Browse entries in the PDBbind-CN Database
HEADER 1UTM_COMPLEX COMPND 1UTM_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 222 ILE VAL GLY GLY TYR GLU CYS LYS PRO TYR SER GLN PRO SEQRES 2 A 222 HIS GLN VAL SER LEU ASN SER GLY TYR HIS PHE CYS GLY SEQRES 3 A 222 GLY SER LEU VAL ASN GLU ASN TRP VAL VAL SER ALA ALA SEQRES 4 A 222 HIS CYS TYR LYS SER ARG VAL GLU VAL ARG LEU GLY GLU SEQRES 5 A 222 HIS ASN ILE LYS VAL THR GLU GLY SER GLU GLN PHE ILE SEQRES 6 A 222 SER SER SER ARG VAL ILE ARG HIS PRO ASN TYR SER SER SEQRES 7 A 222 TYR ASN ILE ASP ASN ASP ILE MET LEU ILE LYS LEU SER SEQRES 8 A 222 LYS PRO ALA THR LEU ASN THR TYR VAL GLN PRO VAL ALA SEQRES 9 A 222 LEU PRO THR SER CYS ALA PRO ALA GLY THR MET CYS THR SEQRES 10 A 222 VAL SER GLY TRP GLY ASN THR MET SER SER THR ALA ASP SEQRES 11 A 222 SER ASN LYS LEU GLN CYS LEU ASN ILE PRO ILE LEU SER SEQRES 12 A 222 TYR SER ASP CYS ASN ASN SER TYR PRO GLY MET ILE THR SEQRES 13 A 222 ASN ALA MET PHE CYS ALA GLY TYR LEU GLU GLY GLY LYS SEQRES 14 A 222 ASP SER CYS GLN GLY ASP SER GLY GLY PRO VAL VAL CYS SEQRES 15 A 222 ASN GLY GLU LEU GLN GLY VAL VAL SER TRP GLY TYR GLY SEQRES 16 A 222 CYS ALA GLU PRO GLY ASN PRO GLY VAL TYR ALA LYS VAL SEQRES 17 A 222 CYS ILE PHE ASN ASP TRP LEU THR SER THR MET ALA SER SEQRES 18 A 222 TYR HET CA A 1 1 HET PEA A 333 21 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 22 CYS A 157 SSBOND 3 CYS A 168 CYS A 182 SSBOND 4 CYS A 136 CYS A 201 SSBOND 5 CYS A 191 CYS A 220 SSBOND 6 CYS A 128 CYS A 232 ATOM 1 N ILE A 16 100.175 73.365 -11.317 1.00 9.80 N ATOM 2 CA ILE A 16 100.307 74.399 -10.237 1.00 11.05 C ATOM 3 C ILE A 16 101.721 74.989 -10.326 1.00 11.98 C ATOM 4 O ILE A 16 102.703 74.243 -10.253 1.00 11.00 O ATOM 5 CB ILE A 16 100.113 73.756 -8.812 1.00 11.30 C ATOM 6 CG1 ILE A 16 98.711 73.140 -8.665 1.00 10.09 C ATOM 7 CG2 ILE A 16 100.394 74.785 -7.691 1.00 11.37 C ATOM 8 CD1 ILE A 16 97.559 74.156 -8.591 1.00 10.20 C ATOM 9 HA ILE A 16 99.544 75.165 -10.374 1.00 0.00 H ATOM 10 HB ILE A 16 100.840 72.950 -8.711 1.00 0.00 H ATOM 11 HG12 ILE A 16 98.535 72.491 -9.523 1.00 0.00 H ATOM 12 HG13 ILE A 16 98.697 72.545 -7.752 1.00 0.00 H ATOM 13 HD11 ILE A 16 97.706 74.808 -7.730 1.00 0.00 H ATOM 14 HD12 ILE A 16 97.544 74.754 -9.503 1.00 0.00 H ATOM 15 HD13 ILE A 16 96.613 73.624 -8.488 1.00 0.00 H ATOM 16 HG21 ILE A 16 101.421 75.141 -7.776 1.00 0.00 H ATOM 17 HG22 ILE A 16 99.707 75.625 -7.790 1.00 0.00 H ATOM 18 HG23 ILE A 16 100.252 74.311 -6.720 1.00 0.00 H ATOM 19 HN3 ILE A 16 100.888 72.621 -11.172 1.00 0.00 H ATOM 20 HN2 ILE A 16 100.323 73.813 -12.244 1.00 0.00 H ATOM 21 HN1 ILE A 16 99.223 72.947 -11.281 1.00 0.00 H ATOM 22 N VAL A 17 101.807 76.311 -10.504 1.00 11.50 N ATOM 23 CA VAL A 17 103.080 77.040 -10.618 1.00 12.04 C ATOM 24 C VAL A 17 103.419 77.763 -9.302 1.00 12.42 C ATOM 25 O VAL A 17 102.576 78.479 -8.744 1.00 12.45 O ATOM 26 CB VAL A 17 103.016 78.120 -11.764 1.00 11.53 C ATOM 27 CG1 VAL A 17 104.346 78.894 -11.882 1.00 11.96 C ATOM 28 CG2 VAL A 17 102.679 77.468 -13.084 1.00 13.82 C ATOM 29 HA VAL A 17 103.848 76.301 -10.848 1.00 0.00 H ATOM 30 HB VAL A 17 102.231 78.831 -11.506 1.00 0.00 H ATOM 31 HG11 VAL A 17 104.555 79.400 -10.940 1.00 0.00 H ATOM 32 HG12 VAL A 17 105.152 78.196 -12.108 1.00 0.00 H ATOM 33 HG13 VAL A 17 104.267 79.630 -12.682 1.00 0.00 H ATOM 34 HG21 VAL A 17 103.445 76.733 -13.331 1.00 0.00 H ATOM 35 HG22 VAL A 17 101.711 76.974 -13.007 1.00 0.00 H ATOM 36 HG23 VAL A 17 102.639 78.229 -13.864 1.00 0.00 H ATOM 37 H VAL A 17 100.923 76.856 -10.565 1.00 0.00 H ATOM 38 N GLY A 18 104.649 77.573 -8.816 1.00 13.43 N ATOM 39 CA GLY A 18 105.096 78.218 -7.587 1.00 13.31 C ATOM 40 C GLY A 18 104.611 77.614 -6.280 1.00 14.62 C ATOM 41 O GLY A 18 104.713 78.262 -5.229 1.00 15.82 O ATOM 42 HA3 GLY A 18 104.759 79.254 -7.617 1.00 0.00 H ATOM 43 HA2 GLY A 18 106.186 78.192 -7.578 1.00 0.00 H ATOM 44 H GLY A 18 105.305 76.949 -9.328 1.00 0.00 H ATOM 45 N GLY A 19 104.103 76.380 -6.313 1.00 13.70 N ATOM 46 CA GLY A 19 103.608 75.747 -5.100 1.00 14.02 C ATOM 47 C GLY A 19 104.579 74.767 -4.469 1.00 14.85 C ATOM 48 O GLY A 19 105.802 74.904 -4.612 1.00 14.78 O ATOM 49 HA3 GLY A 19 102.691 75.211 -5.344 1.00 0.00 H ATOM 50 HA2 GLY A 19 103.388 76.528 -4.372 1.00 0.00 H ATOM 51 H GLY A 19 104.061 75.865 -7.216 1.00 0.00 H ATOM 52 N TYR A 20 104.032 73.757 -3.797 1.00 14.59 N ATOM 53 CA TYR A 20 104.826 72.723 -3.127 1.00 15.69 C ATOM 54 C TYR A 20 104.057 71.395 -3.170 1.00 14.98 C ATOM 55 O TYR A 20 102.846 71.389 -3.349 1.00 14.12 O ATOM 56 CB TYR A 20 105.085 73.127 -1.660 1.00 17.09 C ATOM 57 CG TYR A 20 103.821 73.390 -0.860 1.00 20.62 C ATOM 58 CD1 TYR A 20 103.199 74.644 -0.890 1.00 21.83 C ATOM 59 CD2 TYR A 20 103.207 72.367 -0.125 1.00 21.90 C ATOM 60 CE1 TYR A 20 101.997 74.864 -0.218 1.00 23.50 C ATOM 61 CE2 TYR A 20 102.005 72.578 0.550 1.00 23.61 C ATOM 62 CZ TYR A 20 101.403 73.828 0.496 1.00 24.29 C ATOM 63 OH TYR A 20 100.181 74.028 1.120 1.00 26.98 O ATOM 64 HA TYR A 20 105.783 72.611 -3.636 1.00 0.00 H ATOM 65 HB3 TYR A 20 105.689 74.034 -1.655 1.00 0.00 H ATOM 66 HB2 TYR A 20 105.637 72.322 -1.175 1.00 0.00 H ATOM 67 HD2 TYR A 20 103.679 71.385 -0.080 1.00 0.00 H ATOM 68 HE2 TYR A 20 101.542 71.769 1.115 1.00 0.00 H ATOM 69 HE1 TYR A 20 101.524 75.845 -0.252 1.00 0.00 H ATOM 70 HD1 TYR A 20 103.661 75.460 -1.446 1.00 0.00 H ATOM 71 HH TYR A 20 99.894 74.966 0.987 1.00 0.00 H ATOM 72 H TYR A 20 102.995 73.699 -3.745 1.00 0.00 H ATOM 73 N GLU A 21 104.755 70.270 -3.024 1.00 15.06 N ATOM 74 CA GLU A 21 104.091 68.964 -3.024 1.00 14.35 C ATOM 75 C GLU A 21 103.208 68.836 -1.778 1.00 13.20 C ATOM 76 O GLU A 21 103.678 69.073 -0.660 1.00 15.12 O ATOM 77 CB GLU A 21 105.132 67.827 -3.055 1.00 15.78 C ATOM 78 CG GLU A 21 104.508 66.423 -3.051 1.00 17.45 C ATOM 79 CD GLU A 21 105.525 65.295 -3.178 1.00 20.12 C ATOM 80 OE1 GLU A 21 106.715 65.573 -3.455 1.00 21.39 O ATOM 81 OE2 GLU A 21 105.128 64.122 -3.011 1.00 18.86 O ATOM 82 HA GLU A 21 103.470 68.885 -3.916 1.00 0.00 H ATOM 83 HB2 GLU A 21 105.734 67.935 -3.957 1.00 0.00 H ATOM 84 HB3 GLU A 21 105.773 67.922 -2.179 1.00 0.00 H ATOM 85 HG2 GLU A 21 103.964 66.291 -2.116 1.00 0.00 H ATOM 86 HG3 GLU A 21 103.812 66.354 -3.887 1.00 0.00 H ATOM 87 H GLU A 21 105.787 70.319 -2.908 1.00 0.00 H ATOM 88 N CYS A 22 101.932 68.497 -1.961 1.00 11.47 N ATOM 89 CA CYS A 22 101.013 68.348 -0.826 1.00 12.04 C ATOM 90 C CYS A 22 101.433 67.165 0.044 1.00 12.99 C ATOM 91 O CYS A 22 102.055 66.226 -0.453 1.00 13.67 O ATOM 92 CB CYS A 22 99.583 68.020 -1.300 1.00 11.54 C ATOM 93 SG CYS A 22 98.764 69.080 -2.539 1.00 10.56 S ATOM 94 HA CYS A 22 101.041 69.292 -0.282 1.00 0.00 H ATOM 95 HB2 CYS A 22 98.949 68.025 -0.413 1.00 0.00 H ATOM 96 HB3 CYS A 22 99.613 67.014 -1.718 1.00 0.00 H ATOM 97 H CYS A 22 101.581 68.335 -2.926 1.00 0.00 H ATOM 98 N LYS A 23 101.109 67.203 1.336 1.00 14.24 N ATOM 99 CA LYS A 23 101.374 66.045 2.206 1.00 15.13 C ATOM 100 C LYS A 23 100.401 64.989 1.645 1.00 14.76 C ATOM 101 O LYS A 23 99.229 65.299 1.384 1.00 13.81 O ATOM 102 CB LYS A 23 101.014 66.337 3.673 1.00 16.81 C ATOM 103 CG LYS A 23 101.994 67.243 4.394 1.00 19.90 C ATOM 104 CD LYS A 23 101.572 67.494 5.832 1.00 19.29 C ATOM 105 CE LYS A 23 102.580 68.376 6.550 1.00 19.57 C ATOM 106 NZ LYS A 23 102.165 68.662 7.950 1.00 19.71 N ATOM 107 HA LYS A 23 102.424 65.752 2.207 1.00 0.00 H ATOM 108 HB2 LYS A 23 100.033 66.811 3.695 1.00 0.00 H ATOM 109 HB3 LYS A 23 100.970 65.388 4.208 1.00 0.00 H ATOM 110 HG2 LYS A 23 102.978 66.774 4.391 1.00 0.00 H ATOM 111 HG3 LYS A 23 102.046 68.197 3.869 1.00 0.00 H ATOM 112 HD2 LYS A 23 100.600 67.986 5.838 1.00 0.00 H ATOM 113 HD3 LYS A 23 101.498 66.540 6.354 1.00 0.00 H ATOM 114 HE2 LYS A 23 102.673 69.318 6.010 1.00 0.00 H ATOM 115 HE3 LYS A 23 103.545 67.870 6.564 1.00 0.00 H ATOM 116 HZ1 LYS A 23 101.247 69.151 7.945 1.00 0.00 H ATOM 117 HZ2 LYS A 23 102.080 67.768 8.475 1.00 0.00 H ATOM 118 HZ3 LYS A 23 102.879 69.266 8.405 1.00 0.00 H ATOM 119 H LYS A 23 100.666 68.056 1.733 1.00 0.00 H ATOM 120 N PRO A 24 100.872 63.746 1.426 1.00 15.29 N ATOM 121 CA PRO A 24 99.990 62.696 0.880 1.00 15.45 C ATOM 122 C PRO A 24 98.630 62.576 1.568 1.00 14.84 C ATOM 123 O PRO A 24 98.546 62.523 2.798 1.00 15.13 O ATOM 124 CB PRO A 24 100.828 61.418 1.043 1.00 15.62 C ATOM 125 CG PRO A 24 102.238 61.919 0.928 1.00 16.17 C ATOM 126 CD PRO A 24 102.221 63.215 1.711 1.00 15.67 C ATOM 127 HA PRO A 24 99.708 62.917 -0.150 1.00 0.00 H ATOM 128 HD3 PRO A 24 102.355 63.033 2.777 1.00 0.00 H ATOM 129 HD2 PRO A 24 102.995 63.897 1.360 1.00 0.00 H ATOM 130 HG3 PRO A 24 102.504 62.097 -0.114 1.00 0.00 H ATOM 131 HG2 PRO A 24 102.940 61.209 1.365 1.00 0.00 H ATOM 132 HB2 PRO A 24 100.654 60.957 2.015 1.00 0.00 H ATOM 133 HB3 PRO A 24 100.602 60.699 0.256 1.00 0.00 H ATOM 134 N TYR A 25 97.570 62.579 0.761 1.00 13.91 N ATOM 135 CA TYR A 25 96.186 62.455 1.230 1.00 13.65 C ATOM 136 C TYR A 25 95.664 63.574 2.150 1.00 13.18 C ATOM 137 O TYR A 25 94.682 63.380 2.877 1.00 12.23 O ATOM 138 CB TYR A 25 95.953 61.077 1.864 1.00 14.99 C ATOM 139 CG TYR A 25 96.560 59.935 1.068 1.00 16.25 C ATOM 140 CD1 TYR A 25 97.660 59.231 1.564 1.00 16.75 C ATOM 141 CD2 TYR A 25 96.050 59.574 -0.182 1.00 15.58 C ATOM 142 CE1 TYR A 25 98.240 58.200 0.842 1.00 17.31 C ATOM 143 CE2 TYR A 25 96.621 58.539 -0.920 1.00 17.36 C ATOM 144 CZ TYR A 25 97.717 57.857 -0.398 1.00 18.55 C ATOM 145 OH TYR A 25 98.292 56.820 -1.093 1.00 20.08 O ATOM 146 HA TYR A 25 95.592 62.569 0.323 1.00 0.00 H ATOM 147 HB3 TYR A 25 94.879 60.910 1.943 1.00 0.00 H ATOM 148 HB2 TYR A 25 96.394 61.076 2.861 1.00 0.00 H ATOM 149 HD2 TYR A 25 95.192 60.111 -0.586 1.00 0.00 H ATOM 150 HE2 TYR A 25 96.215 58.267 -1.894 1.00 0.00 H ATOM 151 HE1 TYR A 25 99.099 57.663 1.244 1.00 0.00 H ATOM 152 HD1 TYR A 25 98.070 59.498 2.538 1.00 0.00 H ATOM 153 HH TYR A 25 97.620 56.108 -1.237 1.00 0.00 H ATOM 154 H TYR A 25 97.734 62.675 -0.262 1.00 0.00 H ATOM 155 N SER A 26 96.295 64.751 2.086 1.00 12.58 N ATOM 156 CA SER A 26 95.849 65.895 2.882 1.00 12.28 C ATOM 157 C SER A 26 94.657 66.615 2.232 1.00 12.60 C ATOM 158 O SER A 26 94.015 67.460 2.867 1.00 13.35 O ATOM 159 CB SER A 26 96.999 66.878 3.158 1.00 12.49 C ATOM 160 OG SER A 26 97.579 67.385 1.966 1.00 13.41 O ATOM 161 HA SER A 26 95.512 65.499 3.840 1.00 0.00 H ATOM 162 HB2 SER A 26 97.770 66.362 3.730 1.00 0.00 H ATOM 163 HB3 SER A 26 96.613 67.713 3.742 1.00 0.00 H ATOM 164 HG SER A 26 97.941 66.634 1.431 1.00 0.00 H ATOM 165 H SER A 26 97.118 64.855 1.459 1.00 0.00 H ATOM 166 N GLN A 27 94.356 66.273 0.977 1.00 11.54 N ATOM 167 CA GLN A 27 93.223 66.850 0.228 1.00 10.77 C ATOM 168 C GLN A 27 92.433 65.623 -0.285 1.00 11.05 C ATOM 169 O GLN A 27 92.310 65.423 -1.501 1.00 10.51 O ATOM 170 CB GLN A 27 93.731 67.675 -0.974 1.00 10.90 C ATOM 171 CG GLN A 27 94.923 68.604 -0.701 1.00 12.06 C ATOM 172 CD GLN A 27 94.599 69.727 0.277 1.00 13.58 C ATOM 173 OE1 GLN A 27 93.538 70.362 0.197 1.00 12.92 O ATOM 174 NE2 GLN A 27 95.509 69.969 1.216 1.00 15.35 N ATOM 175 HA GLN A 27 92.622 67.517 0.846 1.00 0.00 H ATOM 176 HB2 GLN A 27 94.026 66.976 -1.757 1.00 0.00 H ATOM 177 HB3 GLN A 27 92.904 68.290 -1.330 1.00 0.00 H ATOM 178 HG2 GLN A 27 95.738 68.010 -0.288 1.00 0.00 H ATOM 179 HG3 GLN A 27 95.240 69.047 -1.645 1.00 0.00 H ATOM 180 HE22 GLN A 27 96.386 69.411 1.246 1.00 0.00 H ATOM 181 HE21 GLN A 27 95.343 70.716 1.920 1.00 0.00 H ATOM 182 H GLN A 27 94.951 65.564 0.503 1.00 0.00 H ATOM 183 N PRO A 28 91.817 64.849 0.630 1.00 10.76 N ATOM 184 CA PRO A 28 91.054 63.630 0.287 1.00 10.04 C ATOM 185 C PRO A 28 89.843 63.708 -0.644 1.00 9.62 C ATOM 186 O PRO A 28 89.323 62.672 -1.073 1.00 9.41 O ATOM 187 CB PRO A 28 90.715 63.042 1.664 1.00 11.47 C ATOM 188 CG PRO A 28 90.524 64.251 2.511 1.00 10.52 C ATOM 189 CD PRO A 28 91.657 65.173 2.065 1.00 10.83 C ATOM 190 HA PRO A 28 91.675 63.014 -0.364 1.00 0.00 H ATOM 191 HD3 PRO A 28 91.385 66.220 2.201 1.00 0.00 H ATOM 192 HD2 PRO A 28 92.573 64.962 2.617 1.00 0.00 H ATOM 193 HG3 PRO A 28 90.613 64.005 3.569 1.00 0.00 H ATOM 194 HG2 PRO A 28 89.552 64.708 2.326 1.00 0.00 H ATOM 195 HB2 PRO A 28 89.803 62.446 1.621 1.00 0.00 H ATOM 196 HB3 PRO A 28 91.533 62.427 2.039 1.00 0.00 H ATOM 197 N HIS A 29 89.410 64.926 -0.956 1.00 8.33 N ATOM 198 CA HIS A 29 88.286 65.180 -1.858 1.00 7.95 C ATOM 199 C HIS A 29 88.747 65.308 -3.333 1.00 7.09 C ATOM 200 O HIS A 29 87.919 65.286 -4.253 1.00 7.48 O ATOM 201 CB HIS A 29 87.580 66.484 -1.440 1.00 8.00 C ATOM 202 CG HIS A 29 88.513 67.655 -1.336 1.00 9.37 C ATOM 203 ND1 HIS A 29 89.246 67.921 -0.198 1.00 9.66 N ATOM 204 CD2 HIS A 29 88.911 68.563 -2.259 1.00 9.56 C ATOM 205 CE1 HIS A 29 90.065 68.932 -0.431 1.00 10.72 C ATOM 206 NE2 HIS A 29 89.882 69.339 -1.674 1.00 10.21 N ATOM 207 HA HIS A 29 87.605 64.332 -1.787 1.00 0.00 H ATOM 208 HB2 HIS A 29 86.814 66.716 -2.180 1.00 0.00 H ATOM 209 HB3 HIS A 29 87.110 66.328 -0.469 1.00 0.00 H ATOM 210 HD2 HIS A 29 88.532 68.660 -3.276 1.00 0.00 H ATOM 211 HE1 HIS A 29 90.771 69.358 0.282 1.00 0.00 H ATOM 212 H HIS A 29 89.897 65.743 -0.536 1.00 0.00 H ATOM 213 N GLN A 30 90.048 65.487 -3.553 1.00 7.80 N ATOM 214 CA GLN A 30 90.597 65.659 -4.911 1.00 7.70 C ATOM 215 C GLN A 30 90.468 64.419 -5.812 1.00 9.36 C ATOM 216 O GLN A 30 90.799 63.308 -5.386 1.00 10.49 O ATOM 217 CB GLN A 30 92.081 66.056 -4.825 1.00 9.06 C ATOM 218 CG GLN A 30 92.824 66.158 -6.167 1.00 8.50 C ATOM 219 CD GLN A 30 92.675 67.523 -6.861 1.00 10.33 C ATOM 220 OE1 GLN A 30 92.967 68.562 -6.271 1.00 11.24 O ATOM 221 NE2 GLN A 30 92.269 67.513 -8.132 1.00 10.06 N ATOM 222 HA GLN A 30 89.997 66.443 -5.372 1.00 0.00 H ATOM 223 HB2 GLN A 30 92.140 67.028 -4.335 1.00 0.00 H ATOM 224 HB3 GLN A 30 92.592 65.311 -4.215 1.00 0.00 H ATOM 225 HG2 GLN A 30 93.884 65.978 -5.987 1.00 0.00 H ATOM 226 HG3 GLN A 30 92.434 65.389 -6.834 1.00 0.00 H ATOM 227 HE22 GLN A 30 92.031 66.613 -8.595 1.00 0.00 H ATOM 228 HE21 GLN A 30 92.190 68.406 -8.660 1.00 0.00 H ATOM 229 H GLN A 30 90.698 65.506 -2.741 1.00 0.00 H ATOM 230 N VAL A 31 89.974 64.603 -7.037 1.00 9.21 N ATOM 231 CA VAL A 31 89.878 63.500 -8.000 1.00 9.03 C ATOM 232 C VAL A 31 90.524 63.867 -9.353 1.00 9.92 C ATOM 233 O VAL A 31 90.782 65.052 -9.637 1.00 7.73 O ATOM 234 CB VAL A 31 88.414 63.024 -8.252 1.00 10.77 C ATOM 235 CG1 VAL A 31 87.689 62.791 -6.947 1.00 11.16 C ATOM 236 CG2 VAL A 31 87.658 64.005 -9.137 1.00 11.14 C ATOM 237 HA VAL A 31 90.425 62.677 -7.541 1.00 0.00 H ATOM 238 HB VAL A 31 88.459 62.073 -8.783 1.00 0.00 H ATOM 239 HG11 VAL A 31 88.212 62.026 -6.374 1.00 0.00 H ATOM 240 HG12 VAL A 31 87.662 63.720 -6.377 1.00 0.00 H ATOM 241 HG13 VAL A 31 86.671 62.460 -7.152 1.00 0.00 H ATOM 242 HG21 VAL A 31 87.627 64.981 -8.652 1.00 0.00 H ATOM 243 HG22 VAL A 31 88.165 64.091 -10.098 1.00 0.00 H ATOM 244 HG23 VAL A 31 86.642 63.643 -9.293 1.00 0.00 H ATOM 245 H VAL A 31 89.649 65.551 -7.316 1.00 0.00 H ATOM 246 N SER A 32 90.857 62.833 -10.137 1.00 10.18 N ATOM 247 CA SER A 32 91.433 62.970 -11.485 1.00 8.29 C ATOM 248 C SER A 32 90.400 62.410 -12.479 1.00 9.77 C ATOM 249 O SER A 32 89.826 61.336 -12.225 1.00 10.38 O ATOM 250 CB SER A 32 92.735 62.146 -11.592 1.00 8.47 C ATOM 251 OG SER A 32 93.250 62.083 -12.923 1.00 9.98 O ATOM 252 HA SER A 32 91.664 64.014 -11.696 1.00 0.00 H ATOM 253 HB2 SER A 32 92.533 61.131 -11.249 1.00 0.00 H ATOM 254 HB3 SER A 32 93.488 62.602 -10.949 1.00 0.00 H ATOM 255 HG SER A 32 93.447 62.999 -13.243 1.00 0.00 H ATOM 256 H SER A 32 90.699 61.873 -9.770 1.00 0.00 H ATOM 257 N LEU A 33 90.097 63.164 -13.546 1.00 8.92 N ATOM 258 CA LEU A 33 89.171 62.724 -14.614 1.00 9.39 C ATOM 259 C LEU A 33 90.054 62.113 -15.724 1.00 9.34 C ATOM 260 O LEU A 33 90.994 62.764 -16.204 1.00 8.67 O ATOM 261 CB LEU A 33 88.348 63.904 -15.161 1.00 10.62 C ATOM 262 CG LEU A 33 87.478 64.673 -14.155 1.00 11.26 C ATOM 263 CD1 LEU A 33 86.565 65.637 -14.917 1.00 11.73 C ATOM 264 CD2 LEU A 33 86.650 63.727 -13.298 1.00 11.87 C ATOM 265 HA LEU A 33 88.452 61.999 -14.231 1.00 0.00 H ATOM 266 HB2 LEU A 33 89.046 64.615 -15.604 1.00 0.00 H ATOM 267 HB3 LEU A 33 87.688 63.514 -15.936 1.00 0.00 H ATOM 268 HG LEU A 33 88.131 65.233 -13.485 1.00 0.00 H ATOM 269 HD21 LEU A 33 85.997 63.136 -13.939 1.00 0.00 H ATOM 270 HD22 LEU A 33 87.315 63.064 -12.745 1.00 0.00 H ATOM 271 HD23 LEU A 33 86.047 64.306 -12.598 1.00 0.00 H ATOM 272 HD11 LEU A 33 87.174 66.338 -15.487 1.00 0.00 H ATOM 273 HD12 LEU A 33 85.928 65.071 -15.597 1.00 0.00 H ATOM 274 HD13 LEU A 33 85.945 66.186 -14.208 1.00 0.00 H ATOM 275 H LEU A 33 90.534 64.104 -13.627 1.00 0.00 H ATOM 276 N ASN A 34 89.724 60.889 -16.145 1.00 9.98 N ATOM 277 CA ASN A 34 90.540 60.136 -17.106 1.00 10.65 C ATOM 278 C ASN A 34 89.775 59.582 -18.331 1.00 11.59 C ATOM 279 O ASN A 34 88.672 59.044 -18.194 1.00 11.81 O ATOM 280 CB ASN A 34 91.195 58.977 -16.307 1.00 10.50 