60 C ATOM 151 O ALA A 11 53.416 36.960 34.710 1.00 21.05 O ATOM 152 CB ALA A 11 52.348 34.758 32.615 1.00 20.49 C ATOM 153 HA ALA A 11 53.876 33.895 33.820 1.00 0.00 H ATOM 154 HB1 ALA A 11 51.830 33.808 32.486 1.00 0.00 H ATOM 155 HB2 ALA A 11 51.619 35.566 32.676 1.00 0.00 H ATOM 156 HB3 ALA A 11 53.012 34.929 31.767 1.00 0.00 H ATOM 157 H ALA A 11 51.625 35.227 35.328 1.00 0.00 H ATOM 158 N VAL A 12 55.125 36.073 33.524 1.00 22.87 N ATOM 159 CA VAL A 12 55.951 37.271 33.556 1.00 24.29 C ATOM 160 C VAL A 12 56.214 37.669 32.109 1.00 25.30 C ATOM 161 O VAL A 12 56.864 36.924 31.377 1.00 25.60 O ATOM 162 CB VAL A 12 57.286 37.012 34.261 1.00 24.36 C ATOM 163 CG1 VAL A 12 58.104 38.293 34.344 1.00 24.62 C ATOM 164 CG2 VAL A 12 57.051 36.438 35.653 1.00 24.73 C ATOM 165 HA VAL A 12 55.437 38.059 34.107 1.00 0.00 H ATOM 166 HB VAL A 12 57.848 36.283 33.677 1.00 0.00 H ATOM 167 HG11 VAL A 12 58.301 38.663 33.338 1.00 0.00 H ATOM 168 HG12 VAL A 12 57.547 39.043 34.905 1.00 0.00 H ATOM 169 HG13 VAL A 12 59.048 38.088 34.848 1.00 0.00 H ATOM 170 HG21 VAL A 12 56.469 37.146 36.243 1.00 0.00 H ATOM 171 HG22 VAL A 12 56.505 35.498 35.570 1.00 0.00 H ATOM 172 HG23 VAL A 12 58.011 36.261 36.138 1.00 0.00 H ATOM 173 H VAL A 12 55.495 35.222 33.054 1.00 0.00 H ATOM 174 N ASP A 13 55.700 38.821 31.693 1.00 26.52 N ATOM 175 CA ASP A 13 55.835 39.266 30.306 1.00 27.62 C ATOM 176 C ASP A 13 55.413 38.151 29.351 1.00 28.18 C ATOM 177 O ASP A 13 56.067 37.915 28.331 1.00 28.31 O ATOM 178 CB ASP A 13 57.272 39.697 29.998 1.00 27.99 C ATOM 179 CG ASP A 13 57.589 41.098 30.499 1.00 29.19 C ATOM 180 OD1 ASP A 13 56.670 41.804 30.973 1.00 30.53 O ATOM 181 OD2 ASP A 13 58.737 41.583 30.455 1.00 31.72 O ATOM 182 HA ASP A 13 55.183 40.128 30.166 1.00 0.00 H ATOM 183 HB2 ASP A 13 57.956 38.994 30.473 1.00 0.00 H ATOM 184 HB3 ASP A 13 57.419 39.672 28.918 1.00 0.00 H ATOM 185 H ASP A 13 55.189 39.422 32.371 1.00 0.00 H ATOM 186 N GLY A 14 54.333 37.453 29.696 1.00 28.58 N ATOM 187 CA GLY A 14 53.814 36.384 28.860 1.00 28.89 C ATOM 188 C GLY A 14 54.434 35.014 29.064 1.00 29.10 C ATOM 189 O GLY A 14 53.889 34.031 28.570 1.00 29.84 O ATOM 190 HA3 GLY A 14 53.971 36.669 27.820 1.00 0.00 H ATOM 191 HA2 GLY A 14 52.745 36.298 29.055 1.00 0.00 H ATOM 192 H GLY A 14 53.848 37.679 30.588 1.00 0.00 H ATOM 193 N GLU A 15 55.558 34.941 29.775 1.00 29.22 N ATOM 194 CA GLU A 15 56.242 33.669 30.020 1.00 29.31 C ATOM 195 C GLU A 15 55.723 33.032 31.299 1.00 28.54 C ATOM 196 O GLU A 15 55.623 33.710 32.315 1.00 28.52 O ATOM 197 CB GLU A 15 57.747 33.882 30.190 1.00 29.77 C ATOM 198 CG GLU A 15 58.364 34.923 29.275 1.00 32.09 C ATOM 199 CD GLU A 15 58.452 34.465 27.841 1.00 34.77 C ATOM 200 OE1 GLU A 15 59.581 34.219 27.366 1.00 36.94 O ATOM 201 OE2 GLU A 15 57.392 34.353 27.195 1.00 37.50 O ATOM 202 HA GLU A 15 56.050 33.025 29.161 1.00 0.00 H ATOM 203 HB2 GLU A 15 57.929 34.189 31.220 1.00 0.00 H ATOM 204 HB3 GLU A 15 58.245 32.931 30.002 1.00 0.00 H ATOM 205 HG2 GLU A 15 57.755 35.826 29.315 1.00 0.00 H ATOM 206 HG3 GLU A 15 59.369 35.148 29.631 1.00 0.00 H ATOM 207 H GLU A 15 55.963 35.814 30.169 1.00 0.00 H ATOM 208 N PRO A 16 55.411 31.738 31.272 1.00 27.61 N ATOM 209 CA PRO A 16 54.964 31.050 32.481 1.00 26.82 C ATOM 210 C PRO A 16 56.036 31.032 33.557 1.00 26.04 C ATOM 211 O PRO A 16 57.190 30.685 33.294 1.00 26.09 O ATOM 212 CB PRO A 16 54.684 29.624 31.997 1.00 27.03 C ATOM 213 CG PRO A 16 54.489 29.753 30.550 1.00 27.65 C ATOM 214 CD PRO A 16 55.428 30.830 30.111 1.00 27.82 C ATOM 215 HA PRO A 16 54.102 31.541 32.933 1.00 0.00 H ATOM 216 HD3 PRO A 16 56.428 30.436 29.930 1.00 0.00 H ATOM 217 HD2 PRO A 16 55.067 31.329 29.211 1.00 0.00 H ATOM 218 HG3 PRO A 16 53.459 30.032 30.328 1.00 0.00 H ATOM 219 HG2 PRO A 16 54.725 28.814 30.049 1.00 0.00 H ATOM 220 HB2 PRO A 16 55.529 28.971 32.214 1.00 0.00 H ATOM 221 HB3 PRO A 16 53.787 29.226 32.472 1.00 0.00 H ATOM 222 N LEU A 17 55.643 31.428 34.763 1.00 24.65 N ATOM 223 CA LEU A 17 56.526 31.420 35.911 1.00 23.93 C ATOM 224 C LEU A 17 56.225 30.171 36.727 1.00 22.77 C ATOM 225 O LEU A 17 57.111 29.396 37.057 1.00 23.28 O ATOM 226 CB LEU A 17 56.313 32.675 36.756 1.00 24.00 C ATOM 227 CG LEU A 17 57.124 32.775 38.047 1.00 24.80 C ATOM 228 CD1 LEU A 17 58.614 32.689 37.758 1.00 26.44 C ATOM 229 CD2 LEU A 17 56.791 34.068 38.788 1.00 25.45 C ATOM 230 HA LEU A 17 57.566 31.413 35.585 1.00 0.00 H ATOM 231 HB2 LEU A 17 56.566 33.537 36.138 1.00 0.00 H ATOM 232 HB3 LEU A 17 55.257 32.719 37.024 1.00 0.00 H ATOM 233 HG LEU A 17 56.855 31.933 38.685 1.00 0.00 H ATOM 234 HD21 LEU A 17 57.029 34.921 38.152 1.00 0.00 H ATOM 235 HD22 LEU A 17 55.729 34.081 39.034 1.00 0.00 H ATOM 236 HD23 LEU A 17 57.378 34.121 39.705 1.00 0.00 H ATOM 237 HD11 LEU A 17 58.835 31.736 37.277 1.00 0.00 H ATOM 238 HD12 LEU A 17 58.902 33.507 37.097 1.00 0.00 H ATOM 239 HD13 LEU A 17 59.169 32.763 38.693 1.00 0.00 H ATOM 240 H LEU A 17 54.664 31.756 34.887 1.00 0.00 H ATOM 241 N GLY A 18 54.955 29.967 37.047 1.00 21.53 N ATOM 242 CA GLY A 18 54.581 28.801 37.815 1.00 20.41 C ATOM 243 C GLY A 18 53.190 28.951 38.391 1.00 19.26 C ATOM 244 O GLY A 18 52.514 29.940 38.124 1.00 18.95 O ATOM 245 HA3 GLY A 18 55.292 28.669 38.631 1.00 0.00 H ATOM 246 HA2 GLY A 18 54.606 27.925 37.167 1.00 0.00 H ATOM 247 H GLY A 18 54.227 30.646 36.745 1.00 0.00 H ATOM 248 N ARG A 19 52.812 27.981 39.213 1.00 18.00 N ATOM 249 CA ARG A 19 51.483 27.933 39.809 1.00 17.49 C ATOM 250 C ARG A 19 51.519 28.137 41.319 1.00 16.89 C ATOM 251 O ARG A 19 52.364 27.581 42.014 1.00 16.98 O ATOM 252 CB ARG A 19 50.856 26.576 39.515 1.00 17.57 C ATOM 253 CG ARG A 19 49.502 26.375 40.206 1.00 17.87 C ATOM 254 CD ARG A 19 48.715 25.169 39.723 1.00 18.91 C ATOM 255 NE ARG A 19 48.279 25.319 38.341 1.00 19.65 N ATOM 256 CZ ARG A 19 47.405 24.516 37.751 1.00 22.16 C ATOM 257 NH1 ARG A 19 46.884 23.498 38.418 1.00 23.26 N ATOM 258 NH2 ARG A 19 47.053 24.728 36.491 1.00 23.60 N ATOM 259 HA ARG A 19 50.897 28.743 39.374 1.00 0.00 H ATOM 260 HB2 ARG A 19 50.713 26.486 38.438 1.00 0.00 H ATOM 261 HB3 ARG A 19 51.538 25.797 39.856 1.00 0.00 H ATOM 262 HG2 ARG A 19 49.680 26.258 41.275 1.00 0.00 H ATOM 263 HG3 ARG A 19 48.898 27.266 40.035 1.00 0.00 H ATOM 264 HD2 ARG A 19 47.838 25.044 40.357 1.00 0.00 H ATOM 265 HD3 ARG A 19 49.346 24.283 39.799 1.00 0.00 H ATOM 266 HE ARG A 19 48.677 26.102 37.785 1.00 0.00 H ATOM 267 HH12 ARG A 19 46.198 22.869 37.954 1.00 0.00 H ATOM 268 HH11 ARG A 19 47.160 23.328 39.406 1.00 0.00 H ATOM 269 HH22 ARG A 19 46.367 24.097 36.029 1.00 0.00 H ATOM 270 HH21 ARG A 19 47.463 25.525 35.964 1.00 0.00 H ATOM 271 H ARG A 19 53.490 27.226 39.441 1.00 0.00 H ATOM 272 N VAL A 20 50.588 28.939 41.822 1.00 15.80 N ATOM 273 CA VAL A 20 50.427 29.137 43.250 1.00 15.89 C ATOM 274 C VAL A 20 49.027 28.663 43.613 1.00 15.59 C ATOM 275 O VAL A 20 48.082 29.026 42.930 1.00 16.37 O ATOM 276 CB VAL A 20 50.547 30.613 43.612 1.00 15.89 C ATOM 277 CG1 VAL A 20 50.411 30.806 45.123 1.00 15.74 C ATOM 278 CG2 VAL A 20 51.855 31.165 43.096 1.00 17.05 C ATOM 279 HA VAL A 20 51.199 28.587 43.788 1.00 0.00 H ATOM 280 HB VAL A 20 49.737 31.166 43.137 1.00 0.00 H ATOM 281 HG11 VAL A 20 49.438 30.439 45.449 1.00 0.00 H ATOM 282 HG12 VAL A 20 51.199 30.251 45.631 1.00 0.00 H ATOM 283 HG13 VAL A 20 50.499 31.866 45.362 1.00 0.00 H ATOM 284 HG21 VAL A 20 52.682 30.616 43.546 1.00 0.00 H ATOM 285 HG22 VAL A 20 51.891 31.056 42.012 1.00 0.00 H ATOM 286 HG23 VAL A 20 51.932 32.220 43.359 1.00 0.00 H ATOM 287 H VAL A 20 49.953 29.442 41.170 1.00 0.00 H ATOM 288 N SER A 21 48.905 27.840 44.653 1.00 15.15 N ATOM 289 CA SER A 21 47.600 27.362 45.117 1.00 15.61 C ATOM 290 C SER A 21 47.285 27.933 46.486 1.00 14.40 C ATOM 291 O SER A 21 48.187 28.176 47.300 1.00 14.51 O ATOM 292 CB SER A 21 47.575 25.840 45.186 1.00 15.98 C ATOM 293 OG SER A 21 47.745 25.304 43.893 1.00 21.49 O ATOM 294 HA SER A 21 46.847 27.697 44.404 1.00 0.00 H ATOM 295 HB2 SER A 21 46.619 25.511 45.592 1.00 0.00 H ATOM 296 HB3 SER A 21 48.382 25.493 45.832 1.00 0.00 H ATOM 297 HG SER A 21 47.728 24.315 43.942 1.00 0.00 H ATOM 298 H SER A 21 49.763 27.527 45.151 1.00 0.00 H ATOM 299 N PHE A 22 46.000 28.147 46.745 1.00 13.07 N ATOM 300 CA PHE A 22 45.566 28.713 48.008 1.00 12.64 C ATOM 301 C PHE A 22 44.482 27.866 48.652 1.00 12.14 C ATOM 302 O PHE A 22 43.625 27.325 47.962 1.00 12.88 O ATOM 303 CB PHE A 22 44.954 30.101 47.800 1.00 12.50 C ATOM 304 CG PHE A 22 45.808 31.054 47.014 1.00 12.75 C ATOM 305 CD1 PHE A 22 45.619 31.209 45.660 1.00 12.87 C ATOM 306 CD2 PHE A 22 46.754 31.838 47.645 1.00 12.39 C ATOM 307 CE1 PHE A 22 46.390 32.102 44.933 1.00 13.78 C ATOM 308 CE2 PHE A 22 47.526 32.729 46.934 1.00 13.25 C ATOM 309 CZ PHE A 22 47.336 32.868 45.566 1.00 14.31 C ATOM 310 HA PHE A 22 46.452 28.758 48.642 1.00 0.00 H ATOM 311 HB2 PHE A 22 44.008 29.979 47.273 1.00 0.00 H ATOM 312 HB3 PHE A 22 44.769 30.541 48.780 1.00 0.00 H ATOM 313 HD2 PHE A 22 46.891 31.750 48.723 1.00 0.00 H ATOM 314 HE2 PHE A 22 48.284 33.324 47.444 1.00 0.00 H ATOM 315 HZ PHE A 22 47.934 33.581 44.999 1.00 0.00 H ATOM 316 HE1 PHE A 22 46.245 32.196 43.857 1.00 0.00 H ATOM 317 HD1 PHE A 22 44.853 30.622 45.153 1.00 0.00 H ATOM 318 H PHE A 22 45.289 27.903 46.026 1.00 0.00 H ATOM 319 N GLU A 23 44.525 27.750 49.971 1.00 11.34 N ATOM 320 CA GLU A 23 43.402 27.206 50.721 1.00 11.65 C ATOM 321 C GLU A 23 42.607 28.425 51.176 1.00 11.64 C ATOM 322 O GLU A 23 43.190 29.373 51.707 1.00 11.73 O ATOM 323 CB GLU A 23 43.850 26.393 51.938 1.00 12.06 C ATOM 324 CG GLU A 23 42.689 26.019 52.845 1.00 14.72 C ATOM 325 CD GLU A 23 43.076 25.141 54.020 1.00 18.25 C ATOM 326 OE1 GLU A 23 42.182 24.826 54.832 1.00 20.34 O ATOM 327 OE2 GLU A 23 44.260 24.766 54.139 1.00 20.08 O ATOM 328 HA GLU A 23 42.822 26.520 50.103 1.00 0.00 H ATOM 329 HB2 GLU A 23 44.332 25.479 51.591 1.00 0.00 H ATOM 330 HB3 GLU A 23 44.565 26.984 52.510 1.00 0.00 H ATOM 331 HG2 GLU A 23 42.249 26.937 53.234 1.00 0.00 H ATOM 332 HG3 GLU A 23 41.947 25.486 52.250 1.00 0.00 H ATOM 333 H GLU A 23 45.379 28.054 50.481 1.00 0.00 H ATOM 334 N LEU A 24 41.300 28.433 50.936 1.00 11.14 N ATOM 335 CA LEU A 24 40.447 29.537 51.377 1.00 11.06 C ATOM 336 C LEU A 24 39.697 29.106 52.627 1.00 11.65 C ATOM 337 O LEU A 24 39.080 28.035 52.649 1.00 11.51 O ATOM 338 CB LEU A 24 39.460 29.933 50.281 1.00 11.17 C ATOM 339 CG LEU A 24 40.072 30.221 48.915 1.00 11.25 C ATOM 340 CD1 LEU A 24 38.966 30.586 47.943 1.00 12.21 C ATOM 341 CD2 LEU A 24 41.130 31.313 48.987 1.00 12.78 C ATOM 342 HA LEU A 24 41.068 30.406 51.596 1.00 0.00 H ATOM 343 HB2 LEU A 24 38.745 29.119 50.163 1.00 0.00 H ATOM 344 HB3 LEU A 24 38.936 30.830 50.610 1.00 0.00 H ATOM 345 HG LEU A 24 40.580 29.324 48.562 1.00 0.00 H ATOM 346 HD21 LEU A 24 40.677 32.232 49.360 1.00 0.00 H ATOM 347 HD22 LEU A 24 41.928 31.000 49.661 1.00 0.00 H ATOM 348 HD23 LEU A 24 41.540 31.486 47.992 1.00 0.00 H ATOM 349 HD11 LEU A 24 38.265 29.755 47.864 1.00 0.00 H ATOM 350 HD12 LEU A 24 38.443 31.471 48.305 1.00 0.00 H ATOM 351 HD13 LEU A 24 39.398 30.793 46.964 1.00 0.00 H ATOM 352 H LEU A 24 40.873 27.636 50.423 1.00 0.00 H ATOM 353 N PHE A 25 39.733 29.938 53.659 1.00 11.92 N ATOM 354 CA PHE A 25 39.154 29.558 54.947 1.00 13.30 C ATOM 355 C PHE A 25 37.659 29.800 54.997 1.00 13.86 C ATOM 356 O PHE A 25 37.179 30.656 55.743 1.00 13.99 O ATOM 357 CB PHE A 25 39.863 30.279 56.087 1.00 13.69 C ATOM 358 CG PHE A 25 41.352 30.071 56.100 1.00 15.52 C ATOM 359 CD1 PHE A 25 42.219 31.125 56.325 1.00 16.21 C ATOM 360 CD2 PHE A 25 41.880 28.827 55.877 1.00 17.39 C ATOM 361 CE1 PHE A 25 43.590 30.916 56.336 1.00 17.42 C ATOM 362 CE2 PHE A 25 43.243 28.613 55.888 1.00 18.21 C ATOM 363 CZ PHE A 25 44.098 29.662 56.116 1.00 17.89 C ATOM 364 HA PHE A 25 39.305 28.485 55.067 1.00 0.00 H ATOM 365 HB2 PHE A 25 39.665 31.347 55.995 1.00 0.00 H ATOM 366 HB3 PHE A 25 39.456 29.915 57.031 1.00 0.00 H ATOM 367 HD2 PHE A 25 41.210 27.989 55.687 1.00 0.00 H ATOM 368 HE2 PHE A 25 43.640 27.613 55.716 1.00 0.00 H ATOM 369 HZ PHE A 25 45.176 29.499 56.122 1.00 0.00 H ATOM 370 HE1 PHE A 25 44.266 31.751 56.520 1.00 0.00 H ATOM 371 HD1 PHE A 25 41.822 32.126 56.495 1.00 0.00 H ATOM 372 H PHE A 25 40.178 30.872 53.551 1.00 0.00 H ATOM 373 N ALA A 26 36.926 29.039 54.193 1.00 14.16 N ATOM 374 CA ALA A 26 35.479 29.146 54.129 1.00 15.00 C ATOM 375 C ALA A 26 34.839 28.791 55.471 1.00 15.79 C ATOM 376 O ALA A 26 33.710 29.199 55.746 1.00 16.91 O ATOM 377 CB ALA A 26 34.938 28.247 53.022 1.00 15.07 C ATOM 378 HA ALA A 26 35.221 30.181 53.902 1.00 0.00 H ATOM 379 HB1 ALA A 26 35.364 28.553 52.066 1.00 0.00 H ATOM 380 HB2 ALA A 26 35.213 27.213 53.229 1.00 0.00 H ATOM 381 HB3 ALA A 26 33.852 28.335 52.983 1.00 0.00 H ATOM 382 H ALA A 26 37.405 28.342 53.588 1.00 0.00 H ATOM 383 N ASP A 27 35.563 28.054 56.310 1.00 16.85 N ATOM 384 CA ASP A 27 35.048 27.695 57.626 1.00 17.48 C ATOM 385 C ASP A 27 35.041 28.850 58.632 1.00 17.69 C ATOM 386 O ASP A 27 34.266 28.819 59.587 1.00 18.82 O ATOM 387 CB ASP A 27 35.793 26.481 58.197 1.00 18.22 C ATOM 388 CG ASP A 27 37.279 26.710 58.353 1.00 19.82 C ATOM 389 OD1 ASP A 27 37.925 25.902 59.059 1.00 25.39 O ATOM 390 OD2 ASP A 27 37.903 27.635 57.810 1.00 20.94 O ATOM 391 HA ASP A 27 34.002 27.433 57.468 1.00 0.00 H ATOM 392 HB2 ASP A 27 35.374 26.247 59.176 1.00 0.00 H ATOM 393 HB3 ASP A 27 35.642 25.635 57.526 1.00 0.00 H ATOM 394 H ASP A 27 36.509 27.730 56.023 1.00 0.00 H ATOM 395 N LYS A 28 35.863 29.875 58.406 1.00 16.89 N ATOM 396 CA LYS A 28 35.950 31.011 59.327 1.00 16.69 C ATOM 397 C LYS A 28 35.444 32.320 58.727 1.00 15.17 C ATOM 398 O LYS A 28 34.906 33.168 59.441 1.00 14.15 O ATOM 399 CB LYS A 28 37.393 31.189 59.811 1.00 17.38 C ATOM 400 CG LYS A 28 37.840 30.126 60.823 1.00 20.39 C ATOM 401 CD LYS A 28 37.030 30.202 62.106 1.00 24.10 C ATOM 402 CE LYS A 28 37.531 29.229 63.169 1.00 26.77 C ATOM 403 NZ LYS A 28 38.887 29.600 63.685 1.00 28.69 N ATOM 404 HA LYS A 28 35.295 30.775 60.166 1.00 0.00 H ATOM 405 HB2 LYS A 28 38.055 31.141 58.946 1.00 0.00 H ATOM 406 HB3 LYS A 28 37.481 32.169 60.280 1.00 0.00 H ATOM 407 HG2 LYS A 28 37.710 29.138 60.380 1.00 0.00 H ATOM 408 HG3 LYS A 28 38.893 30.282 61.059 1.00 0.00 H ATOM 409 HD2 LYS A 28 37.094 31.216 62.501 1.00 0.00 H ATOM 410 HD3 LYS A 28 35.990 29.967 61.878 1.00 0.00 H ATOM 411 HE2 LYS A 28 37.582 28.231 62.735 1.00 0.00 H ATOM 412 HE3 LYS A 28 36.827 29.226 64.002 1.00 0.00 H ATOM 413 HZ1 LYS A 28 39.568 29.598 62.899 1.00 0.00 H ATOM 414 HZ2 LYS A 28 38.848 30.549 64.109 1.00 0.00 H ATOM 415 HZ3 LYS A 28 39.184 28.910 64.404 1.00 0.00 H ATOM 416 H LYS A 28 36.458 29.868 57.553 1.00 0.00 H ATOM 417 N VAL A 29 35.627 32.484 57.419 1.00 13.56 N ATOM 418 CA VAL A 29 35.196 33.694 56.710 1.00 13.41 C ATOM 419 C VAL A 29 34.523 33.300 55.395 1.00 12.18 C ATOM 420 O VAL A 29 35.019 33.562 54.297 1.00 11.85 O ATOM 421 CB VAL A 29 36.362 34.679 56.440 1.00 13.61 C ATOM 422 CG1 VAL A 29 36.573 35.590 57.636 1.00 14.79 C ATOM 423 CG2 VAL A 29 37.644 33.950 56.099 1.00 15.06 C ATOM 424 HA VAL A 29 34.488 34.216 57.354 1.00 0.00 H ATOM 425 HB VAL A 29 36.088 35.285 55.576 1.00 0.00 H ATOM 426 HG11 VAL A 29 35.662 36.159 57.823 1.00 0.00 H ATOM 427 HG12 VAL A 29 36.812 34.988 58.512 1.00 0.00 H ATOM 428 HG13 VAL A 29 37.395 36.275 57.429 1.00 0.00 H ATOM 429 HG21 VAL A 29 37.926 33.304 56.931 1.00 0.00 H ATOM 430 HG22 VAL A 29 37.490 33.346 55.205 1.00 0.00 H ATOM 431 HG23 VAL A 29 38.436 34.676 55.917 1.00 0.00 H ATOM 432 H VAL A 29 36.093 31.727 56.880 1.00 0.00 H ATOM 433 N PRO A 30 33.376 32.653 55.508 1.00 11.43 N ATOM 434 CA PRO A 30 32.693 32.134 54.329 1.00 11.33 C ATOM 435 C PRO A 30 32.336 33.177 53.271 1.00 10.93 C ATOM 436 O PRO A 30 32.494 32.880 52.096 1.00 11.59 O ATOM 437 CB PRO A 30 31.432 31.487 54.925 1.00 11.68 C ATOM 438 CG PRO A 30 31.251 32.144 56.219 1.00 12.01 C ATOM 439 CD PRO A 30 32.628 32.364 56.743 1.00 11.51 C ATOM 440 HA PRO A 30 33.338 31.453 53.774 1.00 0.00 H ATOM 441 HD3 PRO A 30 32.661 33.207 57.434 1.00 0.00 H ATOM 442 HD2 PRO A 30 33.011 31.473 57.240 1.00 0.00 H ATOM 443 HG3 PRO A 30 30.682 31.506 56.895 1.00 0.00 H ATOM 444 HG2 PRO A 30 30.732 33.095 56.096 1.00 0.00 H ATOM 445 HB2 PRO A 30 30.570 31.661 54.281 1.00 0.00 H ATOM 446 HB3 PRO A 30 31.575 30.414 55.055 1.00 0.00 H ATOM 447 N LYS A 31 31.869 34.363 53.651 1.00 10.67 N ATOM 448 CA LYS A 31 31.481 35.365 52.657 1.00 10.56 C ATOM 449 C LYS A 31 32.686 35.856 51.849 1.00 10.53 C ATOM 450 O LYS A 31 32.624 36.006 50.638 1.00 10.54 O ATOM 451 CB LYS A 31 30.776 36.550 53.334 1.00 11.05 C ATOM 452 CG LYS A 31 30.072 37.458 52.362 1.00 11.28 C ATOM 453 CD LYS A 31 29.210 38.493 53.071 1.00 13.17 C ATOM 454 CE LYS A 31 28.650 39.477 52.078 1.00 14.14 C ATOM 455 NZ LYS A 31 27.738 40.468 52.713 1.00 14.36 N ATOM 456 HA LYS A 31 30.788 34.888 51.964 1.00 0.00 H ATOM 457 HB2 LYS A 31 30.041 36.159 54.038 1.00 0.00 H ATOM 458 HB3 LYS A 31 31.521 37.133 53.875 1.00 0.00 H ATOM 459 HG2 LYS A 31 30.818 37.975 51.759 1.00 0.00 H ATOM 460 HG3 LYS A 31 29.437 36.855 51.713 1.00 0.00 H ATOM 461 HD2 LYS A 31 28.389 37.989 53.580 1.00 0.00 H ATOM 462 HD3 LYS A 31 29.817 39.026 53.803 1.00 0.00 H ATOM 463 HE2 LYS A 31 28.096 38.929 51.316 1.00 0.00 H ATOM 464 HE3 LYS A 31 29.477 40.011 51.610 1.00 0.00 H ATOM 465 HZ1 LYS A 31 26.940 39.969 53.156 1.00 0.00 H ATOM 466 HZ2 LYS A 31 28.259 41.003 53.437 1.00 0.00 H ATOM 467 HZ3 LYS A 31 27.380 41.122 51.988 1.00 0.00 H ATOM 468 H LYS A 31 31.779 34.580 54.664 1.00 0.00 H ATOM 469 N THR A 32 33.789 36.101 52.546 1.00 10.23 N ATOM 470 CA THR A 32 35.006 36.603 51.922 1.00 9.67 C ATOM 471 C THR A 32 35.677 35.538 51.066 1.00 9.63 C ATOM 472 O THR A 32 36.161 35.814 49.966 1.00 8.99 O ATOM 473 CB THR A 32 35.949 37.105 53.025 1.00 9.88 C ATOM 474 OG1 THR A 32 35.253 38.071 53.833 1.00 10.21 O ATOM 475 CG2 THR A 32 37.107 37.847 52.442 1.00 9.59 C ATOM 476 HA THR A 32 34.754 37.425 51.252 1.00 0.00 H ATOM 477 HB THR A 32 36.283 36.235 53.591 1.00 0.00 H ATOM 478 HG1 THR A 32 34.457 37.646 54.241 1.00 0.00 H ATOM 479 HG23 THR A 32 37.688 37.174 51.811 1.00 0.00 H ATOM 480 HG21 THR A 32 36.739 38.681 51.844 1.00 0.00 H ATOM 481 HG22 THR A 32 37.737 38.226 53.247 1.00 0.00 H ATOM 482 H THR A 32 33.784 35.929 53.572 1.00 0.00 H ATOM 483 N ALA A 33 35.698 34.313 51.571 1.00 9.22 N ATOM 484 CA ALA A 33 36.274 33.207 50.827 1.00 9.77 C ATOM 485 C ALA A 33 35.471 32.975 49.543 1.00 9.63 C ATOM 486 O ALA A 33 36.039 32.749 48.471 1.00 9.49 O ATOM 487 CB ALA A 33 36.293 31.950 51.668 1.00 10.34 C ATOM 488 HA ALA A 33 37.302 33.457 50.566 1.00 0.00 H ATOM 489 HB1 ALA A 33 36.890 32.122 52.563 1.00 0.00 H ATOM 490 HB2 ALA A 33 35.274 31.690 51.954 1.00 0.00 H ATOM 491 HB3 ALA A 33 36.729 31.135 51.091 1.00 0.00 H ATOM 492 H ALA A 33 35.296 34.141 52.515 1.00 0.00 H ATOM 493 N GLU A 34 34.147 33.028 49.641 1.00 10.26 N ATOM 494 CA GLU A 34 33.315 32.768 48.460 1.00 10.62 C ATOM 495 C GLU A 34 33.552 33.799 47.360 1.00 10.25 C ATOM 496 O GLU A 34 33.591 33.456 46.180 1.00 10.13 O ATOM 497 CB GLU A 34 31.836 32.696 48.842 1.00 11.06 C ATOM 498 CG GLU A 34 30.881 32.608 47.656 1.00 12.68 C ATOM 499 CD GLU A 34 31.037 31.351 46.814 1.00 14.40 C ATOM 500 OE1 GLU A 34 31.742 30.399 47.225 1.00 15.04 O ATOM 501 OE2 GLU A 34 30.443 31.318 45.710 1.00 16.03 O ATOM 502 HA GLU A 34 33.610 31.798 48.059 1.00 0.00 H ATOM 503 HB2 GLU A 34 31.687 31.814 49.465 1.00 0.00 H ATOM 504 HB3 GLU A 34 31.588 33.590 49.414 1.00 0.00 H ATOM 505 HG2 GLU A 34 29.860 32.639 48.037 1.00 0.00 H ATOM 506 HG3 GLU A 34 31.054 33.472 47.014 1.00 0.00 H ATOM 507 H GLU A 34 