Browse entries in the PDBbind-CN Database
HEADER 3LXS_COMPLEX COMPND 3LXS_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 215 ALA PRO ALA ALA VAL ASP TRP ARG ALA ARG GLY ALA VAL SEQRES 2 A 215 THR ALA VAL LYS ASP GLN GLY GLN CYS GLY SER CYS TRP SEQRES 3 A 215 ALA PHE SER ALA ILE GLY ASN VAL GLU CYS GLN TRP PHE SEQRES 4 A 215 LEU ALA GLY HIS PRO LEU THR ASN LEU SER GLU GLN MET SEQRES 5 A 215 LEU VAL SER CYS ASP LYS THR ASP SER GLY CYS SER GLY SEQRES 6 A 215 GLY LEU MET ASN ASN ALA PHE GLU TRP ILE VAL GLN GLU SEQRES 7 A 215 ASN ASN GLY ALA VAL TYR THR GLU ASP SER TYR PRO TYR SEQRES 8 A 215 ALA SER GLY GLU GLY ILE SER PRO PRO CYS THR THR SER SEQRES 9 A 215 GLY HIS THR VAL GLY ALA THR ILE THR GLY HIS VAL GLU SEQRES 10 A 215 LEU PRO GLN ASP GLU ALA GLN ILE ALA ALA TRP LEU ALA SEQRES 11 A 215 VAL ASN GLY PRO VAL ALA VAL ALA VAL ASP ALA SER SER SEQRES 12 A 215 TRP MET THR TYR THR GLY GLY VAL MET THR SER CYS VAL SEQRES 13 A 215 SER GLU GLN LEU ASP HIS GLY VAL LEU LEU VAL GLY TYR SEQRES 14 A 215 ASN ASP SER ALA ALA VAL PRO TYR TRP ILE ILE LYS ASN SEQRES 15 A 215 SER TRP THR THR GLN TRP GLY GLU GLU GLY TYR ILE ARG SEQRES 16 A 215 ILE ALA LYS GLY SER ASN GLN CYS LEU VAL LYS GLU GLU SEQRES 17 A 215 ALA SER SER ALA VAL VAL GLY HET UNN A 456 85 SSBOND 1 CYS A 22 CYS A 63 SSBOND 2 CYS A 56 CYS A 101 SSBOND 3 CYS A 155 CYS A 203 ATOM 1 N ALA A 1 81.110 -5.618 35.653 1.00 18.50 N ATOM 2 CA ALA A 1 80.500 -4.584 34.752 1.00 15.50 C ATOM 3 C ALA A 1 80.531 -3.235 35.505 1.00 13.78 C ATOM 4 O ALA A 1 80.715 -3.221 36.696 1.00 13.83 O ATOM 5 CB ALA A 1 79.054 -4.986 34.389 1.00 15.70 C ATOM 6 HA ALA A 1 81.058 -4.501 33.819 1.00 0.00 H ATOM 7 HB1 ALA A 1 79.063 -5.948 33.877 1.00 0.00 H ATOM 8 HB2 ALA A 1 78.460 -5.064 35.300 1.00 0.00 H ATOM 9 HB3 ALA A 1 78.621 -4.229 33.735 1.00 0.00 H ATOM 10 HN3 ALA A 1 80.558 -5.679 36.532 1.00 0.00 H ATOM 11 HN2 ALA A 1 82.089 -5.348 35.875 1.00 0.00 H ATOM 12 HN1 ALA A 1 81.104 -6.541 35.173 1.00 0.00 H ATOM 13 N PRO A 2 80.371 -2.103 34.815 1.00 9.83 N ATOM 14 CA PRO A 2 80.247 -0.814 35.467 1.00 9.67 C ATOM 15 C PRO A 2 79.143 -0.806 36.486 1.00 9.14 C ATOM 16 O PRO A 2 78.143 -1.544 36.326 1.00 10.31 O ATOM 17 CB PRO A 2 79.961 0.145 34.311 1.00 9.07 C ATOM 18 CG PRO A 2 80.464 -0.577 33.096 1.00 9.48 C ATOM 19 CD PRO A 2 80.214 -2.008 33.350 1.00 10.74 C ATOM 20 HA PRO A 2 81.139 -0.540 36.030 1.00 0.00 H ATOM 21 HD3 PRO A 2 79.208 -2.294 33.042 1.00 0.00 H ATOM 22 HD2 PRO A 2 80.942 -2.633 32.834 1.00 0.00 H ATOM 23 HG3 PRO A 2 81.530 -0.395 32.960 1.00 0.00 H ATOM 24 HG2 PRO A 2 79.924 -0.248 32.208 1.00 0.00 H ATOM 25 HB2 PRO A 2 78.892 0.342 34.228 1.00 0.00 H ATOM 26 HB3 PRO A 2 80.493 1.086 34.449 1.00 0.00 H ATOM 27 N ALA A 3 79.281 0.007 37.525 1.00 9.66 N ATOM 28 CA ALA A 3 78.208 0.128 38.511 1.00 9.13 C ATOM 29 C ALA A 3 76.902 0.669 37.931 1.00 9.45 C ATOM 30 O ALA A 3 75.836 0.278 38.397 1.00 9.39 O ATOM 31 CB ALA A 3 78.643 1.019 39.663 1.00 10.44 C ATOM 32 HA ALA A 3 78.013 -0.886 38.861 1.00 0.00 H ATOM 33 HB1 ALA A 3 79.520 0.586 40.144 1.00 0.00 H ATOM 34 HB2 ALA A 3 78.888 2.010 39.282 1.00 0.00 H ATOM 35 HB3 ALA A 3 77.832 1.097 40.387 1.00 0.00 H ATOM 36 H ALA A 3 80.155 0.560 37.639 1.00 0.00 H ATOM 37 N ALA A 4 76.968 1.573 36.970 1.00 9.30 N ATOM 38 CA ALA A 4 75.803 2.185 36.399 1.00 8.80 C ATOM 39 C ALA A 4 76.124 2.648 35.003 1.00 9.90 C ATOM 40 O ALA A 4 77.224 3.129 34.743 1.00 10.13 O ATOM 41 CB ALA A 4 75.345 3.390 37.222 1.00 10.00 C ATOM 42 HA ALA A 4 75.001 1.446 36.389 1.00 0.00 H ATOM 43 HB1 ALA A 4 75.105 3.067 38.235 1.00 0.00 H ATOM 44 HB2 ALA A 4 76.144 4.131 37.255 1.00 0.00 H ATOM 45 HB3 ALA A 4 74.460 3.829 36.760 1.00 0.00 H ATOM 46 H ALA A 4 77.904 1.853 36.612 1.00 0.00 H ATOM 47 N VAL A 5 75.169 2.496 34.105 1.00 9.52 N ATOM 48 CA VAL A 5 75.330 2.960 32.707 1.00 9.55 C ATOM 49 C VAL A 5 74.043 3.691 32.314 1.00 8.66 C ATOM 50 O VAL A 5 72.947 3.235 32.623 1.00 9.79 O ATOM 51 CB VAL A 5 75.586 1.805 31.732 1.00 9.96 C ATOM 52 CG1 VAL A 5 75.689 2.309 30.281 1.00 13.09 C ATOM 53 CG2 VAL A 5 76.846 1.029 32.106 1.00 12.26 C ATOM 54 HA VAL A 5 76.199 3.615 32.650 1.00 0.00 H ATOM 55 HB VAL A 5 74.732 1.131 31.804 1.00 0.00 H ATOM 56 HG11 VAL A 5 74.757 2.799 30.001 1.00 0.00 H ATOM 57 HG12 VAL A 5 76.512 3.019 30.202 1.00 0.00 H ATOM 58 HG13 VAL A 5 75.871 1.464 29.616 1.00 0.00 H ATOM 59 HG21 VAL A 5 77.705 1.700 32.082 1.00 0.00 H ATOM 60 HG22 VAL A 5 76.733 0.617 33.109 1.00 0.00 H ATOM 61 HG23 VAL A 5 76.996 0.218 31.394 1.00 0.00 H ATOM 62 H VAL A 5 74.279 2.038 34.386 1.00 0.00 H ATOM 63 N ASP A 6 74.146 4.796 31.615 1.00 8.13 N ATOM 64 CA ASP A 6 72.996 5.503 31.076 1.00 8.30 C ATOM 65 C ASP A 6 73.375 5.980 29.693 1.00 7.74 C ATOM 66 O ASP A 6 74.047 7.011 29.514 1.00 8.33 O ATOM 67 CB ASP A 6 72.553 6.656 31.985 1.00 8.52 C ATOM 68 CG ASP A 6 71.307 7.331 31.541 1.00 11.09 C ATOM 69 OD1 ASP A 6 70.842 7.123 30.385 1.00 9.43 O ATOM 70 OD2 ASP A 6 70.757 8.120 32.353 1.00 13.46 O ATOM 71 HA ASP A 6 72.134 4.838 31.021 1.00 0.00 H ATOM 72 HB2 ASP A 6 72.390 6.259 32.987 1.00 0.00 H ATOM 73 HB3 ASP A 6 73.352 7.396 32.014 1.00 0.00 H ATOM 74 H ASP A 6 75.094 5.184 31.438 1.00 0.00 H ATOM 75 N TRP A 7 72.918 5.252 28.677 1.00 7.77 N ATOM 76 CA TRP A 7 73.269 5.599 27.295 1.00 7.68 C ATOM 77 C TRP A 7 72.686 6.925 26.844 1.00 8.52 C ATOM 78 O TRP A 7 73.181 7.522 25.890 1.00 8.77 O ATOM 79 CB TRP A 7 72.906 4.426 26.357 1.00 7.25 C ATOM 80 CG TRP A 7 73.856 3.319 26.472 1.00 6.66 C ATOM 81 CD1 TRP A 7 73.648 2.066 27.031 1.00 6.80 C ATOM 82 CD2 TRP A 7 75.213 3.335 26.038 1.00 6.83 C ATOM 83 NE1 TRP A 7 74.806 1.332 26.961 1.00 7.88 N ATOM 84 CE2 TRP A 7 75.757 2.079 26.312 1.00 7.98 C ATOM 85 CE3 TRP A 7 75.996 4.273 25.372 1.00 7.49 C ATOM 86 CZ2 TRP A 7 77.080 1.784 26.033 1.00 9.62 C ATOM 87 CZ3 TRP A 7 77.264 3.994 25.108 1.00 8.34 C ATOM 88 CH2 TRP A 7 77.815 2.788 25.412 1.00 9.04 C ATOM 89 HA TRP A 7 74.347 5.752 27.248 1.00 0.00 H ATOM 90 HB2 TRP A 7 71.911 4.064 26.614 1.00 0.00 H ATOM 91 HB3 TRP A 7 72.906 4.785 25.328 1.00 0.00 H ATOM 92 HE1 TRP A 7 74.940 0.371 27.337 1.00 0.00 H ATOM 93 HD1 TRP A 7 72.709 1.718 27.460 1.00 0.00 H ATOM 94 HZ2 TRP A 7 77.521 0.820 26.286 1.00 0.00 H ATOM 95 HH2 TRP A 7 78.860 2.604 25.162 1.00 0.00 H ATOM 96 HZ3 TRP A 7 77.884 4.754 24.633 1.00 0.00 H ATOM 97 HE3 TRP A 7 75.570 5.230 25.070 1.00 0.00 H ATOM 98 H TRP A 7 72.308 4.431 28.864 1.00 0.00 H ATOM 99 N ARG A 8 71.667 7.437 27.543 1.00 9.46 N ATOM 100 CA ARG A 8 71.128 8.767 27.194 1.00 10.95 C ATOM 101 C ARG A 8 72.146 9.854 27.472 1.00 11.68 C ATOM 102 O ARG A 8 72.300 10.806 26.675 1.00 12.88 O ATOM 103 CB ARG A 8 69.883 9.078 28.005 1.00 11.84 C ATOM 104 CG ARG A 8 68.802 8.083 27.840 1.00 12.08 C ATOM 105 CD ARG A 8 67.670 8.388 28.819 1.00 12.68 C ATOM 106 NE ARG A 8 68.131 8.229 30.212 1.00 12.34 N ATOM 107 CZ ARG A 8 67.366 8.410 31.267 1.00 12.46 C ATOM 108 NH1 ARG A 8 66.093 8.709 31.103 1.00 13.87 N ATOM 109 NH2 ARG A 8 67.888 8.260 32.463 1.00 12.81 N ATOM 110 HA ARG A 8 70.887 8.743 26.131 1.00 0.00 H ATOM 111 HB2 ARG A 8 70.159 9.115 29.059 1.00 0.00 H ATOM 112 HB3 ARG A 8 69.505 10.052 27.695 1.00 0.00 H ATOM 113 HG2 ARG A 8 68.421 8.127 26.820 1.00 0.00 H ATOM 114 HG3 ARG A 8 69.194 7.085 28.038 1.00 0.00 H ATOM 115 HD2 ARG A 8 66.842 7.703 28.635 1.00 0.00 H ATOM 116 HD3 ARG A 8 67.332 9.413 28.668 1.00 0.00 H ATOM 117 HE ARG A 8 69.122 7.957 30.369 1.00 0.00 H ATOM 118 HH12 ARG A 8 65.482 8.854 31.932 1.00 0.00 H ATOM 119 HH11 ARG A 8 65.700 8.800 30.145 1.00 0.00 H ATOM 120 HH22 ARG A 8 67.299 8.399 33.309 1.00 0.00 H ATOM 121 HH21 ARG A 8 68.890 8.002 32.564 1.00 0.00 H ATOM 122 H ARG A 8 71.255 6.899 28.332 1.00 0.00 H ATOM 123 N ALA A 9 72.872 9.686 28.589 1.00 12.26 N ATOM 124 CA ALA A 9 73.882 10.653 28.973 1.00 14.27 C ATOM 125 C ALA A 9 75.058 10.671 27.982 1.00 13.80 C ATOM 126 O ALA A 9 75.834 11.625 27.902 1.00 13.75 O ATOM 127 CB ALA A 9 74.339 10.366 30.411 1.00 13.97 C ATOM 128 HA ALA A 9 73.448 11.652 28.941 1.00 0.00 H ATOM 129 HB1 ALA A 9 73.485 10.442 31.084 1.00 0.00 H ATOM 130 HB2 ALA A 9 74.757 9.361 30.464 1.00 0.00 H ATOM 131 HB3 ALA A 9 75.098 11.092 30.701 1.00 0.00 H ATOM 132 H ALA A 9 72.708 8.851 29.187 1.00 0.00 H ATOM 133 N ARG A 10 75.221 9.563 27.268 1.00 13.08 N ATOM 134 CA ARG A 10 76.270 9.403 26.311 1.00 13.65 C ATOM 135 C ARG A 10 75.872 9.838 24.906 1.00 12.52 C ATOM 136 O ARG A 10 76.651 9.696 23.965 1.00 13.25 O ATOM 137 CB ARG A 10 76.789 7.964 26.374 1.00 14.16 C ATOM 138 CG ARG A 10 77.654 7.708 27.613 1.00 13.90 C ATOM 139 CD ARG A 10 77.983 6.217 27.793 1.00 14.97 C ATOM 140 NE ARG A 10 78.942 6.005 28.889 1.00 15.89 N ATOM 141 CZ ARG A 10 80.193 5.543 28.757 1.00 13.65 C ATOM 142 NH1 ARG A 10 80.905 5.385 29.839 1.00 13.67 N ATOM 143 NH2 ARG A 10 80.697 5.194 27.584 1.00 11.09 N ATOM 144 HA ARG A 10 77.085 10.077 26.573 1.00 0.00 H ATOM 145 HB2 ARG A 10 75.937 7.285 26.395 1.00 0.00 H ATOM 146 HB3 ARG A 10 77.386 7.768 25.483 1.00 0.00 H ATOM 147 HG2 ARG A 10 78.586 8.264 27.512 1.00 0.00 H ATOM 148 HG3 ARG A 10 77.117 8.058 28.495 1.00 0.00 H ATOM 149 HD2 ARG A 10 78.413 5.834 26.867 1.00 0.00 H ATOM 150 HD3 ARG A 10 77.064 5.676 28.017 1.00 0.00 H ATOM 151 HE ARG A 10 78.620 6.234 29.851 1.00 0.00 H ATOM 152 HH12 ARG A 10 81.880 5.028 29.773 1.00 0.00 H ATOM 153 HH11 ARG A 10 80.498 5.616 30.768 1.00 0.00 H ATOM 154 HH22 ARG A 10 81.673 4.840 27.522 1.00 0.00 H ATOM 155 HH21 ARG A 10 80.117 5.274 26.724 1.00 0.00 H ATOM 156 H ARG A 10 74.556 8.777 27.412 1.00 0.00 H ATOM 157 N GLY A 11 74.633 10.365 24.750 1.00 10.85 N ATOM 158 CA GLY A 11 74.209 10.946 23.472 1.00 11.41 C ATOM 159 C GLY A 11 73.780 9.880 22.484 1.00 10.23 C ATOM 160 O GLY A 11 73.664 10.133 21.277 1.00 10.74 O ATOM 161 HA3 GLY A 11 75.040 11.508 23.046 1.00 0.00 H ATOM 162 HA2 GLY A 11 73.371 11.619 23.651 1.00 0.00 H ATOM 163 H GLY A 11 73.971 10.357 25.552 1.00 0.00 H ATOM 164 N ALA A 12 73.486 8.670 22.965 1.00 9.22 N ATOM 165 CA ALA A 12 73.244 7.509 22.082 1.00 7.28 C ATOM 166 C ALA A 12 71.789 7.188 21.834 1.00 7.20 C ATOM 167 O ALA A 12 71.516 6.224 21.095 1.00 8.63 O ATOM 168 CB ALA A 12 73.949 6.234 22.621 1.00 9.20 C ATOM 169 HA ALA A 12 73.668 7.813 21.125 1.00 0.00 H ATOM 170 HB1 ALA A 12 75.023 6.410 22.677 1.00 0.00 H ATOM 171 HB2 ALA A 12 73.566 6.001 23.614 1.00 0.00 H ATOM 172 HB3 ALA A 12 73.751 5.399 21.949 1.00 0.00 H ATOM 173 H ALA A 12 73.425 8.540 23.995 1.00 0.00 H ATOM 174 N VAL A 13 70.867 7.949 22.420 1.00 7.32 N ATOM 175 CA VAL A 13 69.436 7.601 22.372 1.00 7.20 C ATOM 176 C VAL A 13 68.654 8.804 21.811 1.00 7.02 C ATOM 177 O VAL A 13 68.775 9.921 22.285 1.00 8.65 O ATOM 178 CB VAL A 13 68.927 7.252 23.787 1.00 6.76 C ATOM 179 CG1 VAL A 13 67.494 6.707 23.706 1.00 7.75 C ATOM 180 CG2 VAL A 13 69.844 6.180 24.435 1.00 8.70 C ATOM 181 HA VAL A 13 69.289 6.733 21.730 1.00 0.00 H ATOM 182 HB VAL A 13 68.941 8.156 24.396 1.00 0.00 H ATOM 183 HG11 VAL A 13 66.844 7.463 23.265 1.00 0.00 H ATOM 184 HG12 VAL A 13 67.482 5.810 23.087 1.00 0.00 H ATOM 185 HG13 VAL A 13 67.142 6.463 24.708 1.00 0.00 H ATOM 186 HG21 VAL A 13 69.839 5.280 23.820 1.00 0.00 H ATOM 187 HG22 VAL A 13 70.860 6.568 24.505 1.00 0.00 H ATOM 188 HG23 VAL A 13 69.474 5.943 25.433 1.00 0.00 H ATOM 189 H VAL A 13 71.164 8.809 22.923 1.00 0.00 H ATOM 190 N THR A 14 67.833 8.553 20.783 1.00 7.62 N ATOM 191 CA THR A 14 67.029 9.613 20.202 1.00 7.09 C ATOM 192 C THR A 14 65.853 9.955 21.138 1.00 6.74 C ATOM 193 O THR A 14 65.589 9.249 22.151 1.00 7.15 O ATOM 194 CB THR A 14 66.436 9.185 18.830 1.00 7.30 C ATOM 195 OG1 THR A 14 65.542 8.079 19.023 1.00 7.89 O ATOM 196 CG2 THR A 14 67.500 8.730 17.804 1.00 9.31 C ATOM 197 HA THR A 14 67.680 10.477 20.064 1.00 0.00 H ATOM 198 HB THR A 14 65.936 10.069 18.434 1.00 0.00 H ATOM 199 HG1 THR A 14 66.038 7.320 19.421 1.00 0.00 H ATOM 200 HG23 THR A 14 68.203 9.544 17.627 1.00 0.00 H ATOM 201 HG21 THR A 14 68.035 7.865 18.196 1.00 0.00 H ATOM 202 HG22 THR A 14 67.009 8.462 16.868 1.00 0.00 H ATOM 203 H THR A 14 67.771 7.589 20.397 1.00 0.00 H ATOM 204 N ALA A 15 65.102 10.976 20.774 1.00 7.96 N ATOM 205 CA ALA A 15 63.955 11.407 21.553 1.00 8.13 C ATOM 206 C ALA A 15 62.926 10.287 21.739 1.00 7.39 C ATOM 207 O ALA A 15 62.813 9.367 20.903 1.00 7.65 O ATOM 208 CB ALA A 15 63.282 12.548 20.878 1.00 9.31 C ATOM 209 HA ALA A 15 64.332 11.700 22.533 1.00 0.00 H ATOM 210 HB1 ALA A 15 63.983 13.377 20.782 1.00 0.00 H ATOM 211 HB2 ALA A 15 62.948 12.237 19.888 1.00 0.00 H ATOM 212 HB3 ALA A 15 62.423 12.864 21.470 1.00 0.00 H ATOM 213 H ALA A 15 65.339 11.489 19.901 1.00 0.00 H ATOM 214 N VAL A 16 62.166 10.396 22.818 1.00 7.26 N ATOM 215 CA VAL A 16 61.017 9.531 23.061 1.00 7.69 C ATOM 216 C VAL A 16 59.944 9.806 22.019 1.00 7.67 C ATOM 217 O VAL A 16 59.599 10.950 21.746 1.00 8.45 O ATOM 218 CB VAL A 16 60.456 9.729 24.485 1.00 7.28 C ATOM 219 CG1 VAL A 16 59.067 9.094 24.669 1.00 8.31 C ATOM 220 CG2 VAL A 16 61.490 9.207 25.517 1.00 8.69 C ATOM 221 HA VAL A 16 61.341 8.493 22.979 1.00 0.00 H ATOM 222 HB VAL A 16 60.302 10.795 24.652 1.00 0.00 H ATOM 223 HG11 VAL A 16 58.366 9.546 23.967 1.00 0.00 H ATOM 224 HG12 VAL A 16 59.131 8.022 24.481 1.00 0.00 H ATOM 225 HG13 VAL A 16 58.723 9.265 25.689 1.00 0.00 H ATOM 226 HG21 VAL A 16 61.675 8.148 25.340 1.00 0.00 H ATOM 227 HG22 VAL A 16 62.421 9.763 25.409 1.00 0.00 H ATOM 228 HG23 VAL A 16 61.097 9.345 26.524 1.00 0.00 H ATOM 229 H VAL A 16 62.398 11.127 23.520 1.00 0.00 H ATOM 230 N LYS A 17 59.433 8.734 21.435 1.00 7.82 N ATOM 231 CA LYS A 17 58.430 8.791 20.394 1.00 8.11 C ATOM 232 C LYS A 17 57.032 8.431 20.913 1.00 8.51 C ATOM 233 O LYS A 17 56.837 8.096 22.066 1.00 8.09 O ATOM 234 CB LYS A 17 58.842 7.839 19.239 1.00 8.86 C ATOM 235 CG LYS A 17 60.306 8.097 18.726 1.00 9.16 C ATOM 236 CD LYS A 17 60.542 9.568 18.404 1.00 10.96 C ATOM 237 CE LYS A 17 61.811 9.830 17.631 1.00 9.16 C ATOM 238 NZ LYS A 17 62.998 9.052 18.056 1.00 8.45 N ATOM 239 HA LYS A 17 58.375 9.817 20.031 1.00 0.00 H ATOM 240 HB2 LYS A 17 58.774 6.811 19.594 1.00 0.00 H ATOM 241 HB3 LYS A 17 58.152 7.981 18.408 1.00 0.00 H ATOM 242 HG2 LYS A 17 61.010 7.787 19.498 1.00 0.00 H ATOM 243 HG3 LYS A 17 60.474 7.507 17.825 1.00 0.00 H ATOM 244 HD2 LYS A 17 59.700 9.930 17.814 1.00 0.00 H ATOM 245 HD3 LYS A 17 60.591 10.121 19.342 1.00 0.00 H ATOM 246 HE2 LYS A 17 62.051 10.888 17.731 1.00 0.00 H ATOM 247 HE3 LYS A 17 61.618 9.600 16.583 1.00 0.00 H ATOM 248 HZ1 LYS A 17 63.214 9.266 19.051 1.00 0.00 H ATOM 249 HZ2 LYS A 17 62.800 8.036 17.954 1.00 0.00 H ATOM 250 HZ3 LYS A 17 63.811 9.309 17.461 1.00 0.00 H ATOM 251 H LYS A 17 59.771 7.799 21.741 1.00 0.00 H ATOM 252 N ASP A 18 56.097 8.421 19.983 1.00 9.76 N ATOM 253 CA ASP A 18 54.688 8.200 20.220 1.00 9.01 C ATOM 254 C ASP A 18 54.146 7.252 19.175 1.00 9.34 C ATOM 255 O ASP A 18 53.983 7.617 17.989 1.00 9.36 O ATOM 256 CB ASP A 18 53.915 9.517 20.142 1.00 10.35 C ATOM 257 CG ASP A 18 52.454 9.383 20.485 1.00 10.96 C ATOM 258 OD1 ASP A 18 52.023 8.269 20.918 1.00 13.00 O ATOM 259 OD2 ASP A 18 51.716 10.432 20.329 1.00 16.12 O ATOM 260 HA ASP A 18 54.567 7.775 21.216 1.00 0.00 H ATOM 261 HB2 ASP A 18 54.368 10.224 20.837 1.00 0.00 H ATOM 262 HB3 ASP A 18 53.996 9.904 19.126 1.00 0.00 H ATOM 263 H ASP A 18 56.397 8.585 19.001 1.00 0.00 H ATOM 264 N GLN A 19 53.843 6.032 19.604 1.00 9.38 N ATOM 265 CA GLN A 19 53.229 5.072 18.708 1.00 9.25 C ATOM 266 C GLN A 19 51.800 5.468 18.315 1.00 8.46 C ATOM 267 O GLN A 19 51.250 4.938 17.326 1.00 9.57 O ATOM 268 CB GLN A 19 53.262 3.624 19.274 1.00 13.03 C ATOM 269 CG GLN A 19 52.693 3.447 20.542 1.00 14.59 C ATOM 270 CD GLN A 19 53.052 2.048 21.099 1.00 12.42 C ATOM 271 OE1 GLN A 19 54.098 1.794 21.734 1.00 10.31 O ATOM 272 NE2 GLN A 19 52.117 1.163 20.945 1.00 12.34 N ATOM 273 HA GLN A 19 53.836 5.085 17.803 1.00 0.00 H ATOM 274 HB2 GLN A 19 52.727 2.980 18.575 1.00 0.00 H ATOM 275 HB3 GLN A 19 54.305 3.311 19.329 1.00 0.00 H ATOM 276 HG2 GLN A 19 53.074 4.213 21.218 1.00 0.00 H ATOM 277 HG3 GLN A 19 51.609 3.538 20.466 1.00 0.00 H ATOM 278 HE22 GLN A 19 51.257 1.403 20.411 1.00 0.00 H ATOM 279 HE21 GLN A 19 52.227 0.214 21.355 1.00 0.00 H ATOM 280 H GLN A 19 54.047 5.764 20.588 1.00 0.00 H ATOM 281 N GLY A 20 51.172 6.342 19.076 1.00 8.26 N ATOM 282 CA GLY A 20 49.794 6.630 18.815 1.00 9.17 C ATOM 283 C GLY A 20 48.896 5.459 19.098 1.00 8.82 C ATOM 284 O GLY A 20 49.209 4.599 19.927 1.00 9.29 O ATOM 285 HA3 GLY A 20 49.687 6.907 17.766 1.00 0.00 H ATOM 286 HA2 GLY A 20 49.487 7.466 19.443 1.00 0.00 H ATOM 287 H GLY A 20 51.671 6.816 19.856 1.00 0.00 H ATOM 288 N GLN A 21 47.752 5.461 18.419 1.00 8.68 N ATOM 289 CA GLN A 21 46.723 4.459 18.661 1.00 9.31 C ATOM 290 C GLN A 21 46.944 3.278 17.736 1.00 9.67 C ATOM 291 O GLN A 21 46.110 2.921 16.871 1.00 9.65 O ATOM 292 CB GLN A 21 45.323 5.042 18.510 1.00 9.41 C ATOM 293 CG GLN A 21 44.995 6.176 19.428 1.00 12.68 C ATOM 294 CD GLN A 21 43.617 6.739 19.151 1.00 17.83 C ATOM 295 OE1 GLN A 21 43.447 7.579 18.274 1.00 22.85 O ATOM 296 NE2 GLN A 21 42.640 6.259 19.883 1.00 22.30 N ATOM 297 HA GLN A 21 46.801 4.115 19.692 1.00 0.00 H ATOM 298 HB2 GLN A 21 45.216 5.397 17.485 1.00 0.00 H ATOM 299 HB3 GLN A 21 44.605 4.243 18.693 1.00 0.00 H ATOM 300 HG2 GLN A 21 45.031 5.820 20.457 1.00 0.00 H ATOM 301 HG3 GLN A 21 45.734 6.966 19.292 1.00 0.00 H ATOM 302 HE22 GLN A 21 42.840 5.547 20.614 1.00 0.00 H ATOM 303 HE21 GLN A 21 41.666 6.590 19.732 1.00 0.00 H ATOM 304 H GLN A 21 47.589 6.194 17.700 1.00 0.00 H ATOM 305 N CYS A 22 48.095 2.626 17.932 1.00 9.90 N ATOM 306 CA CYS A 22 48.568 1.564 17.069 1.00 9.24 C ATOM 307 C CYS A 22 49.483 0.654 17.906 1.00 8.21 C ATOM 308 O CYS A 22 50.349 1.153 18.603 1.00 9.13 O ATOM 309 CB CYS A 22 49.358 2.163 15.918 1.00 8.58 C ATOM 310 SG CYS A 22 50.214 1.031 14.805 1.00 8.80 S ATOM 311 HA CYS A 22 47.732 0.995 16.663 1.00 0.00 H ATOM 312 HB2 CYS A 22 50.109 2.825 16.349 1.00 0.00 H ATOM 313 HB3 CYS A 22 48.663 2.747 15.316 1.00 0.00 H ATOM 314 H CYS A 22 48.681 2.896 18.747 1.00 0.00 H ATOM 315 N GLY A 23 49.315 -0.646 17.822 1.00 8.05 N ATOM 316 CA GLY A 23 50.139 -1.617 18.530 1.00 8.42 C ATOM 317 C GLY A 23 51.473 -1.907 17.855 1.00 7.73 C ATOM 318 O GLY A 23 51.860 -3.077 17.711 1.00 8.73 O ATOM 319 HA3 GLY A 23 49.582 -2.551 18.604 1.00 0.00 H ATOM 320 HA2 GLY A 23 50.337 -1.234 19.531 1.00 0.00 H ATOM 321 H GLY A 23 48.550 -1.003 17.215 1.00 0.00 H ATOM 322 N SER A 24 52.200 -0.841 17.508 1.00 7.88 N ATOM 323 CA SER A 24 53.458 -0.937 16.789 1.00 7.63 C ATOM 324 C SER A 24 54.670 -0.872 17.733 1.00 7.77 C ATOM 325 O SER A 24 55.791 -0.629 17.280 1.00 8.89 O ATOM 326 CB SER A 24 53.541 0.226 15.795 1.00 8.10 C ATOM 327 OG SER A 24 53.192 1.438 16.458 1.00 8.57 O ATOM 328 HA SER A 24 53.485 -1.900 16.278 1.00 0.00 H ATOM 329 HB2 SER A 24 52.851 0.050 14.970 1.00 0.00 H ATOM 330 HB3 SER A 24 54.557 0.302 15.407 1.00 0.00 H ATOM 331 HG SER A 24 53.245 2.191 15.817 1.00 0.00 H ATOM 332 H SER A 24 51.848 0.103 17.765 1.00 0.00 H ATOM 333 N CYS A 25 54.432 -1.065 19.029 1.00 7.48 N ATOM 334 CA CYS A 25 55.481 -1.049 20.044 1.00 7.22 C ATOM 335 C CYS A 25 56.712 -1.888 19.622 1.00 7.09 C ATOM 336 O CYS A 25 57.829 -1.436 19.806 1.00 7.97 O ATOM 337 CB CYS A 25 54.986 -1.641 21.369 1.00 8.55 C ATOM 338 SG CYS A 25 54.313 -3.300 21.243 1.00 6.77 S ATOM 339 HA CYS A 25 55.756 -0.001 20.160 1.00 0.00 H ATOM 340 HB2 CYS A 25 54.208 -0.988 21.764 1.00 0.00 H ATOM 341 HB3 CYS A 25 55.825 -1.666 22.065 1.00 0.00 H ATOM 342 HG CYS A 25 53.903 -3.724 22.490 1.00 0.00 H ATOM 343 H CYS A 25 53.452 -1.235 19.332 1.00 0.00 H ATOM 344 N TRP A 26 56.505 -3.036 19.001 1.00 7.15 N ATOM 345 CA TRP A 26 57.562 -3.927 18.534 1.00 6.68 C ATOM 346 C TRP A 26 58.491 -3.211 17.530 1.00 7.74 C ATOM 347 O TRP A 26 59.700 -3.402 17.563 1.00 7.55 O ATOM 348 CB TRP A 26 56.930 -5.205 17.958 1.00 7.61 C ATOM 349 CG TRP A 26 56.057 -4.912 16.781 1.00 7.67 C ATOM 350 CD1 TRP A 26 54.715 -4.571 16.820 1.00 7.24 C ATOM 351 CD2 TRP A 26 56.407 -4.932 15.388 1.00 7.74 C ATOM 352 NE1 TRP A 26 54.242 -4.325 15.549 1.00 7.60 N ATOM 353 CE2 TRP A 26 55.254 -4.563 14.655 1.00 7.47 C ATOM 354 CE3 TRP A 26 57.597 -5.210 14.680 1.00 7.90 C ATOM 355 CZ2 TRP A 26 55.273 -4.412 13.261 1.00 7.89 C ATOM 356 CZ3 TRP A 26 57.603 -5.121 13.298 1.00 7.59 C ATOM 357 CH2 TRP A 26 56.445 -4.727 12.600 1.00 7.92 C ATOM 358 HA TRP A 26 58.196 -4.216 19.372 1.00 0.00 H ATOM 359 HB2 TRP A 26 57.725 -5.883 17.648 1.00 0.00 H ATOM 360 HB3 TRP A 26 56.330 -5.682 18.733 1.00 0.00 H ATOM 361 HE1 TRP A 26 53.280 -4.012 15.309 1.00 0.00 H ATOM 362 HD1 TRP A 26 54.117 -4.506 17.729 1.00 0.00 H ATOM 363 HZ2 TRP A 26 54.396 -4.059 12.719 1.00 0.00 H ATOM 364 HH2 TRP A 26 56.474 -4.669 11.512 1.00 0.00 H ATOM 365 HZ3 TRP A 26 58.512 -5.358 12.745 1.00 0.00 H ATOM 366 HE3 TRP A 26 58.503 -5.492 15.217 1.00 0.00 H ATOM 367 H TRP A 26 55.520 -3.325 18.833 1.00 0.00 H ATOM 368 N ALA A 27 57.918 -2.378 16.674 1.00 6.98 N ATOM 369 CA ALA A 27 58.669 -1.634 15.667 1.00 7.40 C ATOM 370 C ALA A 27 59.429 -0.489 16.298 1.00 7.36 C ATOM 371 O ALA A 27 60.600 -0.239 15.966 1.00 7.17 O ATOM 372 CB ALA A 27 57.728 -1.142 14.559 1.00 7.78 C ATOM 373 HA ALA A 27 59.403 -2.301 15.215 1.00 0.00 H ATOM 374 HB1 ALA A 27 57.247 -1.998 14.086 1.00 0.00 H ATOM 375 HB2 ALA A 27 56.969 -0.491 14.992 1.00 0.00 H ATOM 376 HB3 ALA A 27 58.302 -0.589 13.815 1.00 0.00 H ATOM 377 H ALA A 27 56.887 -2.248 16.721 1.00 0.00 H ATOM 378 N PHE A 28 58.833 0.161 17.308 1.00 7.30 N ATOM 379 CA PHE A 28 59.528 1.199 18.039 1.00 6.76 C ATOM 380 C PHE A 28 60.711 0.657 18.827 1.00 5.44 C ATOM 381 O PHE A 28 61.781 1.243 18.821 1.00 6.53 O ATOM 382 CB PHE A 28 58.542 2.009 18.930 1.00 6.33 C ATOM 383 CG PHE A 28 57.725 2.978 18.160 1.00 6.73 C ATOM 384 CD1 PHE A 28 56.611 2.560 17.399 1.00 7.19 C ATOM 385 CD2 PHE A 28 58.085 4.323 18.105 1.00 7.81 C ATOM 386 CE1 PHE A 28 55.912 3.527 16.625 1.00 6.71 C ATOM 387 CE2 PHE A 28 57.355 5.250 17.329 1.00 7.83 C ATOM 388 CZ PHE A 28 56.281 4.843 16.590 1.00 8.80 C ATOM 389 HA PHE A 28 59.948 1.890 17.308 1.00 0.00 H ATOM 390 HB2 PHE A 28 57.872 1.310 19.430 1.00 0.00 H ATOM 391 HB3 PHE A 28 59.118 2.556 19.677 1.00 0.00 H ATOM 392 HD2 PHE A 28 58.949 4.667 18.673 1.00 0.00 H ATOM 393 HE2 PHE A 28 57.651 6.299 17.320 1.00 0.00 H ATOM 394 HZ PHE A 28 55.726 5.557 15.981 1.00 0.00 H ATOM 395 HE1 PHE A 28 55.051 3.207 16.038 1.00 0.00 H ATOM 396 HD1 PHE A 28 56.293 1.517 17.405 1.00 0.00 H ATOM 397 H PHE A 28 57.857 -0.084 17.570 1.00 0.00 H ATOM 398 N SER A 29 60.535 -0.499 19.458 1.00 5.77 N ATOM 399 CA SER A 29 61.631 -1.172 20.161 1.00 6.33 C ATOM 400 C SER A 29 62.789 -1.566 19.216 1.00 5.33 C ATOM 401 O SER A 29 63.953 -1.235 19.498 1.00 7.23 O ATOM 402 CB SER A 29 61.088 -2.415 20.852 1.00 6.52 C ATOM 403 OG SER A 29 62.113 -3.193 21.458 1.00 7.24 O ATOM 404 HA SER A 29 62.038 -0.471 20.890 1.00 0.00 H ATOM 405 HB2 SER A 29 60.573 -3.029 20.113 1.00 0.00 H ATOM 406 HB3 SER A 29 60.381 -2.106 21.622 1.00 0.00 H ATOM 407 HG SER A 29 62.583 -2.647 22.137 1.00 0.00 H ATOM 408 H SER A 29 59.593 -0.939 19.453 1.00 0.00 H ATOM 409 N ALA A 30 62.480 -2.183 18.070 1.00 6.06 N ATOM 410 CA ALA A 30 63.493 -2.636 17.157 1.00 5.84 C ATOM 411 C ALA A 30 64.213 -1.438 16.563 1.00 5.84 C ATOM 412 O ALA A 30 65.445 -1.438 16.529 1.00 7.27 O ATOM 413 CB ALA A 30 62.862 -3.532 16.056 1.00 7.36 C ATOM 414 HA ALA A 30 64.225 -3.242 17.691 1.00 0.00 H ATOM 415 HB1 ALA A 30 62.388 -4.396 16.521 1.00 0.00 H ATOM 416 HB2 ALA A 30 62.116 -2.958 15.506 1.00 0.00 H ATOM 417 HB3 ALA A 30 63.641 -3.868 15.372 1.00 0.00 H ATOM 418 H ALA A 30 61.479 -2.339 17.833 1.00 0.00 H ATOM 419 N ILE A 31 63.470 -0.425 16.129 1.00 6.88 N ATOM 420 CA ILE A 31 64.065 0.763 15.535 1.00 6.67 C ATOM 421 C ILE A 31 64.920 1.541 16.532 1.00 5.78 C ATOM 422 O ILE A 31 66.014 1.991 16.209 1.00 6.77 O ATOM 423 CB ILE A 31 63.025 1.655 14.875 1.00 7.00 C ATOM 424 CG1 ILE A 31 62.500 1.024 13.622 1.00 7.09 C ATOM 425 CG2 ILE A 31 63.579 3.035 14.561 1.00 8.58 C ATOM 426 CD1 ILE A 31 63.505 0.776 12.467 1.00 9.48 C ATOM 427 HA ILE A 31 64.733 0.412 14.748 1.00 0.00 H ATOM 428 HB ILE A 31 62.209 1.772 15.588 1.00 0.00 H ATOM 429 HG12 ILE A 31 62.074 0.059 13.896 1.00 0.00 H ATOM 430 HG13 