C ATOM 281 CG ASN A 34 92.214 58.159 -17.115 1.00 11.05 C ATOM 282 OD1 ASN A 34 91.854 57.409 -18.027 1.00 11.22 O ATOM 283 ND2 ASN A 34 93.480 58.250 -16.728 1.00 8.93 N ATOM 284 HA ASN A 34 91.267 60.821 -17.542 1.00 0.00 H ATOM 285 HB2 ASN A 34 91.704 59.402 -15.442 1.00 0.00 H ATOM 286 HB3 ASN A 34 90.406 58.305 -15.969 1.00 0.00 H ATOM 287 HD22 ASN A 34 93.742 58.894 -15.955 1.00 0.00 H ATOM 288 HD21 ASN A 34 94.210 57.677 -17.198 1.00 0.00 H ATOM 289 H ASN A 34 88.855 60.452 -15.778 1.00 0.00 H ATOM 290 N SER A 37 90.358 59.752 -19.520 1.00 12.39 N ATOM 291 CA SER A 37 89.783 59.242 -20.779 1.00 14.40 C ATOM 292 C SER A 37 90.929 58.648 -21.619 1.00 14.07 C ATOM 293 O SER A 37 91.035 58.899 -22.827 1.00 15.47 O ATOM 294 CB SER A 37 89.100 60.371 -21.568 1.00 16.22 C ATOM 295 OG SER A 37 90.029 61.403 -21.890 1.00 19.55 O ATOM 296 HA SER A 37 89.031 58.485 -20.555 1.00 0.00 H ATOM 297 HB2 SER A 37 88.295 60.791 -20.965 1.00 0.00 H ATOM 298 HB3 SER A 37 88.687 59.962 -22.490 1.00 0.00 H ATOM 299 HG SER A 37 90.760 61.027 -22.441 1.00 0.00 H ATOM 300 H SER A 37 91.260 60.268 -19.560 1.00 0.00 H ATOM 301 N GLY A 38 91.763 57.838 -20.972 1.00 13.51 N ATOM 302 CA GLY A 38 92.917 57.253 -21.631 1.00 12.07 C ATOM 303 C GLY A 38 94.171 57.940 -21.116 1.00 12.21 C ATOM 304 O GLY A 38 95.294 57.486 -21.368 1.00 11.66 O ATOM 305 HA3 GLY A 38 92.836 57.396 -22.709 1.00 0.00 H ATOM 306 HA2 GLY A 38 92.965 56.187 -21.410 1.00 0.00 H ATOM 307 H GLY A 38 91.584 57.619 -19.971 1.00 0.00 H ATOM 308 N TYR A 39 93.960 59.041 -20.382 1.00 11.43 N ATOM 309 CA TYR A 39 95.007 59.868 -19.771 1.00 11.06 C ATOM 310 C TYR A 39 94.312 60.918 -18.889 1.00 10.43 C ATOM 311 O TYR A 39 93.105 61.129 -19.026 1.00 9.99 O ATOM 312 CB TYR A 39 95.839 60.584 -20.849 1.00 12.10 C ATOM 313 CG TYR A 39 95.009 61.265 -21.919 1.00 14.16 C ATOM 314 CD1 TYR A 39 94.728 60.614 -23.122 1.00 15.29 C ATOM 315 CD2 TYR A 39 94.482 62.551 -21.722 1.00 15.70 C ATOM 316 CE1 TYR A 39 93.941 61.214 -24.109 1.00 16.84 C ATOM 317 CE2 TYR A 39 93.693 63.165 -22.701 1.00 17.64 C ATOM 318 CZ TYR A 39 93.425 62.490 -23.895 1.00 19.02 C ATOM 319 OH TYR A 39 92.643 63.080 -24.879 1.00 21.91 O ATOM 320 HA TYR A 39 95.679 59.239 -19.187 1.00 0.00 H ATOM 321 HB3 TYR A 39 96.482 59.848 -21.331 1.00 0.00 H ATOM 322 HB2 TYR A 39 96.455 61.339 -20.361 1.00 0.00 H ATOM 323 HD2 TYR A 39 94.691 63.080 -20.792 1.00 0.00 H ATOM 324 HE2 TYR A 39 93.290 64.164 -22.533 1.00 0.00 H ATOM 325 HE1 TYR A 39 93.732 60.687 -25.040 1.00 0.00 H ATOM 326 HD1 TYR A 39 95.131 59.616 -23.295 1.00 0.00 H ATOM 327 HH TYR A 39 92.560 62.462 -25.648 1.00 0.00 H ATOM 328 H TYR A 39 92.973 59.333 -20.233 1.00 0.00 H ATOM 329 N HIS A 40 95.053 61.534 -17.967 1.00 10.88 N ATOM 330 CA HIS A 40 94.492 62.588 -17.094 1.00 10.18 C ATOM 331 C HIS A 40 94.248 63.848 -17.944 1.00 10.18 C ATOM 332 O HIS A 40 95.123 64.237 -18.722 1.00 10.40 O ATOM 333 CB HIS A 40 95.494 62.912 -15.966 1.00 10.30 C ATOM 334 CG HIS A 40 95.201 64.192 -15.227 1.00 9.83 C ATOM 335 ND1 HIS A 40 94.340 64.256 -14.151 1.00 9.87 N ATOM 336 CD2 HIS A 40 95.660 65.454 -15.415 1.00 9.96 C ATOM 337 CE1 HIS A 40 94.277 65.499 -13.711 1.00 9.87 C ATOM 338 NE2 HIS A 40 95.068 66.245 -14.460 1.00 8.79 N ATOM 339 HA HIS A 40 93.556 62.248 -16.651 1.00 0.00 H ATOM 340 HB2 HIS A 40 95.478 62.092 -15.248 1.00 0.00 H ATOM 341 HB3 HIS A 40 96.489 62.990 -16.404 1.00 0.00 H ATOM 342 HD2 HIS A 40 96.365 65.780 -16.179 1.00 0.00 H ATOM 343 HE1 HIS A 40 93.675 65.850 -12.873 1.00 0.00 H ATOM 344 H HIS A 40 96.052 61.266 -17.859 1.00 0.00 H ATOM 345 N PHE A 41 93.078 64.476 -17.815 1.00 9.61 N ATOM 346 CA PHE A 41 92.787 65.703 -18.574 1.00 9.70 C ATOM 347 C PHE A 41 92.168 66.861 -17.753 1.00 9.99 C ATOM 348 O PHE A 41 92.191 68.009 -18.195 1.00 10.81 O ATOM 349 CB PHE A 41 91.957 65.412 -19.856 1.00 10.27 C ATOM 350 CG PHE A 41 90.508 65.052 -19.599 1.00 10.98 C ATOM 351 CD1 PHE A 41 90.142 63.735 -19.329 1.00 10.76 C ATOM 352 CD2 PHE A 41 89.514 66.041 -19.589 1.00 11.03 C ATOM 353 CE1 PHE A 41 88.814 63.404 -19.039 1.00 11.87 C ATOM 354 CE2 PHE A 41 88.172 65.723 -19.301 1.00 11.43 C ATOM 355 CZ PHE A 41 87.822 64.403 -19.022 1.00 12.46 C ATOM 356 HA PHE A 41 93.771 66.068 -18.870 1.00 0.00 H ATOM 357 HB2 PHE A 41 91.980 66.301 -20.486 1.00 0.00 H ATOM 358 HB3 PHE A 41 92.426 64.582 -20.384 1.00 0.00 H ATOM 359 HD2 PHE A 41 89.784 67.074 -19.808 1.00 0.00 H ATOM 360 HE2 PHE A 41 87.412 66.504 -19.296 1.00 0.00 H ATOM 361 HZ PHE A 41 86.788 64.146 -18.792 1.00 0.00 H ATOM 362 HE1 PHE A 41 88.546 62.369 -18.825 1.00 0.00 H ATOM 363 HD1 PHE A 41 90.900 62.952 -19.344 1.00 0.00 H ATOM 364 H PHE A 41 92.360 64.092 -17.168 1.00 0.00 H ATOM 365 N CYS A 42 91.638 66.567 -16.565 1.00 9.18 N ATOM 366 CA CYS A 42 91.023 67.592 -15.693 1.00 8.94 C ATOM 367 C CYS A 42 90.910 67.072 -14.247 1.00 9.14 C ATOM 368 O CYS A 42 91.058 65.863 -14.000 1.00 8.17 O ATOM 369 CB CYS A 42 89.598 67.969 -16.183 1.00 8.68 C ATOM 370 SG CYS A 42 89.447 69.256 -17.480 1.00 8.45 S ATOM 371 HA CYS A 42 91.665 68.472 -15.731 1.00 0.00 H ATOM 372 HB2 CYS A 42 89.037 68.316 -15.315 1.00 0.00 H ATOM 373 HB3 CYS A 42 89.138 67.061 -16.572 1.00 0.00 H ATOM 374 H CYS A 42 91.658 65.580 -16.239 1.00 0.00 H ATOM 375 N GLY A 43 90.704 67.996 -13.303 1.00 8.24 N ATOM 376 CA GLY A 43 90.515 67.645 -11.898 1.00 8.19 C ATOM 377 C GLY A 43 89.035 67.762 -11.507 1.00 7.92 C ATOM 378 O GLY A 43 88.191 68.095 -12.361 1.00 8.14 O ATOM 379 HA3 GLY A 43 91.104 68.320 -11.277 1.00 0.00 H ATOM 380 HA2 GLY A 43 90.849 66.620 -11.736 1.00 0.00 H ATOM 381 H GLY A 43 90.677 68.999 -13.578 1.00 0.00 H ATOM 382 N GLY A 44 88.719 67.486 -10.235 1.00 8.16 N ATOM 383 CA GLY A 44 87.353 67.570 -9.710 1.00 7.46 C ATOM 384 C GLY A 44 87.351 67.412 -8.183 1.00 6.65 C ATOM 385 O GLY A 44 88.417 67.162 -7.596 1.00 7.36 O ATOM 386 HA3 GLY A 44 86.749 66.778 -10.153 1.00 0.00 H ATOM 387 HA2 GLY A 44 86.927 68.539 -9.971 1.00 0.00 H ATOM 388 H GLY A 44 89.480 67.198 -9.588 1.00 0.00 H ATOM 389 N SER A 45 86.181 67.555 -7.552 1.00 6.75 N ATOM 390 CA SER A 45 86.022 67.419 -6.090 1.00 8.24 C ATOM 391 C SER A 45 84.816 66.541 -5.688 1.00 7.67 C ATOM 392 O SER A 45 83.706 66.738 -6.176 1.00 8.26 O ATOM 393 CB SER A 45 85.829 68.797 -5.431 1.00 9.23 C ATOM 394 OG SER A 45 86.918 69.671 -5.660 1.00 10.30 O ATOM 395 HA SER A 45 86.937 66.939 -5.744 1.00 0.00 H ATOM 396 HB2 SER A 45 85.715 68.657 -4.356 1.00 0.00 H ATOM 397 HB3 SER A 45 84.925 69.253 -5.835 1.00 0.00 H ATOM 398 HG SER A 45 87.026 69.813 -6.634 1.00 0.00 H ATOM 399 H SER A 45 85.338 67.774 -8.121 1.00 0.00 H ATOM 400 N LEU A 46 85.034 65.588 -4.781 1.00 8.82 N ATOM 401 CA LEU A 46 83.963 64.712 -4.274 1.00 9.68 C ATOM 402 C LEU A 46 83.186 65.485 -3.196 1.00 10.03 C ATOM 403 O LEU A 46 83.786 65.953 -2.215 1.00 10.54 O ATOM 404 CB LEU A 46 84.575 63.453 -3.636 1.00 9.83 C ATOM 405 CG LEU A 46 83.634 62.372 -3.077 1.00 11.11 C ATOM 406 CD1 LEU A 46 82.953 61.621 -4.239 1.00 11.57 C ATOM 407 CD2 LEU A 46 84.428 61.391 -2.211 1.00 10.93 C ATOM 408 HA LEU A 46 83.307 64.416 -5.092 1.00 0.00 H ATOM 409 HB2 LEU A 46 85.194 62.977 -4.397 1.00 0.00 H ATOM 410 HB3 LEU A 46 85.206 63.786 -2.812 1.00 0.00 H ATOM 411 HG LEU A 46 82.867 62.845 -2.464 1.00 0.00 H ATOM 412 HD21 LEU A 46 85.202 60.918 -2.816 1.00 0.00 H ATOM 413 HD22 LEU A 46 84.890 61.930 -1.384 1.00 0.00 H ATOM 414 HD23 LEU A 46 83.755 60.628 -1.818 1.00 0.00 H ATOM 415 HD11 LEU A 46 82.377 62.326 -4.838 1.00 0.00 H ATOM 416 HD12 LEU A 46 83.714 61.151 -4.861 1.00 0.00 H ATOM 417 HD13 LEU A 46 82.288 60.857 -3.836 1.00 0.00 H ATOM 418 H LEU A 46 85.999 65.458 -4.417 1.00 0.00 H ATOM 419 N VAL A 47 81.870 65.628 -3.369 1.00 11.00 N ATOM 420 CA VAL A 47 81.057 66.365 -2.392 1.00 12.56 C ATOM 421 C VAL A 47 80.164 65.481 -1.515 1.00 14.11 C ATOM 422 O VAL A 47 79.574 65.953 -0.542 1.00 14.95 O ATOM 423 CB VAL A 47 80.250 67.521 -3.043 1.00 12.48 C ATOM 424 CG1 VAL A 47 81.212 68.601 -3.538 1.00 13.81 C ATOM 425 CG2 VAL A 47 79.369 67.012 -4.190 1.00 12.12 C ATOM 426 HA VAL A 47 81.785 66.808 -1.713 1.00 0.00 H ATOM 427 HB VAL A 47 79.587 67.948 -2.290 1.00 0.00 H ATOM 428 HG11 VAL A 47 81.786 68.988 -2.696 1.00 0.00 H ATOM 429 HG12 VAL A 47 81.890 68.171 -4.275 1.00 0.00 H ATOM 430 HG13 VAL A 47 80.643 69.411 -3.994 1.00 0.00 H ATOM 431 HG21 VAL A 47 79.998 66.555 -4.954 1.00 0.00 H ATOM 432 HG22 VAL A 47 78.666 66.272 -3.806 1.00 0.00 H ATOM 433 HG23 VAL A 47 78.819 67.848 -4.622 1.00 0.00 H ATOM 434 H VAL A 47 81.414 65.212 -4.206 1.00 0.00 H ATOM 435 N ASN A 48 80.044 64.212 -1.901 1.00 15.80 N ATOM 436 CA ASN A 48 79.302 63.182 -1.159 1.00 17.50 C ATOM 437 C ASN A 48 79.590 61.828 -1.825 1.00 17.49 C ATOM 438 O ASN A 48 80.263 61.783 -2.849 1.00 17.98 O ATOM 439 CB ASN A 48 77.792 63.490 -0.991 1.00 19.02 C ATOM 440 CG ASN A 48 77.006 63.446 -2.294 1.00 19.98 C ATOM 441 OD1 ASN A 48 76.992 62.443 -3.000 1.00 22.28 O ATOM 442 ND2 ASN A 48 76.285 64.522 -2.575 1.00 22.42 N ATOM 443 HA ASN A 48 79.653 63.160 -0.127 1.00 0.00 H ATOM 444 HB2 ASN A 48 77.365 62.756 -0.307 1.00 0.00 H ATOM 445 HB3 ASN A 48 77.690 64.487 -0.562 1.00 0.00 H ATOM 446 HD22 ASN A 48 76.325 65.352 -1.950 1.00 0.00 H ATOM 447 HD21 ASN A 48 75.679 64.536 -3.420 1.00 0.00 H ATOM 448 H ASN A 48 80.507 63.930 -2.789 1.00 0.00 H ATOM 449 N GLU A 49 79.127 60.730 -1.239 1.00 17.89 N ATOM 450 CA GLU A 49 79.412 59.401 -1.800 1.00 17.79 C ATOM 451 C GLU A 49 79.024 59.126 -3.268 1.00 16.76 C ATOM 452 O GLU A 49 79.604 58.236 -3.895 1.00 17.64 O ATOM 453 CB GLU A 49 78.841 58.299 -0.885 1.00 18.99 C ATOM 454 CG GLU A 49 77.330 58.346 -0.710 1.00 19.26 C ATOM 455 CD GLU A 49 76.801 57.189 0.114 1.00 19.58 C ATOM 456 OE1 GLU A 49 76.263 56.232 -0.482 1.00 19.45 O ATOM 457 OE2 GLU A 49 76.924 57.235 1.356 1.00 19.94 O ATOM 458 HA GLU A 49 80.501 59.386 -1.832 1.00 0.00 H ATOM 459 HB2 GLU A 49 79.105 57.331 -1.311 1.00 0.00 H ATOM 460 HB3 GLU A 49 79.301 58.399 0.098 1.00 0.00 H ATOM 461 HG2 GLU A 49 77.065 59.279 -0.212 1.00 0.00 H ATOM 462 HG3 GLU A 49 76.863 58.316 -1.695 1.00 0.00 H ATOM 463 H GLU A 49 78.556 60.811 -0.373 1.00 0.00 H ATOM 464 N ASN A 50 78.098 59.902 -3.831 1.00 15.43 N ATOM 465 CA ASN A 50 77.650 59.683 -5.214 1.00 15.18 C ATOM 466 C ASN A 50 77.910 60.802 -6.235 1.00 13.81 C ATOM 467 O ASN A 50 77.684 60.586 -7.429 1.00 14.31 O ATOM 468 CB ASN A 50 76.136 59.412 -5.246 1.00 17.99 C ATOM 469 CG ASN A 50 75.742 58.149 -4.517 1.00 20.74 C ATOM 470 OD1 ASN A 50 76.102 57.047 -4.917 1.00 23.88 O ATOM 471 ND2 ASN A 50 74.984 58.303 -3.443 1.00 22.91 N ATOM 472 HA ASN A 50 78.265 58.838 -5.522 1.00 0.00 H ATOM 473 HB2 ASN A 50 75.623 60.254 -4.782 1.00 0.00 H ATOM 474 HB3 ASN A 50 75.821 59.325 -6.286 1.00 0.00 H ATOM 475 HD22 ASN A 50 74.701 59.256 -3.138 1.00 0.00 H ATOM 476 HD21 ASN A 50 74.671 57.471 -2.904 1.00 0.00 H ATOM 477 H ASN A 50 77.683 60.680 -3.279 1.00 0.00 H ATOM 478 N TRP A 51 78.380 61.972 -5.794 1.00 12.55 N ATOM 479 CA TRP A 51 78.562 63.111 -6.721 1.00 11.81 C ATOM 480 C TRP A 51 79.903 63.850 -6.685 1.00 10.02 C ATOM 481 O TRP A 51 80.481 64.055 -5.612 1.00 10.06 O ATOM 482 CB TRP A 51 77.448 64.150 -6.499 1.00 11.17 C ATOM 483 CG TRP A 51 76.043 63.673 -6.794 1.00 12.29 C ATOM 484 CD1 TRP A 51 75.162 63.127 -5.902 1.00 13.14 C ATOM 485 CD2 TRP A 51 75.340 63.772 -8.042 1.00 12.50 C ATOM 486 NE1 TRP A 51 73.954 62.890 -6.513 1.00 14.14 N ATOM 487 CE2 TRP A 51 74.031 63.275 -7.828 1.00 13.45 C ATOM 488 CE3 TRP A 51 75.681 64.239 -9.321 1.00 13.88 C ATOM 489 CZ2 TRP A 51 73.060 63.235 -8.842 1.00 13.24 C ATOM 490 CZ3 TRP A 51 74.715 64.200 -10.339 1.00 13.97 C ATOM 491 CH2 TRP A 51 73.417 63.699 -10.088 1.00 14.30 C ATOM 492 HA TRP A 51 78.526 62.633 -7.700 1.00 0.00 H ATOM 493 HB2 TRP A 51 77.484 64.464 -5.456 1.00 0.00 H ATOM 494 HB3 TRP A 51 77.654 65.006 -7.142 1.00 0.00 H ATOM 495 HE1 TRP A 51 73.115 62.484 -6.052 1.00 0.00 H ATOM 496 HD1 TRP A 51 75.386 62.911 -4.857 1.00 0.00 H ATOM 497 HZ2 TRP A 51 72.059 62.850 -8.649 1.00 0.00 H ATOM 498 HH2 TRP A 51 72.685 63.680 -10.896 1.00 0.00 H ATOM 499 HZ3 TRP A 51 74.969 64.561 -11.336 1.00 0.00 H ATOM 500 HE3 TRP A 51 76.680 64.626 -9.521 1.00 0.00 H ATOM 501 H TRP A 51 78.621 62.084 -4.788 1.00 0.00 H ATOM 502 N VAL A 52 80.346 64.284 -7.870 1.00 9.70 N ATOM 503 CA VAL A 52 81.595 65.033 -8.072 1.00 9.29 C ATOM 504 C VAL A 52 81.308 66.371 -8.800 1.00 8.21 C ATOM 505 O VAL A 52 80.515 66.400 -9.740 1.00 8.76 O ATOM 506 CB VAL A 52 82.591 64.195 -8.942 1.00 10.53 C ATOM 507 CG1 VAL A 52 83.752 65.050 -9.461 1.00 9.87 C ATOM 508 CG2 VAL A 52 83.115 63.001 -8.149 1.00 11.82 C ATOM 509 HA VAL A 52 82.034 65.233 -7.094 1.00 0.00 H ATOM 510 HB VAL A 52 82.043 63.829 -9.810 1.00 0.00 H ATOM 511 HG11 VAL A 52 83.359 65.860 -10.075 1.00 0.00 H ATOM 512 HG12 VAL A 52 84.301 65.466 -8.616 1.00 0.00 H ATOM 513 HG13 VAL A 52 84.419 64.430 -10.060 1.00 0.00 H ATOM 514 HG21 VAL A 52 83.633 63.357 -7.259 1.00 0.00 H ATOM 515 HG22 VAL A 52 82.279 62.367 -7.855 1.00 0.00 H ATOM 516 HG23 VAL A 52 83.806 62.430 -8.769 1.00 0.00 H ATOM 517 H VAL A 52 79.766 64.077 -8.708 1.00 0.00 H ATOM 518 N VAL A 53 81.955 67.457 -8.362 1.00 7.88 N ATOM 519 CA VAL A 53 81.819 68.800 -8.982 1.00 8.47 C ATOM 520 C VAL A 53 83.092 69.127 -9.798 1.00 7.56 C ATOM 521 O VAL A 53 84.214 68.932 -9.309 1.00 7.75 O ATOM 522 CB VAL A 53 81.623 69.922 -7.897 1.00 8.19 C ATOM 523 CG1 VAL A 53 81.700 71.310 -8.532 1.00 10.60 C ATOM 524 CG2 VAL A 53 80.288 69.757 -7.188 1.00 9.65 C ATOM 525 HA VAL A 53 80.940 68.777 -9.627 1.00 0.00 H ATOM 526 HB VAL A 53 82.426 69.823 -7.167 1.00 0.00 H ATOM 527 HG11 VAL A 53 82.675 71.440 -9.001 1.00 0.00 H ATOM 528 HG12 VAL A 53 80.918 71.408 -9.285 1.00 0.00 H ATOM 529 HG13 VAL A 53 81.562 72.069 -7.762 1.00 0.00 H ATOM 530 HG21 VAL A 53 79.480 69.826 -7.917 1.00 0.00 H ATOM 531 HG22 VAL A 53 80.256 68.784 -6.699 1.00 0.00 H ATOM 532 HG23 VAL A 53 80.174 70.544 -6.442 1.00 0.00 H ATOM 533 H VAL A 53 82.588 67.355 -7.543 1.00 0.00 H ATOM 534 N SER A 54 82.923 69.618 -11.027 1.00 7.21 N ATOM 535 CA SER A 54 84.055 69.976 -11.900 1.00 7.12 C ATOM 536 C SER A 54 83.653 71.182 -12.787 1.00 7.61 C ATOM 537 O SER A 54 82.664 71.861 -12.486 1.00 8.15 O ATOM 538 CB SER A 54 84.467 68.753 -12.755 1.00 7.45 C ATOM 539 OG SER A 54 85.656 68.960 -13.504 1.00 7.25 O ATOM 540 HA SER A 54 84.917 70.264 -11.298 1.00 0.00 H ATOM 541 HB2 SER A 54 83.657 68.528 -13.449 1.00 0.00 H ATOM 542 HB3 SER A 54 84.621 67.903 -12.090 1.00 0.00 H ATOM 543 HG SER A 54 86.404 69.156 -12.886 1.00 0.00 H ATOM 544 H SER A 54 81.955 69.753 -11.383 1.00 0.00 H ATOM 545 N ALA A 55 84.425 71.466 -13.839 1.00 6.95 N ATOM 546 CA ALA A 55 84.135 72.587 -14.750 1.00 7.82 C ATOM 547 C ALA A 55 83.405 72.141 -16.021 1.00 8.34 C ATOM 548 O ALA A 55 83.743 71.102 -16.601 1.00 8.52 O ATOM 549 CB ALA A 55 85.429 73.301 -15.142 1.00 7.29 C ATOM 550 HA ALA A 55 83.477 73.266 -14.207 1.00 0.00 H ATOM 551 HB1 ALA A 55 85.915 73.687 -14.246 1.00 0.00 H ATOM 552 HB2 ALA A 55 86.093 72.597 -15.643 1.00 0.00 H ATOM 553 HB3 ALA A 55 85.197 74.126 -15.815 1.00 0.00 H ATOM 554 H ALA A 55 85.261 70.875 -14.022 1.00 0.00 H ATOM 555 N ALA A 56 82.456 72.956 -16.489 1.00 8.07 N ATOM 556 CA ALA A 56 81.709 72.653 -17.717 1.00 9.21 C ATOM 557 C ALA A 56 82.624 72.526 -18.957 1.00 9.59 C ATOM 558 O ALA A 56 82.318 71.761 -19.887 1.00 9.42 O ATOM 559 CB ALA A 56 80.631 73.717 -17.967 1.00 9.78 C ATOM 560 HA ALA A 56 81.236 71.683 -17.564 1.00 0.00 H ATOM 561 HB1 ALA A 56 79.938 73.735 -17.126 1.00 0.00 H ATOM 562 HB2 ALA A 56 81.104 74.694 -18.071 1.00 0.00 H ATOM 563 HB3 ALA A 56 80.089 73.475 -18.881 1.00 0.00 H ATOM 564 H ALA A 56 82.240 73.830 -15.969 1.00 0.00 H ATOM 565 N HIS A 57 83.746 73.253 -18.970 1.00 8.36 N ATOM 566 CA HIS A 57 84.662 73.176 -20.104 1.00 8.92 C ATOM 567 C HIS A 57 85.441 71.854 -20.185 1.00 9.43 C ATOM 568 O HIS A 57 86.133 71.607 -21.169 1.00 10.97 O ATOM 569 CB HIS A 57 85.576 74.435 -20.213 1.00 9.21 C ATOM 570 CG HIS A 57 86.810 74.409 -19.353 1.00 9.59 C ATOM 571 ND1 HIS A 57 86.923 75.136 -18.184 1.00 9.61 N ATOM 572 CD2 HIS A 57 88.013 73.812 -19.534 1.00 10.39 C ATOM 573 CE1 HIS A 57 88.137 74.989 -17.684 1.00 9.88 C ATOM 574 NE2 HIS A 57 88.818 74.192 -18.486 1.00 11.71 N ATOM 575 HA HIS A 57 84.030 73.176 -20.992 1.00 0.00 H ATOM 576 HB2 HIS A 57 85.891 74.534 -21.252 1.00 0.00 H ATOM 577 HB3 HIS A 57 84.985 75.306 -19.929 1.00 0.00 H ATOM 578 HD2 HIS A 57 88.291 73.153 -20.357 1.00 0.00 H ATOM 579 HE1 HIS A 57 88.511 75.446 -16.768 1.00 0.00 H ATOM 580 H HIS A 57 83.967 73.877 -18.168 1.00 0.00 H ATOM 581 N CYS A 58 85.309 71.013 -19.158 1.00 9.25 N ATOM 582 CA CYS A 58 85.963 69.701 -19.118 1.00 10.27 C ATOM 583 C CYS A 58 84.994 68.590 -19.586 1.00 11.51 C ATOM 584 O CYS A 58 85.310 67.404 -19.481 1.00 11.95 O ATOM 585 CB CYS A 58 86.416 69.361 -17.682 1.00 