33.701 33.253 50.553 1.00 0.00 H ATOM 508 N ASN A 35 33.703 35.066 47.744 1.00 9.29 N ATOM 509 CA ASN A 35 34.006 36.121 46.790 1.00 9.32 C ATOM 510 C ASN A 35 35.283 35.792 46.006 1.00 8.97 C ATOM 511 O ASN A 35 35.298 35.803 44.777 1.00 8.81 O ATOM 512 CB ASN A 35 34.124 37.464 47.528 1.00 9.59 C ATOM 513 CG ASN A 35 34.451 38.630 46.605 1.00 11.10 C ATOM 514 OD1 ASN A 35 33.680 38.969 45.711 1.00 11.14 O ATOM 515 ND2 ASN A 35 35.596 39.260 46.835 1.00 10.44 N ATOM 516 HA ASN A 35 33.195 36.198 46.066 1.00 0.00 H ATOM 517 HB2 ASN A 35 33.176 37.671 48.025 1.00 0.00 H ATOM 518 HB3 ASN A 35 34.914 37.381 48.275 1.00 0.00 H ATOM 519 HD22 ASN A 35 36.220 38.940 47.603 1.00 0.00 H ATOM 520 HD21 ASN A 35 35.869 40.074 46.247 1.00 0.00 H ATOM 521 H ASN A 35 33.602 35.306 48.751 1.00 0.00 H ATOM 522 N PHE A 36 36.354 35.451 46.711 1.00 8.24 N ATOM 523 CA PHE A 36 37.614 35.144 46.044 1.00 8.19 C ATOM 524 C PHE A 36 37.497 33.893 45.168 1.00 7.91 C ATOM 525 O PHE A 36 38.044 33.854 44.073 1.00 8.28 O ATOM 526 CB PHE A 36 38.720 34.975 47.094 1.00 8.14 C ATOM 527 CG PHE A 36 40.110 34.927 46.533 1.00 8.56 C ATOM 528 CD1 PHE A 36 40.711 33.714 46.234 1.00 10.30 C ATOM 529 CD2 PHE A 36 40.831 36.088 46.340 1.00 10.46 C ATOM 530 CE1 PHE A 36 42.003 33.668 45.741 1.00 10.27 C ATOM 531 CE2 PHE A 36 42.121 36.044 45.845 1.00 10.35 C ATOM 532 CZ PHE A 36 42.706 34.844 45.555 1.00 10.39 C ATOM 533 HA PHE A 36 37.868 35.974 45.384 1.00 0.00 H ATOM 534 HB2 PHE A 36 38.662 35.814 47.788 1.00 0.00 H ATOM 535 HB3 PHE A 36 38.538 34.045 47.633 1.00 0.00 H ATOM 536 HD2 PHE A 36 40.378 37.050 46.580 1.00 0.00 H ATOM 537 HE2 PHE A 36 42.673 36.970 45.686 1.00 0.00 H ATOM 538 HZ PHE A 36 43.728 34.814 45.177 1.00 0.00 H ATOM 539 HE1 PHE A 36 42.464 32.710 45.501 1.00 0.00 H ATOM 540 HD1 PHE A 36 40.160 32.787 46.389 1.00 0.00 H ATOM 541 H PHE A 36 36.294 35.402 47.748 1.00 0.00 H ATOM 542 N ARG A 37 36.781 32.887 45.648 1.00 8.33 N ATOM 543 CA ARG A 37 36.614 31.637 44.895 1.00 9.00 C ATOM 544 C ARG A 37 35.907 31.902 43.572 1.00 9.08 C ATOM 545 O ARG A 37 36.369 31.497 42.515 1.00 9.29 O ATOM 546 CB ARG A 37 35.811 30.614 45.706 1.00 9.42 C ATOM 547 CG ARG A 37 35.752 29.208 45.101 1.00 11.28 C ATOM 548 CD ARG A 37 34.544 28.371 45.531 1.00 12.23 C ATOM 549 NE ARG A 37 33.317 29.069 45.188 1.00 12.39 N ATOM 550 CZ ARG A 37 32.797 29.107 43.970 1.00 13.63 C ATOM 551 NH1 ARG A 37 33.348 28.432 42.974 1.00 13.72 N ATOM 552 NH2 ARG A 37 31.701 29.816 43.750 1.00 13.78 N ATOM 553 HA ARG A 37 37.606 31.231 44.698 1.00 0.00 H ATOM 554 HB2 ARG A 37 36.262 30.538 46.695 1.00 0.00 H ATOM 555 HB3 ARG A 37 34.790 30.984 45.801 1.00 0.00 H ATOM 556 HG2 ARG A 37 35.727 29.307 44.016 1.00 0.00 H ATOM 557 HG3 ARG A 37 36.656 28.674 45.395 1.00 0.00 H ATOM 558 HD2 ARG A 37 34.580 28.209 46.608 1.00 0.00 H ATOM 559 HD3 ARG A 37 34.569 27.409 45.019 1.00 0.00 H ATOM 560 HE ARG A 37 32.814 29.571 45.947 1.00 0.00 H ATOM 561 HH12 ARG A 37 32.928 28.472 42.023 1.00 0.00 H ATOM 562 HH11 ARG A 37 34.201 27.861 43.142 1.00 0.00 H ATOM 563 HH22 ARG A 37 31.287 29.851 42.797 1.00 0.00 H ATOM 564 HH21 ARG A 37 31.254 30.338 44.530 1.00 0.00 H ATOM 565 H ARG A 37 36.327 32.985 46.579 1.00 0.00 H ATOM 566 N ALA A 38 34.787 32.602 43.648 1.00 9.36 N ATOM 567 CA ALA A 38 33.997 32.901 42.453 1.00 9.84 C ATOM 568 C ALA A 38 34.753 33.769 41.442 1.00 10.30 C ATOM 569 O ALA A 38 34.646 33.553 40.236 1.00 11.39 O ATOM 570 CB ALA A 38 32.703 33.535 42.837 1.00 10.32 C ATOM 571 HA ALA A 38 33.798 31.953 41.954 1.00 0.00 H ATOM 572 HB1 ALA A 38 32.141 32.853 43.476 1.00 0.00 H ATOM 573 HB2 ALA A 38 32.900 34.461 43.377 1.00 0.00 H ATOM 574 HB3 ALA A 38 32.125 33.752 41.938 1.00 0.00 H ATOM 575 H ALA A 38 34.462 32.946 44.574 1.00 0.00 H ATOM 576 N LEU A 39 35.538 34.734 41.926 1.00 9.79 N ATOM 577 CA LEU A 39 36.313 35.593 41.029 1.00 10.07 C ATOM 578 C LEU A 39 37.453 34.811 40.370 1.00 10.14 C ATOM 579 O LEU A 39 37.931 35.182 39.299 1.00 10.97 O ATOM 580 CB LEU A 39 36.852 36.817 41.779 1.00 10.05 C ATOM 581 CG LEU A 39 35.815 37.824 42.288 1.00 10.85 C ATOM 582 CD1 LEU A 39 36.472 38.877 43.156 1.00 12.24 C ATOM 583 CD2 LEU A 39 35.070 38.509 41.151 1.00 12.44 C ATOM 584 HA LEU A 39 35.648 35.944 40.240 1.00 0.00 H ATOM 585 HB2 LEU A 39 37.413 36.456 42.641 1.00 0.00 H ATOM 586 HB3 LEU A 39 37.525 37.347 41.105 1.00 0.00 H ATOM 587 HG LEU A 39 35.093 37.257 42.876 1.00 0.00 H ATOM 588 HD21 LEU A 39 35.782 39.044 40.522 1.00 0.00 H ATOM 589 HD22 LEU A 39 34.550 37.759 40.555 1.00 0.00 H ATOM 590 HD23 LEU A 39 34.347 39.213 41.564 1.00 0.00 H ATOM 591 HD11 LEU A 39 36.947 38.396 44.012 1.00 0.00 H ATOM 592 HD12 LEU A 39 37.224 39.409 42.573 1.00 0.00 H ATOM 593 HD13 LEU A 39 35.717 39.581 43.506 1.00 0.00 H ATOM 594 H LEU A 39 35.600 34.878 42.954 1.00 0.00 H ATOM 595 N SER A 40 37.879 33.725 41.010 1.00 10.48 N ATOM 596 CA SER A 40 38.942 32.884 40.471 1.00 11.15 C ATOM 597 C SER A 40 38.409 31.974 39.366 1.00 11.80 C ATOM 598 O SER A 40 39.108 31.718 38.396 1.00 12.89 O ATOM 599 CB SER A 40 39.601 32.066 41.581 1.00 11.56 C ATOM 600 OG SER A 40 40.277 32.934 42.478 1.00 12.02 O ATOM 601 HA SER A 40 39.700 33.534 40.034 1.00 0.00 H ATOM 602 HB2 SER A 40 40.316 31.369 41.143 1.00 0.00 H ATOM 603 HB3 SER A 40 38.837 31.508 42.123 1.00 0.00 H ATOM 604 HG SER A 40 39.627 33.566 42.877 1.00 0.00 H ATOM 605 H SER A 40 37.443 33.469 41.919 1.00 0.00 H ATOM 606 N THR A 41 37.182 31.492 39.498 1.00 12.27 N ATOM 607 CA THR A 41 36.610 30.631 38.463 1.00 12.92 C ATOM 608 C THR A 41 36.052 31.441 37.290 1.00 13.66 C ATOM 609 O THR A 41 35.929 30.917 36.167 1.00 14.83 O ATOM 610 CB THR A 41 35.475 29.734 39.021 1.00 12.58 C ATOM 611 OG1 THR A 41 34.394 30.541 39.520 1.00 12.75 O ATOM 612 CG2 THR A 41 35.917 28.906 40.219 1.00 13.06 C ATOM 613 HA THR A 41 37.430 30.004 38.113 1.00 0.00 H ATOM 614 HB THR A 41 35.184 29.094 38.188 1.00 0.00 H ATOM 615 HG1 THR A 41 33.680 29.953 39.872 1.00 0.00 H ATOM 616 HG23 THR A 41 36.743 28.258 39.926 1.00 0.00 H ATOM 617 HG21 THR A 41 36.241 29.571 41.019 1.00 0.00 H ATOM 618 HG22 THR A 41 35.082 28.298 40.567 1.00 0.00 H ATOM 619 H THR A 41 36.622 31.727 40.342 1.00 0.00 H ATOM 620 N GLY A 42 35.706 32.701 37.541 1.00 13.46 N ATOM 621 CA GLY A 42 35.134 33.559 36.521 1.00 14.03 C ATOM 622 C GLY A 42 33.669 33.241 36.247 1.00 14.31 C ATOM 623 O GLY A 42 33.095 33.734 35.278 1.00 14.41 O ATOM 624 HA3 GLY A 42 35.699 33.430 35.598 1.00 0.00 H ATOM 625 HA2 GLY A 42 35.212 34.595 36.851 1.00 0.00 H ATOM 626 H GLY A 42 35.850 33.082 38.498 1.00 0.00 H ATOM 627 N GLU A 43 33.049 32.462 37.128 1.00 14.15 N ATOM 628 CA GLU A 43 31.667 32.014 36.926 1.00 14.16 C ATOM 629 C GLU A 43 30.616 33.131 36.882 1.00 14.20 C ATOM 630 O GLU A 43 29.531 32.939 36.318 1.00 14.02 O ATOM 631 CB GLU A 43 31.286 30.967 37.980 1.00 14.15 C ATOM 632 CG GLU A 43 31.262 31.463 39.414 1.00 15.00 C ATOM 633 CD GLU A 43 31.270 30.317 40.409 1.00 16.90 C ATOM 634 OE1 GLU A 43 30.325 30.213 41.222 1.00 18.31 O ATOM 635 OE2 GLU A 43 32.222 29.507 40.371 1.00 17.91 O ATOM 636 HA GLU A 43 31.656 31.575 35.929 1.00 0.00 H ATOM 637 HB2 GLU A 43 30.292 30.592 37.737 1.00 0.00 H ATOM 638 HB3 GLU A 43 32.006 30.151 37.919 1.00 0.00 H ATOM 639 HG2 GLU A 43 32.140 32.086 39.586 1.00 0.00 H ATOM 640 HG3 GLU A 43 30.361 32.057 39.567 1.00 0.00 H ATOM 641 H GLU A 43 33.558 32.162 37.984 1.00 0.00 H ATOM 642 N LYS A 44 30.904 34.289 37.473 1.00 13.69 N ATOM 643 CA LYS A 44 29.945 35.396 37.453 1.00 15.09 C ATOM 644 C LYS A 44 30.086 36.276 36.210 1.00 14.95 C ATOM 645 O LYS A 44 29.337 37.246 36.058 1.00 16.02 O ATOM 646 CB LYS A 44 30.092 36.274 38.705 1.00 15.33 C ATOM 647 CG LYS A 44 30.065 35.515 40.021 1.00 16.82 C ATOM 648 CD LYS A 44 28.771 34.776 40.239 1.00 18.33 C ATOM 649 CE LYS A 44 28.779 34.038 41.566 1.00 19.42 C ATOM 650 NZ LYS A 44 27.483 33.376 41.860 1.00 21.27 N ATOM 651 HA LYS A 44 28.956 34.937 37.434 1.00 0.00 H ATOM 652 HB2 LYS A 44 31.042 36.804 38.638 1.00 0.00 H ATOM 653 HB3 LYS A 44 29.275 36.995 38.712 1.00 0.00 H ATOM 654 HG2 LYS A 44 30.883 34.795 40.025 1.00 0.00 H ATOM 655 HG3 LYS A 44 30.203 36.225 40.836 1.00 0.00 H ATOM 656 HD2 LYS A 44 27.948 35.490 40.234 1.00 0.00 H ATOM 657 HD3 LYS A 44 28.631 34.057 39.432 1.00 0.00 H ATOM 658 HE2 LYS A 44 28.995 34.752 42.361 1.00 0.00 H ATOM 659 HE3 LYS A 44 29.561 33.279 41.539 1.00 0.00 H ATOM 660 HZ1 LYS A 44 26.730 34.092 41.897 1.00 0.00 H ATOM 661 HZ2 LYS A 44 27.270 32.686 41.112 1.00 0.00 H ATOM 662 HZ3 LYS A 44 27.544 32.888 42.776 1.00 0.00 H ATOM 663 H LYS A 44 31.819 34.409 37.953 1.00 0.00 H ATOM 664 N GLY A 45 31.048 35.957 35.346 1.00 15.67 N ATOM 665 CA GLY A 45 31.280 36.708 34.115 1.00 16.00 C ATOM 666 C GLY A 45 32.467 37.652 34.146 1.00 16.21 C ATOM 667 O GLY A 45 32.796 38.289 33.143 1.00 17.30 O ATOM 668 HA3 GLY A 45 30.387 37.296 33.906 1.00 0.00 H ATOM 669 HA2 GLY A 45 31.439 35.992 33.308 1.00 0.00 H ATOM 670 H GLY A 45 31.658 35.141 35.556 1.00 0.00 H ATOM 671 N PHE A 46 33.110 37.750 35.306 1.00 15.64 N ATOM 672 CA PHE A 46 34.251 38.628 35.482 1.00 15.42 C ATOM 673 C PHE A 46 35.100 38.009 36.570 1.00 14.75 C ATOM 674 O PHE A 46 34.623 37.167 37.320 1.00 14.54 O ATOM 675 CB PHE A 46 33.810 40.041 35.873 1.00 15.82 C ATOM 676 CG PHE A 46 32.849 40.094 37.033 1.00 15.79 C ATOM 677 CD1 PHE A 46 33.314 40.196 38.331 1.00 17.26 C ATOM 678 CD2 PHE A 46 31.474 40.060 36.826 1.00 17.41 C ATOM 679 CE1 PHE A 46 32.436 40.254 39.400 1.00 18.33 C ATOM 680 CE2 PHE A 46 30.589 40.122 37.891 1.00 18.02 C ATOM 681 CZ PHE A 46 31.068 40.217 39.179 1.00 19.33 C ATOM 682 HA PHE A 46 34.811 38.728 34.552 1.00 0.00 H ATOM 683 HB2 PHE A 46 34.698 40.614 36.139 1.00 0.00 H ATOM 684 HB3 PHE A 46 33.328 40.499 35.009 1.00 0.00 H ATOM 685 HD2 PHE A 46 31.086 39.983 35.810 1.00 0.00 H ATOM 686 HE2 PHE A 46 29.515 40.096 37.709 1.00 0.00 H ATOM 687 HZ PHE A 46 30.375 40.263 40.019 1.00 0.00 H ATOM 688 HE1 PHE A 46 32.821 40.329 40.417 1.00 0.00 H ATOM 689 HD1 PHE A 46 34.388 40.231 38.515 1.00 0.00 H ATOM 690 H PHE A 46 32.785 37.179 36.112 1.00 0.00 H ATOM 691 N GLY A 47 36.350 38.435 36.666 1.00 13.96 N ATOM 692 CA GLY A 47 37.234 37.866 37.664 1.00 13.17 C ATOM 693 C GLY A 47 38.694 38.143 37.393 1.00 12.96 C ATOM 694 O GLY A 47 39.042 38.973 36.556 1.00 12.63 O ATOM 695 HA3 GLY A 47 37.084 36.787 37.685 1.00 0.00 H ATOM 696 HA2 GLY A 47 36.976 38.286 38.636 1.00 0.00 H ATOM 697 H GLY A 47 36.697 39.177 36.026 1.00 0.00 H ATOM 698 N TYR A 48 39.545 37.405 38.095 1.00 12.26 N ATOM 699 CA TYR A 48 40.985 37.652 38.096 1.00 12.48 C ATOM 700 C TYR A 48 41.756 37.282 36.835 1.00 13.59 C ATOM 701 O TYR A 48 42.832 37.834 36.594 1.00 13.75 O ATOM 702 CB TYR A 48 41.622 36.914 39.276 1.00 12.52 C ATOM 703 CG TYR A 48 41.135 37.380 40.630 1.00 10.77 C ATOM 704 CD1 TYR A 48 41.080 38.728 40.943 1.00 10.36 C ATOM 705 CD2 TYR A 48 40.767 36.472 41.607 1.00 10.38 C ATOM 706 CE1 TYR A 48 40.656 39.158 42.178 1.00 9.60 C ATOM 707 CE2 TYR A 48 40.340 36.894 42.848 1.00 9.87 C ATOM 708 CZ TYR A 48 40.293 38.244 43.129 1.00 8.94 C ATOM 709 OH TYR A 48 39.870 38.653 44.374 1.00 10.29 O ATOM 710 HA TYR A 48 41.062 38.737 38.166 1.00 0.00 H ATOM 711 HB3 TYR A 48 42.701 37.061 39.230 1.00 0.00 H ATOM 712 HB2 TYR A 48 41.397 35.852 39.178 1.00 0.00 H ATOM 713 HD2 TYR A 48 40.816 35.405 41.392 1.00 0.00 H ATOM 714 HE2 TYR A 48 40.041 36.166 43.602 1.00 0.00 H ATOM 715 HE1 TYR A 48 40.609 40.224 42.399 1.00 0.00 H ATOM 716 HD1 TYR A 48 41.379 39.463 40.195 1.00 0.00 H ATOM 717 HH TYR A 48 39.892 39.642 44.420 1.00 0.00 H ATOM 718 H TYR A 48 39.172 36.620 38.667 1.00 0.00 H ATOM 719 N LYS A 49 41.245 36.344 36.046 1.00 14.31 N ATOM 720 CA LYS A 49 41.998 35.889 34.886 1.00 15.27 C ATOM 721 C LYS A 49 42.383 37.072 34.006 1.00 15.49 C ATOM 722 O LYS A 49 41.533 37.871 33.618 1.00 16.08 O ATOM 723 CB LYS A 49 41.215 34.858 34.077 1.00 15.72 C ATOM 724 CG LYS A 49 42.037 34.241 32.946 1.00 18.34 C ATOM 725 CD LYS A 49 41.258 33.148 32.220 1.00 21.88 C ATOM 726 CE LYS A 49 42.058 32.568 31.053 1.00 23.69 C ATOM 727 NZ LYS A 49 41.293 31.530 30.302 1.00 25.93 N ATOM 728 HA LYS A 49 42.906 35.406 35.249 1.00 0.00 H ATOM 729 HB2 LYS A 49 40.892 34.061 34.747 1.00 0.00 H ATOM 730 HB3 LYS A 49 40.340 35.345 33.646 1.00 0.00 H ATOM 731 HG2 LYS A 49 42.301 35.022 32.233 1.00 0.00 H ATOM 732 HG3 LYS A 49 42.947 33.810 33.364 1.00 0.00 H ATOM 733 HD2 LYS A 49 41.029 32.348 32.925 1.00 0.00 H ATOM 734 HD3 LYS A 49 40.329 33.570 31.837 1.00 0.00 H ATOM 735 HE2 LYS A 49 42.971 32.117 31.443 1.00 0.00 H ATOM 736 HE3 LYS A 49 42.317 33.376 30.369 1.00 0.00 H ATOM 737 HZ1 LYS A 49 41.048 30.750 30.944 1.00 0.00 H ATOM 738 HZ2 LYS A 49 40.423 31.952 29.919 1.00 0.00 H ATOM 739 HZ3 LYS A 49 41.877 31.168 29.522 1.00 0.00 H ATOM 740 H LYS A 49 40.311 35.936 36.256 1.00 0.00 H ATOM 741 N GLY A 50 43.673 37.180 33.714 1.00 15.99 N ATOM 742 CA GLY A 50 44.192 38.241 32.870 1.00 16.47 C ATOM 743 C GLY A 50 44.593 39.517 33.603 1.00 16.63 C ATOM 744 O GLY A 50 45.183 40.412 32.998 1.00 18.36 O ATOM 745 HA3 GLY A 50 43.424 38.498 32.141 1.00 0.00 H ATOM 746 HA2 GLY A 50 45.071 37.860 32.351 1.00 0.00 H ATOM 747 H GLY A 50 44.336 36.480 34.104 1.00 0.00 H ATOM 748 N SER A 51 44.290 39.612 34.896 1.00 16.40 N ATOM 749 CA SER A 51 44.655 40.796 35.668 1.00 15.87 C ATOM 750 C SER A 51 46.099 40.703 36.139 1.00 16.14 C ATOM 751 O SER A 51 46.723 39.650 36.070 1.00 16.09 O ATOM 752 CB SER A 51 43.724 40.989 36.864 1.00 16.07 C ATOM 753 OG SER A 51 43.895 39.971 37.830 1.00 15.05 O ATOM 754 HA SER A 51 44.551 41.662 35.014 1.00 0.00 H ATOM 755 HB2 SER A 51 42.692 40.975 36.514 1.00 0.00 H ATOM 756 HB3 SER A 51 43.937 41.953 37.325 1.00 0.00 H ATOM 757 HG SER A 51 43.698 39.092 37.420 1.00 0.00 H ATOM 758 H SER A 51 43.786 38.831 35.363 1.00 0.00 H ATOM 759 N CYS A 52 46.632 41.809 36.636 1.00 16.61 N ATOM 760 CA CYS A 52 48.021 41.814 37.054 1.00 17.39 C ATOM 761 C CYS A 52 48.215 42.192 38.515 1.00 16.04 C ATOM 762 O CYS A 52 47.297 42.674 39.186 1.00 15.06 O ATOM 763 CB CYS A 52 48.821 42.772 36.181 1.00 18.09 C ATOM 764 SG CYS A 52 48.522 44.503 36.554 1.00 25.90 S ATOM 765 HA CYS A 52 48.378 40.791 36.938 1.00 0.00 H ATOM 766 HB2 CYS A 52 48.556 42.593 35.139 1.00 0.00 H ATOM 767 HB3 CYS A 52 49.882 42.566 36.325 1.00 0.00 H ATOM 768 HG CYS A 52 47.185 44.789 36.364 1.00 0.00 H ATOM 769 H CYS A 52 46.057 42.671 36.726 1.00 0.00 H ATOM 770 N PHE A 53 49.431 41.939 38.993 1.00 14.83 N ATOM 771 CA PHE A 53 49.845 42.334 40.331 1.00 13.99 C ATOM 772 C PHE A 53 50.431 43.726 40.165 1.00 13.72 C ATOM 773 O PHE A 53 51.542 43.872 39.640 1.00 14.63 O ATOM 774 CB PHE A 53 50.869 41.356 40.908 1.00 13.91 C ATOM 775 CG PHE A 53 50.262 40.115 41.466 1.00 13.52 C ATOM 776 CD1 PHE A 53 49.993 40.009 42.818 1.00 13.16 C ATOM 777 CD2 PHE A 53 49.940 39.056 40.645 1.00 14.91 C ATOM 778 CE1 PHE A 53 49.425 38.875 43.328 1.00 14.11 C ATOM 779 CE2 PHE A 53 49.363 37.927 41.160 1.00 14.60 C ATOM 780 CZ PHE A 53 49.112 37.836 42.498 1.00 13.78 C ATOM 781 HA PHE A 53 49.012 42.328 41.034 1.00 0.00 H ATOM 782 HB2 PHE A 53 51.562 41.074 40.115 1.00 0.00 H ATOM 783 HB3 PHE A 53 51.416 41.860 41.704 1.00 0.00 H ATOM 784 HD2 PHE A 53 50.147 39.118 39.577 1.00 0.00 H ATOM 785 HE2 PHE A 53 49.104 37.099 40.500 1.00 0.00 H ATOM 786 HZ PHE A 53 48.660 36.932 42.906 1.00 0.00 H ATOM 787 HE1 PHE A 53 49.222 38.800 44.396 1.00 0.00 H ATOM 788 HD1 PHE A 53 50.236 40.837 43.483 1.00 0.00 H ATOM 789 H PHE A 53 50.112 41.439 38.386 1.00 0.00 H ATOM 790 N HIS A 54 49.718 44.747 40.622 1.00 13.07 N ATOM 791 CA HIS A 54 50.137 46.125 40.377 1.00 12.94 C ATOM 792 C HIS A 54 51.100 46.697 41.414 1.00 12.38 C ATOM 793 O HIS A 54 51.723 47.733 41.175 1.00 12.80 O ATOM 794 CB HIS A 54 48.930 47.041 40.250 1.00 12.84 C ATOM 795 CG HIS A 54 48.068 47.092 41.473 1.00 12.93 C ATOM 796 ND1 HIS A 54 47.108 46.142 41.749 1.00 13.29 N ATOM 797 CD2 HIS A 54 48.026 47.979 42.494 1.00 13.03 C ATOM 798 CE1 HIS A 54 46.493 46.458 42.874 1.00 11.69 C ATOM 799 NE2 HIS A 54 47.032 47.567 43.349 1.00 12.26 N ATOM 800 HA HIS A 54 50.690 46.083 39.438 1.00 0.00 H ATOM 801 HB2 HIS A 54 49.286 48.050 40.040 1.00 0.00 H ATOM 802 HB3 HIS A 54 48.321 46.691 39.416 1.00 0.00 H ATOM 803 HD2 HIS A 54 48.662 48.856 42.616 1.00 0.00 H ATOM 804 HE1 HIS A 54 45.678 45.898 43.333 1.00 0.00 H ATOM 805 H HIS A 54 48.848 44.564 41.162 1.00 0.00 H ATOM 806 N ARG A 55 51.225 46.041 42.557 1.00 11.55 N ATOM 807 CA ARG A 55 52.099 46.553 43.604 1.00 11.35 C ATOM 808 C ARG A 55 52.794 45.402 44.322 1.00 10.76 C ATOM 809 O ARG A 55 52.145 44.576 44.973 1.00 10.77 O ATOM 810 CB ARG A 55 51.291 47.401 44.587 1.00 11.59 C ATOM 811 CG ARG A 55 52.126 48.140 45.633 1.00 11.90 C ATOM 812 CD ARG A 55 51.299 49.004 46.570 1.00 13.92 C ATOM 813 NE ARG A 55 50.561 50.026 45.829 1.00 15.19 N ATOM 814 CZ ARG A 55 49.272 50.307 45.988 1.00 16.23 C ATOM 815 NH1 ARG A 55 48.709 51.250 45.246 1.00 16.96 N ATOM 816 NH2 ARG A 55 48.545 49.674 46.898 1.00 16.30 N ATOM 817 HA ARG A 55 52.866 47.183 43.153 1.00 0.00 H ATOM 818 HB2 ARG A 55 50.730 48.141 44.016 1.00 0.00 H ATOM 819 HB3 ARG A 55 50.596 46.744 45.110 1.00 0.00 H ATOM 820 HG2 ARG A 55 52.664 47.403 46.228 1.00 0.00 H ATOM 821 HG3 ARG A 55 52.841 48.779 45.115 1.00 0.00 H ATOM 822 HD2 ARG A 55 51.963 49.491 47.284 1.00 0.00 H ATOM 823 HD3 ARG A 55 50.591 48.372 47.106 1.00 0.00 H ATOM 824 HE ARG A 55 51.087 50.577 45.121 1.00 0.00 H ATOM 825 HH12 ARG A 55 47.701 51.474 45.367 1.00 0.00 H ATOM 826 HH11 ARG A 55 49.276 51.766 44.543 1.00 0.00 H ATOM 827 HH22 ARG A 55 47.537 49.905 47.011 1.00 0.00 H ATOM 828 HH21 ARG A 55 48.982 48.947 47.499 1.00 0.00 H ATOM 829 H ARG A 55 50.698 45.157 42.708 1.00 0.00 H ATOM 830 N ILE A 56 54.114 45.349 44.183 1.00 10.55 N ATOM 831 CA ILE A 56 54.923 44.338 44.825 1.00 10.91 C ATOM 832 C ILE A 56 56.061 45.028 45.564 1.00 10.89 C ATOM 833 O ILE A 56 56.900 45.700 44.958 1.00 11.28 O ATOM 834 CB ILE A 56 55.480 43.340 43.801 1.00 10.92 C ATOM 835 CG1 ILE A 56 54.332 42.638 43.069 1.00 11.58 C ATOM 836 CG2 ILE A 56 56.381 42.320 44.503 1.00 12.42 C ATOM 837 CD1 ILE A 56 54.784 41.596 42.089 1.00 12.54 C ATOM 838 HA ILE A 56 54.306 43.775 45.526 1.00 0.00 H ATOM 839 HB ILE A 56 56.076 43.879 43.064 1.00 0.00 H ATOM 840 HG12 ILE A 56 53.694 42.158 43.811 1.00 0.00 H ATOM 841 HG13 ILE A 56 53.757 43.391 42.530 1.00 0.00 H ATOM 842 HD11 ILE A 56 55.415 42.061 41.331 1.00 0.00 H ATOM 843 HD12 ILE A 56 55.351 40.827 42.614 1.00 0.00 H ATOM 844 HD13 ILE A 56 53.913 41.145 41.612 1.00 0.00 H ATOM 845 HG21 ILE A 56 57.209 42.840 44.986 1.00 0.00 H ATOM 846 HG22 ILE A 56 55.802 41.781 45.253 1.00 0.00 H ATOM 847 HG23 ILE A 56 56.772 41.616 43.768 1.00 0.00 H ATOM 848 H ILE A 56 54.583 46.062 43.589 1.00 0.00 H ATOM 849 N ILE A 57 56.052 44.886 46.881 1.00 10.90 N ATOM 850 CA ILE A 57 57.070 45.471 47.741 1.00 10.79 C ATOM 851 C ILE A 57 57.833 44.312 48.365 1.00 11.41 C ATOM 852 O ILE A 57 57.302 43.576 49.197 1.00 11.44 O ATOM 853 CB ILE A 57 56.419 46.366 48.810 1.00 10.96 C ATOM 854 CG1 ILE A 57 55.663 47.509 48.129 1.00 10.34 C ATOM 855 CG2 ILE A 57 57.481 46.917 49.754 1.00 11.80 C ATOM 856 CD1 ILE A 57 54.830 48.359 49.055 1.00 11.57 C ATOM 857 HA ILE A 57 57.751 46.109 47.178 1.00 0.00 H ATOM 858 HB ILE A 57 55.715 45.774 49.395 1.00 0.00 H ATOM 859 HG12 ILE A 57 56.393 48.155 47.641 1.00 0.00 H ATOM 860 HG13 ILE A 57 55.001 47.078 47.378 1.00 0.00 H ATOM 861 HD11 ILE A 57 54.082 47.735 49.544 1.00 0.00 H ATOM 862 HD12 ILE A 57 55.475 48.813 49.808 1.00 0.00 H ATOM 863 HD13 ILE A 57 54.333 49.141 48.480 1.00 0.00 H