ILE A 31 61.712 1.671 13.236 1.00 0.00 H ATOM 431 HD11 ILE A 31 63.936 1.726 12.152 1.00 0.00 H ATOM 432 HD12 ILE A 31 64.298 0.113 12.813 1.00 0.00 H ATOM 433 HD13 ILE A 31 62.985 0.315 11.627 1.00 0.00 H ATOM 434 HG21 ILE A 31 63.903 3.514 15.485 1.00 0.00 H ATOM 435 HG22 ILE A 31 64.427 2.939 13.883 1.00 0.00 H ATOM 436 HG23 ILE A 31 62.803 3.638 14.091 1.00 0.00 H ATOM 437 H ILE A 31 62.435 -0.483 16.216 1.00 0.00 H ATOM 438 N GLY A 32 64.453 1.682 17.766 1.00 7.12 N ATOM 439 CA GLY A 32 65.245 2.426 18.749 1.00 6.81 C ATOM 440 C GLY A 32 66.585 1.734 18.958 1.00 7.14 C ATOM 441 O GLY A 32 67.620 2.407 19.062 1.00 7.72 O ATOM 442 HA3 GLY A 32 64.705 2.465 19.695 1.00 0.00 H ATOM 443 HA2 GLY A 32 65.413 3.440 18.387 1.00 0.00 H ATOM 444 H GLY A 32 63.536 1.270 18.032 1.00 0.00 H ATOM 445 N ASN A 33 66.554 0.406 19.018 1.00 6.74 N ATOM 446 CA ASN A 33 67.798 -0.395 19.106 1.00 5.97 C ATOM 447 C ASN A 33 68.724 -0.122 17.917 1.00 5.77 C ATOM 448 O ASN A 33 69.926 0.113 18.110 1.00 7.12 O ATOM 449 CB ASN A 33 67.498 -1.884 19.276 1.00 5.62 C ATOM 450 CG ASN A 33 68.715 -2.744 19.097 1.00 6.64 C ATOM 451 OD1 ASN A 33 68.923 -3.244 17.997 1.00 8.03 O ATOM 452 ND2 ASN A 33 69.573 -2.886 20.157 1.00 7.01 N ATOM 453 HA ASN A 33 68.331 -0.079 20.002 1.00 0.00 H ATOM 454 HB2 ASN A 33 67.099 -2.048 20.277 1.00 0.00 H ATOM 455 HB3 ASN A 33 66.752 -2.176 18.537 1.00 0.00 H ATOM 456 HD22 ASN A 33 69.350 -2.441 21.070 1.00 0.00 H ATOM 457 HD21 ASN A 33 70.447 -3.439 20.048 1.00 0.00 H ATOM 458 H ASN A 33 65.636 -0.082 19.003 1.00 0.00 H ATOM 459 N VAL A 34 68.189 -0.144 16.700 1.00 6.49 N ATOM 460 CA VAL A 34 69.018 0.118 15.519 1.00 6.45 C ATOM 461 C VAL A 34 69.617 1.519 15.569 1.00 6.61 C ATOM 462 O VAL A 34 70.818 1.707 15.287 1.00 6.86 O ATOM 463 CB VAL A 34 68.261 -0.093 14.195 1.00 6.71 C ATOM 464 CG1 VAL A 34 69.163 0.298 12.977 1.00 7.11 C ATOM 465 CG2 VAL A 34 67.740 -1.586 14.071 1.00 7.96 C ATOM 466 HA VAL A 34 69.825 -0.615 15.546 1.00 0.00 H ATOM 467 HB VAL A 34 67.389 0.561 14.191 1.00 0.00 H ATOM 468 HG11 VAL A 34 69.447 1.347 13.059 1.00 0.00 H ATOM 469 HG12 VAL A 34 70.059 -0.323 12.976 1.00 0.00 H ATOM 470 HG13 VAL A 34 68.609 0.141 12.051 1.00 0.00 H ATOM 471 HG21 VAL A 34 68.589 -2.269 14.102 1.00 0.00 H ATOM 472 HG22 VAL A 34 67.065 -1.804 14.899 1.00 0.00 H ATOM 473 HG23 VAL A 34 67.209 -1.707 13.127 1.00 0.00 H ATOM 474 H VAL A 34 67.176 -0.348 16.585 1.00 0.00 H ATOM 475 N GLU A 35 68.815 2.510 15.954 1.00 6.41 N ATOM 476 CA GLU A 35 69.317 3.854 16.045 1.00 6.45 C ATOM 477 C GLU A 35 70.549 3.937 16.958 1.00 7.41 C ATOM 478 O GLU A 35 71.564 4.584 16.621 1.00 7.30 O ATOM 479 CB GLU A 35 68.256 4.826 16.608 1.00 6.92 C ATOM 480 CG GLU A 35 67.090 5.041 15.666 1.00 6.91 C ATOM 481 CD GLU A 35 65.899 5.714 16.299 1.00 7.81 C ATOM 482 OE1 GLU A 35 65.812 5.843 17.556 1.00 7.97 O ATOM 483 OE2 GLU A 35 65.017 6.175 15.539 1.00 6.75 O ATOM 484 HA GLU A 35 69.582 4.140 15.027 1.00 0.00 H ATOM 485 HB2 GLU A 35 67.875 4.420 17.545 1.00 0.00 H ATOM 486 HB3 GLU A 35 68.732 5.788 16.797 1.00 0.00 H ATOM 487 HG2 GLU A 35 67.431 5.659 14.836 1.00 0.00 H ATOM 488 HG3 GLU A 35 66.773 4.069 15.287 1.00 0.00 H ATOM 489 H GLU A 35 67.822 2.311 16.190 1.00 0.00 H ATOM 490 N CYS A 36 70.435 3.284 18.116 1.00 6.96 N ATOM 491 CA CYS A 36 71.502 3.336 19.096 1.00 6.65 C ATOM 492 C CYS A 36 72.757 2.593 18.595 1.00 7.21 C ATOM 493 O CYS A 36 73.876 3.068 18.694 1.00 8.13 O ATOM 494 CB CYS A 36 71.063 2.708 20.414 1.00 6.51 C ATOM 495 SG CYS A 36 69.677 3.643 21.189 1.00 7.80 S ATOM 496 HA CYS A 36 71.740 4.388 19.250 1.00 0.00 H ATOM 497 HB2 CYS A 36 71.910 2.699 21.100 1.00 0.00 H ATOM 498 HB3 CYS A 36 70.738 1.685 20.227 1.00 0.00 H ATOM 499 HG CYS A 36 68.596 3.654 20.332 1.00 0.00 H ATOM 500 H CYS A 36 69.575 2.734 18.317 1.00 0.00 H ATOM 501 N GLN A 37 72.528 1.430 18.020 1.00 6.62 N ATOM 502 CA GLN A 37 73.642 0.614 17.495 1.00 6.78 C ATOM 503 C GLN A 37 74.377 1.334 16.354 1.00 6.70 C ATOM 504 O GLN A 37 75.599 1.282 16.269 1.00 7.88 O ATOM 505 CB GLN A 37 73.158 -0.766 17.075 1.00 7.12 C ATOM 506 CG GLN A 37 72.637 -1.654 18.241 1.00 8.91 C ATOM 507 CD GLN A 37 73.713 -1.875 19.310 1.00 10.10 C ATOM 508 OE1 GLN A 37 74.839 -2.215 18.951 1.00 10.60 O ATOM 509 NE2 GLN A 37 73.362 -1.706 20.628 1.00 9.23 N ATOM 510 HA GLN A 37 74.363 0.476 18.301 1.00 0.00 H ATOM 511 HB2 GLN A 37 72.348 -0.638 16.357 1.00 0.00 H ATOM 512 HB3 GLN A 37 73.988 -1.286 16.596 1.00 0.00 H ATOM 513 HG2 GLN A 37 71.777 -1.166 18.700 1.00 0.00 H ATOM 514 HG3 GLN A 37 72.333 -2.621 17.840 1.00 0.00 H ATOM 515 HE22 GLN A 37 72.394 -1.417 20.875 1.00 0.00 H ATOM 516 HE21 GLN A 37 74.064 -1.867 21.378 1.00 0.00 H ATOM 517 H GLN A 37 71.552 1.082 17.935 1.00 0.00 H ATOM 518 N TRP A 38 73.647 2.018 15.500 1.00 7.29 N ATOM 519 CA TRP A 38 74.246 2.758 14.401 1.00 7.23 C ATOM 520 C TRP A 38 75.129 3.889 14.965 1.00 7.60 C ATOM 521 O TRP A 38 76.273 4.070 14.514 1.00 8.49 O ATOM 522 CB TRP A 38 73.132 3.322 13.519 1.00 7.28 C ATOM 523 CG TRP A 38 73.566 4.000 12.271 1.00 7.77 C ATOM 524 CD1 TRP A 38 73.439 5.308 11.993 1.00 9.02 C ATOM 525 CD2 TRP A 38 74.242 3.402 11.143 1.00 7.59 C ATOM 526 NE1 TRP A 38 73.977 5.581 10.736 1.00 9.16 N ATOM 527 CE2 TRP A 38 74.458 4.411 10.197 1.00 7.64 C ATOM 528 CE3 TRP A 38 74.627 2.103 10.832 1.00 8.04 C ATOM 529 CZ2 TRP A 38 75.076 4.147 8.953 1.00 7.22 C ATOM 530 CZ3 TRP A 38 75.244 1.851 9.609 1.00 7.63 C ATOM 531 CH2 TRP A 38 75.449 2.867 8.691 1.00 6.74 C ATOM 532 HA TRP A 38 74.874 2.102 13.799 1.00 0.00 H ATOM 533 HB2 TRP A 38 72.478 2.496 13.239 1.00 0.00 H ATOM 534 HB3 TRP A 38 72.570 4.044 14.112 1.00 0.00 H ATOM 535 HE1 TRP A 38 74.009 6.516 10.281 1.00 0.00 H ATOM 536 HD1 TRP A 38 72.983 6.047 12.652 1.00 0.00 H ATOM 537 HZ2 TRP A 38 75.247 4.943 8.229 1.00 0.00 H ATOM 538 HH2 TRP A 38 75.920 2.635 7.736 1.00 0.00 H ATOM 539 HZ3 TRP A 38 75.570 0.839 9.371 1.00 0.00 H ATOM 540 HE3 TRP A 38 74.448 1.291 11.537 1.00 0.00 H ATOM 541 H TRP A 38 72.613 2.030 15.614 1.00 0.00 H ATOM 542 N PHE A 39 74.603 4.683 15.914 1.00 7.73 N ATOM 543 CA PHE A 39 75.402 5.690 16.591 1.00 7.69 C ATOM 544 C PHE A 39 76.657 5.078 17.181 1.00 7.09 C ATOM 545 O PHE A 39 77.758 5.660 17.087 1.00 7.80 O ATOM 546 CB PHE A 39 74.581 6.391 17.667 1.00 7.83 C ATOM 547 CG PHE A 39 75.376 7.334 18.512 1.00 7.22 C ATOM 548 CD1 PHE A 39 75.817 6.980 19.748 1.00 8.35 C ATOM 549 CD2 PHE A 39 75.657 8.601 18.043 1.00 7.69 C ATOM 550 CE1 PHE A 39 76.540 7.878 20.539 1.00 7.19 C ATOM 551 CE2 PHE A 39 76.391 9.503 18.814 1.00 10.04 C ATOM 552 CZ PHE A 39 76.821 9.134 20.077 1.00 7.85 C ATOM 553 HA PHE A 39 75.707 6.435 15.856 1.00 0.00 H ATOM 554 HB2 PHE A 39 73.784 6.953 17.180 1.00 0.00 H ATOM 555 HB3 PHE A 39 74.144 5.632 18.316 1.00 0.00 H ATOM 556 HD2 PHE A 39 75.301 8.901 17.057 1.00 0.00 H ATOM 557 HE2 PHE A 39 76.625 10.494 18.424 1.00 0.00 H ATOM 558 HZ PHE A 39 77.378 9.837 20.697 1.00 0.00 H ATOM 559 HE1 PHE A 39 76.881 7.575 21.529 1.00 0.00 H ATOM 560 HD1 PHE A 39 75.604 5.981 20.128 1.00 0.00 H ATOM 561 H PHE A 39 73.601 4.574 16.169 1.00 0.00 H ATOM 562 N LEU A 40 76.531 3.938 17.849 1.00 7.08 N ATOM 563 CA LEU A 40 77.675 3.379 18.571 1.00 7.82 C ATOM 564 C LEU A 40 78.747 2.772 17.669 1.00 8.04 C ATOM 565 O LEU A 40 79.865 2.539 18.117 1.00 10.55 O ATOM 566 CB LEU A 40 77.211 2.348 19.605 1.00 8.50 C ATOM 567 CG LEU A 40 76.422 2.991 20.743 1.00 7.79 C ATOM 568 CD1 LEU A 40 75.874 1.893 21.645 1.00 8.15 C ATOM 569 CD2 LEU A 40 77.200 3.998 21.571 1.00 9.98 C ATOM 570 HA LEU A 40 78.145 4.225 19.073 1.00 0.00 H ATOM 571 HB2 LEU A 40 76.577 1.613 19.109 1.00 0.00 H ATOM 572 HB3 LEU A 40 78.086 1.849 20.022 1.00 0.00 H ATOM 573 HG LEU A 40 75.622 3.563 20.274 1.00 0.00 H ATOM 574 HD21 LEU A 40 78.061 3.506 22.024 1.00 0.00 H ATOM 575 HD22 LEU A 40 77.541 4.809 20.928 1.00 0.00 H ATOM 576 HD23 LEU A 40 76.555 4.399 22.353 1.00 0.00 H ATOM 577 HD11 LEU A 40 75.221 1.241 21.065 1.00 0.00 H ATOM 578 HD12 LEU A 40 76.702 1.312 22.052 1.00 0.00 H ATOM 579 HD13 LEU A 40 75.309 2.343 22.461 1.00 0.00 H ATOM 580 H LEU A 40 75.618 3.441 17.859 1.00 0.00 H ATOM 581 N ALA A 41 78.418 2.626 16.384 1.00 8.02 N ATOM 582 CA ALA A 41 79.388 2.234 15.365 1.00 8.46 C ATOM 583 C ALA A 41 80.101 3.462 14.753 1.00 8.98 C ATOM 584 O ALA A 41 80.863 3.317 13.813 1.00 10.02 O ATOM 585 CB ALA A 41 78.707 1.374 14.299 1.00 9.26 C ATOM 586 HA ALA A 41 80.165 1.634 15.839 1.00 0.00 H ATOM 587 HB1 ALA A 41 78.294 0.479 14.765 1.00 0.00 H ATOM 588 HB2 ALA A 41 77.905 1.945 13.831 1.00 0.00 H ATOM 589 HB3 ALA A 41 79.439 1.087 13.544 1.00 0.00 H ATOM 590 H ALA A 41 77.433 2.798 16.097 1.00 0.00 H ATOM 591 N GLY A 42 79.884 4.623 15.330 1.00 8.50 N ATOM 592 CA GLY A 42 80.619 5.850 14.983 1.00 8.18 C ATOM 593 C GLY A 42 79.888 6.814 14.042 1.00 9.71 C ATOM 594 O GLY A 42 80.462 7.806 13.558 1.00 10.12 O ATOM 595 HA3 GLY A 42 81.554 5.558 14.505 1.00 0.00 H ATOM 596 HA2 GLY A 42 80.837 6.384 15.908 1.00 0.00 H ATOM 597 H GLY A 42 79.155 4.677 16.070 1.00 0.00 H ATOM 598 N HIS A 43 78.616 6.488 13.734 1.00 8.54 N ATOM 599 CA HIS A 43 77.778 7.352 12.882 1.00 8.39 C ATOM 600 C HIS A 43 76.933 8.376 13.659 1.00 8.87 C ATOM 601 O HIS A 43 76.719 8.177 14.863 1.00 9.75 O ATOM 602 CB HIS A 43 76.824 6.507 12.071 1.00 7.46 C ATOM 603 CG HIS A 43 77.500 5.465 11.270 1.00 7.22 C ATOM 604 ND1 HIS A 43 78.039 5.723 10.013 1.00 7.57 N ATOM 605 CD2 HIS A 43 77.688 4.152 11.511 1.00 8.81 C ATOM 606 CE1 HIS A 43 78.512 4.569 9.537 1.00 8.59 C ATOM 607 NE2 HIS A 43 78.342 3.617 10.438 1.00 10.47 N ATOM 608 HA HIS A 43 78.481 7.902 12.256 1.00 0.00 H ATOM 609 HB2 HIS A 43 76.127 6.021 12.753 1.00 0.00 H ATOM 610 HB3 HIS A 43 76.273 7.160 11.395 1.00 0.00 H ATOM 611 HD2 HIS A 43 77.374 3.613 12.404 1.00 0.00 H ATOM 612 HE1 HIS A 43 78.968 4.433 8.556 1.00 0.00 H ATOM 613 H HIS A 43 78.216 5.604 14.107 1.00 0.00 H ATOM 614 N PRO A 44 76.468 9.479 13.027 1.00 8.83 N ATOM 615 CA PRO A 44 75.600 10.436 13.706 1.00 9.54 C ATOM 616 C PRO A 44 74.307 9.753 14.160 1.00 8.89 C ATOM 617 O PRO A 44 73.733 8.955 13.434 1.00 11.42 O ATOM 618 CB PRO A 44 75.359 11.510 12.654 1.00 11.29 C ATOM 619 CG PRO A 44 76.609 11.415 11.762 1.00 11.77 C ATOM 620 CD PRO A 44 76.819 9.958 11.678 1.00 9.93 C ATOM 621 HA PRO A 44 76.031 10.855 14.615 1.00 0.00 H ATOM 622 HD3 PRO A 44 76.168 9.513 10.925 1.00 0.00 H ATOM 623 HD2 PRO A 44 77.857 9.727 11.441 1.00 0.00 H ATOM 624 HG3 PRO A 44 77.463 11.912 12.223 1.00 0.00 H ATOM 625 HG2 PRO A 44 76.427 11.846 10.778 1.00 0.00 H ATOM 626 HB2 PRO A 44 74.454 11.302 12.083 1.00 0.00 H ATOM 627 HB3 PRO A 44 75.279 12.496 13.112 1.00 0.00 H ATOM 628 N LEU A 45 73.806 10.154 15.314 1.00 8.99 N ATOM 629 CA LEU A 45 72.522 9.736 15.816 1.00 8.96 C ATOM 630 C LEU A 45 71.436 10.264 14.909 1.00 9.36 C ATOM 631 O LEU A 45 71.334 11.447 14.654 1.00 10.14 O ATOM 632 CB LEU A 45 72.342 10.279 17.228 1.00 9.35 C ATOM 633 CG LEU A 45 71.106 9.702 17.943 1.00 10.24 C ATOM 634 CD1 LEU A 45 71.223 8.192 18.183 1.00 10.66 C ATOM 635 CD2 LEU A 45 70.811 10.459 19.224 1.00 11.28 C ATOM 636 HA LEU A 45 72.463 8.648 15.840 1.00 0.00 H ATOM 637 HB2 LEU A 45 73.228 10.030 17.811 1.00 0.00 H ATOM 638 HB3 LEU A 45 72.237 11.363 17.173 1.00 0.00 H ATOM 639 HG LEU A 45 70.255 9.840 17.276 1.00 0.00 H ATOM 640 HD21 LEU A 45 71.668 10.385 19.894 1.00 0.00 H ATOM 641 HD22 LEU A 45 70.621 11.506 18.990 1.00 0.00 H ATOM 642 HD23 LEU A 45 69.933 10.028 19.705 1.00 0.00 H ATOM 643 HD11 LEU A 45 71.329 7.680 17.226 1.00 0.00 H ATOM 644 HD12 LEU A 45 72.097 7.991 18.803 1.00 0.00 H ATOM 645 HD13 LEU A 45 70.326 7.835 18.690 1.00 0.00 H ATOM 646 H LEU A 45 74.370 10.808 15.893 1.00 0.00 H ATOM 647 N THR A 46 70.629 9.333 14.416 1.00 10.03 N ATOM 648 CA THR A 46 69.630 9.604 13.369 1.00 10.37 C ATOM 649 C THR A 46 68.333 8.879 13.686 1.00 9.22 C ATOM 650 O THR A 46 68.380 7.708 14.042 1.00 10.54 O ATOM 651 CB THR A 46 70.137 9.076 12.024 1.00 12.66 C ATOM 652 OG1 THR A 46 71.424 9.647 11.758 1.00 16.30 O ATOM 653 CG2 THR A 46 69.180 9.457 10.887 1.00 15.19 C ATOM 654 HA THR A 46 69.463 10.680 13.325 1.00 0.00 H ATOM 655 HB THR A 46 70.199 7.989 12.077 1.00 0.00 H ATOM 656 HG1 THR A 46 71.345 10.633 11.723 1.00 0.00 H ATOM 657 HG23 THR A 46 68.198 9.027 11.081 1.00 0.00 H ATOM 658 HG21 THR A 46 69.098 10.542 10.831 1.00 0.00 H ATOM 659 HG22 THR A 46 69.567 9.072 9.944 1.00 0.00 H ATOM 660 H THR A 46 70.706 8.365 14.787 1.00 0.00 H ATOM 661 N ASN A 47 67.204 9.565 13.585 1.00 8.74 N ATOM 662 CA ASN A 47 65.876 8.886 13.705 1.00 6.81 C ATOM 663 C ASN A 47 65.643 7.992 12.503 1.00 6.88 C ATOM 664 O ASN A 47 65.804 8.452 11.326 1.00 7.62 O ATOM 665 CB ASN A 47 64.722 9.856 13.829 1.00 7.60 C ATOM 666 CG ASN A 47 64.705 10.568 15.184 1.00 8.81 C ATOM 667 OD1 ASN A 47 64.835 9.903 16.198 1.00 10.62 O ATOM 668 ND2 ASN A 47 64.449 11.883 15.214 1.00 17.32 N ATOM 669 HA ASN A 47 65.910 8.299 14.623 1.00 0.00 H ATOM 670 HB2 ASN A 47 64.806 10.604 13.041 1.00 0.00 H ATOM 671 HB3 ASN A 47 63.788 9.307 13.709 1.00 0.00 H ATOM 672 HD22 ASN A 47 64.345 12.413 14.325 1.00 0.00 H ATOM 673 HD21 ASN A 47 64.354 12.374 16.126 1.00 0.00 H ATOM 674 H ASN A 47 67.241 10.591 13.420 1.00 0.00 H ATOM 675 N LEU A 48 65.192 6.790 12.768 1.00 6.26 N ATOM 676 CA LEU A 48 64.955 5.805 11.708 1.00 6.07 C ATOM 677 C LEU A 48 63.460 5.449 11.627 1.00 6.74 C ATOM 678 O LEU A 48 62.656 5.918 12.440 1.00 6.21 O ATOM 679 CB LEU A 48 65.853 4.595 11.895 1.00 6.66 C ATOM 680 CG LEU A 48 67.362 4.870 11.863 1.00 6.56 C ATOM 681 CD1 LEU A 48 68.131 3.619 12.280 1.00 8.06 C ATOM 682 CD2 LEU A 48 67.833 5.331 10.475 1.00 7.45 C ATOM 683 HA LEU A 48 65.220 6.238 10.744 1.00 0.00 H ATOM 684 HB2 LEU A 48 65.615 4.148 12.860 1.00 0.00 H ATOM 685 HB3 LEU A 48 65.626 3.884 11.101 1.00 0.00 H ATOM 686 HG LEU A 48 67.562 5.678 12.567 1.00 0.00 H ATOM 687 HD21 LEU A 48 67.612 4.556 9.742 1.00 0.00 H ATOM 688 HD22 LEU A 48 67.313 6.249 10.203 1.00 0.00 H ATOM 689 HD23 LEU A 48 68.907 5.514 10.499 1.00 0.00 H ATOM 690 HD11 LEU A 48 67.839 3.335 13.291 1.00 0.00 H ATOM 691 HD12 LEU A 48 67.900 2.806 11.592 1.00 0.00 H ATOM 692 HD13 LEU A 48 69.201 3.826 12.254 1.00 0.00 H ATOM 693 H LEU A 48 64.997 6.528 13.756 1.00 0.00 H ATOM 694 N SER A 49 63.101 4.630 10.644 1.00 7.36 N ATOM 695 CA SER A 49 61.687 4.487 10.256 1.00 7.19 C ATOM 696 C SER A 49 60.956 3.278 10.856 1.00 6.91 C ATOM 697 O SER A 49 61.083 2.157 10.360 1.00 6.96 O ATOM 698 CB SER A 49 61.599 4.384 8.728 1.00 7.77 C ATOM 699 OG SER A 49 60.226 4.208 8.341 1.00 8.12 O ATOM 700 HA SER A 49 61.190 5.371 10.655 1.00 0.00 H ATOM 701 HB2 SER A 49 62.186 3.532 8.386 1.00 0.00 H ATOM 702 HB3 SER A 49 61.990 5.297 8.278 1.00 0.00 H ATOM 703 HG SER A 49 59.695 4.983 8.652 1.00 0.00 H ATOM 704 H SER A 49 63.828 4.082 10.142 1.00 0.00 H ATOM 705 N GLU A 50 60.123 3.533 11.861 1.00 6.64 N ATOM 706 CA GLU A 50 59.211 2.541 12.366 1.00 7.55 C ATOM 707 C GLU A 50 58.187 2.178 11.286 1.00 6.66 C ATOM 708 O GLU A 50 57.769 1.014 11.207 1.00 7.25 O ATOM 709 CB GLU A 50 58.480 3.066 13.601 1.00 6.98 C ATOM 710 CG GLU A 50 59.323 3.345 14.840 1.00 6.60 C ATOM 711 CD GLU A 50 60.084 4.650 14.850 1.00 8.09 C ATOM 712 OE1 GLU A 50 59.982 5.447 13.883 1.00 7.82 O ATOM 713 OE2 GLU A 50 60.769 4.874 15.887 1.00 9.23 O ATOM 714 HA GLU A 50 59.782 1.655 12.642 1.00 0.00 H ATOM 715 HB2 GLU A 50 57.989 3.998 13.321 1.00 0.00 H ATOM 716 HB3 GLU A 50 57.726 2.328 13.876 1.00 0.00 H ATOM 717 HG2 GLU A 50 58.657 3.341 15.703 1.00 0.00 H ATOM 718 HG3 GLU A 50 60.048 2.537 14.938 1.00 0.00 H ATOM 719 H GLU A 50 60.131 4.478 12.295 1.00 0.00 H ATOM 720 N GLN A 51 57.803 3.155 10.460 1.00 6.51 N ATOM 721 CA GLN A 51 56.803 2.882 9.428 1.00 7.19 C ATOM 722 C GLN A 51 57.259 1.826 8.457 1.00 6.96 C ATOM 723 O GLN A 51 56.448 1.041 7.974 1.00 7.28 O ATOM 724 CB GLN A 51 56.422 4.162 8.664 1.00 7.30 C ATOM 725 CG GLN A 51 55.089 3.944 7.877 1.00 7.41 C ATOM 726 CD GLN A 51 53.942 3.612 8.800 1.00 7.94 C ATOM 727 OE1 GLN A 51 53.645 4.368 9.728 1.00 8.04 O ATOM 728 NE2 GLN A 51 53.304 2.513 8.565 1.00 9.39 N ATOM 729 HA GLN A 51 55.922 2.504 9.948 1.00 0.00 H ATOM 730 HB2 GLN A 51 56.292 4.980 9.373 1.00 0.00 H ATOM 731 HB3 GLN A 51 57.218 4.413 7.963 1.00 0.00 H ATOM 732 HG2 GLN A 51 54.849 4.855 7.329 1.00 0.00 H ATOM 733 HG3 GLN A 51 55.225 3.123 7.173 1.00 0.00 H ATOM 734 HE22 GLN A 51 53.590 1.906 7.771 1.00 0.00 H ATOM 735 HE21 GLN A 51 52.505 2.236 9.170 1.00 0.00 H ATOM 736 H GLN A 51 58.214 4.106 10.550 1.00 0.00 H ATOM 737 N MET A 52 58.544 1.827 8.120 1.00 7.37 N ATOM 738 CA MET A 52 59.101 0.806 7.240 1.00 6.56 C ATOM 739 C MET A 52 58.714 -0.570 7.740 1.00 7.61 C ATOM 740 O MET A 52 58.251 -1.424 6.982 1.00 7.91 O ATOM 741 CB MET A 52 60.611 0.961 7.140 1.00 7.03 C ATOM 742 CG MET A 52 61.280 -0.141 6.367 1.00 8.25 C ATOM 743 SD MET A 52 63.061 -0.249 6.605 1.00 8.24 S ATOM 744 CE MET A 52 63.081 -0.935 8.280 1.00 9.65 C ATOM 745 HA MET A 52 58.691 0.929 6.238 1.00 0.00 H ATOM 746 HB2 MET A 52 60.828 1.909 6.647 1.00 0.00 H ATOM 747 HB3 MET A 52 61.024 0.974 8.149 1.00 0.00 H ATOM 748 HG2 MET A 52 61.088 0.022 5.307 1.00 0.00 H ATOM 749 HG3 MET A 52 60.838 -1.089 6.674 1.00 0.00 H ATOM 750 HE1 MET A 52 62.576 -0.248 8.959 1.00 0.00 H ATOM 751 HE2 MET A 52 62.566 -1.896 8.284 1.00 0.00 H ATOM 752 HE3 MET A 52 64.113 -1.073 8.602 1.00 0.00 H ATOM 753 H MET A 52 59.167 2.572 8.492 1.00 0.00 H ATOM 754 N LEU A 53 58.939 -0.817 9.016 1.00 8.27 N ATOM 755 CA LEU A 53 58.557 -2.083 9.600 1.00 8.22 C ATOM 756 C LEU A 53 57.051 -2.300 9.633 1.00 7.46 C ATOM 757 O LEU A 53 56.545 -3.371 9.244 1.00 8.24 O ATOM 758 CB LEU A 53 59.106 -2.232 11.029 1.00 7.71 C ATOM 759 CG LEU A 53 60.622 -2.428 11.141 1.00 8.29 C ATOM 760 CD1 LEU A 53 61.045 -2.381 12.621 1.00 8.83 C ATOM 761 CD2 LEU A 53 61.084 -3.716 10.462 1.00 8.02 C ATOM 762 HA LEU A 53 58.995 -2.840 8.950 1.00 0.00 H ATOM 763 HB2 LEU A 53 58.842 -1.332 11.585 1.00 0.00 H ATOM 764 HB3 LEU A 53 58.622 -3.095 11.486 1.00 0.00 H ATOM 765 HG LEU A 53 61.113 -1.611 10.612 1.00 0.00 H ATOM 766 HD21 LEU A 53 60.594 -4.569 10.932 1.00 0.00 H ATOM 767 HD22 LEU A 53 60.822 -3.682 9.405 1.00 0.00 H ATOM 768 HD23 LEU A 53 62.165 -3.813 10.567 1.00 0.00 H ATOM 769 HD11 LEU A 53 60.773 -1.414 13.045 1.00 0.00 H ATOM 770 HD12 LEU A 53 60.537 -3.175 13.168 1.00 0.00 H ATOM 771 HD13 LEU A 53 62.124 -2.521 12.694 1.00 0.00 H ATOM 772 H LEU A 53 59.396 -0.094 9.608 1.00 0.00 H ATOM 773 N VAL A 54 56.319 -1.340 10.161 1.00 7.26 N ATOM 774 CA VAL A 54 54.853 -1.534 10.299 1.00 6.56 C ATOM 775 C VAL A 54 54.222 -1.862 8.951 1.00 7.23 C ATOM 776 O VAL A 54 53.416 -2.790 8.892 1.00 8.76 O ATOM 777 CB VAL A 54 54.204 -0.322 10.986 1.00 6.85 C ATOM 778 CG1 VAL A 54 52.651 -0.443 11.073 1.00 8.71 C ATOM 779 CG2 VAL A 54 54.814 -0.079 12.357 1.00 7.90 C ATOM 780 HA VAL A 54 54.669 -2.392 10.945 1.00 0.00 H ATOM 781 HB VAL A 54 54.415 0.545 10.359 1.00 0.00 H ATOM 782 HG11 VAL A 54 52.237 -0.520 10.068 1.00 0.00 H ATOM 783 HG12 VAL A 54 52.389 -1.333 11.645 1.00 0.00 H ATOM 784 HG13 VAL A 54 52.246 0.440 11.567 1.00 0.00 H ATOM 785 HG21 VAL A 54 54.661 -0.959 12.982 1.00 0.00 H ATOM 786 HG22 VAL A 54 55.882 0.111 12.250 1.00 0.00 H ATOM 787 HG23 VAL A 54 54.335 0.784 12.819 1.00 0.00 H ATOM 788 H VAL A 54 56.764 -0.455 10.478 1.00 0.00 H ATOM 789 N SER A 55 54.619 -1.131 7.896 1.00 7.18 N ATOM 790 CA SER A 55 54.003 -1.348 6.571 1.00 8.13 C ATOM 791 C SER A 55 54.581 -2.543 5.819 1.00 8.42 C ATOM 792 O SER A 55 53.858 -3.210 5.054 1.00 9.63 O ATOM 793 CB SER A 55 54.173 -0.107 5.688 1.00 8.77 C ATOM 794 OG SER A 55 53.468 1.008 6.151 1.00 11.93 O ATOM 795 HA SER A 55 52.951 -1.549 6.771 1.00 0.00 H ATOM 796 HB2 SER A 55 53.820 -0.346 4.685 1.00 0.00 H ATOM 797 HB3 SER A 55 55.232 0.146 5.649 1.00 0.00 H ATOM 798 HG SER A 55 52.501 0.796 6.182 1.00 0.00 H ATOM 799 H SER A 55 55.361 -0.412 8.012 1.00 0.00 H ATOM 800 N CYS A 56 55.895 -2.768 5.919 1.00 8.53 N ATOM 801 CA CYS A 56 56.546 -3.678 4.999 1.00 8.78 C ATOM 802 C CYS A 56 56.928 -5.054 5.525 1.00 8.22 C ATOM 803 O CYS A 56 57.118 -5.992 4.743 1.00 9.76 O ATOM 804 CB CYS A 56 57.800 -2.997 4.417 1.00 9.19 C ATOM 805 SG CYS A 56 57.449 -1.477 3.537 1.00 10.38 S ATOM 806 HA CYS A 56 55.782 -3.884 4.250 1.00 0.00 H ATOM 807 HB2 CYS A 56 58.281 -3.691 3.728 1.00 0.00 H ATOM 808 HB3 CYS A 56 58.481 -2.771 5.237 1.00 0.00 H ATOM 809 H CYS A 56 56.450 -2.290 6.657 1.00 0.00 H ATOM 810 N ASP A 57 57.058 -5.181 6.852 1.00 8.70 N ATOM 811 CA ASP A 57 57.442 -6.436 7.462 1.00 8.14 C ATOM 812 C ASP A 57 56.219 -7.325 7.635 1.00 8.97 C ATOM 813 O ASP A 57 55.468 -7.198 8.603 1.00 8.78 O ATOM 814 CB ASP A 57 58.162 -6.169 8.780 1.00 7.57 C ATOM 815 CG ASP A 57 58.338 -7.378 9.642 1.00 8.20 C ATOM 816 OD1 ASP A 57 58.134 -8.520 9.178 1.00 9.05 O ATOM 817 OD2 ASP A 57 58.718 -7.186 10.833 1.00 8.98 O ATOM 818 HA ASP A 57 58.137 -6.970 6.814 1.00 0.00 H ATOM 819 HB2 ASP A 57 59.148 -5.764 8.554 1.00 0.00 H ATOM 820 HB3 ASP A 57 57.587 -5.431 9.340 1.00 0.00 H ATOM 821 H ASP A 57 56.878 -4.356 7.460 1.00 0.00 H ATOM 822 N LYS A 58 55.999 -8.207 6.670 1.00 8.96 N ATOM 823 CA LYS A 58 54.817 -9.064 6.729 1.00 9.86 C ATOM 824 C LYS A 58 54.952 -10.301 7.587 1.00 10.52 C ATOM 825 O LYS A 58 53.982 -11.101 7.637 1.00 11.91 O ATOM 826 CB LYS A 58 54.388 -9.418 5.314 1.00 11.20 C ATOM 827 CG LYS A 58 54.194 -8.220 4.386 1.00 12.60 C ATOM 828 CD LYS A 58 53.210 -7.168 4.938 1.00 13.07 C ATOM 829 CE LYS A 58 52.900 -6.038 3.976 1.00 14.30 C ATOM 830 NZ LYS A 58 51.806 -5.165 4.459 1.00 15.05 N ATOM 831 HA LYS A 58 54.046 -8.482 7.234 1.00 0.00 H ATOM 832 HB2 LYS A 58 55.151 -10.064 4.879 1.00 0.00 H ATOM 833 HB3 LYS A 58 53.444 -9.960 5.371 1.00 0.00 H ATOM 834 HG2 LYS A 58 55.161 -7.741 4.233 1.00 0.00 H ATOM 835 HG3 LYS A 58 53.813 -8.581 3.431 1.00 0.00 H ATOM 836 HD2 LYS A 58 52.276 -7.671 5.186 1.00 0.00 H ATOM 837 HD3 LYS A 58 53.641 -6.738 5.842 1.00 0.00 H ATOM 838 HE2 LYS A 58 52.609 -6.466 3.017 1.00 0.00 H ATOM 839 HE3 LYS A 58 53.798 -5.434 3.845 1.00 0.00 H ATOM 840 HZ1 LYS A 58 50.941 -5.730 4.579 1.00 0.00 H ATOM 841 HZ2 LYS A 58 52.077 -4.744 5.371 1.00 0.00 H ATOM 842 HZ3 LYS A 58 51.635 -4.410 3.765 1.00 0.00 H ATOM 843 H LYS A 58 56.664 -8.289 5.875 1.00 0.00 H ATOM 844 N THR A 59 56.104 -10.491 8.253 1.00 8.66 N ATOM 845 CA THR A 59 56.224 -11.550 9.245 1.00 10.22 C ATOM 846 C THR A 59 55.708 -11.057 10.600 1.00 10.17 C ATOM 847 O THR A 59 55.615 -11.803 11.521 1.00 12.33 O ATOM 848 CB THR A 59 57.654 -12.034 9.392 1.00 11.80 C ATOM 849 OG1 THR A 59 58.483 -11.093 10.099 1.00 12.78 O ATOM 850 CG2 THR A 59 58.251 -12.389 8.020 1.00 13.60 C ATOM 851 HA THR A 59 55.622 -12.390 8.899 1.00 0.00 H ATOM 852 HB THR A 59 57.628 -12.939 9.999 1.00 0.00 H ATOM 853 HG1 THR A 59 59.403 -11.453 10.169 1.00 0.00 H ATOM 854 HG23 THR A 59 57.599 -13.101 7.515 1.00 0.00 H ATOM 855 HG21 THR A 59 58.339 -11.484 7.418 1.00 0.00 H ATOM 856 HG22 THR A 59 59.237 -12.832 8.158 1.00 0.00 H ATOM 857 H THR A 59 56.919 -9.875 8.058 1.00 0.00 H ATOM 858 N ASP A 60 55.374 -9.782 10.651 1.00 8.07 N ATOM 859 CA ASP A 60 54.744 -9.181 11.813 1.00 7.75 C ATOM 860 C ASP A 60 53.400 -8.606 11.422 1.00 9.58 C ATOM 861 O ASP A 60 53.023 -8.668 10.240 1.00 9.92 O ATOM 862 CB ASP A 60 55.702 -8.164 12.463 1.00 7.76 C ATOM 863 CG ASP A 60 56.898 -8.859 13.107 1.00 8.40 C ATOM 864 OD1 ASP A 60 56.644 -9.651 14.058 1.00 8.23 O ATOM 865 OD2 ASP A 60 58.080 -8.589 12.695 1.00 8.57 O ATOM 866 HA ASP A 60 54.543 -9.932 12.577 1.00 0.00 H ATOM 867 HB2 ASP A 60 56.061 -7.475 11.698 1.00 0.00 H ATOM 868 HB3 ASP A 60 55.162 -7.606 13.228 1.00 0.00 H ATOM 869 H ASP A 60 55.570 -9.182 9.824 1.00 0.00 H ATOM 870 N SER A 61 52.653 -8.068 12.388 1.00 9.18 N ATOM 871 CA SER A 61 51.243 -7.739 12.188 1.00 9.04 C ATOM 872 C SER A 61 50.914 -6.282 12.392 1.00 9.10 C ATOM 873 O SER A 61 49.804 -5.928 12.832 1.00 8.75 O ATOM 874 CB SER A 61 50.367 -8.605 13.114 1.00 9.94 C ATOM 875 OG SER A 61 50.574 -9.964 12.833 1.00 15.24 O ATOM 876 HA SER A 61 51.030 -7.954 11.141 1.00 0.00 H ATOM 877 HB2 SER A 61 49.317 -8.358 12.954 1.00 0.00 H ATOM 878 HB3 SER A 61 50.631 -8.406 14.153 1.00 0.00 H ATOM 879 HG SER A 61 51.527 -10.189 12.980 1.00 0.00 H ATOM 880 H SER A 61 53.088 -7.877 13.313 1.00 0.00 