10.07 C ATOM 586 SG CYS A 58 87.789 70.327 -16.967 1.00 9.39 S ATOM 587 HA CYS A 58 86.825 69.750 -19.783 1.00 0.00 H ATOM 588 HB2 CYS A 58 86.718 68.314 -17.676 1.00 0.00 H ATOM 589 HB3 CYS A 58 85.553 69.492 -17.030 1.00 0.00 H ATOM 590 H CYS A 58 84.718 71.300 -18.352 1.00 0.00 H ATOM 591 N TYR A 59 83.816 68.968 -20.077 1.00 11.52 N ATOM 592 CA TYR A 59 82.809 67.987 -20.506 1.00 13.18 C ATOM 593 C TYR A 59 83.201 66.902 -21.526 1.00 14.19 C ATOM 594 O TYR A 59 83.870 67.171 -22.530 1.00 14.09 O ATOM 595 CB TYR A 59 81.547 68.705 -21.030 1.00 13.56 C ATOM 596 CG TYR A 59 80.426 67.772 -21.494 1.00 15.27 C ATOM 597 CD1 TYR A 59 79.496 67.255 -20.588 1.00 16.11 C ATOM 598 CD2 TYR A 59 80.317 67.388 -22.834 1.00 16.54 C ATOM 599 CE1 TYR A 59 78.486 66.374 -21.006 1.00 17.28 C ATOM 600 CE2 TYR A 59 79.313 66.508 -23.261 1.00 17.39 C ATOM 601 CZ TYR A 59 78.406 66.007 -22.346 1.00 17.93 C ATOM 602 OH TYR A 59 77.420 65.138 -22.770 1.00 19.92 O ATOM 603 HA TYR A 59 82.650 67.430 -19.582 1.00 0.00 H ATOM 604 HB3 TYR A 59 81.838 69.332 -21.873 1.00 0.00 H ATOM 605 HB2 TYR A 59 81.157 69.333 -20.229 1.00 0.00 H ATOM 606 HD2 TYR A 59 81.027 67.781 -23.561 1.00 0.00 H ATOM 607 HE2 TYR A 59 79.248 66.220 -24.310 1.00 0.00 H ATOM 608 HE1 TYR A 59 77.769 65.980 -20.286 1.00 0.00 H ATOM 609 HD1 TYR A 59 79.556 67.541 -19.538 1.00 0.00 H ATOM 610 HH TYR A 59 76.859 64.875 -21.998 1.00 0.00 H ATOM 611 H TYR A 59 83.603 69.983 -20.159 1.00 0.00 H ATOM 612 N LYS A 60 82.732 65.687 -21.237 1.00 15.04 N ATOM 613 CA LYS A 60 82.851 64.499 -22.088 1.00 16.64 C ATOM 614 C LYS A 60 81.626 63.668 -21.686 1.00 16.65 C ATOM 615 O LYS A 60 81.221 63.678 -20.521 1.00 16.18 O ATOM 616 CB LYS A 60 84.139 63.705 -21.854 1.00 17.74 C ATOM 617 CG LYS A 60 85.364 64.296 -22.521 1.00 19.84 C ATOM 618 CD LYS A 60 86.464 63.245 -22.671 1.00 22.61 C ATOM 619 CE LYS A 60 87.869 63.846 -22.586 1.00 24.94 C ATOM 620 NZ LYS A 60 88.224 64.843 -23.628 1.00 26.43 N ATOM 621 HA LYS A 60 82.892 64.764 -23.144 1.00 0.00 H ATOM 622 HB2 LYS A 60 84.323 63.660 -20.781 1.00 0.00 H ATOM 623 HB3 LYS A 60 83.993 62.696 -22.239 1.00 0.00 H ATOM 624 HG2 LYS A 60 85.089 64.668 -23.508 1.00 0.00 H ATOM 625 HG3 LYS A 60 85.738 65.121 -21.914 1.00 0.00 H ATOM 626 HD2 LYS A 60 86.352 62.506 -21.878 1.00 0.00 H ATOM 627 HD3 LYS A 60 86.351 62.757 -23.639 1.00 0.00 H ATOM 628 HE2 LYS A 60 88.585 63.027 -22.652 1.00 0.00 H ATOM 629 HE3 LYS A 60 87.964 64.332 -21.615 1.00 0.00 H ATOM 630 HZ1 LYS A 60 88.159 64.400 -24.567 1.00 0.00 H ATOM 631 HZ2 LYS A 60 87.566 65.646 -23.576 1.00 0.00 H ATOM 632 HZ3 LYS A 60 89.195 65.178 -23.468 1.00 0.00 H ATOM 633 H LYS A 60 82.239 65.572 -20.329 1.00 0.00 H ATOM 634 N SER A 61 81.013 62.988 -22.651 1.00 18.12 N ATOM 635 CA SER A 61 79.811 62.188 -22.390 1.00 19.61 C ATOM 636 C SER A 61 79.970 61.074 -21.349 1.00 19.42 C ATOM 637 O SER A 61 79.005 60.725 -20.666 1.00 20.71 O ATOM 638 CB SER A 61 79.223 61.643 -23.709 1.00 21.23 C ATOM 639 OG SER A 61 80.230 61.105 -24.561 1.00 24.31 O ATOM 640 HA SER A 61 79.107 62.882 -21.931 1.00 0.00 H ATOM 641 HB2 SER A 61 78.717 62.455 -24.231 1.00 0.00 H ATOM 642 HB3 SER A 61 78.503 60.859 -23.476 1.00 0.00 H ATOM 643 HG SER A 61 79.812 60.768 -25.392 1.00 0.00 H ATOM 644 H SER A 61 81.396 63.024 -23.617 1.00 0.00 H ATOM 645 N ARG A 62 81.179 60.528 -21.229 1.00 19.46 N ATOM 646 CA ARG A 62 81.482 59.480 -20.251 1.00 19.06 C ATOM 647 C ARG A 62 82.953 59.618 -19.842 1.00 17.47 C ATOM 648 O ARG A 62 83.807 59.903 -20.678 1.00 16.91 O ATOM 649 CB ARG A 62 81.229 58.084 -20.846 1.00 21.14 C ATOM 650 CG ARG A 62 81.397 56.947 -19.849 1.00 20.93 C ATOM 651 CD ARG A 62 81.119 55.598 -20.487 1.00 21.63 C ATOM 652 NE ARG A 62 81.291 54.504 -19.534 1.00 22.05 N ATOM 653 CZ ARG A 62 81.141 53.216 -19.832 1.00 22.31 C ATOM 654 NH1 ARG A 62 80.813 52.845 -21.063 1.00 22.57 N ATOM 655 NH2 ARG A 62 81.322 52.295 -18.895 1.00 22.53 N ATOM 656 HA ARG A 62 80.833 59.593 -19.382 1.00 0.00 H ATOM 657 HB2 ARG A 62 80.210 58.055 -21.231 1.00 0.00 H ATOM 658 HB3 ARG A 62 81.930 57.928 -21.666 1.00 0.00 H ATOM 659 HG2 ARG A 62 82.419 56.956 -19.471 1.00 0.00 H ATOM 660 HG3 ARG A 62 80.704 57.097 -19.021 1.00 0.00 H ATOM 661 HD2 ARG A 62 81.807 55.452 -21.320 1.00 0.00 H ATOM 662 HD3 ARG A 62 80.094 55.587 -20.857 1.00 0.00 H ATOM 663 HE ARG A 62 81.548 54.749 -18.556 1.00 0.00 H ATOM 664 HH12 ARG A 62 80.697 51.836 -21.289 1.00 0.00 H ATOM 665 HH11 ARG A 62 80.671 53.563 -21.802 1.00 0.00 H ATOM 666 HH22 ARG A 62 81.205 51.288 -19.126 1.00 0.00 H ATOM 667 HH21 ARG A 62 81.581 52.580 -17.929 1.00 0.00 H ATOM 668 H ARG A 62 81.940 60.860 -21.856 1.00 0.00 H ATOM 669 N VAL A 63 83.238 59.438 -18.555 1.00 16.82 N ATOM 670 CA VAL A 63 84.607 59.544 -18.028 1.00 16.09 C ATOM 671 C VAL A 63 84.826 58.577 -16.859 1.00 13.76 C ATOM 672 O VAL A 63 83.863 58.064 -16.284 1.00 14.53 O ATOM 673 CB VAL A 63 84.932 60.993 -17.486 1.00 16.85 C ATOM 674 CG1 VAL A 63 84.958 62.015 -18.617 1.00 18.95 C ATOM 675 CG2 VAL A 63 83.927 61.408 -16.417 1.00 17.14 C ATOM 676 HA VAL A 63 85.261 59.304 -18.867 1.00 0.00 H ATOM 677 HB VAL A 63 85.925 60.963 -17.037 1.00 0.00 H ATOM 678 HG11 VAL A 63 85.724 61.735 -19.340 1.00 0.00 H ATOM 679 HG12 VAL A 63 83.985 62.038 -19.107 1.00 0.00 H ATOM 680 HG13 VAL A 63 85.184 63.000 -18.209 1.00 0.00 H ATOM 681 HG21 VAL A 63 82.924 61.408 -16.844 1.00 0.00 H ATOM 682 HG22 VAL A 63 83.970 60.703 -15.587 1.00 0.00 H ATOM 683 HG23 VAL A 63 84.171 62.408 -16.059 1.00 0.00 H ATOM 684 H VAL A 63 82.464 59.214 -17.897 1.00 0.00 H ATOM 685 N GLU A 64 86.093 58.309 -16.552 1.00 12.73 N ATOM 686 CA GLU A 64 86.461 57.466 -15.417 1.00 12.22 C ATOM 687 C GLU A 64 86.992 58.398 -14.321 1.00 11.63 C ATOM 688 O GLU A 64 87.881 59.226 -14.583 1.00 12.20 O ATOM 689 CB GLU A 64 87.543 56.451 -15.797 1.00 12.76 C ATOM 690 CG GLU A 64 87.864 55.456 -14.680 1.00 14.80 C ATOM 691 CD GLU A 64 88.856 54.379 -15.103 1.00 17.02 C ATOM 692 OE1 GLU A 64 90.057 54.680 -15.220 1.00 16.64 O ATOM 693 OE2 GLU A 64 88.430 53.223 -15.319 1.00 19.89 O ATOM 694 HA GLU A 64 85.592 56.900 -15.080 1.00 0.00 H ATOM 695 HB2 GLU A 64 87.202 55.893 -16.669 1.00 0.00 H ATOM 696 HB3 GLU A 64 88.454 56.995 -16.048 1.00 0.00 H ATOM 697 HG2 GLU A 64 88.286 56.004 -13.838 1.00 0.00 H ATOM 698 HG3 GLU A 64 86.938 54.972 -14.370 1.00 0.00 H ATOM 699 H GLU A 64 86.848 58.714 -17.141 1.00 0.00 H ATOM 700 N VAL A 65 86.417 58.290 -13.124 1.00 10.61 N ATOM 701 CA VAL A 65 86.809 59.111 -11.968 1.00 10.94 C ATOM 702 C VAL A 65 87.810 58.314 -11.110 1.00 10.92 C ATOM 703 O VAL A 65 87.522 57.180 -10.711 1.00 11.75 O ATOM 704 CB VAL A 65 85.545 59.496 -11.107 1.00 10.50 C ATOM 705 CG1 VAL A 65 85.939 60.306 -9.865 1.00 10.69 C ATOM 706 CG2 VAL A 65 84.541 60.280 -11.954 1.00 11.18 C ATOM 707 HA VAL A 65 87.273 60.033 -12.320 1.00 0.00 H ATOM 708 HB VAL A 65 85.078 58.571 -10.770 1.00 0.00 H ATOM 709 HG11 VAL A 65 86.613 59.714 -9.246 1.00 0.00 H ATOM 710 HG12 VAL A 65 86.440 61.223 -10.175 1.00 0.00 H ATOM 711 HG13 VAL A 65 85.043 60.554 -9.295 1.00 0.00 H ATOM 712 HG21 VAL A 65 85.012 61.192 -12.322 1.00 0.00 H ATOM 713 HG22 VAL A 65 84.223 59.668 -12.798 1.00 0.00 H ATOM 714 HG23 VAL A 65 83.675 60.537 -11.344 1.00 0.00 H ATOM 715 H VAL A 65 85.655 57.593 -13.001 1.00 0.00 H ATOM 716 N ARG A 66 88.982 58.889 -10.852 1.00 9.33 N ATOM 717 CA ARG A 66 90.011 58.224 -10.052 1.00 9.82 C ATOM 718 C ARG A 66 90.218 58.932 -8.706 1.00 10.61 C ATOM 719 O ARG A 66 90.677 60.086 -8.660 1.00 10.54 O ATOM 720 CB ARG A 66 91.323 58.117 -10.852 1.00 9.54 C ATOM 721 CG ARG A 66 91.162 57.303 -12.157 1.00 9.03 C ATOM 722 CD ARG A 66 92.482 57.017 -12.901 1.00 10.11 C ATOM 723 NE ARG A 66 92.244 56.096 -14.020 1.00 11.03 N ATOM 724 CZ ARG A 66 93.196 55.476 -14.726 1.00 10.20 C ATOM 725 NH1 ARG A 66 94.482 55.669 -14.466 1.00 10.36 N ATOM 726 NH2 ARG A 66 92.848 54.590 -15.654 1.00 12.00 N ATOM 727 HA ARG A 66 89.672 57.213 -9.826 1.00 0.00 H ATOM 728 HB2 ARG A 66 91.659 59.122 -11.107 1.00 0.00 H ATOM 729 HB3 ARG A 66 92.073 57.631 -10.228 1.00 0.00 H ATOM 730 HG2 ARG A 66 90.698 56.349 -11.908 1.00 0.00 H ATOM 731 HG3 ARG A 66 90.507 57.860 -12.827 1.00 0.00 H ATOM 732 HD2 ARG A 66 93.195 56.568 -12.210 1.00 0.00 H ATOM 733 HD3 ARG A 66 92.890 57.952 -13.285 1.00 0.00 H ATOM 734 HE ARG A 66 91.255 55.911 -14.285 1.00 0.00 H ATOM 735 HH12 ARG A 66 95.206 55.177 -15.028 1.00 0.00 H ATOM 736 HH11 ARG A 66 94.767 56.313 -13.701 1.00 0.00 H ATOM 737 HH22 ARG A 66 93.581 54.103 -16.208 1.00 0.00 H ATOM 738 HH21 ARG A 66 91.843 54.384 -15.826 1.00 0.00 H ATOM 739 H ARG A 66 89.172 59.839 -11.230 1.00 0.00 H ATOM 740 N LEU A 67 89.856 58.235 -7.627 1.00 9.66 N ATOM 741 CA LEU A 67 89.958 58.750 -6.257 1.00 10.67 C ATOM 742 C LEU A 67 91.093 58.093 -5.465 1.00 12.30 C ATOM 743 O LEU A 67 91.589 57.026 -5.852 1.00 12.36 O ATOM 744 CB LEU A 67 88.638 58.518 -5.513 1.00 11.57 C ATOM 745 CG LEU A 67 87.333 58.942 -6.197 1.00 12.96 C ATOM 746 CD1 LEU A 67 86.704 57.729 -6.873 1.00 15.42 C ATOM 747 CD2 LEU A 67 86.360 59.534 -5.196 1.00 14.69 C ATOM 748 HA LEU A 67 90.175 59.815 -6.335 1.00 0.00 H ATOM 749 HB2 LEU A 67 88.564 57.449 -5.312 1.00 0.00 H ATOM 750 HB3 LEU A 67 88.699 59.061 -4.570 1.00 0.00 H ATOM 751 HG LEU A 67 87.561 59.706 -6.940 1.00 0.00 H ATOM 752 HD21 LEU A 67 86.129 58.791 -4.433 1.00 0.00 H ATOM 753 HD22 LEU A 67 86.810 60.410 -4.728 1.00 0.00 H ATOM 754 HD23 LEU A 67 85.444 59.825 -5.710 1.00 0.00 H ATOM 755 HD11 LEU A 67 87.394 57.330 -7.616 1.00 0.00 H ATOM 756 HD12 LEU A 67 86.494 56.966 -6.124 1.00 0.00 H ATOM 757 HD13 LEU A 67 85.776 58.027 -7.360 1.00 0.00 H ATOM 758 H LEU A 67 89.481 57.275 -7.765 1.00 0.00 H ATOM 759 N GLY A 69 91.491 58.723 -4.357 1.00 12.01 N ATOM 760 CA GLY A 69 92.549 58.187 -3.505 1.00 12.15 C ATOM 761 C GLY A 69 93.952 58.201 -4.093 1.00 12.66 C ATOM 762 O GLY A 69 94.784 57.343 -3.759 1.00 12.95 O ATOM 763 HA3 GLY A 69 92.296 57.153 -3.270 1.00 0.00 H ATOM 764 HA2 GLY A 69 92.567 58.773 -2.586 1.00 0.00 H ATOM 765 H GLY A 69 91.035 59.620 -4.094 1.00 0.00 H ATOM 766 N GLU A 70 94.229 59.187 -4.943 1.00 11.23 N ATOM 767 CA GLU A 70 95.527 59.329 -5.608 1.00 11.51 C ATOM 768 C GLU A 70 96.515 60.346 -5.010 1.00 12.01 C ATOM 769 O GLU A 70 96.105 61.341 -4.405 1.00 11.56 O ATOM 770 CB GLU A 70 95.292 59.772 -7.065 1.00 12.09 C ATOM 771 CG GLU A 70 94.619 58.750 -7.996 1.00 12.04 C ATOM 772 CD GLU A 70 95.625 57.836 -8.668 1.00 11.93 C ATOM 773 OE1 GLU A 70 96.749 57.727 -8.151 1.00 11.73 O ATOM 774 OE2 GLU A 70 95.303 57.239 -9.716 1.00 12.82 O ATOM 775 HA GLU A 70 95.984 58.347 -5.489 1.00 0.00 H ATOM 776 HB2 GLU A 70 94.664 60.663 -7.043 1.00 0.00 H ATOM 777 HB3 GLU A 70 96.262 60.023 -7.495 1.00 0.00 H ATOM 778 HG2 GLU A 70 93.929 58.142 -7.410 1.00 0.00 H ATOM 779 HG3 GLU A 70 94.065 59.288 -8.765 1.00 0.00 H ATOM 780 H GLU A 70 93.489 59.890 -5.145 1.00 0.00 H ATOM 781 N HIS A 71 97.809 60.035 -5.112 1.00 11.37 N ATOM 782 CA HIS A 71 98.877 60.986 -4.765 1.00 11.49 C ATOM 783 C HIS A 71 99.768 61.076 -6.025 1.00 11.31 C ATOM 784 O HIS A 71 99.891 62.146 -6.633 1.00 10.73 O ATOM 785 CB HIS A 71 99.712 60.645 -3.520 1.00 12.34 C ATOM 786 CG HIS A 71 100.658 61.751 -3.137 1.00 13.73 C ATOM 787 ND1 HIS A 71 100.220 63.007 -2.770 1.00 13.40 N ATOM 788 CD2 HIS A 71 102.011 61.829 -3.181 1.00 14.23 C ATOM 789 CE1 HIS A 71 101.256 63.812 -2.615 1.00 13.19 C ATOM 790 NE2 HIS A 71 102.356 63.123 -2.858 1.00 13.66 N ATOM 791 HA HIS A 71 98.417 61.933 -4.483 1.00 0.00 H ATOM 792 HB2 HIS A 71 99.036 60.459 -2.686 1.00 0.00 H ATOM 793 HB3 HIS A 71 100.291 59.745 -3.724 1.00 0.00 H ATOM 794 HD2 HIS A 71 102.698 61.019 -3.426 1.00 0.00 H ATOM 795 HE1 HIS A 71 101.211 64.864 -2.335 1.00 0.00 H ATOM 796 H HIS A 71 98.072 59.087 -5.449 1.00 0.00 H ATOM 797 N ASN A 72 100.373 59.955 -6.422 1.00 11.62 N ATOM 798 CA ASN A 72 101.189 59.892 -7.643 1.00 11.75 C ATOM 799 C ASN A 72 100.327 59.162 -8.683 1.00 12.90 C ATOM 800 O ASN A 72 100.024 57.962 -8.523 1.00 12.30 O ATOM 801 CB ASN A 72 102.489 59.114 -7.403 1.00 12.60 C ATOM 802 CG ASN A 72 103.410 59.121 -8.617 1.00 12.76 C ATOM 803 OD1 ASN A 72 102.955 59.131 -9.762 1.00 13.18 O ATOM 804 ND2 ASN A 72 104.713 59.122 -8.369 1.00 15.19 N ATOM 805 HA ASN A 72 101.475 60.891 -7.972 1.00 0.00 H ATOM 806 HB2 ASN A 72 103.016 59.565 -6.562 1.00 0.00 H ATOM 807 HB3 ASN A 72 102.238 58.081 -7.161 1.00 0.00 H ATOM 808 HD22 ASN A 72 105.055 59.113 -7.387 1.00 0.00 H ATOM 809 HD21 ASN A 72 105.392 59.131 -9.157 1.00 0.00 H ATOM 810 H ASN A 72 100.263 59.095 -5.847 1.00 0.00 H ATOM 811 N ILE A 73 99.891 59.873 -9.721 1.00 12.68 N ATOM 812 CA ILE A 73 99.030 59.264 -10.741 1.00 13.65 C ATOM 813 C ILE A 73 99.674 58.229 -11.681 1.00 13.83 C ATOM 814 O ILE A 73 98.955 57.502 -12.378 1.00 13.57 O ATOM 815 CB ILE A 73 98.247 60.331 -11.578 1.00 14.47 C ATOM 816 CG1 ILE A 73 99.197 61.388 -12.151 1.00 15.13 C ATOM 817 CG2 ILE A 73 97.136 60.966 -10.724 1.00 14.95 C ATOM 818 CD1 ILE A 73 98.499 62.357 -13.111 1.00 16.92 C ATOM 819 HA ILE A 73 98.340 58.685 -10.127 1.00 0.00 H ATOM 820 HB ILE A 73 97.776 59.832 -12.425 1.00 0.00 H ATOM 821 HG12 ILE A 73 99.620 61.960 -11.325 1.00 0.00 H ATOM 822 HG13 ILE A 73 99.998 60.881 -12.689 1.00 0.00 H ATOM 823 HD11 ILE A 73 98.079 61.798 -13.947 1.00 0.00 H ATOM 824 HD12 ILE A 73 97.701 62.878 -12.583 1.00 0.00 H ATOM 825 HD13 ILE A 73 99.223 63.082 -13.484 1.00 0.00 H ATOM 826 HG21 ILE A 73 96.444 60.191 -10.396 1.00 0.00 H ATOM 827 HG22 ILE A 73 97.580 61.450 -9.854 1.00 0.00 H ATOM 828 HG23 ILE A 73 96.600 61.706 -11.319 1.00 0.00 H ATOM 829 H ILE A 73 100.164 60.873 -9.810 1.00 0.00 H ATOM 830 N LYS A 74 101.002 58.123 -11.668 1.00 14.15 N ATOM 831 CA LYS A 74 101.692 57.157 -12.528 1.00 14.70 C ATOM 832 C LYS A 74 102.099 55.868 -11.802 1.00 15.12 C ATOM 833 O LYS A 74 102.640 54.952 -12.423 1.00 16.23 O ATOM 834 CB LYS A 74 102.932 57.793 -13.162 1.00 15.13 C ATOM 835 CG LYS A 74 102.648 59.011 -14.041 1.00 18.17 C ATOM 836 CD LYS A 74 101.569 58.761 -15.096 1.00 17.50 C ATOM 837 CE LYS A 74 102.106 58.058 -16.337 1.00 17.81 C ATOM 838 NZ LYS A 74 102.528 56.653 -16.092 1.00 17.51 N ATOM 839 HA LYS A 74 100.972 56.878 -13.297 1.00 0.00 H ATOM 840 HB2 LYS A 74 103.603 58.102 -12.360 1.00 0.00 H ATOM 841 HB3 LYS A 74 103.424 57.039 -13.776 1.00 0.00 H ATOM 842 HG2 LYS A 74 102.322 59.831 -13.401 1.00 0.00 H ATOM 843 HG3 LYS A 74 103.570 59.293 -14.549 1.00 0.00 H ATOM 844 HD2 LYS A 74 100.788 58.141 -14.655 1.00 0.00 H ATOM 845 HD3 LYS A 74 101.145 59.720 -15.395 1.00 0.00 H ATOM 846 HE2 LYS A 74 102.967 58.617 -16.704 1.00 0.00 H ATOM 847 HE3 LYS A 74 101.325 58.056 -17.097 1.00 0.00 H ATOM 848 HZ1 LYS A 74 103.282 56.639 -15.376 1.00 0.00 H ATOM 849 HZ2 LYS A 74 101.714 56.102 -15.751 1.00 0.00 H ATOM 850 HZ3 LYS A 74 102.881 56.239 -16.978 1.00 0.00 H ATOM 851 H LYS A 74 101.558 58.735 -11.038 1.00 0.00 H ATOM 852 N VAL A 75 101.806 55.778 -10.508 1.00 14.76 N ATOM 853 CA VAL A 75 102.186 54.610 -9.704 1.00 15.69 C ATOM 854 C VAL A 75 101.025 54.050 -8.884 1.00 14.75 C ATOM 855 O VAL A 75 100.256 54.817 -8.285 1.00 14.03 O ATOM 856 CB VAL A 75 103.356 54.987 -8.739 1.00 16.88 C ATOM 857 CG1 VAL A 75 103.615 53.888 -7.709 1.00 19.94 C ATOM 858 CG2 VAL A 75 104.627 55.261 -9.536 1.00 18.03 C ATOM 859 HA VAL A 75 102.498 53.836 -10.405 1.00 0.00 H ATOM 860 HB VAL A 75 103.063 55.888 -8.201 1.00 0.00 H ATOM 861 HG11 VAL A 75 102.716 53.730 -7.114 1.00 0.00 H ATOM 862 HG12 VAL A 75 103.878 52.964 -8.224 1.00 0.00 H ATOM 863 HG13 VAL A 75 104.435 54.189 -7.057 1.00 0.00 H ATOM 864 HG21 VAL A 75 104.901 54.369 -10.099 1.00 0.00 H ATOM 865 HG22 VAL A 75 104.451 56.087 -10.225 1.00 0.00 H ATOM 866 HG23 VAL A 75 105.434 55.522 -8.852 1.00 0.00 H ATOM 867 H VAL A 75 101.292 56.559 -10.052 1.00 0.00 H ATOM 868 N THR A 76 100.870 52.725 -8.881 1.00 14.31 N ATOM 869 CA THR A 76 99.816 52.072 -8.099 1.00 14.14 C ATOM 870 C THR A 76 100.262 52.037 -6.624 1.00 14.91 C ATOM 871 O THR A 76 101.273 51.420 -6.282 1.00 15.95 O ATOM 872 CB THR A 76 99.490 50.650 -8.647 1.00 14.88 C ATOM 873 OG1 THR A 76 98.934 50.774 -9.962 1.00 14.01 O ATOM 874 CG2 THR A 76 98.470 49.942 -7.757 1.00 14.63 C ATOM 875 HA THR A 76 98.889 52.640 -8.182 1.00 0.00 H ATOM 876 HB THR A 76 100.411 50.067 -8.665 1.00 0.00 H ATOM 877 HG1 THR A 76 98.106 51.314 -9.919 1.00 0.00 H ATOM 878 HG23 THR A 76 98.877 49.839 -6.751 1.00 0.00 H ATOM 879 HG21 THR A 76 97.552 50.529 -7.721 1.00 0.00 H ATOM 880 HG22 THR A 76 98.256 48.955 -8.166 1.00 0.00 H ATOM 881 H THR A 76 101.515 52.139 -9.449 1.00 0.00 H ATOM 882 N GLU A 77 99.504 52.728 -5.769 1.00 13.35 N ATOM 883 CA GLU A 77 99.814 52.865 -4.347 1.00 13.54 C ATOM 884 C GLU A 77 99.002 51.980 -3.405 1.00 13.95 C ATOM 885 O GLU A 77 99.416 51.740 -2.267 1.00 15.47 O ATOM 886 CB GLU A 77 99.685 54.352 -3.945 1.00 13.27 C ATOM 887 CG GLU