ATOM 864 HG21 ILE A 57 57.994 46.090 50.245 1.00 0.00 H ATOM 865 HG22 ILE A 57 58.201 47.506 49.185 1.00 0.00 H ATOM 866 HG23 ILE A 57 57.006 47.548 50.505 1.00 0.00 H ATOM 867 H ILE A 57 55.287 44.334 47.318 1.00 0.00 H ATOM 868 N PRO A 58 59.080 44.110 47.952 1.00 11.87 N ATOM 869 CA PRO A 58 59.862 42.997 48.489 1.00 11.96 C ATOM 870 C PRO A 58 59.971 43.032 50.010 1.00 11.58 C ATOM 871 O PRO A 58 60.167 44.107 50.602 1.00 11.92 O ATOM 872 CB PRO A 58 61.233 43.192 47.835 1.00 12.02 C ATOM 873 CG PRO A 58 60.954 43.950 46.612 1.00 12.83 C ATOM 874 CD PRO A 58 59.830 44.863 46.932 1.00 12.62 C ATOM 875 HA PRO A 58 59.404 42.031 48.274 1.00 0.00 H ATOM 876 HD3 PRO A 58 60.194 45.810 47.331 1.00 0.00 H ATOM 877 HD2 PRO A 58 59.215 45.053 46.052 1.00 0.00 H ATOM 878 HG3 PRO A 58 60.673 43.274 45.805 1.00 0.00 H ATOM 879 HG2 PRO A 58 61.832 44.523 46.315 1.00 0.00 H ATOM 880 HB2 PRO A 58 61.897 43.753 48.493 1.00 0.00 H ATOM 881 HB3 PRO A 58 61.687 42.230 47.597 1.00 0.00 H ATOM 882 N GLY A 59 59.823 41.859 50.622 1.00 11.18 N ATOM 883 CA GLY A 59 59.885 41.717 52.068 1.00 10.98 C ATOM 884 C GLY A 59 58.587 42.049 52.778 1.00 10.46 C ATOM 885 O GLY A 59 58.503 41.994 54.006 1.00 10.50 O ATOM 886 HA3 GLY A 59 60.662 42.382 52.445 1.00 0.00 H ATOM 887 HA2 GLY A 59 60.148 40.685 52.300 1.00 0.00 H ATOM 888 H GLY A 59 59.657 41.011 50.043 1.00 0.00 H ATOM 889 N PHE A 60 57.558 42.379 52.007 1.00 9.36 N ATOM 890 CA PHE A 60 56.282 42.784 52.582 1.00 8.55 C ATOM 891 C PHE A 60 55.112 42.004 51.970 1.00 8.42 C ATOM 892 O PHE A 60 54.575 41.105 52.607 1.00 7.89 O ATOM 893 CB PHE A 60 56.113 44.303 52.404 1.00 8.48 C ATOM 894 CG PHE A 60 54.839 44.871 52.972 1.00 8.37 C ATOM 895 CD1 PHE A 60 54.385 46.117 52.542 1.00 10.04 C ATOM 896 CD2 PHE A 60 54.109 44.202 53.933 1.00 9.90 C ATOM 897 CE1 PHE A 60 53.226 46.649 53.045 1.00 10.03 C ATOM 898 CE2 PHE A 60 52.937 44.744 54.447 1.00 9.42 C ATOM 899 CZ PHE A 60 52.504 45.976 54.003 1.00 10.16 C ATOM 900 HA PHE A 60 56.278 42.549 53.646 1.00 0.00 H ATOM 901 HB2 PHE A 60 56.952 44.797 52.894 1.00 0.00 H ATOM 902 HB3 PHE A 60 56.136 44.524 51.337 1.00 0.00 H ATOM 903 HD2 PHE A 60 54.457 43.234 54.294 1.00 0.00 H ATOM 904 HE2 PHE A 60 52.363 44.199 55.197 1.00 0.00 H ATOM 905 HZ PHE A 60 51.593 46.415 54.410 1.00 0.00 H ATOM 906 HE1 PHE A 60 52.873 47.614 52.682 1.00 0.00 H ATOM 907 HD1 PHE A 60 54.957 46.673 51.799 1.00 0.00 H ATOM 908 H PHE A 60 57.665 42.348 50.973 1.00 0.00 H ATOM 909 N MET A 61 54.724 42.338 50.746 1.00 8.63 N ATOM 910 CA MET A 61 53.546 41.702 50.140 1.00 8.81 C ATOM 911 C MET A 61 53.435 41.945 48.642 1.00 9.02 C ATOM 912 O MET A 61 54.090 42.828 48.089 1.00 9.57 O ATOM 913 CB MET A 61 52.270 42.208 50.823 1.00 9.09 C ATOM 914 CG MET A 61 52.059 43.702 50.715 1.00 9.43 C ATOM 915 SD MET A 61 51.075 44.194 49.277 1.00 8.90 S ATOM 916 CE MET A 61 51.949 45.621 48.716 1.00 10.68 C ATOM 917 HA MET A 61 53.666 40.629 50.287 1.00 0.00 H ATOM 918 HB2 MET A 61 51.416 41.708 50.366 1.00 0.00 H ATOM 919 HB3 MET A 61 52.320 41.945 51.880 1.00 0.00 H ATOM 920 HG2 MET A 61 53.034 44.184 50.647 1.00 0.00 H ATOM 921 HG3 MET A 61 51.549 44.044 51.615 1.00 0.00 H ATOM 922 HE1 MET A 61 51.961 46.372 49.506 1.00 0.00 H ATOM 923 HE2 MET A 61 52.972 45.343 48.462 1.00 0.00 H ATOM 924 HE3 MET A 61 51.452 46.027 47.835 1.00 0.00 H ATOM 925 H MET A 61 55.257 43.054 50.212 1.00 0.00 H ATOM 926 N CYS A 62 52.600 41.131 48.001 1.00 9.22 N ATOM 927 CA CYS A 62 52.285 41.262 46.580 1.00 9.14 C ATOM 928 C CYS A 62 50.790 41.529 46.492 1.00 8.65 C ATOM 929 O CYS A 62 50.003 40.737 47.010 1.00 9.32 O ATOM 930 CB CYS A 62 52.575 39.969 45.827 1.00 9.42 C ATOM 931 SG CYS A 62 54.289 39.419 45.886 1.00 13.52 S ATOM 932 HA CYS A 62 52.887 42.058 46.141 1.00 0.00 H ATOM 933 HB2 CYS A 62 52.304 40.118 44.782 1.00 0.00 H ATOM 934 HB3 CYS A 62 51.953 39.182 46.254 1.00 0.00 H ATOM 935 HG CYS A 62 54.419 38.246 45.171 1.00 0.00 H ATOM 936 H CYS A 62 52.149 40.363 48.538 1.00 0.00 H ATOM 937 N GLN A 63 50.408 42.623 45.836 1.00 7.58 N ATOM 938 CA GLN A 63 49.013 43.041 45.749 1.00 7.79 C ATOM 939 C GLN A 63 48.492 43.003 44.316 1.00 8.39 C ATOM 940 O GLN A 63 49.163 43.444 43.396 1.00 8.64 O ATOM 941 CB GLN A 63 48.861 44.464 46.289 1.00 8.20 C ATOM 942 CG GLN A 63 47.426 44.982 46.359 1.00 7.52 C ATOM 943 CD GLN A 63 47.308 46.336 47.032 1.00 7.55 C ATOM 944 OE1 GLN A 63 48.216 46.754 47.750 1.00 9.96 O ATOM 945 NE2 GLN A 63 46.193 47.024 46.803 1.00 7.61 N ATOM 946 HA GLN A 63 48.429 42.340 46.346 1.00 0.00 H ATOM 947 HB2 GLN A 63 49.279 44.490 47.295 1.00 0.00 H ATOM 948 HB3 GLN A 63 49.430 45.133 45.643 1.00 0.00 H ATOM 949 HG2 GLN A 63 47.038 45.065 45.344 1.00 0.00 H ATOM 950 HG3 GLN A 63 46.826 44.264 46.918 1.00 0.00 H ATOM 951 HE22 GLN A 63 45.454 46.627 46.188 1.00 0.00 H ATOM 952 HE21 GLN A 63 46.060 47.959 47.239 1.00 0.00 H ATOM 953 H GLN A 63 51.133 43.203 45.367 1.00 0.00 H ATOM 954 N GLY A 64 47.268 42.533 44.151 1.00 9.06 N ATOM 955 CA GLY A 64 46.654 42.481 42.839 1.00 9.46 C ATOM 956 C GLY A 64 45.144 42.500 42.943 1.00 9.97 C ATOM 957 O GLY A 64 44.586 42.859 43.980 1.00 10.19 O ATOM 958 HA3 GLY A 64 46.965 41.565 42.336 1.00 0.00 H ATOM 959 HA2 GLY A 64 46.982 43.343 42.258 1.00 0.00 H ATOM 960 H GLY A 64 46.736 42.194 44.978 1.00 0.00 H ATOM 961 N GLY A 65 44.473 42.155 41.852 1.00 11.35 N ATOM 962 CA GLY A 65 43.026 42.021 41.871 1.00 11.70 C ATOM 963 C GLY A 65 42.197 43.090 41.193 1.00 12.76 C ATOM 964 O GLY A 65 40.979 42.974 41.185 1.00 13.56 O ATOM 965 HA3 GLY A 65 42.718 41.988 42.916 1.00 0.00 H ATOM 966 HA2 GLY A 65 42.783 41.072 41.392 1.00 0.00 H ATOM 967 H GLY A 65 44.991 41.977 40.968 1.00 0.00 H ATOM 968 N ASP A 66 42.827 44.121 40.641 1.00 13.73 N ATOM 969 CA ASP A 66 42.075 45.161 39.946 1.00 15.27 C ATOM 970 C ASP A 66 41.811 44.745 38.501 1.00 16.25 C ATOM 971 O ASP A 66 42.631 44.999 37.622 1.00 16.81 O ATOM 972 CB ASP A 66 42.839 46.479 39.979 1.00 15.15 C ATOM 973 CG ASP A 66 42.110 47.600 39.267 1.00 16.97 C ATOM 974 OD1 ASP A 66 40.969 47.383 38.790 1.00 17.38 O ATOM 975 OD2 ASP A 66 42.625 48.733 39.138 1.00 17.63 O ATOM 976 HA ASP A 66 41.120 45.297 40.454 1.00 0.00 H ATOM 977 HB2 ASP A 66 42.991 46.768 41.019 1.00 0.00 H ATOM 978 HB3 ASP A 66 43.807 46.333 39.499 1.00 0.00 H ATOM 979 H ASP A 66 43.863 44.188 40.704 1.00 0.00 H ATOM 980 N PHE A 67 40.672 44.104 38.253 1.00 17.95 N ATOM 981 CA PHE A 67 40.351 43.651 36.893 1.00 19.02 C ATOM 982 C PHE A 67 39.449 44.630 36.118 1.00 20.70 C ATOM 983 O PHE A 67 39.113 44.373 34.959 1.00 21.41 O ATOM 984 CB PHE A 67 39.742 42.242 36.929 1.00 18.87 C ATOM 985 CG PHE A 67 38.546 42.122 37.821 1.00 17.85 C ATOM 986 CD1 PHE A 67 37.305 42.563 37.402 1.00 18.22 C ATOM 987 CD2 PHE A 67 38.661 41.566 39.083 1.00 17.69 C ATOM 988 CE1 PHE A 67 36.209 42.455 38.225 1.00 18.05 C ATOM 989 CE2 PHE A 67 37.565 41.457 39.908 1.00 17.43 C ATOM 990 CZ PHE A 67 36.343 41.902 39.480 1.00 18.36 C ATOM 991 HA PHE A 67 41.292 43.619 36.343 1.00 0.00 H ATOM 992 HB2 PHE A 67 39.444 41.970 35.916 1.00 0.00 H ATOM 993 HB3 PHE A 67 40.504 41.547 37.281 1.00 0.00 H ATOM 994 HD2 PHE A 67 39.632 41.210 39.428 1.00 0.00 H ATOM 995 HE2 PHE A 67 37.670 41.017 40.900 1.00 0.00 H ATOM 996 HZ PHE A 67 35.474 41.819 40.133 1.00 0.00 H ATOM 997 HE1 PHE A 67 35.235 42.807 37.885 1.00 0.00 H ATOM 998 HD1 PHE A 67 37.194 43.000 36.410 1.00 0.00 H ATOM 999 H PHE A 67 40.003 43.922 39.028 1.00 0.00 H ATOM 1000 N THR A 68 39.067 45.750 36.731 1.00 22.04 N ATOM 1001 CA THR A 68 38.207 46.717 36.035 1.00 23.41 C ATOM 1002 C THR A 68 38.956 47.924 35.478 1.00 24.95 C ATOM 1003 O THR A 68 38.764 48.280 34.316 1.00 26.14 O ATOM 1004 CB THR A 68 37.055 47.203 36.924 1.00 23.26 C ATOM 1005 OG1 THR A 68 37.562 47.840 38.104 1.00 22.89 O ATOM 1006 CG2 THR A 68 36.225 46.035 37.438 1.00 23.03 C ATOM 1007 HA THR A 68 37.806 46.162 35.187 1.00 0.00 H ATOM 1008 HB THR A 68 36.463 47.880 36.309 1.00 0.00 H ATOM 1009 HG1 THR A 68 36.805 48.146 38.664 1.00 0.00 H ATOM 1010 HG23 THR A 68 35.800 45.493 36.593 1.00 0.00 H ATOM 1011 HG21 THR A 68 36.861 45.366 38.017 1.00 0.00 H ATOM 1012 HG22 THR A 68 35.422 46.412 38.071 1.00 0.00 H ATOM 1013 H THR A 68 39.379 45.940 37.705 1.00 0.00 H ATOM 1014 N ARG A 69 39.785 48.567 36.294 1.00 26.09 N ATOM 1015 CA ARG A 69 40.503 49.764 35.851 1.00 27.26 C ATOM 1016 C ARG A 69 41.957 49.459 35.498 1.00 27.55 C ATOM 1017 O ARG A 69 42.597 50.225 34.780 1.00 27.76 O ATOM 1018 CB ARG A 69 40.426 50.860 36.916 1.00 27.45 C ATOM 1019 CG ARG A 69 39.002 51.328 37.246 1.00 29.38 C ATOM 1020 CD ARG A 69 38.952 52.390 38.337 1.00 32.18 C ATOM 1021 NE ARG A 69 37.599 52.839 38.672 1.00 35.58 N ATOM 1022 CZ ARG A 69 37.217 53.221 39.890 1.00 37.93 C ATOM 1023 NH1 ARG A 69 38.081 53.201 40.902 1.00 39.05 N ATOM 1024 NH2 ARG A 69 35.967 53.621 40.102 1.00 38.84 N ATOM 1025 HA ARG A 69 40.016 50.120 34.943 1.00 0.00 H ATOM 1026 HB2 ARG A 69 40.880 50.479 37.831 1.00 0.00 H ATOM 1027 HB3 ARG A 69 40.994 51.720 36.561 1.00 0.00 H ATOM 1028 HG2 ARG A 69 38.555 51.740 36.341 1.00 0.00 H ATOM 1029 HG3 ARG A 69 38.422 50.466 37.576 1.00 0.00 H ATOM 1030 HD2 ARG A 69 39.526 53.253 38.001 1.00 0.00 H ATOM 1031 HD3 ARG A 69 39.409 51.979 39.237 1.00 0.00 H ATOM 1032 HE ARG A 69 36.891 52.861 37.911 1.00 0.00 H ATOM 1033 HH12 ARG A 69 37.778 53.500 41.851 1.00 0.00 H ATOM 1034 HH11 ARG A 69 39.060 52.886 40.744 1.00 0.00 H ATOM 1035 HH22 ARG A 69 35.671 53.919 41.053 1.00 0.00 H ATOM 1036 HH21 ARG A 69 35.286 53.636 39.317 1.00 0.00 H ATOM 1037 H ARG A 69 39.926 48.215 37.262 1.00 0.00 H ATOM 1038 N HIS A 70 42.473 48.343 36.009 1.00 27.96 N ATOM 1039 CA HIS A 70 43.837 47.898 35.728 1.00 28.39 C ATOM 1040 C HIS A 70 44.915 48.945 36.036 1.00 28.21 C ATOM 1041 O HIS A 70 45.972 48.962 35.400 1.00 28.90 O ATOM 1042 CB HIS A 70 43.947 47.430 34.274 1.00 28.74 C ATOM 1043 CG HIS A 70 43.064 46.263 33.954 1.00 29.86 C ATOM 1044 ND1 HIS A 70 43.489 44.955 34.066 1.00 31.33 N ATOM 1045 CD2 HIS A 70 41.774 46.206 33.544 1.00 30.87 C ATOM 1046 CE1 HIS A 70 42.500 44.144 33.733 1.00 31.56 C ATOM 1047 NE2 HIS A 70 41.450 44.878 33.409 1.00 31.67 N ATOM 1048 HA HIS A 70 44.030 47.067 36.407 1.00 0.00 H ATOM 1049 HB2 HIS A 70 43.673 48.260 33.622 1.00 0.00 H ATOM 1050 HB3 HIS A 70 44.981 47.144 34.080 1.00 0.00 H ATOM 1051 HD2 HIS A 70 41.116 47.055 33.356 1.00 0.00 H ATOM 1052 HE1 HIS A 70 42.543 43.055 33.727 1.00 0.00 H ATOM 1053 H HIS A 70 41.880 47.762 36.636 1.00 0.00 H ATOM 1054 N ASN A 71 44.645 49.814 37.007 1.00 27.61 N ATOM 1055 CA ASN A 71 45.620 50.815 37.438 1.00 26.87 C ATOM 1056 C ASN A 71 45.755 50.889 38.965 1.00 25.87 C ATOM 1057 O ASN A 71 46.393 51.799 39.490 1.00 26.54 O ATOM 1058 CB ASN A 71 45.256 52.187 36.884 1.00 27.00 C ATOM 1059 CG ASN A 71 43.865 52.610 37.261 1.00 27.57 C ATOM 1060 OD1 ASN A 71 43.313 52.140 38.256 1.00 26.09 O ATOM 1061 ND2 ASN A 71 43.282 53.505 36.468 1.00 27.85 N ATOM 1062 HA ASN A 71 46.586 50.503 37.040 1.00 0.00 H ATOM 1063 HB2 ASN A 71 45.962 52.920 37.274 1.00 0.00 H ATOM 1064 HB3 ASN A 71 45.329 52.156 35.797 1.00 0.00 H ATOM 1065 HD22 ASN A 71 43.789 53.873 35.638 1.00 0.00 H ATOM 1066 HD21 ASN A 71 42.319 53.837 36.678 1.00 0.00 H ATOM 1067 H ASN A 71 43.715 49.780 37.472 1.00 0.00 H ATOM 1068 N GLY A 72 45.159 49.933 39.673 1.00 24.28 N ATOM 1069 CA GLY A 72 45.236 49.885 41.124 1.00 23.12 C ATOM 1070 C GLY A 72 44.106 50.537 41.899 1.00 21.87 C ATOM 1071 O GLY A 72 44.104 50.492 43.123 1.00 21.47 O ATOM 1072 HA3 GLY A 72 46.163 50.376 41.420 1.00 0.00 H ATOM 1073 HA2 GLY A 72 45.272 48.836 41.416 1.00 0.00 H ATOM 1074 H GLY A 72 44.621 49.197 39.173 1.00 0.00 H ATOM 1075 N THR A 73 43.143 51.151 41.222 1.00 20.54 N ATOM 1076 CA THR A 73 42.059 51.800 41.954 1.00 19.86 C ATOM 1077 C THR A 73 40.726 51.086 41.810 1.00 19.25 C ATOM 1078 O THR A 73 39.760 51.469 42.461 1.00 19.59 O ATOM 1079 CB THR A 73 41.866 53.265 41.497 1.00 20.07 C ATOM 1080 OG1 THR A 73 41.491 53.308 40.114 1.00 20.71 O ATOM 1081 CG2 THR A 73 43.166 54.040 41.567 1.00 20.59 C ATOM 1082 HA THR A 73 42.364 51.762 43.000 1.00 0.00 H ATOM 1083 HB THR A 73 41.107 53.692 42.153 1.00 0.00 H ATOM 1084 HG1 THR A 73 42.202 52.889 39.567 1.00 0.00 H ATOM 1085 HG23 THR A 73 43.523 54.055 42.597 1.00 0.00 H ATOM 1086 HG21 THR A 73 43.909 53.559 40.930 1.00 0.00 H ATOM 1087 HG22 THR A 73 42.998 55.061 41.224 1.00 0.00 H ATOM 1088 H THR A 73 43.161 51.170 40.182 1.00 0.00 H ATOM 1089 N GLY A 74 40.670 50.058 40.966 1.00 18.41 N ATOM 1090 CA GLY A 74 39.408 49.395 40.671 1.00 17.97 C ATOM 1091 C GLY A 74 39.180 48.047 41.325 1.00 18.11 C ATOM 1092 O GLY A 74 39.812 47.696 42.321 1.00 17.62 O ATOM 1093 HA3 GLY A 74 39.353 49.253 39.592 1.00 0.00 H ATOM 1094 HA2 GLY A 74 38.604 50.058 40.990 1.00 0.00 H ATOM 1095 H GLY A 74 41.542 49.723 40.510 1.00 0.00 H ATOM 1096 N GLY A 75 38.270 47.286 40.731 1.00 17.85 N ATOM 1097 CA GLY A 75 37.867 45.999 41.261 1.00 17.53 C ATOM 1098 C GLY A 75 36.459 46.086 41.819 1.00 17.46 C ATOM 1099 O GLY A 75 35.950 47.176 42.109 1.00 17.83 O ATOM 1100 HA3 GLY A 75 38.553 45.704 42.055 1.00 0.00 H ATOM 1101 HA2 GLY A 75 37.895 45.255 40.464 1.00 0.00 H ATOM 1102 H GLY A 75 37.830 47.626 39.852 1.00 0.00 H ATOM 1103 N LYS A 76 35.810 44.933 41.949 1.00 17.15 N ATOM 1104 CA LYS A 76 34.466 44.865 42.500 1.00 16.79 C ATOM 1105 C LYS A 76 34.226 43.454 43.008 1.00 15.75 C ATOM 1106 O LYS A 76 34.901 42.519 42.583 1.00 15.29 O ATOM 1107 CB LYS A 76 33.418 45.228 41.440 1.00 17.74 C ATOM 1108 CG LYS A 76 33.384 44.301 40.244 1.00 19.68 C ATOM 1109 CD LYS A 76 32.296 44.732 39.269 1.00 23.51 C ATOM 1110 CE LYS A 76 32.211 43.800 38.080 1.00 25.19 C ATOM 1111 NZ LYS A 76 33.428 43.852 37.227 1.00 27.33 N ATOM 1112 HA LYS A 76 34.374 45.582 43.316 1.00 0.00 H ATOM 1113 HB2 LYS A 76 32.436 45.210 41.912 1.00 0.00 H ATOM 1114 HB3 LYS A 76 33.630 46.236 41.083 1.00 0.00 H ATOM 1115 HG2 LYS A 76 34.350 44.329 39.740 1.00 0.00 H ATOM 1116 HG3 LYS A 76 33.181 43.285 40.582 1.00 0.00 H ATOM 1117 HD2 LYS A 76 31.337 44.733 39.787 1.00 0.00 H ATOM 1118 HD3 LYS A 76 32.517 45.739 38.914 1.00 0.00 H ATOM 1119 HE2 LYS A 76 31.348 44.081 37.476 1.00 0.00 H ATOM 1120 HE3 LYS A 76 32.082 42.780 38.443 1.00 0.00 H ATOM 1121 HZ1 LYS A 76 33.557 44.819 36.868 1.00 0.00 H ATOM 1122 HZ2 LYS A 76 34.257 43.577 37.791 1.00 0.00 H ATOM 1123 HZ3 LYS A 76 33.318 43.196 36.428 1.00 0.00 H ATOM 1124 H LYS A 76 36.277 44.054 41.648 1.00 0.00 H ATOM 1125 N SER A 77 33.272 43.301 43.917 1.00 15.19 N ATOM 1126 CA SER A 77 32.965 41.995 44.490 1.00 14.65 C ATOM 1127 C SER A 77 31.775 41.349 43.776 1.00 14.63 C ATOM 1128 O SER A 77 31.147 41.971 42.911 1.00 15.15 O ATOM 1129 CB SER A 77 32.684 42.104 45.993 1.00 14.68 C ATOM 1130 OG SER A 77 31.360 42.563 46.265 1.00 16.06 O ATOM 1131 HA SER A 77 33.840 41.360 44.349 1.00 0.00 H ATOM 1132 HB2 SER A 77 33.395 42.803 46.433 1.00 0.00 H ATOM 1133 HB3 SER A 77 32.815 41.121 46.446 1.00 0.00 H ATOM 1134 HG SER A 77 31.234 43.459 45.863 1.00 0.00 H ATOM 1135 H SER A 77 32.730 44.132 44.229 1.00 0.00 H ATOM 1136 N ILE A 78 31.490 40.100 44.136 1.00 14.35 N ATOM 1137 CA ILE A 78 30.362 39.369 43.552 1.00 14.62 C ATOM 1138 C ILE A 78 29.050 39.814 44.195 1.00 15.76 C ATOM 1139 O ILE A 78 27.976 39.446 43.726 1.00 15.65 O ATOM 1140 CB ILE A 78 30.539 37.825 43.682 1.00 14.38 C ATOM 1141 CG1 ILE A 78 30.544 37.380 45.142 1.00 13.83 C ATOM 1142 CG2 ILE A 78 31.816 37.382 42.965 1.00 14.43 C ATOM 1143 CD1 ILE A 78 30.485 35.884 45.322 1.00 14.12 C ATOM 1144 HA ILE A 78 30.334 39.605 42.488 1.00 0.00 H ATOM 1145 HB ILE A 78 29.685 37.343 43.205 1.00 0.00 H ATOM 1146 HG12 ILE A 78 31.457 37.747 45.610 1.00 0.00 H ATOM 1147 HG13 ILE A 78 29.680 37.821 45.639 1.00 0.00 H ATOM 1148 HD11 ILE A 78 29.571 35.501 44.869 1.00 0.00 H ATOM 1149 HD12 ILE A 78 31.350 35.427 44.841 1.00 0.00 H ATOM 1150 HD13 ILE A 78 30.492 35.647 46.386 1.00 0.00 H ATOM 1151 HG21 ILE A 78 31.750 37.648 41.910 1.00 0.00 H ATOM 1152 HG22 ILE A 78 32.675 37.881 43.414 1.00 0.00 H ATOM 1153 HG23 ILE A 78 31.930 36.302 43.062 1.00 0.00 H ATOM 1154 H ILE A 78 32.083 39.631 44.850 1.00 0.00 H ATOM 1155 N TYR A 79 29.143 40.590 45.270 1.00 16.24 N ATOM 1156 CA TYR A 79 27.962 41.074 45.990 1.00 17.52 C ATOM 1157 C TYR A 79 27.586 42.494 45.604 1.00 18.66 C ATOM 1158 O TYR A 79 26.554 43.009 46.050 1.00 20.12 O ATOM 1159 CB TYR A 79 28.216 41.050 47.495 1.00 17.00 C ATOM 1160 CG TYR A 79 28.777 39.741 47.985 1.00 16.25 C ATOM 1161 CD1 TYR A 79 30.092 39.646 48.423 1.00 14.36 C ATOM 1162 CD2 TYR A 79 28.000 38.596 48.000 1.00 15.82 C ATOM 1163 CE1 TYR A 79 30.608 38.446 48.860 1.00 14.10 C ATOM 1164 CE2 TYR A 79 28.504 37.395 48.433 1.00 15.57 C ATOM 1165 CZ TYR A 79 29.812 37.316 48.860 1.00 14.94 C ATOM 1166 OH TYR A 79 30.296 36.103 49.301 1.00 14.79 O ATOM 1167 HA TYR A 79 27.143 40.408 45.718 1.00 0.00 H ATOM 1168 HB3 TYR A 79 27.272 41.236 48.008 1.00 0.00 H ATOM 1169 HB2 TYR A 79 28.923 41.843 47.739 1.00 0.00 H ATOM 1170 HD2 TYR A 79 26.966 38.649 47.661 1.00 0.00 H ATOM 1171 HE2 TYR A 79 27.872 36.507 48.439 1.00 0.00 H ATOM 1172 HE1 TYR A 79 31.640 38.388 49.205 1.00 0.00 H ATOM 1173 HD1 TYR A 79 30.724 40.534 48.421 1.00 0.00 H ATOM 1174 HH TYR A 79 31.243 36.206 49.572 1.00 0.00 H ATOM 1175 H TYR A 79 30.086 40.863 45.612 1.00 0.00 H ATOM 1176 N GLY A 80 28.438 43.125 44.810 1.00 19.79 N ATOM 1177 CA GLY A 80 28.260 44.507 44.407 1.00 20.39 C ATOM 1178 C GLY A 80 29.603 45.212 44.427 1.00 20.86 C ATOM 1179 O GLY A 80 30.656 44.570 44.471 1.00 20.70 O ATOM 1180 HA3 GLY A 80 27.578 45.003 45.097 1.00 0.00 H ATOM 1181 HA2 GLY A 80 27.845 44.542 43.400 1.00 0.00 H ATOM 1182 H GLY A 80 29.270 42.608 44.461 1.00 0.00 H ATOM 1183 N GLU A 81 29.579 46.538 44.417 1.00 21.17 N ATOM 1184 CA GLU A 81 30.803 47.322 44.373 1.00 21.64 C ATOM 1185 C GLU A 81 31.737 47.057 45.558 1.00 20.63 C ATOM 1186 O GLU A 81 32.954 46.920 45.385 1.00 20.91 O ATOM 1187 CB GLU A 81 30.457 48.806 44.331 1.00 22.09 C ATOM 1188 CG GLU A 81 31.612 49.691 43.904 1.00 25.86 C ATOM 1189 CD GLU A 81 31.721 49.842 42.394 1.00 29.02 C ATOM 1190 OE1 GLU A 81 32.010 50.966 41.937 1.00 33.57 O ATOM 1191 OE2 GLU A 81 31.513 48.850 41.662 1.00 31.07 O ATOM 1192 HA GLU A 81 31.336 47.019 43.472 1.00 0.00 H ATOM 1193 HB2 GLU A 81 29.636 48.948 43.628 1.00 0.00 H ATOM 1194 HB3 GLU A 81 30.138 49.113 45.327 1.00 0.00 H ATOM 1195 HG2 GLU A 81 31.473 50.679 44.343 1.00 0.00 H ATOM 1196 HG3 GLU A 81 32.539 49.256 44.277 1.00 0.00 H ATOM 1197 H GLU A 81 28.663 47.029 44.441 1.00 0.00 H ATOM 1198 N LYS A 82 31.166 47.001 46.755 1.00 19.54 N ATOM 1199 CA LYS A 82 31.943 46.797 47.968 1.00 19.30 C ATOM 1200 C LYS A 82 31.150 45.940 48.937 1.00 17.95 C ATOM 1201 O LYS A 82 29.929 45.838 48.818 1.00 18.68 O ATOM 1202 CB LYS A 82 32.236 48.141 48.654 1.00 19.85 C ATOM 1203 CG LYS A 82 32.948 49.186 47.807 1.00 23.20 C ATOM 1204 CD LYS A 82 32.880 50.568 48.470 1.00 27.15 C ATOM 1205 CE LYS A 82 33.508 51.672 47.616 1.00 28.81 C ATOM 1206 NZ LYS A 82 33.325 53.043 48.190 1.00 31.06 N ATOM 1207 HA LYS A 82 32.880 46.311 47.696 1.00 0.00 H ATOM 1208 HB2 LYS A 82 31.285 48.565 48.976 1.00 0.00 H ATOM 1209 HB3 LYS A 82 32.857 47.941 49.527 1.00 0.00 H ATOM 1210 HG2 LYS A 82 33.993 48.898 47.688 1.00 0.00 H ATOM 1211 HG3 LYS A 82 32.472 49.236 46.827 1.00 0.00 H ATOM 1212 HD2 LYS A 82 31.834 50.818 48.647 1.00 0.00 H ATOM 1213 HD3 LYS A 82 33.407 50.523 49.423 1.00 0.00 H ATOM 1214 HE2 LYS A 82 33.050 51.647 46.627 1.00 0.00 H ATOM 1215 HE3 LYS A 82 34.576 51.474 47.526 1.00 0.00 H ATOM 1216 HZ1 LYS A 82 32.309 53.250 48.273 1.00 0.00 H ATOM 1217 HZ2 