H ATOM 881 N GLY A 62 51.819 -5.388 11.974 1.00 8.59 N ATOM 882 CA GLY A 62 51.501 -3.989 11.947 1.00 8.22 C ATOM 883 C GLY A 62 50.980 -3.419 13.266 1.00 7.96 C ATOM 884 O GLY A 62 51.614 -3.612 14.329 1.00 8.57 O ATOM 885 HA3 GLY A 62 50.738 -3.830 11.185 1.00 0.00 H ATOM 886 HA2 GLY A 62 52.404 -3.442 11.675 1.00 0.00 H ATOM 887 H GLY A 62 52.759 -5.710 11.667 1.00 0.00 H ATOM 888 N CYS A 63 49.798 -2.793 13.233 1.00 7.83 N ATOM 889 CA CYS A 63 49.216 -2.177 14.441 1.00 7.81 C ATOM 890 C CYS A 63 48.598 -3.235 15.385 1.00 8.70 C ATOM 891 O CYS A 63 48.122 -2.890 16.474 1.00 8.37 O ATOM 892 CB CYS A 63 48.170 -1.129 14.055 1.00 8.77 C ATOM 893 SG CYS A 63 48.850 0.376 13.388 1.00 9.47 S ATOM 894 HA CYS A 63 50.026 -1.687 14.982 1.00 0.00 H ATOM 895 HB2 CYS A 63 47.593 -0.878 14.945 1.00 0.00 H ATOM 896 HB3 CYS A 63 47.509 -1.566 13.307 1.00 0.00 H ATOM 897 H CYS A 63 49.277 -2.739 12.335 1.00 0.00 H ATOM 898 N SER A 64 48.664 -4.500 14.986 1.00 7.86 N ATOM 899 CA SER A 64 48.207 -5.641 15.787 1.00 8.64 C ATOM 900 C SER A 64 49.331 -6.464 16.397 1.00 8.62 C ATOM 901 O SER A 64 49.097 -7.548 16.883 1.00 9.34 O ATOM 902 CB SER A 64 47.197 -6.488 14.988 1.00 8.99 C ATOM 903 OG SER A 64 46.023 -5.726 14.718 1.00 8.44 O ATOM 904 HA SER A 64 47.690 -5.232 16.655 1.00 0.00 H ATOM 905 HB2 SER A 64 46.928 -7.371 15.568 1.00 0.00 H ATOM 906 HB3 SER A 64 47.651 -6.797 14.046 1.00 0.00 H ATOM 907 HG SER A 64 45.382 -6.280 14.205 1.00 0.00 H ATOM 908 H SER A 64 49.065 -4.694 14.046 1.00 0.00 H ATOM 909 N GLY A 65 50.572 -5.967 16.319 1.00 7.61 N ATOM 910 CA GLY A 65 51.673 -6.495 17.151 1.00 8.05 C ATOM 911 C GLY A 65 52.727 -7.234 16.332 1.00 8.46 C ATOM 912 O GLY A 65 52.579 -7.441 15.112 1.00 9.22 O ATOM 913 HA3 GLY A 65 51.256 -7.184 17.886 1.00 0.00 H ATOM 914 HA2 GLY A 65 52.152 -5.662 17.666 1.00 0.00 H ATOM 915 H GLY A 65 50.766 -5.190 15.656 1.00 0.00 H ATOM 916 N GLY A 66 53.804 -7.638 16.986 1.00 7.93 N ATOM 917 CA GLY A 66 54.944 -8.209 16.330 1.00 7.61 C ATOM 918 C GLY A 66 55.990 -8.651 17.331 1.00 8.38 C ATOM 919 O GLY A 66 55.780 -8.553 18.547 1.00 7.92 O ATOM 920 HA3 GLY A 66 55.381 -7.465 15.665 1.00 0.00 H ATOM 921 HA2 GLY A 66 54.623 -9.072 15.747 1.00 0.00 H ATOM 922 H GLY A 66 53.825 -7.537 18.021 1.00 0.00 H ATOM 923 N LEU A 67 57.112 -9.157 16.803 1.00 8.11 N ATOM 924 CA LEU A 67 58.257 -9.604 17.570 1.00 8.80 C ATOM 925 C LEU A 67 59.460 -8.784 17.078 1.00 9.02 C ATOM 926 O LEU A 67 59.702 -8.731 15.877 1.00 8.55 O ATOM 927 CB LEU A 67 58.512 -11.102 17.404 1.00 11.24 C ATOM 928 CG LEU A 67 57.377 -12.046 17.799 1.00 12.89 C ATOM 929 CD1 LEU A 67 57.788 -13.457 17.363 1.00 16.26 C ATOM 930 CD2 LEU A 67 57.235 -12.003 19.294 1.00 14.00 C ATOM 931 HA LEU A 67 58.080 -9.451 18.635 1.00 0.00 H ATOM 932 HB2 LEU A 67 58.740 -11.283 16.354 1.00 0.00 H ATOM 933 HB3 LEU A 67 59.380 -11.358 18.012 1.00 0.00 H ATOM 934 HG LEU A 67 56.433 -11.764 17.333 1.00 0.00 H ATOM 935 HD21 LEU A 67 58.169 -12.323 19.756 1.00 0.00 H ATOM 936 HD22 LEU A 67 57.004 -10.985 19.607 1.00 0.00 H ATOM 937 HD23 LEU A 67 56.429 -12.670 19.601 1.00 0.00 H ATOM 938 HD11 LEU A 67 57.942 -13.472 16.284 1.00 0.00 H ATOM 939 HD12 LEU A 67 58.713 -13.737 17.867 1.00 0.00 H ATOM 940 HD13 LEU A 67 57.000 -14.162 17.629 1.00 0.00 H ATOM 941 H LEU A 67 57.165 -9.235 15.767 1.00 0.00 H ATOM 942 N MET A 68 60.238 -8.211 17.990 1.00 7.90 N ATOM 943 CA MET A 68 61.439 -7.513 17.578 1.00 7.11 C ATOM 944 C MET A 68 62.413 -8.455 16.864 1.00 7.62 C ATOM 945 O MET A 68 63.062 -8.032 15.910 1.00 7.38 O ATOM 946 CB MET A 68 62.148 -6.792 18.769 1.00 6.52 C ATOM 947 CG MET A 68 61.326 -5.666 19.400 1.00 7.12 C ATOM 948 SD MET A 68 59.958 -6.192 20.429 1.00 8.03 S ATOM 949 CE MET A 68 60.847 -6.667 21.944 1.00 8.79 C ATOM 950 HA MET A 68 61.123 -6.743 16.874 1.00 0.00 H ATOM 951 HB2 MET A 68 62.361 -7.533 19.539 1.00 0.00 H ATOM 952 HB3 MET A 68 63.084 -6.369 18.404 1.00 0.00 H ATOM 953 HG2 MET A 68 60.924 -5.052 18.594 1.00 0.00 H ATOM 954 HG3 MET A 68 61.996 -5.064 20.014 1.00 0.00 H ATOM 955 HE1 MET A 68 61.555 -7.463 21.714 1.00 0.00 H ATOM 956 HE2 MET A 68 61.384 -5.803 22.335 1.00 0.00 H ATOM 957 HE3 MET A 68 60.132 -7.019 22.688 1.00 0.00 H ATOM 958 H MET A 68 59.985 -8.263 18.998 1.00 0.00 H ATOM 959 N ASN A 69 62.529 -9.700 17.296 1.00 7.63 N ATOM 960 CA ASN A 69 63.404 -10.644 16.599 1.00 8.14 C ATOM 961 C ASN A 69 62.959 -10.909 15.179 1.00 10.03 C ATOM 962 O ASN A 69 63.786 -10.961 14.292 1.00 9.10 O ATOM 963 CB ASN A 69 63.589 -11.932 17.383 1.00 9.53 C ATOM 964 CG ASN A 69 64.433 -11.692 18.627 1.00 9.52 C ATOM 965 OD1 ASN A 69 65.361 -10.877 18.584 1.00 10.54 O ATOM 966 ND2 ASN A 69 64.158 -12.440 19.707 1.00 10.48 N ATOM 967 HA ASN A 69 64.381 -10.165 16.532 1.00 0.00 H ATOM 968 HB2 ASN A 69 62.612 -12.312 17.682 1.00 0.00 H ATOM 969 HB3 ASN A 69 64.086 -12.667 16.750 1.00 0.00 H ATOM 970 HD22 ASN A 69 63.363 -13.111 19.686 1.00 0.00 H ATOM 971 HD21 ASN A 69 64.740 -12.349 20.564 1.00 0.00 H ATOM 972 H ASN A 69 61.996 -10.009 18.134 1.00 0.00 H ATOM 973 N ASN A 70 61.649 -10.979 14.957 1.00 9.04 N ATOM 974 CA ASN A 70 61.134 -11.085 13.580 1.00 9.10 C ATOM 975 C ASN A 70 61.529 -9.821 12.801 1.00 7.67 C ATOM 976 O ASN A 70 61.897 -9.910 11.614 1.00 8.95 O ATOM 977 CB ASN A 70 59.629 -11.223 13.561 1.00 8.80 C ATOM 978 CG ASN A 70 59.155 -12.587 13.845 1.00 9.26 C ATOM 979 OD1 ASN A 70 59.887 -13.462 14.274 1.00 13.72 O ATOM 980 ND2 ASN A 70 57.844 -12.773 13.678 1.00 15.10 N ATOM 981 HA ASN A 70 61.565 -11.975 13.121 1.00 0.00 H ATOM 982 HB2 ASN A 70 59.212 -10.551 14.311 1.00 0.00 H ATOM 983 HB3 ASN A 70 59.269 -10.932 12.574 1.00 0.00 H ATOM 984 HD22 ASN A 70 57.252 -12.001 13.309 1.00 0.00 H ATOM 985 HD21 ASN A 70 57.414 -13.689 13.917 1.00 0.00 H ATOM 986 H ASN A 70 60.986 -10.959 15.758 1.00 0.00 H ATOM 987 N ALA A 71 61.388 -8.613 13.381 1.00 7.81 N ATOM 988 CA ALA A 71 61.723 -7.351 12.704 1.00 7.66 C ATOM 989 C ALA A 71 63.207 -7.347 12.292 1.00 7.35 C ATOM 990 O ALA A 71 63.532 -6.974 11.170 1.00 7.45 O ATOM 991 CB ALA A 71 61.426 -6.188 13.603 1.00 7.97 C ATOM 992 HA ALA A 71 61.113 -7.260 11.805 1.00 0.00 H ATOM 993 HB1 ALA A 71 60.366 -6.188 13.856 1.00 0.00 H ATOM 994 HB2 ALA A 71 62.019 -6.274 14.514 1.00 0.00 H ATOM 995 HB3 ALA A 71 61.678 -5.260 13.090 1.00 0.00 H ATOM 996 H ALA A 71 61.025 -8.571 14.355 1.00 0.00 H ATOM 997 N PHE A 72 64.103 -7.755 13.183 1.00 7.96 N ATOM 998 CA PHE A 72 65.521 -7.756 12.842 1.00 7.96 C ATOM 999 C PHE A 72 65.795 -8.735 11.700 1.00 8.68 C ATOM 1000 O PHE A 72 66.568 -8.428 10.798 1.00 9.06 O ATOM 1001 CB PHE A 72 66.410 -8.098 14.035 1.00 8.01 C ATOM 1002 CG PHE A 72 66.355 -7.127 15.185 1.00 6.37 C ATOM 1003 CD1 PHE A 72 66.498 -5.783 14.991 1.00 8.13 C ATOM 1004 CD2 PHE A 72 66.274 -7.604 16.492 1.00 8.16 C ATOM 1005 CE1 PHE A 72 66.460 -4.915 16.066 1.00 7.79 C ATOM 1006 CE2 PHE A 72 66.273 -6.713 17.534 1.00 9.16 C ATOM 1007 CZ PHE A 72 66.389 -5.392 17.303 1.00 7.87 C ATOM 1008 HA PHE A 72 65.768 -6.742 12.527 1.00 0.00 H ATOM 1009 HB2 PHE A 72 66.110 -9.077 14.408 1.00 0.00 H ATOM 1010 HB3 PHE A 72 67.441 -8.144 13.684 1.00 0.00 H ATOM 1011 HD2 PHE A 72 66.212 -8.675 16.684 1.00 0.00 H ATOM 1012 HE2 PHE A 72 66.178 -7.077 18.557 1.00 0.00 H ATOM 1013 HZ PHE A 72 66.425 -4.702 18.146 1.00 0.00 H ATOM 1014 HE1 PHE A 72 66.488 -3.838 15.898 1.00 0.00 H ATOM 1015 HD1 PHE A 72 66.643 -5.393 13.984 1.00 0.00 H ATOM 1016 H PHE A 72 63.794 -8.074 14.123 1.00 0.00 H ATOM 1017 N GLU A 73 65.165 -9.901 11.722 1.00 8.14 N ATOM 1018 CA GLU A 73 65.355 -10.913 10.685 1.00 9.20 C ATOM 1019 C GLU A 73 64.799 -10.399 9.370 1.00 9.39 C ATOM 1020 O GLU A 73 65.414 -10.613 8.325 1.00 10.13 O ATOM 1021 CB GLU A 73 64.705 -12.184 11.135 1.00 11.45 C ATOM 1022 CG GLU A 73 65.480 -12.851 12.252 1.00 17.11 C ATOM 1023 CD GLU A 73 64.865 -14.135 12.815 1.00 24.22 C ATOM 1024 OE1 GLU A 73 63.814 -14.626 12.310 1.00 31.14 O ATOM 1025 OE2 GLU A 73 65.429 -14.660 13.798 1.00 28.35 O ATOM 1026 HA GLU A 73 66.413 -11.120 10.522 1.00 0.00 H ATOM 1027 HB2 GLU A 73 63.699 -11.959 11.489 1.00 0.00 H ATOM 1028 HB3 GLU A 73 64.646 -12.869 10.289 1.00 0.00 H ATOM 1029 HG2 GLU A 73 66.472 -13.094 11.872 1.00 0.00 H ATOM 1030 HG3 GLU A 73 65.570 -12.136 13.070 1.00 0.00 H ATOM 1031 H GLU A 73 64.512 -10.103 12.506 1.00 0.00 H ATOM 1032 N TRP A 74 63.634 -9.718 9.389 1.00 7.31 N ATOM 1033 CA TRP A 74 63.075 -9.119 8.155 1.00 7.86 C ATOM 1034 C TRP A 74 64.037 -8.126 7.558 1.00 7.52 C ATOM 1035 O TRP A 74 64.271 -8.090 6.357 1.00 8.91 O ATOM 1036 CB TRP A 74 61.710 -8.467 8.418 1.00 7.68 C ATOM 1037 CG TRP A 74 61.098 -7.891 7.173 1.00 8.39 C ATOM 1038 CD1 TRP A 74 60.314 -8.552 6.276 1.00 11.22 C ATOM 1039 CD2 TRP A 74 61.301 -6.580 6.643 1.00 8.47 C ATOM 1040 NE1 TRP A 74 59.982 -7.729 5.244 1.00 8.92 N ATOM 1041 CE2 TRP A 74 60.585 -6.513 5.430 1.00 9.03 C ATOM 1042 CE3 TRP A 74 61.963 -5.438 7.091 1.00 7.36 C ATOM 1043 CZ2 TRP A 74 60.578 -5.369 4.630 1.00 7.59 C ATOM 1044 CZ3 TRP A 74 61.972 -4.331 6.279 1.00 8.93 C ATOM 1045 CH2 TRP A 74 61.269 -4.297 5.085 1.00 8.77 C ATOM 1046 HA TRP A 74 62.924 -9.924 7.435 1.00 0.00 H ATOM 1047 HB2 TRP A 74 61.035 -9.220 8.823 1.00 0.00 H ATOM 1048 HB3 TRP A 74 61.839 -7.667 9.147 1.00 0.00 H ATOM 1049 HE1 TRP A 74 59.369 -7.983 4.443 1.00 0.00 H ATOM 1050 HD1 TRP A 74 59.998 -9.591 6.371 1.00 0.00 H ATOM 1051 HZ2 TRP A 74 60.041 -5.340 3.682 1.00 0.00 H ATOM 1052 HH2 TRP A 74 61.272 -3.381 4.495 1.00 0.00 H ATOM 1053 HZ3 TRP A 74 62.547 -3.456 6.581 1.00 0.00 H ATOM 1054 HE3 TRP A 74 62.461 -5.424 8.061 1.00 0.00 H ATOM 1055 H TRP A 74 63.119 -9.612 10.286 1.00 0.00 H ATOM 1056 N ILE A 75 64.570 -7.241 8.373 1.00 8.23 N ATOM 1057 CA ILE A 75 65.491 -6.198 7.878 1.00 7.49 C ATOM 1058 C ILE A 75 66.643 -6.875 7.141 1.00 8.08 C ATOM 1059 O ILE A 75 66.990 -6.446 6.027 1.00 8.44 O ATOM 1060 CB ILE A 75 66.022 -5.303 9.036 1.00 7.46 C ATOM 1061 CG1 ILE A 75 64.870 -4.449 9.563 1.00 8.38 C ATOM 1062 CG2 ILE A 75 67.203 -4.456 8.533 1.00 8.37 C ATOM 1063 CD1 ILE A 75 65.147 -3.776 10.925 1.00 7.04 C ATOM 1064 HA ILE A 75 64.951 -5.541 7.197 1.00 0.00 H ATOM 1065 HB ILE A 75 66.394 -5.911 9.861 1.00 0.00 H ATOM 1066 HG12 ILE A 75 64.662 -3.668 8.832 1.00 0.00 H ATOM 1067 HG13 ILE A 75 63.993 -5.087 9.670 1.00 0.00 H ATOM 1068 HD11 ILE A 75 65.344 -4.543 11.674 1.00 0.00 H ATOM 1069 HD12 ILE A 75 66.014 -3.122 10.836 1.00 0.00 H ATOM 1070 HD13 ILE A 75 64.277 -3.190 11.223 1.00 0.00 H ATOM 1071 HG21 ILE A 75 68.000 -5.115 8.189 1.00 0.00 H ATOM 1072 HG22 ILE A 75 66.871 -3.824 7.709 1.00 0.00 H ATOM 1073 HG23 ILE A 75 67.572 -3.831 9.346 1.00 0.00 H ATOM 1074 H ILE A 75 64.338 -7.277 9.386 1.00 0.00 H ATOM 1075 N VAL A 76 67.259 -7.854 7.762 1.00 8.97 N ATOM 1076 CA VAL A 76 68.425 -8.537 7.159 1.00 10.20 C ATOM 1077 C VAL A 76 68.046 -9.389 5.954 1.00 11.23 C ATOM 1078 O VAL A 76 68.697 -9.311 4.917 1.00 12.77 O ATOM 1079 CB VAL A 76 69.181 -9.353 8.233 1.00 10.04 C ATOM 1080 CG1 VAL A 76 70.278 -10.158 7.577 1.00 11.80 C ATOM 1081 CG2 VAL A 76 69.700 -8.375 9.320 1.00 12.25 C ATOM 1082 HA VAL A 76 69.098 -7.769 6.777 1.00 0.00 H ATOM 1083 HB VAL A 76 68.524 -10.071 8.725 1.00 0.00 H ATOM 1084 HG11 VAL A 76 69.841 -10.838 6.846 1.00 0.00 H ATOM 1085 HG12 VAL A 76 70.973 -9.483 7.078 1.00 0.00 H ATOM 1086 HG13 VAL A 76 70.809 -10.732 8.336 1.00 0.00 H ATOM 1087 HG21 VAL A 76 70.372 -7.649 8.863 1.00 0.00 H ATOM 1088 HG22 VAL A 76 68.855 -7.856 9.773 1.00 0.00 H ATOM 1089 HG23 VAL A 76 70.236 -8.936 10.086 1.00 0.00 H ATOM 1090 H VAL A 76 66.920 -8.156 8.698 1.00 0.00 H ATOM 1091 N GLN A 77 67.007 -10.199 6.079 1.00 10.74 N ATOM 1092 CA GLN A 77 66.744 -11.244 5.074 1.00 11.48 C ATOM 1093 C GLN A 77 65.925 -10.716 3.939 1.00 12.49 C ATOM 1094 O GLN A 77 66.073 -11.181 2.797 1.00 15.44 O ATOM 1095 CB GLN A 77 66.023 -12.434 5.717 1.00 11.48 C ATOM 1096 CG GLN A 77 66.880 -13.181 6.710 1.00 14.79 C ATOM 1097 CD GLN A 77 68.072 -13.879 6.073 1.00 13.65 C ATOM 1098 OE1 GLN A 77 67.976 -14.427 4.975 1.00 13.38 O ATOM 1099 NE2 GLN A 77 69.203 -13.867 6.770 1.00 13.55 N ATOM 1100 HA GLN A 77 67.706 -11.572 4.681 1.00 0.00 H ATOM 1101 HB2 GLN A 77 65.136 -12.065 6.232 1.00 0.00 H ATOM 1102 HB3 GLN A 77 65.723 -13.125 4.929 1.00 0.00 H ATOM 1103 HG2 GLN A 77 67.250 -12.472 7.451 1.00 0.00 H ATOM 1104 HG3 GLN A 77 66.263 -13.932 7.204 1.00 0.00 H ATOM 1105 HE22 GLN A 77 69.239 -13.392 7.694 1.00 0.00 H ATOM 1106 HE21 GLN A 77 70.052 -14.333 6.391 1.00 0.00 H ATOM 1107 H GLN A 77 66.370 -10.097 6.895 1.00 0.00 H ATOM 1108 N GLU A 78 65.024 -9.800 4.224 1.00 10.58 N ATOM 1109 CA GLU A 78 64.133 -9.238 3.195 1.00 10.34 C ATOM 1110 C GLU A 78 64.456 -7.843 2.777 1.00 11.79 C ATOM 1111 O GLU A 78 64.004 -7.419 1.711 1.00 15.37 O ATOM 1112 CB GLU A 78 62.636 -9.286 3.621 1.00 11.06 C ATOM 1113 CG GLU A 78 62.114 -10.639 3.955 1.00 12.95 C ATOM 1114 CD GLU A 78 62.000 -11.610 2.809 1.00 20.33 C ATOM 1115 OE1 GLU A 78 62.057 -11.208 1.612 1.00 20.52 O ATOM 1116 OE2 GLU A 78 61.865 -12.806 3.156 1.00 23.90 O ATOM 1117 HA GLU A 78 64.306 -9.887 2.336 1.00 0.00 H ATOM 1118 HB2 GLU A 78 62.515 -8.652 4.499 1.00 0.00 H ATOM 1119 HB3 GLU A 78 62.039 -8.887 2.801 1.00 0.00 H ATOM 1120 HG2 GLU A 78 62.779 -11.078 4.698 1.00 0.00 H ATOM 1121 HG3 GLU A 78 61.121 -10.515 4.386 1.00 0.00 H ATOM 1122 H GLU A 78 64.939 -9.463 5.204 1.00 0.00 H ATOM 1123 N ASN A 79 65.229 -7.089 3.553 1.00 9.29 N ATOM 1124 CA ASN A 79 65.542 -5.738 3.171 1.00 9.36 C ATOM 1125 C ASN A 79 67.050 -5.491 3.087 1.00 8.72 C ATOM 1126 O ASN A 79 67.485 -4.362 3.093 1.00 10.10 O ATOM 1127 CB ASN A 79 64.894 -4.714 4.159 1.00 8.11 C ATOM 1128 CG ASN A 79 64.364 -3.506 3.464 1.00 10.77 C ATOM 1129 OD1 ASN A 79 63.713 -3.643 2.411 1.00 11.71 O ATOM 1130 ND2 ASN A 79 64.607 -2.328 4.015 1.00 9.08 N ATOM 1131 HA ASN A 79 65.124 -5.593 2.175 1.00 0.00 H ATOM 1132 HB2 ASN A 79 64.073 -5.204 4.683 1.00 0.00 H ATOM 1133 HB3 ASN A 79 65.648 -4.400 4.881 1.00 0.00 H ATOM 1134 HD22 ASN A 79 65.157 -2.269 4.896 1.00 0.00 H ATOM 1135 HD21 ASN A 79 64.248 -1.461 3.567 1.00 0.00 H ATOM 1136 H ASN A 79 65.609 -7.478 4.440 1.00 0.00 H ATOM 1137 N ASN A 80 67.812 -6.583 2.987 1.00 9.79 N ATOM 1138 CA ASN A 80 69.265 -6.519 2.735 1.00 8.89 C ATOM 1139 C ASN A 80 69.998 -5.638 3.743 1.00 10.25 C ATOM 1140 O ASN A 80 70.947 -4.959 3.415 1.00 10.86 O ATOM 1141 CB ASN A 80 69.610 -6.125 1.255 1.00 9.19 C ATOM 1142 CG ASN A 80 69.289 -4.612 0.863 1.00 14.62 C ATOM 1143 OD1 ASN A 80 70.095 -3.622 1.059 1.00 18.42 O ATOM 1144 ND2 ASN A 80 68.152 -4.464 0.206 1.00 16.95 N ATOM 1145 HA ASN A 80 69.633 -7.535 2.879 1.00 0.00 H ATOM 1146 HB2 ASN A 80 70.675 -6.295 1.100 1.00 0.00 H ATOM 1147 HB3 ASN A 80 69.039 -6.774 0.591 1.00 0.00 H ATOM 1148 HD22 ASN A 80 67.523 -5.280 0.064 1.00 0.00 H ATOM 1149 HD21 ASN A 80 67.886 -3.531 -0.169 1.00 0.00 H ATOM 1150 H ASN A 80 67.364 -7.516 3.091 1.00 0.00 H ATOM 1151 N GLY A 81 69.494 -5.647 4.971 1.00 9.99 N ATOM 1152 CA GLY A 81 70.090 -4.894 6.071 1.00 8.98 C ATOM 1153 C GLY A 81 69.671 -3.427 6.192 1.00 7.59 C ATOM 1154 O GLY A 81 70.015 -2.759 7.167 1.00 9.10 O ATOM 1155 HA3 GLY A 81 71.172 -4.922 5.945 1.00 0.00 H ATOM 1156 HA2 GLY A 81 69.821 -5.395 7.001 1.00 0.00 H ATOM 1157 H GLY A 81 68.641 -6.213 5.157 1.00 0.00 H ATOM 1158 N ALA A 82 68.925 -2.890 5.213 1.00 7.62 N ATOM 1159 CA ALA A 82 68.647 -1.496 5.133 1.00 7.93 C ATOM 1160 C ALA A 82 67.520 -1.047 6.065 1.00 7.65 C ATOM 1161 O ALA A 82 66.459 -1.668 6.152 1.00 8.62 O ATOM 1162 CB ALA A 82 68.296 -1.101 3.653 1.00 8.11 C ATOM 1163 HA ALA A 82 69.551 -0.983 5.460 1.00 0.00 H ATOM 1164 HB1 ALA A 82 69.141 -1.336 3.005 1.00 0.00 H ATOM 1165 HB2 ALA A 82 67.420 -1.661 3.327 1.00 0.00 H ATOM 1166 HB3 ALA A 82 68.085 -0.033 3.604 1.00 0.00 H ATOM 1167 H ALA A 82 68.534 -3.519 4.483 1.00 0.00 H ATOM 1168 N VAL A 83 67.763 0.057 6.725 1.00 6.87 N ATOM 1169 CA VAL A 83 66.738 0.695 7.566 1.00 7.33 C ATOM 1170 C VAL A 83 66.611 2.164 7.137 1.00 6.92 C ATOM 1171 O VAL A 83 67.584 2.936 7.180 1.00 7.63 O ATOM 1172 CB VAL A 83 67.099 0.627 9.049 1.00 6.20 C ATOM 1173 CG1 VAL A 83 65.985 1.275 9.908 1.00 7.95 C ATOM 1174 CG2 VAL A 83 67.380 -0.823 9.448 1.00 7.28 C ATOM 1175 HA VAL A 83 65.795 0.164 7.433 1.00 0.00 H ATOM 1176 HB VAL A 83 68.009 1.199 9.232 1.00 0.00 H ATOM 1177 HG11 VAL A 83 65.866 2.319 9.619 1.00 0.00 H ATOM 1178 HG12 VAL A 83 65.047 0.743 9.746 1.00 0.00 H ATOM 1179 HG13 VAL A 83 66.260 1.217 10.961 1.00 0.00 H ATOM 1180 HG21 VAL A 83 66.492 -1.428 9.265 1.00 0.00 H ATOM 1181 HG22 VAL A 83 68.211 -1.207 8.856 1.00 0.00 H ATOM 1182 HG23 VAL A 83 67.637 -0.864 10.507 1.00 0.00 H ATOM 1183 H VAL A 83 68.704 0.494 6.653 1.00 0.00 H ATOM 1184 N TYR A 84 65.436 2.564 6.654 1.00 6.69 N ATOM 1185 CA TYR A 84 65.234 3.929 6.175 1.00 7.76 C ATOM 1186 C TYR A 84 65.180 4.973 7.266 1.00 7.27 C ATOM 1187 O TYR A 84 64.876 4.661 8.427 1.00 7.46 O ATOM 1188 CB TYR A 84 63.950 4.008 5.337 1.00 6.93 C ATOM 1189 CG TYR A 84 63.936 3.098 4.122 1.00 6.11 C ATOM 1190 CD1 TYR A 84 62.967 2.087 3.995 1.00 8.12 C ATOM 1191 CD2 TYR A 84 64.912 3.184 3.132 1.00 8.90 C ATOM 1192 CE1 TYR A 84 62.971 1.215 2.904 1.00 8.61 C ATOM 1193 CE2 TYR A 84 64.918 2.328 2.038 1.00 8.36 C ATOM 1194 CZ TYR A 84 63.947 1.373 1.899 1.00 7.23 C ATOM 1195 OH TYR A 84 63.918 0.545 0.811 1.00 9.51 O ATOM 1196 HA TYR A 84 66.112 4.159 5.572 1.00 0.00 H ATOM 1197 HB3 TYR A 84 63.829 5.036 4.995 1.00 0.00 H ATOM 1198 HB2 TYR A 84 63.109 3.737 5.975 1.00 0.00 H ATOM 1199 HD2 TYR A 84 65.691 3.942 3.218 1.00 0.00 H ATOM 1200 HE2 TYR A 84 65.701 2.417 1.285 1.00 0.00 H ATOM 1201 HE1 TYR A 84 62.228 0.421 2.830 1.00 0.00 H ATOM 1202 HD1 TYR A 84 62.199 1.982 4.762 1.00 0.00 H ATOM 1203 HH TYR A 84 63.149 -0.073 0.889 1.00 0.00 H ATOM 1204 H TYR A 84 64.645 1.890 6.617 1.00 0.00 H ATOM 1205 N THR A 85 65.510 6.217 6.908 1.00 6.31 N ATOM 1206 CA THR A 85 65.391 7.343 7.821 1.00 7.64 C ATOM 1207 C THR A 85 63.924 7.629 8.118 1.00 7.94 C ATOM 1208 O THR A 85 63.017 7.383 7.280 1.00 8.14 O ATOM 1209 CB THR A 85 66.025 8.619 7.246 1.00 8.18 C ATOM 1210 OG1 THR A 85 65.312 8.985 6.060 1.00 8.66 O ATOM 1211 CG2 THR A 85 67.518 8.458 6.956 1.00 9.17 C ATOM 1212 HA THR A 85 65.920 7.067 8.733 1.00 0.00 H ATOM 1213 HB THR A 85 65.949 9.409 7.994 1.00 0.00 H ATOM 1214 HG1 THR A 85 65.710 9.807 5.678 1.00 0.00 H ATOM 1215 HG23 THR A 85 68.037 8.180 7.873 1.00 0.00 H ATOM 1216 HG21 THR A 85 67.659 7.679 6.207 1.00 0.00 H ATOM 1217 HG22 THR A 85 67.918 9.401 6.582 1.00 0.00 H ATOM 1218 H THR A 85 65.864 6.386 5.945 1.00 0.00 H ATOM 1219 N GLU A 86 63.677 8.158 9.313 1.00 6.23 N ATOM 1220 CA GLU A 86 62.354 8.644 9.624 1.00 7.17 C ATOM 1221 C GLU A 86 61.941 9.739 8.654 1.00 7.86 C ATOM 1222 O GLU A 86 60.792 9.758 8.219 1.00 9.36 O ATOM 1223 CB GLU A 86 62.332 9.226 11.044 1.00 8.31 C ATOM 1224 CG GLU A 86 61.043 9.897 11.452 1.00 7.49 C ATOM 1225 CD GLU A 86 59.862 8.926 11.560 1.00 9.87 C ATOM 1226 OE1 GLU A 86 60.031 7.700 11.730 1.00 8.95 O ATOM 1227 OE2 GLU A 86 58.705 9.388 11.403 1.00 10.32 O ATOM 1228 HA GLU A 86 61.661 7.806 9.545 1.00 0.00 H ATOM 1229 HB2 GLU A 86 62.523 8.412 11.744 1.00 0.00 H ATOM 1230 HB3 GLU A 86 63.132 9.963 11.118 1.00 0.00 H ATOM 1231 HG2 GLU A 86 61.191 10.371 12.422 1.00 0.00 H ATOM 1232 HG3 GLU A 86 60.799 10.658 10.711 1.00 0.00 H ATOM 1233 H GLU A 86 64.435 8.221 10.022 1.00 0.00 H ATOM 1234 N ASP A 87 62.832 10.671 8.322 1.00 8.67 N ATOM 1235 CA ASP A 87 62.430 11.815 7.518 1.00 10.49 C ATOM 1236 C ASP A 87 61.947 11.370 6.159 1.00 9.82 C ATOM 1237 O ASP A 87 61.032 11.963 5.601 1.00 11.63 O ATOM 1238 CB ASP A 87 63.607 12.767 7.374 1.00 11.83 C ATOM 1239 CG ASP A 87 63.231 14.112 6.739 1.00 20.21 C ATOM 1240 OD1 ASP A 87 62.526 14.924 7.394 1.00 29.63 O ATOM 1241 OD2 ASP A 87 63.708 14.386 5.628 1.00 29.70 O ATOM 1242 HA ASP A 87 61.607 12.328 8.016 1.00 0.00 H ATOM 1243 HB2 ASP A 87 64.021 12.956 8.364 1.00 0.00 H ATOM 1244 HB3 ASP A 87 64.363 12.290 6.750 1.00 0.00 H ATOM 1245 H ASP A 87 63.819 10.581 8.638 1.00 0.00 H ATOM 1246 N SER A 88 62.561 10.326 5.621 1.00 9.42 N ATOM 1247 CA SER A 88 62.195 9.850 4.277 1.00 8.63 C ATOM 1248 C SER A 88 61.071 8.825 4.275 1.00 8.26 C ATOM 1249 O SER A 88 60.531 8.473 3.208 1.00 9.12 O ATOM 1250 CB SER A 88 63.402 9.267 3.550 1.00 8.38 C ATOM 1251 OG SER A 88 63.749 7.977 3.998 1.00 8.17 O ATOM 1252 HA SER A 88 61.832 10.734 3.752 1.00 0.00 H ATOM 1253 HB2 SER A 88 64.254 9.929 3.706 1.00 0.00 H ATOM 1254 HB3 SER A 88 63.174 9.215 2.485 1.00 0.00 H ATOM 1255 HG SER A 88 63.968 8.012 4.963 1.00 0.00 H ATOM 1256 H SER A 88 63.309 9.838 6.154 1.00 0.00 H ATOM 1257 N TYR A 89 60.739 8.250 5.429 1.00 8.89 N ATOM 1258 CA TYR A 89 59.665 7.259 5.498 1.00 8.16 C ATOM 1259 C TYR A 89 58.947 7.511 6.858 1.00 7.84 C ATOM 1260 O TYR A 89 59.097 6.721 7.807 1.00 8.11 O ATOM 1261 CB TYR A 89 60.211 5.815 5.392 1.00 8.50 C ATOM 1262 CG TYR A 89 59.187 4.769 5.002 1.00 7.80 C ATOM 1263 CD1 TYR A 89 59.563 3.568 4.411 1.00 8.10 C ATOM 1264 CD2 TYR A 89 57.820 4.998 5.163 1.00 8.69 C ATOM 1265 CE1 TYR A 89 58.644 2.628 4.014 1.00 10.37 C ATOM 1266 CE2 TYR A 89 56.884 4.042 4.763 1.00 8.67 C ATOM 1267 CZ TYR A 89 57.285 2.888 4.169 1.00 8.67 C ATOM 1268 OH TYR A 89 56.358 1.919 3.717 1.00 10.92 O ATOM 1269 HA TYR A 89 58.973 7.363 4.662 1.00 0.00 H ATOM 1270 HB3 TYR A 89 60.625 5.538 6.362 1.00 0.00 H ATOM 1271 HB2 TYR A 89 61.004 5.807 4.644 1.00 0.00 H ATOM 1272 HD2 TYR A 89 57.479 5.934 5.606 1.00 0.00 H ATOM 1273 HE2 TYR A 89 55.822 4.223 4.929 1.00 0.00 H ATOM 1274 HE1 TYR A 89 58.976 1.685 3.580 1.00 0.00 H ATOM 1275 HD1 TYR A 89 60.623 3.366 4.258 1.00 0.00 H ATOM 1276 HH TYR A 89 55.763 2.325 3.037 1.00 0.00 H ATOM 1277 H TYR A 89 61.252 8.510 6.296 1.00 0.00 H ATOM 1278 N PRO A 90 58.222 8.627 6.957 1.00 9.11 N ATOM 1279 CA PRO A 90 57.744 9.085 8.252 1.00 8.66 C ATOM 1280 C PRO A 90 56.594 8.257 8.809 1.00 9.15 C ATOM 1281 O PRO A 90 55.815 7.635 8.081 1.00 9.11 O ATOM 1282 CB PRO A 90 57.302 10.527 7.982 1.00 9.18 C ATOM 1283 CG PRO A 90 57.062 10.549 6.519 1.00 11.31 C ATOM 1284 CD PRO A 90 58.016 9.641 5.913 1.00 9.76 C ATOM 1285 HA PRO A 90 58.520 8.996 9.012 1.00 0.00 H ATOM 1286 HD3 PRO A 90 57.609 9.193 5.007 1.00 0.00 H ATOM 1287 HD2 PRO A 90 58.948 10.154 5.676 1.00 0.00 H ATOM 1288 HG3 PRO A 90 57.208 11.557 6.132 1.00 0.00 H ATOM 1289 HG2 PRO A 90 56.045 10.222 6.302 1.00 0.00 H ATOM 1290 HB2 PRO A 90 56.390 10.764 8.530 1.00 0.00 H ATOM 1291 HB3 PRO A 90 58.085 11.233 8.259 1.00 0.00 H ATOM 1292 N TYR A 91 56.445 8.298 10.126 1.00 9.13 N ATOM 1293 CA TYR A 91 55.428 7.507 10.777 1.00 8.78 C ATOM 1294 C TYR A 91 54.058 8.039 10.432 1.00 9.81 C ATOM 1295 O TYR A 91 53.820 9.241 10.495 1.00 11.70 O ATOM 1296 CB TYR A 91 55.645 7.548 12.269 1.00 8.82 C ATOM 1297 CG TYR A 91 54.794 6.572 13.044 1.00 8.63 C ATOM 1298 CD1 TYR A 91 54.902 5.215 12.852 1.00 8.88 C ATOM 1299 CD2 TYR A 91 53.880 7.025 13.996 1.00 7.47 C ATOM 1300 CE1 TYR A 91 54.134 4.285 13.548 1.00 6.34 C ATOM 1301 CE2 TYR A 91 53.128 6.079 14.740 1.00 6.52 C ATOM 1302 CZ TYR A 91 53.236 4.745 14.505 1.00 6.74 C ATOM 1303 OH TYR A 91 52.499 3.871 15.277 1.00 6.96 O ATOM 1304 HA TYR A 91 55.494 6.475 10.432 1.00 0.00 H ATOM 1305 HB3 TYR A 91 55.418 8.554 12.620 1.00 0.00 H ATOM 1306 HB2 TYR A 91 56.693 7.323 12.469 1.00 0.00 H ATOM 1307 HD2 TYR A 91 53.745 8.093 14.166 1.00 0.00 H ATOM 1308 HE2 TYR A 91 52.449 6.430 15.517 1.00 0.00 H ATOM 1309 HE1 TYR A 91 54.235 3.218 13.347 1.00 0.00 H ATOM 1310 HD1 TYR A 91 55.623 4.850 12.120 1.00 0.00 H ATOM 1311 HH TYR A 91 52.752 3.979 16.228 1.00 0.00 H ATOM 1312 H TYR A 91 57.067 8.906 10.696 1.00 0.00 H ATOM 1313 N ALA A 92 53.168 7.130 10.052 1.00 9.53 N ATOM 1314 CA ALA A 92 51.875 7.461 9.551 1.00 10.17 C ATOM 1315 C ALA A 92 50.766 6.622 10.135 1.00 10.85 C ATOM 1316 O ALA A 92 49.605 6.735 9.682 1.00 12.26 O ATOM 1317 CB ALA A 92 51.885 7.315 8.003 1.00 11.98 C ATOM 1318 HA ALA A 92 51.668 8.488 9.850 1.00 0.00 H ATOM 1319 HB1 ALA A 92 52.629 7.990 7.580 1.00 0.00 H ATOM 1320 HB2 ALA A 92 52.133 6.287 7.738 1.00 0.00 H ATOM 1321 HB3 ALA A 92 50.900 7.566 7.609 1.00 0.00 H ATOM 1322 H ALA A 92 53.427 6.125 10.123 1.00 0.00 H ATOM 1323 N SER A 93 51.059 5.838 11.163 1.00 8.63 N ATOM 1324 CA SER A 93 50.076 