A 77 100.750 55.232 -4.612 1.00 13.94 C ATOM 888 CD GLU A 77 100.308 56.668 -4.888 1.00 16.59 C ATOM 889 OE1 GLU A 77 99.185 56.893 -5.386 1.00 15.19 O ATOM 890 OE2 GLU A 77 101.118 57.583 -4.646 1.00 17.74 O ATOM 891 HA GLU A 77 100.837 52.508 -4.229 1.00 0.00 H ATOM 892 HB2 GLU A 77 98.699 54.711 -4.240 1.00 0.00 H ATOM 893 HB3 GLU A 77 99.791 54.433 -2.863 1.00 0.00 H ATOM 894 HG2 GLU A 77 101.622 55.264 -3.959 1.00 0.00 H ATOM 895 HG3 GLU A 77 101.025 54.772 -5.561 1.00 0.00 H ATOM 896 H GLU A 77 98.648 53.193 -6.134 1.00 0.00 H ATOM 897 N GLY A 78 97.853 51.498 -3.869 1.00 14.36 N ATOM 898 CA GLY A 78 97.011 50.651 -3.035 1.00 15.55 C ATOM 899 C GLY A 78 95.864 51.371 -2.338 1.00 16.20 C ATOM 900 O GLY A 78 95.056 50.745 -1.653 1.00 16.59 O ATOM 901 HA3 GLY A 78 97.640 50.197 -2.270 1.00 0.00 H ATOM 902 HA2 GLY A 78 96.587 49.870 -3.666 1.00 0.00 H ATOM 903 H GLY A 78 97.552 51.728 -4.838 1.00 0.00 H ATOM 904 N SER A 79 95.777 52.685 -2.538 1.00 15.67 N ATOM 905 CA SER A 79 94.735 53.521 -1.937 1.00 14.63 C ATOM 906 C SER A 79 93.653 53.975 -2.927 1.00 14.23 C ATOM 907 O SER A 79 92.641 54.584 -2.529 1.00 14.78 O ATOM 908 CB SER A 79 95.404 54.773 -1.371 1.00 14.74 C ATOM 909 OG SER A 79 96.190 55.400 -2.377 1.00 13.80 O ATOM 910 HA SER A 79 94.241 52.916 -1.176 1.00 0.00 H ATOM 911 HB2 SER A 79 96.044 54.494 -0.534 1.00 0.00 H ATOM 912 HB3 SER A 79 94.638 55.467 -1.026 1.00 0.00 H ATOM 913 HG SER A 79 95.609 55.655 -3.137 1.00 0.00 H ATOM 914 H SER A 79 96.484 53.140 -3.151 1.00 0.00 H ATOM 915 N GLU A 80 93.860 53.664 -4.204 1.00 12.74 N ATOM 916 CA GLU A 80 92.965 54.094 -5.281 1.00 12.90 C ATOM 917 C GLU A 80 91.625 53.382 -5.470 1.00 12.88 C ATOM 918 O GLU A 80 91.475 52.208 -5.109 1.00 13.85 O ATOM 919 CB GLU A 80 93.716 54.050 -6.624 1.00 12.32 C ATOM 920 CG GLU A 80 95.039 54.813 -6.668 1.00 12.11 C ATOM 921 CD GLU A 80 96.270 53.941 -6.387 1.00 12.64 C ATOM 922 OE1 GLU A 80 96.158 52.881 -5.732 1.00 12.25 O ATOM 923 OE2 GLU A 80 97.367 54.330 -6.821 1.00 11.55 O ATOM 924 HA GLU A 80 92.683 55.093 -4.950 1.00 0.00 H ATOM 925 HB2 GLU A 80 93.923 53.006 -6.858 1.00 0.00 H ATOM 926 HB3 GLU A 80 93.061 54.469 -7.388 1.00 0.00 H ATOM 927 HG2 GLU A 80 95.149 55.253 -7.659 1.00 0.00 H ATOM 928 HG3 GLU A 80 95.003 55.607 -5.922 1.00 0.00 H ATOM 929 H GLU A 80 94.693 53.091 -4.448 1.00 0.00 H ATOM 930 N GLN A 81 90.667 54.121 -6.042 1.00 12.54 N ATOM 931 CA GLN A 81 89.333 53.635 -6.416 1.00 11.50 C ATOM 932 C GLN A 81 89.062 54.248 -7.795 1.00 12.56 C ATOM 933 O GLN A 81 89.183 55.465 -7.961 1.00 12.32 O ATOM 934 CB GLN A 81 88.241 54.091 -5.435 1.00 12.53 C ATOM 935 CG GLN A 81 88.248 53.382 -4.079 1.00 14.12 C ATOM 936 CD GLN A 81 87.201 53.922 -3.112 1.00 14.77 C ATOM 937 OE1 GLN A 81 86.005 53.967 -3.420 1.00 15.47 O ATOM 938 NE2 GLN A 81 87.649 54.320 -1.928 1.00 14.67 N ATOM 939 HA GLN A 81 89.310 52.545 -6.409 1.00 0.00 H ATOM 940 HB2 GLN A 81 88.370 55.159 -5.258 1.00 0.00 H ATOM 941 HB3 GLN A 81 87.272 53.916 -5.903 1.00 0.00 H ATOM 942 HG2 GLN A 81 88.055 52.322 -4.242 1.00 0.00 H ATOM 943 HG3 GLN A 81 89.233 53.506 -3.628 1.00 0.00 H ATOM 944 HE22 GLN A 81 88.665 54.265 -1.711 1.00 0.00 H ATOM 945 HE21 GLN A 81 86.985 54.687 -1.217 1.00 0.00 H ATOM 946 H GLN A 81 90.885 55.119 -6.237 1.00 0.00 H ATOM 947 N PHE A 82 88.796 53.411 -8.799 1.00 12.25 N ATOM 948 CA PHE A 82 88.499 53.861 -10.170 1.00 13.67 C ATOM 949 C PHE A 82 87.015 53.550 -10.424 1.00 15.69 C ATOM 950 O PHE A 82 86.618 52.372 -10.406 1.00 16.53 O ATOM 951 CB PHE A 82 89.339 53.090 -11.208 1.00 14.92 C ATOM 952 CG PHE A 82 90.817 53.411 -11.201 1.00 14.97 C ATOM 953 CD1 PHE A 82 91.370 54.299 -10.280 1.00 15.54 C ATOM 954 CD2 PHE A 82 91.662 52.792 -12.126 1.00 15.71 C ATOM 955 CE1 PHE A 82 92.739 54.569 -10.279 1.00 16.37 C ATOM 956 CE2 PHE A 82 93.034 53.049 -12.136 1.00 15.91 C ATOM 957 CZ PHE A 82 93.579 53.941 -11.208 1.00 16.31 C ATOM 958 HA PHE A 82 88.729 54.922 -10.267 1.00 0.00 H ATOM 959 HB2 PHE A 82 89.223 52.024 -11.012 1.00 0.00 H ATOM 960 HB3 PHE A 82 88.947 53.321 -12.199 1.00 0.00 H ATOM 961 HD2 PHE A 82 91.242 52.096 -12.853 1.00 0.00 H ATOM 962 HE2 PHE A 82 93.678 52.556 -12.865 1.00 0.00 H ATOM 963 HZ PHE A 82 94.649 54.146 -11.207 1.00 0.00 H ATOM 964 HE1 PHE A 82 93.155 55.269 -9.555 1.00 0.00 H ATOM 965 HD1 PHE A 82 90.725 54.789 -9.551 1.00 0.00 H ATOM 966 H PHE A 82 88.798 52.389 -8.604 1.00 0.00 H ATOM 967 N ILE A 83 86.202 54.576 -10.685 1.00 14.69 N ATOM 968 CA ILE A 83 84.755 54.398 -10.894 1.00 14.52 C ATOM 969 C ILE A 83 84.232 55.172 -12.114 1.00 15.65 C ATOM 970 O ILE A 83 84.512 56.366 -12.266 1.00 14.28 O ATOM 971 CB ILE A 83 83.952 54.891 -9.645 1.00 14.42 C ATOM 972 CG1 ILE A 83 84.509 54.263 -8.357 1.00 14.54 C ATOM 973 CG2 ILE A 83 82.470 54.574 -9.803 1.00 14.56 C ATOM 974 CD1 ILE A 83 83.856 54.764 -7.074 1.00 14.59 C ATOM 975 HA ILE A 83 84.609 53.331 -11.060 1.00 0.00 H ATOM 976 HB ILE A 83 84.065 55.973 -9.570 1.00 0.00 H ATOM 977 HG12 ILE A 83 84.364 53.184 -8.414 1.00 0.00 H ATOM 978 HG13 ILE A 83 85.575 54.483 -8.305 1.00 0.00 H ATOM 979 HD11 ILE A 83 84.002 55.841 -6.990 1.00 0.00 H ATOM 980 HD12 ILE A 83 82.789 54.541 -7.100 1.00 0.00 H ATOM 981 HD13 ILE A 83 84.312 54.267 -6.218 1.00 0.00 H ATOM 982 HG21 ILE A 83 82.085 55.074 -10.692 1.00 0.00 H ATOM 983 HG22 ILE A 83 82.339 53.497 -9.906 1.00 0.00 H ATOM 984 HG23 ILE A 83 81.929 54.925 -8.924 1.00 0.00 H ATOM 985 H ILE A 83 86.604 55.533 -10.743 1.00 0.00 H ATOM 986 N SER A 84 83.481 54.492 -12.981 1.00 15.80 N ATOM 987 CA SER A 84 82.907 55.122 -14.175 1.00 16.69 C ATOM 988 C SER A 84 81.696 55.998 -13.847 1.00 16.13 C ATOM 989 O SER A 84 81.008 55.788 -12.834 1.00 15.37 O ATOM 990 CB SER A 84 82.460 54.060 -15.181 1.00 19.26 C ATOM 991 OG SER A 84 83.562 53.308 -15.646 1.00 26.55 O ATOM 992 HA SER A 84 83.694 55.748 -14.596 1.00 0.00 H ATOM 993 HB2 SER A 84 81.980 54.550 -16.028 1.00 0.00 H ATOM 994 HB3 SER A 84 81.748 53.390 -14.699 1.00 0.00 H ATOM 995 HG SER A 84 83.247 52.629 -16.294 1.00 0.00 H ATOM 996 H SER A 84 83.296 53.484 -12.805 1.00 0.00 H ATOM 997 N SER A 85 81.416 56.951 -14.733 1.00 15.45 N ATOM 998 CA SER A 85 80.280 57.850 -14.562 1.00 15.95 C ATOM 999 C SER A 85 79.016 57.229 -15.156 1.00 16.71 C ATOM 1000 O SER A 85 79.096 56.387 -16.059 1.00 16.98 O ATOM 1001 CB SER A 85 80.556 59.184 -15.277 1.00 15.03 C ATOM 1002 OG SER A 85 80.674 59.003 -16.684 1.00 15.85 O ATOM 1003 HA SER A 85 80.136 58.021 -13.495 1.00 0.00 H ATOM 1004 HB2 SER A 85 81.485 59.607 -14.894 1.00 0.00 H ATOM 1005 HB3 SER A 85 79.735 59.872 -15.075 1.00 0.00 H ATOM 1006 HG SER A 85 81.422 58.383 -16.874 1.00 0.00 H ATOM 1007 H SER A 85 82.024 57.058 -15.570 1.00 0.00 H ATOM 1008 N SER A 86 77.861 57.591 -14.608 1.00 17.12 N ATOM 1009 CA SER A 86 76.598 57.126 -15.157 1.00 18.26 C ATOM 1010 C SER A 86 75.832 58.329 -15.727 1.00 19.20 C ATOM 1011 O SER A 86 74.918 58.158 -16.534 1.00 19.17 O ATOM 1012 CB SER A 86 75.769 56.374 -14.118 1.00 18.79 C ATOM 1013 OG SER A 86 75.588 57.133 -12.945 1.00 22.19 O ATOM 1014 HA SER A 86 76.799 56.414 -15.958 1.00 0.00 H ATOM 1015 HB2 SER A 86 76.280 55.446 -13.863 1.00 0.00 H ATOM 1016 HB3 SER A 86 74.792 56.144 -14.544 1.00 0.00 H ATOM 1017 HG SER A 86 75.048 56.614 -12.298 1.00 0.00 H ATOM 1018 H SER A 86 77.861 58.215 -13.776 1.00 0.00 H ATOM 1019 N ARG A 87 76.230 59.542 -15.329 1.00 19.04 N ATOM 1020 CA ARG A 87 75.613 60.784 -15.809 1.00 19.60 C ATOM 1021 C ARG A 87 76.581 61.956 -15.703 1.00 17.96 C ATOM 1022 O ARG A 87 77.257 62.087 -14.687 1.00 17.77 O ATOM 1023 CB ARG A 87 74.367 61.137 -14.992 1.00 23.40 C ATOM 1024 CG ARG A 87 73.107 60.439 -15.426 1.00 28.82 C ATOM 1025 CD ARG A 87 71.891 61.132 -14.843 1.00 34.68 C ATOM 1026 NE ARG A 87 71.723 60.874 -13.413 1.00 39.09 N ATOM 1027 CZ ARG A 87 71.037 61.663 -12.587 1.00 40.75 C ATOM 1028 NH1 ARG A 87 70.464 62.774 -13.044 1.00 41.71 N ATOM 1029 NH2 ARG A 87 70.863 61.308 -11.317 1.00 42.41 N ATOM 1030 HA ARG A 87 75.342 60.612 -16.851 1.00 0.00 H ATOM 1031 HB2 ARG A 87 74.558 60.875 -13.951 1.00 0.00 H ATOM 1032 HB3 ARG A 87 74.203 62.212 -15.071 1.00 0.00 H ATOM 1033 HG2 ARG A 87 73.043 60.456 -16.514 1.00 0.00 H ATOM 1034 HG3 ARG A 87 73.132 59.405 -15.081 1.00 0.00 H ATOM 1035 HD2 ARG A 87 71.003 60.779 -15.368 1.00 0.00 H ATOM 1036 HD3 ARG A 87 71.997 62.206 -14.993 1.00 0.00 H ATOM 1037 HE ARG A 87 72.167 60.021 -13.016 1.00 0.00 H ATOM 1038 HH12 ARG A 87 69.929 63.388 -12.396 1.00 0.00 H ATOM 1039 HH11 ARG A 87 70.551 63.029 -14.049 1.00 0.00 H ATOM 1040 HH22 ARG A 87 70.327 61.925 -10.673 1.00 0.00 H ATOM 1041 HH21 ARG A 87 71.263 60.414 -10.968 1.00 0.00 H ATOM 1042 H ARG A 87 77.013 59.608 -14.648 1.00 0.00 H ATOM 1043 N VAL A 88 76.660 62.782 -16.751 1.00 16.35 N ATOM 1044 CA VAL A 88 77.524 63.983 -16.765 1.00 15.75 C ATOM 1045 C VAL A 88 76.600 65.164 -17.117 1.00 15.46 C ATOM 1046 O VAL A 88 76.044 65.208 -18.216 1.00 15.30 O ATOM 1047 CB VAL A 88 78.684 63.870 -17.810 1.00 15.81 C ATOM 1048 CG1 VAL A 88 79.573 65.117 -17.758 1.00 16.39 C ATOM 1049 CG2 VAL A 88 79.536 62.626 -17.540 1.00 16.22 C ATOM 1050 HA VAL A 88 78.008 64.111 -15.797 1.00 0.00 H ATOM 1051 HB VAL A 88 78.238 63.787 -18.801 1.00 0.00 H ATOM 1052 HG11 VAL A 88 78.974 65.999 -17.986 1.00 0.00 H ATOM 1053 HG12 VAL A 88 80.001 65.215 -16.760 1.00 0.00 H ATOM 1054 HG13 VAL A 88 80.374 65.021 -18.491 1.00 0.00 H ATOM 1055 HG21 VAL A 88 79.966 62.692 -16.541 1.00 0.00 H ATOM 1056 HG22 VAL A 88 78.910 61.736 -17.610 1.00 0.00 H ATOM 1057 HG23 VAL A 88 80.336 62.568 -18.278 1.00 0.00 H ATOM 1058 H VAL A 88 76.089 62.571 -17.594 1.00 0.00 H ATOM 1059 N ILE A 89 76.424 66.095 -16.178 1.00 15.12 N ATOM 1060 CA ILE A 89 75.516 67.237 -16.342 1.00 15.81 C ATOM 1061 C ILE A 89 76.164 68.635 -16.296 1.00 15.33 C ATOM 1062 O ILE A 89 76.521 69.142 -15.229 1.00 15.18 O ATOM 1063 CB ILE A 89 74.392 67.176 -15.263 1.00 16.33 C ATOM 1064 CG1 ILE A 89 73.765 65.772 -15.230 1.00 16.99 C ATOM 1065 CG2 ILE A 89 73.322 68.249 -15.529 1.00 17.60 C ATOM 1066 CD1 ILE A 89 72.968 65.469 -13.975 1.00 17.82 C ATOM 1067 HA ILE A 89 75.129 67.128 -17.355 1.00 0.00 H ATOM 1068 HB ILE A 89 74.834 67.380 -14.288 1.00 0.00 H ATOM 1069 HG12 ILE A 89 73.100 65.676 -16.088 1.00 0.00 H ATOM 1070 HG13 ILE A 89 74.567 65.038 -15.310 1.00 0.00 H ATOM 1071 HD11 ILE A 89 73.620 65.547 -13.105 1.00 0.00 H ATOM 1072 HD12 ILE A 89 72.151 66.184 -13.884 1.00 0.00 H ATOM 1073 HD13 ILE A 89 72.563 64.459 -14.038 1.00 0.00 H ATOM 1074 HG21 ILE A 89 73.784 69.236 -15.501 1.00 0.00 H ATOM 1075 HG22 ILE A 89 72.878 68.082 -16.510 1.00 0.00 H ATOM 1076 HG23 ILE A 89 72.549 68.187 -14.763 1.00 0.00 H ATOM 1077 H ILE A 89 76.955 66.008 -15.288 1.00 0.00 H ATOM 1078 N ARG A 90 76.257 69.261 -17.462 1.00 16.58 N ATOM 1079 CA ARG A 90 76.819 70.604 -17.619 1.00 17.13 C ATOM 1080 C ARG A 90 75.747 71.667 -17.250 1.00 16.61 C ATOM 1081 O ARG A 90 74.544 71.435 -17.449 1.00 16.15 O ATOM 1082 CB ARG A 90 77.256 70.739 -19.084 1.00 20.06 C ATOM 1083 CG ARG A 90 78.028 71.982 -19.453 1.00 25.16 C ATOM 1084 CD ARG A 90 78.751 71.803 -20.800 1.00 27.74 C ATOM 1085 NE ARG A 90 77.853 71.354 -21.865 1.00 29.97 N ATOM 1086 CZ ARG A 90 77.946 71.710 -23.144 1.00 30.02 C ATOM 1087 NH1 ARG A 90 78.900 72.536 -23.555 1.00 30.82 N ATOM 1088 NH2 ARG A 90 77.074 71.232 -24.022 1.00 30.53 N ATOM 1089 HA ARG A 90 77.672 70.761 -16.959 1.00 0.00 H ATOM 1090 HB2 ARG A 90 77.882 69.879 -19.322 1.00 0.00 H ATOM 1091 HB3 ARG A 90 76.357 70.714 -19.700 1.00 0.00 H ATOM 1092 HG2 ARG A 90 77.337 72.822 -19.528 1.00 0.00 H ATOM 1093 HG3 ARG A 90 78.765 72.188 -18.677 1.00 0.00 H ATOM 1094 HD2 ARG A 90 79.543 71.064 -20.676 1.00 0.00 H ATOM 1095 HD3 ARG A 90 79.189 72.758 -21.091 1.00 0.00 H ATOM 1096 HE ARG A 90 77.083 70.707 -21.602 1.00 0.00 H ATOM 1097 HH12 ARG A 90 78.959 72.804 -24.558 1.00 0.00 H ATOM 1098 HH11 ARG A 90 79.589 72.915 -22.874 1.00 0.00 H ATOM 1099 HH22 ARG A 90 77.141 71.506 -25.023 1.00 0.00 H ATOM 1100 HH21 ARG A 90 76.324 70.583 -23.709 1.00 0.00 H ATOM 1101 H ARG A 90 75.912 68.771 -18.312 1.00 0.00 H ATOM 1102 N HIS A 91 76.152 72.812 -16.691 1.00 14.28 N ATOM 1103 CA HIS A 91 75.177 73.855 -16.347 1.00 13.79 C ATOM 1104 C HIS A 91 74.419 74.276 -17.615 1.00 14.17 C ATOM 1105 O HIS A 91 75.027 74.559 -18.644 1.00 14.15 O ATOM 1106 CB HIS A 91 75.846 75.089 -15.722 1.00 12.74 C ATOM 1107 CG HIS A 91 74.876 76.020 -15.057 1.00 12.70 C ATOM 1108 ND1 HIS A 91 74.163 76.979 -15.750 1.00 12.78 N ATOM 1109 CD2 HIS A 91 74.447 76.090 -13.774 1.00 12.84 C ATOM 1110 CE1 HIS A 91 73.333 77.591 -14.923 1.00 13.36 C ATOM 1111 NE2 HIS A 91 73.487 77.071 -13.719 1.00 12.67 N ATOM 1112 HA HIS A 91 74.492 73.440 -15.608 1.00 0.00 H ATOM 1113 HB2 HIS A 91 76.567 74.752 -14.978 1.00 0.00 H ATOM 1114 HB3 HIS A 91 76.366 75.636 -16.508 1.00 0.00 H ATOM 1115 HD2 HIS A 91 74.798 75.481 -12.941 1.00 0.00 H ATOM 1116 HE1 HIS A 91 72.640 78.389 -15.189 1.00 0.00 H ATOM 1117 H HIS A 91 77.163 72.965 -16.499 1.00 0.00 H ATOM 1118 N PRO A 92 73.081 74.372 -17.538 1.00 15.62 N ATOM 1119 CA PRO A 92 72.277 74.758 -18.706 1.00 16.39 C ATOM 1120 C PRO A 92 72.573 76.103 -19.382 1.00 15.80 C ATOM 1121 O PRO A 92 72.270 76.283 -20.556 1.00 17.91 O ATOM 1122 CB PRO A 92 70.833 74.677 -18.176 1.00 16.40 C ATOM 1123 CG PRO A 92 70.972 74.893 -16.703 1.00 18.64 C ATOM 1124 CD PRO A 92 72.218 74.091 -16.376 1.00 16.54 C ATOM 1125 HA PRO A 92 72.512 74.091 -19.536 1.00 0.00 H ATOM 1126 HD3 PRO A 92 72.678 74.434 -15.449 1.00 0.00 H ATOM 1127 HD2 PRO A 92 71.995 73.027 -16.297 1.00 0.00 H ATOM 1128 HG3 PRO A 92 70.104 74.513 -16.164 1.00 0.00 H ATOM 1129 HG2 PRO A 92 71.109 75.949 -16.469 1.00 0.00 H ATOM 1130 HB2 PRO A 92 70.212 75.453 -18.624 1.00 0.00 H ATOM 1131 HB3 PRO A 92 70.398 73.699 -18.385 1.00 0.00 H ATOM 1132 N ASN A 93 73.187 77.037 -18.667 1.00 14.80 N ATOM 1133 CA ASN A 93 73.476 78.347 -19.249 1.00 14.40 C ATOM 1134 C ASN A 93 74.965 78.592 -19.566 1.00 13.65 C ATOM 1135 O ASN A 93 75.398 79.745 -19.660 1.00 12.03 O ATOM 1136 CB ASN A 93 72.936 79.462 -18.326 1.00 17.12 C ATOM 1137 CG ASN A 93 71.450 79.264 -17.940 1.00 19.99 C ATOM 1138 OD1 ASN A 93 71.091 79.360 -16.759 1.00 21.11 O ATOM 1139 ND2 ASN A 93 70.600 78.982 -18.927 1.00 20.71 N ATOM 1140 HA ASN A 93 72.966 78.366 -20.212 1.00 0.00 H ATOM 1141 HB2 ASN A 93 73.533 79.477 -17.414 1.00 0.00 H ATOM 1142 HB3 ASN A 93 73.037 80.418 -18.840 1.00 0.00 H ATOM 1143 HD22 ASN A 93 70.945 78.911 -19.906 1.00 0.00 H ATOM 1144 HD21 ASN A 93 69.592 78.833 -18.719 1.00 0.00 H ATOM 1145 H ASN A 93 73.465 76.836 -17.685 1.00 0.00 H ATOM 1146 N TYR A 94 75.756 77.525 -19.710 1.00 11.91 N ATOM 1147 CA TYR A 94 77.179 77.669 -20.019 1.00 11.95 C ATOM 1148 C TYR A 94 77.368 78.378 -21.367 1.00 12.78 C ATOM 1149 O TYR A 94 76.670 78.068 -22.338 1.00 13.83 O ATOM 1150 CB TYR A 94 77.879 76.291 -20.037 1.00 11.97 C ATOM 1151 CG TYR A 94 79.320 76.350 -20.519 1.00 12.07 C ATOM 1152 CD1 TYR A 94 80.316 76.918 -19.726 1.00 11.99 C ATOM 1153 CD2 TYR A 94 79.674 75.899 -21.794 1.00 12.83 C ATOM 1154 CE1 TYR A 94 81.624 77.046 -20.184 1.00 13.17 C ATOM 1155 CE2 TYR A 94 80.993 76.021 -22.269 1.00 14.38 C ATOM 1156 CZ TYR A 94 81.959 76.599 -21.455 1.00 14.19 C ATOM 1157 OH TYR A 94 83.251 76.761 -21.903 1.00 15.36 O ATOM 1158 HA TYR A 94 77.635 78.277 -19.238 1.00 0.00 H ATOM 1159 HB3 TYR A 94 77.320 75.628 -20.698 1.00 0.00 H ATOM 1160 HB2 TYR A 94 77.869 75.885 -19.025 1.00 0.00 H ATOM 1161 HD2 TYR A 94 78.915 75.445 -22.431 1.00 0.00 H ATOM 1162 HE2 TYR A 94 81.254 75.666 -23.266 1.00 0.00 H ATOM 1163 HE1 TYR A 94 82.384 77.496 -19.546 1.00 0.00 H ATOM 1164 HD1 TYR A 94 80.065 77.270 -18.725 1.00 0.00 H ATOM 1165 HH TYR A 94 83.794 77.186 -21.193 1.00 0.00 H ATOM 1166 H TYR A 94 75.352 76.573 -19.600 1.00 0.00 H ATOM 1167 N SER A 95 78.318 79.308 -21.428 1.00 13.09 N ATOM 1168 CA SER A 95 78.597 80.055 -22.652 1.00 15.20 C ATOM 1169 C SER A 95 80.103 80.257 -22.899 1.00 15.78 C ATOM 1170 O SER A 95 80.817 80.715 -22.007 1.00 15.93 O ATOM 1171 CB SER A 95 77.912 81.418 -22.579 1.00 15.00 C ATOM 1172 OG SER A 95 78.201 82.179 -23.737 1.00 19.52 O ATOM 1173 HA SER A 95 78.208 79.467 -23.484 1.00 0.00 H ATOM 1174 HB2 SER A 95 78.269 81.953 -21.699 1.00 0.00 H ATOM 1175 HB3 SER A 95 76.834 81.275 -22.503 1.00 0.00 H ATOM 1176 HG SER A 95 77.750 83.058 -23.674 1.00 0.00 H ATOM 1177 H SER A 95 78.880 79.510 -20.577 1.00 0.00 H ATOM 1178 N SER A 96 80.570 79.997 -24.125 1.00 16.99 N ATOM 1179 CA SER A 96 82.000 80.152 -24.459 1.00 18.10 C ATOM 1180 C SER A 96 82.460 81.576 -24.792 1.00 19.76 C ATOM 1181 O SER A 96 83.664 81.822 -24.931 1.00 20.20 O ATOM 1182 CB SER A 96 82.389 79.238 -25.616 1.00 17.57 C ATOM 1183 OG SER A 96 81.730 79.654 -26.799 1.00 17.54 O ATOM 1184 HA SER A 96 82.509 79.875 -23.536 1.00 0.00 H ATOM 1185 HB2 SER A 96 82.100 78.214 -25.381 1.00 0.00 H ATOM 