LYS A 82 33.766 53.085 49.131 1.00 0.00 H ATOM 1218 HZ3 LYS A 82 33.773 53.742 47.564 1.00 0.00 H ATOM 1219 H LYS A 82 30.134 47.106 46.828 1.00 0.00 H ATOM 1220 N PHE A 83 31.834 45.318 49.891 1.00 16.06 N ATOM 1221 CA PHE A 83 31.145 44.617 50.972 1.00 15.12 C ATOM 1222 C PHE A 83 31.886 44.793 52.289 1.00 14.94 C ATOM 1223 O PHE A 83 33.051 45.203 52.318 1.00 14.21 O ATOM 1224 CB PHE A 83 30.843 43.148 50.653 1.00 15.07 C ATOM 1225 CG PHE A 83 32.049 42.268 50.526 1.00 13.36 C ATOM 1226 CD1 PHE A 83 32.362 41.352 51.519 1.00 14.29 C ATOM 1227 CD2 PHE A 83 32.826 42.303 49.385 1.00 13.56 C ATOM 1228 CE1 PHE A 83 33.457 40.515 51.386 1.00 14.17 C ATOM 1229 CE2 PHE A 83 33.922 41.466 49.250 1.00 13.27 C ATOM 1230 CZ PHE A 83 34.232 40.576 50.252 1.00 13.39 C ATOM 1231 HA PHE A 83 30.165 45.083 51.078 1.00 0.00 H ATOM 1232 HB2 PHE A 83 30.216 42.750 51.451 1.00 0.00 H ATOM 1233 HB3 PHE A 83 30.296 43.112 49.711 1.00 0.00 H ATOM 1234 HD2 PHE A 83 32.575 42.996 48.582 1.00 0.00 H ATOM 1235 HE2 PHE A 83 34.537 41.513 48.352 1.00 0.00 H ATOM 1236 HZ PHE A 83 35.094 39.917 50.147 1.00 0.00 H ATOM 1237 HE1 PHE A 83 33.704 39.809 52.179 1.00 0.00 H ATOM 1238 HD1 PHE A 83 31.740 41.290 52.412 1.00 0.00 H ATOM 1239 H PHE A 83 32.874 45.330 49.868 1.00 0.00 H ATOM 1240 N GLU A 84 31.180 44.510 53.373 1.00 14.64 N ATOM 1241 CA GLU A 84 31.665 44.747 54.725 1.00 14.67 C ATOM 1242 C GLU A 84 32.820 43.849 55.168 1.00 14.03 C ATOM 1243 O GLU A 84 33.066 42.790 54.581 1.00 14.03 O ATOM 1244 CB GLU A 84 30.494 44.599 55.706 1.00 15.24 C ATOM 1245 CG GLU A 84 30.031 43.168 55.948 1.00 16.18 C ATOM 1246 CD GLU A 84 29.156 42.581 54.842 1.00 18.25 C ATOM 1247 OE1 GLU A 84 28.718 41.419 55.004 1.00 20.51 O ATOM 1248 OE2 GLU A 84 28.897 43.245 53.826 1.00 18.93 O ATOM 1249 HA GLU A 84 32.072 45.758 54.725 1.00 0.00 H ATOM 1250 HB2 GLU A 84 30.799 45.022 56.663 1.00 0.00 H ATOM 1251 HB3 GLU A 84 29.650 45.165 55.313 1.00 0.00 H ATOM 1252 HG2 GLU A 84 30.915 42.538 56.051 1.00 0.00 H ATOM 1253 HG3 GLU A 84 29.462 43.148 56.877 1.00 0.00 H ATOM 1254 H GLU A 84 30.233 44.098 53.253 1.00 0.00 H ATOM 1255 N ASP A 85 33.527 44.302 56.203 1.00 13.59 N ATOM 1256 CA ASP A 85 34.558 43.495 56.842 1.00 13.47 C ATOM 1257 C ASP A 85 33.838 42.396 57.615 1.00 13.61 C ATOM 1258 O ASP A 85 33.098 42.662 58.572 1.00 13.67 O ATOM 1259 CB ASP A 85 35.410 44.337 57.790 1.00 13.36 C ATOM 1260 CG ASP A 85 36.282 45.327 57.061 1.00 13.72 C ATOM 1261 OD1 ASP A 85 36.361 46.500 57.506 1.00 13.14 O ATOM 1262 OD2 ASP A 85 36.919 45.029 56.027 1.00 12.73 O ATOM 1263 HA ASP A 85 35.233 43.078 56.094 1.00 0.00 H ATOM 1264 HB2 ASP A 85 34.748 44.883 58.463 1.00 0.00 H ATOM 1265 HB3 ASP A 85 36.048 43.671 58.371 1.00 0.00 H ATOM 1266 H ASP A 85 33.337 45.258 56.565 1.00 0.00 H ATOM 1267 N GLU A 86 34.055 41.156 57.196 1.00 13.32 N ATOM 1268 CA GLU A 86 33.360 40.003 57.771 1.00 13.19 C ATOM 1269 C GLU A 86 33.668 39.775 59.243 1.00 13.81 C ATOM 1270 O GLU A 86 32.764 39.748 60.081 1.00 14.32 O ATOM 1271 CB GLU A 86 33.709 38.753 56.975 1.00 13.22 C ATOM 1272 CG GLU A 86 32.899 37.544 57.386 1.00 13.01 C ATOM 1273 CD GLU A 86 32.835 36.496 56.299 1.00 13.31 C ATOM 1274 OE1 GLU A 86 33.576 36.604 55.299 1.00 11.43 O ATOM 1275 OE2 GLU A 86 32.052 35.529 56.450 1.00 13.42 O ATOM 1276 HA GLU A 86 32.293 40.219 57.710 1.00 0.00 H ATOM 1277 HB2 GLU A 86 33.526 38.951 55.919 1.00 0.00 H ATOM 1278 HB3 GLU A 86 34.766 38.530 57.124 1.00 0.00 H ATOM 1279 HG2 GLU A 86 33.354 37.102 58.272 1.00 0.00 H ATOM 1280 HG3 GLU A 86 31.885 37.866 57.622 1.00 0.00 H ATOM 1281 H GLU A 86 34.743 40.998 56.432 1.00 0.00 H ATOM 1282 N ASN A 87 34.946 39.578 59.546 1.00 13.66 N ATOM 1283 CA ASN A 87 35.423 39.433 60.907 1.00 13.79 C ATOM 1284 C ASN A 87 36.935 39.578 60.856 1.00 14.44 C ATOM 1285 O ASN A 87 37.519 39.616 59.768 1.00 14.28 O ATOM 1286 CB ASN A 87 34.987 38.104 61.555 1.00 14.17 C ATOM 1287 CG ASN A 87 35.583 36.879 60.882 1.00 13.89 C ATOM 1288 OD1 ASN A 87 36.797 36.715 60.821 1.00 14.42 O ATOM 1289 ND2 ASN A 87 34.719 35.979 60.408 1.00 13.77 N ATOM 1290 HA ASN A 87 34.982 40.201 61.543 1.00 0.00 H ATOM 1291 HB2 ASN A 87 35.298 38.110 62.600 1.00 0.00 H ATOM 1292 HB3 ASN A 87 33.901 38.033 61.501 1.00 0.00 H ATOM 1293 HD22 ASN A 87 33.696 36.153 60.478 1.00 0.00 H ATOM 1294 HD21 ASN A 87 35.069 35.103 59.969 1.00 0.00 H ATOM 1295 H ASN A 87 35.637 39.525 58.770 1.00 0.00 H ATOM 1296 N PHE A 88 37.563 39.685 62.020 1.00 14.72 N ATOM 1297 CA PHE A 88 39.013 39.795 62.100 1.00 15.31 C ATOM 1298 C PHE A 88 39.577 38.668 62.977 1.00 15.96 C ATOM 1299 O PHE A 88 40.526 38.862 63.731 1.00 16.56 O ATOM 1300 CB PHE A 88 39.400 41.174 62.640 1.00 15.29 C ATOM 1301 CG PHE A 88 39.019 42.306 61.727 1.00 15.33 C ATOM 1302 CD1 PHE A 88 39.697 42.505 60.537 1.00 14.36 C ATOM 1303 CD2 PHE A 88 37.971 43.156 62.040 1.00 15.88 C ATOM 1304 CE1 PHE A 88 39.347 43.537 59.686 1.00 14.89 C ATOM 1305 CE2 PHE A 88 37.624 44.199 61.196 1.00 16.22 C ATOM 1306 CZ PHE A 88 38.313 44.389 60.018 1.00 16.45 C ATOM 1307 HA PHE A 88 39.443 39.690 61.104 1.00 0.00 H ATOM 1308 HB2 PHE A 88 38.902 41.321 63.598 1.00 0.00 H ATOM 1309 HB3 PHE A 88 40.480 41.197 62.786 1.00 0.00 H ATOM 1310 HD2 PHE A 88 37.412 43.002 62.963 1.00 0.00 H ATOM 1311 HE2 PHE A 88 36.807 44.869 61.464 1.00 0.00 H ATOM 1312 HZ PHE A 88 38.043 45.208 59.352 1.00 0.00 H ATOM 1313 HE1 PHE A 88 39.889 43.678 58.751 1.00 0.00 H ATOM 1314 HD1 PHE A 88 40.517 41.840 60.267 1.00 0.00 H ATOM 1315 H PHE A 88 37.005 39.690 62.898 1.00 0.00 H ATOM 1316 N ILE A 89 38.988 37.480 62.859 1.00 16.29 N ATOM 1317 CA ILE A 89 39.394 36.339 63.668 1.00 16.68 C ATOM 1318 C ILE A 89 40.823 35.910 63.364 1.00 16.32 C ATOM 1319 O ILE A 89 41.613 35.635 64.277 1.00 17.07 O ATOM 1320 CB ILE A 89 38.431 35.164 63.435 1.00 16.88 C ATOM 1321 CG1 ILE A 89 37.090 35.472 64.103 1.00 18.19 C ATOM 1322 CG2 ILE A 89 39.052 33.858 63.940 1.00 18.02 C ATOM 1323 CD1 ILE A 89 36.046 34.392 63.928 1.00 19.82 C ATOM 1324 HA ILE A 89 39.356 36.642 64.714 1.00 0.00 H ATOM 1325 HB ILE A 89 38.251 35.032 62.368 1.00 0.00 H ATOM 1326 HG12 ILE A 89 37.263 35.610 65.170 1.00 0.00 H ATOM 1327 HG13 ILE A 89 36.700 36.396 63.677 1.00 0.00 H ATOM 1328 HD11 ILE A 89 35.849 34.248 62.866 1.00 0.00 H ATOM 1329 HD12 ILE A 89 36.412 33.461 64.360 1.00 0.00 H ATOM 1330 HD13 ILE A 89 35.127 34.691 64.432 1.00 0.00 H ATOM 1331 HG21 ILE A 89 39.982 33.668 63.404 1.00 0.00 H ATOM 1332 HG22 ILE A 89 39.258 33.944 65.007 1.00 0.00 H ATOM 1333 HG23 ILE A 89 38.357 33.036 63.767 1.00 0.00 H ATOM 1334 H ILE A 89 38.217 37.364 62.171 1.00 0.00 H ATOM 1335 N LEU A 90 41.160 35.855 62.081 1.00 15.55 N ATOM 1336 CA LEU A 90 42.488 35.417 61.668 1.00 15.14 C ATOM 1337 C LEU A 90 43.476 36.573 61.604 1.00 14.90 C ATOM 1338 O LEU A 90 43.109 37.705 61.304 1.00 14.46 O ATOM 1339 CB LEU A 90 42.397 34.696 60.331 1.00 15.16 C ATOM 1340 CG LEU A 90 41.495 33.462 60.402 1.00 16.48 C ATOM 1341 CD1 LEU A 90 41.255 32.910 59.025 1.00 16.97 C ATOM 1342 CD2 LEU A 90 42.121 32.409 61.304 1.00 18.26 C ATOM 1343 HA LEU A 90 42.867 34.725 62.420 1.00 0.00 H ATOM 1344 HB2 LEU A 90 41.994 35.384 59.587 1.00 0.00 H ATOM 1345 HB3 LEU A 90 43.397 34.384 60.031 1.00 0.00 H ATOM 1346 HG LEU A 90 40.533 33.751 60.825 1.00 0.00 H ATOM 1347 HD21 LEU A 90 43.093 32.120 60.903 1.00 0.00 H ATOM 1348 HD22 LEU A 90 42.247 32.819 62.306 1.00 0.00 H ATOM 1349 HD23 LEU A 90 41.470 31.536 61.347 1.00 0.00 H ATOM 1350 HD11 LEU A 90 40.772 33.669 58.410 1.00 0.00 H ATOM 1351 HD12 LEU A 90 42.208 32.629 58.576 1.00 0.00 H ATOM 1352 HD13 LEU A 90 40.612 32.033 59.094 1.00 0.00 H ATOM 1353 H LEU A 90 40.465 36.129 61.358 1.00 0.00 H ATOM 1354 N LYS A 91 44.736 36.270 61.888 1.00 14.82 N ATOM 1355 CA LYS A 91 45.784 37.280 61.907 1.00 14.45 C ATOM 1356 C LYS A 91 46.818 37.070 60.813 1.00 13.62 C ATOM 1357 O LYS A 91 46.912 35.997 60.213 1.00 13.43 O ATOM 1358 CB LYS A 91 46.502 37.274 63.260 1.00 15.15 C ATOM 1359 CG LYS A 91 45.598 37.504 64.441 1.00 18.41 C ATOM 1360 CD LYS A 91 46.412 37.542 65.719 1.00 22.34 C ATOM 1361 CE LYS A 91 45.567 37.963 66.901 1.00 24.51 C ATOM 1362 NZ LYS A 91 45.085 39.358 66.760 1.00 26.45 N ATOM 1363 HA LYS A 91 45.293 38.238 61.735 1.00 0.00 H ATOM 1364 HB2 LYS A 91 46.988 36.306 63.385 1.00 0.00 H ATOM 1365 HB3 LYS A 91 47.257 38.060 63.250 1.00 0.00 H ATOM 1366 HG2 LYS A 91 45.076 38.453 64.317 1.00 0.00 H ATOM 1367 HG3 LYS A 91 44.869 36.695 64.501 1.00 0.00 H ATOM 1368 HD2 LYS A 91 46.819 36.549 65.910 1.00 0.00 H ATOM 1369 HD3 LYS A 91 47.230 38.252 65.597 1.00 0.00 H ATOM 1370 HE2 LYS A 91 46.165 37.885 67.809 1.00 0.00 H ATOM 1371 HE3 LYS A 91 44.707 37.297 66.976 1.00 0.00 H ATOM 1372 HZ1 LYS A 91 45.900 40.000 66.694 1.00 0.00 H ATOM 1373 HZ2 LYS A 91 44.508 39.439 65.899 1.00 0.00 H ATOM 1374 HZ3 LYS A 91 44.510 39.610 67.589 1.00 0.00 H ATOM 1375 H LYS A 91 44.982 35.283 62.103 1.00 0.00 H ATOM 1376 N HIS A 92 47.601 38.116 60.576 1.00 12.48 N ATOM 1377 CA HIS A 92 48.665 38.099 59.580 1.00 12.60 C ATOM 1378 C HIS A 92 49.914 37.535 60.257 1.00 13.54 C ATOM 1379 O HIS A 92 50.811 38.283 60.653 1.00 14.57 O ATOM 1380 CB HIS A 92 48.925 39.524 59.059 1.00 12.28 C ATOM 1381 CG HIS A 92 47.739 40.165 58.399 1.00 10.74 C ATOM 1382 ND1 HIS A 92 46.723 40.774 59.107 1.00 9.59 N ATOM 1383 CD2 HIS A 92 47.429 40.324 57.089 1.00 10.54 C ATOM 1384 CE1 HIS A 92 45.822 41.253 58.262 1.00 8.94 C ATOM 1385 NE2 HIS A 92 46.243 41.022 57.032 1.00 9.43 N ATOM 1386 HA HIS A 92 48.387 37.482 58.725 1.00 0.00 H ATOM 1387 HB2 HIS A 92 49.225 40.147 59.902 1.00 0.00 H ATOM 1388 HB3 HIS A 92 49.738 39.480 58.334 1.00 0.00 H ATOM 1389 HD2 HIS A 92 48.010 39.966 56.239 1.00 0.00 H ATOM 1390 HE1 HIS A 92 44.892 41.752 58.535 1.00 0.00 H ATOM 1391 H HIS A 92 47.448 38.986 61.125 1.00 0.00 H ATOM 1392 N THR A 93 49.968 36.213 60.381 1.00 14.17 N ATOM 1393 CA THR A 93 50.998 35.551 61.190 1.00 14.69 C ATOM 1394 C THR A 93 52.338 35.282 60.529 1.00 14.26 C ATOM 1395 O THR A 93 53.313 34.983 61.227 1.00 15.34 O ATOM 1396 CB THR A 93 50.472 34.219 61.701 1.00 15.18 C ATOM 1397 OG1 THR A 93 49.964 33.457 60.598 1.00 16.70 O ATOM 1398 CG2 THR A 93 49.282 34.417 62.614 1.00 16.46 C ATOM 1399 HA THR A 93 51.198 36.279 61.976 1.00 0.00 H ATOM 1400 HB THR A 93 51.294 33.727 62.220 1.00 0.00 H ATOM 1401 HG1 THR A 93 50.691 33.299 59.945 1.00 0.00 H ATOM 1402 HG23 THR A 93 49.587 34.994 63.487 1.00 0.00 H ATOM 1403 HG21 THR A 93 48.499 34.954 62.078 1.00 0.00 H ATOM 1404 HG22 THR A 93 48.905 33.445 62.933 1.00 0.00 H ATOM 1405 H THR A 93 49.260 35.631 59.890 1.00 0.00 H ATOM 1406 N GLY A 94 52.406 35.366 59.210 1.00 13.46 N ATOM 1407 CA GLY A 94 53.645 35.108 58.508 1.00 12.91 C ATOM 1408 C GLY A 94 53.477 35.030 57.010 1.00 12.59 C ATOM 1409 O GLY A 94 52.413 35.330 56.471 1.00 11.79 O ATOM 1410 HA3 GLY A 94 54.052 34.160 58.861 1.00 0.00 H ATOM 1411 HA2 GLY A 94 54.346 35.911 58.737 1.00 0.00 H ATOM 1412 H GLY A 94 51.555 35.622 58.669 1.00 0.00 H ATOM 1413 N PRO A 95 54.536 34.597 56.338 1.00 12.08 N ATOM 1414 CA PRO A 95 54.526 34.441 54.884 1.00 11.83 C ATOM 1415 C PRO A 95 53.424 33.511 54.388 1.00 11.48 C ATOM 1416 O PRO A 95 53.165 32.474 55.015 1.00 12.59 O ATOM 1417 CB PRO A 95 55.897 33.810 54.587 1.00 12.25 C ATOM 1418 CG PRO A 95 56.739 34.160 55.751 1.00 11.98 C ATOM 1419 CD PRO A 95 55.818 34.178 56.925 1.00 12.24 C ATOM 1420 HA PRO A 95 54.343 35.394 54.387 1.00 0.00 H ATOM 1421 HD3 PRO A 95 55.738 33.188 57.375 1.00 0.00 H ATOM 1422 HD2 PRO A 95 56.156 34.891 57.677 1.00 0.00 H ATOM 1423 HG3 PRO A 95 57.195 35.140 55.610 1.00 0.00 H ATOM 1424 HG2 PRO A 95 57.521 33.414 55.893 1.00 0.00 H ATOM 1425 HB2 PRO A 95 55.808 32.728 54.489 1.00 0.00 H ATOM 1426 HB3 PRO A 95 56.319 34.223 53.671 1.00 0.00 H ATOM 1427 N GLY A 96 52.801 33.873 53.271 1.00 10.80 N ATOM 1428 CA GLY A 96 51.768 33.058 52.659 1.00 10.30 C ATOM 1429 C GLY A 96 50.339 33.449 52.991 1.00 9.94 C ATOM 1430 O GLY A 96 49.416 32.904 52.395 1.00 10.16 O ATOM 1431 HA3 GLY A 96 51.918 32.028 52.983 1.00 0.00 H ATOM 1432 HA2 GLY A 96 51.890 33.119 51.578 1.00 0.00 H ATOM 1433 H GLY A 96 53.063 34.772 52.820 1.00 0.00 H ATOM 1434 N ILE A 97 50.142 34.363 53.933 1.00 8.75 N ATOM 1435 CA ILE A 97 48.801 34.786 54.323 1.00 9.37 C ATOM 1436 C ILE A 97 48.155 35.569 53.180 1.00 8.70 C ATOM 1437 O ILE A 97 48.807 36.411 52.549 1.00 8.63 O ATOM 1438 CB ILE A 97 48.881 35.643 55.604 1.00 9.73 C ATOM 1439 CG1 ILE A 97 49.145 34.751 56.826 1.00 11.73 C ATOM 1440 CG2 ILE A 97 47.623 36.518 55.773 1.00 11.54 C ATOM 1441 CD1 ILE A 97 47.975 33.894 57.251 1.00 14.54 C ATOM 1442 HA ILE A 97 48.184 33.912 54.531 1.00 0.00 H ATOM 1443 HB ILE A 97 49.722 36.330 55.513 1.00 0.00 H ATOM 1444 HG12 ILE A 97 49.980 34.092 56.591 1.00 0.00 H ATOM 1445 HG13 ILE A 97 49.416 35.394 57.663 1.00 0.00 H ATOM 1446 HD11 ILE A 97 47.131 34.535 57.506 1.00 0.00 H ATOM 1447 HD12 ILE A 97 47.696 33.231 56.432 1.00 0.00 H ATOM 1448 HD13 ILE A 97 48.258 33.301 58.120 1.00 0.00 H ATOM 1449 HG21 ILE A 97 47.527 37.184 54.915 1.00 0.00 H ATOM 1450 HG22 ILE A 97 46.743 35.878 55.838 1.00 0.00 H ATOM 1451 HG23 ILE A 97 47.712 37.108 56.685 1.00 0.00 H ATOM 1452 H ILE A 97 50.965 34.789 54.405 1.00 0.00 H ATOM 1453 N LEU A 98 46.877 35.279 52.928 1.00 8.05 N ATOM 1454 CA LEU A 98 46.082 35.936 51.895 1.00 8.14 C ATOM 1455 C LEU A 98 45.052 36.813 52.603 1.00 7.74 C ATOM 1456 O LEU A 98 44.295 36.331 53.437 1.00 7.29 O ATOM 1457 CB LEU A 98 45.390 34.863 51.042 1.00 8.67 C ATOM 1458 CG LEU A 98 44.567 35.309 49.839 1.00 10.64 C ATOM 1459 CD1 LEU A 98 45.403 36.048 48.827 1.00 12.54 C ATOM 1460 CD2 LEU A 98 43.899 34.078 49.199 1.00 11.46 C ATOM 1461 HA LEU A 98 46.701 36.548 51.239 1.00 0.00 H ATOM 1462 HB2 LEU A 98 46.168 34.196 50.671 1.00 0.00 H ATOM 1463 HB3 LEU A 98 44.722 34.309 51.701 1.00 0.00 H ATOM 1464 HG LEU A 98 43.802 36.005 50.184 1.00 0.00 H ATOM 1465 HD21 LEU A 98 44.668 33.375 48.877 1.00 0.00 H ATOM 1466 HD22 LEU A 98 43.249 33.598 49.930 1.00 0.00 H ATOM 1467 HD23 LEU A 98 43.309 34.393 48.338 1.00 0.00 H ATOM 1468 HD11 LEU A 98 45.835 36.934 49.292 1.00 0.00 H ATOM 1469 HD12 LEU A 98 46.201 35.396 48.472 1.00 0.00 H ATOM 1470 HD13 LEU A 98 44.775 36.347 47.987 1.00 0.00 H ATOM 1471 H LEU A 98 46.420 34.541 53.502 1.00 0.00 H ATOM 1472 N SER A 99 45.031 38.099 52.266 1.00 7.40 N ATOM 1473 CA SER A 99 44.213 39.061 52.977 1.00 7.89 C ATOM 1474 C SER A 99 43.609 40.075 52.015 1.00 7.42 C ATOM 1475 O SER A 99 44.105 40.260 50.893 1.00 7.41 O ATOM 1476 CB SER A 99 45.111 39.761 53.996 1.00 8.26 C ATOM 1477 OG SER A 99 44.399 40.670 54.813 1.00 9.40 O ATOM 1478 HA SER A 99 43.385 38.557 53.476 1.00 0.00 H ATOM 1479 HB2 SER A 99 45.888 40.307 53.461 1.00 0.00 H ATOM 1480 HB3 SER A 99 45.572 39.006 54.633 1.00 0.00 H ATOM 1481 HG SER A 99 45.023 41.095 55.453 1.00 0.00 H ATOM 1482 H SER A 99 45.617 38.423 51.471 1.00 0.00 H ATOM 1483 N MET A 100 42.534 40.737 52.438 1.00 7.24 N ATOM 1484 CA MET A 100 41.869 41.714 51.580 1.00 7.88 C ATOM 1485 C MET A 100 42.431 43.129 51.697 1.00 7.97 C ATOM 1486 O MET A 100 42.574 43.664 52.796 1.00 8.37 O ATOM 1487 CB MET A 100 40.374 41.785 51.926 1.00 8.15 C ATOM 1488 CG MET A 100 39.571 40.537 51.615 1.00 8.64 C ATOM 1489 SD MET A 100 39.578 40.161 49.852 1.00 9.93 S ATOM 1490 CE MET A 100 38.626 41.495 49.159 1.00 12.86 C ATOM 1491 HA MET A 100 42.041 41.366 50.561 1.00 0.00 H ATOM 1492 HB2 MET A 100 40.285 41.984 52.994 1.00 0.00 H ATOM 1493 HB3 MET A 100 39.939 42.613 51.366 1.00 0.00 H ATOM 1494 HG2 MET A 100 38.542 40.689 51.940 1.00 0.00 H ATOM 1495 HG3 MET A 100 40.001 39.695 52.158 1.00 0.00 H ATOM 1496 HE1 MET A 100 37.624 41.485 49.587 1.00 0.00 H ATOM 1497 HE2 MET A 100 39.111 42.444 49.389 1.00 0.00 H ATOM 1498 HE3 MET A 100 38.562 41.371 48.078 1.00 0.00 H ATOM 1499 H MET A 100 42.163 40.556 53.392 1.00 0.00 H ATOM 1500 N ALA A 101 42.724 43.738 50.550 1.00 7.73 N ATOM 1501 CA ALA A 101 43.076 45.150 50.491 1.00 8.03 C ATOM 1502 C ALA A 101 41.785 45.954 50.579 1.00 8.40 C ATOM 1503 O ALA A 101 40.727 45.449 50.237 1.00 8.93 O ATOM 1504 CB ALA A 101 43.790 45.453 49.203 1.00 8.25 C ATOM 1505 HA ALA A 101 43.742 45.411 51.313 1.00 0.00 H ATOM 1506 HB1 ALA A 101 44.699 44.855 49.144 1.00 0.00 H ATOM 1507 HB2 ALA A 101 43.139 45.211 48.363 1.00 0.00 H ATOM 1508 HB3 ALA A 101 44.047 46.512 49.172 1.00 0.00 H ATOM 1509 H ALA A 101 42.701 43.188 49.668 1.00 0.00 H ATOM 1510 N ASN A 102 41.869 47.197 51.036 1.00 9.04 N ATOM 1511 CA ASN A 102 40.683 48.024 51.162 1.00 9.36 C ATOM 1512 C ASN A 102 41.044 49.506 51.208 1.00 10.35 C ATOM 1513 O ASN A 102 42.215 49.870 51.196 1.00 10.41 O ATOM 1514 CB ASN A 102 39.855 47.606 52.379 1.00 9.42 C ATOM 1515 CG ASN A 102 40.575 47.833 53.693 1.00 10.33 C ATOM 1516 OD1 ASN A 102 41.022 48.940 53.994 1.00 12.12 O ATOM 1517 ND2 ASN A 102 40.694 46.776 54.491 1.00 11.09 N ATOM 1518 HA ASN A 102 40.068 47.870 50.275 1.00 0.00 H ATOM 1519 HB2 ASN A 102 38.931 48.183 52.385 1.00 0.00 H ATOM 1520 HB3 ASN A 102 39.619 46.546 52.291 1.00 0.00 H ATOM 1521 HD22 ASN A 102 40.302 45.858 54.200 1.00 0.00 H ATOM 1522 HD21 ASN A 102 41.179 46.868 55.407 1.00 0.00 H ATOM 1523 H ASN A 102 42.796 47.583 51.307 1.00 0.00 H ATOM 1524 N ALA A 103 40.020 50.349 51.209 1.00 11.14 N ATOM 1525 CA ALA A 103 40.213 51.798 51.269 1.00 12.24 C ATOM 1526 C ALA A 103 39.525 52.357 52.508 1.00 12.72 C ATOM 1527 O ALA A 103 39.002 53.498 52.501 1.00 13.35 O ATOM 1528 CB ALA A 103 39.681 52.452 50.022 1.00 12.50 C ATOM 1529 HA ALA A 103 41.280 52.013 51.333 1.00 0.00 H ATOM 1530 HB1 ALA A 103 40.210 52.059 49.153 1.00 0.00 H ATOM 1531 HB2 ALA A 103 38.616 52.239 49.928 1.00 0.00 H ATOM 1532 HB3 ALA A 103 39.833 53.529 50.085 1.00 0.00 H ATOM 1533 H ALA A 103 39.053 49.969 51.166 1.00 0.00 H ATOM 1534 N GLY A 104 39.548 51.570 53.577 1.00 13.09 N ATOM 1535 CA GLY A 104 38.923 51.936 54.835 1.00 13.52 C ATOM 1536 C GLY A 104 37.937 50.867 55.250 1.00 13.96 C ATOM 1537 O GLY A 104 37.729 49.897 54.522 1.00 13.17 O ATOM 1538 HA3 GLY A 104 38.399 52.885 54.716 1.00 0.00 H ATOM 1539 HA2 GLY A 104 39.689 52.039 55.603 1.00 0.00 H ATOM 1540 H GLY A 104 40.034 50.653 53.510 1.00 0.00 H ATOM 1541 N PRO A 105 37.332 51.020 56.419 1.00 14.60 N ATOM 1542 CA PRO A 105 36.376 50.030 56.907 1.00 14.66 C ATOM 1543 C PRO A 105 35.243 49.780 55.919 1.00 14.42 C ATOM 1544 O PRO A 105 34.715 50.695 55.285 1.00 14.75 O ATOM 1545 CB PRO A 105 35.856 50.662 58.201 1.00 15.12 C ATOM 1546 CG PRO A 105 36.939 51.571 58.625 1.00 15.34 C ATOM 1547 CD PRO A 105 37.498 52.140 57.362 1.00 15.19 C ATOM 1548 HA PRO A 105 36.829 49.049 57.052 1.00 0.00 H ATOM 1549 HD3 PRO A 105 36.935 53.016 57.039 1.00 0.00 H ATOM 1550 HD2 PRO A 105 38.548 52.407 57.479 1.00 0.00 H ATOM 1551 HG3 PRO A 105 37.707 51.021 59.169 1.00 0.00 H ATOM 1552 HG2 PRO A 105 36.544 52.365 59.259 1.00 0.00 H ATOM 1553 HB2 PRO A 105 34.936 51.217 58.017 1.00 0.00 H ATOM 1554 HB3 PRO A 105 35.674 49.899 58.958 1.00 0.00 H ATOM 1555 N ASN A 106 34.918 48.502 55.773 1.00 13.80 N ATOM 1556 CA ASN A 106 33.817 48.044 54.935 1.00 13.60 C ATOM 1557 C ASN A 106 33.877 48.496 53.486 1.00 12.84 C ATOM 1558 O ASN A 106 32.889 48.984 52.927 1.00 13.68 O ATOM 1559 CB ASN A 106 32.496 48.442 55.590 1.00 13.91 C ATOM 1560 CG ASN A 106 32.428 48.001 57.041 1.00 15.38 C ATOM 1561 OD1 ASN A 106 32.679 46.839 57.366 1.00 16.40 O ATOM 1562 ND2 ASN A 106 32.129 48.950 57.931 1.00 18.78 N ATOM 1563 HA ASN A 106 33.904 46.959 54.873 1.00 0.00 H ATOM 1564 HB2 ASN A 106 32.393 49.526 55.546 1.00 0.00 H ATOM 1565 HB3 ASN A 106 31.676 47.978 55.042 1.00 0.00 H ATOM 1566 HD22 