4.902 11.709 1.00 10.21 C ATOM 1325 C SER A 93 49.485 5.303 13.070 1.00 9.59 C ATOM 1326 O SER A 93 48.860 4.465 13.753 1.00 9.26 O ATOM 1327 CB SER A 93 50.722 3.560 11.887 1.00 9.16 C ATOM 1328 OG SER A 93 51.269 3.041 10.685 1.00 11.83 O ATOM 1329 HA SER A 93 49.257 4.895 10.990 1.00 0.00 H ATOM 1330 HB2 SER A 93 49.973 2.861 12.258 1.00 0.00 H ATOM 1331 HB3 SER A 93 51.523 3.655 12.620 1.00 0.00 H ATOM 1332 HG SER A 93 51.959 3.663 10.342 1.00 0.00 H ATOM 1333 H SER A 93 52.006 5.889 11.590 1.00 0.00 H ATOM 1334 N GLY A 94 49.651 6.534 13.487 1.00 10.20 N ATOM 1335 CA GLY A 94 49.220 6.937 14.817 1.00 10.02 C ATOM 1336 C GLY A 94 47.711 6.943 15.027 1.00 10.11 C ATOM 1337 O GLY A 94 47.262 7.046 16.163 1.00 11.31 O ATOM 1338 HA3 GLY A 94 49.592 7.944 15.003 1.00 0.00 H ATOM 1339 HA2 GLY A 94 49.660 6.249 15.539 1.00 0.00 H ATOM 1340 H GLY A 94 50.097 7.233 12.859 1.00 0.00 H ATOM 1341 N GLU A 95 46.931 6.832 13.967 1.00 11.03 N ATOM 1342 CA GLU A 95 45.464 6.624 14.108 1.00 12.90 C ATOM 1343 C GLU A 95 45.034 5.196 13.835 1.00 13.00 C ATOM 1344 O GLU A 95 43.831 4.914 13.691 1.00 14.88 O ATOM 1345 CB GLU A 95 44.668 7.616 13.253 1.00 13.82 C ATOM 1346 CG GLU A 95 44.770 9.020 13.716 1.00 17.15 C ATOM 1347 CD GLU A 95 43.815 9.947 12.970 1.00 21.97 C ATOM 1348 OE1 GLU A 95 43.397 9.636 11.825 1.00 26.99 O ATOM 1349 OE2 GLU A 95 43.499 10.982 13.549 1.00 31.92 O ATOM 1350 HA GLU A 95 45.234 6.819 15.156 1.00 0.00 H ATOM 1351 HB2 GLU A 95 45.039 7.563 12.230 1.00 0.00 H ATOM 1352 HB3 GLU A 95 43.618 7.323 13.273 1.00 0.00 H ATOM 1353 HG2 GLU A 95 44.535 9.057 14.780 1.00 0.00 H ATOM 1354 HG3 GLU A 95 45.791 9.368 13.559 1.00 0.00 H ATOM 1355 H GLU A 95 47.349 6.891 13.017 1.00 0.00 H ATOM 1356 N GLY A 96 45.976 4.266 13.802 1.00 11.19 N ATOM 1357 CA GLY A 96 45.670 2.852 13.721 1.00 12.56 C ATOM 1358 C GLY A 96 45.694 2.235 12.342 1.00 12.38 C ATOM 1359 O GLY A 96 45.504 1.039 12.182 1.00 14.80 O ATOM 1360 HA3 GLY A 96 44.671 2.705 14.133 1.00 0.00 H ATOM 1361 HA2 GLY A 96 46.397 2.320 14.335 1.00 0.00 H ATOM 1362 H GLY A 96 46.973 4.561 13.835 1.00 0.00 H ATOM 1363 N ILE A 97 45.954 3.051 11.343 1.00 12.72 N ATOM 1364 CA ILE A 97 45.940 2.586 9.979 1.00 14.32 C ATOM 1365 C ILE A 97 47.305 2.791 9.380 1.00 13.08 C ATOM 1366 O ILE A 97 47.798 3.917 9.272 1.00 14.34 O ATOM 1367 CB ILE A 97 44.832 3.264 9.126 1.00 14.79 C ATOM 1368 CG1 ILE A 97 43.427 3.013 9.770 1.00 17.65 C ATOM 1369 CG2 ILE A 97 44.858 2.673 7.686 1.00 16.74 C ATOM 1370 CD1 ILE A 97 42.290 3.539 9.030 1.00 18.64 C ATOM 1371 HA ILE A 97 45.698 1.523 9.980 1.00 0.00 H ATOM 1372 HB ILE A 97 45.016 4.338 9.087 1.00 0.00 H ATOM 1373 HG12 ILE A 97 43.292 1.936 9.871 1.00 0.00 H ATOM 1374 HG13 ILE A 97 43.425 3.472 10.759 1.00 0.00 H ATOM 1375 HD11 ILE A 97 42.392 4.620 8.930 1.00 0.00 H ATOM 1376 HD12 ILE A 97 42.259 3.082 8.041 1.00 0.00 H ATOM 1377 HD13 ILE A 97 41.370 3.308 9.567 1.00 0.00 H ATOM 1378 HG21 ILE A 97 45.833 2.860 7.235 1.00 0.00 H ATOM 1379 HG22 ILE A 97 44.678 1.599 7.732 1.00 0.00 H ATOM 1380 HG23 ILE A 97 44.081 3.147 7.086 1.00 0.00 H ATOM 1381 H ILE A 97 46.173 4.048 11.541 1.00 0.00 H ATOM 1382 N SER A 98 47.870 1.682 8.941 1.00 12.43 N ATOM 1383 CA SER A 98 49.222 1.663 8.346 1.00 13.25 C ATOM 1384 C SER A 98 49.083 1.724 6.825 1.00 14.23 C ATOM 1385 O SER A 98 48.419 0.870 6.235 1.00 16.09 O ATOM 1386 CB SER A 98 49.902 0.359 8.717 1.00 13.19 C ATOM 1387 OG SER A 98 51.162 0.285 8.054 1.00 15.27 O ATOM 1388 HA SER A 98 49.806 2.508 8.710 1.00 0.00 H ATOM 1389 HB2 SER A 98 49.277 -0.479 8.409 1.00 0.00 H ATOM 1390 HB3 SER A 98 50.054 0.320 9.796 1.00 0.00 H ATOM 1391 HG SER A 98 51.021 0.321 7.075 1.00 0.00 H ATOM 1392 H SER A 98 47.344 0.788 9.017 1.00 0.00 H ATOM 1393 N PRO A 99 49.696 2.728 6.185 1.00 12.99 N ATOM 1394 CA PRO A 99 49.604 2.753 4.734 1.00 13.70 C ATOM 1395 C PRO A 99 50.340 1.577 4.074 1.00 13.40 C ATOM 1396 O PRO A 99 51.189 0.918 4.694 1.00 13.53 O ATOM 1397 CB PRO A 99 50.266 4.073 4.386 1.00 13.05 C ATOM 1398 CG PRO A 99 50.115 4.929 5.610 1.00 16.99 C ATOM 1399 CD PRO A 99 50.369 3.912 6.710 1.00 14.31 C ATOM 1400 HA PRO A 99 48.578 2.661 4.379 1.00 0.00 H ATOM 1401 HD3 PRO A 99 51.436 3.734 6.848 1.00 0.00 H ATOM 1402 HD2 PRO A 99 49.930 4.232 7.655 1.00 0.00 H ATOM 1403 HG3 PRO A 99 49.114 5.354 5.681 1.00 0.00 H ATOM 1404 HG2 PRO A 99 50.851 5.733 5.630 1.00 0.00 H ATOM 1405 HB2 PRO A 99 51.320 3.922 4.153 1.00 0.00 H ATOM 1406 HB3 PRO A 99 49.770 4.536 3.533 1.00 0.00 H ATOM 1407 N PRO A 100 50.000 1.262 2.829 1.00 13.79 N ATOM 1408 CA PRO A 100 50.667 0.188 2.110 1.00 14.07 C ATOM 1409 C PRO A 100 52.180 0.403 2.047 1.00 12.66 C ATOM 1410 O PRO A 100 52.615 1.541 1.909 1.00 14.36 O ATOM 1411 CB PRO A 100 50.092 0.289 0.702 1.00 15.38 C ATOM 1412 CG PRO A 100 48.717 0.876 0.939 1.00 17.27 C ATOM 1413 CD PRO A 100 48.905 1.863 2.036 1.00 15.78 C ATOM 1414 HA PRO A 100 50.510 -0.778 2.591 1.00 0.00 H ATOM 1415 HD3 PRO A 100 49.193 2.838 1.643 1.00 0.00 H ATOM 1416 HD2 PRO A 100 47.998 1.966 2.632 1.00 0.00 H ATOM 1417 HG3 PRO A 100 48.014 0.098 1.239 1.00 0.00 H ATOM 1418 HG2 PRO A 100 48.350 1.368 0.039 1.00 0.00 H ATOM 1419 HB2 PRO A 100 50.697 0.946 0.077 1.00 0.00 H ATOM 1420 HB3 PRO A 100 50.024 -0.693 0.234 1.00 0.00 H ATOM 1421 N CYS A 101 52.896 -0.719 2.042 1.00 10.61 N ATOM 1422 CA CYS A 101 54.391 -0.739 1.904 1.00 10.55 C ATOM 1423 C CYS A 101 54.805 -0.001 0.606 1.00 11.08 C ATOM 1424 O CYS A 101 54.195 -0.226 -0.448 1.00 12.92 O ATOM 1425 CB CYS A 101 54.894 -2.159 1.955 1.00 11.48 C ATOM 1426 SG CYS A 101 56.664 -2.231 1.751 1.00 12.72 S ATOM 1427 HA CYS A 101 54.853 -0.209 2.737 1.00 0.00 H ATOM 1428 HB2 CYS A 101 54.421 -2.732 1.157 1.00 0.00 H ATOM 1429 HB3 CYS A 101 54.630 -2.595 2.919 1.00 0.00 H ATOM 1430 H CYS A 101 52.396 -1.626 2.138 1.00 0.00 H ATOM 1431 N THR A 102 55.820 0.855 0.708 1.00 11.73 N ATOM 1432 CA THR A 102 56.460 1.529 -0.462 1.00 12.03 C ATOM 1433 C THR A 102 57.970 1.380 -0.331 1.00 13.65 C ATOM 1434 O THR A 102 58.495 1.280 0.799 1.00 12.83 O ATOM 1435 CB THR A 102 56.070 3.013 -0.558 1.00 12.55 C ATOM 1436 OG1 THR A 102 56.355 3.673 0.686 1.00 13.53 O ATOM 1437 CG2 THR A 102 54.542 3.182 -0.882 1.00 14.26 C ATOM 1438 HA THR A 102 56.108 1.056 -1.379 1.00 0.00 H ATOM 1439 HB THR A 102 56.652 3.458 -1.365 1.00 0.00 H ATOM 1440 HG1 THR A 102 57.323 3.600 0.883 1.00 0.00 H ATOM 1441 HG23 THR A 102 54.315 2.684 -1.825 1.00 0.00 H ATOM 1442 HG21 THR A 102 53.951 2.736 -0.082 1.00 0.00 H ATOM 1443 HG22 THR A 102 54.304 4.243 -0.963 1.00 0.00 H ATOM 1444 H THR A 102 56.189 1.067 1.657 1.00 0.00 H ATOM 1445 N THR A 103 58.655 1.308 -1.482 1.00 15.15 N ATOM 1446 CA THR A 103 60.139 1.128 -1.548 1.00 14.41 C ATOM 1447 C THR A 103 60.830 2.364 -2.127 1.00 14.20 C ATOM 1448 O THR A 103 61.720 3.016 -1.484 1.00 14.02 O ATOM 1449 CB THR A 103 60.583 -0.132 -2.321 1.00 14.98 C ATOM 1450 OG1 THR A 103 60.017 -1.306 -1.729 1.00 16.62 O ATOM 1451 CG2 THR A 103 62.112 -0.281 -2.379 1.00 16.79 C ATOM 1452 HA THR A 103 60.452 0.989 -0.513 1.00 0.00 H ATOM 1453 HB THR A 103 60.220 -0.015 -3.342 1.00 0.00 H ATOM 1454 HG1 THR A 103 60.321 -1.380 -0.790 1.00 0.00 H ATOM 1455 HG23 THR A 103 62.546 0.612 -2.829 1.00 0.00 H ATOM 1456 HG21 THR A 103 62.502 -0.406 -1.369 1.00 0.00 H ATOM 1457 HG22 THR A 103 62.368 -1.154 -2.980 1.00 0.00 H ATOM 1458 H THR A 103 58.127 1.381 -2.375 1.00 0.00 H ATOM 1459 N SER A 104 60.346 2.799 -3.289 1.00 12.48 N ATOM 1460 CA SER A 104 60.965 3.930 -3.918 1.00 12.95 C ATOM 1461 C SER A 104 60.673 5.170 -3.113 1.00 10.98 C ATOM 1462 O SER A 104 59.600 5.251 -2.424 1.00 13.29 O ATOM 1463 CB SER A 104 60.507 4.068 -5.355 1.00 13.04 C ATOM 1464 OG SER A 104 59.166 4.523 -5.404 1.00 19.02 O ATOM 1465 HA SER A 104 62.045 3.784 -3.946 1.00 0.00 H ATOM 1466 HB2 SER A 104 60.576 3.099 -5.849 1.00 0.00 H ATOM 1467 HB3 SER A 104 61.148 4.783 -5.870 1.00 0.00 H ATOM 1468 HG SER A 104 58.581 3.873 -4.939 1.00 0.00 H ATOM 1469 H SER A 104 59.533 2.327 -3.733 1.00 0.00 H ATOM 1470 N GLY A 105 61.601 6.109 -3.141 1.00 10.47 N ATOM 1471 CA GLY A 105 61.467 7.366 -2.464 1.00 10.58 C ATOM 1472 C GLY A 105 62.082 7.487 -1.090 1.00 10.75 C ATOM 1473 O GLY A 105 62.228 8.586 -0.554 1.00 15.29 O ATOM 1474 HA3 GLY A 105 60.401 7.571 -2.364 1.00 0.00 H ATOM 1475 HA2 GLY A 105 61.925 8.128 -3.095 1.00 0.00 H ATOM 1476 H GLY A 105 62.472 5.928 -3.680 1.00 0.00 H ATOM 1477 N HIS A 106 62.490 6.385 -0.537 1.00 9.79 N ATOM 1478 CA HIS A 106 63.054 6.342 0.814 1.00 7.98 C ATOM 1479 C HIS A 106 64.566 6.283 0.787 1.00 8.45 C ATOM 1480 O HIS A 106 65.161 5.728 -0.156 1.00 8.75 O ATOM 1481 CB HIS A 106 62.464 5.140 1.581 1.00 9.01 C ATOM 1482 CG HIS A 106 60.972 5.095 1.530 1.00 7.96 C ATOM 1483 ND1 HIS A 106 60.162 6.117 1.985 1.00 8.96 N ATOM 1484 CD2 HIS A 106 60.148 4.104 1.115 1.00 11.02 C ATOM 1485 CE1 HIS A 106 58.896 5.754 1.806 1.00 8.87 C ATOM 1486 NE2 HIS A 106 58.865 4.547 1.277 1.00 8.85 N ATOM 1487 HA HIS A 106 62.784 7.262 1.331 1.00 0.00 H ATOM 1488 HB2 HIS A 106 62.855 4.222 1.143 1.00 0.00 H ATOM 1489 HB3 HIS A 106 62.775 5.205 2.624 1.00 0.00 H ATOM 1490 HD2 HIS A 106 60.451 3.133 0.724 1.00 0.00 H ATOM 1491 HE1 HIS A 106 58.024 6.357 2.056 1.00 0.00 H ATOM 1492 H HIS A 106 62.413 5.498 -1.075 1.00 0.00 H ATOM 1493 N THR A 107 65.170 6.818 1.833 1.00 7.31 N ATOM 1494 CA THR A 107 66.602 6.983 1.946 1.00 7.73 C ATOM 1495 C THR A 107 67.108 6.093 3.071 1.00 7.51 C ATOM 1496 O THR A 107 66.541 6.119 4.150 1.00 8.14 O ATOM 1497 CB THR A 107 66.955 8.460 2.237 1.00 8.60 C ATOM 1498 OG1 THR A 107 66.477 9.283 1.163 1.00 9.64 O ATOM 1499 CG2 THR A 107 68.504 8.634 2.393 1.00 8.92 C ATOM 1500 HA THR A 107 67.077 6.700 1.007 1.00 0.00 H ATOM 1501 HB THR A 107 66.479 8.762 3.170 1.00 0.00 H ATOM 1502 HG1 THR A 107 66.702 10.229 1.348 1.00 0.00 H ATOM 1503 HG23 THR A 107 68.858 8.006 3.210 1.00 0.00 H ATOM 1504 HG21 THR A 107 68.997 8.339 1.466 1.00 0.00 H ATOM 1505 HG22 THR A 107 68.731 9.678 2.610 1.00 0.00 H ATOM 1506 H THR A 107 64.578 7.141 2.625 1.00 0.00 H ATOM 1507 N VAL A 108 68.097 5.248 2.816 1.00 7.36 N ATOM 1508 CA VAL A 108 68.661 4.378 3.825 1.00 7.50 C ATOM 1509 C VAL A 108 69.449 5.205 4.855 1.00 8.81 C ATOM 1510 O VAL A 108 70.347 5.965 4.503 1.00 9.29 O ATOM 1511 CB VAL A 108 69.583 3.323 3.208 1.00 7.02 C ATOM 1512 CG1 VAL A 108 70.068 2.352 4.292 1.00 7.96 C ATOM 1513 CG2 VAL A 108 68.869 2.609 2.044 1.00 9.53 C ATOM 1514 HA VAL A 108 67.834 3.865 4.316 1.00 0.00 H ATOM 1515 HB VAL A 108 70.467 3.804 2.790 1.00 0.00 H ATOM 1516 HG11 VAL A 108 70.615 2.905 5.055 1.00 0.00 H ATOM 1517 HG12 VAL A 108 69.209 1.857 4.746 1.00 0.00 H ATOM 1518 HG13 VAL A 108 70.723 1.606 3.843 1.00 0.00 H ATOM 1519 HG21 VAL A 108 67.967 2.123 2.416 1.00 0.00 H ATOM 1520 HG22 VAL A 108 68.601 3.340 1.281 1.00 0.00 H ATOM 1521 HG23 VAL A 108 69.536 1.861 1.614 1.00 0.00 H ATOM 1522 H VAL A 108 68.483 5.209 1.851 1.00 0.00 H ATOM 1523 N GLY A 109 69.048 5.084 6.127 1.00 7.81 N ATOM 1524 CA GLY A 109 69.738 5.746 7.224 1.00 8.10 C ATOM 1525 C GLY A 109 70.777 4.894 7.948 1.00 8.60 C ATOM 1526 O GLY A 109 71.735 5.446 8.532 1.00 11.05 O ATOM 1527 HA3 GLY A 109 68.990 6.058 7.953 1.00 0.00 H ATOM 1528 HA2 GLY A 109 70.243 6.625 6.823 1.00 0.00 H ATOM 1529 H GLY A 109 68.216 4.497 6.338 1.00 0.00 H ATOM 1530 N ALA A 110 70.584 3.586 7.970 1.00 8.85 N ATOM 1531 CA ALA A 110 71.474 2.666 8.722 1.00 8.14 C ATOM 1532 C ALA A 110 71.453 1.316 8.076 1.00 8.53 C ATOM 1533 O ALA A 110 70.466 1.006 7.404 1.00 7.46 O ATOM 1534 CB ALA A 110 71.032 2.556 10.192 1.00 8.77 C ATOM 1535 HA ALA A 110 72.488 3.064 8.703 1.00 0.00 H ATOM 1536 HB1 ALA A 110 71.071 3.541 10.657 1.00 0.00 H ATOM 1537 HB2 ALA A 110 70.013 2.173 10.236 1.00 0.00 H ATOM 1538 HB3 ALA A 110 71.700 1.876 10.721 1.00 0.00 H ATOM 1539 H ALA A 110 69.781 3.188 7.442 1.00 0.00 H ATOM 1540 N THR A 111 72.467 0.490 8.299 1.00 9.13 N ATOM 1541 CA THR A 111 72.528 -0.851 7.796 1.00 10.70 C ATOM 1542 C THR A 111 72.903 -1.772 8.930 1.00 9.66 C ATOM 1543 O THR A 111 73.787 -1.408 9.724 1.00 9.90 O ATOM 1544 CB THR A 111 73.589 -0.936 6.666 1.00 13.13 C ATOM 1545 OG1 THR A 111 73.300 0.089 5.712 1.00 15.56 O ATOM 1546 CG2 THR A 111 73.586 -2.245 5.980 1.00 16.01 C ATOM 1547 HA THR A 111 71.561 -1.145 7.388 1.00 0.00 H ATOM 1548 HB THR A 111 74.575 -0.809 7.114 1.00 0.00 H ATOM 1549 HG1 THR A 111 73.966 0.054 4.980 1.00 0.00 H ATOM 1550 HG23 THR A 111 73.806 -3.032 6.701 1.00 0.00 H ATOM 1551 HG21 THR A 111 72.605 -2.419 5.537 1.00 0.00 H ATOM 1552 HG22 THR A 111 74.345 -2.245 5.197 1.00 0.00 H ATOM 1553 H THR A 111 73.263 0.835 8.872 1.00 0.00 H ATOM 1554 N ILE A 112 72.242 -2.924 9.028 1.00 8.39 N ATOM 1555 CA ILE A 112 72.573 -3.951 10.006 1.00 8.30 C ATOM 1556 C ILE A 112 72.925 -5.238 9.287 1.00 8.91 C ATOM 1557 O ILE A 112 72.471 -5.451 8.160 1.00 10.67 O ATOM 1558 CB ILE A 112 71.457 -4.163 11.074 1.00 8.59 C ATOM 1559 CG1 ILE A 112 70.199 -4.778 10.486 1.00 9.75 C ATOM 1560 CG2 ILE A 112 71.194 -2.790 11.795 1.00 7.81 C ATOM 1561 CD1 ILE A 112 69.158 -5.225 11.563 1.00 9.56 C ATOM 1562 HA ILE A 112 73.441 -3.609 10.569 1.00 0.00 H ATOM 1563 HB ILE A 112 71.794 -4.890 11.813 1.00 0.00 H ATOM 1564 HG12 ILE A 112 69.727 -4.042 9.835 1.00 0.00 H ATOM 1565 HG13 ILE A 112 70.484 -5.651 9.899 1.00 0.00 H ATOM 1566 HD11 ILE A 112 69.611 -5.971 12.216 1.00 0.00 H ATOM 1567 HD12 ILE A 112 68.853 -4.360 12.153 1.00 0.00 H ATOM 1568 HD13 ILE A 112 68.287 -5.654 11.068 1.00 0.00 H ATOM 1569 HG21 ILE A 112 72.112 -2.452 12.276 1.00 0.00 H ATOM 1570 HG22 ILE A 112 70.873 -2.051 11.061 1.00 0.00 H ATOM 1571 HG23 ILE A 112 70.415 -2.919 12.547 1.00 0.00 H ATOM 1572 H ILE A 112 71.452 -3.099 8.375 1.00 0.00 H ATOM 1573 N THR A 113 73.702 -6.087 9.924 1.00 8.60 N ATOM 1574 CA THR A 113 74.164 -7.332 9.319 1.00 9.23 C ATOM 1575 C THR A 113 73.514 -8.579 9.944 1.00 9.56 C ATOM 1576 O THR A 113 73.668 -9.691 9.440 1.00 10.56 O ATOM 1577 CB THR A 113 75.689 -7.472 9.447 1.00 10.25 C ATOM 1578 OG1 THR A 113 76.043 -7.347 10.832 1.00 10.63 O ATOM 1579 CG2 THR A 113 76.406 -6.414 8.593 1.00 10.20 C ATOM 1580 HA THR A 113 73.870 -7.276 8.271 1.00 0.00 H ATOM 1581 HB THR A 113 76.004 -8.449 9.079 1.00 0.00 H ATOM 1582 HG1 THR A 113 77.024 -7.435 10.930 1.00 0.00 H ATOM 1583 HG23 THR A 113 76.117 -6.535 7.549 1.00 0.00 H ATOM 1584 HG21 THR A 113 76.123 -5.419 8.937 1.00 0.00 H ATOM 1585 HG22 THR A 113 77.484 -6.540 8.690 1.00 0.00 H ATOM 1586 H THR A 113 73.998 -5.863 10.895 1.00 0.00 H ATOM 1587 N GLY A 114 72.838 -8.401 11.082 1.00 9.02 N ATOM 1588 CA GLY A 114 72.275 -9.537 11.790 1.00 8.66 C ATOM 1589 C GLY A 114 71.722 -9.071 13.117 1.00 9.13 C ATOM 1590 O GLY A 114 71.525 -7.870 13.301 1.00 8.46 O ATOM 1591 HA3 GLY A 114 73.052 -10.283 11.960 1.00 0.00 H ATOM 1592 HA2 GLY A 114 71.475 -9.977 11.195 1.00 0.00 H ATOM 1593 H GLY A 114 72.714 -7.442 11.464 1.00 0.00 H ATOM 1594 N HIS A 115 71.423 -10.024 14.000 1.00 9.77 N ATOM 1595 CA HIS A 115 71.014 -9.639 15.348 1.00 9.53 C ATOM 1596 C HIS A 115 71.421 -10.749 16.301 1.00 10.17 C ATOM 1597 O HIS A 115 71.660 -11.895 15.890 1.00 10.81 O ATOM 1598 CB HIS A 115 69.513 -9.355 15.412 1.00 10.01 C ATOM 1599 CG HIS A 115 68.668 -10.592 15.491 1.00 10.06 C ATOM 1600 ND1 HIS A 115 68.356 -11.345 14.379 1.00 11.60 N ATOM 1601 CD2 HIS A 115 68.093 -11.222 16.539 1.00 10.49 C ATOM 1602 CE1 HIS A 115 67.628 -12.382 14.742 1.00 13.56 C ATOM 1603 NE2 HIS A 115 67.428 -12.325 16.045 1.00 12.30 N ATOM 1604 HA HIS A 115 71.510 -8.713 15.638 1.00 0.00 H ATOM 1605 HB2 HIS A 115 69.315 -8.746 16.294 1.00 0.00 H ATOM 1606 HB3 HIS A 115 69.229 -8.800 14.518 1.00 0.00 H ATOM 1607 HD2 HIS A 115 68.145 -10.915 17.584 1.00 0.00 H ATOM 1608 HE1 HIS A 115 67.253 -13.159 14.076 1.00 0.00 H ATOM 1609 H HIS A 115 71.480 -11.027 13.733 1.00 0.00 H ATOM 1610 N VAL A 116 71.573 -10.396 17.565 1.00 9.86 N ATOM 1611 CA VAL A 116 71.879 -11.368 18.592 1.00 10.02 C ATOM 1612 C VAL A 116 70.744 -11.481 19.577 1.00 9.78 C ATOM 1613 O VAL A 116 70.128 -10.481 19.928 1.00 10.25 O ATOM 1614 CB VAL A 116 73.223 -10.988 19.337 1.00 10.81 C ATOM 1615 CG1 VAL A 116 74.403 -11.249 18.375 1.00 15.21 C ATOM 1616 CG2 VAL A 116 73.205 -9.624 19.901 1.00 11.90 C ATOM 1617 HA VAL A 116 72.013 -12.337 18.112 1.00 0.00 H ATOM 1618 HB VAL A 116 73.343 -11.623 20.215 1.00 0.00 H ATOM 1619 HG11 VAL A 116 74.416 -12.302 18.095 1.00 0.00 H ATOM 1620 HG12 VAL A 116 74.284 -10.636 17.482 1.00 0.00 H ATOM 1621 HG13 VAL A 116 75.339 -10.992 18.872 1.00 0.00 H ATOM 1622 HG21 VAL A 116 73.056 -8.902 19.098 1.00 0.00 H ATOM 1623 HG22 VAL A 116 72.392 -9.541 20.622 1.00 0.00 H ATOM 1624 HG23 VAL A 116 74.154 -9.425 20.398 1.00 0.00 H ATOM 1625 H VAL A 116 71.470 -9.395 17.828 1.00 0.00 H ATOM 1626 N GLU A 117 70.533 -12.686 20.068 1.00 9.15 N ATOM 1627 CA GLU A 117 69.531 -12.956 21.085 1.00 10.81 C ATOM 1628 C GLU A 117 70.312 -13.240 22.355 1.00 10.23 C ATOM 1629 O GLU A 117 71.151 -14.118 22.380 1.00 11.65 O ATOM 1630 CB GLU A 117 68.580 -14.066 20.634 1.00 11.13 C ATOM 1631 CG GLU A 117 67.774 -13.592 19.419 1.00 12.04 C ATOM 1632 CD GLU A 117 66.816 -14.580 18.772 1.00 15.93 C ATOM 1633 OE1 GLU A 117 66.518 -15.600 19.419 1.00 18.42 O ATOM 1634 OE2 GLU A 117 66.301 -14.280 17.648 1.00 15.42 O ATOM 1635 HA GLU A 117 68.859 -12.117 21.267 1.00 0.00 H ATOM 1636 HB2 GLU A 117 69.157 -14.951 20.364 1.00 0.00 H ATOM 1637 HB3 GLU A 117 67.898 -14.313 21.448 1.00 0.00 H ATOM 1638 HG2 GLU A 117 67.187 -12.729 19.735 1.00 0.00 H ATOM 1639 HG3 GLU A 117 68.488 -13.284 18.655 1.00 0.00 H ATOM 1640 H GLU A 117 71.108 -13.477 19.713 1.00 0.00 H ATOM 1641 N LEU A 118 70.093 -12.433 23.385 1.00 9.31 N ATOM 1642 CA LEU A 118 70.913 -12.447 24.581 1.00 9.16 C ATOM 1643 C LEU A 118 70.441 -13.486 25.584 1.00 9.53 C ATOM 1644 O LEU A 118 69.267 -13.895 25.553 1.00 9.44 O ATOM 1645 CB LEU A 118 70.953 -11.061 25.226 1.00 9.11 C ATOM 1646 CG LEU A 118 71.590 -9.957 24.389 1.00 9.92 C ATOM 1647 CD1 LEU A 118 71.525 -8.650 25.185 1.00 13.76 C ATOM 1648 CD2 LEU A 118 73.040 -10.321 23.961 1.00 14.48 C ATOM 1649 HA LEU A 118 71.922 -12.723 24.276 1.00 0.00 H ATOM 1650 HB2 LEU A 118 69.927 -10.765 25.446 1.00 0.00 H ATOM 1651 HB3 LEU A 118 71.514 -11.141 26.157 1.00 0.00 H ATOM 1652 HG LEU A 118 71.036 -9.834 23.458 1.00 0.00 H ATOM 1653 HD21 LEU A 118 73.652 -10.474 24.850 1.00 0.00 H ATOM 1654 HD22 LEU A 118 73.024 -11.235 23.368 1.00 0.00 H ATOM 1655 HD23 LEU A 118 73.457 -9.508 23.367 1.00 0.00 H ATOM 1656 HD11 LEU A 118 70.484 -8.406 25.396 1.00 0.00 H ATOM 1657 HD12 LEU A 118 72.068 -8.769 26.122 1.00 0.00 H ATOM 1658 HD13 LEU A 118 71.977 -7.848 24.601 1.00 0.00 H ATOM 1659 H LEU A 118 69.300 -11.762 23.333 1.00 0.00 H ATOM 1660 N PRO A 119 71.352 -13.935 26.473 1.00 10.42 N ATOM 1661 CA PRO A 119 70.933 -14.895 27.493 1.00 10.63 C ATOM 1662 C PRO A 119 69.791 -14.358 28.350 1.00 10.16 C ATOM 1663 O PRO A 119 69.672 -13.146 28.576 1.00 10.17 O ATOM 1664 CB PRO A 119 72.209 -15.097 28.315 1.00 12.10 C ATOM 1665 CG PRO A 119 73.314 -14.671 27.444 1.00 14.45 C ATOM 1666 CD PRO A 119 72.764 -13.550 26.653 1.00 12.53 C ATOM 1667 HA PRO A 119 70.541 -15.820 27.070 1.00 0.00 H ATOM 1668 HD3 PRO A 119 72.848 -12.608 27.196 1.00 0.00 H ATOM 1669 HD2 PRO A 119 73.272 -13.461 25.693 1.00 0.00 H ATOM 1670 HG3 PRO A 119 73.624 -15.486 26.790 1.00 0.00 H ATOM 1671 HG2 PRO A 119 74.166 -14.340 28.038 1.00 0.00 H ATOM 1672 HB2 PRO A 119 72.180 -14.488 29.218 1.00 0.00 H ATOM 1673 HB3 PRO A 119 72.323 -16.146 28.589 1.00 0.00 H ATOM 1674 N GLN A 120 68.974 -15.292 28.867 1.00 9.77 N ATOM 1675 CA GLN A 120 67.864 -14.927 29.771 1.00 10.11 C ATOM 1676 C GLN A 120 68.428 -14.786 31.189 1.00 9.51 C ATOM 1677 O GLN A 120 68.182 -15.588 32.067 1.00 10.52 O ATOM 1678 CB GLN A 120 66.799 -16.004 29.686 1.00 9.57 C ATOM 1679 CG GLN A 120 66.173 -16.099 28.311 1.00 11.63 C ATOM 1680 CD GLN A 120 65.130 -17.186 28.196 1.00 15.76 C ATOM 1681 OE1 GLN A 120 65.307 -18.316 28.725 1.00 22.14 O ATOM 1682 NE2 GLN A 120 64.019 -16.868 27.513 1.00 17.66 N ATOM 1683 HA GLN A 120 67.406 -13.979 29.489 1.00 0.00 H ATOM 1684 HB2 GLN A 120 67.253 -16.964 29.930 1.00 0.00 H ATOM 1685 HB3 GLN A 120 66.017 -15.779 30.411 1.00 0.00 H ATOM 1686 HG2 GLN A 120 65.703 -15.143 28.079 1.00 0.00 H ATOM 1687 HG3 GLN A 120 66.962 -16.299 27.586 1.00 0.00 H ATOM 1688 HE22 GLN A 120 63.919 -15.921 27.094 1.00 0.00 H ATOM 1689 HE21 GLN A 120 63.258 -17.568 27.403 1.00 0.00 H ATOM 1690 H GLN A 120 69.126 -16.292 28.626 1.00 0.00 H ATOM 1691 N ASP A 121 69.195 -13.721 31.388 1.00 9.27 N ATOM 1692 CA ASP A 121 70.018 -13.549 32.568 1.00 9.93 C ATOM 1693 C ASP A 121 70.290 -12.047 32.699 1.00 8.60 C ATOM 1694 O ASP A 121 70.904 -11.447 31.807 1.00 9.00 O ATOM 1695 CB ASP A 121 71.344 -14.296 32.397 1.00 9.55 C ATOM 1696 CG ASP A 121 72.208 -14.231 33.648 1.00 13.57 C ATOM 1697 OD1 ASP A 121 72.662 -13.158 34.033 1.00 13.85 O ATOM 1698 OD2 ASP A 121 72.417 -15.282 34.284 1.00 23.06 O ATOM 1699 HA ASP A 121 69.518 -13.943 33.453 1.00 0.00 H ATOM 1700 HB2 ASP A 121 71.132 -15.341 32.171 1.00 0.00 H ATOM 1701 HB3 ASP A 121 71.893 -13.851 31.568 1.00 0.00 H ATOM 1702 H ASP A 121 69.206 -12.975 30.663 1.00 0.00 H ATOM 1703 N GLU A 122 69.757 -11.400 33.750 1.00 8.87 N ATOM 1704 CA GLU A 122 69.851 -9.963 33.887 1.00 8.42 C ATOM 1705 C GLU A 122 71.295 -9.452 34.021 1.00 9.53 C ATOM 1706 O GLU A 122 71.617 -8.410 33.426 1.00 8.56 O ATOM 1707 CB GLU A 122 68.985 -9.427 35.024 1.00 7.43 C ATOM 1708 CG GLU A 122 67.500 -9.548 34.745 1.00 8.20 C ATOM 1709 CD GLU A 122 66.694 -9.021 35.905 1.00 8.16 C ATOM 1710 OE1 GLU A 122 66.459 -7.821 35.985 1.00 7.65 O ATOM 1711 OE2 GLU A 122 66.330 -9.843 36.748 1.00 8.67 O ATOM 1712 HA GLU A 122 69.461 -9.569 32.949 1.00 0.00 H ATOM 1713 HB2 GLU A 122 69.215 -9.987 35.930 1.00 0.00 H ATOM 1714 HB3 GLU A 122 69.225 -8.375 35.178 1.00 0.00 H ATOM 1715 HG2 GLU A 122 67.256 -8.975 33.850 1.00 0.00 H ATOM 1716 HG3 GLU A 122 67.251 -10.597 34.583 1.00 0.00 H ATOM 1717 H GLU A 122 69.264 -11.947 34.484 1.00 0.00 H ATOM 1718 N ALA A 123 72.155 -10.161 34.749 1.00 9.20 N ATOM 1719 CA ALA A 123 73.538 -9.733 34.884 1.00 10.47 C ATOM 1720 C ALA A 123 74.223 -9.803 33.528 1.00 9.79 C ATOM 1721 O ALA A 123 74.976 -8.900 33.180 1.00 10.03 O ATOM 1722 CB ALA A 123 74.253 -10.611 35.936 1.00 11.33 C ATOM 1723 HA ALA A 123 73.581 -8.700 35.229 1.00 0.00 H ATOM 1724 HB1 ALA A 123 73.747 -10.510 36.896 1.00 0.00 H ATOM 1725 HB2 ALA A 123 74.225 -11.653 35.617 1.00 0.00 H ATOM 1726 HB3 ALA A 123 75.289 -10.287 36.034 1.00 0.00 H ATOM 1727 H ALA A 123 71.835 -11.028 35.225 1.00 0.00 H ATOM 1728 N GLN A 124 74.011 -10.878 32.767 1.00 9.12 N ATOM 1729 CA GLN A 124 74.657 -10.973 31.454 1.00 9.32 C ATOM 1730 C GLN A 124 74.133 -9.918 30.495 1.00 8.22 C ATOM 1731 O GLN A 124 74.884 -9.333 29.698 1.00 8.71 O ATOM 1732 CB GLN A 124 74.527 -12.365 30.851 1.00 9.34 C ATOM 1733 CG GLN A 124 75.299 -13.457 31.560 1.00 12.83 C ATOM 1734 CD GLN A 124 75.172 -14.758 30.790 1.00 17.19 C ATOM 1735 OE1 GLN A 124 75.987 -15.054 29.911 1.00 28.11 O ATOM 1736 NE2 GLN A 124 74.135 -15.483 31.038 1.00 22.81 N ATOM 1737 HA GLN A 124 75.718 -10.784 31.615 1.00 0.00 H ATOM 1738 HB2 GLN A 124 73.472 -12.638 30.861 1.00 0.00 H ATOM 1739 HB3 GLN A 124 74.879 -12.319 29.821 1.00 0.00 H ATOM 1740 HG2 GLN A 124 76.350 -13.175 31.624 1.00 0.00 H ATOM 1741 HG3 GLN A 124 74.898 -13.590 32.565 1.00 0.00 H ATOM 1742 HE22 GLN A 124 73.470 -15.201 31.787 1.00 0.00 H ATOM 1743 HE21 GLN A 124 73.963 -16.350 30.489 1.00 0.00 H ATOM 1744 H GLN A 124 73.392 -11.643 33.103 1.00 0.00 H ATOM 1745 N ILE A 125 72.853 -9.608 30.573 1.00 8.32 N ATOM 1746 CA ILE A 125 72.286 -8.538 29.724 1.00 7.54 C ATOM 1747 C ILE A 125 72.905 -7.198 30.057 1.00 8.03 C ATOM 1748 O ILE A 125 73.276 -6.432 29.159 1.00 7.55 O ATOM 1749 CB ILE A 125 70.728 -8.478 29.814 1.00 7.37 C ATOM 1750 CG1 ILE A 125 70.121 -9.751 29.200 1.00 6.30 C ATOM 1751 CG2 ILE A 125 70.171 -7.231 29.069 1.00 7.41 C ATOM 1752 CD1 ILE A 125 68.681 -10.017 29.583 1.00 9.04 C ATOM 1753 HA ILE A 125 72.535 -8.781 28.691 1.00 0.00 H ATOM 1754 HB ILE A 125 70.453 -8.406 30.866 1.00 0.00 H ATOM 1755 HG12 ILE A 125 70.173 -9.662 28.115 1.00 0.00 H ATOM 1756 HG13 ILE A 125 70.721 -10.602 29.522 1.00 0.00 H