1186 HB3 SER A 96 83.468 79.284 -25.767 1.00 0.00 H ATOM 1187 HG SER A 96 81.987 79.057 -27.546 1.00 0.00 H ATOM 1188 H SER A 96 79.909 79.678 -24.862 1.00 0.00 H ATOM 1189 N TYR A 97 81.521 82.509 -24.928 1.00 20.90 N ATOM 1190 CA TYR A 97 81.888 83.886 -25.244 1.00 23.45 C ATOM 1191 C TYR A 97 82.857 84.409 -24.178 1.00 23.40 C ATOM 1192 O TYR A 97 83.941 84.903 -24.504 1.00 23.73 O ATOM 1193 CB TYR A 97 80.642 84.782 -25.327 1.00 26.60 C ATOM 1194 CG TYR A 97 80.930 86.179 -25.842 1.00 29.76 C ATOM 1195 CD1 TYR A 97 81.009 86.435 -27.211 1.00 31.30 C ATOM 1196 CD2 TYR A 97 81.132 87.245 -24.960 1.00 31.16 C ATOM 1197 CE1 TYR A 97 81.283 87.717 -27.690 1.00 32.38 C ATOM 1198 CE2 TYR A 97 81.408 88.530 -25.428 1.00 32.35 C ATOM 1199 CZ TYR A 97 81.481 88.762 -26.791 1.00 33.26 C ATOM 1200 OH TYR A 97 81.747 90.035 -27.258 1.00 34.23 O ATOM 1201 HA TYR A 97 82.376 83.908 -26.218 1.00 0.00 H ATOM 1202 HB3 TYR A 97 80.210 84.865 -24.330 1.00 0.00 H ATOM 1203 HB2 TYR A 97 79.922 84.310 -25.995 1.00 0.00 H ATOM 1204 HD2 TYR A 97 81.073 87.069 -23.886 1.00 0.00 H ATOM 1205 HE2 TYR A 97 81.565 89.347 -24.724 1.00 0.00 H ATOM 1206 HE1 TYR A 97 81.342 87.899 -28.763 1.00 0.00 H ATOM 1207 HD1 TYR A 97 80.854 85.620 -27.918 1.00 0.00 H ATOM 1208 HH TYR A 97 81.764 90.025 -28.248 1.00 0.00 H ATOM 1209 H TYR A 97 80.519 82.256 -24.808 1.00 0.00 H ATOM 1210 N ASN A 98 82.467 84.273 -22.909 1.00 21.67 N ATOM 1211 CA ASN A 98 83.289 84.714 -21.779 1.00 20.34 C ATOM 1212 C ASN A 98 83.514 83.608 -20.749 1.00 17.20 C ATOM 1213 O ASN A 98 84.013 83.871 -19.664 1.00 16.28 O ATOM 1214 CB ASN A 98 82.665 85.943 -21.092 1.00 22.66 C ATOM 1215 CG ASN A 98 81.213 85.730 -20.706 1.00 24.96 C ATOM 1216 OD1 ASN A 98 80.504 84.908 -21.307 1.00 28.03 O ATOM 1217 ND2 ASN A 98 80.754 86.472 -19.711 1.00 25.25 N ATOM 1218 HA ASN A 98 84.261 84.983 -22.193 1.00 0.00 H ATOM 1219 HB2 ASN A 98 83.236 86.165 -20.190 1.00 0.00 H ATOM 1220 HB3 ASN A 98 82.723 86.790 -21.775 1.00 0.00 H ATOM 1221 HD22 ASN A 98 81.383 87.149 -19.234 1.00 0.00 H ATOM 1222 HD21 ASN A 98 79.764 86.378 -19.406 1.00 0.00 H ATOM 1223 H ASN A 98 81.543 83.837 -22.714 1.00 0.00 H ATOM 1224 N ILE A 99 83.181 82.372 -21.123 1.00 15.68 N ATOM 1225 CA ILE A 99 83.316 81.192 -20.247 1.00 14.33 C ATOM 1226 C ILE A 99 82.480 81.356 -18.954 1.00 12.74 C ATOM 1227 O ILE A 99 82.945 81.071 -17.845 1.00 12.74 O ATOM 1228 CB ILE A 99 84.809 80.910 -19.938 1.00 14.51 C ATOM 1229 CG1 ILE A 99 85.621 81.065 -21.227 1.00 17.05 C ATOM 1230 CG2 ILE A 99 84.995 79.475 -19.437 1.00 14.72 C ATOM 1231 CD1 ILE A 99 87.099 81.048 -21.022 1.00 22.23 C ATOM 1232 HA ILE A 99 82.919 80.325 -20.775 1.00 0.00 H ATOM 1233 HB ILE A 99 85.143 81.611 -19.173 1.00 0.00 H ATOM 1234 HG12 ILE A 99 85.359 80.247 -21.898 1.00 0.00 H ATOM 1235 HG13 ILE A 99 85.350 82.014 -21.690 1.00 0.00 H ATOM 1236 HD11 ILE A 99 87.383 81.869 -20.363 1.00 0.00 H ATOM 1237 HD12 ILE A 99 87.391 80.100 -20.570 1.00 0.00 H ATOM 1238 HD13 ILE A 99 87.599 81.163 -21.984 1.00 0.00 H ATOM 1239 HG21 ILE A 99 84.412 79.331 -18.527 1.00 0.00 H ATOM 1240 HG22 ILE A 99 84.655 78.777 -20.202 1.00 0.00 H ATOM 1241 HG23 ILE A 99 86.050 79.299 -19.226 1.00 0.00 H ATOM 1242 H ILE A 99 82.806 82.232 -22.083 1.00 0.00 H ATOM 1243 N ASP A 100 81.229 81.789 -19.125 1.00 10.94 N ATOM 1244 CA ASP A 100 80.294 82.041 -18.026 1.00 10.35 C ATOM 1245 C ASP A 100 79.604 80.737 -17.576 1.00 9.39 C ATOM 1246 O ASP A 100 79.343 79.856 -18.399 1.00 9.35 O ATOM 1247 CB ASP A 100 79.248 83.071 -18.513 1.00 11.09 C ATOM 1248 CG ASP A 100 78.507 83.790 -17.373 1.00 12.84 C ATOM 1249 OD1 ASP A 100 78.945 83.724 -16.202 1.00 12.65 O ATOM 1250 OD2 ASP A 100 77.480 84.447 -17.668 1.00 12.51 O ATOM 1251 HA ASP A 100 80.835 82.433 -17.164 1.00 0.00 H ATOM 1252 HB2 ASP A 100 79.759 83.820 -19.118 1.00 0.00 H ATOM 1253 HB3 ASP A 100 78.513 82.551 -19.127 1.00 0.00 H ATOM 1254 H ASP A 100 80.898 81.958 -20.097 1.00 0.00 H ATOM 1255 N ASN A 101 79.310 80.636 -16.275 1.00 8.86 N ATOM 1256 CA ASN A 101 78.650 79.470 -15.667 1.00 8.80 C ATOM 1257 C ASN A 101 79.439 78.172 -15.920 1.00 9.27 C ATOM 1258 O ASN A 101 78.868 77.147 -16.334 1.00 8.65 O ATOM 1259 CB ASN A 101 77.210 79.334 -16.182 1.00 10.68 C ATOM 1260 CG ASN A 101 76.382 80.589 -15.936 1.00 11.96 C ATOM 1261 OD1 ASN A 101 76.077 80.936 -14.790 1.00 13.22 O ATOM 1262 ND2 ASN A 101 76.010 81.273 -17.014 1.00 11.55 N ATOM 1263 HA ASN A 101 78.623 79.634 -14.590 1.00 0.00 H ATOM 1264 HB2 ASN A 101 77.239 79.138 -17.254 1.00 0.00 H ATOM 1265 HB3 ASN A 101 76.734 78.496 -15.673 1.00 0.00 H ATOM 1266 HD22 ASN A 101 76.289 80.944 -17.960 1.00 0.00 H ATOM 1267 HD21 ASN A 101 75.440 82.137 -16.911 1.00 0.00 H ATOM 1268 H ASN A 101 79.564 81.431 -15.655 1.00 0.00 H ATOM 1269 N ASP A 102 80.734 78.211 -15.598 1.00 8.10 N ATOM 1270 CA ASP A 102 81.655 77.084 -15.832 1.00 8.11 C ATOM 1271 C ASP A 102 81.645 76.036 -14.700 1.00 7.40 C ATOM 1272 O ASP A 102 82.631 75.878 -13.967 1.00 7.43 O ATOM 1273 CB ASP A 102 83.075 77.643 -16.066 1.00 6.84 C ATOM 1274 CG ASP A 102 84.011 76.647 -16.750 1.00 8.04 C ATOM 1275 OD1 ASP A 102 83.531 75.631 -17.298 1.00 8.20 O ATOM 1276 OD2 ASP A 102 85.237 76.890 -16.741 1.00 7.50 O ATOM 1277 HA ASP A 102 81.310 76.550 -16.717 1.00 0.00 H ATOM 1278 HB2 ASP A 102 82.998 78.532 -16.692 1.00 0.00 H ATOM 1279 HB3 ASP A 102 83.504 77.915 -15.101 1.00 0.00 H ATOM 1280 H ASP A 102 81.111 79.077 -15.162 1.00 0.00 H ATOM 1281 N ILE A 103 80.548 75.287 -14.596 1.00 8.13 N ATOM 1282 CA ILE A 103 80.395 74.277 -13.542 1.00 8.64 C ATOM 1283 C ILE A 103 79.625 73.055 -14.108 1.00 9.47 C ATOM 1284 O ILE A 103 78.797 73.194 -15.036 1.00 9.71 O ATOM 1285 CB ILE A 103 79.730 74.930 -12.267 1.00 9.74 C ATOM 1286 CG1 ILE A 103 79.861 74.026 -11.038 1.00 11.47 C ATOM 1287 CG2 ILE A 103 78.285 75.334 -12.533 1.00 10.09 C ATOM 1288 CD1 ILE A 103 79.572 74.761 -9.722 1.00 12.15 C ATOM 1289 HA ILE A 103 81.365 73.903 -13.213 1.00 0.00 H ATOM 1290 HB ILE A 103 80.278 75.846 -12.045 1.00 0.00 H ATOM 1291 HG12 ILE A 103 79.157 73.200 -11.137 1.00 0.00 H ATOM 1292 HG13 ILE A 103 80.877 73.633 -11.001 1.00 0.00 H ATOM 1293 HD11 ILE A 103 80.276 75.585 -9.605 1.00 0.00 H ATOM 1294 HD12 ILE A 103 78.554 75.151 -9.741 1.00 0.00 H ATOM 1295 HD13 ILE A 103 79.681 74.067 -8.888 1.00 0.00 H ATOM 1296 HG21 ILE A 103 78.256 76.059 -13.347 1.00 0.00 H ATOM 1297 HG22 ILE A 103 77.707 74.452 -12.809 1.00 0.00 H ATOM 1298 HG23 ILE A 103 77.862 75.779 -11.633 1.00 0.00 H ATOM 1299 H ILE A 103 79.778 75.422 -15.282 1.00 0.00 H ATOM 1300 N MET A 104 79.899 71.872 -13.555 1.00 8.91 N ATOM 1301 CA MET A 104 79.313 70.611 -14.038 1.00 9.96 C ATOM 1302 C MET A 104 79.214 69.564 -12.906 1.00 9.77 C ATOM 1303 O MET A 104 80.053 69.560 -11.999 1.00 10.22 O ATOM 1304 CB MET A 104 80.258 70.102 -15.148 1.00 11.16 C ATOM 1305 CG MET A 104 80.026 68.718 -15.722 1.00 14.35 C ATOM 1306 SD MET A 104 81.199 68.357 -17.083 1.00 13.92 S ATOM 1307 CE MET A 104 82.641 67.748 -16.215 1.00 13.60 C ATOM 1308 HA MET A 104 78.299 70.772 -14.404 1.00 0.00 H ATOM 1309 HB2 MET A 104 80.192 70.808 -15.975 1.00 0.00 H ATOM 1310 HB3 MET A 104 81.269 70.116 -14.741 1.00 0.00 H ATOM 1311 HG2 MET A 104 79.007 68.658 -16.105 1.00 0.00 H ATOM 1312 HG3 MET A 104 80.159 67.979 -14.932 1.00 0.00 H ATOM 1313 HE1 MET A 104 83.008 68.519 -15.537 1.00 0.00 H ATOM 1314 HE2 MET A 104 82.372 66.859 -15.645 1.00 0.00 H ATOM 1315 HE3 MET A 104 83.419 67.497 -16.936 1.00 0.00 H ATOM 1316 H MET A 104 80.555 71.839 -12.748 1.00 0.00 H ATOM 1317 N LEU A 105 78.196 68.700 -12.952 1.00 9.23 N ATOM 1318 CA LEU A 105 78.023 67.621 -11.960 1.00 9.97 C ATOM 1319 C LEU A 105 78.201 66.236 -12.614 1.00 10.54 C ATOM 1320 O LEU A 105 77.728 66.000 -13.730 1.00 11.31 O ATOM 1321 CB LEU A 105 76.638 67.676 -11.307 1.00 10.32 C ATOM 1322 CG LEU A 105 76.431 68.571 -10.078 1.00 11.91 C ATOM 1323 CD1 LEU A 105 74.946 68.594 -9.686 1.00 13.29 C ATOM 1324 CD2 LEU A 105 77.282 68.089 -8.914 1.00 12.55 C ATOM 1325 HA LEU A 105 78.787 67.770 -11.197 1.00 0.00 H ATOM 1326 HB2 LEU A 105 75.938 68.014 -12.071 1.00 0.00 H ATOM 1327 HB3 LEU A 105 76.385 66.659 -11.008 1.00 0.00 H ATOM 1328 HG LEU A 105 76.743 69.585 -10.330 1.00 0.00 H ATOM 1329 HD21 LEU A 105 77.001 67.067 -8.658 1.00 0.00 H ATOM 1330 HD22 LEU A 105 78.334 68.117 -9.198 1.00 0.00 H ATOM 1331 HD23 LEU A 105 77.119 68.738 -8.054 1.00 0.00 H ATOM 1332 HD11 LEU A 105 74.358 68.984 -10.517 1.00 0.00 H ATOM 1333 HD12 LEU A 105 74.618 67.581 -9.451 1.00 0.00 H ATOM 1334 HD13 LEU A 105 74.812 69.232 -8.813 1.00 0.00 H ATOM 1335 H LEU A 105 77.498 68.791 -13.717 1.00 0.00 H ATOM 1336 N ILE A 106 78.883 65.332 -11.917 1.00 10.89 N ATOM 1337 CA ILE A 106 79.118 63.968 -12.404 1.00 12.42 C ATOM 1338 C ILE A 106 78.576 62.972 -11.365 1.00 13.20 C ATOM 1339 O ILE A 106 78.949 63.032 -10.186 1.00 13.12 O ATOM 1340 CB ILE A 106 80.638 63.685 -12.608 1.00 12.43 C ATOM 1341 CG1 ILE A 106 81.236 64.628 -13.665 1.00 13.81 C ATOM 1342 CG2 ILE A 106 80.855 62.225 -13.028 1.00 12.53 C ATOM 1343 CD1 ILE A 106 82.770 64.657 -13.679 1.00 15.31 C ATOM 1344 HA ILE A 106 78.612 63.858 -13.363 1.00 0.00 H ATOM 1345 HB ILE A 106 81.145 63.864 -11.660 1.00 0.00 H ATOM 1346 HG12 ILE A 106 80.890 64.306 -14.647 1.00 0.00 H ATOM 1347 HG13 ILE A 106 80.876 65.638 -13.467 1.00 0.00 H ATOM 1348 HD11 ILE A 106 83.135 64.989 -12.707 1.00 0.00 H ATOM 1349 HD12 ILE A 106 83.149 63.657 -13.888 1.00 0.00 H ATOM 1350 HD13 ILE A 106 83.112 65.345 -14.452 1.00 0.00 H ATOM 1351 HG21 ILE A 106 80.470 61.564 -12.252 1.00 0.00 H ATOM 1352 HG22 ILE A 106 80.328 62.035 -13.963 1.00 0.00 H ATOM 1353 HG23 ILE A 106 81.921 62.043 -13.167 1.00 0.00 H ATOM 1354 H ILE A 106 79.266 65.603 -10.989 1.00 0.00 H ATOM 1355 N LYS A 107 77.682 62.083 -11.800 1.00 14.44 N ATOM 1356 CA LYS A 107 77.080 61.053 -10.941 1.00 15.01 C ATOM 1357 C LYS A 107 77.887 59.752 -11.090 1.00 14.43 C ATOM 1358 O LYS A 107 78.147 59.311 -12.216 1.00 14.20 O ATOM 1359 CB LYS A 107 75.614 60.827 -11.366 1.00 16.86 C ATOM 1360 CG LYS A 107 74.893 59.638 -10.726 1.00 20.64 C ATOM 1361 CD LYS A 107 74.608 59.846 -9.251 1.00 21.70 C ATOM 1362 CE LYS A 107 73.877 58.651 -8.662 1.00 21.56 C ATOM 1363 NZ LYS A 107 72.580 58.395 -9.353 1.00 21.82 N ATOM 1364 HA LYS A 107 77.097 61.371 -9.899 1.00 0.00 H ATOM 1365 HB2 LYS A 107 75.054 61.728 -11.116 1.00 0.00 H ATOM 1366 HB3 LYS A 107 75.601 60.680 -12.446 1.00 0.00 H ATOM 1367 HG2 LYS A 107 73.947 59.484 -11.245 1.00 0.00 H ATOM 1368 HG3 LYS A 107 75.516 58.751 -10.839 1.00 0.00 H ATOM 1369 HD2 LYS A 107 75.551 59.983 -8.722 1.00 0.00 H ATOM 1370 HD3 LYS A 107 73.991 60.737 -9.129 1.00 0.00 H ATOM 1371 HE2 LYS A 107 73.682 58.842 -7.607 1.00 0.00 H ATOM 1372 HE3 LYS A 107 74.509 57.768 -8.760 1.00 0.00 H ATOM 1373 HZ1 LYS A 107 71.968 59.230 -9.259 1.00 0.00 H ATOM 1374 HZ2 LYS A 107 72.757 58.205 -10.360 1.00 0.00 H ATOM 1375 HZ3 LYS A 107 72.115 57.572 -8.920 1.00 0.00 H ATOM 1376 H LYS A 107 77.396 62.120 -12.799 1.00 0.00 H ATOM 1377 N LEU A 108 78.313 59.166 -9.968 1.00 14.44 N ATOM 1378 CA LEU A 108 79.100 57.920 -9.988 1.00 15.52 C ATOM 1379 C LEU A 108 78.201 56.695 -10.209 1.00 16.69 C ATOM 1380 O LEU A 108 77.090 56.648 -9.676 1.00 16.35 O ATOM 1381 CB LEU A 108 79.868 57.757 -8.674 1.00 15.07 C ATOM 1382 CG LEU A 108 80.894 58.843 -8.347 1.00 17.04 C ATOM 1383 CD1 LEU A 108 81.575 58.524 -7.022 1.00 18.14 C ATOM 1384 CD2 LEU A 108 81.930 58.955 -9.467 1.00 18.03 C ATOM 1385 HA LEU A 108 79.804 57.987 -10.818 1.00 0.00 H ATOM 1386 HB2 LEU A 108 79.139 57.734 -7.864 1.00 0.00 H ATOM 1387 HB3 LEU A 108 80.395 56.804 -8.714 1.00 0.00 H ATOM 1388 HG LEU A 108 80.381 59.801 -8.261 1.00 0.00 H ATOM 1389 HD21 LEU A 108 82.446 58.002 -9.580 1.00 0.00 H ATOM 1390 HD22 LEU A 108 81.428 59.210 -10.400 1.00 0.00 H ATOM 1391 HD23 LEU A 108 82.651 59.733 -9.216 1.00 0.00 H ATOM 1392 HD11 LEU A 108 80.826 58.483 -6.231 1.00 0.00 H ATOM 1393 HD12 LEU A 108 82.079 57.561 -7.097 1.00 0.00 H ATOM 1394 HD13 LEU A 108 82.305 59.301 -6.794 1.00 0.00 H ATOM 1395 H LEU A 108 78.082 59.602 -9.052 1.00 0.00 H ATOM 1396 N SER A 109 78.681 55.710 -10.975 1.00 17.98 N ATOM 1397 CA SER A 109 77.888 54.501 -11.247 1.00 19.15 C ATOM 1398 C SER A 109 77.694 53.617 -10.004 1.00 20.12 C ATOM 1399 O SER A 109 76.796 52.777 -9.968 1.00 21.39 O ATOM 1400 CB SER A 109 78.472 53.698 -12.418 1.00 18.85 C ATOM 1401 OG SER A 109 79.796 53.264 -12.162 1.00 20.50 O ATOM 1402 HA SER A 109 76.895 54.847 -11.536 1.00 0.00 H ATOM 1403 HB2 SER A 109 78.474 54.327 -13.308 1.00 0.00 H ATOM 1404 HB3 SER A 109 77.844 52.825 -12.593 1.00 0.00 H ATOM 1405 HG SER A 109 80.376 54.051 -12.009 1.00 0.00 H ATOM 1406 H SER A 109 79.632 55.800 -11.386 1.00 0.00 H ATOM 1407 N LYS A 110 78.582 53.761 -9.026 1.00 20.28 N ATOM 1408 CA LYS A 110 78.478 53.053 -7.753 1.00 21.22 C ATOM 1409 C LYS A 110 79.089 54.010 -6.726 1.00 21.57 C ATOM 1410 O LYS A 110 80.004 54.783 -7.056 1.00 21.45 O ATOM 1411 CB LYS A 110 79.160 51.664 -7.786 1.00 22.45 C ATOM 1412 CG LYS A 110 80.679 51.625 -7.830 1.00 24.02 C ATOM 1413 CD LYS A 110 81.280 51.504 -6.436 1.00 24.12 C ATOM 1414 CE LYS A 110 82.789 51.337 -6.493 1.00 24.47 C ATOM 1415 NZ LYS A 110 83.389 51.286 -5.132 1.00 24.41 N ATOM 1416 HA LYS A 110 77.445 52.812 -7.501 1.00 0.00 H ATOM 1417 HB2 LYS A 110 78.846 51.125 -6.892 1.00 0.00 H ATOM 1418 HB3 LYS A 110 78.795 51.142 -8.671 1.00 0.00 H ATOM 1419 HG2 LYS A 110 80.994 50.768 -8.426 1.00 0.00 H ATOM 1420 HG3 LYS A 110 81.043 52.542 -8.294 1.00 0.00 H ATOM 1421 HD2 LYS A 110 81.044 52.404 -5.869 1.00 0.00 H ATOM 1422 HD3 LYS A 110 80.846 50.638 -5.937 1.00 0.00 H ATOM 1423 HE2 LYS A 110 83.218 52.179 -7.037 1.00 0.00 H ATOM 1424 HE3 LYS A 110 83.023 50.410 -7.017 1.00 0.00 H ATOM 1425 HZ1 LYS A 110 83.176 52.170 -4.627 1.00 0.00 H ATOM 1426 HZ2 LYS A 110 82.990 50.481 -4.608 1.00 0.00 H ATOM 1427 HZ3 LYS A 110 84.420 51.171 -5.213 1.00 0.00 H ATOM 1428 H LYS A 110 79.385 54.405 -9.173 1.00 0.00 H ATOM 1429 N PRO A 111 78.540 54.041 -5.502 1.00 21.17 N ATOM 1430 CA PRO A 111 79.055 54.937 -4.463 1.00 21.16 C ATOM 1431 C PRO A 111 80.496 54.683 -4.035 1.00 20.84 C ATOM 1432 O PRO A 111 80.968 53.540 -4.031 1.00 21.55 O ATOM 1433 CB PRO A 111 78.066 54.735 -3.313 1.00 22.52 C ATOM 1434 CG PRO A 111 77.580 53.327 -3.525 1.00 22.72 C ATOM 1435 CD PRO A 111 77.393 53.257 -5.007 1.00 22.23 C ATOM 1436 HA PRO A 111 79.114 55.963 -4.827 1.00 0.00 H ATOM 1437 HD3 PRO A 111 77.434 52.228 -5.363 1.00 0.00 H ATOM 1438 HD2 PRO A 111 76.447 53.707 -5.308 1.00 0.00 H ATOM 1439 HG3 PRO A 111 76.639 53.154 -3.002 1.00 0.00 H ATOM 1440 HG2 PRO A 111 78.320 52.601 -3.188 1.00 0.00 H ATOM 1441 HB2 PRO A 111 78.562 54.837 -2.348 1.00 0.00 H ATOM 1442 HB3 PRO A 111 77.243 55.447 -3.375 1.00 0.00 H ATOM 1443 N ALA A 112 81.200 55.758 -3.704 1.00 19.22 N ATOM 1444 CA ALA A 112 82.587 55.661 -3.265 1.00 18.72 C ATOM 1445 C ALA A 112 82.634 55.186 -1.816 1.00 18.57 C ATOM 1446 O ALA A 112 81.692 55.441 -1.049 1.00 18.85 O ATOM 1447 CB ALA A 112 83.261 57.018 -3.385 1.00 17.67 C ATOM 1448 HA ALA A 112 83.114 54.945 -3.895 1.00 0.00 H ATOM 1449 HB1 ALA A 112 83.233 57.345 -4.424 1.00 0.00 H ATOM 1450 HB2 ALA A 112 82.734 57.740 -2.761 1.00 0.00 H ATOM 1451 HB3 ALA A 112 84.297 56.938 -3.055 1.00 0.00 H ATOM 1452 H ALA A 112 80.751 56.694 -3.759 1.00 0.00 H ATOM 1453 N THR A 113 83.723 54.511 -1.445 1.00 18.05 N ATOM 1454 CA THR A 113 83.920 54.027 -0.070 1.00 18.10 C ATOM 1455 C THR A 113 84.742 55.062 0.690 1.00 17.74 C ATOM 1456 O THR A 113 85.882 55.352 0.319 1.00 18.93 O ATOM 1457 CB THR A 113 84.676 52.676 -0.040 1.00 18.72 C ATOM 1458 OG1 THR A 113 83.897 51.680 -0.712 1.00 19.95 O ATOM 1459 CG2 THR A 113 84.942 52.232 1.390 1.00 18.24 C ATOM 1460 HA THR A 113 82.941 53.879 0.387 1.00 0.00 H ATOM 1461 HB THR A 113 85.634 52.804 -0.544 1.00 0.00 H ATOM 1462 HG1 THR A 113 84.380 50.816 -0.693 1.00 0.00 H ATOM 1463 HG23 THR A 113 85.535 52.991 1.900 1.00 0.00 H ATOM 1464 HG21 THR A 113 83.993 52.100 1.910 1.00 0.00 H ATOM 1465 HG22 THR A 113 85.488 51.288 1.381 1.00 0.00 H ATOM 1466 H THR A 113 84.460 54.320 -2.154 1.00 0.00 H ATOM 1467 N LEU A 114 84.168 55.624 1.746 1.00 16.95 N ATOM 1468 CA LEU A 114 84.861 56.633 2.529 1.00 17.13 C ATOM 1469 C LEU A 114 85.804 55.973 3.536 1.00 17.87 C ATOM 1470 O LEU A 114 85.397 55.045 4.247 1.00 18.97 O ATOM 1471 CB LEU A 114 83.840 57.537 3.225 1.00 18.36 C ATOM 1472 CG LEU A 114 82.759 58.124 2.302 1.00 18.29 C ATOM 1473 CD1 LEU A 114 81.923 59.135 3.065 1.00 19.38 C ATOM 1474 CD2 LEU A 114 83.382 58.783 1.072 1.00 19.38 C ATOM 1475 HA LEU A 114 85.469 57.250 1.867 1.00 0.00 H ATOM 1476 HB2 LEU A 114 83.343 56.953 4.000 1.00 0.00 H ATOM 1477 HB3 LEU A 114 84.379 58.365 3.685 1.00 0.00 H ATOM 1478 HG LEU A 114 82.121 57.308 1.962 1.00 0.00 H ATOM 1479 HD21 LEU A 114 84.044 59.588 1.389 1.00 0.00 