ASN A 106 31.924 49.918 57.610 1.00 0.00 H ATOM 1567 HD21 ASN A 106 32.101 48.722 58.945 1.00 0.00 H ATOM 1568 H ASN A 106 35.478 47.790 56.283 1.00 0.00 H ATOM 1569 N THR A 107 35.046 48.335 52.864 1.00 12.20 N ATOM 1570 CA THR A 107 35.205 48.679 51.456 1.00 11.46 C ATOM 1571 C THR A 107 35.868 47.556 50.663 1.00 11.80 C ATOM 1572 O THR A 107 36.553 47.820 49.694 1.00 13.16 O ATOM 1573 CB THR A 107 36.001 49.983 51.244 1.00 11.73 C ATOM 1574 OG1 THR A 107 37.300 49.866 51.835 1.00 10.77 O ATOM 1575 CG2 THR A 107 35.342 51.169 51.950 1.00 11.69 C ATOM 1576 HA THR A 107 34.192 48.831 51.084 1.00 0.00 H ATOM 1577 HB THR A 107 36.043 50.145 50.167 1.00 0.00 H ATOM 1578 HG1 THR A 107 37.206 49.696 52.806 1.00 0.00 H ATOM 1579 HG23 THR A 107 34.340 51.319 51.547 1.00 0.00 H ATOM 1580 HG21 THR A 107 35.279 50.965 53.019 1.00 0.00 H ATOM 1581 HG22 THR A 107 35.939 52.066 51.785 1.00 0.00 H ATOM 1582 H THR A 107 35.858 47.958 53.393 1.00 0.00 H ATOM 1583 N ASN A 108 35.655 46.313 51.070 1.00 11.56 N ATOM 1584 CA ASN A 108 36.216 45.187 50.332 1.00 11.48 C ATOM 1585 C ASN A 108 35.612 45.061 48.948 1.00 11.59 C ATOM 1586 O ASN A 108 34.398 45.165 48.783 1.00 12.30 O ATOM 1587 CB ASN A 108 35.973 43.894 51.087 1.00 11.21 C ATOM 1588 CG ASN A 108 36.616 43.900 52.448 1.00 12.04 C ATOM 1589 OD1 ASN A 108 37.836 43.805 52.560 1.00 11.62 O ATOM 1590 ND2 ASN A 108 35.801 44.035 53.498 1.00 10.95 N ATOM 1591 HA ASN A 108 37.285 45.372 50.230 1.00 0.00 H ATOM 1592 HB2 ASN A 108 34.899 43.754 51.207 1.00 0.00 H ATOM 1593 HB3 ASN A 108 36.384 43.067 50.508 1.00 0.00 H ATOM 1594 HD22 ASN A 108 34.774 44.112 53.353 1.00 0.00 H ATOM 1595 HD21 ASN A 108 36.194 44.063 54.461 1.00 0.00 H ATOM 1596 H ASN A 108 35.084 46.139 51.922 1.00 0.00 H ATOM 1597 N GLY A 109 36.460 44.809 47.965 1.00 10.64 N ATOM 1598 CA GLY A 109 36.015 44.620 46.599 1.00 10.28 C ATOM 1599 C GLY A 109 36.616 43.324 46.093 1.00 10.08 C ATOM 1600 O GLY A 109 36.165 42.225 46.447 1.00 10.51 O ATOM 1601 HA3 GLY A 109 36.351 45.452 45.980 1.00 0.00 H ATOM 1602 HA2 GLY A 109 34.927 44.562 46.567 1.00 0.00 H ATOM 1603 H GLY A 109 37.476 44.745 48.179 1.00 0.00 H ATOM 1604 N SER A 110 37.652 43.453 45.280 1.00 9.64 N ATOM 1605 CA SER A 110 38.341 42.299 44.744 1.00 9.43 C ATOM 1606 C SER A 110 39.838 42.314 44.999 1.00 8.99 C ATOM 1607 O SER A 110 40.491 41.294 44.835 1.00 9.38 O ATOM 1608 CB SER A 110 38.091 42.178 43.249 1.00 9.41 C ATOM 1609 OG SER A 110 38.556 43.310 42.550 1.00 9.69 O ATOM 1610 HA SER A 110 37.932 41.437 45.271 1.00 0.00 H ATOM 1611 HB2 SER A 110 37.020 42.071 43.077 1.00 0.00 H ATOM 1612 HB3 SER A 110 38.608 41.294 42.874 1.00 0.00 H ATOM 1613 HG SER A 110 39.530 43.410 42.697 1.00 0.00 H ATOM 1614 H SER A 110 37.979 44.406 45.020 1.00 0.00 H ATOM 1615 N GLN A 111 40.402 43.456 45.377 1.00 8.41 N ATOM 1616 CA GLN A 111 41.845 43.520 45.563 1.00 7.99 C ATOM 1617 C GLN A 111 42.262 42.759 46.811 1.00 7.35 C ATOM 1618 O GLN A 111 41.581 42.787 47.828 1.00 7.63 O ATOM 1619 CB GLN A 111 42.326 44.964 45.610 1.00 8.51 C ATOM 1620 CG GLN A 111 42.243 45.651 44.268 1.00 8.41 C ATOM 1621 CD GLN A 111 43.018 46.953 44.221 1.00 11.14 C ATOM 1622 OE1 GLN A 111 44.127 47.035 44.749 1.00 11.70 O ATOM 1623 NE2 GLN A 111 42.456 47.964 43.556 1.00 11.41 N ATOM 1624 HA GLN A 111 42.319 43.042 44.706 1.00 0.00 H ATOM 1625 HB2 GLN A 111 41.710 45.514 46.322 1.00 0.00 H ATOM 1626 HB3 GLN A 111 43.363 44.975 45.944 1.00 0.00 H ATOM 1627 HG2 GLN A 111 42.644 44.980 43.508 1.00 0.00 H ATOM 1628 HG3 GLN A 111 41.196 45.861 44.049 1.00 0.00 H ATOM 1629 HE22 GLN A 111 41.516 47.846 43.127 1.00 0.00 H ATOM 1630 HE21 GLN A 111 42.958 48.870 43.467 1.00 0.00 H ATOM 1631 H GLN A 111 39.816 44.300 45.539 1.00 0.00 H ATOM 1632 N PHE A 112 43.393 42.077 46.706 1.00 7.32 N ATOM 1633 CA PHE A 112 43.907 41.223 47.763 1.00 7.38 C ATOM 1634 C PHE A 112 45.422 41.351 47.800 1.00 7.10 C ATOM 1635 O PHE A 112 46.036 41.880 46.883 1.00 6.55 O ATOM 1636 CB PHE A 112 43.556 39.763 47.427 1.00 7.45 C ATOM 1637 CG PHE A 112 44.180 39.293 46.148 1.00 7.89 C ATOM 1638 CD1 PHE A 112 43.554 39.494 44.926 1.00 9.69 C ATOM 1639 CD2 PHE A 112 45.442 38.728 46.156 1.00 9.72 C ATOM 1640 CE1 PHE A 112 44.160 39.105 43.746 1.00 9.67 C ATOM 1641 CE2 PHE A 112 46.048 38.338 44.984 1.00 10.05 C ATOM 1642 CZ PHE A 112 45.409 38.523 43.777 1.00 11.00 C ATOM 1643 HA PHE A 112 43.476 41.511 48.722 1.00 0.00 H ATOM 1644 HB2 PHE A 112 43.905 39.125 48.239 1.00 0.00 H ATOM 1645 HB3 PHE A 112 42.473 39.677 47.338 1.00 0.00 H ATOM 1646 HD2 PHE A 112 45.964 38.590 47.103 1.00 0.00 H ATOM 1647 HE2 PHE A 112 47.037 37.881 45.010 1.00 0.00 H ATOM 1648 HZ PHE A 112 45.890 38.210 42.850 1.00 0.00 H ATOM 1649 HE1 PHE A 112 43.652 39.258 42.794 1.00 0.00 H ATOM 1650 HD1 PHE A 112 42.571 39.965 44.896 1.00 0.00 H ATOM 1651 H PHE A 112 43.939 42.157 45.825 1.00 0.00 H ATOM 1652 N PHE A 113 46.045 40.810 48.838 1.00 7.15 N ATOM 1653 CA PHE A 113 47.493 40.786 48.870 1.00 7.37 C ATOM 1654 C PHE A 113 47.956 39.490 49.524 1.00 7.49 C ATOM 1655 O PHE A 113 47.222 38.883 50.301 1.00 7.36 O ATOM 1656 CB PHE A 113 48.090 42.038 49.527 1.00 7.49 C ATOM 1657 CG PHE A 113 47.678 42.261 50.957 1.00 7.24 C ATOM 1658 CD1 PHE A 113 46.472 42.873 51.258 1.00 6.74 C ATOM 1659 CD2 PHE A 113 48.507 41.888 52.004 1.00 8.80 C ATOM 1660 CE1 PHE A 113 46.099 43.080 52.574 1.00 7.46 C ATOM 1661 CE2 PHE A 113 48.131 42.097 53.321 1.00 9.41 C ATOM 1662 CZ PHE A 113 46.931 42.689 53.603 1.00 8.43 C ATOM 1663 HA PHE A 113 47.869 40.808 47.847 1.00 0.00 H ATOM 1664 HB2 PHE A 113 49.176 41.951 49.497 1.00 0.00 H ATOM 1665 HB3 PHE A 113 47.780 42.906 48.946 1.00 0.00 H ATOM 1666 HD2 PHE A 113 49.469 41.423 51.788 1.00 0.00 H ATOM 1667 HE2 PHE A 113 48.791 41.790 54.132 1.00 0.00 H ATOM 1668 HZ PHE A 113 46.632 42.852 54.639 1.00 0.00 H ATOM 1669 HE1 PHE A 113 45.144 43.554 52.799 1.00 0.00 H ATOM 1670 HD1 PHE A 113 45.812 43.194 50.452 1.00 0.00 H ATOM 1671 H PHE A 113 45.497 40.405 49.624 1.00 0.00 H ATOM 1672 N ILE A 114 49.132 39.036 49.106 1.00 7.46 N ATOM 1673 CA ILE A 114 49.776 37.855 49.659 1.00 8.06 C ATOM 1674 C ILE A 114 50.970 38.374 50.448 1.00 8.10 C ATOM 1675 O ILE A 114 51.819 39.057 49.892 1.00 9.08 O ATOM 1676 CB ILE A 114 50.269 36.916 48.546 1.00 8.63 C ATOM 1677 CG1 ILE A 114 49.141 36.590 47.553 1.00 9.57 C ATOM 1678 CG2 ILE A 114 50.807 35.639 49.148 1.00 10.14 C ATOM 1679 CD1 ILE A 114 49.617 35.955 46.246 1.00 11.22 C ATOM 1680 HA ILE A 114 49.080 37.285 50.275 1.00 0.00 H ATOM 1681 HB ILE A 114 51.065 37.425 48.003 1.00 0.00 H ATOM 1682 HG12 ILE A 114 48.449 35.900 48.036 1.00 0.00 H ATOM 1683 HG13 ILE A 114 48.619 37.516 47.313 1.00 0.00 H ATOM 1684 HD11 ILE A 114 50.301 36.637 45.740 1.00 0.00 H ATOM 1685 HD12 ILE A 114 50.131 35.019 46.464 1.00 0.00 H ATOM 1686 HD13 ILE A 114 48.758 35.758 45.605 1.00 0.00 H ATOM 1687 HG21 ILE A 114 51.638 35.874 49.814 1.00 0.00 H ATOM 1688 HG22 ILE A 114 50.017 35.144 49.712 1.00 0.00 H ATOM 1689 HG23 ILE A 114 51.154 34.981 48.351 1.00 0.00 H ATOM 1690 H ILE A 114 49.617 39.551 48.344 1.00 0.00 H ATOM 1691 N CYS A 115 51.035 38.047 51.730 1.00 8.47 N ATOM 1692 CA CYS A 115 52.139 38.494 52.563 1.00 9.23 C ATOM 1693 C CYS A 115 53.341 37.614 52.372 1.00 9.62 C ATOM 1694 O CYS A 115 53.208 36.399 52.197 1.00 9.97 O ATOM 1695 CB CYS A 115 51.762 38.417 54.025 1.00 8.93 C ATOM 1696 SG CYS A 115 50.380 39.466 54.455 1.00 13.41 S ATOM 1697 HA CYS A 115 52.366 39.520 52.273 1.00 0.00 H ATOM 1698 HB2 CYS A 115 52.624 38.718 54.621 1.00 0.00 H ATOM 1699 HB3 CYS A 115 51.500 37.386 54.261 1.00 0.00 H ATOM 1700 HG CYS A 115 50.106 39.334 55.801 1.00 0.00 H ATOM 1701 H CYS A 115 50.284 37.461 52.147 1.00 0.00 H ATOM 1702 N THR A 116 54.518 38.218 52.416 1.00 10.12 N ATOM 1703 CA THR A 116 55.759 37.449 52.372 1.00 11.29 C ATOM 1704 C THR A 116 56.509 37.578 53.697 1.00 12.10 C ATOM 1705 O THR A 116 57.674 37.180 53.799 1.00 13.02 O ATOM 1706 CB THR A 116 56.647 37.869 51.209 1.00 11.51 C ATOM 1707 OG1 THR A 116 56.918 39.278 51.268 1.00 11.55 O ATOM 1708 CG2 THR A 116 55.934 37.673 49.880 1.00 12.79 C ATOM 1709 HA THR A 116 55.494 36.403 52.215 1.00 0.00 H ATOM 1710 HB THR A 116 57.552 37.265 51.281 1.00 0.00 H ATOM 1711 HG1 THR A 116 57.496 39.534 50.506 1.00 0.00 H ATOM 1712 HG23 THR A 116 55.689 36.619 49.753 1.00 0.00 H ATOM 1713 HG21 THR A 116 55.018 38.264 49.870 1.00 0.00 H ATOM 1714 HG22 THR A 116 56.586 37.996 49.068 1.00 0.00 H ATOM 1715 H THR A 116 54.560 39.255 52.483 1.00 0.00 H ATOM 1716 N ALA A 117 55.846 38.132 54.702 1.00 12.32 N ATOM 1717 CA ALA A 117 56.410 38.258 56.040 1.00 12.56 C ATOM 1718 C ALA A 117 55.267 38.401 57.043 1.00 12.63 C ATOM 1719 O ALA A 117 54.114 38.579 56.649 1.00 12.18 O ATOM 1720 CB ALA A 117 57.332 39.469 56.112 1.00 12.89 C ATOM 1721 HA ALA A 117 56.997 37.371 56.277 1.00 0.00 H ATOM 1722 HB1 ALA A 117 58.142 39.350 55.393 1.00 0.00 H ATOM 1723 HB2 ALA A 117 56.765 40.370 55.877 1.00 0.00 H ATOM 1724 HB3 ALA A 117 57.746 39.550 57.117 1.00 0.00 H ATOM 1725 H ALA A 117 54.885 38.491 54.529 1.00 0.00 H ATOM 1726 N LYS A 118 55.579 38.315 58.333 1.00 13.18 N ATOM 1727 CA LYS A 118 54.594 38.605 59.359 1.00 13.71 C ATOM 1728 C LYS A 118 54.325 40.103 59.346 1.00 13.73 C ATOM 1729 O LYS A 118 55.266 40.897 59.325 1.00 13.70 O ATOM 1730 CB LYS A 118 55.088 38.183 60.736 1.00 14.32 C ATOM 1731 CG LYS A 118 54.078 38.487 61.818 1.00 16.81 C ATOM 1732 CD LYS A 118 54.251 37.620 63.047 1.00 21.41 C ATOM 1733 CE LYS A 118 55.205 38.239 64.020 1.00 24.18 C ATOM 1734 NZ LYS A 118 56.589 38.283 63.467 1.00 27.57 N ATOM 1735 HA LYS A 118 53.682 38.045 59.150 1.00 0.00 H ATOM 1736 HB2 LYS A 118 55.282 37.110 60.727 1.00 0.00 H ATOM 1737 HB3 LYS A 118 56.012 38.717 60.957 1.00 0.00 H ATOM 1738 HG2 LYS A 118 54.186 39.531 62.111 1.00 0.00 H ATOM 1739 HG3 LYS A 118 53.078 38.325 61.416 1.00 0.00 H ATOM 1740 HD2 LYS A 118 53.283 37.493 63.531 1.00 0.00 H ATOM 1741 HD3 LYS A 118 54.635 36.646 62.744 1.00 0.00 H ATOM 1742 HE2 LYS A 118 55.208 37.652 64.938 1.00 0.00 H ATOM 1743 HE3 LYS A 118 54.878 39.255 64.241 1.00 0.00 H ATOM 1744 HZ1 LYS A 118 56.909 37.316 63.259 1.00 0.00 H ATOM 1745 HZ2 LYS A 118 56.594 38.847 62.593 1.00 0.00 H ATOM 1746 HZ3 LYS A 118 57.226 38.717 64.165 1.00 0.00 H ATOM 1747 H LYS A 118 56.542 38.036 58.610 1.00 0.00 H ATOM 1748 N THR A 119 53.050 40.495 59.369 1.00 13.33 N ATOM 1749 CA THR A 119 52.691 41.917 59.261 1.00 13.59 C ATOM 1750 C THR A 119 51.639 42.279 60.299 1.00 13.99 C ATOM 1751 O THR A 119 50.475 42.537 59.978 1.00 13.45 O ATOM 1752 CB THR A 119 52.171 42.223 57.853 1.00 13.41 C ATOM 1753 OG1 THR A 119 51.072 41.352 57.542 1.00 13.62 O ATOM 1754 CG2 THR A 119 53.216 41.898 56.796 1.00 13.28 C ATOM 1755 HA THR A 119 53.582 42.517 59.446 1.00 0.00 H ATOM 1756 HB THR A 119 51.901 43.279 57.845 1.00 0.00 H ATOM 1757 HG1 THR A 119 50.345 41.493 58.199 1.00 0.00 H ATOM 1758 HG23 THR A 119 54.097 42.519 56.955 1.00 0.00 H ATOM 1759 HG21 THR A 119 53.493 40.846 56.872 1.00 0.00 H ATOM 1760 HG22 THR A 119 52.804 42.096 55.807 1.00 0.00 H ATOM 1761 H THR A 119 52.298 39.783 59.465 1.00 0.00 H ATOM 1762 N GLU A 120 52.065 42.309 61.556 1.00 14.73 N ATOM 1763 CA GLU A 120 51.169 42.553 62.687 1.00 15.69 C ATOM 1764 C GLU A 120 50.323 43.816 62.616 1.00 14.80 C ATOM 1765 O GLU A 120 49.178 43.813 63.060 1.00 14.72 O ATOM 1766 CB GLU A 120 51.983 42.641 63.981 1.00 16.64 C ATOM 1767 CG GLU A 120 52.801 41.420 64.338 1.00 21.43 C ATOM 1768 CD GLU A 120 53.510 41.624 65.661 1.00 26.38 C ATOM 1769 OE1 GLU A 120 52.816 41.956 66.652 1.00 30.31 O ATOM 1770 OE2 GLU A 120 54.754 41.484 65.705 1.00 30.64 O ATOM 1771 HA GLU A 120 50.480 41.709 62.657 1.00 0.00 H ATOM 1772 HB2 GLU A 120 52.667 43.485 63.888 1.00 0.00 H ATOM 1773 HB3 GLU A 120 51.288 42.827 64.800 1.00 0.00 H ATOM 1774 HG2 GLU A 120 52.141 40.556 64.414 1.00 0.00 H ATOM 1775 HG3 GLU A 120 53.541 41.243 63.558 1.00 0.00 H ATOM 1776 H GLU A 120 53.076 42.153 61.744 1.00 0.00 H ATOM 1777 N TRP A 121 50.885 44.904 62.102 1.00 13.96 N ATOM 1778 CA TRP A 121 50.165 46.183 62.071 1.00 13.59 C ATOM 1779 C TRP A 121 48.845 46.086 61.305 1.00 13.07 C ATOM 1780 O TRP A 121 47.923 46.842 61.555 1.00 12.93 O ATOM 1781 CB TRP A 121 51.047 47.307 61.480 1.00 13.54 C ATOM 1782 CG TRP A 121 50.510 48.683 61.753 1.00 14.48 C ATOM 1783 CD1 TRP A 121 50.721 49.439 62.874 1.00 15.98 C ATOM 1784 CD2 TRP A 121 49.678 49.472 60.895 1.00 14.15 C ATOM 1785 NE1 TRP A 121 50.054 50.637 62.772 1.00 17.33 N ATOM 1786 CE2 TRP A 121 49.407 50.685 61.564 1.00 15.34 C ATOM 1787 CE3 TRP A 121 49.111 49.270 59.633 1.00 14.39 C ATOM 1788 CZ2 TRP A 121 48.611 51.691 61.007 1.00 15.70 C ATOM 1789 CZ3 TRP A 121 48.320 50.267 59.087 1.00 14.77 C ATOM 1790 CH2 TRP A 121 48.078 51.460 59.773 1.00 15.89 C ATOM 1791 HA TRP A 121 49.928 46.432 63.105 1.00 0.00 H ATOM 1792 HB2 TRP A 121 52.044 47.231 61.915 1.00 0.00 H ATOM 1793 HB3 TRP A 121 51.111 47.167 60.401 1.00 0.00 H ATOM 1794 HE1 TRP A 121 50.042 51.385 63.494 1.00 0.00 H ATOM 1795 HD1 TRP A 121 51.330 49.135 63.725 1.00 0.00 H ATOM 1796 HZ2 TRP A 121 48.424 52.624 61.539 1.00 0.00 H ATOM 1797 HH2 TRP A 121 47.450 52.222 59.312 1.00 0.00 H ATOM 1798 HZ3 TRP A 121 47.877 50.118 58.102 1.00 0.00 H ATOM 1799 HE3 TRP A 121 49.289 48.343 59.088 1.00 0.00 H ATOM 1800 H TRP A 121 51.849 44.849 61.716 1.00 0.00 H ATOM 1801 N LEU A 122 48.762 45.143 60.372 1.00 12.17 N ATOM 1802 CA LEU A 122 47.578 44.974 59.545 1.00 11.85 C ATOM 1803 C LEU A 122 46.440 44.260 60.252 1.00 11.58 C ATOM 1804 O LEU A 122 45.309 44.306 59.783 1.00 11.06 O ATOM 1805 CB LEU A 122 47.946 44.219 58.262 1.00 11.59 C ATOM 1806 CG LEU A 122 49.053 44.856 57.420 1.00 11.07 C ATOM 1807 CD1 LEU A 122 49.287 44.064 56.150 1.00 10.58 C ATOM 1808 CD2 LEU A 122 48.717 46.285 57.068 1.00 12.10 C ATOM 1809 HA LEU A 122 47.218 45.976 59.311 1.00 0.00 H ATOM 1810 HB2 LEU A 122 48.271 43.217 58.543 1.00 0.00 H ATOM 1811 HB3 LEU A 122 47.051 44.150 57.644 1.00 0.00 H ATOM 1812 HG LEU A 122 49.963 44.847 58.019 1.00 0.00 H ATOM 1813 HD21 LEU A 122 47.788 46.309 56.498 1.00 0.00 H ATOM 1814 HD22 LEU A 122 48.598 46.865 57.983 1.00 0.00 H ATOM 1815 HD23 LEU A 122 49.523 46.710 56.470 1.00 0.00 H ATOM 1816 HD11 LEU A 122 49.582 43.047 56.407 1.00 0.00 H ATOM 1817 HD12 LEU A 122 48.368 44.040 55.564 1.00 0.00 H ATOM 1818 HD13 LEU A 122 50.079 44.537 55.569 1.00 0.00 H ATOM 1819 H LEU A 122 49.571 44.505 60.229 1.00 0.00 H ATOM 1820 N ASP A 123 46.725 43.595 61.371 1.00 11.80 N ATOM 1821 CA ASP A 123 45.673 42.901 62.111 1.00 12.50 C ATOM 1822 C ASP A 123 44.578 43.881 62.535 1.00 12.65 C ATOM 1823 O ASP A 123 44.860 44.978 63.020 1.00 13.72 O ATOM 1824 CB ASP A 123 46.243 42.206 63.341 1.00 12.68 C ATOM 1825 CG ASP A 123 47.152 41.064 62.992 1.00 13.83 C ATOM 1826 OD1 ASP A 123 47.893 40.605 63.889 1.00 14.07 O ATOM 1827 OD2 ASP A 123 47.192 40.549 61.853 1.00 12.90 O ATOM 1828 HA ASP A 123 45.242 42.148 61.451 1.00 0.00 H ATOM 1829 HB2 ASP A 123 46.806 42.935 63.924 1.00 0.00 H ATOM 1830 HB3 ASP A 123 45.417 41.824 63.940 1.00 0.00 H ATOM 1831 H ASP A 123 47.704 43.570 61.721 1.00 0.00 H ATOM 1832 N GLY A 124 43.323 43.482 62.344 1.00 12.89 N ATOM 1833 CA GLY A 124 42.182 44.311 62.701 1.00 12.92 C ATOM 1834 C GLY A 124 41.818 45.371 61.668 1.00 12.75 C ATOM 1835 O GLY A 124 40.853 46.122 61.853 1.00 13.41 O ATOM 1836 HA3 GLY A 124 42.409 44.815 63.640 1.00 0.00 H ATOM 1837 HA2 GLY A 124 41.319 43.660 62.839 1.00 0.00 H ATOM 1838 H GLY A 124 43.152 42.546 61.925 1.00 0.00 H ATOM 1839 N LYS A 125 42.575 45.440 60.576 1.00 12.27 N ATOM 1840 CA LYS A 125 42.327 46.414 59.512 1.00 12.09 C ATOM 1841 C LYS A 125 42.033 45.742 58.167 1.00 11.02 C ATOM 1842 O LYS A 125 41.336 46.311 57.322 1.00 11.95 O ATOM 1843 CB LYS A 125 43.526 47.351 59.353 1.00 12.47 C ATOM 1844 CG LYS A 125 43.950 48.013 60.647 1.00 15.81 C ATOM 1845 CD LYS A 125 45.207 48.849 60.468 1.00 18.12 C ATOM 1846 CE LYS A 125 45.694 49.443 61.785 1.00 19.01 C ATOM 1847 NZ LYS A 125 46.178 48.431 62.759 1.00 22.21 N ATOM 1848 HA LYS A 125 41.446 46.983 59.807 1.00 0.00 H ATOM 1849 HB2 LYS A 125 44.367 46.774 58.969 1.00 0.00 H ATOM 1850 HB3 LYS A 125 43.263 48.129 58.637 1.00 0.00 H ATOM 1851 HG2 LYS A 125 43.143 48.658 60.994 1.00 0.00 H ATOM 1852 HG3 LYS A 125 44.142 47.241 61.392 1.00 0.00 H ATOM 1853 HD2 LYS A 125 45.993 48.217 60.055 1.00 0.00 H ATOM 1854 HD3 LYS A 125 44.993 49.661 59.774 1.00 0.00 H ATOM 1855 HE2 LYS A 125 44.869 49.991 62.240 1.00 0.00 H ATOM 1856 HE3 LYS A 125 46.511 50.131 61.570 1.00 0.00 H ATOM 1857 HZ1 LYS A 125 45.406 47.772 62.985 1.00 0.00 H ATOM 1858 HZ2 LYS A 125 46.974 47.906 62.344 1.00 0.00 H ATOM 1859 HZ3 LYS A 125 46.492 48.910 63.627 1.00 0.00 H ATOM 1860 H LYS A 125 43.371 44.778 60.475 1.00 0.00 H ATOM 1861 N HIS A 126 42.587 44.543 57.983 1.00 9.74 N ATOM 1862 CA HIS A 126 42.418 43.766 56.755 1.00 8.82 C ATOM 1863 C HIS A 126 41.923 42.374 57.097 1.00 8.56 C ATOM 1864 O HIS A 126 42.419 41.757 58.033 1.00 9.00 O ATOM 1865 CB HIS A 126 43.747 43.692 55.997 1.00 8.36 C ATOM 1866 CG HIS A 126 44.252 45.031 55.561 1.00 7.92 C ATOM 1867 ND1 HIS A 126 43.849 45.623 54.388 1.00 7.57 N ATOM 1868 CD2 HIS A 126 45.100 45.908 56.157 1.00 9.82 C ATOM 1869 CE1 HIS A 126 44.423 46.810 54.278 1.00 9.66 C ATOM 1870 NE2 HIS A 126 45.198 47.001 55.335 1.00 9.20 N ATOM 1871 HA HIS A 126 41.682 44.254 56.116 1.00 0.00 H ATOM 1872 HB2 HIS A 126 44.493 43.235 56.648 1.00 0.00 H ATOM 1873 HB3 HIS A 126 43.608 43.069 55.113 1.00 0.00 H ATOM 1874 HD2 HIS A 126 45.608 45.769 57.111 1.00 0.00 H ATOM 1875 HE1 HIS A 126 44.282 47.512 53.456 1.00 0.00 H ATOM 1876 H HIS A 126 43.166 44.142 58.748 1.00 0.00 H ATOM 1877 N VAL A 127 40.955 41.870 56.337 1.00 8.51 N ATOM 1878 CA VAL A 127 40.387 40.558 56.599 1.00 8.56 C ATOM 1879 C VAL A 127 41.233 39.444 55.973 1.00 8.52 C ATOM 1880 O VAL A 127 41.373 39.371 54.750 1.00 8.48 O ATOM 1881 CB VAL A 127 38.940 40.448 56.073 1.00 8.28 C ATOM 1882 CG1 VAL A 127 38.394 39.020 56.271 1.00 9.13 C ATOM 1883 CG2 VAL A 127 38.049 41.487 56.758 1.00 8.60 C ATOM 1884 HA VAL A 127 40.381 40.436 57.682 1.00 0.00 H ATOM 1885 HB VAL A 127 38.939 40.654 55.003 1.00 0.00 H ATOM 1886 HG11 VAL A 127 39.021 38.314 55.727 1.00 0.00 H ATOM 1887 HG12 VAL A 127 38.403 38.773 57.333 1.00 0.00 H ATOM 1888 HG13 VAL A 127 37.373 38.967 55.893 1.00 0.00 H ATOM 1889 HG21 VAL A 127 38.053 41.314 57.834 1.00 0.00 H ATOM 1890 HG22 VAL A 127 38.431 42.486 56.548 1.00 0.00 H ATOM 1891 HG23 VAL A 127 37.031 41.398 56.378 1.00 0.00 H ATOM 1892 H VAL A 127 40.596 42.428 55.536 1.00 0.00 H ATOM 1893 N VAL A 128 41.800 38.595 56.827 1.00 8.37 N ATOM 1894 CA VAL A 128 42.591 37.455 56.396 1.00 8.83 C ATOM 1895 C VAL A 128 41.617 36.331 56.050 1.00 9.24 C ATOM 1896 O VAL A 128 40.724 36.030 56.841 1.00 9.88 O ATOM 1897 CB VAL A 128 43.525 36.985 57.524 1.00 9.16 C ATOM 1898 CG1 VAL A 128 44.216 35.675 57.151 1.00 9.65 C ATOM 1899 CG2 VAL A 128 44.539 38.077 57.875 1.00 9.73 C ATOM 1900 HA VAL A 128 43.205 37.729 55.538 1.00 0.00 H ATOM 1901 HB VAL A 128 42.923 36.794 58.412 1.00 0.00 H ATOM 1902 HG11 VAL A 128 43.464 34.906 56.976 1.00 0.00 H ATOM 1903 HG12 VAL A 128 44.806 35.822 56.246 1.00 0.00 H ATOM 1904 HG13 VAL A 128 44.870 35.366 57.966 1.00 0.00 H ATOM 1905 HG21 VAL A 128 45.138 38.311 56.995 1.00 0.00 H ATOM 1906 HG22 VAL A 128 44.009 38.971 58.204 1.00 0.00 H ATOM 1907 HG23 VAL A 128 45.190 37.723 58.675 1.00 0.00 H ATOM 1908 H VAL A 128 41.671 38.754 57.847 1.00 0.00 H ATOM 1909 N PHE A 129 41.772 35.709 54.883 1.00 8.86 N ATOM 1910 CA PHE A 129 40.796 34.689 54.469 1.00 8.54 C