ATOM 1757 HD11 ILE A 125 68.608 -10.124 30.665 1.00 0.00 H ATOM 1758 HD12 ILE A 125 68.060 -9.183 29.257 1.00 0.00 H ATOM 1759 HD13 ILE A 125 68.342 -10.935 29.102 1.00 0.00 H ATOM 1760 HG21 ILE A 125 70.582 -6.327 29.519 1.00 0.00 H ATOM 1761 HG22 ILE A 125 70.458 -7.278 28.019 1.00 0.00 H ATOM 1762 HG23 ILE A 125 69.084 -7.217 29.149 1.00 0.00 H ATOM 1763 H ILE A 125 72.238 -10.120 31.237 1.00 0.00 H ATOM 1764 N ALA A 126 73.027 -6.904 31.344 1.00 8.00 N ATOM 1765 CA ALA A 126 73.643 -5.650 31.826 1.00 8.35 C ATOM 1766 C ALA A 126 75.079 -5.531 31.345 1.00 7.89 C ATOM 1767 O ALA A 126 75.486 -4.477 30.836 1.00 7.55 O ATOM 1768 CB ALA A 126 73.574 -5.585 33.341 1.00 8.82 C ATOM 1769 HA ALA A 126 73.084 -4.809 31.415 1.00 0.00 H ATOM 1770 HB1 ALA A 126 72.532 -5.617 33.658 1.00 0.00 H ATOM 1771 HB2 ALA A 126 74.110 -6.434 33.765 1.00 0.00 H ATOM 1772 HB3 ALA A 126 74.031 -4.657 33.685 1.00 0.00 H ATOM 1773 H ALA A 126 72.674 -7.586 32.045 1.00 0.00 H ATOM 1774 N ALA A 127 75.826 -6.620 31.461 1.00 7.85 N ATOM 1775 CA ALA A 127 77.234 -6.563 31.080 1.00 8.53 C ATOM 1776 C ALA A 127 77.373 -6.353 29.577 1.00 8.25 C ATOM 1777 O ALA A 127 78.227 -5.583 29.120 1.00 9.10 O ATOM 1778 CB ALA A 127 77.984 -7.811 31.538 1.00 8.70 C ATOM 1779 HA ALA A 127 77.687 -5.710 31.585 1.00 0.00 H ATOM 1780 HB1 ALA A 127 77.921 -7.893 32.623 1.00 0.00 H ATOM 1781 HB2 ALA A 127 77.535 -8.692 31.079 1.00 0.00 H ATOM 1782 HB3 ALA A 127 79.029 -7.736 31.238 1.00 0.00 H ATOM 1783 H ALA A 127 75.414 -7.505 31.819 1.00 0.00 H ATOM 1784 N TRP A 128 76.513 -7.021 28.814 1.00 8.17 N ATOM 1785 CA TRP A 128 76.483 -6.822 27.389 1.00 8.50 C ATOM 1786 C TRP A 128 76.129 -5.364 27.030 1.00 7.51 C ATOM 1787 O TRP A 128 76.756 -4.723 26.167 1.00 8.35 O ATOM 1788 CB TRP A 128 75.512 -7.805 26.726 1.00 7.39 C ATOM 1789 CG TRP A 128 75.623 -7.853 25.218 1.00 8.87 C ATOM 1790 CD1 TRP A 128 76.288 -8.796 24.478 1.00 9.44 C ATOM 1791 CD2 TRP A 128 74.986 -6.989 24.276 1.00 9.08 C ATOM 1792 NE1 TRP A 128 76.175 -8.521 23.140 1.00 11.09 N ATOM 1793 CE2 TRP A 128 75.372 -7.423 22.984 1.00 9.00 C ATOM 1794 CE3 TRP A 128 74.188 -5.846 24.393 1.00 8.83 C ATOM 1795 CZ2 TRP A 128 74.977 -6.755 21.814 1.00 8.62 C ATOM 1796 CZ3 TRP A 128 73.804 -5.181 23.225 1.00 8.74 C ATOM 1797 CH2 TRP A 128 74.156 -5.663 21.947 1.00 10.07 C ATOM 1798 HA TRP A 128 77.483 -7.018 27.003 1.00 0.00 H ATOM 1799 HB2 TRP A 128 75.713 -8.802 27.117 1.00 0.00 H ATOM 1800 HB3 TRP A 128 74.495 -7.512 26.986 1.00 0.00 H ATOM 1801 HE1 TRP A 128 76.625 -9.057 22.371 1.00 0.00 H ATOM 1802 HD1 TRP A 128 76.830 -9.645 24.895 1.00 0.00 H ATOM 1803 HZ2 TRP A 128 75.311 -7.092 20.833 1.00 0.00 H ATOM 1804 HH2 TRP A 128 73.773 -5.164 21.057 1.00 0.00 H ATOM 1805 HZ3 TRP A 128 73.217 -4.266 23.304 1.00 0.00 H ATOM 1806 HE3 TRP A 128 73.873 -5.483 25.371 1.00 0.00 H ATOM 1807 H TRP A 128 75.854 -7.696 29.252 1.00 0.00 H ATOM 1808 N LEU A 129 75.097 -4.818 27.659 1.00 7.27 N ATOM 1809 CA LEU A 129 74.666 -3.456 27.428 1.00 6.95 C ATOM 1810 C LEU A 129 75.729 -2.414 27.733 1.00 6.64 C ATOM 1811 O LEU A 129 75.841 -1.395 27.045 1.00 7.08 O ATOM 1812 CB LEU A 129 73.376 -3.192 28.210 1.00 8.52 C ATOM 1813 CG LEU A 129 72.833 -1.772 28.201 1.00 7.79 C ATOM 1814 CD1 LEU A 129 71.274 -1.796 28.258 1.00 10.10 C ATOM 1815 CD2 LEU A 129 73.395 -0.858 29.350 1.00 7.30 C ATOM 1816 HA LEU A 129 74.476 -3.354 26.360 1.00 0.00 H ATOM 1817 HB2 LEU A 129 72.604 -3.841 27.797 1.00 0.00 H ATOM 1818 HB3 LEU A 129 73.561 -3.466 29.249 1.00 0.00 H ATOM 1819 HG LEU A 129 73.177 -1.328 27.267 1.00 0.00 H ATOM 1820 HD21 LEU A 129 73.139 -1.292 30.316 1.00 0.00 H ATOM 1821 HD22 LEU A 129 74.479 -0.787 29.258 1.00 0.00 H ATOM 1822 HD23 LEU A 129 72.956 0.136 29.269 1.00 0.00 H ATOM 1823 HD11 LEU A 129 70.888 -2.333 27.392 1.00 0.00 H ATOM 1824 HD12 LEU A 129 70.953 -2.297 29.171 1.00 0.00 H ATOM 1825 HD13 LEU A 129 70.896 -0.774 28.251 1.00 0.00 H ATOM 1826 H LEU A 129 74.574 -5.394 28.349 1.00 0.00 H ATOM 1827 N ALA A 130 76.496 -2.636 28.786 1.00 7.68 N ATOM 1828 CA ALA A 130 77.565 -1.680 29.123 1.00 7.71 C ATOM 1829 C ALA A 130 78.578 -1.533 28.000 1.00 7.47 C ATOM 1830 O ALA A 130 79.107 -0.431 27.800 1.00 9.30 O ATOM 1831 CB ALA A 130 78.244 -2.082 30.413 1.00 8.56 C ATOM 1832 HA ALA A 130 77.100 -0.704 29.260 1.00 0.00 H ATOM 1833 HB1 ALA A 130 77.511 -2.095 31.219 1.00 0.00 H ATOM 1834 HB2 ALA A 130 78.678 -3.075 30.299 1.00 0.00 H ATOM 1835 HB3 ALA A 130 79.031 -1.365 30.647 1.00 0.00 H ATOM 1836 H ALA A 130 76.346 -3.481 29.374 1.00 0.00 H ATOM 1837 N VAL A 131 78.924 -2.648 27.344 1.00 8.59 N ATOM 1838 CA VAL A 131 79.941 -2.667 26.288 1.00 9.10 C ATOM 1839 C VAL A 131 79.313 -2.369 24.903 1.00 9.34 C ATOM 1840 O VAL A 131 79.925 -1.700 24.050 1.00 11.00 O ATOM 1841 CB VAL A 131 80.656 -4.017 26.265 1.00 9.86 C ATOM 1842 CG1 VAL A 131 81.492 -4.223 24.981 1.00 13.91 C ATOM 1843 CG2 VAL A 131 81.490 -4.182 27.568 1.00 12.84 C ATOM 1844 HA VAL A 131 80.668 -1.885 26.505 1.00 0.00 H ATOM 1845 HB VAL A 131 79.908 -4.809 26.238 1.00 0.00 H ATOM 1846 HG11 VAL A 131 80.837 -4.175 24.111 1.00 0.00 H ATOM 1847 HG12 VAL A 131 82.248 -3.441 24.912 1.00 0.00 H ATOM 1848 HG13 VAL A 131 81.978 -5.198 25.018 1.00 0.00 H ATOM 1849 HG21 VAL A 131 82.226 -3.380 27.631 1.00 0.00 H ATOM 1850 HG22 VAL A 131 80.826 -4.136 28.431 1.00 0.00 H ATOM 1851 HG23 VAL A 131 82.000 -5.145 27.552 1.00 0.00 H ATOM 1852 H VAL A 131 78.451 -3.539 27.595 1.00 0.00 H ATOM 1853 N ASN A 132 78.114 -2.889 24.664 1.00 7.83 N ATOM 1854 CA ASN A 132 77.574 -2.927 23.325 1.00 8.16 C ATOM 1855 C ASN A 132 76.328 -2.063 23.100 1.00 8.03 C ATOM 1856 O ASN A 132 75.903 -1.895 21.970 1.00 9.20 O ATOM 1857 CB ASN A 132 77.233 -4.359 22.959 1.00 7.43 C ATOM 1858 CG ASN A 132 78.436 -5.282 22.987 1.00 9.59 C ATOM 1859 OD1 ASN A 132 78.473 -6.250 23.777 1.00 14.63 O ATOM 1860 ND2 ASN A 132 79.405 -5.000 22.193 1.00 10.74 N ATOM 1861 HA ASN A 132 78.356 -2.510 22.690 1.00 0.00 H ATOM 1862 HB2 ASN A 132 76.493 -4.732 23.667 1.00 0.00 H ATOM 1863 HB3 ASN A 132 76.810 -4.370 21.954 1.00 0.00 H ATOM 1864 HD22 ASN A 132 79.331 -4.184 21.552 1.00 0.00 H ATOM 1865 HD21 ASN A 132 80.263 -5.587 22.191 1.00 0.00 H ATOM 1866 H ASN A 132 77.556 -3.274 25.453 1.00 0.00 H ATOM 1867 N GLY A 133 75.784 -1.442 24.123 1.00 7.82 N ATOM 1868 CA GLY A 133 74.693 -0.515 23.991 1.00 7.39 C ATOM 1869 C GLY A 133 73.295 -1.008 24.275 1.00 6.67 C ATOM 1870 O GLY A 133 73.083 -2.131 24.727 1.00 6.94 O ATOM 1871 HA3 GLY A 133 74.704 -0.148 22.965 1.00 0.00 H ATOM 1872 HA2 GLY A 133 74.888 0.312 24.673 1.00 0.00 H ATOM 1873 H GLY A 133 76.161 -1.630 25.074 1.00 0.00 H ATOM 1874 N PRO A 134 72.326 -0.120 24.040 1.00 5.70 N ATOM 1875 CA PRO A 134 70.903 -0.446 24.339 1.00 6.68 C ATOM 1876 C PRO A 134 70.388 -1.692 23.675 1.00 7.30 C ATOM 1877 O PRO A 134 70.786 -2.025 22.555 1.00 7.13 O ATOM 1878 CB PRO A 134 70.157 0.812 23.867 1.00 7.14 C ATOM 1879 CG PRO A 134 71.219 1.922 24.051 1.00 7.23 C ATOM 1880 CD PRO A 134 72.498 1.302 23.659 1.00 5.66 C ATOM 1881 HA PRO A 134 70.762 -0.678 25.395 1.00 0.00 H ATOM 1882 HD3 PRO A 134 72.666 1.400 22.587 1.00 0.00 H ATOM 1883 HD2 PRO A 134 73.331 1.752 24.199 1.00 0.00 H ATOM 1884 HG3 PRO A 134 71.255 2.249 25.090 1.00 0.00 H ATOM 1885 HG2 PRO A 134 70.995 2.775 23.411 1.00 0.00 H ATOM 1886 HB2 PRO A 134 69.857 0.723 22.823 1.00 0.00 H ATOM 1887 HB3 PRO A 134 69.277 1.002 24.482 1.00 0.00 H ATOM 1888 N VAL A 135 69.489 -2.370 24.390 1.00 6.39 N ATOM 1889 CA VAL A 135 68.978 -3.682 24.083 1.00 6.36 C ATOM 1890 C VAL A 135 67.454 -3.647 23.955 1.00 6.39 C ATOM 1891 O VAL A 135 66.739 -3.100 24.802 1.00 7.71 O ATOM 1892 CB VAL A 135 69.353 -4.640 25.222 1.00 6.38 C ATOM 1893 CG1 VAL A 135 68.757 -6.048 25.035 1.00 7.75 C ATOM 1894 CG2 VAL A 135 70.915 -4.771 25.379 1.00 8.23 C ATOM 1895 HA VAL A 135 69.408 -4.017 23.139 1.00 0.00 H ATOM 1896 HB VAL A 135 68.928 -4.200 26.124 1.00 0.00 H ATOM 1897 HG11 VAL A 135 67.670 -5.979 25.000 1.00 0.00 H ATOM 1898 HG12 VAL A 135 69.125 -6.476 24.103 1.00 0.00 H ATOM 1899 HG13 VAL A 135 69.056 -6.681 25.870 1.00 0.00 H ATOM 1900 HG21 VAL A 135 71.341 -5.154 24.452 1.00 0.00 H ATOM 1901 HG22 VAL A 135 71.340 -3.792 25.598 1.00 0.00 H ATOM 1902 HG23 VAL A 135 71.141 -5.457 26.195 1.00 0.00 H ATOM 1903 H VAL A 135 69.123 -1.910 25.248 1.00 0.00 H ATOM 1904 N ALA A 136 66.935 -4.226 22.873 1.00 6.58 N ATOM 1905 CA ALA A 136 65.485 -4.366 22.728 1.00 6.27 C ATOM 1906 C ALA A 136 65.004 -5.452 23.667 1.00 7.30 C ATOM 1907 O ALA A 136 65.620 -6.487 23.727 1.00 6.92 O ATOM 1908 CB ALA A 136 65.143 -4.761 21.286 1.00 6.43 C ATOM 1909 HA ALA A 136 65.001 -3.419 22.966 1.00 0.00 H ATOM 1910 HB1 ALA A 136 65.501 -3.989 20.605 1.00 0.00 H ATOM 1911 HB2 ALA A 136 65.623 -5.710 21.047 1.00 0.00 H ATOM 1912 HB3 ALA A 136 64.063 -4.863 21.185 1.00 0.00 H ATOM 1913 H ALA A 136 67.565 -4.581 22.126 1.00 0.00 H ATOM 1914 N VAL A 137 63.919 -5.209 24.397 1.00 5.99 N ATOM 1915 CA VAL A 137 63.357 -6.242 25.257 1.00 6.55 C ATOM 1916 C VAL A 137 61.859 -6.310 25.163 1.00 5.74 C ATOM 1917 O VAL A 137 61.186 -5.263 25.071 1.00 6.58 O ATOM 1918 CB VAL A 137 63.757 -6.087 26.770 1.00 7.13 C ATOM 1919 CG1 VAL A 137 65.231 -6.355 27.000 1.00 7.15 C ATOM 1920 CG2 VAL A 137 63.344 -4.725 27.305 1.00 7.76 C ATOM 1921 HA VAL A 137 63.791 -7.169 24.881 1.00 0.00 H ATOM 1922 HB VAL A 137 63.211 -6.846 27.331 1.00 0.00 H ATOM 1923 HG11 VAL A 137 65.467 -7.372 26.688 1.00 0.00 H ATOM 1924 HG12 VAL A 137 65.823 -5.649 26.418 1.00 0.00 H ATOM 1925 HG13 VAL A 137 65.460 -6.236 28.059 1.00 0.00 H ATOM 1926 HG21 VAL A 137 63.841 -3.944 26.729 1.00 0.00 H ATOM 1927 HG22 VAL A 137 62.264 -4.613 27.215 1.00 0.00 H ATOM 1928 HG23 VAL A 137 63.633 -4.645 28.353 1.00 0.00 H ATOM 1929 H VAL A 137 63.468 -4.273 24.353 1.00 0.00 H ATOM 1930 N ALA A 138 61.326 -7.533 25.233 1.00 6.09 N ATOM 1931 CA ALA A 138 59.882 -7.693 25.433 1.00 6.91 C ATOM 1932 C ALA A 138 59.590 -7.702 26.914 1.00 6.31 C ATOM 1933 O ALA A 138 60.411 -8.146 27.742 1.00 6.78 O ATOM 1934 CB ALA A 138 59.394 -9.011 24.808 1.00 8.18 C ATOM 1935 HA ALA A 138 59.361 -6.865 24.952 1.00 0.00 H ATOM 1936 HB1 ALA A 138 59.605 -9.005 23.739 1.00 0.00 H ATOM 1937 HB2 ALA A 138 59.912 -9.848 25.277 1.00 0.00 H ATOM 1938 HB3 ALA A 138 58.320 -9.111 24.967 1.00 0.00 H ATOM 1939 H ALA A 138 61.935 -8.372 25.146 1.00 0.00 H ATOM 1940 N VAL A 139 58.437 -7.134 27.276 1.00 6.36 N ATOM 1941 CA VAL A 139 58.029 -7.087 28.660 1.00 6.62 C ATOM 1942 C VAL A 139 56.537 -7.318 28.789 1.00 6.60 C ATOM 1943 O VAL A 139 55.782 -7.123 27.808 1.00 6.25 O ATOM 1944 CB VAL A 139 58.343 -5.709 29.319 1.00 6.91 C ATOM 1945 CG1 VAL A 139 59.881 -5.446 29.467 1.00 8.01 C ATOM 1946 CG2 VAL A 139 57.645 -4.495 28.550 1.00 6.53 C ATOM 1947 HA VAL A 139 58.591 -7.872 29.166 1.00 0.00 H ATOM 1948 HB VAL A 139 57.918 -5.764 30.321 1.00 0.00 H ATOM 1949 HG11 VAL A 139 60.323 -6.223 30.090 1.00 0.00 H ATOM 1950 HG12 VAL A 139 60.347 -5.460 28.482 1.00 0.00 H ATOM 1951 HG13 VAL A 139 60.039 -4.473 29.932 1.00 0.00 H ATOM 1952 HG21 VAL A 139 58.001 -4.466 27.520 1.00 0.00 H ATOM 1953 HG22 VAL A 139 56.564 -4.635 28.558 1.00 0.00 H ATOM 1954 HG23 VAL A 139 57.895 -3.559 29.049 1.00 0.00 H ATOM 1955 H VAL A 139 57.822 -6.718 26.548 1.00 0.00 H ATOM 1956 N ASP A 140 56.102 -7.661 29.986 1.00 6.01 N ATOM 1957 CA ASP A 140 54.700 -7.499 30.372 1.00 6.71 C ATOM 1958 C ASP A 140 54.518 -6.082 30.894 1.00 5.63 C ATOM 1959 O ASP A 140 55.033 -5.754 31.955 1.00 6.53 O ATOM 1960 CB ASP A 140 54.345 -8.546 31.410 1.00 5.83 C ATOM 1961 CG ASP A 140 52.865 -8.585 31.739 1.00 7.16 C ATOM 1962 OD1 ASP A 140 52.189 -7.561 31.564 1.00 6.75 O ATOM 1963 OD2 ASP A 140 52.391 -9.639 32.259 1.00 7.25 O ATOM 1964 HA ASP A 140 54.030 -7.644 29.525 1.00 0.00 H ATOM 1965 HB2 ASP A 140 54.642 -9.524 31.031 1.00 0.00 H ATOM 1966 HB3 ASP A 140 54.898 -8.329 32.324 1.00 0.00 H ATOM 1967 H ASP A 140 56.774 -8.057 30.674 1.00 0.00 H ATOM 1968 N ALA A 141 53.854 -5.211 30.127 1.00 6.03 N ATOM 1969 CA ALA A 141 53.608 -3.847 30.500 1.00 5.41 C ATOM 1970 C ALA A 141 52.163 -3.611 30.893 1.00 6.29 C ATOM 1971 O ALA A 141 51.703 -2.470 30.992 1.00 7.39 O ATOM 1972 CB ALA A 141 54.015 -2.901 29.350 1.00 6.98 C ATOM 1973 HA ALA A 141 54.218 -3.633 31.378 1.00 0.00 H ATOM 1974 HB1 ALA A 141 55.076 -3.028 29.135 1.00 0.00 H ATOM 1975 HB2 ALA A 141 53.432 -3.140 28.461 1.00 0.00 H ATOM 1976 HB3 ALA A 141 53.824 -1.869 29.645 1.00 0.00 H ATOM 1977 H ALA A 141 53.495 -5.541 29.208 1.00 0.00 H ATOM 1978 N SER A 142 51.424 -4.674 31.101 1.00 6.48 N ATOM 1979 CA SER A 142 50.023 -4.541 31.518 1.00 6.01 C ATOM 1980 C SER A 142 49.814 -3.697 32.761 1.00 6.58 C ATOM 1981 O SER A 142 48.826 -2.949 32.831 1.00 7.55 O ATOM 1982 CB SER A 142 49.419 -5.923 31.701 1.00 6.88 C ATOM 1983 OG SER A 142 50.015 -6.695 32.744 1.00 8.42 O ATOM 1984 HA SER A 142 49.513 -4.001 30.720 1.00 0.00 H ATOM 1985 HB2 SER A 142 49.531 -6.471 30.765 1.00 0.00 H ATOM 1986 HB3 SER A 142 48.359 -5.805 31.927 1.00 0.00 H ATOM 1987 HG SER A 142 50.977 -6.824 32.549 1.00 0.00 H ATOM 1988 H SER A 142 51.834 -5.620 30.969 1.00 0.00 H ATOM 1989 N SER A 143 50.768 -3.780 33.700 1.00 6.67 N ATOM 1990 CA SER A 143 50.674 -3.045 34.955 1.00 6.73 C ATOM 1991 C SER A 143 51.333 -1.688 34.928 1.00 7.26 C ATOM 1992 O SER A 143 51.547 -1.092 35.992 1.00 8.46 O ATOM 1993 CB SER A 143 51.242 -3.945 36.096 1.00 7.31 C ATOM 1994 OG SER A 143 52.644 -4.112 36.060 1.00 7.81 O ATOM 1995 HA SER A 143 49.622 -2.824 35.135 1.00 0.00 H ATOM 1996 HB2 SER A 143 50.778 -4.928 36.018 1.00 0.00 H ATOM 1997 HB3 SER A 143 50.976 -3.494 37.052 1.00 0.00 H ATOM 1998 HG SER A 143 52.903 -4.532 35.202 1.00 0.00 H ATOM 1999 H SER A 143 51.597 -4.385 33.528 1.00 0.00 H ATOM 2000 N TRP A 144 51.571 -1.150 33.723 1.00 7.04 N ATOM 2001 CA TRP A 144 52.238 0.153 33.562 1.00 7.60 C ATOM 2002 C TRP A 144 51.297 1.347 33.323 1.00 8.93 C ATOM 2003 O TRP A 144 51.732 2.467 33.029 1.00 10.56 O ATOM 2004 CB TRP A 144 53.199 0.079 32.394 1.00 8.08 C ATOM 2005 CG TRP A 144 54.414 -0.812 32.574 1.00 6.84 C ATOM 2006 CD1 TRP A 144 54.653 -1.764 33.537 1.00 8.06 C ATOM 2007 CD2 TRP A 144 55.541 -0.824 31.705 1.00 6.24 C ATOM 2008 NE1 TRP A 144 55.898 -2.346 33.334 1.00 6.11 N ATOM 2009 CE2 TRP A 144 56.468 -1.752 32.220 1.00 7.42 C ATOM 2010 CE3 TRP A 144 55.909 -0.020 30.586 1.00 8.60 C ATOM 2011 CZ2 TRP A 144 57.698 -1.962 31.614 1.00 6.14 C ATOM 2012 CZ3 TRP A 144 57.146 -0.276 29.990 1.00 7.26 C ATOM 2013 CH2 TRP A 144 57.997 -1.222 30.500 1.00 7.74 C ATOM 2014 HA TRP A 144 52.738 0.337 34.513 1.00 0.00 H ATOM 2015 HB2 TRP A 144 52.644 -0.287 31.530 1.00 0.00 H ATOM 2016 HB3 TRP A 144 53.555 1.089 32.193 1.00 0.00 H ATOM 2017 HE1 TRP A 144 56.326 -3.095 33.915 1.00 0.00 H ATOM 2018 HD1 TRP A 144 53.966 -2.024 34.342 1.00 0.00 H ATOM 2019 HZ2 TRP A 144 58.404 -2.692 32.011 1.00 0.00 H ATOM 2020 HH2 TRP A 144 58.950 -1.392 29.999 1.00 0.00 H ATOM 2021 HZ3 TRP A 144 57.440 0.286 29.104 1.00 0.00 H ATOM 2022 HE3 TRP A 144 55.251 0.764 30.211 1.00 0.00 H ATOM 2023 H TRP A 144 51.274 -1.671 32.873 1.00 0.00 H ATOM 2024 N MET A 145 49.999 1.106 33.458 1.00 10.75 N ATOM 2025 CA MET A 145 49.024 2.103 33.037 1.00 11.78 C ATOM 2026 C MET A 145 48.984 3.309 33.942 1.00 14.03 C ATOM 2027 O MET A 145 48.644 4.394 33.456 1.00 17.39 O ATOM 2028 CB MET A 145 47.619 1.504 32.954 1.00 12.75 C ATOM 2029 CG MET A 145 47.535 0.348 31.999 1.00 11.44 C ATOM 2030 SD MET A 145 47.906 0.771 30.305 1.00 14.64 S ATOM 2031 CE MET A 145 49.603 0.293 30.184 1.00 13.13 C ATOM 2032 HA MET A 145 49.350 2.430 32.050 1.00 0.00 H ATOM 2033 HB2 MET A 145 47.328 1.158 33.946 1.00 0.00 H ATOM 2034 HB3 MET A 145 46.928 2.280 32.624 1.00 0.00 H ATOM 2035 HG2 MET A 145 46.523 -0.055 32.037 1.00 0.00 H ATOM 2036 HG3 MET A 145 48.241 -0.416 32.324 1.00 0.00 H ATOM 2037 HE1 MET A 145 50.191 0.858 30.908 1.00 0.00 H ATOM 2038 HE2 MET A 145 49.695 -0.773 30.392 1.00 0.00 H ATOM 2039 HE3 MET A 145 49.967 0.501 29.178 1.00 0.00 H ATOM 2040 H MET A 145 49.678 0.204 33.865 1.00 0.00 H ATOM 2041 N THR A 146 49.304 3.158 35.202 1.00 15.76 N ATOM 2042 CA THR A 146 49.276 4.358 36.070 1.00 17.86 C ATOM 2043 C THR A 146 50.643 4.825 36.535 1.00 16.14 C ATOM 2044 O THR A 146 50.753 5.713 37.362 1.00 17.16 O ATOM 2045 CB THR A 146 48.397 4.126 37.245 1.00 17.67 C ATOM 2046 OG1 THR A 146 48.932 3.069 38.039 1.00 21.45 O ATOM 2047 CG2 THR A 146 46.971 3.814 36.774 1.00 22.98 C ATOM 2048 HA THR A 146 48.877 5.159 35.448 1.00 0.00 H ATOM 2049 HB THR A 146 48.355 5.024 37.861 1.00 0.00 H ATOM 2050 HG1 THR A 146 48.982 2.243 37.496 1.00 0.00 H ATOM 2051 HG23 THR A 146 46.599 4.643 36.172 1.00 0.00 H ATOM 2052 HG21 THR A 146 46.979 2.903 36.175 1.00 0.00 H ATOM 2053 HG22 THR A 146 46.326 3.674 37.641 1.00 0.00 H ATOM 2054 H THR A 146 49.569 2.227 35.581 1.00 0.00 H ATOM 2055 N TYR A 147 51.693 4.266 35.947 1.00 14.14 N ATOM 2056 CA TYR A 147 53.033 4.645 36.346 1.00 12.43 C ATOM 2057 C TYR A 147 53.335 6.117 36.065 1.00 13.86 C ATOM 2058 O TYR A 147 53.214 6.589 34.928 1.00 15.74 O ATOM 2059 CB TYR A 147 54.048 3.768 35.584 1.00 10.92 C ATOM 2060 CG TYR A 147 55.510 4.098 35.905 1.00 9.05 C ATOM 2061 CD1 TYR A 147 56.250 4.856 35.026 1.00 8.34 C ATOM 2062 CD2 TYR A 147 56.126 3.670 37.081 1.00 10.43 C ATOM 2063 CE1 TYR A 147 57.568 5.197 35.290 1.00 7.89 C ATOM 2064 CE2 TYR A 147 57.418 3.993 37.365 1.00 9.33 C ATOM 2065 CZ TYR A 147 58.152 4.776 36.468 1.00 7.02 C ATOM 2066 OH TYR A 147 59.460 5.050 36.700 1.00 8.48 O ATOM 2067 HA TYR A 147 53.112 4.495 37.423 1.00 0.00 H ATOM 2068 HB3 TYR A 147 53.890 3.908 34.515 1.00 0.00 H ATOM 2069 HB2 TYR A 147 53.865 2.725 35.843 1.00 0.00 H ATOM 2070 HD2 TYR A 147 55.561 3.063 37.788 1.00 0.00 H ATOM 2071 HE2 TYR A 147 57.879 3.642 38.289 1.00 0.00 H ATOM 2072 HE1 TYR A 147 58.137 5.791 34.575 1.00 0.00 H ATOM 2073 HD1 TYR A 147 55.788 5.197 34.099 1.00 0.00 H ATOM 2074 HH TYR A 147 59.547 5.534 37.559 1.00 0.00 H ATOM 2075 H TYR A 147 51.554 3.556 35.200 1.00 0.00 H ATOM 2076 N THR A 148 53.778 6.831 37.094 1.00 13.86 N ATOM 2077 CA THR A 148 54.188 8.172 36.931 1.00 14.43 C ATOM 2078 C THR A 148 55.585 8.443 37.399 1.00 14.12 C ATOM 2079 O THR A 148 56.048 9.602 37.306 1.00 20.26 O ATOM 2080 CB THR A 148 53.244 9.120 37.716 1.00 15.17 C ATOM 2081 OG1 THR A 148 53.285 8.773 39.101 1.00 17.02 O ATOM 2082 CG2 THR A 148 51.866 8.985 37.173 1.00 16.82 C ATOM 2083 HA THR A 148 54.149 8.354 35.857 1.00 0.00 H ATOM 2084 HB THR A 148 53.561 10.157 37.608 1.00 0.00 H ATOM 2085 HG1 THR A 148 54.211 8.869 39.437 1.00 0.00 H ATOM 2086 HG23 THR A 148 51.865 9.256 36.117 1.00 0.00 H ATOM 2087 HG21 THR A 148 51.532 7.954 37.286 1.00 0.00 H ATOM 2088 HG22 THR A 148 51.195 9.647 37.720 1.00 0.00 H ATOM 2089 H THR A 148 53.824 6.394 38.037 1.00 0.00 H ATOM 2090 N GLY A 149 56.271 7.452 37.938 1.00 11.61 N ATOM 2091 CA GLY A 149 57.631 7.660 38.429 1.00 12.09 C ATOM 2092 C GLY A 149 58.006 6.681 39.541 1.00 10.59 C ATOM 2093 O GLY A 149 57.153 6.019 40.121 1.00 11.03 O ATOM 2094 HA3 GLY A 149 57.712 8.676 38.815 1.00 0.00 H ATOM 2095 HA2 GLY A 149 58.326 7.531 37.600 1.00 0.00 H ATOM 2096 H GLY A 149 55.837 6.510 38.014 1.00 0.00 H ATOM 2097 N GLY A 150 59.300 6.609 39.836 1.00 10.19 N ATOM 2098 CA GLY A 150 59.846 5.715 40.848 1.00 10.14 C ATOM 2099 C GLY A 150 60.335 4.419 40.276 1.00 10.05 C ATOM 2100 O GLY A 150 60.272 4.187 39.053 1.00 10.76 O ATOM 2101 HA3 GLY A 150 59.068 5.501 41.580 1.00 0.00 H ATOM 2102 HA2 GLY A 150 60.680 6.215 41.341 1.00 0.00 H ATOM 2103 H GLY A 150 59.958 7.224 39.316 1.00 0.00 H ATOM 2104 N VAL A 151 60.833 3.557 41.137 1.00 9.40 N ATOM 2105 CA VAL A 151 61.340 2.272 40.701 1.00 8.42 C ATOM 2106 C VAL A 151 60.266 1.214 40.984 1.00 9.60 C ATOM 2107 O VAL A 151 59.891 0.920 42.146 1.00 10.35 O ATOM 2108 CB VAL A 151 62.673 1.873 41.389 1.00 9.01 C ATOM 2109 CG1 VAL A 151 63.133 0.441 40.998 1.00 9.34 C ATOM 2110 CG2 VAL A 151 63.780 2.972 41.143 1.00 9.60 C ATOM 2111 HA VAL A 151 61.560 2.340 39.636 1.00 0.00 H ATOM 2112 HB VAL A 151 62.498 1.833 42.464 1.00 0.00 H ATOM 2113 HG11 VAL A 151 62.370 -0.278 41.296 1.00 0.00 H ATOM 2114 HG12 VAL A 151 63.281 0.390 39.919 1.00 0.00 H ATOM 2115 HG13 VAL A 151 64.070 0.210 41.506 1.00 0.00 H ATOM 2116 HG21 VAL A 151 63.954 3.078 40.072 1.00 0.00 H ATOM 2117 HG22 VAL A 151 63.443 3.924 41.553 1.00 0.00 H ATOM 2118 HG23 VAL A 151 64.705 2.671 41.634 1.00 0.00 H ATOM 2119 H VAL A 151 60.863 3.803 42.147 1.00 0.00 H ATOM 2120 N MET A 152 59.799 0.594 39.900 1.00 8.23 N ATOM 2121 CA MET A 152 58.737 -0.376 40.030 1.00 7.85 C ATOM 2122 C MET A 152 59.266 -1.689 40.614 1.00 7.87 C ATOM 2123 O MET A 152 60.258 -2.288 40.099 1.00 8.77 O ATOM 2124 CB MET A 152 58.090 -0.587 38.642 1.00 8.81 C ATOM 2125 CG MET A 152 56.953 -1.522 38.662 1.00 8.44 C ATOM 2126 SD MET A 152 56.135 -1.706 37.034 1.00 10.42 S ATOM 2127 CE MET A 152 55.252 -0.187 36.944 1.00 10.50 C ATOM 2128 HA MET A 152 57.980 -0.008 40.723 1.00 0.00 H ATOM 2129 HB2 MET A 152 57.738 0.377 38.274 1.00 0.00 H ATOM 2130 HB3 MET A 152 58.848 -0.979 37.963 1.00 0.00 H ATOM 2131 HG2 MET A 152 56.218 -1.157 39.379 1.00 0.00 H ATOM 2132 HG3 MET A 152 57.315 -2.500 38.980 1.00 0.00 H ATOM 2133 HE1 MET A 152 54.556 -0.123 37.780 1.00 0.00 H ATOM 2134 HE2 MET A 152 55.956 0.644 36.990 1.00 0.00 H ATOM 2135 HE3 MET A 152 54.699 -0.145 36.006 1.00 0.00 H ATOM 2136 H MET A 152 60.198 0.808 38.964 1.00 0.00 H ATOM 2137 N THR A 153 58.617 -2.190 41.686 1.00 8.59 N ATOM 2138 CA THR A 153 59.080 -3.402 42.342 1.00 7.97 C ATOM 2139 C THR A 153 58.049 -4.541 42.378 1.00 8.13 C ATOM 2140 O THR A 153 58.366 -5.653 42.850 1.00 8.37 O ATOM 2141 CB THR A 153 59.511 -3.093 43.806 1.00 8.24 C ATOM 2142 OG1 THR A 153 58.376 -2.514 44.458 1.00 12.86 O ATOM 2143 CG2 THR A 153 60.704 -2.108 43.864 1.00 9.81 C ATOM 2144 HA THR A 153 59.920 -3.745 41.738 1.00 0.00 H ATOM 2145 HB THR A 153 59.837 -4.012 44.294 1.00 0.00 H ATOM 2146 HG1 THR A 153 58.609 -2.301 45.396 1.00 0.00 H ATOM 2147 HG23 THR A 153 61.566 -2.553 43.366 1.00 0.00 H ATOM 2148 HG21 THR A 153 60.432 -1.180 43.361 1.00 0.00 H ATOM 2149 HG22 THR A 153 60.951 -1.900 44.905 1.00 0.00 H ATOM 2150 H THR A 153 57.773 -1.702 42.048 1.00 0.00 H ATOM 2151 N SER A 154 56.862 -4.325 41.814 1.00 8.45 N ATOM 2152 CA SER A 154 55.878 -5.412 41.710 1.00 8.92 C ATOM 2153 C SER A 154 55.205 -5.444 40.373 1.00 8.82 C ATOM 2154 O SER A 154 54.006 -5.637 40.229 1.00 8.96 O ATOM 2155 CB SER A 154 54.883 -5.406 42.862 1.00 10.14 C ATOM 2156 OG SER A 154 54.158 -4.231 42.905 1.00 11.55 O ATOM 2157 HA SER A 154 56.438 -6.344 41.794 1.00 0.00 H ATOM 2158 HB2 SER A 154 55.427 -5.520 43.800 1.00 0.00 H ATOM 2159 HB3 SER A 154 54.194 -6.242 42.739 1.00 0.00 H ATOM 2160 HG SER A 154 53.656 -4.123 42.059 1.00 0.00 H ATOM 2161 H SER A 154 56.630 -3.381 41.445 1.00 0.00 H ATOM 2162 N CYS A 155 56.024 -5.245 39.340 1.00 7.44 N ATOM 2163 CA CYS A 155 55.513 -5.371 37.974 1.00 7.60 C ATOM 2164 C CYS A 155 54.811 -6.711 37.798 1.00 7.73 C ATOM 2165 O CYS A 155 55.376 -7.736 38.108 1.00 7.23 O ATOM 2166 CB CYS A 155 56.683 -5.289 37.001 1.00 7.53 C ATOM 2167 SG CYS A 155 56.146 -5.178 35.273 1.00 7.66 S ATOM 2168 HA CYS A 155 54.802 -4.568 37.780 1.00 0.00 H ATOM 2169 HB2 CYS A 155 57.299 -6.181 37.119 1.00 0.00 H ATOM 2170 HB3 CYS A 155 57.275 -4.406 37.240 1.00 0.00 H ATOM 2171 H CYS A 155 57.022 -5.001 39.504 1.00 0.00 H ATOM 2172 N VAL A 156 53.621 -6.704 37.194 1.00 7.72 N ATOM 2173 CA VAL A 156 52.907 -7.939 36.885 1.00 7.28 C ATOM 2174 C VAL A 156 53.682 -8.594 35.738 1.00 7.60 C ATOM 2175 O VAL A 156 53.898 -8.004 34.674 1.00 8.59 O ATOM 2176 CB VAL A 156 51.456 -7.690 36.507 1.00 7.33 C ATOM 2177 CG1 VAL A 156 50.814 -8.979 35.933 1.00 7.98 C ATOM 2178 CG2 VAL A 156 50.712 -7.117 37.731 1.00 7.43 C ATOM 2179 HA VAL A 156 52.862 -8.587 37.760 1.00 0.00 H ATOM 2180 HB VAL A 156 51.387 -6.950 35.710 1.00 0.00 H ATOM 2181 HG11 VAL A 156 51.363 -9.292 35.045 1.00 0.00 H ATOM 2182 HG12 VAL A 156 50.854 -9.769 36.683 1.00 0.00 H ATOM 2183 HG13 VAL A 156 49.776 -8.779 35.669 1.00 0.00 H ATOM 2184 HG21 VAL A 156 50.762 -7.832 38.552 1.00 0.00 H ATOM 2185 HG22 VAL A 156 51.180 -6.181 38.034 1.00 0.00 H ATOM 2186 HG23 VAL A 156 49.670 -6.935 37.469 1.00 0.00 H ATOM 