H ATOM 1480 HD22 LEU A 114 83.952 58.041 0.513 1.00 0.00 H ATOM 1481 HD23 LEU A 114 82.592 59.188 0.439 1.00 0.00 H ATOM 1482 HD11 LEU A 114 81.445 58.644 3.913 1.00 0.00 H ATOM 1483 HD12 LEU A 114 82.566 59.939 3.424 1.00 0.00 H ATOM 1484 HD13 LEU A 114 81.160 59.546 2.404 1.00 0.00 H ATOM 1485 H LEU A 114 83.206 55.338 2.018 1.00 0.00 H ATOM 1486 N ASN A 115 87.053 56.446 3.591 1.00 16.58 N ATOM 1487 CA ASN A 115 88.077 55.889 4.493 1.00 15.57 C ATOM 1488 C ASN A 115 89.208 56.888 4.807 1.00 15.40 C ATOM 1489 O ASN A 115 88.994 58.099 4.749 1.00 14.70 O ATOM 1490 CB ASN A 115 88.642 54.565 3.917 1.00 15.63 C ATOM 1491 CG ASN A 115 89.260 54.720 2.513 1.00 15.88 C ATOM 1492 OD1 ASN A 115 89.827 55.763 2.172 1.00 13.69 O ATOM 1493 ND2 ASN A 115 89.155 53.668 1.706 1.00 14.80 N ATOM 1494 HA ASN A 115 87.585 55.679 5.443 1.00 0.00 H ATOM 1495 HB2 ASN A 115 89.412 54.194 4.594 1.00 0.00 H ATOM 1496 HB3 ASN A 115 87.831 53.839 3.859 1.00 0.00 H ATOM 1497 HD22 ASN A 115 88.669 52.808 2.033 1.00 0.00 H ATOM 1498 HD21 ASN A 115 89.559 53.705 0.748 1.00 0.00 H ATOM 1499 H ASN A 115 87.313 57.240 2.972 1.00 0.00 H ATOM 1500 N THR A 116 90.397 56.401 5.161 1.00 15.29 N ATOM 1501 CA THR A 116 91.528 57.289 5.467 1.00 15.66 C ATOM 1502 C THR A 116 91.945 58.131 4.245 1.00 16.43 C ATOM 1503 O THR A 116 92.365 59.287 4.390 1.00 16.48 O ATOM 1504 CB THR A 116 92.788 56.480 5.921 1.00 15.78 C ATOM 1505 OG1 THR A 116 92.491 55.750 7.119 1.00 17.14 O ATOM 1506 CG2 THR A 116 93.987 57.400 6.178 1.00 15.80 C ATOM 1507 HA THR A 116 91.181 57.939 6.271 1.00 0.00 H ATOM 1508 HB THR A 116 93.048 55.793 5.116 1.00 0.00 H ATOM 1509 HG1 THR A 116 91.744 55.124 6.946 1.00 0.00 H ATOM 1510 HG23 THR A 116 94.217 57.957 5.270 1.00 0.00 H ATOM 1511 HG21 THR A 116 93.744 58.096 6.981 1.00 0.00 H ATOM 1512 HG22 THR A 116 94.850 56.799 6.465 1.00 0.00 H ATOM 1513 H THR A 116 90.528 55.371 5.222 1.00 0.00 H ATOM 1514 N TYR A 117 91.768 57.567 3.052 1.00 14.64 N ATOM 1515 CA TYR A 117 92.195 58.213 1.815 1.00 14.75 C ATOM 1516 C TYR A 117 91.150 58.986 1.003 1.00 14.15 C ATOM 1517 O TYR A 117 91.508 59.835 0.174 1.00 14.03 O ATOM 1518 CB TYR A 117 92.840 57.150 0.910 1.00 15.51 C ATOM 1519 CG TYR A 117 93.811 56.251 1.641 1.00 17.53 C ATOM 1520 CD1 TYR A 117 95.048 56.730 2.061 1.00 18.62 C ATOM 1521 CD2 TYR A 117 93.461 54.942 1.973 1.00 19.72 C ATOM 1522 CE1 TYR A 117 95.919 55.932 2.809 1.00 22.16 C ATOM 1523 CE2 TYR A 117 94.324 54.130 2.721 1.00 21.65 C ATOM 1524 CZ TYR A 117 95.550 54.634 3.141 1.00 22.80 C ATOM 1525 OH TYR A 117 96.396 53.861 3.924 1.00 26.31 O ATOM 1526 HA TYR A 117 92.881 58.991 2.150 1.00 0.00 H ATOM 1527 HB3 TYR A 117 93.375 57.657 0.107 1.00 0.00 H ATOM 1528 HB2 TYR A 117 92.049 56.532 0.484 1.00 0.00 H ATOM 1529 HD2 TYR A 117 92.501 54.544 1.645 1.00 0.00 H ATOM 1530 HE2 TYR A 117 94.036 53.109 2.972 1.00 0.00 H ATOM 1531 HE1 TYR A 117 96.883 56.326 3.130 1.00 0.00 H ATOM 1532 HD1 TYR A 117 95.344 57.747 1.802 1.00 0.00 H ATOM 1533 HH TYR A 117 97.217 54.375 4.127 1.00 0.00 H ATOM 1534 H TYR A 117 91.310 56.635 3.000 1.00 0.00 H ATOM 1535 N VAL A 118 89.878 58.662 1.206 1.00 13.11 N ATOM 1536 CA VAL A 118 88.776 59.268 0.450 1.00 13.25 C ATOM 1537 C VAL A 118 87.716 59.866 1.382 1.00 13.39 C ATOM 1538 O VAL A 118 87.049 59.139 2.126 1.00 13.12 O ATOM 1539 CB VAL A 118 88.113 58.186 -0.460 1.00 12.64 C ATOM 1540 CG1 VAL A 118 86.907 58.745 -1.203 1.00 14.93 C ATOM 1541 CG2 VAL A 118 89.144 57.603 -1.428 1.00 14.18 C ATOM 1542 HA VAL A 118 89.187 60.074 -0.158 1.00 0.00 H ATOM 1543 HB VAL A 118 87.749 57.381 0.178 1.00 0.00 H ATOM 1544 HG11 VAL A 118 86.166 59.092 -0.482 1.00 0.00 H ATOM 1545 HG12 VAL A 118 87.223 59.578 -1.831 1.00 0.00 H ATOM 1546 HG13 VAL A 118 86.472 57.964 -1.826 1.00 0.00 H ATOM 1547 HG21 VAL A 118 89.543 58.400 -2.055 1.00 0.00 H ATOM 1548 HG22 VAL A 118 89.954 57.144 -0.861 1.00 0.00 H ATOM 1549 HG23 VAL A 118 88.667 56.850 -2.055 1.00 0.00 H ATOM 1550 H VAL A 118 89.654 57.950 1.930 1.00 0.00 H ATOM 1551 N GLN A 119 87.550 61.186 1.322 1.00 13.68 N ATOM 1552 CA GLN A 119 86.577 61.906 2.155 1.00 15.03 C ATOM 1553 C GLN A 119 86.043 63.131 1.369 1.00 14.73 C ATOM 1554 O GLN A 119 86.808 63.809 0.670 1.00 14.45 O ATOM 1555 CB GLN A 119 87.242 62.356 3.473 1.00 17.72 C ATOM 1556 CG GLN A 119 87.673 61.210 4.408 1.00 21.81 C ATOM 1557 CD GLN A 119 88.507 61.681 5.594 1.00 25.08 C ATOM 1558 OE1 GLN A 119 88.334 62.802 6.085 1.00 27.88 O ATOM 1559 NE2 GLN A 119 89.410 60.822 6.069 1.00 26.58 N ATOM 1560 HA GLN A 119 85.744 61.247 2.400 1.00 0.00 H ATOM 1561 HB2 GLN A 119 88.128 62.940 3.223 1.00 0.00 H ATOM 1562 HB3 GLN A 119 86.534 62.985 4.012 1.00 0.00 H ATOM 1563 HG2 GLN A 119 86.778 60.718 4.788 1.00 0.00 H ATOM 1564 HG3 GLN A 119 88.262 60.496 3.832 1.00 0.00 H ATOM 1565 HE22 GLN A 119 89.523 59.888 5.626 1.00 0.00 H ATOM 1566 HE21 GLN A 119 90.001 61.086 6.883 1.00 0.00 H ATOM 1567 H GLN A 119 88.135 61.731 0.657 1.00 0.00 H ATOM 1568 N PRO A 120 84.730 63.423 1.469 1.00 14.21 N ATOM 1569 CA PRO A 120 84.143 64.567 0.747 1.00 13.58 C ATOM 1570 C PRO A 120 84.404 65.947 1.365 1.00 13.29 C ATOM 1571 O PRO A 120 84.787 66.050 2.529 1.00 13.79 O ATOM 1572 CB PRO A 120 82.649 64.231 0.746 1.00 14.11 C ATOM 1573 CG PRO A 120 82.467 63.563 2.082 1.00 15.76 C ATOM 1574 CD PRO A 120 83.694 62.667 2.197 1.00 14.08 C ATOM 1575 HA PRO A 120 84.594 64.673 -0.240 1.00 0.00 H ATOM 1576 HD3 PRO A 120 83.976 62.521 3.240 1.00 0.00 H ATOM 1577 HD2 PRO A 120 83.516 61.698 1.731 1.00 0.00 H ATOM 1578 HG3 PRO A 120 81.550 62.974 2.103 1.00 0.00 H ATOM 1579 HG2 PRO A 120 82.443 64.298 2.886 1.00 0.00 H ATOM 1580 HB2 PRO A 120 82.042 65.133 0.670 1.00 0.00 H ATOM 1581 HB3 PRO A 120 82.397 63.555 -0.071 1.00 0.00 H ATOM 1582 N VAL A 121 84.226 67.000 0.567 1.00 11.94 N ATOM 1583 CA VAL A 121 84.398 68.372 1.053 1.00 11.79 C ATOM 1584 C VAL A 121 83.011 69.046 1.138 1.00 11.43 C ATOM 1585 O VAL A 121 82.115 68.772 0.325 1.00 12.00 O ATOM 1586 CB VAL A 121 85.365 69.203 0.152 1.00 11.41 C ATOM 1587 CG1 VAL A 121 84.799 69.357 -1.262 1.00 11.38 C ATOM 1588 CG2 VAL A 121 85.641 70.579 0.791 1.00 11.56 C ATOM 1589 HA VAL A 121 84.856 68.334 2.041 1.00 0.00 H ATOM 1590 HB VAL A 121 86.310 68.666 0.073 1.00 0.00 H ATOM 1591 HG11 VAL A 121 84.665 68.371 -1.708 1.00 0.00 H ATOM 1592 HG12 VAL A 121 83.838 69.869 -1.214 1.00 0.00 H ATOM 1593 HG13 VAL A 121 85.493 69.940 -1.868 1.00 0.00 H ATOM 1594 HG21 VAL A 121 84.702 71.122 0.902 1.00 0.00 H ATOM 1595 HG22 VAL A 121 86.099 70.438 1.770 1.00 0.00 H ATOM 1596 HG23 VAL A 121 86.317 71.146 0.151 1.00 0.00 H ATOM 1597 H VAL A 121 83.958 66.844 -0.426 1.00 0.00 H ATOM 1598 N ALA A 122 82.826 69.890 2.151 1.00 11.36 N ATOM 1599 CA ALA A 122 81.555 70.588 2.366 1.00 13.14 C ATOM 1600 C ALA A 122 81.238 71.705 1.364 1.00 13.05 C ATOM 1601 O ALA A 122 82.137 72.410 0.900 1.00 12.43 O ATOM 1602 CB ALA A 122 81.523 71.169 3.790 1.00 13.79 C ATOM 1603 HA ALA A 122 80.786 69.831 2.215 1.00 0.00 H ATOM 1604 HB1 ALA A 122 81.620 70.360 4.514 1.00 0.00 H ATOM 1605 HB2 ALA A 122 82.348 71.870 3.914 1.00 0.00 H ATOM 1606 HB3 ALA A 122 80.577 71.688 3.948 1.00 0.00 H ATOM 1607 H ALA A 122 83.610 70.060 2.813 1.00 0.00 H ATOM 1608 N LEU A 123 79.964 71.846 1.012 1.00 14.23 N ATOM 1609 CA LEU A 123 79.543 72.931 0.123 1.00 15.02 C ATOM 1610 C LEU A 123 79.463 74.204 1.006 1.00 15.39 C ATOM 1611 O LEU A 123 79.329 74.104 2.231 1.00 15.52 O ATOM 1612 CB LEU A 123 78.214 72.591 -0.563 1.00 16.00 C ATOM 1613 CG LEU A 123 78.311 71.561 -1.704 1.00 17.62 C ATOM 1614 CD1 LEU A 123 76.924 71.289 -2.262 1.00 19.71 C ATOM 1615 CD2 LEU A 123 79.237 72.058 -2.821 1.00 17.88 C ATOM 1616 HA LEU A 123 80.249 73.090 -0.693 1.00 0.00 H ATOM 1617 HB2 LEU A 123 77.535 72.195 0.193 1.00 0.00 H ATOM 1618 HB3 LEU A 123 77.801 73.512 -0.974 1.00 0.00 H ATOM 1619 HG LEU A 123 78.732 70.639 -1.302 1.00 0.00 H ATOM 1620 HD21 LEU A 123 78.847 72.992 -3.226 1.00 0.00 H ATOM 1621 HD22 LEU A 123 80.235 72.225 -2.416 1.00 0.00 H ATOM 1622 HD23 LEU A 123 79.285 71.309 -3.612 1.00 0.00 H ATOM 1623 HD11 LEU A 123 76.286 70.896 -1.471 1.00 0.00 H ATOM 1624 HD12 LEU A 123 76.499 72.217 -2.645 1.00 0.00 H ATOM 1625 HD13 LEU A 123 76.995 70.560 -3.069 1.00 0.00 H ATOM 1626 H LEU A 123 79.256 71.176 1.373 1.00 0.00 H ATOM 1627 N PRO A 124 79.548 75.407 0.404 1.00 14.56 N ATOM 1628 CA PRO A 124 79.510 76.694 1.120 1.00 15.34 C ATOM 1629 C PRO A 124 78.326 77.050 2.038 1.00 16.09 C ATOM 1630 O PRO A 124 77.165 76.860 1.663 1.00 15.76 O ATOM 1631 CB PRO A 124 79.585 77.726 -0.017 1.00 15.76 C ATOM 1632 CG PRO A 124 80.195 77.006 -1.140 1.00 15.05 C ATOM 1633 CD PRO A 124 79.599 75.631 -1.052 1.00 14.54 C ATOM 1634 HA PRO A 124 80.317 76.660 1.852 1.00 0.00 H ATOM 1635 HD3 PRO A 124 78.602 75.603 -1.492 1.00 0.00 H ATOM 1636 HD2 PRO A 124 80.233 74.893 -1.544 1.00 0.00 H ATOM 1637 HG3 PRO A 124 81.279 76.967 -1.033 1.00 0.00 H ATOM 1638 HG2 PRO A 124 79.941 77.479 -2.089 1.00 0.00 H ATOM 1639 HB2 PRO A 124 78.588 78.078 -0.283 1.00 0.00 H ATOM 1640 HB3 PRO A 124 80.203 78.575 0.275 1.00 0.00 H ATOM 1641 N THR A 125 78.635 77.604 3.219 1.00 15.90 N ATOM 1642 CA THR A 125 77.603 78.084 4.142 1.00 16.99 C ATOM 1643 C THR A 125 77.535 79.607 3.989 1.00 18.03 C ATOM 1644 O THR A 125 76.733 80.268 4.656 1.00 19.73 O ATOM 1645 CB THR A 125 77.852 77.723 5.657 1.00 16.88 C ATOM 1646 OG1 THR A 125 79.161 78.135 6.081 1.00 16.84 O ATOM 1647 CG2 THR A 125 77.666 76.223 5.899 1.00 17.79 C ATOM 1648 HA THR A 125 76.670 77.585 3.879 1.00 0.00 H ATOM 1649 HB THR A 125 77.114 78.265 6.249 1.00 0.00 H ATOM 1650 HG1 THR A 125 79.844 77.677 5.530 1.00 0.00 H ATOM 1651 HG23 THR A 125 76.670 75.924 5.573 1.00 0.00 H ATOM 1652 HG21 THR A 125 78.416 75.669 5.334 1.00 0.00 H ATOM 1653 HG22 THR A 125 77.781 76.011 6.962 1.00 0.00 H ATOM 1654 H THR A 125 79.635 77.696 3.488 1.00 0.00 H ATOM 1655 N SER A 127 78.387 80.157 3.120 1.00 17.53 N ATOM 1656 CA SER A 127 78.424 81.592 2.840 1.00 17.79 C ATOM 1657 C SER A 127 79.389 81.858 1.687 1.00 16.79 C ATOM 1658 O SER A 127 80.039 80.936 1.201 1.00 16.57 O ATOM 1659 CB SER A 127 78.876 82.378 4.081 1.00 19.99 C ATOM 1660 OG SER A 127 80.273 82.254 4.308 1.00 23.59 O ATOM 1661 HA SER A 127 77.421 81.921 2.569 1.00 0.00 H ATOM 1662 HB2 SER A 127 78.342 81.999 4.952 1.00 0.00 H ATOM 1663 HB3 SER A 127 78.634 83.431 3.939 1.00 0.00 H ATOM 1664 HG SER A 127 80.523 82.773 5.113 1.00 0.00 H ATOM 1665 H SER A 127 79.055 79.536 2.619 1.00 0.00 H ATOM 1666 N CYS A 128 79.429 83.099 1.206 1.00 15.55 N ATOM 1667 CA CYS A 128 80.355 83.478 0.140 1.00 14.42 C ATOM 1668 C CYS A 128 81.552 84.140 0.837 1.00 15.25 C ATOM 1669 O CYS A 128 81.384 85.090 1.614 1.00 16.52 O ATOM 1670 CB CYS A 128 79.714 84.474 -0.849 1.00 13.56 C ATOM 1671 SG CYS A 128 78.342 83.873 -1.907 1.00 13.03 S ATOM 1672 HA CYS A 128 80.643 82.602 -0.441 1.00 0.00 H ATOM 1673 HB2 CYS A 128 80.504 84.827 -1.512 1.00 0.00 H ATOM 1674 HB3 CYS A 128 79.331 85.310 -0.265 1.00 0.00 H ATOM 1675 H CYS A 128 78.786 83.816 1.598 1.00 0.00 H ATOM 1676 N ALA A 129 82.751 83.619 0.594 1.00 14.05 N ATOM 1677 CA ALA A 129 83.970 84.151 1.207 1.00 14.93 C ATOM 1678 C ALA A 129 84.325 85.573 0.704 1.00 15.22 C ATOM 1679 O ALA A 129 84.301 85.839 -0.503 1.00 15.84 O ATOM 1680 CB ALA A 129 85.142 83.187 0.962 1.00 13.33 C ATOM 1681 HA ALA A 129 83.781 84.237 2.277 1.00 0.00 H ATOM 1682 HB1 ALA A 129 84.911 82.217 1.402 1.00 0.00 H ATOM 1683 HB2 ALA A 129 85.299 83.073 -0.111 1.00 0.00 H ATOM 1684 HB3 ALA A 129 86.045 83.590 1.421 1.00 0.00 H ATOM 1685 H ALA A 129 82.826 82.808 -0.052 1.00 0.00 H ATOM 1686 N PRO A 130 84.658 86.497 1.630 1.00 16.13 N ATOM 1687 CA PRO A 130 85.013 87.876 1.261 1.00 15.83 C ATOM 1688 C PRO A 130 86.456 88.055 0.767 1.00 15.11 C ATOM 1689 O PRO A 130 87.316 87.189 0.971 1.00 14.73 O ATOM 1690 CB PRO A 130 84.780 88.632 2.566 1.00 16.87 C ATOM 1691 CG PRO A 130 85.237 87.638 3.595 1.00 16.57 C ATOM 1692 CD PRO A 130 84.603 86.344 3.098 1.00 16.13 C ATOM 1693 HA PRO A 130 84.424 88.228 0.414 1.00 0.00 H ATOM 1694 HD3 PRO A 130 85.175 85.475 3.424 1.00 0.00 H ATOM 1695 HD2 PRO A 130 83.574 86.252 3.445 1.00 0.00 H ATOM 1696 HG3 PRO A 130 84.872 87.901 4.588 1.00 0.00 H ATOM 1697 HG2 PRO A 130 86.324 87.563 3.617 1.00 0.00 H ATOM 1698 HB2 PRO A 130 85.375 89.545 2.606 1.00 0.00 H ATOM 1699 HB3 PRO A 130 83.727 88.880 2.697 1.00 0.00 H ATOM 1700 N ALA A 132 86.710 89.190 0.118 1.00 14.81 N ATOM 1701 CA ALA A 132 88.043 89.525 -0.392 1.00 14.22 C ATOM 1702 C ALA A 132 89.053 89.476 0.759 1.00 13.64 C ATOM 1703 O ALA A 132 88.740 89.876 1.887 1.00 14.45 O ATOM 1704 CB ALA A 132 88.032 90.931 -1.027 1.00 14.03 C ATOM 1705 HA ALA A 132 88.329 88.802 -1.156 1.00 0.00 H ATOM 1706 HB1 ALA A 132 87.319 90.951 -1.851 1.00 0.00 H ATOM 1707 HB2 ALA A 132 87.742 91.665 -0.276 1.00 0.00 H ATOM 1708 HB3 ALA A 132 89.028 91.167 -1.402 1.00 0.00 H ATOM 1709 H ALA A 132 85.933 89.864 -0.033 1.00 0.00 H ATOM 1710 N GLY A 133 90.245 88.960 0.482 1.00 13.36 N ATOM 1711 CA GLY A 133 91.269 88.864 1.505 1.00 13.52 C ATOM 1712 C GLY A 133 91.397 87.505 2.178 1.00 13.74 C ATOM 1713 O GLY A 133 92.406 87.247 2.836 1.00 14.95 O ATOM 1714 HA3 GLY A 133 91.044 89.601 2.276 1.00 0.00 H ATOM 1715 HA2 GLY A 133 92.228 89.103 1.044 1.00 0.00 H ATOM 1716 H GLY A 133 90.447 88.621 -0.480 1.00 0.00 H ATOM 1717 N THR A 134 90.387 86.647 2.046 1.00 12.91 N ATOM 1718 CA THR A 134 90.429 85.300 2.640 1.00 13.06 C ATOM 1719 C THR A 134 91.519 84.433 1.971 1.00 12.76 C ATOM 1720 O THR A 134 91.669 84.469 0.746 1.00 11.92 O ATOM 1721 CB THR A 134 89.055 84.594 2.468 1.00 13.28 C ATOM 1722 OG1 THR A 134 88.021 85.378 3.080 1.00 15.83 O ATOM 1723 CG2 THR A 134 89.062 83.219 3.109 1.00 13.96 C ATOM 1724 HA THR A 134 90.661 85.413 3.699 1.00 0.00 H ATOM 1725 HB THR A 134 88.868 84.489 1.399 1.00 0.00 H ATOM 1726 HG1 THR A 134 87.986 86.269 2.650 1.00 0.00 H ATOM 1727 HG23 THR A 134 89.844 82.611 2.653 1.00 0.00 H ATOM 1728 HG21 THR A 134 89.254 83.319 4.177 1.00 0.00 H ATOM 1729 HG22 THR A 134 88.094 82.743 2.955 1.00 0.00 H ATOM 1730 H THR A 134 89.545 86.936 1.508 1.00 0.00 H ATOM 1731 N MET A 135 92.304 83.701 2.766 1.00 12.96 N ATOM 1732 CA MET A 135 93.353 82.814 2.221 1.00 13.18 C ATOM 1733 C MET A 135 92.750 81.423 1.981 1.00 13.31 C ATOM 1734 O MET A 135 92.036 80.879 2.844 1.00 13.06 O ATOM 1735 CB MET A 135 94.556 82.722 3.167 1.00 13.71 C ATOM 1736 CG MET A 135 95.772 81.989 2.579 1.00 14.13 C ATOM 1737 SD MET A 135 96.541 82.791 1.134 1.00 15.12 S ATOM 1738 CE MET A 135 97.610 83.971 1.923 1.00 16.00 C ATOM 1739 HA MET A 135 93.714 83.229 1.280 1.00 0.00 H ATOM 1740 HB2 MET A 135 94.862 83.735 3.429 1.00 0.00 H ATOM 1741 HB3 MET A 135 94.242 82.194 4.068 1.00 0.00 H ATOM 1742 HG2 MET A 135 95.452 80.991 2.280 1.00 0.00 H ATOM 1743 HG3 MET A 135 96.527 81.908 3.361 1.00 0.00 H ATOM 1744 HE1 MET A 135 97.013 84.651 2.530 1.00 0.00 H ATOM 1745 HE2 MET A 135 98.323 83.446 2.558 1.00 0.00 H ATOM 1746 HE3 MET A 135 98.148 84.538 1.163 1.00 0.00 H ATOM 1747 H MET A 135 92.174 83.757 3.796 1.00 0.00 H ATOM 1748 N CYS A 136 93.067 80.842 0.827 1.00 11.08 N ATOM 1749 CA CYS A 136 92.531 79.542 0.435 1.00 10.59 C ATOM 1750 C CYS A 136 93.652 78.646 -0.116 1.00 10.77 C ATOM 1751 O CYS A 136 94.800 79.089 -0.247 1.00 11.14 O ATOM 1752 CB CYS A 136 91.479 79.746 -0.669 1.00 10.62 C ATOM 1753 SG CYS A 136 90.185 81.010 -0.336 1.00 12.09 S ATOM 1754 HA CYS A 136 92.085 79.066 1.308 1.00 0.00 H ATOM 1755 HB2 CYS A 136 90.978 78.792 -0.831 1.00 0.00 H ATOM 1756 HB3 CYS A 136 92.004 80.039 -1.578 1.00 0.00 H ATOM 1757 H CYS A 136 93.720 81.331 0.182 1.00 0.00 H ATOM 1758 N THR A 137 93.307 77.397 -0.442 1.00 10.11 N ATOM 1759 CA THR A 137 94.255 76.428 -1.019 1.00 10.94 C ATOM 1760 C THR A 137 93.700 75.873 -2.343 1.00 9.62 C ATOM 1761 O THR A 137 92.498 75.591 -2.444 1.00 10.15 O ATOM 1762 CB THR A 137 94.484 75.207 -0.068 1.00 12.16 C ATOM 1763 OG1 THR A 137 94.951 75.667 1.209 1.00 14.46 O ATOM 1764 CG2 THR A 137 95.511 74.232 -0.666 1.00 12.71 C ATOM 1765 HA THR A 137 95.195 76.958 -1.172 1.00 0.00 H ATOM 1766 HB THR A 137 93.535 74.684 0.052 1.00 0.00 H ATOM 1767 HG1 THR A 137 95.804 76.155 1.091 1.00 0.00 H ATOM 1768 HG23 THR A 137 95.157 73.883 -1.636 1.00 0.00 H ATOM 1769 HG21 THR A 137 96.466 74.743 -0.789 1.00 0.00 H ATOM 1770 HG22 THR A 137 95.636 73.382 0.004 1.00 0.00 H ATOM 1771 H THR A 137 92.325 77.095 -0.281 1.00 0.00 H ATOM 1772 N VAL A 138 94.559 75.764 -3.354 1.00 8.37 N ATOM 1773 CA VAL A 138 94.182 75.183 -4.652 1.00 8.68 C ATOM 1774 C VAL A 138 95.183 74.028 -4.906 1.00 8.42 C ATOM 1775 O VAL A 138 96.351 74.088 -4.459 1.00 8.66 O ATOM 1776 CB VAL A 138 94.215 76.251 -5.793 1.00 9.02 C ATOM 1777 CG1 VAL A 138 95.619 76.841 -5.947 1.00 9.90 C ATOM 1778 CG2 VAL A 138 93.715 75.643 -7.116 1.00 9.48 C ATOM 1779 HA VAL A 138 93.157 74.814 -4.639 