ATOM 1911 C PHE A 129 41.391 33.447 53.814 1.00 8.72 C ATOM 1912 O PHE A 129 40.644 32.576 53.369 1.00 9.17 O ATOM 1913 CB PHE A 129 39.754 35.308 53.536 1.00 8.60 C ATOM 1914 CG PHE A 129 40.320 35.789 52.236 1.00 8.12 C ATOM 1915 CD1 PHE A 129 40.238 35.011 51.081 1.00 9.22 C ATOM 1916 CD2 PHE A 129 40.914 37.034 52.158 1.00 8.27 C ATOM 1917 CE1 PHE A 129 40.769 35.464 49.887 1.00 10.16 C ATOM 1918 CE2 PHE A 129 41.430 37.499 50.972 1.00 8.81 C ATOM 1919 CZ PHE A 129 41.365 36.711 49.826 1.00 9.15 C ATOM 1920 HA PHE A 129 40.340 34.342 55.396 1.00 0.00 H ATOM 1921 HB2 PHE A 129 38.993 34.557 53.323 1.00 0.00 H ATOM 1922 HB3 PHE A 129 39.295 36.155 54.046 1.00 0.00 H ATOM 1923 HD2 PHE A 129 40.974 37.657 53.050 1.00 0.00 H ATOM 1924 HE2 PHE A 129 41.891 38.486 50.929 1.00 0.00 H ATOM 1925 HZ PHE A 129 41.781 37.074 48.886 1.00 0.00 H ATOM 1926 HE1 PHE A 129 40.718 34.839 48.995 1.00 0.00 H ATOM 1927 HD1 PHE A 129 39.751 34.037 51.120 1.00 0.00 H ATOM 1928 H PHE A 129 42.578 35.943 54.268 1.00 0.00 H ATOM 1929 N GLY A 130 42.713 33.345 53.740 1.00 8.31 N ATOM 1930 CA GLY A 130 43.311 32.174 53.124 1.00 8.86 C ATOM 1931 C GLY A 130 44.813 32.131 53.310 1.00 9.52 C ATOM 1932 O GLY A 130 45.398 32.986 53.980 1.00 8.56 O ATOM 1933 HA3 GLY A 130 43.090 32.187 52.057 1.00 0.00 H ATOM 1934 HA2 GLY A 130 42.876 31.281 53.573 1.00 0.00 H ATOM 1935 H GLY A 130 43.317 34.101 54.122 1.00 0.00 H ATOM 1936 N LYS A 131 45.436 31.129 52.704 1.00 10.69 N ATOM 1937 CA LYS A 131 46.881 30.977 52.774 1.00 11.95 C ATOM 1938 C LYS A 131 47.401 30.190 51.588 1.00 12.35 C ATOM 1939 O LYS A 131 46.697 29.347 51.012 1.00 13.00 O ATOM 1940 CB LYS A 131 47.285 30.290 54.077 1.00 12.74 C ATOM 1941 CG LYS A 131 46.974 28.810 54.129 1.00 16.69 C ATOM 1942 CD LYS A 131 47.601 28.170 55.361 1.00 20.98 C ATOM 1943 CE LYS A 131 47.347 26.690 55.417 1.00 24.15 C ATOM 1944 NZ LYS A 131 45.896 26.360 55.430 1.00 27.64 N ATOM 1945 HA LYS A 131 47.325 31.972 52.748 1.00 0.00 H ATOM 1946 HB2 LYS A 131 48.359 30.417 54.210 1.00 0.00 H ATOM 1947 HB3 LYS A 131 46.758 30.778 54.897 1.00 0.00 H ATOM 1948 HG2 LYS A 131 45.893 28.672 54.165 1.00 0.00 H ATOM 1949 HG3 LYS A 131 47.371 28.329 53.235 1.00 0.00 H ATOM 1950 HD2 LYS A 131 48.677 28.342 55.338 1.00 0.00 H ATOM 1951 HD3 LYS A 131 47.179 28.634 56.252 1.00 0.00 H ATOM 1952 HE2 LYS A 131 47.805 26.291 56.322 1.00 0.00 H ATOM 1953 HE3 LYS A 131 47.804 26.224 54.544 1.00 0.00 H ATOM 1954 HZ1 LYS A 131 45.451 26.793 56.264 1.00 0.00 H ATOM 1955 HZ2 LYS A 131 45.450 26.729 54.566 1.00 0.00 H ATOM 1956 HZ3 LYS A 131 45.777 25.328 55.469 1.00 0.00 H ATOM 1957 H LYS A 131 44.878 30.436 52.166 1.00 0.00 H ATOM 1958 N VAL A 132 48.636 30.478 51.212 1.00 12.55 N ATOM 1959 CA VAL A 132 49.288 29.741 50.150 1.00 13.25 C ATOM 1960 C VAL A 132 49.450 28.287 50.592 1.00 14.27 C ATOM 1961 O VAL A 132 49.905 27.996 51.699 1.00 14.26 O ATOM 1962 CB VAL A 132 50.647 30.360 49.797 1.00 12.89 C ATOM 1963 CG1 VAL A 132 51.447 29.429 48.895 1.00 13.33 C ATOM 1964 CG2 VAL A 132 50.447 31.706 49.123 1.00 12.26 C ATOM 1965 HA VAL A 132 48.674 29.785 49.251 1.00 0.00 H ATOM 1966 HB VAL A 132 51.210 30.507 50.719 1.00 0.00 H ATOM 1967 HG11 VAL A 132 51.614 28.482 49.409 1.00 0.00 H ATOM 1968 HG12 VAL A 132 50.891 29.251 47.974 1.00 0.00 H ATOM 1969 HG13 VAL A 132 52.406 29.890 48.659 1.00 0.00 H ATOM 1970 HG21 VAL A 132 49.866 31.571 48.210 1.00 0.00 H ATOM 1971 HG22 VAL A 132 49.913 32.374 49.799 1.00 0.00 H ATOM 1972 HG23 VAL A 132 51.418 32.136 48.877 1.00 0.00 H ATOM 1973 H VAL A 132 49.148 31.248 51.688 1.00 0.00 H ATOM 1974 N LYS A 133 49.053 27.383 49.711 1.00 16.22 N ATOM 1975 CA LYS A 133 49.101 25.956 49.959 1.00 18.05 C ATOM 1976 C LYS A 133 50.346 25.361 49.308 1.00 18.53 C ATOM 1977 O LYS A 133 51.067 24.574 49.927 1.00 20.02 O ATOM 1978 CB LYS A 133 47.829 25.330 49.371 1.00 18.48 C ATOM 1979 CG LYS A 133 47.586 23.893 49.715 1.00 21.49 C ATOM 1980 CD LYS A 133 46.286 23.413 49.077 1.00 23.62 C ATOM 1981 CE LYS A 133 45.947 21.995 49.489 1.00 25.14 C ATOM 1982 NZ LYS A 133 45.554 21.886 50.925 1.00 26.85 N ATOM 1983 HA LYS A 133 49.151 25.752 51.029 1.00 0.00 H ATOM 1984 HB2 LYS A 133 46.977 25.908 49.728 1.00 0.00 H ATOM 1985 HB3 LYS A 133 47.890 25.408 48.285 1.00 0.00 H ATOM 1986 HG2 LYS A 133 48.414 23.289 49.345 1.00 0.00 H ATOM 1987 HG3 LYS A 133 47.517 23.788 50.798 1.00 0.00 H ATOM 1988 HD2 LYS A 133 45.476 24.074 49.386 1.00 0.00 H ATOM 1989 HD3 LYS A 133 46.390 23.450 47.993 1.00 0.00 H ATOM 1990 HE2 LYS A 133 46.820 21.365 49.318 1.00 0.00 H ATOM 1991 HE3 LYS A 133 45.119 21.642 48.874 1.00 0.00 H ATOM 1992 HZ1 LYS A 133 46.340 22.211 51.524 1.00 0.00 H ATOM 1993 HZ2 LYS A 133 44.716 22.476 51.100 1.00 0.00 H ATOM 1994 HZ3 LYS A 133 45.334 20.894 51.149 1.00 0.00 H ATOM 1995 H LYS A 133 48.688 27.713 48.795 1.00 0.00 H ATOM 1996 N GLU A 134 50.589 25.760 48.063 1.00 18.89 N ATOM 1997 CA GLU A 134 51.693 25.262 47.256 1.00 19.17 C ATOM 1998 C GLU A 134 52.175 26.391 46.353 1.00 18.23 C ATOM 1999 O GLU A 134 51.381 27.211 45.913 1.00 17.46 O ATOM 2000 CB GLU A 134 51.179 24.090 46.412 1.00 20.27 C ATOM 2001 CG GLU A 134 52.039 23.650 45.250 1.00 23.77 C ATOM 2002 CD GLU A 134 51.287 22.700 44.327 1.00 28.31 C ATOM 2003 OE1 GLU A 134 50.879 21.617 44.798 1.00 30.96 O ATOM 2004 OE2 GLU A 134 51.087 23.036 43.137 1.00 32.23 O ATOM 2005 HA GLU A 134 52.519 24.924 47.881 1.00 0.00 H ATOM 2006 HB2 GLU A 134 51.060 23.234 47.076 1.00 0.00 H ATOM 2007 HB3 GLU A 134 50.206 24.375 46.012 1.00 0.00 H ATOM 2008 HG2 GLU A 134 52.344 24.529 44.682 1.00 0.00 H ATOM 2009 HG3 GLU A 134 52.924 23.143 45.636 1.00 0.00 H ATOM 2010 H GLU A 134 49.954 26.468 47.642 1.00 0.00 H ATOM 2011 N GLY A 135 53.473 26.443 46.081 1.00 17.17 N ATOM 2012 CA GLY A 135 54.003 27.472 45.202 1.00 16.83 C ATOM 2013 C GLY A 135 54.501 28.727 45.906 1.00 16.30 C ATOM 2014 O GLY A 135 54.609 29.772 45.275 1.00 15.59 O ATOM 2015 HA3 GLY A 135 53.214 27.764 44.508 1.00 0.00 H ATOM 2016 HA2 GLY A 135 54.836 27.044 44.644 1.00 0.00 H ATOM 2017 H GLY A 135 54.116 25.742 46.500 1.00 0.00 H ATOM 2018 N MET A 136 54.813 28.639 47.198 1.00 16.16 N ATOM 2019 CA MET A 136 55.365 29.804 47.892 1.00 16.61 C ATOM 2020 C MET A 136 56.643 30.263 47.177 1.00 16.79 C ATOM 2021 O MET A 136 56.961 31.445 47.158 1.00 16.10 O ATOM 2022 CB MET A 136 55.641 29.507 49.368 1.00 16.79 C ATOM 2023 CG MET A 136 55.914 30.755 50.204 1.00 17.92 C ATOM 2024 SD MET A 136 54.487 31.886 50.286 1.00 19.69 S ATOM 2025 CE MET A 136 55.329 33.431 50.601 1.00 21.19 C ATOM 2026 HA MET A 136 54.627 30.606 47.864 1.00 0.00 H ATOM 2027 HB2 MET A 136 54.773 28.996 49.785 1.00 0.00 H ATOM 2028 HB3 MET A 136 56.511 28.853 49.431 1.00 0.00 H ATOM 2029 HG2 MET A 136 56.756 31.290 49.765 1.00 0.00 H ATOM 2030 HG3 MET A 136 56.170 30.445 51.217 1.00 0.00 H ATOM 2031 HE1 MET A 136 55.888 33.355 51.534 1.00 0.00 H ATOM 2032 HE2 MET A 136 56.015 33.643 49.781 1.00 0.00 H ATOM 2033 HE3 MET A 136 54.596 34.234 50.679 1.00 0.00 H ATOM 2034 H MET A 136 54.665 27.747 47.711 1.00 0.00 H ATOM 2035 N ASN A 137 57.368 29.329 46.564 1.00 17.30 N ATOM 2036 CA ASN A 137 58.584 29.685 45.839 1.00 17.44 C ATOM 2037 C ASN A 137 58.283 30.576 44.634 1.00 16.87 C ATOM 2038 O ASN A 137 59.121 31.364 44.206 1.00 16.93 O ATOM 2039 CB ASN A 137 59.351 28.425 45.412 1.00 18.37 C ATOM 2040 CG ASN A 137 58.547 27.539 44.488 1.00 19.81 C ATOM 2041 OD1 ASN A 137 57.404 27.191 44.783 1.00 23.19 O ATOM 2042 ND2 ASN A 137 59.143 27.157 43.365 1.00 24.04 N ATOM 2043 HA ASN A 137 59.216 30.258 46.517 1.00 0.00 H ATOM 2044 HB2 ASN A 137 60.263 28.729 44.898 1.00 0.00 H ATOM 2045 HB3 ASN A 137 59.610 27.855 46.304 1.00 0.00 H ATOM 2046 HD22 ASN A 137 60.111 27.475 43.156 1.00 0.00 H ATOM 2047 HD21 ASN A 137 58.642 26.540 42.695 1.00 0.00 H ATOM 2048 H ASN A 137 57.064 28.335 46.602 1.00 0.00 H ATOM 2049 N ILE A 138 57.075 30.463 44.093 1.00 16.00 N ATOM 2050 CA ILE A 138 56.655 31.287 42.972 1.00 15.72 C ATOM 2051 C ILE A 138 56.385 32.721 43.452 1.00 14.95 C ATOM 2052 O ILE A 138 56.736 33.684 42.772 1.00 15.33 O ATOM 2053 CB ILE A 138 55.409 30.679 42.306 1.00 16.06 C ATOM 2054 CG1 ILE A 138 55.703 29.248 41.840 1.00 17.79 C ATOM 2055 CG2 ILE A 138 54.930 31.564 41.169 1.00 15.81 C ATOM 2056 CD1 ILE A 138 56.872 29.134 40.886 1.00 19.13 C ATOM 2057 HA ILE A 138 57.451 31.320 42.228 1.00 0.00 H ATOM 2058 HB ILE A 138 54.601 30.626 43.036 1.00 0.00 H ATOM 2059 HG12 ILE A 138 55.918 28.639 42.718 1.00 0.00 H ATOM 2060 HG13 ILE A 138 54.815 28.862 41.340 1.00 0.00 H ATOM 2061 HD11 ILE A 138 56.670 29.726 39.994 1.00 0.00 H ATOM 2062 HD12 ILE A 138 57.774 29.504 41.373 1.00 0.00 H ATOM 2063 HD13 ILE A 138 57.011 28.090 40.607 1.00 0.00 H ATOM 2064 HG21 ILE A 138 54.679 32.550 41.559 1.00 0.00 H ATOM 2065 HG22 ILE A 138 55.721 31.657 40.425 1.00 0.00 H ATOM 2066 HG23 ILE A 138 54.048 31.118 40.710 1.00 0.00 H ATOM 2067 H ILE A 138 56.410 29.765 44.483 1.00 0.00 H ATOM 2068 N VAL A 139 55.768 32.846 44.624 1.00 14.67 N ATOM 2069 CA VAL A 139 55.509 34.145 45.237 1.00 14.74 C ATOM 2070 C VAL A 139 56.858 34.832 45.525 1.00 15.01 C ATOM 2071 O VAL A 139 57.031 36.023 45.267 1.00 15.28 O ATOM 2072 CB VAL A 139 54.685 33.994 46.527 1.00 14.49 C ATOM 2073 CG1 VAL A 139 54.557 35.325 47.252 1.00 15.13 C ATOM 2074 CG2 VAL A 139 53.297 33.404 46.213 1.00 15.06 C ATOM 2075 HA VAL A 139 54.924 34.759 44.552 1.00 0.00 H ATOM 2076 HB VAL A 139 55.210 33.304 47.188 1.00 0.00 H ATOM 2077 HG11 VAL A 139 55.550 35.693 47.512 1.00 0.00 H ATOM 2078 HG12 VAL A 139 54.060 36.045 46.602 1.00 0.00 H ATOM 2079 HG13 VAL A 139 53.970 35.188 48.160 1.00 0.00 H ATOM 2080 HG21 VAL A 139 52.768 34.068 45.529 1.00 0.00 H ATOM 2081 HG22 VAL A 139 53.416 32.424 45.751 1.00 0.00 H ATOM 2082 HG23 VAL A 139 52.728 33.304 47.138 1.00 0.00 H ATOM 2083 H VAL A 139 55.459 31.987 45.122 1.00 0.00 H ATOM 2084 N GLU A 140 57.814 34.065 46.044 1.00 15.59 N ATOM 2085 CA GLU A 140 59.159 34.577 46.319 1.00 16.18 C ATOM 2086 C GLU A 140 59.827 35.078 45.023 1.00 16.34 C ATOM 2087 O GLU A 140 60.511 36.099 45.019 1.00 17.21 O ATOM 2088 CB GLU A 140 60.010 33.493 47.005 1.00 16.15 C ATOM 2089 CG GLU A 140 59.523 33.155 48.408 1.00 17.11 C ATOM 2090 CD GLU A 140 60.084 31.863 48.984 1.00 18.66 C ATOM 2091 OE1 GLU A 140 59.623 31.457 50.059 1.00 20.15 O ATOM 2092 OE2 GLU A 140 60.990 31.251 48.383 1.00 20.89 O ATOM 2093 HA GLU A 140 59.080 35.426 46.998 1.00 0.00 H ATOM 2094 HB2 GLU A 140 59.976 32.588 46.398 1.00 0.00 H ATOM 2095 HB3 GLU A 140 61.039 33.848 47.070 1.00 0.00 H ATOM 2096 HG2 GLU A 140 59.805 33.973 49.071 1.00 0.00 H ATOM 2097 HG3 GLU A 140 58.437 33.070 48.379 1.00 0.00 H ATOM 2098 H GLU A 140 57.600 33.071 46.261 1.00 0.00 H ATOM 2099 N ALA A 141 59.614 34.369 43.922 1.00 16.50 N ATOM 2100 CA ALA A 141 60.154 34.778 42.633 1.00 16.99 C ATOM 2101 C ALA A 141 59.508 36.073 42.138 1.00 17.53 C ATOM 2102 O ALA A 141 60.166 36.909 41.517 1.00 17.90 O ATOM 2103 CB ALA A 141 59.975 33.668 41.600 1.00 17.15 C ATOM 2104 HA ALA A 141 61.219 34.967 42.768 1.00 0.00 H ATOM 2105 HB1 ALA A 141 60.499 32.773 41.936 1.00 0.00 H ATOM 2106 HB2 ALA A 141 58.914 33.448 41.486 1.00 0.00 H ATOM 2107 HB3 ALA A 141 60.385 33.994 40.644 1.00 0.00 H ATOM 2108 H ALA A 141 59.047 33.499 43.981 1.00 0.00 H ATOM 2109 N MET A 142 58.215 36.240 42.407 1.00 17.77 N ATOM 2110 CA MET A 142 57.509 37.450 42.005 1.00 18.49 C ATOM 2111 C MET A 142 58.106 38.677 42.690 1.00 18.83 C ATOM 2112 O MET A 142 58.145 39.751 42.109 1.00 18.19 O ATOM 2113 CB MET A 142 56.021 37.334 42.348 1.00 18.34 C ATOM 2114 CG MET A 142 55.268 36.379 41.448 1.00 19.96 C ATOM 2115 SD MET A 142 53.644 35.952 42.105 1.00 23.26 S ATOM 2116 CE MET A 142 52.950 37.551 42.219 1.00 21.34 C ATOM 2117 HA MET A 142 57.618 37.566 40.927 1.00 0.00 H ATOM 2118 HB2 MET A 142 55.930 36.984 43.376 1.00 0.00 H ATOM 2119 HB3 MET A 142 55.568 38.322 42.260 1.00 0.00 H ATOM 2120 HG2 MET A 142 55.853 35.466 41.339 1.00 0.00 H ATOM 2121 HG3 MET A 142 55.139 36.846 40.471 1.00 0.00 H ATOM 2122 HE1 MET A 142 53.556 38.162 42.887 1.00 0.00 H ATOM 2123 HE2 MET A 142 52.926 38.007 41.229 1.00 0.00 H ATOM 2124 HE3 MET A 142 51.936 37.478 42.611 1.00 0.00 H ATOM 2125 H MET A 142 57.699 35.493 42.914 1.00 0.00 H ATOM 2126 N GLU A 143 58.582 38.508 43.922 1.00 19.98 N ATOM 2127 CA GLU A 143 59.180 39.618 44.679 1.00 21.35 C ATOM 2128 C GLU A 143 60.381 40.241 43.990 1.00 22.44 C ATOM 2129 O GLU A 143 60.696 41.408 44.228 1.00 22.87 O ATOM 2130 CB GLU A 143 59.645 39.145 46.057 1.00 21.64 C ATOM 2131 CG GLU A 143 58.553 39.025 47.091 1.00 22.35 C ATOM 2132 CD GLU A 143 59.113 38.802 48.484 1.00 24.00 C ATOM 2133 OE1 GLU A 143 58.861 39.631 49.379 1.00 23.53 O ATOM 2134 OE2 GLU A 143 59.797 37.781 48.680 1.00 26.77 O ATOM 2135 HA GLU A 143 58.392 40.367 44.756 1.00 0.00 H ATOM 2136 HB2 GLU A 143 60.110 38.166 45.940 1.00 0.00 H ATOM 2137 HB3 GLU A 143 60.385 39.855 46.427 1.00 0.00 H ATOM 2138 HG2 GLU A 143 57.965 39.943 47.090 1.00 0.00 H ATOM 2139 HG3 GLU A 143 57.911 38.183 46.830 1.00 0.00 H ATOM 2140 H GLU A 143 58.530 37.566 44.360 1.00 0.00 H ATOM 2141 N ARG A 144 61.064 39.457 43.159 1.00 23.60 N ATOM 2142 CA ARG A 144 62.259 39.914 42.456 1.00 24.35 C ATOM 2143 C ARG A 144 61.979 41.026 41.443 1.00 24.30 C ATOM 2144 O ARG A 144 62.904 41.714 40.992 1.00 24.54 O ATOM 2145 CB ARG A 144 62.933 38.736 41.748 1.00 24.89 C ATOM 2146 CG ARG A 144 63.367 37.610 42.682 1.00 27.07 C ATOM 2147 CD ARG A 144 63.837 36.367 41.956 1.00 30.30 C ATOM 2148 NE ARG A 144 63.863 35.184 42.817 1.00 33.06 N ATOM 2149 CZ ARG A 144 64.026 33.941 42.376 1.00 34.98 C ATOM 2150 NH1 ARG A 144 64.189 33.704 41.080 1.00 36.17 N ATOM 2151 NH2 ARG A 144 64.036 32.928 43.233 1.00 35.96 N ATOM 2152 HA ARG A 144 62.921 40.333 43.214 1.00 0.00 H ATOM 2153 HB2 ARG A 144 62.231 38.326 41.022 1.00 0.00 H ATOM 2154 HB3 ARG A 144 63.816 39.109 41.228 1.00 0.00 H ATOM 2155 HG2 ARG A 144 64.183 37.975 43.306 1.00 0.00 H ATOM 2156 HG3 ARG A 144 62.521 37.341 43.314 1.00 0.00 H ATOM 2157 HD2 ARG A 144 64.843 36.544 41.577 1.00 0.00 H ATOM 2158 HD3 ARG A 144 63.164 36.176 41.121 1.00 0.00 H ATOM 2159 HE ARG A 144 63.746 35.325 43.841 1.00 0.00 H ATOM 2160 HH12 ARG A 144 64.316 32.729 40.742 1.00 0.00 H ATOM 2161 HH11 ARG A 144 64.190 34.494 40.403 1.00 0.00 H ATOM 2162 HH22 ARG A 144 64.164 31.956 42.887 1.00 0.00 H ATOM 2163 HH21 ARG A 144 63.916 33.107 44.251 1.00 0.00 H ATOM 2164 H ARG A 144 60.734 38.483 43.005 1.00 0.00 H ATOM 2165 N PHE A 145 60.710 41.217 41.094 1.00 23.78 N ATOM 2166 CA PHE A 145 60.334 42.226 40.112 1.00 23.87 C ATOM 2167 C PHE A 145 59.721 43.464 40.753 1.00 23.57 C ATOM 2168 O PHE A 145 59.227 44.348 40.055 1.00 23.85 O ATOM 2169 CB PHE A 145 59.344 41.627 39.118 1.00 24.20 C ATOM 2170 CG PHE A 145 59.880 40.443 38.379 1.00 25.03 C ATOM 2171 CD1 PHE A 145 59.534 39.155 38.757 1.00 26.16 C ATOM 2172 CD2 PHE A 145 60.742 40.617 37.311 1.00 26.97 C ATOM 2173 CE1 PHE A 145 60.035 38.059 38.075 1.00 26.66 C ATOM 2174 CE2 PHE A 145 61.245 39.528 36.624 1.00 27.17 C ATOM 2175 CZ PHE A 145 60.894 38.249 37.005 1.00 27.04 C ATOM 2176 HA PHE A 145 61.246 42.539 39.603 1.00 0.00 H ATOM 2177 HB2 PHE A 145 58.452 41.318 39.663 1.00 0.00 H ATOM 2178 HB3 PHE A 145 59.077 42.395 38.392 1.00 0.00 H ATOM 2179 HD2 PHE A 145 61.028 41.624 37.008 1.00 0.00 H ATOM 2180 HE2 PHE A 145 61.919 39.680 35.781 1.00 0.00 H ATOM 2181 HZ PHE A 145 61.292 37.390 36.465 1.00 0.00 H ATOM 2182 HE1 PHE A 145 59.755 37.051 38.379 1.00 0.00 H ATOM 2183 HD1 PHE A 145 58.860 39.003 39.600 1.00 0.00 H ATOM 2184 H PHE A 145 59.969 40.633 41.532 1.00 0.00 H ATOM 2185 N GLY A 146 59.734 43.519 42.080 1.00 23.08 N ATOM 2186 CA GLY A 146 59.167 44.644 42.804 1.00 23.03 C ATOM 2187 C GLY A 146 60.176 45.719 43.170 1.00 22.98 C ATOM 2188 O GLY A 146 61.332 45.673 42.763 1.00 23.19 O ATOM 2189 HA3 GLY A 146 58.718 44.268 43.723 1.00 0.00 H ATOM 2190 HA2 GLY A 146 58.394 45.097 42.183 1.00 0.00 H ATOM 2191 H GLY A 146 60.161 42.736 42.615 1.00 0.00 H ATOM 2192 N SER A 147 59.730 46.693 43.950 1.00 22.72 N ATOM 2193 CA SER A 147 60.582 47.812 44.343 1.00 22.96 C ATOM 2194 C SER A 147 59.993 48.501 45.572 1.00 23.36 C ATOM 2195 O SER A 147 58.886 48.185 45.977 1.00 22.76 O ATOM 2196 CB SER A 147 60.696 48.800 43.181 1.00 22.71 C ATOM 2197 OG SER A 147 59.435 49.356 42.857 1.00 22.83 O ATOM 2198 HA SER A 147 61.577 47.444 44.592 1.00 0.00 H ATOM 2199 HB2 SER A 147 61.090 48.279 42.308 1.00 0.00 H ATOM 2200 HB3 SER A 147 61.377 49.603 43.462 1.00 0.00 H ATOM 2201 HG SER A 147 58.813 48.631 42.596 1.00 0.00 H ATOM 2202 H SER A 147 58.748 46.660 44.291 1.00 0.00 H ATOM 2203 N ARG A 148 60.733 49.439 46.163 1.00 24.43 N ATOM 2204 CA ARG A 148 60.276 50.173 47.352 1.00 25.24 C ATOM 2205 C ARG A 148 58.865 50.703 47.224 1.00 25.72 C ATOM 2206 O ARG A 148 58.026 50.518 48.104 1.00 26.02 O ATOM 2207 CB ARG A 148 61.162 51.396 47.593 1.00 25.67 C ATOM 2208 CG ARG A 148 62.452 51.135 48.283 1.00 27.00 C ATOM 2209 CD ARG A 148 63.023 52.398 48.922 1.00 28.62 C ATOM 2210 NE ARG A 148 64.307 52.156 49.571 1.00 30.97 N ATOM 2211 CZ ARG A 148 64.825 52.924 50.523 1.00 33.19 C ATOM 2212 NH1 ARG A 148 65.999 52.615 51.051 1.00 34.13 N ATOM 2213 NH2 ARG A 148 64.171 54.000 50.954 1.00 34.49 N ATOM 2214 HA ARG A 148 60.323 49.452 48.168 1.00 0.00 H ATOM 2215 HB2 ARG A 148 61.385 51.844 46.625 1.00 0.00 H ATOM 2216 HB3 ARG A 148 60.596 52.105 48.198 1.00 0.00 H ATOM 2217 HG2 ARG A 148 62.291 50.388 49.061 1.00 0.00 H ATOM 2218 HG3 ARG A 148 63.169 50.752 47.557 1.00 0.00 H ATOM 2219 HD2 ARG A 148 62.317 52.765 49.667 1.00 0.00 H ATOM 2220 HD3 ARG A 148 63.158 53.153 48.148 1.00 0.00 H ATOM 2221 HE ARG A 148 64.854 51.325 49.268 1.00 0.00 H ATOM 2222 HH12 ARG A 148 66.408 53.214 51.797 1.00 0.00 H ATOM 2223 HH11 ARG A 148 66.513 51.773 50.720 1.00 0.00 H ATOM 2224 HH22 ARG A 148 64.584 54.596 51.700 1.00 0.00 H ATOM 2225 HH21 ARG A 148 63.247 54.245 50.545 1.00 0.00 H ATOM 2226 H ARG A 148 61.669 49.660 45.768 1.00 0.00 H ATOM 2227 N ASN A 149 58.646 51.425 46.133 1.00 26.33 N ATOM 2228 CA ASN A 149 57.364 52.028 45.811 1.00 26.76 C ATOM 2229 C ASN A 149 56.323 51.005 45.372 1.00 26.08 C ATOM 2230 O ASN A 149 55.131 51.312 45.311 1.00 26.64 O ATOM 2231 CB ASN A 149 57.571 53.043 44.693 1.00 27.51 C ATOM 2232 CG ASN A 149 58.447 52.503 43.580 1.00 29.23 C ATOM 2233 OD1 ASN A 149 59.648 52.278 43.765 1.00 32.61 O ATOM 2234 ND2 ASN A 149 57.852 52.285 42.420 1.00 31.98 N ATOM 2235 HA ASN A 149 56.985 52.503 46.716 1.00 0.00 H ATOM 2236 HB2 ASN A 149 56.599 53.309 44.277 1.00 0.00 H ATOM 2237 HB3 ASN A 149 58.042 53.933 45.110 1.00 0.00 H ATOM 2238 HD22 ASN A 149 56.838 52.489 42.309 1.00 0.00 H ATOM 2239 HD21 ASN A 149 58.398 51.910 41.618 1.00 0.00 H ATOM 2240 H ASN A 149 59.436 51.567 45.471 1.00 0.00 H ATOM 2241 N GLY A 150 56.778 49.797 45.054 1.00 25.12 N ATOM 2242 CA GLY A 150 55.881 48.728 44.644 1.00 24.57 C ATOM 2243 C GLY A 150 55.731 48.564 43.142 1.00 24.20 C ATOM 2244 O GLY A 150 55.110 47.616 42.679 1.00 23.36 O ATOM 2245 HA3 GLY A 150 54.896 48.932 45.063 1.00 0.00 H ATOM 2246 HA2 GLY A 150 56.261 47.791 45.051 1.00 0.00 H ATOM 2247 H GLY A 150 57.800 49.612 45.100 1.00 0.00 H ATOM 2248 N LYS A 151 56.287 49.486 42.365 1.00 24.32 N ATOM 2249 CA LYS A 151 56.193 49.372 40.916 1.00 24.64 C ATOM 2250 C LYS A 151 56.973 48.150 40.455 1.00 24.05 C ATOM 2251 O LYS A 151 58.079 47.899 40.940 1.00 23.93 O ATOM 2252 CB LYS A 151 56.716 50.639 40.240 1.00 25.11 C ATOM 2253 CG LYS A 151 55.676 51.760 40.178 1.00 27.57 C ATOM 2254 CD LYS A 151 54.902 51.921 41.488 1.00 30.14 C