2187 H VAL A 156 53.190 -5.793 36.936 1.00 0.00 H ATOM 2188 N SER A 157 54.167 -9.787 36.000 1.00 6.89 N ATOM 2189 CA SER A 157 55.129 -10.497 35.162 1.00 6.02 C ATOM 2190 C SER A 157 54.588 -11.843 34.657 1.00 7.12 C ATOM 2191 O SER A 157 54.989 -12.890 35.135 1.00 8.39 O ATOM 2192 CB SER A 157 56.405 -10.661 36.010 1.00 6.36 C ATOM 2193 OG SER A 157 56.876 -9.411 36.507 1.00 7.48 O ATOM 2194 HA SER A 157 55.338 -9.931 34.254 1.00 0.00 H ATOM 2195 HB2 SER A 157 57.183 -11.111 35.394 1.00 0.00 H ATOM 2196 HB3 SER A 157 56.187 -11.316 36.853 1.00 0.00 H ATOM 2197 HG SER A 157 56.177 -8.998 37.074 1.00 0.00 H ATOM 2198 H SER A 157 53.842 -10.260 36.867 1.00 0.00 H ATOM 2199 N GLU A 158 53.648 -11.767 33.708 1.00 3.10 N ATOM 2200 CA GLU A 158 52.863 -12.938 33.366 1.00 4.18 C ATOM 2201 C GLU A 158 52.815 -13.255 31.875 1.00 3.94 C ATOM 2202 O GLU A 158 52.813 -14.417 31.450 1.00 5.67 O ATOM 2203 CB GLU A 158 51.440 -12.807 33.912 1.00 3.71 C ATOM 2204 CG GLU A 158 51.422 -12.779 35.417 1.00 4.73 C ATOM 2205 CD GLU A 158 50.081 -12.656 36.073 1.00 8.08 C ATOM 2206 OE1 GLU A 158 49.061 -12.438 35.395 1.00 9.54 O ATOM 2207 OE2 GLU A 158 50.049 -12.772 37.327 1.00 9.27 O ATOM 2208 HA GLU A 158 53.377 -13.776 33.837 1.00 0.00 H ATOM 2209 HB2 GLU A 158 51.001 -11.883 33.536 1.00 0.00 H ATOM 2210 HB3 GLU A 158 50.849 -13.656 33.567 1.00 0.00 H ATOM 2211 HG2 GLU A 158 51.879 -13.704 35.770 1.00 0.00 H ATOM 2212 HG3 GLU A 158 52.026 -11.931 35.739 1.00 0.00 H ATOM 2213 H GLU A 158 53.480 -10.867 33.215 1.00 0.00 H ATOM 2214 N GLN A 159 52.733 -12.200 31.054 1.00 6.92 N ATOM 2215 CA GLN A 159 52.598 -12.400 29.603 1.00 8.40 C ATOM 2216 C GLN A 159 53.318 -11.281 28.868 1.00 6.68 C ATOM 2217 O GLN A 159 53.002 -10.077 29.039 1.00 8.35 O ATOM 2218 CB GLN A 159 51.113 -12.428 29.193 1.00 9.46 C ATOM 2219 CG GLN A 159 50.813 -12.473 27.728 1.00 12.61 C ATOM 2220 CD GLN A 159 51.383 -13.685 27.045 1.00 17.74 C ATOM 2221 OE1 GLN A 159 51.117 -14.805 27.472 1.00 19.73 O ATOM 2222 NE2 GLN A 159 52.211 -13.470 25.969 1.00 19.22 N ATOM 2223 HA GLN A 159 53.045 -13.358 29.337 1.00 0.00 H ATOM 2224 HB2 GLN A 159 50.663 -13.310 29.648 1.00 0.00 H ATOM 2225 HB3 GLN A 159 50.643 -11.532 29.598 1.00 0.00 H ATOM 2226 HG2 GLN A 159 49.731 -12.477 27.595 1.00 0.00 H ATOM 2227 HG3 GLN A 159 51.232 -11.582 27.260 1.00 0.00 H ATOM 2228 HE22 GLN A 159 52.404 -12.500 25.647 1.00 0.00 H ATOM 2229 HE21 GLN A 159 52.644 -14.277 25.477 1.00 0.00 H ATOM 2230 H GLN A 159 52.765 -11.236 31.444 1.00 0.00 H ATOM 2231 N LEU A 160 54.270 -11.651 28.023 1.00 7.77 N ATOM 2232 CA LEU A 160 54.953 -10.663 27.199 1.00 8.54 C ATOM 2233 C LEU A 160 53.926 -10.040 26.303 1.00 8.26 C ATOM 2234 O LEU A 160 53.211 -10.743 25.556 1.00 10.12 O ATOM 2235 CB LEU A 160 56.075 -11.339 26.376 1.00 7.71 C ATOM 2236 CG LEU A 160 57.201 -11.898 27.247 1.00 8.71 C ATOM 2237 CD1 LEU A 160 58.129 -12.673 26.343 1.00 9.95 C ATOM 2238 CD2 LEU A 160 57.938 -10.805 28.009 1.00 8.66 C ATOM 2239 HA LEU A 160 55.423 -9.897 27.817 1.00 0.00 H ATOM 2240 HB2 LEU A 160 55.640 -12.157 25.802 1.00 0.00 H ATOM 2241 HB3 LEU A 160 56.497 -10.602 25.693 1.00 0.00 H ATOM 2242 HG LEU A 160 56.785 -12.552 28.013 1.00 0.00 H ATOM 2243 HD21 LEU A 160 58.375 -10.102 27.300 1.00 0.00 H ATOM 2244 HD22 LEU A 160 57.237 -10.280 28.658 1.00 0.00 H ATOM 2245 HD23 LEU A 160 58.727 -11.253 28.612 1.00 0.00 H ATOM 2246 HD11 LEU A 160 57.577 -13.483 25.866 1.00 0.00 H ATOM 2247 HD12 LEU A 160 58.531 -12.007 25.580 1.00 0.00 H ATOM 2248 HD13 LEU A 160 58.947 -13.087 26.933 1.00 0.00 H ATOM 2249 H LEU A 160 54.531 -12.655 27.948 1.00 0.00 H ATOM 2250 N ASP A 161 53.867 -8.710 26.321 1.00 6.42 N ATOM 2251 CA ASP A 161 52.823 -7.979 25.599 1.00 6.56 C ATOM 2252 C ASP A 161 53.252 -6.622 25.020 1.00 6.29 C ATOM 2253 O ASP A 161 52.446 -5.919 24.413 1.00 6.16 O ATOM 2254 CB ASP A 161 51.566 -7.839 26.480 1.00 6.44 C ATOM 2255 CG ASP A 161 51.722 -6.839 27.615 1.00 6.55 C ATOM 2256 OD1 ASP A 161 52.684 -6.053 27.621 1.00 7.01 O ATOM 2257 OD2 ASP A 161 50.847 -6.854 28.554 1.00 7.03 O ATOM 2258 HA ASP A 161 52.598 -8.585 24.721 1.00 0.00 H ATOM 2259 HB2 ASP A 161 50.738 -7.517 25.849 1.00 0.00 H ATOM 2260 HB3 ASP A 161 51.336 -8.814 26.910 1.00 0.00 H ATOM 2261 H ASP A 161 54.579 -8.178 26.860 1.00 0.00 H ATOM 2262 N HIS A 162 54.530 -6.291 25.149 1.00 6.49 N ATOM 2263 CA HIS A 162 55.038 -4.986 24.784 1.00 6.28 C ATOM 2264 C HIS A 162 56.520 -5.138 24.449 1.00 6.42 C ATOM 2265 O HIS A 162 57.179 -6.063 24.862 1.00 7.30 O ATOM 2266 CB HIS A 162 54.863 -4.059 26.002 1.00 5.93 C ATOM 2267 CG HIS A 162 55.134 -2.620 25.731 1.00 5.12 C ATOM 2268 ND1 HIS A 162 54.935 -2.031 24.494 1.00 7.72 N ATOM 2269 CD2 HIS A 162 55.521 -1.625 26.563 1.00 6.82 C ATOM 2270 CE1 HIS A 162 55.227 -0.748 24.576 1.00 8.10 C ATOM 2271 NE2 HIS A 162 55.585 -0.467 25.821 1.00 6.94 N ATOM 2272 HA HIS A 162 54.511 -4.570 23.926 1.00 0.00 H ATOM 2273 HB2 HIS A 162 53.836 -4.151 26.355 1.00 0.00 H ATOM 2274 HB3 HIS A 162 55.545 -4.392 26.784 1.00 0.00 H ATOM 2275 HD2 HIS A 162 55.742 -1.723 27.626 1.00 0.00 H ATOM 2276 HE1 HIS A 162 55.181 -0.034 23.754 1.00 0.00 H ATOM 2277 H HIS A 162 55.193 -6.997 25.527 1.00 0.00 H ATOM 2278 N GLY A 163 57.018 -4.199 23.663 1.00 7.02 N ATOM 2279 CA GLY A 163 58.427 -4.107 23.325 1.00 6.69 C ATOM 2280 C GLY A 163 58.927 -2.696 23.639 1.00 6.92 C ATOM 2281 O GLY A 163 58.274 -1.710 23.301 1.00 7.19 O ATOM 2282 HA3 GLY A 163 58.562 -4.314 22.263 1.00 0.00 H ATOM 2283 HA2 GLY A 163 58.991 -4.833 23.911 1.00 0.00 H ATOM 2284 H GLY A 163 56.368 -3.491 23.267 1.00 0.00 H ATOM 2285 N VAL A 164 60.101 -2.625 24.304 1.00 6.98 N ATOM 2286 CA VAL A 164 60.690 -1.378 24.793 1.00 6.62 C ATOM 2287 C VAL A 164 62.201 -1.475 24.615 1.00 7.00 C ATOM 2288 O VAL A 164 62.714 -2.443 24.016 1.00 6.98 O ATOM 2289 CB VAL A 164 60.278 -1.122 26.270 1.00 6.23 C ATOM 2290 CG1 VAL A 164 58.767 -0.823 26.352 1.00 8.73 C ATOM 2291 CG2 VAL A 164 60.700 -2.271 27.176 1.00 7.55 C ATOM 2292 HA VAL A 164 60.322 -0.523 24.225 1.00 0.00 H ATOM 2293 HB VAL A 164 60.808 -0.243 26.636 1.00 0.00 H ATOM 2294 HG11 VAL A 164 58.540 0.062 25.757 1.00 0.00 H ATOM 2295 HG12 VAL A 164 58.208 -1.675 25.966 1.00 0.00 H ATOM 2296 HG13 VAL A 164 58.489 -0.645 27.391 1.00 0.00 H ATOM 2297 HG21 VAL A 164 60.223 -3.191 26.839 1.00 0.00 H ATOM 2298 HG22 VAL A 164 61.783 -2.385 27.135 1.00 0.00 H ATOM 2299 HG23 VAL A 164 60.395 -2.056 28.200 1.00 0.00 H ATOM 2300 H VAL A 164 60.617 -3.511 24.479 1.00 0.00 H ATOM 2301 N LEU A 165 62.938 -0.486 25.112 1.00 6.94 N ATOM 2302 CA LEU A 165 64.397 -0.457 24.918 1.00 6.74 C ATOM 2303 C LEU A 165 65.107 -0.229 26.241 1.00 6.65 C ATOM 2304 O LEU A 165 64.826 0.780 26.905 1.00 6.72 O ATOM 2305 CB LEU A 165 64.722 0.668 23.937 1.00 6.74 C ATOM 2306 CG LEU A 165 66.178 0.806 23.505 1.00 5.66 C ATOM 2307 CD1 LEU A 165 66.611 -0.346 22.609 1.00 7.75 C ATOM 2308 CD2 LEU A 165 66.378 2.127 22.770 1.00 8.50 C ATOM 2309 HA LEU A 165 64.740 -1.412 24.520 1.00 0.00 H ATOM 2310 HB2 LEU A 165 64.126 0.505 23.039 1.00 0.00 H ATOM 2311 HB3 LEU A 165 64.426 1.608 24.403 1.00 0.00 H ATOM 2312 HG LEU A 165 66.794 0.784 24.404 1.00 0.00 H ATOM 2313 HD21 LEU A 165 65.737 2.152 21.889 1.00 0.00 H ATOM 2314 HD22 LEU A 165 66.119 2.953 23.433 1.00 0.00 H ATOM 2315 HD23 LEU A 165 67.421 2.217 22.465 1.00 0.00 H ATOM 2316 HD11 LEU A 165 66.500 -1.286 23.149 1.00 0.00 H ATOM 2317 HD12 LEU A 165 65.987 -0.364 21.715 1.00 0.00 H ATOM 2318 HD13 LEU A 165 67.654 -0.210 22.323 1.00 0.00 H ATOM 2319 H LEU A 165 62.477 0.278 25.646 1.00 0.00 H ATOM 2320 N LEU A 166 65.970 -1.176 26.633 1.00 7.06 N ATOM 2321 CA LEU A 166 66.822 -0.961 27.781 1.00 7.51 C ATOM 2322 C LEU A 166 67.899 0.031 27.394 1.00 6.06 C ATOM 2323 O LEU A 166 68.669 -0.259 26.472 1.00 7.31 O ATOM 2324 CB LEU A 166 67.482 -2.205 28.243 1.00 8.87 C ATOM 2325 CG LEU A 166 66.689 -3.344 28.817 1.00 10.69 C ATOM 2326 CD1 LEU A 166 67.648 -4.525 29.131 1.00 8.47 C ATOM 2327 CD2 LEU A 166 65.950 -2.867 30.070 1.00 11.15 C ATOM 2328 HA LEU A 166 66.197 -0.594 28.595 1.00 0.00 H ATOM 2329 HB2 LEU A 166 68.020 -2.606 27.384 1.00 0.00 H ATOM 2330 HB3 LEU A 166 68.196 -1.908 29.011 1.00 0.00 H ATOM 2331 HG LEU A 166 65.945 -3.692 28.100 1.00 0.00 H ATOM 2332 HD21 LEU A 166 66.674 -2.518 30.807 1.00 0.00 H ATOM 2333 HD22 LEU A 166 65.278 -2.051 29.805 1.00 0.00 H ATOM 2334 HD23 LEU A 166 65.374 -3.693 30.487 1.00 0.00 H ATOM 2335 HD11 LEU A 166 68.140 -4.846 28.213 1.00 0.00 H ATOM 2336 HD12 LEU A 166 68.398 -4.200 29.852 1.00 0.00 H ATOM 2337 HD13 LEU A 166 67.077 -5.354 29.548 1.00 0.00 H ATOM 2338 H LEU A 166 66.027 -2.072 26.108 1.00 0.00 H ATOM 2339 N VAL A 167 67.992 1.130 28.126 1.00 6.46 N ATOM 2340 CA VAL A 167 69.028 2.132 27.849 1.00 6.40 C ATOM 2341 C VAL A 167 70.057 2.283 28.976 1.00 6.41 C ATOM 2342 O VAL A 167 71.031 3.028 28.802 1.00 8.41 O ATOM 2343 CB VAL A 167 68.474 3.504 27.418 1.00 7.42 C ATOM 2344 CG1 VAL A 167 67.613 3.386 26.185 1.00 7.93 C ATOM 2345 CG2 VAL A 167 67.735 4.204 28.557 1.00 9.14 C ATOM 2346 HA VAL A 167 69.556 1.723 26.988 1.00 0.00 H ATOM 2347 HB VAL A 167 69.328 4.131 27.162 1.00 0.00 H ATOM 2348 HG11 VAL A 167 68.207 2.979 25.366 1.00 0.00 H ATOM 2349 HG12 VAL A 167 66.773 2.722 26.392 1.00 0.00 H ATOM 2350 HG13 VAL A 167 67.239 4.372 25.909 1.00 0.00 H ATOM 2351 HG21 VAL A 167 66.899 3.584 28.881 1.00 0.00 H ATOM 2352 HG22 VAL A 167 68.419 4.359 29.391 1.00 0.00 H ATOM 2353 HG23 VAL A 167 67.362 5.167 28.209 1.00 0.00 H ATOM 2354 H VAL A 167 67.323 1.285 28.907 1.00 0.00 H ATOM 2355 N GLY A 168 69.898 1.600 30.105 1.00 7.58 N ATOM 2356 CA GLY A 168 70.897 1.699 31.132 1.00 7.14 C ATOM 2357 C GLY A 168 70.436 0.933 32.343 1.00 7.59 C ATOM 2358 O GLY A 168 69.382 0.274 32.319 1.00 7.41 O ATOM 2359 HA3 GLY A 168 71.046 2.746 31.397 1.00 0.00 H ATOM 2360 HA2 GLY A 168 71.836 1.280 30.770 1.00 0.00 H ATOM 2361 H GLY A 168 69.059 1.001 30.243 1.00 0.00 H ATOM 2362 N TYR A 169 71.222 1.071 33.409 1.00 7.12 N ATOM 2363 CA TYR A 169 70.921 0.435 34.679 1.00 8.06 C ATOM 2364 C TYR A 169 71.694 1.170 35.775 1.00 7.27 C ATOM 2365 O TYR A 169 72.668 1.849 35.484 1.00 7.83 O ATOM 2366 CB TYR A 169 71.251 -1.086 34.651 1.00 7.08 C ATOM 2367 CG TYR A 169 72.715 -1.397 34.515 1.00 6.72 C ATOM 2368 CD1 TYR A 169 73.568 -1.406 35.611 1.00 8.20 C ATOM 2369 CD2 TYR A 169 73.262 -1.617 33.262 1.00 7.57 C ATOM 2370 CE1 TYR A 169 74.932 -1.659 35.465 1.00 9.93 C ATOM 2371 CE2 TYR A 169 74.621 -1.818 33.093 1.00 8.72 C ATOM 2372 CZ TYR A 169 75.461 -1.842 34.195 1.00 9.08 C ATOM 2373 OH TYR A 169 76.786 -2.104 33.987 1.00 8.85 O ATOM 2374 HA TYR A 169 69.852 0.503 34.882 1.00 0.00 H ATOM 2375 HB3 TYR A 169 70.726 -1.534 33.807 1.00 0.00 H ATOM 2376 HB2 TYR A 169 70.892 -1.531 35.579 1.00 0.00 H ATOM 2377 HD2 TYR A 169 72.608 -1.632 32.390 1.00 0.00 H ATOM 2378 HE2 TYR A 169 75.031 -1.957 32.093 1.00 0.00 H ATOM 2379 HE1 TYR A 169 75.577 -1.713 36.342 1.00 0.00 H ATOM 2380 HD1 TYR A 169 73.164 -1.212 36.604 1.00 0.00 H ATOM 2381 HH TYR A 169 77.264 -2.090 34.854 1.00 0.00 H ATOM 2382 H TYR A 169 72.080 1.654 33.329 1.00 0.00 H ATOM 2383 N ASN A 170 71.326 0.904 37.023 1.00 8.34 N ATOM 2384 CA ASN A 170 72.099 1.404 38.164 1.00 9.28 C ATOM 2385 C ASN A 170 72.129 0.336 39.237 1.00 9.31 C ATOM 2386 O ASN A 170 71.087 0.083 39.847 1.00 9.44 O ATOM 2387 CB ASN A 170 71.461 2.700 38.632 1.00 9.58 C ATOM 2388 CG ASN A 170 72.221 3.363 39.751 1.00 11.69 C ATOM 2389 OD1 ASN A 170 73.110 2.769 40.333 1.00 12.53 O ATOM 2390 ND2 ASN A 170 71.790 4.540 40.113 1.00 14.17 N ATOM 2391 HA ASN A 170 73.134 1.619 37.898 1.00 0.00 H ATOM 2392 HB2 ASN A 170 71.415 3.389 37.788 1.00 0.00 H ATOM 2393 HB3 ASN A 170 70.451 2.484 38.979 1.00 0.00 H ATOM 2394 HD22 ASN A 170 71.027 5.001 39.578 1.00 0.00 H ATOM 2395 HD21 ASN A 170 72.210 5.017 40.936 1.00 0.00 H ATOM 2396 H ASN A 170 70.475 0.331 37.194 1.00 0.00 H ATOM 2397 N ASP A 171 73.270 -0.340 39.415 1.00 9.94 N ATOM 2398 CA ASP A 171 73.451 -1.336 40.472 1.00 9.68 C ATOM 2399 C ASP A 171 73.824 -0.773 41.844 1.00 11.22 C ATOM 2400 O ASP A 171 73.836 -1.499 42.832 1.00 12.27 O ATOM 2401 CB ASP A 171 74.521 -2.335 40.049 1.00 9.84 C ATOM 2402 CG ASP A 171 74.056 -3.333 39.012 1.00 9.25 C ATOM 2403 OD1 ASP A 171 72.849 -3.677 38.925 1.00 11.36 O ATOM 2404 OD2 ASP A 171 74.892 -3.903 38.311 1.00 11.43 O ATOM 2405 HA ASP A 171 72.474 -1.803 40.594 1.00 0.00 H ATOM 2406 HB2 ASP A 171 75.364 -1.781 39.637 1.00 0.00 H ATOM 2407 HB3 ASP A 171 74.846 -2.885 40.933 1.00 0.00 H ATOM 2408 H ASP A 171 74.065 -0.149 38.772 1.00 0.00 H ATOM 2409 N SER A 172 74.147 0.494 41.892 1.00 11.03 N ATOM 2410 CA SER A 172 74.530 1.193 43.148 1.00 12.80 C ATOM 2411 C SER A 172 73.369 1.732 43.950 1.00 13.30 C ATOM 2412 O SER A 172 73.525 1.999 45.133 1.00 15.22 O ATOM 2413 CB SER A 172 75.414 2.397 42.809 1.00 13.26 C ATOM 2414 OG SER A 172 76.592 1.961 42.218 1.00 17.40 O ATOM 2415 HA SER A 172 75.035 0.437 43.749 1.00 0.00 H ATOM 2416 HB2 SER A 172 75.647 2.944 43.722 1.00 0.00 H ATOM 2417 HB3 SER A 172 74.884 3.054 42.119 1.00 0.00 H ATOM 2418 HG SER A 172 77.160 2.742 42.001 1.00 0.00 H ATOM 2419 H SER A 172 74.135 1.040 41.007 1.00 0.00 H ATOM 2420 N ALA A 173 72.216 1.928 43.325 1.00 12.95 N ATOM 2421 CA ALA A 173 71.067 2.445 44.008 1.00 13.46 C ATOM 2422 C ALA A 173 70.545 1.466 45.084 1.00 13.57 C ATOM 2423 O ALA A 173 70.780 0.278 45.020 1.00 13.97 O ATOM 2424 CB ALA A 173 69.976 2.700 42.993 1.00 13.58 C ATOM 2425 HA ALA A 173 71.355 3.367 44.513 1.00 0.00 H ATOM 2426 HB1 ALA A 173 70.328 3.424 42.257 1.00 0.00 H ATOM 2427 HB2 ALA A 173 69.721 1.766 42.493 1.00 0.00 H ATOM 2428 HB3 ALA A 173 69.095 3.094 43.500 1.00 0.00 H ATOM 2429 H ALA A 173 72.144 1.701 42.313 1.00 0.00 H ATOM 2430 N ALA A 174 69.851 2.024 46.060 1.00 14.67 N ATOM 2431 CA ALA A 174 69.262 1.282 47.161 1.00 14.68 C ATOM 2432 C ALA A 174 68.430 0.132 46.624 1.00 13.75 C ATOM 2433 O ALA A 174 68.490 -0.985 47.124 1.00 14.31 O ATOM 2434 CB ALA A 174 68.386 2.252 48.025 1.00 16.44 C ATOM 2435 HA ALA A 174 70.049 0.865 47.789 1.00 0.00 H ATOM 2436 HB1 ALA A 174 69.012 3.054 48.417 1.00 0.00 H ATOM 2437 HB2 ALA A 174 67.596 2.676 47.405 1.00 0.00 H ATOM 2438 HB3 ALA A 174 67.942 1.699 48.853 1.00 0.00 H ATOM 2439 H ALA A 174 69.719 3.055 46.039 1.00 0.00 H ATOM 2440 N VAL A 175 67.652 0.442 45.598 1.00 12.38 N ATOM 2441 CA VAL A 175 66.937 -0.560 44.841 1.00 10.11 C ATOM 2442 C VAL A 175 67.508 -0.521 43.412 1.00 8.93 C ATOM 2443 O VAL A 175 67.133 0.357 42.654 1.00 9.72 O ATOM 2444 CB VAL A 175 65.412 -0.286 44.841 1.00 10.21 C ATOM 2445 CG1 VAL A 175 64.664 -1.402 44.042 1.00 9.95 C ATOM 2446 CG2 VAL A 175 64.886 -0.202 46.288 1.00 11.43 C ATOM 2447 HA VAL A 175 67.068 -1.546 45.286 1.00 0.00 H ATOM 2448 HB VAL A 175 65.224 0.670 44.353 1.00 0.00 H ATOM 2449 HG11 VAL A 175 65.025 -1.415 43.014 1.00 0.00 H ATOM 2450 HG12 VAL A 175 64.854 -2.369 44.507 1.00 0.00 H ATOM 2451 HG13 VAL A 175 63.593 -1.197 44.050 1.00 0.00 H ATOM 2452 HG21 VAL A 175 65.080 -1.145 46.799 1.00 0.00 H ATOM 2453 HG22 VAL A 175 65.395 0.607 46.812 1.00 0.00 H ATOM 2454 HG23 VAL A 175 63.813 -0.009 46.273 1.00 0.00 H ATOM 2455 H VAL A 175 67.552 1.441 45.328 1.00 0.00 H ATOM 2456 N PRO A 176 68.379 -1.493 43.050 1.00 8.52 N ATOM 2457 CA PRO A 176 68.967 -1.456 41.714 1.00 8.41 C ATOM 2458 C PRO A 176 67.884 -1.452 40.667 1.00 8.35 C ATOM 2459 O PRO A 176 66.813 -2.046 40.864 1.00 7.10 O ATOM 2460 CB PRO A 176 69.826 -2.713 41.655 1.00 9.49 C ATOM 2461 CG PRO A 176 70.299 -2.891 43.121 1.00 10.04 C ATOM 2462 CD PRO A 176 69.032 -2.483 43.916 1.00 9.69 C ATOM 2463 HA PRO A 176 69.557 -0.560 41.522 1.00 0.00 H ATOM 2464 HD3 PRO A 176 68.383 -3.343 44.081 1.00 0.00 H ATOM 2465 HD2 PRO A 176 69.301 -2.042 44.876 1.00 0.00 H ATOM 2466 HG3 PRO A 176 71.139 -2.235 43.349 1.00 0.00 H ATOM 2467 HG2 PRO A 176 70.580 -3.924 43.325 1.00 0.00 H ATOM 2468 HB2 PRO A 176 69.240 -3.572 41.326 1.00 0.00 H ATOM 2469 HB3 PRO A 176 70.674 -2.575 40.985 1.00 0.00 H ATOM 2470 N TYR A 177 68.115 -0.769 39.554 1.00 7.83 N ATOM 2471 CA TYR A 177 67.084 -0.651 38.541 1.00 8.21 C ATOM 2472 C TYR A 177 67.631 -0.650 37.105 1.00 7.98 C ATOM 2473 O TYR A 177 68.805 -0.398 36.876 1.00 7.74 O ATOM 2474 CB TYR A 177 66.242 0.623 38.757 1.00 8.04 C ATOM 2475 CG TYR A 177 67.032 1.923 38.753 1.00 7.31 C ATOM 2476 CD1 TYR A 177 67.363 2.560 37.560 1.00 8.30 C ATOM 2477 CD2 TYR A 177 67.386 2.540 39.947 1.00 10.18 C ATOM 2478 CE1 TYR A 177 68.094 3.740 37.555 1.00 8.19 C ATOM 2479 CE2 TYR A 177 68.104 3.720 39.959 1.00 9.98 C ATOM 2480 CZ TYR A 177 68.456 4.338 38.781 1.00 9.94 C ATOM 2481 OH TYR A 177 69.159 5.519 38.798 1.00 12.07 O ATOM 2482 HA TYR A 177 66.463 -1.539 38.655 1.00 0.00 H ATOM 2483 HB3 TYR A 177 65.738 0.536 39.719 1.00 0.00 H ATOM 2484 HB2 TYR A 177 65.498 0.676 37.962 1.00 0.00 H ATOM 2485 HD2 TYR A 177 67.091 2.084 40.892 1.00 0.00 H ATOM 2486 HE2 TYR A 177 68.394 4.166 40.910 1.00 0.00 H ATOM 2487 HE1 TYR A 177 68.386 4.201 36.612 1.00 0.00 H ATOM 2488 HD1 TYR A 177 67.043 2.125 36.614 1.00 0.00 H ATOM 2489 HH TYR A 177 69.324 5.817 37.868 1.00 0.00 H ATOM 2490 H TYR A 177 69.040 -0.316 39.407 1.00 0.00 H ATOM 2491 N TRP A 178 66.738 -0.995 36.174 1.00 6.89 N ATOM 2492 CA TRP A 178 66.896 -0.797 34.745 1.00 6.56 C ATOM 2493 C TRP A 178 66.256 0.516 34.339 1.00 6.93 C ATOM 2494 O TRP A 178 65.279 0.949 34.953 1.00 7.39 O ATOM 2495 CB TRP A 178 66.135 -1.901 33.977 1.00 5.89 C ATOM 2496 CG TRP A 178 66.664 -3.280 34.047 1.00 5.27 C ATOM 2497 CD1 TRP A 178 66.095 -4.323 34.677 1.00 7.13 C ATOM 2498 CD2 TRP A 178 67.858 -3.768 33.430 1.00 5.72 C ATOM 2499 NE1 TRP A 178 66.851 -5.441 34.485 1.00 7.22 N ATOM 2500 CE2 TRP A 178 67.938 -5.137 33.706 1.00 6.55 C ATOM 2501 CE3 TRP A 178 68.839 -3.186 32.626 1.00 7.62 C ATOM 2502 CZ2 TRP A 178 68.988 -5.950 33.229 1.00 7.84 C ATOM 2503 CZ3 TRP A 178 69.915 -3.970 32.206 1.00 7.89 C ATOM 2504 CH2 TRP A 178 69.965 -5.340 32.489 1.00 7.41 C ATOM 2505 HA TRP A 178 67.962 -0.813 34.516 1.00 0.00 H ATOM 2506 HB2 TRP A 178 65.116 -1.923 34.364 1.00 0.00 H ATOM 2507 HB3 TRP A 178 66.117 -1.613 32.926 1.00 0.00 H ATOM 2508 HE1 TRP A 178 66.636 -6.382 34.871 1.00 0.00 H ATOM 2509 HD1 TRP A 178 65.171 -4.281 35.253 1.00 0.00 H ATOM 2510 HZ2 TRP A 178 69.020 -7.019 33.441 1.00 0.00 H ATOM 2511 HH2 TRP A 178 70.799 -5.933 32.113 1.00 0.00 H ATOM 2512 HZ3 TRP A 178 70.730 -3.508 31.649 1.00 0.00 H ATOM 2513 HE3 TRP A 178 68.766 -2.139 32.332 1.00 0.00 H ATOM 2514 H TRP A 178 65.857 -1.442 36.500 1.00 0.00 H ATOM 2515 N ILE A 179 66.786 1.165 33.301 1.00 7.49 N ATOM 2516 CA ILE A 179 66.225 2.336 32.720 1.00 7.02 C ATOM 2517 C ILE A 179 65.700 1.992 31.337 1.00 6.91 C ATOM 2518 O ILE A 179 66.465 1.491 30.509 1.00 7.67 O ATOM 2519 CB ILE A 179 67.257 3.479 32.585 1.00 6.60 C ATOM 2520 CG1 ILE A 179 67.962 3.812 33.903 1.00 8.45 C ATOM 2521 CG2 ILE A 179 66.545 4.769 32.005 1.00 8.83 C ATOM 2522 CD1 ILE A 179 69.233 4.660 33.682 1.00 9.95 C ATOM 2523 HA ILE A 179 65.427 2.682 33.377 1.00 0.00 H ATOM 2524 HB ILE A 179 68.031 3.134 31.899 1.00 0.00 H ATOM 2525 HG12 ILE A 179 67.274 4.368 34.540 1.00 0.00 H ATOM 2526 HG13 ILE A 179 68.241 2.882 34.398 1.00 0.00 H ATOM 2527 HD11 ILE A 179 69.931 4.109 33.052 1.00 0.00 H ATOM 2528 HD12 ILE A 179 68.963 5.597 33.194 1.00 0.00 H ATOM 2529 HD13 ILE A 179 69.699 4.871 34.644 1.00 0.00 H ATOM 2530 HG21 ILE A 179 66.125 4.541 31.025 1.00 0.00 H ATOM 2531 HG22 ILE A 179 65.748 5.077 32.681 1.00 0.00 H ATOM 2532 HG23 ILE A 179 67.274 5.574 31.911 1.00 0.00 H ATOM 2533 H ILE A 179 67.665 0.791 32.890 1.00 0.00 H ATOM 2534 N ILE A 180 64.418 2.241 31.093 1.00 6.01 N ATOM 2535 CA ILE A 180 63.722 1.767 29.891 1.00 7.10 C ATOM 2536 C ILE A 180 63.087 2.924 29.167 1.00 6.27 C ATOM 2537 O ILE A 180 62.341 3.696 29.753 1.00 7.64 O ATOM 2538 CB ILE A 180 62.643 0.742 30.270 1.00 7.12 C ATOM 2539 CG1 ILE A 180 63.311 -0.547 30.780 1.00 8.68 C ATOM 2540 CG2 ILE A 180 61.710 0.431 29.097 1.00 8.47 C ATOM 2541 CD1 ILE A 180 62.391 -1.630 31.320 1.00 9.49 C ATOM 2542 HA ILE A 180 64.451 1.291 29.235 1.00 0.00 H ATOM 2543 HB ILE A 180 62.031 1.175 31.061 1.00 0.00 H ATOM 2544 HG12 ILE A 180 63.875 -0.976 29.952 1.00 0.00 H ATOM 2545 HG13 ILE A 180 63.997 -0.269 31.580 1.00 0.00 H ATOM 2546 HD11 ILE A 180 61.826 -1.237 32.165 1.00 0.00 H ATOM 2547 HD12 ILE A 180 61.703 -1.945 30.535 1.00 0.00 H ATOM 2548 HD13 ILE A 180 62.987 -2.482 31.646 1.00 0.00 H ATOM 2549 HG21 ILE A 180 61.213 1.347 28.777 1.00 0.00 H ATOM 2550 HG22 ILE A 180 62.292 0.024 28.270 1.00 0.00 H ATOM 2551 HG23 ILE A 180 60.963 -0.298 29.412 1.00 0.00 H ATOM 2552 H ILE A 180 63.882 2.799 31.788 1.00 0.00 H ATOM 2553 N LYS A 181 63.353 2.983 27.848 1.00 6.72 N ATOM 2554 CA LYS A 181 62.703 3.925 26.947 1.00 7.36 C ATOM 2555 C LYS A 181 61.398 3.338 26.457 1.00 6.95 C ATOM 2556 O LYS A 181 61.384 2.285 25.843 1.00 7.36 O ATOM 2557 CB LYS A 181 63.630 4.231 25.753 1.00 7.46 C ATOM 2558 CG LYS A 181 63.121 5.298 24.833 1.00 8.56 C ATOM 2559 CD LYS A 181 63.929 5.339 23.524 1.00 7.97 C ATOM 2560 CE LYS A 181 63.690 6.633 22.767 1.00 9.63 C ATOM 2561 NZ LYS A 181 64.385 6.733 21.417 1.00 8.62 N ATOM 2562 HA LYS A 181 62.498 4.854 27.480 1.00 0.00 H ATOM 2563 HB2 LYS A 181 64.596 4.550 26.144 1.00 0.00 H ATOM 2564 HB3 LYS A 181 63.757 3.315 25.176 1.00 0.00 H ATOM 2565 HG2 LYS A 181 62.076 5.097 24.599 1.00 0.00 H ATOM 2566 HG3 LYS A 181 63.201 6.264 25.331 1.00 0.00 H ATOM 2567 HD2 LYS A 181 64.990 5.256 23.759 1.00 0.00 H ATOM 2568 HD3 LYS A 181 63.630 4.500 22.896 1.00 0.00 H ATOM 2569 HE2 LYS A 181 64.040 7.457 23.389 1.00 0.00 H ATOM 2570 HE3 LYS A 181 62.617 6.734 22.602 1.00 0.00 H ATOM 2571 HZ1 LYS A 181 65.413 6.654 21.551 1.00 0.00 H ATOM 2572 HZ2 LYS A 181 64.054 5.964 20.800 1.00 0.00 H ATOM 2573 HZ3 LYS A 181 64.161 7.650 20.980 1.00 0.00 H ATOM 2574 H LYS A 181 64.056 2.325 27.454 1.00 0.00 H ATOM 2575 N ASN A 182 60.296 4.039 26.707 1.00 5.93 N ATOM 2576 CA ASN A 182 59.011 3.620 26.214 1.00 7.21 C ATOM 2577 C ASN A 182 58.660 4.530 24.996 1.00 6.55 C ATOM 2578 O ASN A 182 59.378 5.441 24.663 1.00 7.88 O ATOM 2579 CB ASN A 182 57.931 3.693 27.352 1.00 6.83 C ATOM 2580 CG ASN A 182 56.761 2.766 27.144 1.00 6.73 C ATOM 2581 OD1 ASN A 182 56.601 2.138 26.091 1.00 7.23 O ATOM 2582 ND2 ASN A 182 55.883 2.694 28.166 1.00 7.63 N ATOM 2583 HA ASN A 182 59.033 2.579 25.890 1.00 0.00 H ATOM 2584 HB2 ASN A 182 58.410 3.435 28.297 1.00 0.00 H ATOM 2585 HB3 ASN A 182 57.555 4.715 27.403 1.00 0.00 H ATOM 2586 HD22 ASN A 182 56.052 3.238 29.036 1.00 0.00 H ATOM 2587 HD21 ASN A 182 55.037 2.095 28.083 1.00 0.00 H ATOM 2588 H ASN A 182 60.365 4.910 27.272 1.00 0.00 H ATOM 2589 N SER A 183 57.534 4.236 24.338 1.00 7.30 N ATOM 2590 CA SER A 183 57.101 4.899 23.133 1.00 6.54 C ATOM 2591 C SER A 183 55.690 5.409 23.268 1.00 7.94 C ATOM 2592 O SER A 183 54.896 5.322 22.324 1.00 8.54 O ATOM 2593 CB SER A 183 57.201 3.931 21.939 1.00 7.01 C ATOM 2594 OG SER A 183 56.617 2.656 22.190 1.00 7.89 O ATOM 2595 HA SER A 183 57.754 5.755 22.962 1.00 0.00 H ATOM 2596 HB2 SER A 183 58.254 3.787 21.699 1.00 0.00 H ATOM 2597 HB3 SER A 183 56.693 4.381 21.086 1.00 0.00 H ATOM 2598 HG SER A 183 55.656 2.770 22.400 1.00 0.00 H ATOM 2599 H SER A 183 56.931 3.480 24.720 1.00 0.00 H ATOM 2600 N TRP A 184 55.401 5.975 24.446 1.00 7.71 N ATOM 2601 CA TRP A 184 54.075 6.474 24.797 1.00 8.03 C ATOM 2602 C TRP A 184 54.098 7.958 25.120 1.00 8.95 C ATOM 2603 O TRP A 184 53.290 8.440 25.897 1.00 9.57 O ATOM 2604 CB TRP A 184 53.445 5.662 25.960 1.00 8.00 C ATOM 2605 CG TRP A 184 53.248 4.202 25.747 1.00 7.63 C ATOM 2606 CD1 TRP A 184 53.319 3.495 24.576 1.00 7.74 C ATOM 2607 CD2 TRP A 184 52.944 3.251 26.774 1.00 6.48 C ATOM 2608 NE1 TRP A 184 53.078 2.148 24.832 1.00 8.19 N ATOM 2609 CE2 TRP A 184 52.873 1.987 26.175 1.00 7.72 C ATOM 2610 CE3 TRP A 184 52.779 3.353 28.169 1.00 7.99 C ATOM 2611 CZ2 TRP A 184 52.636 0.844 26.905 1.00 8.73 C ATOM 2612 CZ3 TRP A 184 52.516 2.212 28.896 1.00 8.28 C ATOM 2613 CH2 TRP A 184 52.445 0.978 28.260 1.00 8.60 C ATOM 2614 HA TRP A 184 53.445 6.338 23.918 1.00 0.00 H ATOM 2615 HB2 TRP A 184 54.090 5.782 26.830 1.00 0.00 H ATOM 2616 HB3 TRP A 184 52.468 6.097 26.171 1.00 0.00 H ATOM 2617 HE1 TRP A 184 53.057 