1.00 0.00 H ATOM 1780 HB VAL A 138 93.543 77.066 -5.522 1.00 0.00 H ATOM 1781 HG11 VAL A 138 95.917 77.316 -5.012 1.00 0.00 H ATOM 1782 HG12 VAL A 138 96.322 76.044 -6.191 1.00 0.00 H ATOM 1783 HG13 VAL A 138 95.615 77.581 -6.747 1.00 0.00 H ATOM 1784 HG21 VAL A 138 94.356 74.806 -7.395 1.00 0.00 H ATOM 1785 HG22 VAL A 138 92.691 75.292 -6.989 1.00 0.00 H ATOM 1786 HG23 VAL A 138 93.746 76.402 -7.898 1.00 0.00 H ATOM 1787 H VAL A 138 95.533 76.102 -3.221 1.00 0.00 H ATOM 1788 N SER A 139 94.727 72.966 -5.575 1.00 8.25 N ATOM 1789 CA SER A 139 95.586 71.804 -5.829 1.00 8.22 C ATOM 1790 C SER A 139 95.344 71.150 -7.199 1.00 8.14 C ATOM 1791 O SER A 139 94.290 71.371 -7.818 1.00 7.45 O ATOM 1792 CB SER A 139 95.395 70.772 -4.694 1.00 8.43 C ATOM 1793 OG SER A 139 94.020 70.445 -4.505 1.00 10.03 O ATOM 1794 HA SER A 139 96.615 72.162 -5.848 1.00 0.00 H ATOM 1795 HB2 SER A 139 95.790 71.188 -3.767 1.00 0.00 H ATOM 1796 HB3 SER A 139 95.943 69.864 -4.946 1.00 0.00 H ATOM 1797 HG SER A 139 93.655 70.061 -5.341 1.00 0.00 H ATOM 1798 H SER A 139 93.747 72.963 -5.922 1.00 0.00 H ATOM 1799 N GLY A 140 96.330 70.386 -7.689 1.00 8.11 N ATOM 1800 CA GLY A 140 96.180 69.707 -8.977 1.00 7.88 C ATOM 1801 C GLY A 140 97.440 69.079 -9.565 1.00 7.49 C ATOM 1802 O GLY A 140 98.546 69.283 -9.033 1.00 8.19 O ATOM 1803 HA3 GLY A 140 95.807 70.437 -9.695 1.00 0.00 H ATOM 1804 HA2 GLY A 140 95.443 68.914 -8.850 1.00 0.00 H ATOM 1805 H GLY A 140 97.211 70.274 -7.148 1.00 0.00 H ATOM 1806 N TRP A 141 97.265 68.359 -10.680 1.00 7.78 N ATOM 1807 CA TRP A 141 98.349 67.675 -11.412 1.00 9.27 C ATOM 1808 C TRP A 141 98.726 68.373 -12.740 1.00 10.54 C ATOM 1809 O TRP A 141 99.239 67.737 -13.665 1.00 11.25 O ATOM 1810 CB TRP A 141 97.979 66.198 -11.702 1.00 8.38 C ATOM 1811 CG TRP A 141 97.907 65.296 -10.480 1.00 8.02 C ATOM 1812 CD1 TRP A 141 98.959 64.707 -9.832 1.00 9.21 C ATOM 1813 CD2 TRP A 141 96.723 64.870 -9.787 1.00 8.47 C ATOM 1814 NE1 TRP A 141 98.503 63.943 -8.784 1.00 8.72 N ATOM 1815 CE2 TRP A 141 97.136 64.022 -8.729 1.00 8.65 C ATOM 1816 CE3 TRP A 141 95.348 65.118 -9.961 1.00 8.36 C ATOM 1817 CZ2 TRP A 141 96.224 63.419 -7.843 1.00 8.82 C ATOM 1818 CZ3 TRP A 141 94.434 64.514 -9.081 1.00 8.82 C ATOM 1819 CH2 TRP A 141 94.882 63.672 -8.035 1.00 8.97 C ATOM 1820 HA TRP A 141 99.219 67.721 -10.757 1.00 0.00 H ATOM 1821 HB2 TRP A 141 97.004 66.184 -12.190 1.00 0.00 H ATOM 1822 HB3 TRP A 141 98.729 65.789 -12.379 1.00 0.00 H ATOM 1823 HE1 TRP A 141 99.101 63.392 -8.135 1.00 0.00 H ATOM 1824 HD1 TRP A 141 100.007 64.826 -10.107 1.00 0.00 H ATOM 1825 HZ2 TRP A 141 96.566 62.775 -7.033 1.00 0.00 H ATOM 1826 HH2 TRP A 141 94.152 63.214 -7.368 1.00 0.00 H ATOM 1827 HZ3 TRP A 141 93.367 64.696 -9.205 1.00 0.00 H ATOM 1828 HE3 TRP A 141 94.999 65.767 -10.764 1.00 0.00 H ATOM 1829 H TRP A 141 96.299 68.276 -11.056 1.00 0.00 H ATOM 1830 N GLY A 142 98.479 69.678 -12.826 1.00 10.20 N ATOM 1831 CA GLY A 142 98.803 70.418 -14.040 1.00 12.09 C ATOM 1832 C GLY A 142 100.249 70.896 -14.129 1.00 13.38 C ATOM 1833 O GLY A 142 101.076 70.591 -13.263 1.00 12.46 O ATOM 1834 HA3 GLY A 142 98.153 71.291 -14.089 1.00 0.00 H ATOM 1835 HA2 GLY A 142 98.606 69.771 -14.895 1.00 0.00 H ATOM 1836 H GLY A 142 98.051 70.175 -12.019 1.00 0.00 H ATOM 1837 N ASN A 143 100.521 71.703 -15.154 1.00 15.31 N ATOM 1838 CA ASN A 143 101.842 72.279 -15.423 1.00 18.12 C ATOM 1839 C ASN A 143 102.470 73.000 -14.233 1.00 18.03 C ATOM 1840 O ASN A 143 101.787 73.769 -13.552 1.00 15.98 O ATOM 1841 CB ASN A 143 101.720 73.285 -16.557 1.00 22.55 C ATOM 1842 CG ASN A 143 102.709 73.037 -17.647 1.00 27.09 C ATOM 1843 OD1 ASN A 143 102.346 72.524 -18.706 1.00 32.08 O ATOM 1844 ND2 ASN A 143 103.977 73.386 -17.405 1.00 28.89 N ATOM 1845 HA ASN A 143 102.489 71.437 -15.670 1.00 0.00 H ATOM 1846 HB2 ASN A 143 100.715 73.222 -16.975 1.00 0.00 H ATOM 1847 HB3 ASN A 143 101.883 74.286 -16.157 1.00 0.00 H ATOM 1848 HD22 ASN A 143 104.233 73.816 -16.494 1.00 0.00 H ATOM 1849 HD21 ASN A 143 104.707 73.227 -18.128 1.00 0.00 H ATOM 1850 H ASN A 143 99.746 71.940 -15.806 1.00 0.00 H ATOM 1851 N THR A 144 103.766 72.772 -13.993 1.00 18.80 N ATOM 1852 CA THR A 144 104.467 73.428 -12.879 1.00 19.98 C ATOM 1853 C THR A 144 105.508 74.459 -13.336 1.00 22.22 C ATOM 1854 O THR A 144 105.966 75.274 -12.537 1.00 20.52 O ATOM 1855 CB THR A 144 105.194 72.408 -11.943 1.00 20.30 C ATOM 1856 OG1 THR A 144 106.326 71.841 -12.623 1.00 19.61 O ATOM 1857 CG2 THR A 144 104.249 71.287 -11.513 1.00 17.99 C ATOM 1858 HA THR A 144 103.672 73.937 -12.334 1.00 0.00 H ATOM 1859 HB THR A 144 105.527 72.943 -11.054 1.00 0.00 H ATOM 1860 HG1 THR A 144 106.781 71.197 -12.024 1.00 0.00 H ATOM 1861 HG23 THR A 144 103.390 71.716 -10.997 1.00 0.00 H ATOM 1862 HG21 THR A 144 103.910 70.741 -12.394 1.00 0.00 H ATOM 1863 HG22 THR A 144 104.775 70.607 -10.843 1.00 0.00 H ATOM 1864 H THR A 144 104.289 72.116 -14.608 1.00 0.00 H ATOM 1865 N MET A 145 105.894 74.404 -14.611 1.00 25.00 N ATOM 1866 CA MET A 145 106.904 75.314 -15.158 1.00 28.92 C ATOM 1867 C MET A 145 108.158 75.352 -14.259 1.00 30.20 C ATOM 1868 O MET A 145 108.761 76.410 -14.062 1.00 30.34 O ATOM 1869 CB MET A 145 106.328 76.732 -15.335 1.00 31.35 C ATOM 1870 CG MET A 145 105.215 76.855 -16.378 1.00 34.11 C ATOM 1871 SD MET A 145 104.676 78.578 -16.679 1.00 38.69 S ATOM 1872 CE MET A 145 105.691 79.003 -18.088 1.00 37.59 C ATOM 1873 HA MET A 145 107.196 74.936 -16.138 1.00 0.00 H ATOM 1874 HB2 MET A 145 105.928 77.057 -14.374 1.00 0.00 H ATOM 1875 HB3 MET A 145 107.143 77.393 -15.630 1.00 0.00 H ATOM 1876 HG2 MET A 145 104.355 76.280 -16.034 1.00 0.00 H ATOM 1877 HG3 MET A 145 105.576 76.438 -17.318 1.00 0.00 H ATOM 1878 HE1 MET A 145 106.743 78.915 -17.816 1.00 0.00 H ATOM 1879 HE2 MET A 145 105.469 78.325 -18.912 1.00 0.00 H ATOM 1880 HE3 MET A 145 105.478 80.028 -18.392 1.00 0.00 H ATOM 1881 H MET A 145 105.465 73.693 -15.237 1.00 0.00 H ATOM 1882 N SER A 146 108.546 74.190 -13.728 1.00 31.82 N ATOM 1883 CA SER A 146 109.706 74.073 -12.836 1.00 33.06 C ATOM 1884 C SER A 146 110.562 72.848 -13.176 1.00 34.29 C ATOM 1885 O SER A 146 110.039 71.798 -13.559 1.00 33.79 O ATOM 1886 CB SER A 146 109.235 73.979 -11.379 1.00 32.38 C ATOM 1887 OG SER A 146 110.299 73.669 -10.491 1.00 33.02 O ATOM 1888 HA SER A 146 110.320 74.963 -12.973 1.00 0.00 H ATOM 1889 HB2 SER A 146 108.477 73.200 -11.304 1.00 0.00 H ATOM 1890 HB3 SER A 146 108.801 74.936 -11.087 1.00 0.00 H ATOM 1891 HG SER A 146 109.951 73.618 -9.566 1.00 0.00 H ATOM 1892 H SER A 146 108.004 73.332 -13.956 1.00 0.00 H ATOM 1893 N SER A 147 111.875 72.983 -12.999 1.00 35.36 N ATOM 1894 CA SER A 147 112.812 71.894 -13.278 1.00 37.38 C ATOM 1895 C SER A 147 112.968 70.916 -12.108 1.00 38.05 C ATOM 1896 O SER A 147 113.643 69.889 -12.236 1.00 38.82 O ATOM 1897 CB SER A 147 114.185 72.461 -13.658 1.00 37.87 C ATOM 1898 OG SER A 147 114.663 73.343 -12.653 1.00 38.74 O ATOM 1899 HA SER A 147 112.391 71.332 -14.112 1.00 0.00 H ATOM 1900 HB2 SER A 147 114.099 73.004 -14.599 1.00 0.00 H ATOM 1901 HB3 SER A 147 114.891 71.639 -13.777 1.00 0.00 H ATOM 1902 HG SER A 147 115.549 73.696 -12.919 1.00 0.00 H ATOM 1903 H SER A 147 112.246 73.890 -12.652 1.00 0.00 H ATOM 1904 N THR A 148 112.348 71.243 -10.975 1.00 38.54 N ATOM 1905 CA THR A 148 112.427 70.406 -9.783 1.00 38.25 C ATOM 1906 C THR A 148 111.076 69.861 -9.291 1.00 37.93 C ATOM 1907 O THR A 148 111.041 68.872 -8.560 1.00 38.82 O ATOM 1908 CB THR A 148 113.109 71.176 -8.628 1.00 38.30 C ATOM 1909 OG1 THR A 148 114.228 71.913 -9.139 1.00 38.56 O ATOM 1910 CG2 THR A 148 113.603 70.213 -7.557 1.00 38.42 C ATOM 1911 HA THR A 148 113.020 69.542 -10.084 1.00 0.00 H ATOM 1912 HB THR A 148 112.378 71.855 -8.188 1.00 0.00 H ATOM 1913 HG1 THR A 148 114.663 72.405 -8.399 1.00 0.00 H ATOM 1914 HG23 THR A 148 112.759 69.647 -7.162 1.00 0.00 H ATOM 1915 HG21 THR A 148 114.329 69.527 -7.994 1.00 0.00 H ATOM 1916 HG22 THR A 148 114.073 70.777 -6.752 1.00 0.00 H ATOM 1917 H THR A 148 111.791 72.121 -10.939 1.00 0.00 H ATOM 1918 N ALA A 149 109.971 70.490 -9.693 1.00 36.36 N ATOM 1919 CA ALA A 149 108.637 70.055 -9.264 1.00 34.09 C ATOM 1920 C ALA A 149 108.004 69.058 -10.236 1.00 32.57 C ATOM 1921 O ALA A 149 107.778 69.373 -11.401 1.00 32.93 O ATOM 1922 CB ALA A 149 107.727 71.262 -9.073 1.00 33.70 C ATOM 1923 HA ALA A 149 108.758 69.537 -8.313 1.00 0.00 H ATOM 1924 HB1 ALA A 149 108.151 71.918 -8.313 1.00 0.00 H ATOM 1925 HB2 ALA A 149 107.641 71.803 -10.015 1.00 0.00 H ATOM 1926 HB3 ALA A 149 106.741 70.925 -8.755 1.00 0.00 H ATOM 1927 H ALA A 149 110.057 71.310 -10.327 1.00 0.00 H ATOM 1928 N ASP A 150 107.667 67.881 -9.718 1.00 30.62 N ATOM 1929 CA ASP A 150 107.071 66.777 -10.483 1.00 28.62 C ATOM 1930 C ASP A 150 105.532 66.848 -10.513 1.00 26.17 C ATOM 1931 O ASP A 150 104.878 66.556 -9.511 1.00 24.49 O ATOM 1932 CB ASP A 150 107.527 65.453 -9.835 1.00 30.49 C ATOM 1933 CG ASP A 150 107.181 64.214 -10.659 1.00 32.66 C ATOM 1934 OD1 ASP A 150 106.473 64.310 -11.690 1.00 34.51 O ATOM 1935 OD2 ASP A 150 107.637 63.120 -10.254 1.00 33.88 O ATOM 1936 HA ASP A 150 107.405 66.845 -11.518 1.00 0.00 H ATOM 1937 HB2 ASP A 150 108.609 65.488 -9.704 1.00 0.00 H ATOM 1938 HB3 ASP A 150 107.047 65.363 -8.860 1.00 0.00 H ATOM 1939 H ASP A 150 107.837 67.731 -8.703 1.00 0.00 H ATOM 1940 N SER A 152 104.960 67.161 -11.676 1.00 23.53 N ATOM 1941 CA SER A 152 103.502 67.266 -11.820 1.00 21.62 C ATOM 1942 C SER A 152 102.740 65.948 -11.637 1.00 20.08 C ATOM 1943 O SER A 152 101.509 65.952 -11.577 1.00 20.02 O ATOM 1944 CB SER A 152 103.132 67.902 -13.166 1.00 22.18 C ATOM 1945 OG SER A 152 103.484 67.069 -14.268 1.00 22.95 O ATOM 1946 HA SER A 152 103.185 67.909 -10.999 1.00 0.00 H ATOM 1947 HB2 SER A 152 103.657 68.853 -13.262 1.00 0.00 H ATOM 1948 HB3 SER A 152 102.057 68.078 -13.188 1.00 0.00 H ATOM 1949 HG SER A 152 103.006 66.205 -14.193 1.00 0.00 H ATOM 1950 H SER A 152 105.563 67.336 -12.505 1.00 0.00 H ATOM 1951 N ASN A 153 103.457 64.824 -11.579 1.00 18.27 N ATOM 1952 CA ASN A 153 102.818 63.513 -11.372 1.00 16.71 C ATOM 1953 C ASN A 153 102.397 63.336 -9.906 1.00 14.27 C ATOM 1954 O ASN A 153 101.584 62.456 -9.579 1.00 12.33 O ATOM 1955 CB ASN A 153 103.755 62.363 -11.770 1.00 19.99 C ATOM 1956 CG ASN A 153 103.999 62.298 -13.260 1.00 22.85 C ATOM 1957 OD1 ASN A 153 103.074 62.445 -14.064 1.00 24.83 O ATOM 1958 ND2 ASN A 153 105.250 62.079 -13.642 1.00 26.02 N ATOM 1959 HA ASN A 153 101.934 63.483 -12.009 1.00 0.00 H ATOM 1960 HB2 ASN A 153 104.711 62.502 -11.266 1.00 0.00 H ATOM 1961 HB3 ASN A 153 103.309 61.422 -11.448 1.00 0.00 H ATOM 1962 HD22 ASN A 153 105.998 61.961 -12.929 1.00 0.00 H ATOM 1963 HD21 ASN A 153 105.483 62.025 -14.654 1.00 0.00 H ATOM 1964 H ASN A 153 104.491 64.875 -11.682 1.00 0.00 H ATOM 1965 N LYS A 154 102.996 64.144 -9.032 1.00 12.32 N ATOM 1966 CA LYS A 154 102.701 64.139 -7.602 1.00 12.28 C ATOM 1967 C LYS A 154 101.842 65.382 -7.310 1.00 11.18 C ATOM 1968 O LYS A 154 102.190 66.492 -7.736 1.00 11.55 O ATOM 1969 CB LYS A 154 104.001 64.194 -6.796 1.00 13.15 C ATOM 1970 CG LYS A 154 104.923 63.009 -7.059 1.00 17.33 C ATOM 1971 CD LYS A 154 106.259 63.193 -6.370 1.00 21.80 C ATOM 1972 CE LYS A 154 107.183 62.012 -6.628 1.00 24.45 C ATOM 1973 NZ LYS A 154 108.484 62.157 -5.903 1.00 27.99 N ATOM 1974 HA LYS A 154 102.171 63.229 -7.320 1.00 0.00 H ATOM 1975 HB2 LYS A 154 104.531 65.110 -7.056 1.00 0.00 H ATOM 1976 HB3 LYS A 154 103.751 64.209 -5.735 1.00 0.00 H ATOM 1977 HG2 LYS A 154 104.451 62.101 -6.684 1.00 0.00 H ATOM 1978 HG3 LYS A 154 105.086 62.916 -8.133 1.00 0.00 H ATOM 1979 HD2 LYS A 154 106.730 64.101 -6.746 1.00 0.00 H ATOM 1980 HD3 LYS A 154 106.095 63.288 -5.297 1.00 0.00 H ATOM 1981 HE2 LYS A 154 107.380 61.945 -7.698 1.00 0.00 H ATOM 1982 HE3 LYS A 154 106.691 61.099 -6.292 1.00 0.00 H ATOM 1983 HZ1 LYS A 154 108.963 63.023 -6.222 1.00 0.00 H ATOM 1984 HZ2 LYS A 154 108.305 62.215 -4.880 1.00 0.00 H ATOM 1985 HZ3 LYS A 154 109.085 61.333 -6.104 1.00 0.00 H ATOM 1986 H LYS A 154 103.710 64.812 -9.386 1.00 0.00 H ATOM 1987 N LEU A 155 100.731 65.192 -6.599 1.00 9.75 N ATOM 1988 CA LEU A 155 99.813 66.298 -6.290 1.00 9.30 C ATOM 1989 C LEU A 155 100.496 67.527 -5.656 1.00 9.95 C ATOM 1990 O LEU A 155 101.175 67.418 -4.627 1.00 9.75 O ATOM 1991 CB LEU A 155 98.645 65.815 -5.412 1.00 9.78 C ATOM 1992 CG LEU A 155 97.460 66.784 -5.227 1.00 8.55 C ATOM 1993 CD1 LEU A 155 96.701 66.978 -6.540 1.00 7.92 C ATOM 1994 CD2 LEU A 155 96.527 66.267 -4.151 1.00 10.17 C ATOM 1995 HA LEU A 155 99.428 66.634 -7.253 1.00 0.00 H ATOM 1996 HB2 LEU A 155 98.255 64.900 -5.858 1.00 0.00 H ATOM 1997 HB3 LEU A 155 99.046 65.594 -4.423 1.00 0.00 H ATOM 1998 HG LEU A 155 97.855 67.752 -4.919 1.00 0.00 H ATOM 1999 HD21 LEU A 155 96.147 65.288 -4.441 1.00 0.00 H ATOM 2000 HD22 LEU A 155 97.071 66.183 -3.210 1.00 0.00 H ATOM 2001 HD23 LEU A 155 95.695 66.960 -4.030 1.00 0.00 H ATOM 2002 HD11 LEU A 155 97.376 67.389 -7.291 1.00 0.00 H ATOM 2003 HD12 LEU A 155 96.317 66.017 -6.882 1.00 0.00 H ATOM 2004 HD13 LEU A 155 95.871 67.666 -6.380 1.00 0.00 H ATOM 2005 H LEU A 155 100.508 64.237 -6.254 1.00 0.00 H ATOM 2006 N GLN A 156 100.294 68.688 -6.287 1.00 9.92 N ATOM 2007 CA GLN A 156 100.866 69.969 -5.842 1.00 9.66 C ATOM 2008 C GLN A 156 99.801 70.845 -5.137 1.00 10.29 C ATOM 2009 O GLN A 156 98.610 70.805 -5.499 1.00 9.86 O ATOM 2010 CB GLN A 156 101.449 70.720 -7.055 1.00 10.06 C ATOM 2011 CG GLN A 156 102.512 69.941 -7.868 1.00 11.86 C ATOM 2012 CD GLN A 156 103.855 69.815 -7.151 1.00 14.21 C ATOM 2013 OE1 GLN A 156 104.447 70.817 -6.731 1.00 14.52 O ATOM 2014 NE2 GLN A 156 104.348 68.587 -7.023 1.00 13.24 N ATOM 2015 HA GLN A 156 101.658 69.762 -5.122 1.00 0.00 H ATOM 2016 HB2 GLN A 156 100.626 70.967 -7.726 1.00 0.00 H ATOM 2017 HB3 GLN A 156 101.909 71.639 -6.693 1.00 0.00 H ATOM 2018 HG2 GLN A 156 102.130 68.939 -8.065 1.00 0.00 H ATOM 2019 HG3 GLN A 156 102.672 70.460 -8.813 1.00 0.00 H ATOM 2020 HE22 GLN A 156 103.816 67.772 -7.391 1.00 0.00 H ATOM 2021 HE21 GLN A 156 105.265 68.441 -6.555 1.00 0.00 H ATOM 2022 H GLN A 156 99.699 68.686 -7.140 1.00 0.00 H ATOM 2023 N CYS A 157 100.241 71.647 -4.165 1.00 9.51 N ATOM 2024 CA CYS A 157 99.370 72.533 -3.385 1.00 10.29 C ATOM 2025 C CYS A 157 99.894 73.980 -3.427 1.00 11.24 C ATOM 2026 O CYS A 157 101.095 74.200 -3.612 1.00 11.24 O ATOM 2027 CB CYS A 157 99.335 72.059 -1.919 1.00 11.10 C ATOM 2028 SG CYS A 157 98.152 70.720 -1.498 1.00 11.65 S ATOM 2029 HA CYS A 157 98.369 72.502 -3.816 1.00 0.00 H ATOM 2030 HB2 CYS A 157 99.087 72.922 -1.301 1.00 0.00 H ATOM 2031 HB3 CYS A 157 100.334 71.706 -1.664 1.00 0.00 H ATOM 2032 H CYS A 157 101.258 71.644 -3.949 1.00 0.00 H ATOM 2033 N LEU A 158 99.001 74.956 -3.245 1.00 10.78 N ATOM 2034 CA LEU A 158 99.380 76.381 -3.252 1.00 11.15 C ATOM 2035 C LEU A 158 98.346 77.222 -2.480 1.00 11.09 C ATOM 2036 O LEU A 158 97.141 76.977 -2.582 1.00 10.20 O ATOM 2037 CB LEU A 158 99.499 76.897 -4.704 1.00 11.58 C ATOM 2038 CG LEU A 158 99.759 78.402 -4.960 1.00 12.71 C ATOM 2039 CD1 LEU A 158 101.193 78.800 -4.615 1.00 12.91 C ATOM 2040 CD2 LEU A 158 99.455 78.746 -6.415 1.00 13.33 C ATOM 2041 HA LEU A 158 100.347 76.479 -2.759 1.00 0.00 H ATOM 2042 HB2 LEU A 158 100.319 76.350 -5.169 1.00 0.00 H ATOM 2043 HB3 LEU A 158 98.565 76.646 -5.207 1.00 0.00 H ATOM 2044 HG LEU A 158 99.095 78.967 -4.306 1.00 0.00 H ATOM 2045 HD21 LEU A 158 100.097 78.155 -7.068 1.00 0.00 H ATOM 2046 HD22 LEU A 158 98.410 78.521 -6.630 1.00 0.00 H ATOM 2047 HD23 LEU A 158 99.642 79.807 -6.583 1.00 0.00 H ATOM 2048 HD11 LEU A 158 101.382 78.595 -3.561 1.00 0.00 H ATOM 2049 HD12 LEU A 158 101.886 78.224 -5.228 1.00 0.00 H ATOM 2050 HD13 LEU A 158 101.330 79.864 -4.810 1.00 0.00 H ATOM 2051 H LEU A 158 98.004 74.702 -3.093 1.00 0.00 H ATOM 2052 N ASN A 159 98.815 78.189 -1.688 1.00 12.08 N ATOM 2053 CA ASN A 159 97.903 79.061 -0.934 1.00 12.82 C ATOM 2054 C ASN A 159 97.755 80.385 -1.681 1.00 12.40 C ATOM 2055 O ASN A 159 98.763 81.003 -2.045 1.00 12.71 O ATOM 2056 CB ASN A 159 98.422 79.301 0.490 1.00 16.39 C ATOM 2057 CG ASN A 159 98.519 78.017 1.294 1.00 20.44 C ATOM 2058 OD1 ASN A 159 97.515 77.333 1.535 1.00 22.83 O ATOM 2059 ND2 ASN A 159 99.737 77.662 1.685 1.00 23.44 N ATOM 2060 HA ASN A 159 96.931 78.576 -0.850 1.00 0.00 H ATOM 2061 HB2 ASN A 159 99.412 79.753 0.431 1.00 0.00 H ATOM 2062 HB3 ASN A 159 97.742 79.984 1.000 1.00 0.00 H ATOM 2063 HD22 ASN A 159 100.552 78.267 1.460 1.00 0.00 H ATOM 2064 HD21 ASN A 159 99.876 76.779 2.216 1.00 0.00 H ATOM 2065 H ASN A 159 99.842 78.328 -1.603 1.00 0.00 H ATOM 2066 N ILE A 160 96.512 80.793 -1.941 1.00 11.19 N ATOM 2067 CA ILE A 160 96.211 82.030 -2.681 1.00 11.39 C ATOM 2068 C ILE A 160 95.077 82.840 -2.025 1.00 11.37 C ATOM 2069 O ILE A 160 94.151 82.267 -1.437 1.00 11.17 O ATOM 2070 CB ILE A 160 95.759 81.730 -4.158 1.00 12.47 C