ATOM 2255 CE LYS A 151 53.959 53.095 41.434 1.00 31.61 C ATOM 2256 NZ LYS A 151 54.686 54.386 41.283 1.00 33.43 N ATOM 2257 HA LYS A 151 55.147 49.254 40.632 1.00 0.00 H ATOM 2258 HB2 LYS A 151 57.581 50.998 40.798 1.00 0.00 H ATOM 2259 HB3 LYS A 151 57.019 50.390 39.223 1.00 0.00 H ATOM 2260 HG2 LYS A 151 56.186 52.697 39.957 1.00 0.00 H ATOM 2261 HG3 LYS A 151 54.968 51.536 39.380 1.00 0.00 H ATOM 2262 HD2 LYS A 151 54.327 51.014 41.674 1.00 0.00 H ATOM 2263 HD3 LYS A 151 55.611 52.073 42.302 1.00 0.00 H ATOM 2264 HE2 LYS A 151 53.378 53.123 42.356 1.00 0.00 H ATOM 2265 HE3 LYS A 151 53.286 52.968 40.586 1.00 0.00 H ATOM 2266 HZ1 LYS A 151 55.326 54.519 42.092 1.00 0.00 H ATOM 2267 HZ2 LYS A 151 55.238 54.371 40.402 1.00 0.00 H ATOM 2268 HZ3 LYS A 151 54.000 55.167 41.250 1.00 0.00 H ATOM 2269 H LYS A 151 56.790 50.290 42.791 1.00 0.00 H ATOM 2270 N THR A 152 56.398 47.381 39.536 1.00 23.85 N ATOM 2271 CA THR A 152 57.060 46.180 39.031 1.00 23.93 C ATOM 2272 C THR A 152 57.869 46.473 37.766 1.00 24.43 C ATOM 2273 O THR A 152 57.507 47.343 36.966 1.00 24.57 O ATOM 2274 CB THR A 152 56.042 45.058 38.765 1.00 23.91 C ATOM 2275 OG1 THR A 152 55.045 45.504 37.835 1.00 23.65 O ATOM 2276 CG2 THR A 152 55.252 44.728 40.030 1.00 23.76 C ATOM 2277 HA THR A 152 57.752 45.845 39.804 1.00 0.00 H ATOM 2278 HB THR A 152 56.612 44.204 38.399 1.00 0.00 H ATOM 2279 HG1 THR A 152 54.397 44.774 37.672 1.00 0.00 H ATOM 2280 HG23 THR A 152 55.936 44.376 40.802 1.00 0.00 H ATOM 2281 HG21 THR A 152 54.737 45.623 40.379 1.00 0.00 H ATOM 2282 HG22 THR A 152 54.521 43.950 39.808 1.00 0.00 H ATOM 2283 H THR A 152 55.459 47.639 39.169 1.00 0.00 H ATOM 2284 N SER A 153 58.960 45.732 37.596 1.00 25.10 N ATOM 2285 CA SER A 153 59.865 45.924 36.466 1.00 25.80 C ATOM 2286 C SER A 153 59.374 45.189 35.228 1.00 26.00 C ATOM 2287 O SER A 153 59.724 45.550 34.109 1.00 26.60 O ATOM 2288 CB SER A 153 61.271 45.453 36.827 1.00 25.97 C ATOM 2289 OG SER A 153 61.271 44.110 37.273 1.00 27.63 O ATOM 2290 HA SER A 153 59.889 46.990 36.239 1.00 0.00 H ATOM 2291 HB2 SER A 153 61.665 46.089 37.619 1.00 0.00 H ATOM 2292 HB3 SER A 153 61.909 45.534 35.947 1.00 0.00 H ATOM 2293 HG SER A 153 60.698 44.030 38.076 1.00 0.00 H ATOM 2294 H SER A 153 59.176 44.990 38.292 1.00 0.00 H ATOM 2295 N LYS A 154 58.571 44.151 35.443 1.00 26.06 N ATOM 2296 CA LYS A 154 57.992 43.360 34.362 1.00 26.11 C ATOM 2297 C LYS A 154 56.504 43.239 34.648 1.00 25.44 C ATOM 2298 O LYS A 154 56.077 43.483 35.772 1.00 25.60 O ATOM 2299 CB LYS A 154 58.621 41.963 34.317 1.00 26.63 C ATOM 2300 CG LYS A 154 59.831 41.815 33.395 1.00 28.29 C ATOM 2301 CD LYS A 154 61.053 42.553 33.892 1.00 30.23 C ATOM 2302 CE LYS A 154 62.142 42.574 32.826 1.00 31.36 C ATOM 2303 NZ LYS A 154 62.462 41.205 32.326 1.00 32.31 N ATOM 2304 HA LYS A 154 58.176 43.840 33.401 1.00 0.00 H ATOM 2305 HB2 LYS A 154 58.935 41.703 35.328 1.00 0.00 H ATOM 2306 HB3 LYS A 154 57.857 41.261 33.984 1.00 0.00 H ATOM 2307 HG2 LYS A 154 60.076 40.756 33.312 1.00 0.00 H ATOM 2308 HG3 LYS A 154 59.567 42.204 32.412 1.00 0.00 H ATOM 2309 HD2 LYS A 154 60.776 43.577 34.141 1.00 0.00 H ATOM 2310 HD3 LYS A 154 61.434 42.055 34.783 1.00 0.00 H ATOM 2311 HE2 LYS A 154 63.044 43.013 33.253 1.00 0.00 H ATOM 2312 HE3 LYS A 154 61.803 43.184 31.989 1.00 0.00 H ATOM 2313 HZ1 LYS A 154 62.793 40.617 33.117 1.00 0.00 H ATOM 2314 HZ2 LYS A 154 61.608 40.781 31.910 1.00 0.00 H ATOM 2315 HZ3 LYS A 154 63.207 41.267 31.603 1.00 0.00 H ATOM 2316 H LYS A 154 58.346 43.892 36.425 1.00 0.00 H ATOM 2317 N LYS A 155 55.715 42.864 33.647 1.00 24.66 N ATOM 2318 CA LYS A 155 54.282 42.699 33.842 1.00 24.17 C ATOM 2319 C LYS A 155 54.005 41.311 34.413 1.00 22.78 C ATOM 2320 O LYS A 155 54.283 40.295 33.769 1.00 22.34 O ATOM 2321 CB LYS A 155 53.523 42.913 32.532 1.00 24.67 C ATOM 2322 CG LYS A 155 52.088 43.359 32.730 1.00 26.97 C ATOM 2323 CD LYS A 155 51.687 44.412 31.694 1.00 29.58 C ATOM 2324 CE LYS A 155 50.357 45.074 32.037 1.00 31.07 C ATOM 2325 NZ LYS A 155 50.096 46.284 31.189 1.00 32.82 N ATOM 2326 HA LYS A 155 53.931 43.451 34.549 1.00 0.00 H ATOM 2327 HB2 LYS A 155 54.044 43.674 31.951 1.00 0.00 H ATOM 2328 HB3 LYS A 155 53.519 41.974 31.978 1.00 0.00 H ATOM 2329 HG2 LYS A 155 51.430 42.495 32.632 1.00 0.00 H ATOM 2330 HG3 LYS A 155 51.982 43.784 33.728 1.00 0.00 H ATOM 2331 HD2 LYS A 155 52.461 45.178 31.653 1.00 0.00 H ATOM 2332 HD3 LYS A 155 51.600 43.932 30.719 1.00 0.00 H ATOM 2333 HE2 LYS A 155 50.373 45.375 33.085 1.00 0.00 H ATOM 2334 HE3 LYS A 155 49.554 44.354 31.880 1.00 0.00 H ATOM 2335 HZ1 LYS A 155 50.854 46.980 31.338 1.00 0.00 H ATOM 2336 HZ2 LYS A 155 50.072 46.005 30.187 1.00 0.00 H ATOM 2337 HZ3 LYS A 155 49.182 46.702 31.456 1.00 0.00 H ATOM 2338 H LYS A 155 56.128 42.686 32.709 1.00 0.00 H ATOM 2339 N ILE A 156 53.479 41.274 35.638 1.00 21.10 N ATOM 2340 CA ILE A 156 53.171 40.022 36.313 1.00 19.92 C ATOM 2341 C ILE A 156 51.670 39.800 36.248 1.00 19.09 C ATOM 2342 O ILE A 156 50.914 40.528 36.879 1.00 18.13 O ATOM 2343 CB ILE A 156 53.608 40.075 37.789 1.00 20.22 C ATOM 2344 CG1 ILE A 156 55.031 40.629 37.919 1.00 20.81 C ATOM 2345 CG2 ILE A 156 53.492 38.693 38.424 1.00 20.19 C ATOM 2346 CD1 ILE A 156 56.067 39.828 37.191 1.00 21.75 C ATOM 2347 HA ILE A 156 53.706 39.209 35.822 1.00 0.00 H ATOM 2348 HB ILE A 156 52.942 40.752 38.324 1.00 0.00 H ATOM 2349 HG12 ILE A 156 55.041 41.644 37.522 1.00 0.00 H ATOM 2350 HG13 ILE A 156 55.295 40.651 38.976 1.00 0.00 H ATOM 2351 HD11 ILE A 156 56.080 38.811 37.584 1.00 0.00 H ATOM 2352 HD12 ILE A 156 55.826 39.805 36.128 1.00 0.00 H ATOM 2353 HD13 ILE A 156 57.045 40.287 37.334 1.00 0.00 H ATOM 2354 HG21 ILE A 156 52.457 38.355 38.370 1.00 0.00 H ATOM 2355 HG22 ILE A 156 54.132 37.993 37.887 1.00 0.00 H ATOM 2356 HG23 ILE A 156 53.804 38.746 39.467 1.00 0.00 H ATOM 2357 H ILE A 156 53.282 42.170 36.128 1.00 0.00 H ATOM 2358 N THR A 157 51.238 38.802 35.485 1.00 18.10 N ATOM 2359 CA THR A 157 49.812 38.565 35.319 1.00 17.78 C ATOM 2360 C THR A 157 49.369 37.197 35.785 1.00 16.87 C ATOM 2361 O THR A 157 50.160 36.269 35.917 1.00 16.45 O ATOM 2362 CB THR A 157 49.404 38.696 33.841 1.00 18.13 C ATOM 2363 OG1 THR A 157 50.174 37.780 33.059 1.00 19.54 O ATOM 2364 CG2 THR A 157 49.729 40.049 33.279 1.00 19.10 C ATOM 2365 HA THR A 157 49.327 39.320 35.938 1.00 0.00 H ATOM 2366 HB THR A 157 48.331 38.511 33.800 1.00 0.00 H ATOM 2367 HG1 THR A 157 51.136 37.990 33.159 1.00 0.00 H ATOM 2368 HG23 THR A 157 49.175 40.811 33.827 1.00 0.00 H ATOM 2369 HG21 THR A 157 50.799 40.234 33.377 1.00 0.00 H ATOM 2370 HG22 THR A 157 49.448 40.081 32.226 1.00 0.00 H ATOM 2371 H THR A 157 51.924 38.186 35.003 1.00 0.00 H ATOM 2372 N ILE A 158 48.066 37.098 36.014 1.00 16.52 N ATOM 2373 CA ILE A 158 47.418 35.847 36.336 1.00 16.51 C ATOM 2374 C ILE A 158 46.972 35.317 34.972 1.00 16.91 C ATOM 2375 O ILE A 158 45.956 35.745 34.436 1.00 16.99 O ATOM 2376 CB ILE A 158 46.225 36.102 37.266 1.00 16.33 C ATOM 2377 CG1 ILE A 158 46.712 36.738 38.575 1.00 15.88 C ATOM 2378 CG2 ILE A 158 45.493 34.815 37.549 1.00 16.47 C ATOM 2379 CD1 ILE A 158 45.592 37.102 39.549 1.00 15.78 C ATOM 2380 HA ILE A 158 48.059 35.139 36.861 1.00 0.00 H ATOM 2381 HB ILE A 158 45.535 36.788 36.774 1.00 0.00 H ATOM 2382 HG12 ILE A 158 47.380 36.033 39.070 1.00 0.00 H ATOM 2383 HG13 ILE A 158 47.261 37.647 38.330 1.00 0.00 H ATOM 2384 HD11 ILE A 158 44.919 37.817 39.076 1.00 0.00 H ATOM 2385 HD12 ILE A 158 45.038 36.202 39.816 1.00 0.00 H ATOM 2386 HD13 ILE A 158 46.023 37.545 40.447 1.00 0.00 H ATOM 2387 HG21 ILE A 158 45.129 34.392 36.613 1.00 0.00 H ATOM 2388 HG22 ILE A 158 46.172 34.110 38.028 1.00 0.00 H ATOM 2389 HG23 ILE A 158 44.650 35.016 38.210 1.00 0.00 H ATOM 2390 H ILE A 158 47.485 37.959 35.959 1.00 0.00 H ATOM 2391 N ALA A 159 47.761 34.415 34.400 1.00 17.30 N ATOM 2392 CA ALA A 159 47.491 33.911 33.056 1.00 17.77 C ATOM 2393 C ALA A 159 46.270 33.001 33.030 1.00 17.95 C ATOM 2394 O ALA A 159 45.534 32.951 32.041 1.00 18.66 O ATOM 2395 CB ALA A 159 48.714 33.188 32.517 1.00 18.15 C ATOM 2396 HA ALA A 159 47.271 34.764 32.414 1.00 0.00 H ATOM 2397 HB1 ALA A 159 49.556 33.879 32.479 1.00 0.00 H ATOM 2398 HB2 ALA A 159 48.958 32.352 33.172 1.00 0.00 H ATOM 2399 HB3 ALA A 159 48.502 32.816 31.515 1.00 0.00 H ATOM 2400 H ALA A 159 48.589 34.060 34.920 1.00 0.00 H ATOM 2401 N ASP A 160 46.070 32.260 34.110 1.00 17.71 N ATOM 2402 CA ASP A 160 44.907 31.390 34.233 1.00 17.60 C ATOM 2403 C ASP A 160 44.638 31.216 35.716 1.00 16.79 C ATOM 2404 O ASP A 160 45.529 31.428 36.539 1.00 15.94 O ATOM 2405 CB ASP A 160 45.165 30.045 33.553 1.00 18.39 C ATOM 2406 CG ASP A 160 43.890 29.259 33.283 1.00 19.58 C ATOM 2407 OD1 ASP A 160 42.782 29.838 33.310 1.00 21.23 O ATOM 2408 OD2 ASP A 160 43.913 28.032 33.039 1.00 23.34 O ATOM 2409 HA ASP A 160 44.039 31.827 33.740 1.00 0.00 H ATOM 2410 HB2 ASP A 160 45.669 30.227 32.604 1.00 0.00 H ATOM 2411 HB3 ASP A 160 45.811 29.448 34.197 1.00 0.00 H ATOM 2412 H ASP A 160 46.759 32.300 34.888 1.00 0.00 H ATOM 2413 N CYS A 161 43.405 30.871 36.056 1.00 15.88 N ATOM 2414 CA CYS A 161 43.028 30.655 37.444 1.00 15.45 C ATOM 2415 C CYS A 161 41.751 29.839 37.485 1.00 15.61 C ATOM 2416 O CYS A 161 41.007 29.764 36.502 1.00 15.67 O ATOM 2417 CB CYS A 161 42.865 31.975 38.208 1.00 14.74 C ATOM 2418 SG CYS A 161 41.862 33.245 37.428 1.00 13.95 S ATOM 2419 HA CYS A 161 43.829 30.108 37.942 1.00 0.00 H ATOM 2420 HB2 CYS A 161 43.860 32.391 38.364 1.00 0.00 H ATOM 2421 HB3 CYS A 161 42.413 31.744 39.173 1.00 0.00 H ATOM 2422 HG CYS A 161 40.583 32.765 37.235 1.00 0.00 H ATOM 2423 H CYS A 161 42.689 30.752 35.312 1.00 0.00 H ATOM 2424 N GLY A 162 41.507 29.218 38.627 1.00 15.80 N ATOM 2425 CA GLY A 162 40.331 28.401 38.788 1.00 16.16 C ATOM 2426 C GLY A 162 40.316 27.673 40.111 1.00 16.82 C ATOM 2427 O GLY A 162 41.133 27.928 41.005 1.00 16.40 O ATOM 2428 HA3 GLY A 162 40.301 27.667 37.983 1.00 0.00 H ATOM 2429 HA2 GLY A 162 39.449 29.039 38.729 1.00 0.00 H ATOM 2430 H GLY A 162 42.173 29.321 39.419 1.00 0.00 H ATOM 2431 N GLN A 163 39.353 26.768 40.232 1.00 17.64 N ATOM 2432 CA GLN A 163 39.207 25.967 41.428 1.00 18.92 C ATOM 2433 C GLN A 163 39.720 24.563 41.163 1.00 20.73 C ATOM 2434 O GLN A 163 39.439 23.983 40.115 1.00 21.05 O ATOM 2435 CB GLN A 163 37.741 25.925 41.844 1.00 18.71 C ATOM 2436 CG GLN A 163 37.474 25.190 43.134 1.00 18.60 C ATOM 2437 CD GLN A 163 36.083 25.432 43.660 1.00 19.05 C ATOM 2438 OE1 GLN A 163 35.286 26.125 43.023 1.00 17.50 O ATOM 2439 NE2 GLN A 163 35.784 24.869 44.827 1.00 18.56 N ATOM 2440 HA GLN A 163 39.788 26.410 42.237 1.00 0.00 H ATOM 2441 HB2 GLN A 163 37.390 26.951 41.958 1.00 0.00 H ATOM 2442 HB3 GLN A 163 37.176 25.436 41.051 1.00 0.00 H ATOM 2443 HG2 GLN A 163 37.601 24.121 42.960 1.00 0.00 H ATOM 2444 HG3 GLN A 163 38.194 25.523 43.882 1.00 0.00 H ATOM 2445 HE22 GLN A 163 36.494 24.293 45.324 1.00 0.00 H ATOM 2446 HE21 GLN A 163 34.841 25.004 45.243 1.00 0.00 H ATOM 2447 H GLN A 163 38.686 26.631 39.446 1.00 0.00 H ATOM 2448 N LEU A 164 40.501 24.028 42.089 1.00 22.53 N ATOM 2449 CA LEU A 164 40.976 22.662 41.964 1.00 24.65 C ATOM 2450 C LEU A 164 40.033 21.776 42.754 1.00 26.07 C ATOM 2451 O LEU A 164 39.382 20.886 42.198 1.00 27.16 O ATOM 2452 CB LEU A 164 42.404 22.528 42.495 1.00 24.65 C ATOM 2453 CG LEU A 164 43.501 23.069 41.581 1.00 25.94 C ATOM 2454 CD1 LEU A 164 44.853 23.007 42.275 1.00 26.81 C ATOM 2455 CD2 LEU A 164 43.532 22.305 40.266 1.00 26.66 C ATOM 2456 HA LEU A 164 40.993 22.366 40.915 1.00 0.00 H ATOM 2457 HB2 LEU A 164 42.462 23.064 43.442 1.00 0.00 H ATOM 2458 HB3 LEU A 164 42.601 21.470 42.665 1.00 0.00 H ATOM 2459 HG LEU A 164 43.279 24.113 41.360 1.00 0.00 H ATOM 2460 HD21 LEU A 164 43.726 21.251 40.464 1.00 0.00 H ATOM 2461 HD22 LEU A 164 42.571 22.410 39.763 1.00 0.00 H ATOM 2462 HD23 LEU A 164 44.321 22.708 39.632 1.00 0.00 H ATOM 2463 HD11 LEU A 164 44.821 23.608 43.184 1.00 0.00 H ATOM 2464 HD12 LEU A 164 45.082 21.972 42.529 1.00 0.00 H ATOM 2465 HD13 LEU A 164 45.621 23.397 41.607 1.00 0.00 H ATOM 2466 H LEU A 164 40.778 24.594 42.917 1.00 0.00 H ATOM 2467 N GLU A 165 39.948 22.050 44.051 1.00 27.74 N ATOM 2468 CA GLU A 165 39.126 21.271 44.966 1.00 29.01 C ATOM 2469 C GLU A 165 38.253 22.158 45.856 1.00 29.08 C ATOM 2470 O GLU A 165 37.502 21.669 46.711 1.00 30.87 O ATOM 2471 CB GLU A 165 40.020 20.393 45.849 1.00 29.60 C ATOM 2472 CG GLU A 165 41.071 19.600 45.095 1.00 31.55 C ATOM 2473 CD GLU A 165 42.464 20.199 45.178 1.00 34.03 C ATOM 2474 OE1 GLU A 165 43.452 19.434 45.083 1.00 35.78 O ATOM 2475 OE2 GLU A 165 42.583 21.430 45.331 1.00 37.37 O ATOM 2476 HA GLU A 165 38.465 20.651 44.360 1.00 0.00 H ATOM 2477 OXT GLU A 165 38.256 23.376 45.764 1.00 27.46 O ATOM 2478 HB2 GLU A 165 40.529 21.038 46.565 1.00 0.00 H ATOM 2479 HB3 GLU A 165 39.383 19.690 46.385 1.00 0.00 H ATOM 2480 HG2 GLU A 165 41.104 18.592 45.509 1.00 0.00 H ATOM 2481 HG3 GLU A 165 40.779 19.551 44.046 1.00 0.00 H ATOM 2482 H GLU A 165 40.490 22.853 44.428 1.00 0.00 H TER 2483 GLU A 165 HETATM 2484 O HOH 1 37.285 47.144 54.170 1.00 11.80 O HETATM 2485 O HOH 2 39.405 44.034 54.651 1.00 11.87 O HETATM 2486 O HOH 3 35.306 40.783 54.606 1.00 12.41 O HETATM 2487 O HOH 4 41.181 38.786 59.722 1.00 12.96 O HETATM 2488 O HOH 5 39.442 36.577 59.570 1.00 13.27 O HETATM 2489 O HOH 6 45.650 44.595 39.888 1.00 13.55 O HETATM 2490 O HOH 7 43.112 41.057 60.629 1.00 14.00 O HETATM 2491 O HOH 8 37.314 38.104 48.851 1.00 14.13 O HETATM 2492 O HOH 9 60.455 41.058 55.616 1.00 14.89 O HETATM 2493 O HOH 10 33.259 35.370 38.744 1.00 15.11 O HETATM 2494 O HOH 11 46.063 50.024 44.868 1.00 15.18 O HETATM 2495 O HOH 12 51.357 37.949 57.405 1.00 15.39 O HETATM 2496 O HOH 13 39.315 44.842 48.069 1.00 15.86 O HETATM 2497 O HOH 14 38.592 34.662 36.464 1.00 16.84 O HETATM 2498 O HOH 15 38.929 47.659 57.782 1.00 17.56 O HETATM 2499 O HOH 16 50.001 38.930 63.468 1.00 18.55 O HETATM 2500 O HOH 17 52.907 43.737 37.206 1.00 18.58 O HETATM 2501 O HOH 18 45.456 40.651 39.829 1.00 18.57 O HETATM 2502 O HOH 19 38.763 46.140 44.907 1.00 19.47 O HETATM 2503 O HOH 20 39.863 21.809 48.527 1.00 19.44 O HETATM 2504 O HOH 21 39.023 31.917 35.416 1.00 20.12 O HETATM 2505 O HOH 22 33.302 29.177 49.201 1.00 21.25 O HETATM 2506 O HOH 23 45.165 44.413 36.488 1.00 21.30 O HETATM 2507 O HOH 24 58.479 32.691 52.176 1.00 21.55 O HETATM 2508 O HOH 25 44.502 50.383 57.097 1.00 21.90 O HETATM 2509 O HOH 26 53.933 45.213 61.563 1.00 21.83 O HETATM 2510 O HOH 27 59.144 35.142 52.446 1.00 22.01 O HETATM 2511 O HOH 28 57.918 47.675 60.191 1.00 22.11 O HETATM 2512 O HOH 29 28.137 39.291 34.590 1.00 22.50 O HETATM 2513 O HOH 30 32.444 30.183 51.455 1.00 22.82 O HETATM 2514 O HOH 31 40.530 49.745 56.917 1.00 24.32 O HETATM 2515 O HOH 32 55.885 34.188 61.174 1.00 24.70 O HETATM 2516 O HOH 33 31.283 34.997 59.083 1.00 24.84 O HETATM 2517 O HOH 34 37.031 40.272 34.351 1.00 25.18 O HETATM 2518 O HOH 35 37.743 26.521 37.776 1.00 25.22 O HETATM 2519 O HOH 36 36.204 39.889 64.652 1.00 25.36 O HETATM 2520 O HOH 37 54.954 42.343 62.009 1.00 25.90 O HETATM 2521 O HOH 38 26.967 42.470 50.981 1.00 25.89 O HETATM 2522 O HOH 39 53.349 48.014 38.847 1.00 25.78 O HETATM 2523 O HOH 40 52.659 38.675 32.062 1.00 25.85 O HETATM 2524 O HOH 41 54.468 26.274 49.157 1.00 25.95 O HETATM 2525 O HOH 42 47.203 45.708 64.557 1.00 25.96 O HETATM 2526 O HOH 43 37.149 35.928 34.491 1.00 26.70 O HETATM 2527 O HOH 44 58.361 37.435 58.769 1.00 26.92 O HETATM 2528 O HOH 45 31.445 28.497 57.220 1.00 27.04 O HETATM 2529 O HOH 46 62.147 46.035 50.449 1.00 27.18 O HETATM 2530 O HOH 47 45.468 33.658 63.249 1.00 27.40 O HETATM 2531 O HOH 48 54.636 25.639 39.171 1.00 28.11 O HETATM 2532 O HOH 49 35.346 47.286 59.931 1.00 28.62 O HETATM 2533 O HOH 50 40.920 21.822 51.702 1.00 28.88 O HETATM 2534 O HOH 51 34.494 35.017 33.430 1.00 29.06 O HETATM 2535 O HOH 52 29.780 40.010 57.161 1.00 30.23 O HETATM 2536 O HOH 53 46.144 33.305 60.341 1.00 30.32 O HETATM 2537 O HOH 54 26.908 37.653 37.444 1.00 30.84 O HETATM 2538 O HOH 55 26.316 33.328 37.251 1.00 30.79 O HETATM 2539 O HOH 56 52.114 29.962 34.299 1.00 31.68 O HETATM 2540 O HOH 57 39.004 48.108 60.649 1.00 32.00 O HETATM 2541 O HOH 58 30.100 48.055 52.571 1.00 32.30 O HETATM 2542 O HOH 59 32.793 26.547 48.934 1.00 32.81 O HETATM 2543 O HOH 60 60.711 36.327 50.508 1.00 32.81 O HETATM 2544 O HOH 61 27.637 44.461 49.244 1.00 33.80 O HETATM 2545 O HOH 62 34.892 53.499 54.879 1.00 33.87 O HETATM 2546 O HOH 63 61.985 31.423 44.089 1.00 34.03 O HETATM 2547 O HOH 64 27.330 31.694 39.261 1.00 34.06 O HETATM 2548 O HOH 65 27.076 45.191 53.276 1.00 34.61 O HETATM 2549 O HOH 66 62.407 29.384 49.797 1.00 34.96 O HETATM 2550 O HOH 67 38.519 49.072 48.310 1.00 34.74 O HETATM 2551 O HOH 68 51.431 29.486 53.624 1.00 35.24 O HETATM 2552 O HOH 69 53.383 31.348 57.568 1.00 35.51 O HETATM 2553 O HOH 70 33.044 25.122 45.841 1.00 35.60 O HETATM 2554 O HOH 71 59.512 29.563 51.919 1.00 35.84 O HETATM 2555 O HOH 72 32.563 26.951 39.146 1.00 36.37 O HETATM 2556 O HOH 73 48.213 21.791 40.523 1.00 36.14 O HETATM 2557 O HOH 74 37.932 48.523 45.824 1.00 37.05 O HETATM 2558 O HOH 75 39.449 45.816 64.389 1.00 36.70 O HETATM 2559 O HOH 76 28.246 32.913 44.913 1.00 36.71 O HETATM 2560 O HOH 77 52.016 50.248 41.818 1.00 37.64 O HETATM 2561 O HOH 78 39.133 17.999 42.863 1.00 37.76 O HETATM 2562 O HOH 79 32.565 32.733 60.917 1.00 38.48 O HETATM 2563 O HOH 80 39.582 28.171 35.057 1.00 38.16 O HETATM 2564 O HOH 81 46.618 24.261 53.023 1.00 38.35 O HETATM 2565 O HOH 82 43.306 33.314 64.861 1.00 38.33 O HETATM 2566 O HOH 83 47.996 21.737 52.176 1.00 38.72 O HETATM 2567 O HOH 84 57.895 40.811 60.050 1.00 38.67 O HETATM 2568 O HOH 85 28.839 42.267 41.426 1.00 38.79 O HETATM 2569 O HOH 86 44.389 52.480 58.525 1.00 39.00 O HETATM 2570 O HOH 87 60.022 29.334 36.136 1.00 39.27 O HETATM 2571 O HOH 88 49.457 50.709 38.699 1.00 39.49 O HETATM 2572 O HOH 89 38.223 22.059 55.293 1.00 39.64 O HETATM 2573 O HOH 90 37.854 51.157 44.315 1.00 38.97 O HETATM 2574 O HOH 91 51.504 31.544 59.699 1.00 39.49 O HETATM 2575 O HOH 92 36.958 50.602 33.486 1.00 40.22 O HETATM 2576 O HOH 93 35.891 49.864 39.055 1.00 40.69 O HETATM 2577 O HOH 94 27.891 47.621 47.351 1.00 40.69 O HETATM 2578 O HOH 95 62.226 37.009 46.852 1.00 40.33 O HETATM 2579 O HOH 96 45.218 21.855 53.669 1.00 40.90 O HETATM 2580 O HOH 97 24.582 42.419 47.872 1.00 41.40 O HETATM 2581 O HOH 98 30.329 41.484 59.796 1.00 40.93 O HETATM 2582 O HOH 99 54.198 25.585 41.979 1.00 40.52 O HETATM 2583 O HOH 100 45.993 46.788 37.829 1.00 41.45 O HETATM 2584 O HOH 101 62.640 33.843 28.388 1.00 41.78 O HETATM 2585 O HOH 102 42.989 22.938 50.648 1.00 42.32 O HETATM 2586 O HOH 103 62.553 39.662 48.570 1.00 42.42 O HETATM 2587 O HOH 104 59.535 37.074 30.495 1.00 42.30 O HETATM 2588 O HOH 105 26.986 47.954 44.031 1.00 42.80 O HETATM 2589 O HOH 106 57.052 26.415 47.622 1.00 42.43 O HETATM 2590 O HOH 107 35.352 47.986 46.333 1.00 42.46 O HETATM 2591 O HOH 108 47.156 41.384 66.445 1.00 42.81 O HETATM 2592 O HOH 109 40.688 50.785 60.581 1.00 43.02 O HETATM 2593 O HOH 110 28.149 46.925 51.617 1.00 43.25 O HETATM 2594 O HOH 111 50.720 37.483 65.516 1.00 42.90 O HETATM 2595 O HOH 112 56.024 52.192 49.690 1.00 43.21 O HETATM 2596 O HOH 113 52.557 51.389 44.116 1.00 43.34 O HETATM 2597 O HOH 114 30.991 27.996 53.335 1.00 43.16 O HETATM 2598 O HOH 115 44.790 23.855 56.687 1.00 43.96 O HETATM 2599 O HOH 116 32.808 48.509 60.680 1.00 44.00 O HETATM 2600 O HOH 117 63.633 49.480 45.232 1.00 43.83 O HETATM 2601 O HOH 118 62.840 31.876 46.912 1.00 43.53 O HETATM 2602 O HOH 119 34.542 25.146 40.035 1.00 