1.390 24.120 1.00 0.00 H ATOM 2618 HD1 TRP A 184 53.531 3.921 23.595 1.00 0.00 H ATOM 2619 HZ2 TRP A 184 52.601 -0.134 26.425 1.00 0.00 H ATOM 2620 HH2 TRP A 184 52.231 0.089 28.854 1.00 0.00 H ATOM 2621 HZ3 TRP A 184 52.363 2.277 29.973 1.00 0.00 H ATOM 2622 HE3 TRP A 184 52.858 4.320 28.666 1.00 0.00 H ATOM 2623 H TRP A 184 56.162 6.064 25.149 1.00 0.00 H ATOM 2624 N THR A 185 54.951 8.699 24.407 1.00 9.14 N ATOM 2625 CA THR A 185 55.228 10.130 24.605 1.00 10.32 C ATOM 2626 C THR A 185 56.058 10.435 25.851 1.00 9.95 C ATOM 2627 O THR A 185 56.146 9.630 26.744 1.00 9.81 O ATOM 2628 CB THR A 185 53.968 11.037 24.651 1.00 10.46 C ATOM 2629 OG1 THR A 185 53.391 11.062 25.957 1.00 11.29 O ATOM 2630 CG2 THR A 185 52.902 10.662 23.564 1.00 11.48 C ATOM 2631 HA THR A 185 55.803 10.368 23.710 1.00 0.00 H ATOM 2632 HB THR A 185 54.309 12.044 24.411 1.00 0.00 H ATOM 2633 HG1 THR A 185 53.128 10.144 26.218 1.00 0.00 H ATOM 2634 HG23 THR A 185 53.375 10.652 22.582 1.00 0.00 H ATOM 2635 HG21 THR A 185 52.494 9.675 23.782 1.00 0.00 H ATOM 2636 HG22 THR A 185 52.099 11.399 23.575 1.00 0.00 H ATOM 2637 H THR A 185 55.467 8.220 23.641 1.00 0.00 H ATOM 2638 N THR A 186 56.574 11.659 25.945 1.00 11.20 N ATOM 2639 CA THR A 186 57.242 12.098 27.173 1.00 13.04 C ATOM 2640 C THR A 186 56.283 12.440 28.306 1.00 13.03 C ATOM 2641 O THR A 186 56.723 12.718 29.425 1.00 13.75 O ATOM 2642 CB THR A 186 58.099 13.305 26.915 1.00 13.26 C ATOM 2643 OG1 THR A 186 57.270 14.347 26.413 1.00 16.41 O ATOM 2644 CG2 THR A 186 59.188 12.977 25.904 1.00 12.52 C ATOM 2645 HA THR A 186 57.845 11.245 27.484 1.00 0.00 H ATOM 2646 HB THR A 186 58.578 13.619 27.842 1.00 0.00 H ATOM 2647 HG1 THR A 186 57.821 15.150 26.238 1.00 0.00 H ATOM 2648 HG23 THR A 186 59.818 12.179 26.296 1.00 0.00 H ATOM 2649 HG21 THR A 186 58.729 12.654 24.970 1.00 0.00 H ATOM 2650 HG22 THR A 186 59.794 13.865 25.724 1.00 0.00 H ATOM 2651 H THR A 186 56.502 12.311 25.138 1.00 0.00 H ATOM 2652 N GLN A 187 54.980 12.416 28.058 1.00 14.49 N ATOM 2653 CA GLN A 187 54.007 12.709 29.127 1.00 15.53 C ATOM 2654 C GLN A 187 53.755 11.507 30.029 1.00 15.28 C ATOM 2655 O GLN A 187 53.178 11.640 31.102 1.00 18.13 O ATOM 2656 CB GLN A 187 52.673 13.242 28.546 1.00 16.28 C ATOM 2657 CG GLN A 187 52.846 14.447 27.604 1.00 23.42 C ATOM 2658 CD GLN A 187 53.704 15.558 28.175 1.00 26.78 C ATOM 2659 OE1 GLN A 187 53.580 15.917 29.346 1.00 28.06 O ATOM 2660 NE2 GLN A 187 54.576 16.118 27.343 1.00 28.25 N ATOM 2661 HA GLN A 187 54.452 13.490 29.743 1.00 0.00 H ATOM 2662 HB2 GLN A 187 52.193 12.436 27.990 1.00 0.00 H ATOM 2663 HB3 GLN A 187 52.032 13.542 29.375 1.00 0.00 H ATOM 2664 HG2 GLN A 187 53.308 14.097 26.681 1.00 0.00 H ATOM 2665 HG3 GLN A 187 51.859 14.854 27.384 1.00 0.00 H ATOM 2666 HE22 GLN A 187 54.647 15.783 26.361 1.00 0.00 H ATOM 2667 HE21 GLN A 187 55.187 16.892 27.674 1.00 0.00 H ATOM 2668 H GLN A 187 54.642 12.189 27.101 1.00 0.00 H ATOM 2669 N TRP A 188 54.213 10.326 29.605 1.00 12.37 N ATOM 2670 CA TRP A 188 54.063 9.111 30.367 1.00 11.30 C ATOM 2671 C TRP A 188 55.343 8.898 31.172 1.00 10.39 C ATOM 2672 O TRP A 188 56.449 9.108 30.677 1.00 10.06 O ATOM 2673 CB TRP A 188 53.839 7.898 29.438 1.00 11.02 C ATOM 2674 CG TRP A 188 53.684 6.622 30.176 1.00 9.92 C ATOM 2675 CD1 TRP A 188 52.524 6.079 30.717 1.00 10.87 C ATOM 2676 CD2 TRP A 188 54.720 5.707 30.493 1.00 7.83 C ATOM 2677 NE1 TRP A 188 52.799 4.921 31.349 1.00 12.43 N ATOM 2678 CE2 TRP A 188 54.136 4.638 31.233 1.00 7.93 C ATOM 2679 CE3 TRP A 188 56.097 5.669 30.237 1.00 7.33 C ATOM 2680 CZ2 TRP A 188 54.892 3.594 31.724 1.00 9.75 C ATOM 2681 CZ3 TRP A 188 56.834 4.605 30.702 1.00 9.12 C ATOM 2682 CH2 TRP A 188 56.218 3.566 31.426 1.00 9.67 C ATOM 2683 HA TRP A 188 53.197 9.201 31.022 1.00 0.00 H ATOM 2684 HB2 TRP A 188 52.937 8.072 28.851 1.00 0.00 H ATOM 2685 HB3 TRP A 188 54.695 7.810 28.769 1.00 0.00 H ATOM 2686 HE1 TRP A 188 52.103 4.331 31.849 1.00 0.00 H ATOM 2687 HD1 TRP A 188 51.533 6.526 30.641 1.00 0.00 H ATOM 2688 HZ2 TRP A 188 54.439 2.813 32.334 1.00 0.00 H ATOM 2689 HH2 TRP A 188 56.819 2.719 31.756 1.00 0.00 H ATOM 2690 HZ3 TRP A 188 57.906 4.566 30.508 1.00 0.00 H ATOM 2691 HE3 TRP A 188 56.577 6.471 29.677 1.00 0.00 H ATOM 2692 H TRP A 188 54.698 10.281 28.686 1.00 0.00 H ATOM 2693 N GLY A 189 55.203 8.452 32.408 1.00 9.94 N ATOM 2694 CA GLY A 189 56.361 8.049 33.179 1.00 9.67 C ATOM 2695 C GLY A 189 57.303 9.165 33.489 1.00 10.72 C ATOM 2696 O GLY A 189 56.876 10.281 33.746 1.00 11.73 O ATOM 2697 HA3 GLY A 189 56.902 7.290 32.614 1.00 0.00 H ATOM 2698 HA2 GLY A 189 56.015 7.621 34.120 1.00 0.00 H ATOM 2699 H GLY A 189 54.255 8.390 32.830 1.00 0.00 H ATOM 2700 N GLU A 190 58.579 8.853 33.467 1.00 9.61 N ATOM 2701 CA GLU A 190 59.618 9.816 33.810 1.00 9.01 C ATOM 2702 C GLU A 190 60.126 10.389 32.475 1.00 9.43 C ATOM 2703 O GLU A 190 61.097 9.892 31.885 1.00 9.06 O ATOM 2704 CB GLU A 190 60.742 9.163 34.625 1.00 9.34 C ATOM 2705 CG GLU A 190 60.229 8.595 35.957 1.00 9.83 C ATOM 2706 CD GLU A 190 61.264 7.970 36.875 1.00 10.05 C ATOM 2707 OE1 GLU A 190 62.277 7.417 36.383 1.00 11.50 O ATOM 2708 OE2 GLU A 190 61.075 8.054 38.121 1.00 10.46 O ATOM 2709 HA GLU A 190 59.229 10.611 34.446 1.00 0.00 H ATOM 2710 HB2 GLU A 190 61.176 8.352 34.040 1.00 0.00 H ATOM 2711 HB3 GLU A 190 61.508 9.911 34.832 1.00 0.00 H ATOM 2712 HG2 GLU A 190 59.752 9.410 36.502 1.00 0.00 H ATOM 2713 HG3 GLU A 190 59.487 7.831 35.727 1.00 0.00 H ATOM 2714 H GLU A 190 58.857 7.888 33.196 1.00 0.00 H ATOM 2715 N GLU A 191 59.437 11.387 31.979 1.00 9.78 N ATOM 2716 CA GLU A 191 59.766 11.956 30.667 1.00 9.51 C ATOM 2717 C GLU A 191 59.832 10.885 29.578 1.00 8.62 C ATOM 2718 O GLU A 191 60.636 10.947 28.649 1.00 9.60 O ATOM 2719 CB GLU A 191 61.064 12.769 30.726 1.00 11.38 C ATOM 2720 CG GLU A 191 60.883 13.986 31.642 1.00 16.82 C ATOM 2721 CD GLU A 191 59.841 15.003 31.110 1.00 24.70 C ATOM 2722 OE1 GLU A 191 59.862 15.397 29.899 1.00 28.71 O ATOM 2723 OE2 GLU A 191 58.959 15.383 31.905 1.00 33.00 O ATOM 2724 HA GLU A 191 58.956 12.635 30.399 1.00 0.00 H ATOM 2725 HB2 GLU A 191 61.866 12.141 31.115 1.00 0.00 H ATOM 2726 HB3 GLU A 191 61.323 13.108 29.723 1.00 0.00 H ATOM 2727 HG2 GLU A 191 60.557 13.637 32.622 1.00 0.00 H ATOM 2728 HG3 GLU A 191 61.843 14.493 31.739 1.00 0.00 H ATOM 2729 H GLU A 191 58.644 11.782 32.524 1.00 0.00 H ATOM 2730 N GLY A 192 58.895 9.951 29.642 1.00 7.80 N ATOM 2731 CA GLY A 192 58.807 8.878 28.678 1.00 8.98 C ATOM 2732 C GLY A 192 59.533 7.598 29.005 1.00 8.63 C ATOM 2733 O GLY A 192 59.410 6.654 28.231 1.00 7.33 O ATOM 2734 HA3 GLY A 192 59.207 9.250 27.735 1.00 0.00 H ATOM 2735 HA2 GLY A 192 57.752 8.634 28.553 1.00 0.00 H ATOM 2736 H GLY A 192 58.198 9.991 30.413 1.00 0.00 H ATOM 2737 N TYR A 193 60.271 7.568 30.110 1.00 8.67 N ATOM 2738 CA TYR A 193 61.044 6.452 30.561 1.00 7.78 C ATOM 2739 C TYR A 193 60.394 5.824 31.790 1.00 7.76 C ATOM 2740 O TYR A 193 59.597 6.434 32.499 1.00 8.29 O ATOM 2741 CB TYR A 193 62.487 6.906 30.902 1.00 8.47 C ATOM 2742 CG TYR A 193 63.289 7.267 29.676 1.00 8.74 C ATOM 2743 CD1 TYR A 193 64.142 6.344 29.113 1.00 8.36 C ATOM 2744 CD2 TYR A 193 63.168 8.493 29.047 1.00 9.42 C ATOM 2745 CE1 TYR A 193 64.847 6.623 27.975 1.00 9.45 C ATOM 2746 CE2 TYR A 193 63.913 8.797 27.874 1.00 8.91 C ATOM 2747 CZ TYR A 193 64.727 7.830 27.362 1.00 10.01 C ATOM 2748 OH TYR A 193 65.431 8.088 26.202 1.00 14.45 O ATOM 2749 HA TYR A 193 61.084 5.710 29.764 1.00 0.00 H ATOM 2750 HB3 TYR A 193 62.994 6.095 31.424 1.00 0.00 H ATOM 2751 HB2 TYR A 193 62.434 7.778 31.553 1.00 0.00 H ATOM 2752 HD2 TYR A 193 62.489 9.240 29.458 1.00 0.00 H ATOM 2753 HE2 TYR A 193 63.836 9.775 27.398 1.00 0.00 H ATOM 2754 HE1 TYR A 193 65.513 5.869 27.555 1.00 0.00 H ATOM 2755 HD1 TYR A 193 64.258 5.369 29.585 1.00 0.00 H ATOM 2756 HH TYR A 193 64.796 8.290 25.470 1.00 0.00 H ATOM 2757 H TYR A 193 60.288 8.427 30.695 1.00 0.00 H ATOM 2758 N ILE A 194 60.765 4.580 32.051 1.00 6.47 N ATOM 2759 CA ILE A 194 60.384 3.915 33.298 1.00 6.79 C ATOM 2760 C ILE A 194 61.629 3.259 33.909 1.00 7.13 C ATOM 2761 O ILE A 194 62.481 2.701 33.184 1.00 8.02 O ATOM 2762 CB ILE A 194 59.237 2.910 33.086 1.00 6.68 C ATOM 2763 CG1 ILE A 194 58.994 2.081 34.339 1.00 7.02 C ATOM 2764 CG2 ILE A 194 59.502 1.934 31.826 1.00 9.34 C ATOM 2765 CD1 ILE A 194 57.626 1.316 34.297 1.00 8.11 C ATOM 2766 HA ILE A 194 59.997 4.656 33.998 1.00 0.00 H ATOM 2767 HB ILE A 194 58.346 3.500 32.871 1.00 0.00 H ATOM 2768 HG12 ILE A 194 59.799 1.353 34.438 1.00 0.00 H ATOM 2769 HG13 ILE A 194 58.997 2.745 35.204 1.00 0.00 H ATOM 2770 HD11 ILE A 194 56.812 2.035 34.206 1.00 0.00 H ATOM 2771 HD12 ILE A 194 57.614 0.642 33.440 1.00 0.00 H ATOM 2772 HD13 ILE A 194 57.504 0.741 35.215 1.00 0.00 H ATOM 2773 HG21 ILE A 194 59.600 2.531 30.920 1.00 0.00 H ATOM 2774 HG22 ILE A 194 60.420 1.370 31.992 1.00 0.00 H ATOM 2775 HG23 ILE A 194 58.664 1.245 31.720 1.00 0.00 H ATOM 2776 H ILE A 194 61.340 4.064 31.355 1.00 0.00 H ATOM 2777 N ARG A 195 61.726 3.299 35.246 1.00 7.24 N ATOM 2778 CA ARG A 195 62.701 2.450 35.968 1.00 7.33 C ATOM 2779 C ARG A 195 61.954 1.285 36.582 1.00 7.70 C ATOM 2780 O ARG A 195 61.003 1.473 37.327 1.00 7.98 O ATOM 2781 CB ARG A 195 63.435 3.278 37.022 1.00 7.74 C ATOM 2782 CG ARG A 195 64.338 4.366 36.420 1.00 8.89 C ATOM 2783 CD ARG A 195 65.009 5.161 37.521 1.00 9.20 C ATOM 2784 NE ARG A 195 64.046 6.044 38.133 1.00 10.52 N ATOM 2785 CZ ARG A 195 64.085 6.430 39.396 1.00 10.38 C ATOM 2786 NH1 ARG A 195 65.097 6.045 40.188 1.00 10.84 N ATOM 2787 NH2 ARG A 195 63.138 7.246 39.861 1.00 11.47 N ATOM 2788 HA ARG A 195 63.456 2.061 35.285 1.00 0.00 H ATOM 2789 HB2 ARG A 195 62.695 3.758 37.663 1.00 0.00 H ATOM 2790 HB3 ARG A 195 64.052 2.608 37.621 1.00 0.00 H ATOM 2791 HG2 ARG A 195 65.101 3.897 35.798 1.00 0.00 H ATOM 2792 HG3 ARG A 195 63.735 5.037 35.808 1.00 0.00 H ATOM 2793 HD2 ARG A 195 65.825 5.749 37.100 1.00 0.00 H ATOM 2794 HD3 ARG A 195 65.405 4.478 38.273 1.00 0.00 H ATOM 2795 HE ARG A 195 63.269 6.400 37.540 1.00 0.00 H ATOM 2796 HH12 ARG A 195 65.125 6.351 41.182 1.00 0.00 H ATOM 2797 HH11 ARG A 195 65.854 5.441 39.808 1.00 0.00 H ATOM 2798 HH22 ARG A 195 63.160 7.556 40.854 1.00 0.00 H ATOM 2799 HH21 ARG A 195 62.378 7.573 39.231 1.00 0.00 H ATOM 2800 H ARG A 195 61.106 3.937 35.785 1.00 0.00 H ATOM 2801 N ILE A 196 62.395 0.084 36.248 1.00 6.08 N ATOM 2802 CA ILE A 196 61.936 -1.144 36.919 1.00 5.78 C ATOM 2803 C ILE A 196 63.076 -1.735 37.717 1.00 6.70 C ATOM 2804 O ILE A 196 64.261 -1.631 37.330 1.00 7.43 O ATOM 2805 CB ILE A 196 61.291 -2.196 35.929 1.00 6.72 C ATOM 2806 CG1 ILE A 196 62.336 -2.792 34.996 1.00 8.28 C ATOM 2807 CG2 ILE A 196 60.177 -1.482 35.109 1.00 7.58 C ATOM 2808 CD1 ILE A 196 61.787 -3.815 34.036 1.00 8.26 C ATOM 2809 HA ILE A 196 61.128 -0.871 37.598 1.00 0.00 H ATOM 2810 HB ILE A 196 60.866 -3.018 36.506 1.00 0.00 H ATOM 2811 HG12 ILE A 196 62.781 -1.983 34.417 1.00 0.00 H ATOM 2812 HG13 ILE A 196 63.106 -3.269 35.603 1.00 0.00 H ATOM 2813 HD11 ILE A 196 61.348 -4.640 34.598 1.00 0.00 H ATOM 2814 HD12 ILE A 196 61.023 -3.352 33.411 1.00 0.00 H ATOM 2815 HD13 ILE A 196 62.594 -4.191 33.407 1.00 0.00 H ATOM 2816 HG21 ILE A 196 59.418 -1.096 35.789 1.00 0.00 H ATOM 2817 HG22 ILE A 196 60.614 -0.658 34.545 1.00 0.00 H ATOM 2818 HG23 ILE A 196 59.721 -2.194 34.421 1.00 0.00 H ATOM 2819 H ILE A 196 63.093 0.003 35.482 1.00 0.00 H ATOM 2820 N ALA A 197 62.741 -2.393 38.812 1.00 7.01 N ATOM 2821 CA ALA A 197 63.781 -2.992 39.633 1.00 6.89 C ATOM 2822 C ALA A 197 64.549 -4.009 38.822 1.00 7.07 C ATOM 2823 O ALA A 197 63.973 -4.648 37.936 1.00 6.84 O ATOM 2824 CB ALA A 197 63.209 -3.630 40.905 1.00 6.87 C ATOM 2825 HA ALA A 197 64.459 -2.200 39.951 1.00 0.00 H ATOM 2826 HB1 ALA A 197 62.703 -2.867 41.497 1.00 0.00 H ATOM 2827 HB2 ALA A 197 62.498 -4.410 40.631 1.00 0.00 H ATOM 2828 HB3 ALA A 197 64.021 -4.065 41.488 1.00 0.00 H ATOM 2829 H ALA A 197 61.741 -2.482 39.085 1.00 0.00 H ATOM 2830 N LYS A 198 65.825 -4.178 39.139 1.00 6.94 N ATOM 2831 CA LYS A 198 66.743 -5.048 38.414 1.00 7.06 C ATOM 2832 C LYS A 198 67.200 -6.189 39.356 1.00 7.66 C ATOM 2833 O LYS A 198 67.620 -5.925 40.491 1.00 7.66 O ATOM 2834 CB LYS A 198 67.958 -4.228 37.953 1.00 7.09 C ATOM 2835 CG LYS A 198 69.049 -5.061 37.281 1.00 7.27 C ATOM 2836 CD LYS A 198 70.103 -4.125 36.664 1.00 9.21 C ATOM 2837 CE LYS A 198 71.293 -4.956 36.137 1.00 10.40 C ATOM 2838 NZ LYS A 198 72.125 -5.573 37.202 1.00 10.93 N ATOM 2839 HA LYS A 198 66.249 -5.474 37.541 1.00 0.00 H ATOM 2840 HB2 LYS A 198 67.615 -3.475 37.244 1.00 0.00 H ATOM 2841 HB3 LYS A 198 68.390 -3.735 38.824 1.00 0.00 H ATOM 2842 HG2 LYS A 198 69.523 -5.704 38.022 1.00 0.00 H ATOM 2843 HG3 LYS A 198 68.606 -5.676 36.498 1.00 0.00 H ATOM 2844 HD2 LYS A 198 69.656 -3.569 35.840 1.00 0.00 H ATOM 2845 HD3 LYS A 198 70.456 -3.427 37.423 1.00 0.00 H ATOM 2846 HE2 LYS A 198 71.930 -4.302 35.541 1.00 0.00 H ATOM 2847 HE3 LYS A 198 70.901 -5.753 35.505 1.00 0.00 H ATOM 2848 HZ1 LYS A 198 72.519 -4.826 37.809 1.00 0.00 H ATOM 2849 HZ2 LYS A 198 71.536 -6.211 37.774 1.00 0.00 H ATOM 2850 HZ3 LYS A 198 72.900 -6.112 36.766 1.00 0.00 H ATOM 2851 H LYS A 198 66.195 -3.656 39.959 1.00 0.00 H ATOM 2852 N GLY A 199 67.065 -7.420 38.889 1.00 7.13 N ATOM 2853 CA GLY A 199 67.458 -8.608 39.638 1.00 7.39 C ATOM 2854 C GLY A 199 66.367 -9.620 39.892 1.00 6.82 C ATOM 2855 O GLY A 199 66.647 -10.699 40.366 1.00 7.28 O ATOM 2856 HA3 GLY A 199 67.842 -8.282 40.604 1.00 0.00 H ATOM 2857 HA2 GLY A 199 68.252 -9.106 39.082 1.00 0.00 H ATOM 2858 H GLY A 199 66.658 -7.546 37.940 1.00 0.00 H ATOM 2859 N SER A 200 65.129 -9.225 39.639 1.00 6.23 N ATOM 2860 CA SER A 200 63.947 -10.023 39.969 1.00 6.50 C ATOM 2861 C SER A 200 63.060 -10.326 38.789 1.00 7.19 C ATOM 2862 O SER A 200 61.893 -10.710 38.937 1.00 7.95 O ATOM 2863 CB SER A 200 63.167 -9.333 41.059 1.00 7.89 C ATOM 2864 OG SER A 200 62.687 -8.096 40.655 1.00 7.43 O ATOM 2865 HA SER A 200 64.308 -10.992 40.314 1.00 0.00 H ATOM 2866 HB2 SER A 200 63.818 -9.193 41.922 1.00 0.00 H ATOM 2867 HB3 SER A 200 62.323 -9.963 41.340 1.00 0.00 H ATOM 2868 HG SER A 200 63.448 -7.514 40.404 1.00 0.00 H ATOM 2869 H SER A 200 64.989 -8.301 39.183 1.00 0.00 H ATOM 2870 N ASN A 201 63.643 -10.272 37.602 1.00 5.92 N ATOM 2871 CA ASN A 201 62.896 -10.473 36.353 1.00 6.71 C ATOM 2872 C ASN A 201 61.582 -9.690 36.291 1.00 6.75 C ATOM 2873 O ASN A 201 60.543 -10.191 35.800 1.00 7.53 O ATOM 2874 CB ASN A 201 62.697 -11.960 36.058 1.00 6.77 C ATOM 2875 CG ASN A 201 62.404 -12.236 34.599 1.00 7.66 C ATOM 2876 OD1 ASN A 201 62.808 -11.444 33.725 1.00 7.54 O ATOM 2877 ND2 ASN A 201 61.682 -13.320 34.323 1.00 9.76 N ATOM 2878 HA ASN A 201 63.514 -10.055 35.559 1.00 0.00 H ATOM 2879 HB2 ASN A 201 63.604 -12.495 36.338 1.00 0.00 H ATOM 2880 HB3 ASN A 201 61.862 -12.325 36.656 1.00 0.00 H ATOM 2881 HD22 ASN A 201 61.371 -13.947 35.092 1.00 0.00 H ATOM 2882 HD21 ASN A 201 61.429 -13.540 33.338 1.00 0.00 H ATOM 2883 H ASN A 201 64.664 -10.081 37.552 1.00 0.00 H ATOM 2884 N GLN A 202 61.626 -8.440 36.729 1.00 6.09 N ATOM 2885 CA GLN A 202 60.469 -7.585 36.650 1.00 6.47 C ATOM 2886 C GLN A 202 59.947 -7.537 35.243 1.00 7.68 C ATOM 2887 O GLN A 202 60.682 -7.248 34.315 1.00 6.85 O ATOM 2888 CB GLN A 202 60.773 -6.160 37.122 1.00 6.63 C ATOM 2889 CG GLN A 202 61.102 -6.009 38.589 1.00 7.25 C ATOM 2890 CD GLN A 202 59.904 -6.094 39.497 1.00 7.55 C ATOM 2891 OE1 GLN A 202 58.908 -5.458 39.260 1.00 8.48 O ATOM 2892 NE2 GLN A 202 60.049 -6.760 40.601 1.00 7.19 N ATOM 2893 HA GLN A 202 59.715 -8.011 37.312 1.00 0.00 H ATOM 2894 HB2 GLN A 202 61.624 -5.792 36.549 1.00 0.00 H ATOM 2895 HB3 GLN A 202 59.899 -5.544 36.910 1.00 0.00 H ATOM 2896 HG2 GLN A 202 61.800 -6.799 38.867 1.00 0.00 H ATOM 2897 HG3 GLN A 202 61.576 -5.039 38.736 1.00 0.00 H ATOM 2898 HE22 GLN A 202 60.922 -7.298 40.773 1.00 0.00 H ATOM 2899 HE21 GLN A 202 59.292 -6.756 41.314 1.00 0.00 H ATOM 2900 H GLN A 202 62.509 -8.071 37.136 1.00 0.00 H ATOM 2901 N CYS A 203 58.640 -7.740 35.106 1.00 6.06 N ATOM 2902 CA CYS A 203 57.993 -7.604 33.813 1.00 6.25 C ATOM 2903 C CYS A 203 58.512 -8.620 32.787 1.00 7.34 C ATOM 2904 O CYS A 203 58.253 -8.461 31.581 1.00 7.20 O ATOM 2905 CB CYS A 203 58.128 -6.187 33.227 1.00 6.76 C ATOM 2906 SG CYS A 203 57.981 -4.839 34.378 1.00 7.54 S ATOM 2907 HA CYS A 203 56.939 -7.803 34.005 1.00 0.00 H ATOM 2908 HB2 CYS A 203 57.352 -6.065 32.472 1.00 0.00 H ATOM 2909 HB3 CYS A 203 59.108 -6.115 32.755 1.00 0.00 H ATOM 2910 H CYS A 203 58.072 -8.000 35.938 1.00 0.00 H ATOM 2911 N LEU A 204 59.176 -9.676 33.243 1.00 6.58 N ATOM 2912 CA LEU A 204 59.780 -10.669 32.382 1.00 7.44 C ATOM 2913 C LEU A 204 60.851 -10.072 31.455 1.00 7.06 C ATOM 2914 O LEU A 204 61.116 -10.623 30.370 1.00 7.14 O ATOM 2915 CB LEU A 204 58.706 -11.387 31.549 1.00 7.09 C ATOM 2916 CG LEU A 204 57.559 -12.030 32.322 1.00 7.26 C ATOM 2917 CD1 LEU A 204 56.536 -12.632 31.393 1.00 8.83 C ATOM 2918 CD2 LEU A 204 58.081 -13.068 33.359 1.00 9.79 C ATOM 2919 HA LEU A 204 60.277 -11.389 33.033 1.00 0.00 H ATOM 2920 HB2 LEU A 204 58.275 -10.657 30.864 1.00 0.00 H ATOM 2921 HB3 LEU A 204 59.201 -12.172 30.977 1.00 0.00 H ATOM 2922 HG LEU A 204 57.058 -11.240 32.882 1.00 0.00 H ATOM 2923 HD21 LEU A 204 58.631 -13.853 32.840 1.00 0.00 H ATOM 2924 HD22 LEU A 204 58.740 -12.570 34.070 1.00 0.00 H ATOM 2925 HD23 LEU A 204 57.236 -13.505 33.890 1.00 0.00 H ATOM 2926 HD11 LEU A 204 56.126 -11.852 30.751 1.00 0.00 H ATOM 2927 HD12 LEU A 204 57.011 -13.397 30.779 1.00 0.00 H ATOM 2928 HD13 LEU A 204 55.734 -13.081 31.979 1.00 0.00 H ATOM 2929 H LEU A 204 59.266 -9.795 34.272 1.00 0.00 H ATOM 2930 N VAL A 205 61.548 -9.065 31.954 1.00 6.74 N ATOM 2931 CA VAL A 205 62.493 -8.276 31.163 1.00 7.54 C ATOM 2932 C VAL A 205 63.644 -9.115 30.617 1.00 7.36 C ATOM 2933 O VAL A 205 64.205 -8.724 29.584 1.00 7.50 O ATOM 2934 CB VAL A 205 63.045 -7.073 31.983 1.00 6.90 C ATOM 2935 CG1 VAL A 205 63.897 -7.562 33.168 1.00 8.35 C ATOM 2936 CG2 VAL A 205 63.800 -6.083 31.065 1.00 8.30 C ATOM 2937 HA VAL A 205 61.935 -7.894 30.308 1.00 0.00 H ATOM 2938 HB VAL A 205 62.206 -6.523 32.410 1.00 0.00 H ATOM 2939 HG11 VAL A 205 63.285 -8.182 33.823 1.00 0.00 H ATOM 2940 HG12 VAL A 205 64.737 -8.147 32.793 1.00 0.00 H ATOM 2941 HG13 VAL A 205 64.271 -6.702 33.724 1.00 0.00 H ATOM 2942 HG21 VAL A 205 64.635 -6.596 30.588 1.00 0.00 H ATOM 2943 HG22 VAL A 205 63.119 -5.706 30.302 1.00 0.00 H ATOM 2944 HG23 VAL A 205 64.176 -5.251 31.661 1.00 0.00 H ATOM 2945 H VAL A 205 61.418 -8.822 32.957 1.00 0.00 H ATOM 2946 N LYS A 206 63.986 -10.252 31.219 1.00 7.80 N ATOM 2947 CA LYS A 206 65.106 -11.040 30.741 1.00 6.87 C ATOM 2948 C LYS A 206 64.760 -11.984 29.649 1.00 9.55 C ATOM 2949 O LYS A 206 65.647 -12.558 29.089 1.00 8.76 O ATOM 2950 CB LYS A 206 65.820 -11.783 31.874 1.00 7.22 C ATOM 2951 CG LYS A 206 65.145 -13.039 32.291 1.00 8.09 C ATOM 2952 CD LYS A 206 65.755 -13.585 33.574 1.00 10.79 C ATOM 2953 CE LYS A 206 65.153 -14.942 33.921 1.00 13.78 C ATOM 2954 NZ LYS A 206 65.743 -15.608 35.088 1.00 17.98 N ATOM 2955 HA LYS A 206 65.791 -10.306 30.317 1.00 0.00 H ATOM 2956 HB2 LYS A 206 66.828 -12.029 31.541 1.00 0.00 H ATOM 2957 HB3 LYS A 206 65.876 -11.120 32.738 1.00 0.00 H ATOM 2958 HG2 LYS A 206 64.087 -12.837 32.457 1.00 0.00 H ATOM 2959 HG3 LYS A 206 65.253 -13.782 31.500 1.00 0.00 H ATOM 2960 HD2 LYS A 206 66.831 -13.694 33.441 1.00 0.00 H ATOM 2961 HD3 LYS A 206 65.560 -12.888 34.389 1.00 0.00 H ATOM 2962 HE2 LYS A 206 65.279 -15.597 33.059 1.00 0.00 H ATOM 2963 HE3 LYS A 206 64.090 -14.800 34.115 1.00 0.00 H ATOM 2964 HZ1 LYS A 206 66.757 -15.768 34.919 1.00 0.00 H ATOM 2965 HZ2 LYS A 206 65.621 -15.006 35.927 1.00 0.00 H ATOM 2966 HZ3 LYS A 206 65.268 -16.520 35.242 1.00 0.00 H ATOM 2967 H LYS A 206 63.443 -10.580 32.043 1.00 0.00 H ATOM 2968 N GLU A 207 63.485 -12.149 29.344 1.00 14.46 N ATOM 2969 CA GLU A 207 63.056 -13.337 28.600 1.00 18.15 C ATOM 2970 C GLU A 207 63.301 -13.260 27.098 1.00 15.92 C ATOM 2971 O GLU A 207 63.491 -14.272 26.458 1.00 12.56 O ATOM 2972 CB GLU A 207 61.578 -13.569 28.827 1.00 17.97 C ATOM 2973 CG GLU A 207 61.070 -14.806 28.148 1.00 22.14 C ATOM 2974 CD GLU A 207 59.725 -15.263 28.674 1.00 23.38 C ATOM 2975 OE1 GLU A 207 59.393 -14.960 29.863 1.00 20.84 O ATOM 2976 OE2 GLU A 207 59.027 -15.970 27.870 1.00 24.99 O ATOM 2977 HA GLU A 207 63.663 -14.158 28.981 1.00 0.00 H ATOM 2978 HB2 GLU A 207 61.401 -13.662 29.898 1.00 0.00 H ATOM 2979 HB3 GLU A 207 61.028 -12.710 28.443 1.00 0.00 H ATOM 2980 HG2 GLU A 207 60.975 -14.602 27.081 1.00 0.00 H ATOM 2981 HG3 GLU A 207 61.793 -15.607 28.300 1.00 0.00 H ATOM 2982 H GLU A 207 62.785 -11.436 29.632 1.00 0.00 H ATOM 2983 N GLU A 208 63.258 -12.055 26.550 1.00 8.84 N ATOM 2984 CA GLU A 208 63.346 -11.860 25.082 1.00 9.69 C ATOM 2985 C GLU A 208 64.135 -10.586 24.805 1.00 8.03 C ATOM 2986 O GLU A 208 63.638 -9.609 24.260 1.00 8.46 O ATOM 2987 CB GLU A 208 61.946 -11.822 24.472 1.00 9.37 C ATOM 2988 CG GLU A 208 61.824 -12.012 23.029 1.00 12.57 C ATOM 2989 CD GLU A 208 60.330 -12.092 22.652 1.00 14.14 C ATOM 2990 OE1 GLU A 208 59.680 -13.108 23.036 1.00 13.26 O ATOM 2991 OE2 GLU A 208 59.847 -11.137 22.029 1.00 14.15 O ATOM 2992 HA GLU A 208 63.870 -12.694 24.615 1.00 0.00 H ATOM 2993 HB2 GLU A 208 61.360 -12.605 24.953 1.00 0.00 H ATOM 2994 HB3 GLU A 208 61.514 -10.850 24.709 1.00 0.00 H ATOM 2995 HG2 GLU A 208 62.287 -11.173 22.510 1.00 0.00 H ATOM 2996 HG3 GLU A 208 62.323 -12.937 22.739 1.00 0.00 H ATOM 2997 H GLU A 208 63.160 -11.223 27.166 1.00 0.00 H ATOM 2998 N ALA A 209 65.415 -10.641 25.114 1.00 7.21 N ATOM 2999 CA ALA A 209 66.321 -9.531 24.953 1.00 7.61 C ATOM 3000 C ALA A 209 67.166 -9.749 23.713 1.00 6.65 C ATOM 3001 O ALA A 209 67.726 -10.836 23.512 1.00 8.16 O ATOM 3002 CB ALA A 209 67.211 -9.430 26.201 1.00 8.51 C ATOM 3003 HA ALA A 209 65.764 -8.601 24.836 1.00 0.00 H ATOM 3004 HB1 ALA A 209 66.586 -9.272 27.080 1.00 0.00 H ATOM 3005 HB2 ALA A 209 67.777 -10.354 26.318 1.00 0.00 H ATOM 3006 HB3 ALA A 209 67.900 -8.593 26.088 1.00 0.00 H ATOM 3007 H ALA A 209 65.792 -11.533 25.494 1.00 0.00 H ATOM 3008 N SER A 210 67.292 -8.708 22.883 1.00 7.04 N ATOM 3009 CA SER A 210 68.055 -8.864 21.652 1.00 8.43 C ATOM 3010 C SER A 210 68.578 -7.530 21.121 1.00 7.61 C ATOM 3011 O SER A 210 68.186 -6.460 21.593 1.00 7.85 O ATOM 3012 CB SER A 210 67.265 -9.580 20.601 1.00 9.58 C ATOM 3013 OG SER A 210 66.165 -8.812 20.234 1.00 10.84 O ATOM 3014 HA SER A 210 68.921 -9.477 21.902 1.00 0.00 H ATOM 3015 HB2 SER A 210 66.923 -10.538 20.994 1.00 0.00 H ATOM 3016 HB3 SER A 210 67.895 -9.751 19.728 1.00 0.00 H ATOM 3017 HG SER A 210 65.647 -9.291 19.539 1.00 0.00 H ATOM 3018 H SER A 210 66.849 -7.796 23.114 1.00 0.00 H ATOM 3019 N SER A 211 69.493 -7.600 20.145 1.00 7.37 N ATOM 3020 CA SER A 211 70.025 -6.398 19.536 1.00 7.46 C ATOM 3021 C SER A 211 70.402 -6.638 18.116 1.00 7.43 C ATOM 3022 O SER A 211 70.916 -7.718 17.791 1.00 8.67 O ATOM 3023 CB SER A 211 71.257 -5.865 20.288 1.00 8.31 C ATOM 3024 OG SER A 211 71.769 -4.713 19.677 1.00 7.40 O ATOM 3025 HA SER A 211 69.231 -5.653 19.588 1.00 0.00 H ATOM 3026 HB2 SER A 211 72.028 -6.635 20.297 1.00 0.00 H ATOM 3027 HB3 SER A 211 70.972 -5.627 21.313 1.00 0.00 H ATOM 3028 HG SER A 211 72.035 -4.924 18.747 1.00 0.00 H ATOM 3029 H SER A 211 69.826 -8.530 19.820 1.00 0.00 H ATOM 3030 N ALA A 212 70.190 -5.604 17.299 1.00 7.13 N ATOM 3031 CA ALA A 212 70.810 -5.564 15.965 1.00 6.68 C ATOM 3032 C ALA A 212 72.318 -5.560 16.089 1.00 8.06 C ATOM 3033 O ALA A 212 72.867 -5.153 17.112 1.00 8.66 O ATOM 3034 CB ALA A 212 70.288 -4.382 15.184 1.00 7.58 C ATOM 3035 HA ALA A 212 70.539 -6.461 15.408 1.00 0.00 H ATOM 3036 HB1 ALA A 212 69.207 -4.470 15.074 1.00 0.00 H ATOM 3037 HB2 ALA A 212 70.527 -3.462 15.717 1.00 0.00 H ATOM 3038 HB3 ALA A 212 70.755 -4.364 14.199 1.00 0.00 H ATOM 3039 H ALA A 212 69.581 -4.820 17.608 1.00 0.00 H ATOM 3040 N VAL A 213 72.972 -6.006 15.016 1.00 8.02 N ATOM 3041 CA VAL A 213 74.421 -5.946 14.882 1.00 8.02 C ATOM 3042 C VAL A 213 74.709 -5.076 13.695 1.00 7.95 C ATOM 3043 O VAL A 213 74.171 -5.293 12.584 1.00 9.06 O ATOM 3044 CB VAL A 213 75.007 -7.329 14.635 1.00 9.27 C ATOM 3045 CG1 VAL A 213 76.545 -7.215 14.426 1.00 10.89 C ATOM 3046 CG2 VAL A 213 74.639 -8.317 15.784 1.00 10.83 C ATOM 3047 HA VAL A 213 74.865 -5.554 15.797 1.00 0.00 H ATOM 3048 HB VAL A 213 74.570 -7.743 13.726 1.00 0.00 H ATOM 3049 HG11 VAL A 213 76.747 -6.577 13.566 1.00 0.00 H ATOM 3050 HG12 VAL A 213 77.000 -6.782 15.317 1.00 0.00 H ATOM 3051 HG13 VAL A 213 76.961 -8.207 14.249 1.00 0.00 H ATOM 3052 HG21 VAL A 213 75.032 -7.938 16.727 1.00 0.00 H ATOM 3053 HG22 VAL A 213 73.555 -8.407 15.851 1.00 0.00 H ATOM 3054 HG23 VAL A 213 75.074 -9.294 15.574 1.00 0.00 H ATOM 3055 H VAL A 213 72.420 -6.417 14.236 1.00 0.00 H ATOM 3056 N VAL A 214 75.573 -4.111 13.907 1.00 8.10 N ATOM 3057 CA VAL A 214 76.077 -3.207 12.845 1.00 7.74 C ATOM 3058 C VAL A 214 77.483 -3.671 12.519 1.00 10.50 C ATOM 3059 O VAL A 214 78.312 -3.821 13.422 1.00 10.67 O ATOM 3060 CB VAL A 214 76.061 -1.694 13.247 1.00 8.78 C ATOM 3061 CG1 VAL A 214 76.757 -0.788 12.177 1.00 8.41 C ATOM 3062 CG2 VAL A 214 74.648 -1.255 13.479 1.00 8.44 C ATOM 3063 HA VAL A 214 75.417 -3.265 11.979 1.00 0.00 H ATOM 3064 HB VAL A 214 76.634 -1.583 14.168 1.00 0.00 H ATOM 3065 HG11 VAL A 214 77.796 -1.097 12.062 1.00 0.00 H ATOM 3066 HG12 VAL A 214 76.239 -0.890 11.224 1.00 0.00 H ATOM 3067 HG13 VAL A 214 76.719 0.251 12.503 1.00 0.00 H ATOM 3068 HG21 VAL A 214 74.071 -1.395 12.565 1.00 0.00 H ATOM 3069 HG22 VAL A 214 74.211 -1.850 14.281 1.00 0.00 H ATOM 3070 HG23 VAL A 214 74.637 -0.202 13.759 1.00 0.00 H ATOM 3071 H VAL A 214 75.925 -3.972 14.876 1.00 0.00 H ATOM 3072 N GLY A 215 77.731 -3.879 11.230 1.00 10.77 N ATOM 3073 CA GLY A 215 79.085 -4.241 10.790 1.00 12.10 C ATOM 3074 C GLY A 215 79.420 -5.688 10.943 1.00 14.11 C ATOM 3075 O GLY A 215 78.591 -6.520 11.371 1.00 13.85 O ATOM 3076 HA3 GLY A 215 79.800 -3.662 11.375 1.00 0.00 H ATOM 3077 HA2 GLY A 215 79.183 -3.978 9.737 1.00 0.00 H ATOM 3078 OXT GLY A 215 80.599 -6.069 10.687 1.00 17.48 O ATOM 3079 H GLY A 215 76.966 -3.785 10.532 1.00 0.00 H TER 3080 GLY A 215 HETATM 3081 O HOH 1 45.280 -2.594 26.920 1.00 22.25 O HETATM 3082 O HOH 2 69.695 5.068 46.132 1.00 25.32 O HETATM 3083 O HOH 3 67.230 12.328 12.690 1.00 21.18 O HETATM 3084 O HOH 4 76.756 5.898 31.254 1.00 16.54 O HETATM 3085 O HOH 5 70.407 10.814 31.406 1.00 29.20 O HETATM 3086 O HOH 6 62.450 -1.568 1.154 1.00 13.28 O HETATM 3087 O HOH 7 60.140 10.267 39.357 1.00 22.35 O HETATM 3088 O HOH 8 77.408 -9.861 20.860 1.00 20.14 O HETATM 3089 O HOH 9 59.093 -8.358 2.227 1.00 22.64 O HETATM 3090 O HOH 10 62.014 -5.481 1.063 1.00 20.05 O HETATM 3091 O HOH 11 68.977 -12.623 10.042 1.00 21.81 O HETATM 3092 O HOH 12 66.501 7.913 35.043 1.00 21.59 O HETATM 3093 O HOH 13 81.115 -8.102 34.195 1.00 32.05 O HETATM 3094 O HOH 14 48.346 -2.692 10.819 1.00 18.43 O HETATM 3095 O HOH 15 52.260 -10.668 22.969 1.00 28.27 O HETATM 3096 O HOH 16 77.361 4.526 40.741 1.00 28.05 O HETATM 3097 O HOH 17 46.530 -0.843 8.969 1.00 22.90 O HETATM 3098 O HOH 18 72.943 -12.389 9.760 1.00 23.04 O HETATM 3099 O HOH 19 60.147 13.590 22.302 1.00 21.92 O HETATM 3100 O HOH 20 57.527 -6.073 2.155 1.00 22.61 O HETATM 3101 O HOH 21 56.668 -14.786 37.358 1.00 23.73 O HETATM 3102 O HOH 22 67.928 -15.823 24.075 1.00 28.06 O HETATM 3103 O HOH 23 57.452 11.610 36.756 1.00 36.32 O HETATM 3104 O HOH 24 49.671 -10.893 39.221 1.00 19.39 O HETATM 3105 O HOH 25 72.889 13.486 15.541 1.00 21.99 O HETATM 3106 O HOH 26 60.217 -15.368 24.361 1.00 29.29 O HETATM 3107 O HOH 27 72.959 5.778 42.678 1.00 33.89 O HETATM 3108 O HOH 28 59.546 -4.134 1.233 1.00 24.48 O HETATM 3109 O HOH 29 80.491 -8.278 23.993 1.00 24.49 O HETATM 3110 O HOH 30 52.433 8.560 33.486 1.00 21.50 O HETATM 3111 O HOH 31 82.743 -4.308 10.842 1.00 18.21 O HETATM 3112 O HOH 32 53.893 3.168 3.559 1.00 24.20 O HETATM 3113 O HOH 33 70.277 -14.470 16.455 1.00 35.33 O HETATM 3114 O HOH 34 45.902 9.035 17.592 1.00 29.37 O HETATM 3115 O HOH 35 53.386 5.432 4.871 1.00 24.15 O HETATM 3116 O HOH 36 47.365 9.199 19.968 1.00 30.49 O HETATM 3117 O HOH 37 56.911 6.858 26.682 1.00 7.89 O HETATM 3118 O HOH 38 58.405 5.971 10.521 1.00 8.19 O HETATM 3119 O HOH 39 62.721 -9.432 27.327 1.00 7.59 O HETATM 3120 O HOH 40 53.151 -5.550 33.890 1.00 7.97 O HETATM 3121 O HOH 41 64.686 -6.520 41.687 1.00 9.09 O HETATM 3122 O HOH 42 63.579 -8.801 21.590 1.00 10.33 O HETATM 3123 O HOH 43 70.927 10.420 24.055 1.00 12.68 O HETATM 3124 O HOH 44 50.817 8.952 12.405 1.00 18.77 O HETATM 3125 O HOH 45 60.328 6.190 22.207 1.00 8.39 O HETATM 3126 O HOH 46 66.685 -12.943 26.413 1.00 9.32 O HETATM 3127 O HOH 47 54.492 -11.846 14.807 1.00 25.81 O HETATM 3128 O HOH 48 65.416 10.920 9.948 1.00 9.66 O HETATM 3129 O HOH 49 67.121 5.576 20.089 1.00 9.05 O HETATM 3130 O HOH 50 70.912 -8.237 38.341 1.00 12.47 O HETATM 3131 O HOH 51 66.391 -4.313 42.548 1.00 8.59 O HETATM 3132 O HOH 52 61.221 1.834 22.944 1.00 10.46 O HETATM 3133 O HOH 53 80.373 -5.168 30.981 1.00 11.16 O HETATM 3134 O HOH 54 64.178 -7.251 37.482 1.00 6.85 O HETATM 3135 O HOH 55 82.401 -3.284 30.734 1.00 10.94 O HETATM 3136 O HOH 56 80.420 -2.071 13.863 1.00 10.32 O HETATM 3137 O HOH 57 65.723 -12.657 22.220 1.00 11.09 O HETATM 3138 O HOH 58 75.028 12.408 16.868 1.00 13.64 O HETATM 3139 O HOH 59 71.141 6.514 14.601 1.00 12.75 O HETATM 3140 O HOH 60 44.489 -0.815 10.782 1.00 19.43 O HETATM 3141 O HOH 61 52.415 -13.480 38.563 1.00 13.96 O HETATM 3142 O HOH 62 45.708 -5.659 12.065 1.00 12.29 O HETATM 3143 O HOH 63 53.985 -5.332 10.143 1.00 9.80 O HETATM 3144 O HOH 64 71.167 -12.034 36.868 1.00 18.20 O HETATM 3145 O HOH 65 61.627 8.378 14.328 1.00 9.49 O HETATM 3146 O HOH 66 66.483 2.862 43.799 1.00 15.12 O HETATM 3147 O HOH 67 80.721 -0.550 11.610 1.00 11.21 O HETATM 3148 O HOH 68 77.758 -1.394 19.816 1.00 11.66 O HETATM 3149 O HOH 69 62.539 6.905 16.338 1.00 8.43 O HETATM 3150 O HOH 70 72.669 4.923 35.417 1.00 14.71 O HETATM 3151 O HOH 71 61.598 -9.998 20.084 1.00 13.93 O HETATM 3152 O HOH 72 68.747 -13.280 35.749 1.00 12.11 O HETATM 3153 O HOH 73 61.087 -11.963 10.039 1.00 13.02 O HETATM 3154 O HOH 74 79.556 3.384 36.721 1.00 12.16 O HETATM 3155 O HOH 75 66.392 11.045 4.871 1.00 15.23 O HETATM 3156 O HOH 76 41.539 3.667 13.080 1.00 13.68 O HETATM 3157 O HOH 77 57.642 -9.414 4.366 1.00 14.22 O HETATM 3158 O HOH 78 72.219 -5.130 41.262 1.00 19.30 O HETATM 3159 O HOH 79 62.585 12.403 27.419 1.00 15.07 O HETATM 3160 O HOH 80 68.501 -16.053 35.170 1.00 19.83 O HETATM 3161 O HOH 81 46.897 6.130 11.068 1.00 12.94 O HETATM 3162 O HOH 82 65.314 10.128 24.818 1.00 17.17 O HETATM 3163 O HOH 83 63.539 5.670 19.120 1.00 10.13 O HETATM 3164 O HOH 84 57.110 -8.457 40.331 1.00 10.33 O HETATM 3165 O HOH 85 55.125 7.409 5.498 1.00 12.59 O HETATM 3166 O HOH 86 58.663 0.900 22.703 1.00 11.67 O HETATM 3167 O HOH 87 48.897 0.554 38.162 1.00 31.05 O HETATM 3168 O HOH 88 76.115 -2.895 9.132 1.00 10.54 O HETATM 3169 O HOH 89 71.840 -12.545 12.702 1.00 19.21 O HETATM 3170 O HOH 90 54.315 10.873 34.781 1.00 26.57 O HETATM 3171 O HOH 91 56.360 -9.286 42.937 1.00 11.77 O HETATM 3172 O HOH 92 76.257 -3.416 16.654 1.00 15.18 O HETATM 3173 O HOH 93 73.048 -6.929 5.876 1.00 22.21 O HETATM 3174 O HOH 94 61.865 -14.372 19.450 1.00 27.45 O HETATM 3175 O HOH 95 59.897 -1.652 0.920 1.00 22.81 O HETATM 3176 O HOH 96 58.519 -8.007 44.252 1.00 9.88 O HETATM 3177 O HOH 97 68.794 -10.323 11.810 1.00 16.77 O HETATM 3178 O HOH 98 45.977 -1.500 17.665 1.00 15.89 O HETATM 3179 O HOH 99 62.823 12.564 24.681 1.00 15.53 O HETATM 3180 O HOH 100 77.390 -0.774 17.084 1.00 9.59 O HETATM 3181 O HOH 101 64.006 7.433 34.177 1.00 17.60 O HETATM 3182 O HOH 102 63.835 9.810 32.714 1.00 14.48 O HETATM 3183 O HOH 103 67.088 5.347 43.143 1.00 19.74 O HETATM 3184 O HOH 104 71.922 -14.960 18.887 1.00 20.25 O HETATM 3185 O HOH 105 77.514 -3.592 38.190 1.00 13.27 O HETATM 3186 O HOH 106 56.536 7.593 3.047 1.00 14.83 O HETATM 3187 O HOH 107 79.757 -5.715 14.860 1.00 30.83 O HETATM 3188 O HOH 108 65.822 12.745 18.587 1.00 17.40 O HETATM 3189 O HOH 109 74.446 12.234 19.741 1.00 14.62 O HETATM 3190 O HOH 110 56.807 11.624 21.671 1.00 18.88 O HETATM 3191 O HOH 111 62.163 -12.392 7.395 1.00 17.39 O HETATM 3192 O HOH 112 82.018 -2.055 9.699 1.00 14.50 O HETATM 3193 O HOH 113 51.885 -4.557 7.325 1.00 16.56 O HETATM 3194 O HOH 114 81.788 -7.402 31.526 1.00 16.84 O HETATM 3195 O HOH 115 79.035 -5.899 37.991 1.00 22.75 O HETATM 3196 O HOH 116 79.715 10.318 13.224 1.00 12.72 O HETATM 3197 O HOH 117 61.564 3.963 18.260 1.00 8.35 O HETATM 3198 O HOH 118 63.821 13.053 11.914 1.00 27.36 O HETATM 3199 O HOH 119 77.172 -10.643 28.803 1.00 16.91 O HETATM 3200 O HOH 120 60.518 -13.158 5.499 1.00 24.01 O HETATM 3201 O HOH 121 79.410 -0.112 21.587 1.00 32.57 O HETATM 3202 O HOH 122 49.510 -10.027 21.863 1.00 17.89 O HETATM 3203 O HOH 123 68.307 12.442 17.618 1.00 20.78 O HETATM 3204 O HOH 124 74.794 -6.189 36.763 1.00 16.23 O HETATM 3205 O HOH 125 70.264 -6.968 41.063 1.00 16.62 O HETATM 3206 O HOH 126 69.498 -18.130 28.393 1.00 24.75 O HETATM 3207 O HOH 127 75.941 -9.970 12.065 1.00 19.77 O HETATM 3208 O HOH 128 74.988 6.362 34.887 1.00 23.51 O HETATM 3209 O HOH 129 51.742 -7.153 8.296 1.00 16.54 O HETATM 3210 O HOH 130 61.331 4.000 21.095 1.00 18.67 O HETATM 3211 O HOH 131 53.787 -15.170 36.964 1.00 19.88 O HETATM 3212 O HOH 132 57.571 13.371 33.224 1.00 34.84 O HETATM 3213 O HOH 133 65.301 -14.876 24.123 1.00 21.94 O HETATM 3214 O HOH 134 58.077 11.954 11.347 1.00 20.93 O HETATM 3215 O HOH 135 57.522 -1.914 -2.779 1.00 29.31 O HETATM 3216 O HOH 136 75.288 -5.913 18.460 1.00 18.90 O HETATM 3217 O HOH 137 56.298 13.327 23.560 1.00 18.53 O HETATM 3218 O HOH 138 54.272 5.487 39.663 1.00 17.79 O HETATM 3219 O HOH 139 46.670 -0.306 20.024 1.00 18.72 O HETATM 3220 O HOH 140 59.883 -10.127 42.529 1.00 11.99 O HETATM 3221 O HOH 141 44.956 1.867 20.088 1.00 19.08 O HETATM 3222 O HOH 142 53.401 9.684 5.301 1.00 29.21 O HETATM 3223 O HOH 143 76.465 -7.290 35.066 1.00 17.72 O HETATM 3224 O HOH 144 54.865 -14.479 27.606 1.00 18.71 O HETATM 3225 O HOH 145 54.786 5.538 1.595 1.00 24.70 O HETATM 3226 O HOH 146 72.726 -1.535 45.620 1.00 22.44 O HETATM 3227 O HOH 147 47.282 6.061 7.384 1.00 30.74 O HETATM 3228 O HOH 148 71.343 -8.599 4.406 1.00 23.02 O HETATM 3229 O HOH 149 51.692 1.456 36.742 1.00 24.83 O HETATM 3230 O HOH 150 54.679 -2.359 40.919 1.00 23.73 O HETATM 3231 O HOH 151 42.436 7.304 10.194 1.00 26.22 O HETATM 3232 O HOH 152 78.842 5.491 6.300 1.00 27.54 O HETATM 3233 O HOH 153 51.335 3.787 0.634 1.00 27.25 O HETATM 3234 O HOH 154 58.251 7.409 -0.912 1.00 28.88 O HETATM 3235 O HOH 155 79.378 9.218 25.180 1.00 20.29 O HETATM 3236 O HOH 156 48.805 1.949 21.481 1.00 31.20 O HETATM 3237 O HOH 157 55.860 -15.871 34.610 1.00 21.49 O HETATM 3238 O HOH 158 68.596 7.100 36.517 1.00 21.68 O HETATM 3239 O HOH 159 59.692 -15.101 20.818 1.00 30.59 O HETATM 3240 O HOH 160 70.966 8.915 5.202 1.00 26.01 O HETATM 3241 O HOH 161 59.260 13.778 6.804 1.00 29.25 O HETATM 3242 O HOH 162 73.756 -4.105 43.521 1.00 25.64 O HETATM 3243 O HOH 163 48.179 -11.417 33.026 1.00 23.54 O HETATM 3244 O HOH 164 55.269 -14.491 11.394 1.00 23.51 O HETATM 3245 O HOH 165 61.582 -8.577 0.436 1.00 31.53 O HETATM 3246 O HOH 166 63.695 13.681 17.410 1.00 28.84 O HETATM 3247 O HOH 167 64.532 12.832 3.723 1.00 35.54 O HETATM 3248 O HOH 168 44.946 7.336 9.535 1.00 26.91 O HETATM 3249 O HOH 169 74.331 -10.048 6.772 1.00 28.92 O HETATM 3250 O HOH 170 50.546 -1.965 5.668 1.00 29.67 O HETATM 3251 O HOH 171 60.898 4.464 43.915 1.00 25.62 O HETATM 3252 O HOH 172 63.939 3.163 44.921 1.00 23.97 O HETATM 3253 O HOH 173 75.351 7.083 6.073 1.00 28.18 O HETATM 3254 O HOH 174 83.826 -4.225 34.120 1.00 36.35 O HETATM 3255 O HOH 175 73.782 8.542 10.719 1.00 25.12 O HETATM 3256 O HOH 176 54.228 14.715 23.822 1.00 45.31 O HETATM 3257 O HOH 177 53.291 10.899 8.097 1.00 34.11 O HETATM 3258 O HOH 178 64.171 -15.282 15.874 1.00 32.19 O HETATM 3259 O HOH 179 61.452 -14.399 10.812 1.00 28.08 O HETATM 3260 O HOH 180 56.920 4.793 -3.343 1.00 31.04 O HETATM 3261 O HOH 181 74.704 10.438 8.648 1.00 23.84 O HETATM 3262 O HOH 182 71.098 7.506 35.082 1.00 27.77 O HETATM 3263 O HOH 183 71.722 12.272 10.876 1.00 35.95 O HETATM 3264 O HOH 184 75.604 14.071 29.149 1.00 38.55 O HETATM 3265 O HOH 185 52.094 -7.345 41.402 1.00 15.87 O HETATM 3266 O HOH 186 47.122 -9.511 17.751 1.00 26.44 O HETATM 3267 O HOH 187 59.365 -10.023 39.597 1.00 12.87 O HETATM 3268 O HOH 188 55.195 11.345 11.527 1.00 23.96 O HETATM 3269 O HOH 189 61.769 15.185 27.890 1.00 28.05 O HETATM 3270 O HOH 190 52.887 12.775 20.059 1.00 29.09 O HETATM 3271 O HOH 191 57.589 -16.426 31.129 1.00 30.70 O HETATM 3272 O HOH 192 49.749 10.027 17.957 1.00 39.64 O HETATM 3273 O HOH 193 46.455 -12.325 36.796 1.00 39.29 O HETATM 3274 O HOH 194 70.879 6.142 36.820 1.00 27.53 O HETATM 3275 O HOH 195 61.441 1.379 44.822 1.00 36.76 O HETATM 3276 O HOH 196 49.393 4.940 30.877 1.00 49.48 O HETATM 3277 O HOH 197 48.877 -10.172 10.352 1.00 36.67 O HETATM 3278 O HOH 198 50.493 8.337 26.687 1.00 35.26 O HETATM 3279 O HOH 199 79.321 -8.925 12.689 1.00 35.03 O HETATM 3280 O HOH 200 53.169 9.526 16.421 1.00 30.99 O HETATM 3281 O HOH 201 56.467 -15.424 14.101 1.00 35.79 O HETATM 3282 O HOH 202 57.313 16.374 28.921 1.00 48.66 O HETATM 3283 O HOH 203 77.497 -1.151 42.472 1.00 34.42 O HETATM 3284 O HOH 204 68.711 12.759 21.854 1.00 27.32 O HETATM 3285 O HOH 205 67.320 -19.780 29.639 1.00 34.51 O HETATM 3286 O HOH 206 82.037 1.486 41.188 1.00 37.21 O HETATM 3287 O HOH 207 79.318 -3.702 19.791 1.00 26.66 O HETATM 3288 O HOH 208 62.932 -15.732 24.187 1.00 33.35 O HETATM 3289 O HOH 209 76.687 -4.415 19.472 1.00 30.99 O HETATM 3290 O HOH 210 78.615 9.986 4.592 1.00 32.94 O HETATM 3291 O HOH 211 59.212 12.065 3.417 1.00 32.51 O HETATM 3292 O HOH 212 72.886 7.685 7.214 1.00 32.54 O HETATM 3293 O HOH 213 52.262 10.247 14.124 1.00 39.73 O HETATM 3294 O HOH 214 50.734 12.290 25.506 1.00 35.25 O HETATM 3295 O HOH 215 55.423 9.881 40.603 1.00 43.49 O HETATM 3296 O HOH 216 82.042 -1.820 38.707 1.00 41.68 O HETATM 3297 O HOH 217 61.706 -18.615 26.990 1.00 38.31 O HETATM 3298 O HOH 218 58.644 16.609 25.732 1.00 38.53 O HETATM 3299 O HOH 219 75.895 1.415 46.526 1.00 43.96 O HETATM 3300 O HOH 220 58.501 11.898 14.184 1.00 37.06 O HETATM 3301 O HOH 221 52.637 -11.661 12.550 1.00 30.05 O HETATM 3302 O HOH 222 64.078 -18.277 31.344 1.00 40.61 O HETATM 3303 O HOH 223 72.489 13.945 20.057 1.00 36.32 O HETATM 3304 O HOH 224 77.528 -11.140 33.743 1.00 25.35 O HETATM 3305 O HOH 225 78.741 -11.280 31.189 1.00 27.58 O HETATM 3306 O HOH 226 78.587 -9.081 35.241 1.00 39.07 O HETATM 3307 O HOH 227 78.270 -2.979 40.882 1.00 29.27 O HETATM 3308 O HOH 228 66.523 14.108 22.583 1.00 36.68 O HETATM 3309 O HOH 229 47.343 -12.311 40.107 1.00 29.35 O HETATM 3310 O HOH 230 75.251 9.593 33.710 1.00 39.73 O HETATM 3311 O HOH 231 80.247 -2.579 7.552 1.00 20.97 O HETATM 3312 O HOH 232 47.471 7.560 21.570 1.00 34.70 O HETATM 3313 O HOH 233 76.952 -8.297 18.523 1.00 24.26 O HETATM 3314 O HOH 234 74.703 -7.990 38.731 1.00 35.48 O HETATM 3315 O HOH 235 70.754 -10.599 38.725 1.00 32.06 O HETATM 3316 O HOH 236 53.311 2.343 39.361 1.00 31.90 O HETATM 3317 O HOH 237 59.578 13.477 9.738 1.00 28.45 O HETATM 3318 O HOH 238 49.559 -6.818 4.351 1.00 32.98 O HETATM 3319 O HOH 239 55.989 -0.828 42.301 1.00 20.14 O HETATM 3320 O HOH 240 85.802 3.762 36.385 1.00 35.64 O HETATM 3321 O5 UNN A 241 50.144 -1.476 22.504 1.00 -0.17 O HETATM 3322 S1 UNN A 241 51.233 -1.599 23.451 1.00 -0.00 S HETATM 3323 O4 UNN A 241 52.147 -0.439 23.416 1.00 -0.17 O HETATM 3324 CAB UNN A 241 50.570 -1.869 25.025 1.00 0.09 C HETATM 3325 CAD UNN A 241 51.153 -2.761 25.880 1.00 -0.04 C HETATM 3326 CAF UNN A 241 50.599 -2.980 27.135 1.00 -0.06 C HETATM 3327 CAE UNN A 241 49.500 -2.267 27.538 1.00 -0.06 C HETATM 3328 CAC UNN A 241 48.892 -1.386 26.660 1.00 -0.06 C HETATM 3329 CAA UNN A 241 49.446 -1.159 25.387 1.00 -0.04 C HETATM 3330 H UNN A 241 48.997 -0.439 24.703 1.00 0.06 H HETATM 3331 H UNN A 241 47.981 -0.866 26.956 1.00 0.06 H HETATM 3332 H UNN A 241 49.106 -2.393 28.546 1.00 0.06 H HETATM 3333 H UNN A 241 51.040 -3.721 27.802 1.00 0.06 H HETATM 3334 H UNN A 241 52.051 -3.300 25.578 1.00 0.06 H HETATM 3335 C28 UNN A 241 52.186 -3.034 23.018 1.00 0.07 C HETATM 3336 C27 UNN A 241 52.504 -3.128 21.505 1.00 -0.01 C HETATM 3337 C18 UNN A 241 51.907 -4.431 20.835 1.00 0.05 C HETATM 3338 C19 UNN A 241 50.355 -4.393 20.962 1.00 -0.02 C HETATM 3339 C20 UNN A 241 49.765 -5.368 19.900 1.00 -0.02 C HETATM 3340 C21 UNN A 241 48.253 -5.443 19.944 1.00 -0.04 C HETATM 3341 C26 UNN A 241 47.681 -6.655 20.291 1.00 -0.06 C HETATM 3342 C25 UNN A 241 46.285 -6.781 20.338 1.00 -0.07 C HETATM 3343 C24 UNN A 241 45.509 -5.706 20.003 1.00 -0.07 C HETATM 3344 C23 UNN A 241 46.068 -4.493 19.674 1.00 -0.07 C HETATM 3345 C22 UNN A 241 47.458 -4.350 19.602 1.00 -0.06 C HETATM 3346 H UNN A 241 47.908 -3.408 19.287 1.00 0.06 H HETATM 3347 H UNN A 241 45.424 -3.638 19.468 1.00 0.06 H HETATM 3348 H UNN A 241 44.424 -5.813 19.997 1.00 0.06 H HETATM 3349 H UNN A 241 45.825 -7.723 20.637 1.00 0.06 H HETATM 3350 H UNN A 241 48.315 -7.510 20.527 1.00 0.06 H HETATM 3351 H UNN A 241 50.154 -6.364 20.110 1.00 0.04 H HETATM 3352 H UNN A 241 50.051 -5.000 18.915 1.00 0.04 H HETATM 3353 H UNN A 241 49.987 -3.381 20.792 1.00 0.03 H HETATM 3354 H UNN A 241 50.050 -4.696 21.964 1.00 0.03 H HETATM 3355 N2 UNN A 241 52.384 -5.613 21.546 1.00 -0.28 N HETATM 3356 C17 UNN A 241 53.288 -6.458 21.025 1.00 0.20 C HETATM 3357 O3 UNN A 241 53.519 -6.204 19.607 1.00 -0.39 O HETATM 3358 C9 UNN A 241 53.814 -7.753 21.322 1.00 0.13 C HETATM 3359 C10 UNN A 241 55.260 -7.369 21.699 1.00 -0.01 C HETATM 3360 C11 UNN A 241 55.861 -8.499 22.569 1.00 -0.02 C HETATM 3361 C01 UNN A 241 56.692 -9.456 21.712 1.00 0.06 C HETATM 3362 N01 UNN A 241 57.069 -10.692 22.396 1.00 -0.27 N HETATM 3363 C02 UNN A 241 56.282 -11.748 22.519 1.00 0.29 C HETATM 3364 N03 UNN A 241 56.812 -12.879 22.953 1.00 -0.28 N HETATM 3365 H UNN A 241 57.805 -12.922 23.183 1.00 0.26 H HETATM 3366 H UNN A 241 56.228 -13.709 23.057 1.00 0.26 H HETATM 3367 N02 UNN A 241 54.970 -11.674 22.235 1.00 -0.28 N HETATM 3368 H UNN A 241 54.566 -10.793 21.919 1.00 0.26 H HETATM 3369 H UNN A 241 54.379 -12.499 22.336 1.00 0.26 H HETATM 3370 H UNN A 241 58.002 -10.743 22.806 1.00 0.26 H HETATM 3371 H UNN A 241 57.614 -8.937 21.450 1.00 0.07 H HETATM 3372 H UNN A 241 56.081 -9.735 20.854 1.00 0.07 H HETATM 3373 H UNN A 241 55.048 -9.057 23.033 1.00 0.03 H HETATM 3374 H UNN A 241 56.505 -8.055 23.328 1.00 0.03 H HETATM 3375 H UNN A 241 55.262 -6.432 22.256 1.00 0.03 H HETATM 3376 H UNN A 241 55.857 -7.239 20.796 1.00 0.03 H HETATM 3377 N1 UNN A 241 53.675 -8.779 20.448 1.00 -0.25 N HETATM 3378 C8 UNN A 241 52.449 -9.112 20.086 1.00 0.26 C HETATM 3379 O2 UNN A 241 51.475 -8.504 20.520 1.00 -0.40 O HETATM 3380 N3 UNN A 241 52.264 -10.145 19.282 1.00 -0.26 N HETATM 3381 C39 UNN A 241 50.912 -10.489 18.819 1.00 0.02 C HETATM 3382 C40 UNN A 241 50.745 -11.990 18.929 1.00 -0.09 C HETATM 3383 N4 UNN A 241 51.837 -12.674 18.212 1.00 0.40 N HETATM 3384 C49 UNN A 241 53.074 -12.447 18.972 1.00 -0.09 C HETATM 3385 C48 UNN A 241 53.393 -10.985 18.922 1.00 0.02 C HETATM 3386 H UNN A 241 54.191 -10.794 19.640 1.00 0.05 H HETATM 3387 H UNN A 241 53.675 -10.742 17.898 1.00 0.05 H HETATM 3388 H UNN A 241 52.942 -12.766 20.006 1.00 0.00 H HETATM 3389 H UNN A 241 53.891 -13.024 18.538 1.00 0.00 H HETATM 3390 C33 UNN A 241 51.563 -14.127 18.307 1.00 -0.13 C HETATM 3391 H UNN A 241 51.541 -14.424 19.356 1.00 -0.00 H HETATM 3392 H UNN A 241 50.599 -14.345 17.846 1.00 -0.00 H HETATM 3393 H UNN A 241 52.348 -14.678 17.789 1.00 -0.00 H HETATM 3394 H UNN A 241 49.791 -12.278 18.487 1.00 0.00 H HETATM 3395 H UNN A 241 50.772 -12.277 19.980 1.00 0.00 H HETATM 3396 H UNN A 241 50.776 -10.171 17.785 1.00 0.05 H HETATM 3397 H UNN A 241 50.165 -9.982 19.430 1.00 0.05 H HETATM 3398 H UNN A 241 54.487 -9.276 20.083 1.00 0.19 H HETATM 3399 H UNN A 241 53.225 -8.255 22.090 1.00 0.08 H HETATM 3400 H UNN A 241 52.015 -5.805 22.477 1.00 0.19 H HETATM 3401 H UNN A 241 52.215 -4.471 19.790 1.00 0.06 H HETATM 3402 H UNN A 241 53.588 -3.160 21.392 1.00 0.03 H HETATM 3403 H UNN A 241 52.055 -2.264 21.015 1.00 0.03 H HETATM 3404 H UNN A 241 51.598 -3.912 23.285 1.00 0.05 H HETATM 3405 H UNN A 241 53.135 -2.971 23.550 1.00 0.05 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 310 309 893 CONECT 805 804 1426 CONECT 893 310 892 CONECT 1426 805 1425 CONECT 2167 2166 2906 CONECT 2906 2167 2905 CONECT 3321 3322 CONECT 3322 3321 3323 3324 3335 CONECT 3323 3322 CONECT 3324 3322 3325 3329 CONECT 3325 3324 3326 3334 CONECT 3326 3325 3327 3333 CONECT 3327 3326 3328 3332 CONECT 3328 3327 3329 3331 CONECT 3329 3324 3328 3330 CONECT 3330 3329 CONECT 3331 3328 CONECT 3332 3327 CONECT 3333 3326 CONECT 3334 3325 CONECT 3335 3322 3336 3404 3405 CONECT 3336 3335 3337 3402 3403 CONECT 3337 3336 3338 3355 3401 CONECT 3338 3337 3339 3353 3354 CONECT 3339 3338 3340 3351 3352 CONECT 3340 3339 3341 3345 CONECT 3341 3340 3342 3350 CONECT 3342 3341 3343 3349 CONECT 3343 3342 3344 3348 CONECT 3344 3343 3345 3347 CONECT 3345 3340 3344 3346 CONECT 3346 3345 CONECT 3347 3344 CONECT 3348 3343 CONECT 3349 3342 CONECT 3350 3341 CONECT 3351 3339 CONECT 3352 3339 CONECT 3353 3338 CONECT 3354 3338 CONECT 3355 3337 3356 3400 CONECT 3356 3355 3357 3358 CONECT 3357 3356 CONECT 3358 3356 3359 3377 3399 CONECT 3359 3358 3360 3375 3376 CONECT 3360 3359 3361 3373 3374 CONECT 3361 3360 3362 3371 3372 CONECT 3362 3361 3363 3370 CONECT 3363 3362 3364 3367 CONECT 3364 3363 3365 3366 CONECT 3365 3364 CONECT 3366 3364 CONECT 3367 3363 3368 3369 CONECT 3368 3367 CONECT 3369 3367 CONECT 3370 3362 CONECT 3371 3361 CONECT 3372 3361 CONECT 3373 3360 CONECT 3374 3360 CONECT 3375 3359 CONECT 3376 3359 CONECT 3377 3358 3378 3398 CONECT 3378 3377 3379 3380 CONECT 3379 3378 CONECT 3380 3378 3381 3385 CONECT 3381 3380 3382 3396 3397 CONECT 3382 3381 3383 3394 3395 CONECT 3383 3382 3384 3390 CONECT 3384 3383 3385 3388 3389 CONECT 3385 3380 3384 3386 3387 CONECT 3386 3385 CONECT 3387 3385 CONECT 3388 3384 CONECT 3389 3384 CONECT 3390 3383 3391 3392 3393 CONECT 3391 3390 CONECT 3392 3390 CONECT 3393 3390 CONECT 3394 3382 CONECT 3395 3382 CONECT 3396 3381 CONECT 3397 3381 CONECT 3398 3377 CONECT 3399 3358 CONECT 3400 3355 CONECT 3401 3337 CONECT 3402 3336 CONECT 3403 3336 CONECT 3404 3335 CONECT 3405 3335 MASTER 0 0 0 0 0 0 0 0 3404 1 95 17 END
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Structure:
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Related entries of code: 3lxs
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1me3
RCSB PDB
PDBbind
215aa, >1ME3_1|Chain... at 99%
1me4
RCSB PDB
PDBbind
215aa, >1ME4_1|Chain... at 99%
1u9q
RCSB PDB
PDBbind
215aa, >1U9Q_1|Chain... at 99%
2oz2
RCSB PDB
PDBbind
215aa, >2OZ2_1|Chains... at 99%
3hd3
RCSB PDB
PDBbind
215aa, >3HD3_1|Chains... at 100%
3i06
RCSB PDB
PDBbind
215aa, >3I06_1|Chain... at 99%
3iut
RCSB PDB
PDBbind
221aa, >3IUT_1|Chain... *
3kku
RCSB PDB
PDBbind
215aa, >3KKU_1|Chain... at 99%
4klb
RCSB PDB
PDBbind
215aa, >4KLB_1|Chains... at 99%
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
3lxs
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Cruzain, the major cysteine protease of Trypanosoma cruzi
Ligand Name
4MC
EC.Number
E.C.3.4.22.51
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
IC50=8nM
Release Year
2010
Protein/NA Sequence
Check fasta file
Primary Reference
(2010) Plos Negl Trop Dis Vol. 4: pp. e825
Ligand Properties
Formula
C
2
9
H
4
5
N
7
O
4
S
Molecular Weight
587.777
Exact Mass
587.325
No. of atoms
86
No. of bonds
88
Polar Surface Area
174.41
LOGP Value
3.69 (
Computed with XLOGP3
)
2.78 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 17
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 3
Canonical SMILES
NC(=[NH+]CCC[C@@H](C(=O)N[C@H](CCS(=O)(=O)c1ccccc1)CCc1ccccc1)NC(=O)N1CC[N@H+](CC1)C)N
InChI String
InChI=1S/C29H43N7O4S/c1-35-18-20-36(21-19-35)29(38)34-26(13-8-17-32-28(30)31)27(37)33-24(15-14-23-9-4-2-5-10-23)16-22-41(39,40)25-11-6-3-7-12-25/h2-7,9-12,24,26H,8,13-22H2,1H3,(H,33,37)(H,34,38)(H4,30,31,32)/p+2/t24-,26-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P25779
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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