44.41 O HETATM 2603 O HOH 120 33.625 24.998 51.570 1.00 44.50 O HETATM 2604 O HOH 121 31.782 45.212 59.547 1.00 44.64 O HETATM 2605 O HOH 122 55.347 24.475 46.297 1.00 44.23 O HETATM 2606 O HOH 123 38.492 37.536 32.949 1.00 42.06 O HETATM 2607 O HOH 124 34.602 46.340 34.016 1.00 45.09 O HETATM 2608 O HOH 125 54.305 46.488 34.853 1.00 44.81 O HETATM 2609 O HOH 126 56.298 25.048 43.116 1.00 45.70 O HETATM 2610 O HOH 127 34.267 22.017 54.892 1.00 46.34 O HETATM 2611 O HOH 128 42.452 25.184 57.617 1.00 46.37 O HETATM 2612 O HOH 129 65.320 40.846 33.429 1.00 46.24 O HETATM 2613 O HOH 130 46.406 43.551 33.425 1.00 46.90 O HETATM 2614 O HOH 131 45.882 20.581 45.245 1.00 46.83 O HETATM 2615 O HOH 132 51.787 27.371 35.395 1.00 46.44 O HETATM 2616 O HOH 133 65.363 44.618 41.991 1.00 46.76 O HETATM 2617 O HOH 134 30.167 27.203 42.092 1.00 46.59 O HETATM 2618 O HOH 135 59.941 31.744 28.844 1.00 46.38 O HETATM 2619 O HOH 136 29.616 41.332 33.504 1.00 46.98 O HETATM 2620 O HOH 137 43.969 47.387 63.976 1.00 46.73 O HETATM 2621 O HOH 138 33.344 52.368 38.958 1.00 47.33 O HETATM 2622 O HOH 139 49.779 18.969 44.885 1.00 46.25 O HETATM 2623 O HOH 140 43.162 40.207 63.586 1.00 46.93 O HETATM 2624 O HOH 141 49.463 51.345 42.272 1.00 48.66 O HETATM 2625 O HOH 142 36.486 28.115 35.699 1.00 48.56 O HETATM 2626 O HOH 143 32.321 40.874 62.833 1.00 49.16 O HETATM 2627 O HOH 144 36.929 19.175 47.040 1.00 49.19 O HETATM 2628 O HOH 145 62.336 35.609 39.359 1.00 50.42 O HETATM 2629 O HOH 146 34.960 50.624 45.620 1.00 50.32 O HETATM 2630 O HOH 147 45.855 26.124 33.499 1.00 49.87 O HETATM 2631 O HOH 148 60.625 47.809 39.435 1.00 50.37 O HETATM 2632 O HOH 149 39.169 32.182 29.217 1.00 50.88 O HETATM 2633 O HOH 150 31.787 51.983 53.411 1.00 50.24 O HETATM 2634 O HOH 151 45.236 21.167 37.454 1.00 49.90 O HETATM 2635 O HOH 152 63.472 40.374 46.157 1.00 50.55 O HETATM 2636 O HOH 153 31.939 21.795 54.273 1.00 51.78 O HETATM 2637 O HOH 154 47.833 22.421 45.739 1.00 51.15 O HETATM 2638 O HOH 155 59.015 38.808 62.585 1.00 51.12 O HETATM 2639 O HOH 156 52.055 54.585 42.618 1.00 52.97 O HETATM 2640 O HOH 157 47.827 49.316 64.416 1.00 52.78 O HETATM 2641 O HOH 158 30.079 51.373 49.124 1.00 53.04 O HETATM 2642 O HOH 159 54.915 41.903 28.280 1.00 52.91 O HETATM 2643 O HOH 160 51.669 47.500 32.788 1.00 53.97 O HETATM 2644 O HOH 161 35.439 19.890 55.497 1.00 53.99 O HETATM 2645 O HOH 162 57.541 26.739 37.739 1.00 54.20 O HETATM 2646 O HOH 163 34.916 24.782 54.278 1.00 53.14 O HETATM 2647 O HOH 164 62.534 39.258 50.936 1.00 55.98 O HETATM 2648 O HOH 165 53.126 52.529 47.032 1.00 55.36 O HETATM 2649 O HOH 166 40.089 56.457 40.820 1.00 55.83 O HETATM 2650 O HOH 167 35.208 22.698 48.763 1.00 56.72 O HETATM 2651 O HOH 168 35.657 49.987 42.697 1.00 56.54 O HETATM 2652 O HOH 169 49.634 54.155 43.614 1.00 56.99 O HETATM 2653 O HOH 170 60.303 51.336 40.496 1.00 57.25 O HETATM 2654 O HOH 171 58.430 26.041 40.352 1.00 57.84 O HETATM 2655 O HOH 172 50.315 21.216 47.606 1.00 60.49 O HETATM 2656 O HOH 173 44.965 23.319 35.076 1.00 60.51 O HETATM 2657 O HOH 174 62.872 45.430 40.101 1.00 63.70 O HETATM 2658 O HOH 175 30.062 51.925 46.063 1.00 64.13 O HETATM 2659 O HOH 176 62.317 51.836 44.182 1.00 64.68 O HETATM 2660 O HOH 177 37.725 32.565 33.091 1.00 66.45 O HETATM 2661 O HOH 178 53.425 45.887 64.189 1.00 67.07 O HETATM 2662 O HOH 179 41.197 22.212 54.822 1.00 67.61 O HETATM 2663 O HOH 180 49.529 41.949 66.293 1.00 68.01 O HETATM 2664 O HOH 181 36.112 43.708 34.027 1.00 71.37 O HETATM 2665 O HOH 182 49.531 57.243 48.090 1.00 18.03 O HETATM 2666 O HOH 183 59.670 51.387 59.723 1.00 18.21 O HETATM 2667 O HOH 184 46.400 54.431 43.533 1.00 27.28 O HETATM 2668 O HOH 185 62.915 48.306 58.462 1.00 30.06 O HETATM 2669 O HOH 186 63.121 35.469 48.622 1.00 36.42 O HETATM 2670 O HOH 187 35.957 26.156 33.971 1.00 45.90 O HETATM 2671 O HOH 188 51.085 47.264 65.886 1.00 51.97 O HETATM 2672 O77 SFA A 189 60.203 49.189 58.251 1.00 -0.40 O HETATM 2673 C41 SFA A 189 59.652 48.972 57.161 1.00 0.18 C HETATM 2674 C40 SFA A 189 59.157 50.144 56.255 1.00 0.05 C HETATM 2675 C43 SFA A 189 60.347 50.824 55.570 1.00 -0.04 C HETATM 2676 C44 SFA A 189 61.315 51.505 56.490 1.00 -0.06 C HETATM 2677 H4 SFA A 189 62.126 51.957 55.900 1.00 0.02 H HETATM 2678 H5 SFA A 189 61.738 50.768 57.188 1.00 0.02 H HETATM 2679 H6 SFA A 189 60.792 52.289 57.057 1.00 0.02 H HETATM 2680 H2 SFA A 189 59.952 51.579 54.874 1.00 0.03 H HETATM 2681 H3 SFA A 189 60.898 50.057 55.006 1.00 0.03 H HETATM 2682 C39 SFA A 189 58.212 49.649 55.153 1.00 -0.03 C HETATM 2683 C38 SFA A 189 58.750 48.401 54.482 1.00 0.01 C HETATM 2684 C37 SFA A 189 58.804 47.267 55.528 1.00 0.16 C HETATM 2685 N42 SFA A 189 59.486 47.707 56.762 1.00 -0.26 N HETATM 2686 H9 SFA A 189 59.858 46.992 57.354 1.00 0.19 H HETATM 2687 O76 SFA A 189 57.430 46.939 55.833 1.00 -0.35 O HETATM 2688 C33 SFA A 189 57.192 45.962 56.810 1.00 0.07 C HETATM 2689 C34 SFA A 189 57.784 44.606 56.318 1.00 0.01 C HETATM 2690 C35 SFA A 189 59.294 44.792 55.965 1.00 0.07 C HETATM 2691 C36 SFA A 189 59.460 45.968 54.956 1.00 0.03 C HETATM 2692 C46 SFA A 189 60.932 46.215 54.618 1.00 -0.06 C HETATM 2693 H15 SFA A 189 61.376 45.292 54.218 1.00 0.02 H HETATM 2694 H16 SFA A 189 61.471 46.517 55.528 1.00 0.02 H HETATM 2695 H17 SFA A 189 61.006 47.014 53.865 1.00 0.02 H HETATM 2696 H14 SFA A 189 58.938 45.697 54.027 1.00 0.04 H HETATM 2697 O75 SFA A 189 60.036 45.025 57.178 1.00 -0.39 O HETATM 2698 H19 SFA A 189 59.913 44.291 57.769 1.00 0.21 H HETATM 2699 H18 SFA A 189 59.669 43.871 55.494 1.00 0.06 H HETATM 2700 C47 SFA A 189 57.619 43.439 57.335 1.00 -0.06 C HETATM 2701 H21 SFA A 189 56.554 43.313 57.579 1.00 0.02 H HETATM 2702 H22 SFA A 189 58.181 43.670 58.252 1.00 0.02 H HETATM 2703 H23 SFA A 189 58.006 42.509 56.892 1.00 0.02 H HETATM 2704 H20 SFA A 189 57.246 44.323 55.401 1.00 0.03 H HETATM 2705 C32 SFA A 189 55.721 45.785 57.145 1.00 0.00 C HETATM 2706 C31 SFA A 189 55.183 47.008 57.895 1.00 0.06 C HETATM 2707 O74 SFA A 189 55.468 46.819 59.287 1.00 -0.39 O HETATM 2708 H28 SFA A 189 56.407 46.740 59.409 1.00 0.21 H HETATM 2709 C30 SFA A 189 53.658 47.119 57.691 1.00 -0.02 C HETATM 2710 C48 SFA A 189 52.952 45.876 58.220 1.00 -0.06 C HETATM 2711 H30 SFA A 189 51.868 45.976 58.065 1.00 0.02 H HETATM 2712 H31 SFA A 189 53.160 45.766 59.294 1.00 0.02 H HETATM 2713 H32 SFA A 189 53.319 44.989 57.682 1.00 0.02 H HETATM 2714 C29 SFA A 189 53.122 48.370 58.391 1.00 -0.04 C HETATM 2715 C28 SFA A 189 53.504 49.668 57.681 1.00 -0.03 C HETATM 2716 C27 SFA A 189 52.751 49.778 56.327 1.00 -0.10 C HETATM 2717 C26 SFA A 189 53.355 49.978 55.155 1.00 -0.11 C HETATM 2718 C25 SFA A 189 52.598 50.059 54.020 1.00 -0.09 C HETATM 2719 C24 SFA A 189 53.146 50.255 52.811 1.00 -0.03 C HETATM 2720 C49 SFA A 189 54.639 50.410 52.536 1.00 -0.03 C HETATM 2721 H40 SFA A 189 55.196 50.334 53.482 1.00 0.04 H HETATM 2722 H41 SFA A 189 54.827 51.392 52.077 1.00 0.04 H HETATM 2723 H42 SFA A 189 54.970 49.615 51.851 1.00 0.04 H HETATM 2724 C23 SFA A 189 52.352 50.355 51.523 1.00 0.13 C HETATM 2725 O65 SFA A 189 51.053 49.743 51.812 1.00 -0.25 O HETATM 2726 C1 SFA A 189 50.425 49.044 50.862 1.00 0.29 C HETATM 2727 C2 SFA A 189 49.149 48.463 51.391 1.00 0.10 C HETATM 2728 N65 SFA A 189 48.121 48.374 50.343 1.00 0.38 N HETATM 2729 N6 SFA A 189 46.949 47.749 50.736 1.00 -0.24 N HETATM 2730 C7 SFA A 189 45.784 48.405 50.873 1.00 0.24 C HETATM 2731 C8 SFA A 189 45.728 49.873 50.435 1.00 0.14 C HETATM 2732 N9 SFA A 189 44.537 50.117 49.643 1.00 -0.26 N HETATM 2733 C10 SFA A 189 44.495 50.162 48.326 1.00 0.20 C HETATM 2734 C11 SFA A 189 43.172 50.704 47.778 1.00 0.13 C HETATM 2735 N12 SFA A 189 43.581 51.973 47.164 1.00 -0.27 N HETATM 2736 C13 SFA A 189 43.289 53.153 47.730 1.00 0.18 C HETATM 2737 C14 SFA A 189 43.854 54.443 47.069 1.00 0.08 C HETATM 2738 C15 SFA A 189 45.377 54.353 46.682 1.00 0.08 C HETATM 2739 C16 SFA A 189 46.342 54.395 47.937 1.00 0.02 C HETATM 2740 C17 SFA A 189 47.787 54.357 47.440 1.00 0.09 C HETATM 2741 C18 SFA A 189 48.759 54.210 48.640 1.00 -0.06 C HETATM 2742 C19 SFA A 189 49.621 53.177 48.751 1.00 -0.09 C HETATM 2743 C20 SFA A 189 50.451 53.056 49.802 1.00 -0.09 C HETATM 2744 C21 SFA A 189 51.293 52.014 49.871 1.00 -0.08 C HETATM 2745 C22 SFA A 189 52.242 51.833 51.054 1.00 0.02 C HETATM 2746 H44 SFA A 189 53.242 52.182 50.758 1.00 0.05 H HETATM 2747 H45 SFA A 189 51.875 52.441 51.894 1.00 0.05 H HETATM 2748 H46 SFA A 189 51.300 51.281 49.066 1.00 0.06 H HETATM 2749 H47 SFA A 189 50.440 53.802 50.595 1.00 0.04 H HETATM 2750 H48 SFA A 189 49.645 52.421 47.968 1.00 0.04 H HETATM 2751 H49 SFA A 189 48.745 54.968 49.422 1.00 0.06 H HETATM 2752 O73 SFA A 189 48.028 55.560 46.681 1.00 -0.38 O HETATM 2753 H51 SFA A 189 47.916 56.316 47.245 1.00 0.21 H HETATM 2754 H50 SFA A 189 47.920 53.489 46.778 1.00 0.08 H HETATM 2755 C50 SFA A 189 46.120 53.198 48.899 1.00 -0.06 C HETATM 2756 H53 SFA A 189 45.083 53.210 49.267 1.00 0.02 H HETATM 2757 H54 SFA A 189 46.812 53.279 49.750 1.00 0.02 H HETATM 2758 H55 SFA A 189 46.307 52.256 48.362 1.00 0.02 H HETATM 2759 H52 SFA A 189 46.166 55.330 48.488 1.00 0.04 H HETATM 2760 O72 SFA A 189 45.654 53.208 45.855 1.00 -0.39 O HETATM 2761 H57 SFA A 189 46.552 53.251 45.548 1.00 0.21 H HETATM 2762 H56 SFA A 189 45.601 55.246 46.080 1.00 0.06 H HETATM 2763 C51 SFA A 189 43.061 54.770 45.799 1.00 -0.01 C HETATM 2764 C52 SFA A 189 41.560 54.951 46.071 1.00 0.02 C HETATM 2765 C53 SFA A 189 40.802 55.137 44.772 1.00 0.10 C HETATM 2766 C54 SFA A 189 39.416 54.539 44.561 1.00 0.01 C HETATM 2767 H63 SFA A 189 39.055 54.796 43.554 1.00 0.05 H HETATM 2768 H64 SFA A 189 38.723 54.944 45.313 1.00 0.05 H HETATM 2769 H65 SFA A 189 39.469 53.445 44.663 1.00 0.05 H HETATM 2770 O71 SFA A 189 41.240 55.753 43.795 1.00 -0.39 O HETATM 2771 H61 SFA A 189 41.412 55.837 46.706 1.00 0.05 H HETATM 2772 H62 SFA A 189 41.176 54.060 46.589 1.00 0.05 H HETATM 2773 H59 SFA A 189 43.192 53.948 45.080 1.00 0.03 H HETATM 2774 H60 SFA A 189 43.456 55.701 45.367 1.00 0.03 H HETATM 2775 H58 SFA A 189 43.733 55.267 47.787 1.00 0.06 H HETATM 2776 O70 SFA A 189 42.602 53.218 48.762 1.00 -0.40 O HETATM 2777 H66 SFA A 189 44.090 51.957 46.303 1.00 0.19 H HETATM 2778 C55 SFA A 189 42.565 49.761 46.719 1.00 -0.01 C HETATM 2779 C56 SFA A 189 41.331 50.438 46.091 1.00 -0.06 C HETATM 2780 H69 SFA A 189 40.892 49.771 45.334 1.00 0.02 H HETATM 2781 H70 SFA A 189 41.633 51.383 45.616 1.00 0.02 H HETATM 2782 H71 SFA A 189 40.587 50.643 46.875 1.00 0.02 H HETATM 2783 C57 SFA A 189 42.170 48.435 47.355 1.00 -0.06 C HETATM 2784 H72 SFA A 189 43.058 47.962 47.799 1.00 0.02 H HETATM 2785 H73 SFA A 189 41.747 47.771 46.587 1.00 0.02 H HETATM 2786 H74 SFA A 189 41.419 48.614 48.139 1.00 0.02 H HETATM 2787 H68 SFA A 189 43.312 49.572 45.934 1.00 0.03 H HETATM 2788 H67 SFA A 189 42.444 50.866 48.587 1.00 0.08 H HETATM 2789 O69 SFA A 189 45.412 49.839 47.591 1.00 -0.39 O HETATM 2790 H75 SFA A 189 43.679 50.263 50.136 1.00 0.19 H HETATM 2791 C58 SFA A 189 45.560 50.818 51.632 1.00 0.02 C HETATM 2792 C59 SFA A 189 46.605 50.671 52.701 1.00 -0.05 C HETATM 2793 C60 SFA A 189 46.383 49.857 53.815 1.00 -0.03 C HETATM 2794 C61 SFA A 189 47.330 49.716 54.802 1.00 0.08 C HETATM 2795 O68 SFA A 189 47.058 48.899 55.870 1.00 -0.33 O HETATM 2796 H80 SFA A 189 46.902 48.015 55.559 1.00 0.25 H HETATM 2797 C62 SFA A 189 48.525 50.401 54.703 1.00 -0.04 C HETATM 2798 C63 SFA A 189 48.752 51.217 53.621 1.00 -0.08 C HETATM 2799 C64 SFA A 189 47.810 51.359 52.620 1.00 -0.07 C HETATM 2800 H83 SFA A 189 48.010 52.006 51.773 1.00 0.05 H HETATM 2801 H82 SFA A 189 49.688 51.760 53.551 1.00 0.06 H HETATM 2802 H81 SFA A 189 49.279 50.296 55.474 1.00 0.05 H HETATM 2803 H79 SFA A 189 45.443 49.325 53.903 1.00 0.05 H HETATM 2804 H77 SFA A 189 44.577 50.625 52.086 1.00 0.05 H HETATM 2805 H78 SFA A 189 45.595 51.852 51.259 1.00 0.05 H HETATM 2806 H76 SFA A 189 46.638 50.120 49.868 1.00 0.08 H HETATM 2807 O67 SFA A 189 44.776 47.861 51.305 1.00 -0.39 O HETATM 2808 C5 SFA A 189 47.105 46.357 51.207 1.00 0.07 C HETATM 2809 C4 SFA A 189 48.141 46.307 52.324 1.00 -0.02 C HETATM 2810 C3 SFA A 189 49.420 47.056 51.973 1.00 0.01 C HETATM 2811 H90 SFA A 189 49.978 46.469 51.229 1.00 0.03 H HETATM 2812 H91 SFA A 189 50.026 47.163 52.885 1.00 0.03 H HETATM 2813 H88 SFA A 189 48.393 45.255 52.524 1.00 0.03 H HETATM 2814 H89 SFA A 189 47.706 46.758 53.228 1.00 0.03 H HETATM 2815 H86 SFA A 189 47.437 45.723 50.372 1.00 0.06 H HETATM 2816 H87 SFA A 189 46.140 45.989 51.586 1.00 0.06 H HETATM 2817 H84 SFA A 189 47.894 49.310 50.045 1.00 0.23 H HETATM 2818 H85 SFA A 189 48.507 47.859 49.567 1.00 0.23 H HETATM 2819 H92 SFA A 189 48.775 49.115 52.194 1.00 0.11 H HETATM 2820 O66 SFA A 189 50.799 48.849 49.725 1.00 -0.36 O HETATM 2821 H43 SFA A 189 52.855 49.780 50.732 1.00 0.09 H HETATM 2822 H39 SFA A 189 51.516 49.961 54.099 1.00 0.02 H HETATM 2823 H38 SFA A 189 54.438 50.076 55.103 1.00 0.04 H HETATM 2824 H37 SFA A 189 51.666 49.686 56.335 1.00 0.05 H HETATM 2825 H35 SFA A 189 54.588 49.676 57.496 1.00 0.04 H HETATM 2826 H36 SFA A 189 53.234 50.524 58.318 1.00 0.04 H HETATM 2827 H33 SFA A 189 53.527 48.399 59.413 1.00 0.03 H HETATM 2828 H34 SFA A 189 52.025 48.304 58.432 1.00 0.03 H HETATM 2829 H29 SFA A 189 53.455 47.205 56.613 1.00 0.03 H HETATM 2830 H27 SFA A 189 55.673 47.922 57.528 1.00 0.06 H HETATM 2831 H25 SFA A 189 55.600 44.893 57.776 1.00 0.03 H HETATM 2832 H26 SFA A 189 55.152 45.655 56.213 1.00 0.03 H HETATM 2833 H24 SFA A 189 57.714 46.265 57.730 1.00 0.06 H HETATM 2834 C45 SFA A 189 57.804 48.005 53.326 1.00 -0.06 C HETATM 2835 H11 SFA A 189 57.771 48.817 52.585 1.00 0.02 H HETATM 2836 H12 SFA A 189 56.793 47.829 53.723 1.00 0.02 H HETATM 2837 H13 SFA A 189 58.175 47.087 52.847 1.00 0.02 H HETATM 2838 H10 SFA A 189 59.759 48.592 54.087 1.00 0.03 H HETATM 2839 H7 SFA A 189 58.098 50.440 54.398 1.00 0.03 H HETATM 2840 H8 SFA A 189 57.232 49.422 55.597 1.00 0.03 H HETATM 2841 H1 SFA A 189 58.628 50.876 56.883 1.00 0.05 H CONECT 1 2 16 17 18 CONECT 16 1 CONECT 17 1 CONECT 18 1 CONECT 2672 2673 CONECT 2673 2672 2674 2685 CONECT 2674 2673 2675 2682 2841 CONECT 2675 2674 2676 2680 2681 CONECT 2676 2675 2677 2678 2679 CONECT 2677 2676 CONECT 2678 2676 CONECT 2679 2676 CONECT 2680 2675 CONECT 2681 2675 CONECT 2682 2674 2683 2839 2840 CONECT 2683 2682 2684 2834 2838 CONECT 2684 2683 2685 2687 2691 CONECT 2685 2673 2684 2686 CONECT 2686 2685 CONECT 2687 2684 2688 CONECT 2688 2687 2689 2705 2833 CONECT 2689 2688 2690 2700 2704 CONECT 2690 2689 2691 2697 2699 CONECT 2691 2684 2690 2692 2696 CONECT 2692 2691 2693 2694 2695 CONECT 2693 2692 CONECT 2694 2692 CONECT 2695 2692 CONECT 2696 2691 CONECT 2697 2690 2698 CONECT 2698 2697 CONECT 2699 2690 CONECT 2700 2689 2701 2702 2703 CONECT 2701 2700 CONECT 2702 2700 CONECT 2703 2700 CONECT 2704 2689 CONECT 2705 2688 2706 2831 2832 CONECT 2706 2705 2707 2709 2830 CONECT 2707 2706 2708 CONECT 2708 2707 CONECT 2709 2706 2710 2714 2829 CONECT 2710 2709 2711 2712 2713 CONECT 2711 2710 CONECT 2712 2710 CONECT 2713 2710 CONECT 2714 2709 2715 2827 2828 CONECT 2715 2714 2716 2825 2826 CONECT 2716 2715 2717 2824 CONECT 2717 2716 2718 2823 CONECT 2718 2717 2719 2822 CONECT 2719 2718 2720 2724 CONECT 2720 2719 2721 2722 2723 CONECT 2721 2720 CONECT 2722 2720 CONECT 2723 2720 CONECT 2724 2719 2725 2745 2821 CONECT 2725 2724 2726 CONECT 2726 2725 2727 2820 CONECT 2727 2726 2728 2810 2819 CONECT 2728 2727 2729 2817 2818 CONECT 2729 2728 2730 2808 CONECT 2730 2729 2731 2807 CONECT 2731 2730 2732 2791 2806 CONECT 2732 2731 2733 2790 CONECT 2733 2732 2734 2789 CONECT 2734 2733 2735 2778 2788 CONECT 2735 2734 2736 2777 CONECT 2736 2735 2737 2776 CONECT 2737 2736 2738 2763 2775 CONECT 2738 2737 2739 2760 2762 CONECT 2739 2738 2740 2755 2759 CONECT 2740 2739 2741 2752 2754 CONECT 2741 2740 2742 2751 CONECT 2742 2741 2743 2750 CONECT 2743 2742 2744 2749 CONECT 2744 2743 2745 2748 CONECT 2745 2724 2744 2746 2747 CONECT 2746 2745 CONECT 2747 2745 CONECT 2748 2744 CONECT 2749 2743 CONECT 2750 2742 CONECT 2751 2741 CONECT 2752 2740 2753 CONECT 2753 2752 CONECT 2754 2740 CONECT 2755 2739 2756 2757 2758 CONECT 2756 2755 CONECT 2757 2755 CONECT 2758 2755 CONECT 2759 2739 CONECT 2760 2738 2761 CONECT 2761 2760 CONECT 2762 2738 CONECT 2763 2737 2764 2773 2774 CONECT 2764 2763 2765 2771 2772 CONECT 2765 2764 2766 2770 CONECT 2766 2765 2767 2768 2769 CONECT 2767 2766 CONECT 2768 2766 CONECT 2769 2766 CONECT 2770 2765 CONECT 2771 2764 CONECT 2772 2764 CONECT 2773 2763 CONECT 2774 2763 CONECT 2775 2737 CONECT 2776 2736 CONECT 2777 2735 CONECT 2778 2734 2779 2783 2787 CONECT 2779 2778 2780 2781 2782 CONECT 2780 2779 CONECT 2781 2779 CONECT 2782 2779 CONECT 2783 2778 2784 2785 2786 CONECT 2784 2783 CONECT 2785 2783 CONECT 2786 2783 CONECT 2787 2778 CONECT 2788 2734 CONECT 2789 2733 CONECT 2790 2732 CONECT 2791 2731 2792 2804 2805 CONECT 2792 2791 2793 2799 CONECT 2793 2792 2794 2803 CONECT 2794 2793 2795 2797 CONECT 2795 2794 2796 CONECT 2796 2795 CONECT 2797 2794 2798 2802 CONECT 2798 2797 2799 2801 CONECT 2799 2792 2798 2800 CONECT 2800 2799 CONECT 2801 2798 CONECT 2802 2797 CONECT 2803 2793 CONECT 2804 2791 CONECT 2805 2791 CONECT 2806 2731 CONECT 2807 2730 CONECT 2808 2729 2809 2815 2816 CONECT 2809 2808 2810 2813 2814 CONECT 2810 2727 2809 2811 2812 CONECT 2811 2810 CONECT 2812 2810 CONECT 2813 2809 CONECT 2814 2809 CONECT 2815 2808 CONECT 2816 2808 CONECT 2817 2728 CONECT 2818 2728 CONECT 2819 2727 CONECT 2820 2726 CONECT 2821 2724 CONECT 2822 2718 CONECT 2823 2717 CONECT 2824 2716 CONECT 2825 2715 CONECT 2826 2715 CONECT 2827 2714 CONECT 2828 2714 CONECT 2829 2709 CONECT 2830 2706 CONECT 2831 2705 CONECT 2832 2705 CONECT 2833 2688 CONECT 2834 2683 2835 2836 2837 CONECT 2835 2834 CONECT 2836 2834 CONECT 2837 2834 CONECT 2838 2683 CONECT 2839 2682 CONECT 2840 2682 CONECT 2841 2674 MASTER 0 0 0 0 0 0 0 0 2840 1 174 13 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
1ynd
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
peptidyl-prolyl cis-trans isomerase a
Ligand Name
SFA
EC.Number
E.C.5.2.1.8
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
IC50=3.6nM
Release Year
2005
Protein/NA Sequence
Check fasta file
Primary Reference
J.Biol.Chem. v280 pp. 21965-71, 2005
Ligand Properties
Formula
C
6
0
H
9
2
N
5
O
1
3
Molecular Weight
1091.400
Exact Mass
1090.670
No. of atoms
170
No. of bonds
174
Polar Surface Area
277.97
LOGP Value
7.32 (
Computed with XLOGP3
)
6.87 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 9
No. of Hydrogen Bond Acceptors: 11
No. of Rotatable Bonds: 20
No. of Nitrogen and Oxygen Atoms: 18
No. of Rings: 5
Canonical SMILES
CC[C@H]1C[C@H](C)[C@@]2(NC1=O)O[C@@H](C[C@@H]([C@H](CC/C=C/C=C(/[C@@H]1C/C=C/C=C/[C@H](O)[C@H](C)[C@@H](O)[C@@H](CCC(=O)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N3[NH2+][C@H](C(=O)O1)CCC3)Cc1cccc(c1)O)C(C)C)\C)C)O)[C@@H]([C@@H]([C@@H]2C)O)C
InChI String
InChI=1S/C60H91N5O13/c1-11-43-30-37(6)60(63-55(43)72)41(10)53(70)40(9)51(78-60)33-49(69)35(4)20-14-12-15-21-36(5)50-26-17-13-16-25-48(68)39(8)54(71)45(28-27-38(7)66)56(73)62-52(34(2)3)57(74)61-47(32-42-22-18-23-44(67)31-42)58(75)65-29-19-24-46(64-65)59(76)77-50/h12-13,15-18,21-23,25,31,34-35,37,39-41,43,45-54,64,67-71H,11,14,19-20,24,26-30,32-33H2,1-10H3,(H,61,74)(H,62,73)(H,63,72)/p+1/b15-12+,17-13+,25-16+,36-21+/t35-,37-,39-,40-,41-,43-,45+,46-,47-,48-,49-,50-,51-,52-,53-,54+,60+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P62937
Entrez Gene ID
NCBI Entrez Gene ID:
5478
ASD
Information of known allosteric effects of PDB entries
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