ATOM 2071 CG1 ILE A 160 94.598 80.722 -4.177 1.00 12.98 C ATOM 2072 CG2 ILE A 160 96.938 81.257 -5.015 1.00 12.27 C ATOM 2073 CD1 ILE A 160 94.043 80.417 -5.568 1.00 14.82 C ATOM 2074 HA ILE A 160 97.139 82.602 -2.669 1.00 0.00 H ATOM 2075 HB ILE A 160 95.397 82.659 -4.599 1.00 0.00 H ATOM 2076 HG12 ILE A 160 94.951 79.788 -3.739 1.00 0.00 H ATOM 2077 HG13 ILE A 160 93.788 81.124 -3.568 1.00 0.00 H ATOM 2078 HD11 ILE A 160 93.671 81.337 -6.019 1.00 0.00 H ATOM 2079 HD12 ILE A 160 94.835 80.000 -6.190 1.00 0.00 H ATOM 2080 HD13 ILE A 160 93.229 79.697 -5.483 1.00 0.00 H ATOM 2081 HG21 ILE A 160 97.704 82.032 -5.036 1.00 0.00 H ATOM 2082 HG22 ILE A 160 97.354 80.345 -4.587 1.00 0.00 H ATOM 2083 HG23 ILE A 160 96.592 81.058 -6.029 1.00 0.00 H ATOM 2084 H ILE A 160 95.719 80.210 -1.605 1.00 0.00 H ATOM 2085 N PRO A 161 95.172 84.185 -2.062 1.00 10.99 N ATOM 2086 CA PRO A 161 94.137 85.053 -1.474 1.00 10.50 C ATOM 2087 C PRO A 161 93.090 85.506 -2.507 1.00 9.20 C ATOM 2088 O PRO A 161 93.407 85.672 -3.688 1.00 9.24 O ATOM 2089 CB PRO A 161 94.954 86.250 -0.970 1.00 11.86 C ATOM 2090 CG PRO A 161 96.013 86.401 -2.029 1.00 11.01 C ATOM 2091 CD PRO A 161 96.410 84.946 -2.339 1.00 10.35 C ATOM 2092 HA PRO A 161 93.559 84.547 -0.701 1.00 0.00 H ATOM 2093 HD3 PRO A 161 96.710 84.837 -3.381 1.00 0.00 H ATOM 2094 HD2 PRO A 161 97.223 84.617 -1.692 1.00 0.00 H ATOM 2095 HG3 PRO A 161 96.865 86.967 -1.653 1.00 0.00 H ATOM 2096 HG2 PRO A 161 95.613 86.895 -2.915 1.00 0.00 H ATOM 2097 HB2 PRO A 161 94.337 87.146 -0.901 1.00 0.00 H ATOM 2098 HB3 PRO A 161 95.398 86.041 0.003 1.00 0.00 H ATOM 2099 N ILE A 162 91.842 85.672 -2.075 1.00 9.58 N ATOM 2100 CA ILE A 162 90.783 86.149 -2.973 1.00 10.06 C ATOM 2101 C ILE A 162 90.963 87.669 -3.192 1.00 9.72 C ATOM 2102 O ILE A 162 91.186 88.412 -2.228 1.00 10.52 O ATOM 2103 CB ILE A 162 89.372 85.880 -2.385 1.00 10.85 C ATOM 2104 CG1 ILE A 162 89.136 84.365 -2.243 1.00 12.14 C ATOM 2105 CG2 ILE A 162 88.296 86.526 -3.273 1.00 10.71 C ATOM 2106 CD1 ILE A 162 87.796 83.998 -1.613 1.00 12.81 C ATOM 2107 HA ILE A 162 90.862 85.610 -3.917 1.00 0.00 H ATOM 2108 HB ILE A 162 89.308 86.328 -1.393 1.00 0.00 H ATOM 2109 HG12 ILE A 162 89.182 83.917 -3.236 1.00 0.00 H ATOM 2110 HG13 ILE A 162 89.931 83.951 -1.622 1.00 0.00 H ATOM 2111 HD11 ILE A 162 87.737 84.427 -0.613 1.00 0.00 H ATOM 2112 HD12 ILE A 162 86.987 84.392 -2.228 1.00 0.00 H ATOM 2113 HD13 ILE A 162 87.711 82.913 -1.550 1.00 0.00 H ATOM 2114 HG21 ILE A 162 88.464 87.602 -3.321 1.00 0.00 H ATOM 2115 HG22 ILE A 162 88.352 86.103 -4.276 1.00 0.00 H ATOM 2116 HG23 ILE A 162 87.311 86.330 -2.849 1.00 0.00 H ATOM 2117 H ILE A 162 91.613 85.460 -1.083 1.00 0.00 H ATOM 2118 N LEU A 163 90.886 88.116 -4.445 1.00 9.29 N ATOM 2119 CA LEU A 163 91.049 89.542 -4.784 1.00 10.55 C ATOM 2120 C LEU A 163 89.699 90.278 -4.838 1.00 10.83 C ATOM 2121 O LEU A 163 88.648 89.651 -4.982 1.00 11.17 O ATOM 2122 CB LEU A 163 91.785 89.682 -6.135 1.00 11.75 C ATOM 2123 CG LEU A 163 93.181 89.042 -6.255 1.00 12.92 C ATOM 2124 CD1 LEU A 163 93.727 89.162 -7.672 1.00 14.18 C ATOM 2125 CD2 LEU A 163 94.142 89.702 -5.278 1.00 15.34 C ATOM 2126 HA LEU A 163 91.643 90.004 -3.995 1.00 0.00 H ATOM 2127 HB2 LEU A 163 91.152 89.232 -6.900 1.00 0.00 H ATOM 2128 HB3 LEU A 163 91.896 90.747 -6.338 1.00 0.00 H ATOM 2129 HG LEU A 163 93.085 87.983 -6.015 1.00 0.00 H ATOM 2130 HD21 LEU A 163 94.214 90.766 -5.504 1.00 0.00 H ATOM 2131 HD22 LEU A 163 93.772 89.569 -4.261 1.00 0.00 H ATOM 2132 HD23 LEU A 163 95.126 89.242 -5.371 1.00 0.00 H ATOM 2133 HD11 LEU A 163 93.053 88.656 -8.364 1.00 0.00 H ATOM 2134 HD12 LEU A 163 93.804 90.215 -7.942 1.00 0.00 H ATOM 2135 HD13 LEU A 163 94.713 88.700 -7.720 1.00 0.00 H ATOM 2136 H LEU A 163 90.705 87.436 -5.210 1.00 0.00 H ATOM 2137 N SER A 164 89.725 91.609 -4.735 1.00 11.27 N ATOM 2138 CA SER A 164 88.491 92.405 -4.793 1.00 10.24 C ATOM 2139 C SER A 164 87.915 92.424 -6.211 1.00 9.89 C ATOM 2140 O SER A 164 88.643 92.204 -7.187 1.00 9.36 O ATOM 2141 CB SER A 164 88.770 93.855 -4.356 1.00 11.10 C ATOM 2142 OG SER A 164 89.631 94.524 -5.277 1.00 12.60 O ATOM 2143 HA SER A 164 87.770 91.944 -4.118 1.00 0.00 H ATOM 2144 HB2 SER A 164 89.242 93.844 -3.374 1.00 0.00 H ATOM 2145 HB3 SER A 164 87.825 94.395 -4.298 1.00 0.00 H ATOM 2146 HG SER A 164 90.494 94.041 -5.331 1.00 0.00 H ATOM 2147 H SER A 164 90.637 92.092 -4.611 1.00 0.00 H ATOM 2148 N TYR A 165 86.615 92.699 -6.326 1.00 10.59 N ATOM 2149 CA TYR A 165 85.951 92.800 -7.638 1.00 12.01 C ATOM 2150 C TYR A 165 86.640 93.860 -8.518 1.00 11.39 C ATOM 2151 O TYR A 165 86.881 93.627 -9.702 1.00 11.66 O ATOM 2152 CB TYR A 165 84.463 93.180 -7.478 1.00 13.52 C ATOM 2153 CG TYR A 165 83.752 93.452 -8.798 1.00 15.50 C ATOM 2154 CD1 TYR A 165 83.407 92.400 -9.656 1.00 17.42 C ATOM 2155 CD2 TYR A 165 83.462 94.761 -9.210 1.00 15.67 C ATOM 2156 CE1 TYR A 165 82.793 92.640 -10.893 1.00 18.59 C ATOM 2157 CE2 TYR A 165 82.850 95.013 -10.448 1.00 16.99 C ATOM 2158 CZ TYR A 165 82.521 93.944 -11.283 1.00 18.75 C ATOM 2159 OH TYR A 165 81.938 94.164 -12.514 1.00 20.52 O ATOM 2160 HA TYR A 165 86.025 91.823 -8.115 1.00 0.00 H ATOM 2161 HB3 TYR A 165 84.402 94.078 -6.863 1.00 0.00 H ATOM 2162 HB2 TYR A 165 83.951 92.360 -6.974 1.00 0.00 H ATOM 2163 HD2 TYR A 165 83.716 95.597 -8.558 1.00 0.00 H ATOM 2164 HE2 TYR A 165 82.633 96.036 -10.755 1.00 0.00 H ATOM 2165 HE1 TYR A 165 82.531 91.807 -11.545 1.00 0.00 H ATOM 2166 HD1 TYR A 165 83.620 91.374 -9.356 1.00 0.00 H ATOM 2167 HH TYR A 165 82.542 94.717 -13.070 1.00 0.00 H ATOM 2168 H TYR A 165 86.053 92.847 -5.464 1.00 0.00 H ATOM 2169 N SER A 166 86.934 95.019 -7.936 1.00 11.03 N ATOM 2170 CA SER A 166 87.592 96.117 -8.650 1.00 11.22 C ATOM 2171 C SER A 166 88.919 95.702 -9.308 1.00 10.42 C ATOM 2172 O SER A 166 89.146 95.984 -10.491 1.00 10.73 O ATOM 2173 CB SER A 166 87.827 97.294 -7.703 1.00 11.90 C ATOM 2174 OG SER A 166 86.602 97.755 -7.159 1.00 14.42 O ATOM 2175 HA SER A 166 86.919 96.412 -9.455 1.00 0.00 H ATOM 2176 HB2 SER A 166 88.302 98.106 -8.253 1.00 0.00 H ATOM 2177 HB3 SER A 166 88.481 96.975 -6.892 1.00 0.00 H ATOM 2178 HG SER A 166 86.169 97.021 -6.655 1.00 0.00 H ATOM 2179 H SER A 166 86.687 95.152 -6.934 1.00 0.00 H ATOM 2180 N ASP A 167 89.785 95.013 -8.562 1.00 9.79 N ATOM 2181 CA ASP A 167 91.069 94.578 -9.117 1.00 10.24 C ATOM 2182 C ASP A 167 90.878 93.499 -10.200 1.00 9.78 C ATOM 2183 O ASP A 167 91.623 93.457 -11.190 1.00 9.35 O ATOM 2184 CB ASP A 167 92.011 94.066 -8.009 1.00 11.26 C ATOM 2185 CG ASP A 167 92.787 95.194 -7.306 1.00 14.35 C ATOM 2186 OD1 ASP A 167 92.968 96.290 -7.882 1.00 15.20 O ATOM 2187 OD2 ASP A 167 93.256 94.960 -6.177 1.00 14.96 O ATOM 2188 HA ASP A 167 91.530 95.448 -9.584 1.00 0.00 H ATOM 2189 HB2 ASP A 167 91.416 93.538 -7.264 1.00 0.00 H ATOM 2190 HB3 ASP A 167 92.728 93.377 -8.454 1.00 0.00 H ATOM 2191 H ASP A 167 89.546 94.783 -7.576 1.00 0.00 H ATOM 2192 N CYS A 168 89.871 92.641 -10.014 1.00 9.04 N ATOM 2193 CA CYS A 168 89.574 91.569 -10.973 1.00 9.59 C ATOM 2194 C CYS A 168 89.059 92.174 -12.304 1.00 9.66 C ATOM 2195 O CYS A 168 89.577 91.860 -13.393 1.00 9.42 O ATOM 2196 CB CYS A 168 88.565 90.585 -10.348 1.00 9.00 C ATOM 2197 SG CYS A 168 88.244 89.009 -11.242 1.00 10.82 S ATOM 2198 HA CYS A 168 90.482 91.011 -11.204 1.00 0.00 H ATOM 2199 HB2 CYS A 168 87.613 91.108 -10.257 1.00 0.00 H ATOM 2200 HB3 CYS A 168 88.933 90.327 -9.355 1.00 0.00 H ATOM 2201 H CYS A 168 89.279 92.735 -9.164 1.00 0.00 H ATOM 2202 N ASN A 169 88.085 93.078 -12.219 1.00 10.04 N ATOM 2203 CA ASN A 169 87.546 93.728 -13.417 1.00 10.17 C ATOM 2204 C ASN A 169 88.608 94.601 -14.108 1.00 10.02 C ATOM 2205 O ASN A 169 88.641 94.686 -15.338 1.00 10.16 O ATOM 2206 CB ASN A 169 86.302 94.557 -13.075 1.00 11.48 C ATOM 2207 CG ASN A 169 85.761 95.346 -14.278 1.00 16.40 C ATOM 2208 OD1 ASN A 169 85.867 96.579 -14.324 1.00 20.36 O ATOM 2209 ND2 ASN A 169 85.171 94.645 -15.245 1.00 14.65 N ATOM 2210 HA ASN A 169 87.255 92.943 -14.115 1.00 0.00 H ATOM 2211 HB2 ASN A 169 85.521 93.884 -12.721 1.00 0.00 H ATOM 2212 HB3 ASN A 169 86.559 95.261 -12.284 1.00 0.00 H ATOM 2213 HD22 ASN A 169 85.102 93.610 -15.169 1.00 0.00 H ATOM 2214 HD21 ASN A 169 84.779 95.133 -16.076 1.00 0.00 H ATOM 2215 H ASN A 169 87.700 93.327 -11.286 1.00 0.00 H ATOM 2216 N ASN A 170 89.503 95.214 -13.331 1.00 9.47 N ATOM 2217 CA ASN A 170 90.553 96.054 -13.918 1.00 10.20 C ATOM 2218 C ASN A 170 91.516 95.244 -14.790 1.00 9.52 C ATOM 2219 O ASN A 170 92.025 95.746 -15.793 1.00 9.22 O ATOM 2220 CB ASN A 170 91.342 96.814 -12.832 1.00 10.85 C ATOM 2221 CG ASN A 170 92.376 97.781 -13.420 1.00 10.80 C ATOM 2222 OD1 ASN A 170 93.586 97.603 -13.252 1.00 12.47 O ATOM 2223 ND2 ASN A 170 91.902 98.798 -14.120 1.00 9.57 N ATOM 2224 HA ASN A 170 90.047 96.779 -14.555 1.00 0.00 H ATOM 2225 HB2 ASN A 170 90.639 97.383 -12.223 1.00 0.00 H ATOM 2226 HB3 ASN A 170 91.860 96.088 -12.205 1.00 0.00 H ATOM 2227 HD22 ASN A 170 90.875 98.914 -14.239 1.00 0.00 H ATOM 2228 HD21 ASN A 170 92.556 99.482 -14.552 1.00 0.00 H ATOM 2229 H ASN A 170 89.456 95.095 -12.299 1.00 0.00 H ATOM 2230 N SER A 171 91.769 93.995 -14.401 1.00 9.57 N ATOM 2231 CA SER A 171 92.665 93.123 -15.164 1.00 10.13 C ATOM 2232 C SER A 171 92.026 92.605 -16.465 1.00 10.53 C ATOM 2233 O SER A 171 92.733 92.370 -17.453 1.00 10.85 O ATOM 2234 CB SER A 171 93.083 91.900 -14.326 1.00 11.30 C ATOM 2235 OG SER A 171 93.634 92.263 -13.071 1.00 13.79 O ATOM 2236 HA SER A 171 93.530 93.736 -15.416 1.00 0.00 H ATOM 2237 HB2 SER A 171 93.828 91.332 -14.884 1.00 0.00 H ATOM 2238 HB3 SER A 171 92.205 91.277 -14.155 1.00 0.00 H ATOM 2239 HG SER A 171 92.963 92.773 -12.552 1.00 0.00 H ATOM 2240 H SER A 171 91.320 93.631 -13.536 1.00 0.00 H ATOM 2241 N TYR A 172 90.709 92.377 -16.438 1.00 10.51 N ATOM 2242 CA TYR A 172 89.961 91.838 -17.587 1.00 10.32 C ATOM 2243 C TYR A 172 88.665 92.665 -17.778 1.00 10.52 C ATOM 2244 O TYR A 172 87.551 92.171 -17.561 1.00 9.98 O ATOM 2245 CB TYR A 172 89.610 90.349 -17.314 1.00 11.22 C ATOM 2246 CG TYR A 172 90.792 89.433 -16.961 1.00 10.11 C ATOM 2247 CD1 TYR A 172 91.728 89.051 -17.933 1.00 10.77 C ATOM 2248 CD2 TYR A 172 90.943 88.912 -15.668 1.00 10.46 C ATOM 2249 CE1 TYR A 172 92.783 88.171 -17.632 1.00 10.27 C ATOM 2250 CE2 TYR A 172 92.004 88.021 -15.356 1.00 9.98 C ATOM 2251 CZ TYR A 172 92.912 87.656 -16.350 1.00 10.65 C ATOM 2252 OH TYR A 172 93.929 86.766 -16.080 1.00 10.58 O ATOM 2253 HA TYR A 172 90.564 91.902 -18.492 1.00 0.00 H ATOM 2254 HB3 TYR A 172 89.133 89.949 -18.209 1.00 0.00 H ATOM 2255 HB2 TYR A 172 88.905 90.319 -16.484 1.00 0.00 H ATOM 2256 HD2 TYR A 172 90.235 89.195 -14.890 1.00 0.00 H ATOM 2257 HE2 TYR A 172 92.108 87.625 -14.346 1.00 0.00 H ATOM 2258 HE1 TYR A 172 93.499 87.894 -18.406 1.00 0.00 H ATOM 2259 HD1 TYR A 172 91.636 89.445 -18.945 1.00 0.00 H ATOM 2260 HH TYR A 172 93.542 85.903 -15.788 1.00 0.00 H ATOM 2261 H TYR A 172 90.187 92.590 -15.564 1.00 0.00 H ATOM 2262 N PRO A 173 88.793 93.918 -18.260 1.00 11.41 N ATOM 2263 CA PRO A 173 87.668 94.842 -18.485 1.00 12.01 C ATOM 2264 C PRO A 173 86.392 94.307 -19.164 1.00 12.30 C ATOM 2265 O PRO A 173 86.411 93.931 -20.334 1.00 12.79 O ATOM 2266 CB PRO A 173 88.311 95.968 -19.313 1.00 13.08 C ATOM 2267 CG PRO A 173 89.724 95.972 -18.850 1.00 12.53 C ATOM 2268 CD PRO A 173 90.045 94.491 -18.791 1.00 11.90 C ATOM 2269 HA PRO A 173 87.254 95.126 -17.518 1.00 0.00 H ATOM 2270 HD3 PRO A 173 90.271 94.096 -19.781 1.00 0.00 H ATOM 2271 HD2 PRO A 173 90.884 94.295 -18.123 1.00 0.00 H ATOM 2272 HG3 PRO A 173 89.817 96.437 -17.868 1.00 0.00 H ATOM 2273 HG2 PRO A 173 90.371 96.489 -19.558 1.00 0.00 H ATOM 2274 HB2 PRO A 173 88.250 95.752 -20.380 1.00 0.00 H ATOM 2275 HB3 PRO A 173 87.831 96.925 -19.110 1.00 0.00 H ATOM 2276 N GLY A 174 85.282 94.328 -18.424 1.00 12.64 N ATOM 2277 CA GLY A 174 84.000 93.879 -18.943 1.00 14.21 C ATOM 2278 C GLY A 174 83.783 92.377 -19.112 1.00 15.80 C ATOM 2279 O GLY A 174 82.706 91.958 -19.555 1.00 16.12 O ATOM 2280 HA3 GLY A 174 83.867 94.338 -19.922 1.00 0.00 H ATOM 2281 HA2 GLY A 174 83.229 94.244 -18.264 1.00 0.00 H ATOM 2282 H GLY A 174 85.335 94.676 -17.446 1.00 0.00 H ATOM 2283 N MET A 175 84.768 91.565 -18.727 1.00 15.57 N ATOM 2284 CA MET A 175 84.672 90.108 -18.873 1.00 16.30 C ATOM 2285 C MET A 175 84.338 89.315 -17.604 1.00 15.46 C ATOM 2286 O MET A 175 84.160 88.093 -17.670 1.00 16.04 O ATOM 2287 CB MET A 175 85.973 89.566 -19.451 1.00 19.65 C ATOM 2288 CG MET A 175 86.307 90.076 -20.842 1.00 25.26 C ATOM 2289 SD MET A 175 87.871 89.347 -21.400 1.00 34.69 S ATOM 2290 CE MET A 175 87.413 87.554 -21.399 1.00 31.08 C ATOM 2291 HA MET A 175 83.820 89.963 -19.538 1.00 0.00 H ATOM 2292 HB2 MET A 175 86.786 89.847 -18.781 1.00 0.00 H ATOM 2293 HB3 MET A 175 85.899 88.479 -19.495 1.00 0.00 H ATOM 2294 HG2 MET A 175 86.401 91.162 -20.817 1.00 0.00 H ATOM 2295 HG3 MET A 175 85.510 89.797 -21.532 1.00 0.00 H ATOM 2296 HE1 MET A 175 87.120 87.256 -20.392 1.00 0.00 H ATOM 2297 HE2 MET A 175 86.580 87.393 -22.084 1.00 0.00 H ATOM 2298 HE3 MET A 175 88.270 86.961 -21.720 1.00 0.00 H ATOM 2299 H MET A 175 85.628 91.976 -18.312 1.00 0.00 H ATOM 2300 N ILE A 176 84.253 89.998 -16.463 1.00 12.94 N ATOM 2301 CA ILE A 176 83.963 89.364 -15.179 1.00 11.56 C ATOM 2302 C ILE A 176 82.459 89.426 -14.864 1.00 12.41 C ATOM 2303 O ILE A 176 81.878 90.521 -14.769 1.00 12.89 O ATOM 2304 CB ILE A 176 84.812 90.040 -14.040 1.00 10.99 C ATOM 2305 CG1 ILE A 176 86.306 90.006 -14.404 1.00 10.32 C ATOM 2306 CG2 ILE A 176 84.569 89.366 -12.679 1.00 10.18 C ATOM 2307 CD1 ILE A 176 86.873 88.603 -14.668 1.00 11.37 C ATOM 2308 HA ILE A 176 84.242 88.312 -15.237 1.00 0.00 H ATOM 2309 HB ILE A 176 84.493 91.078 -13.952 1.00 0.00 H ATOM 2310 HG12 ILE A 176 86.450 90.605 -15.303 1.00 0.00 H ATOM 2311 HG13 ILE A 176 86.866 90.449 -13.580 1.00 0.00 H ATOM 2312 HD11 ILE A 176 86.753 87.990 -13.775 1.00 0.00 H ATOM 2313 HD12 ILE A 176 86.336 88.146 -15.499 1.00 0.00 H ATOM 2314 HD13 ILE A 176 87.931 88.681 -14.917 1.00 0.00 H ATOM 2315 HG21 ILE A 176 83.514 89.448 -12.418 1.00 0.00 H ATOM 2316 HG22 ILE A 176 84.849 88.314 -12.741 1.00 0.00 H ATOM 2317 HG23 ILE A 176 85.172 89.860 -11.917 1.00 0.00 H ATOM 2318 H ILE A 176 84.399 91.027 -16.488 1.00 0.00 H ATOM 2319 N THR A 177 81.825 88.257 -14.739 1.00 10.29 N ATOM 2320 CA THR A 177 80.388 88.170 -14.444 1.00 10.64 C ATOM 2321 C THR A 177 80.088 87.884 -12.961 1.00 10.58 C ATOM 2322 O THR A 177 81.009 87.742 -12.145 1.00 10.49 O ATOM 2323 CB THR A 177 79.708 87.049 -15.281 1.00 10.52 C ATOM 2324 OG1 THR A 177 80.157 85.765 -14.816 1.00 10.24 O ATOM 2325 CG2 THR A 177 80.056 87.196 -16.760 1.00 10.15 C ATOM 2326 HA THR A 177 79.988 89.150 -14.703 1.00 0.00 H ATOM 2327 HB THR A 177 78.628 87.133 -15.162 1.00 0.00 H ATOM 2328 HG1 THR A 177 79.724 85.052 -15.349 1.00 0.00 H ATOM 2329 HG23 THR A 177 79.717 88.169 -17.117 1.00 0.00 H ATOM 2330 HG21 THR A 177 81.136 87.117 -16.888 1.00 0.00 H ATOM 2331 HG22 THR A 177 79.563 86.407 -17.328 1.00 0.00 H ATOM 2332 H THR A 177 82.368 87.377 -14.855 1.00 0.00 H ATOM 2333 N ASN A 178 78.803 87.785 -12.620 1.00 11.31 N ATOM 2334 CA ASN A 178 78.389 87.485 -11.247 1.00 11.82 C ATOM 2335 C ASN A 178 78.831 86.093 -10.787 1.00 11.50 C ATOM 2336 O ASN A 178 78.837 85.810 -9.589 1.00 12.44 O ATOM 2337 CB ASN A 178 76.862 87.655 -11.081 1.00 13.11 C ATOM 2338 CG ASN A 178 76.054 86.778 -12.039 1.00 13.54 C ATOM 2339 OD1 ASN A 178 76.438 85.650 -12.339 1.00 15.98 O ATOM 2340 ND2 ASN A 178 74.923 87.299 -12.516 1.00 12.70 N ATOM 2341 HA ASN A 178 78.895 88.206 -10.605 1.00 0.00 H ATOM 2342 HB2 ASN A 178 76.592 87.392 -10.058 1.00 0.00 H ATOM 2343 HB3 ASN A 178 76.606 88.698 -11.266 1.00 0.00 H ATOM 2344 HD22 ASN A 178 74.634 88.258 -12.237 1.00 0.00 H ATOM 2345 HD21 ASN A 178 74.330 86.746 -13.167 1.00 0.00 H ATOM 2346 H ASN A 178 78.074 87.925 -13.349 1.00 0.00 H ATOM 2347 N ALA A 179 79.178 85.228 -11.733 1.00 9.91 N ATOM 2348 CA ALA A 179 79.568 83.852 -11.423 1.00 9.48 C ATOM 2349 C ALA A 179 81.066 83.584 -11.370 1.00 9.32 C ATOM 2350 O ALA A 179 81.480 82.419 -11.427 1.00 8.60 O ATOM 2351 CB ALA A 179 78.922 82.905 -12.429 1.00 10.76 C ATOM 2352 HA ALA A 179 79.212 83.678 -10.408 1.00 0.00 H ATOM 2353 HB1 ALA A 179 77.838 82.999 -12.370 1.00 0.00 H ATOM 2354 HB2 ALA A 179 79.256 83.162 -13.434 1.00 0.00 H ATOM 2355 HB3 ALA A 179 79.212 81.880 -12.199 1.00 0.00 H ATOM 2356 H ALA A 179 79.172 85.538 -12.726 1.00 0.00 H ATOM 2357 N MET A 180 81.866 84.638 -11.216 1.00 8.30 N ATOM 2358 CA MET A 180 83.327 84.513 -11.186 1.00 9.22 C ATOM 2359 C MET A 180 83.994 85.350 -10.084 1.00 9.36 C ATOM 2360 O MET A 180 83.391 86.283 -9.552 1.00 9.56 O ATOM 2361 CB MET A 180 83.922 85.021 -12.516 1.00 9.59 C ATOM 2362 CG MET A 180 83.374 84.429 -13.804 1.00 8.67 C ATOM 2363 SD MET A 180 83.993 85.355 -15.256 1.00 10.60 S ATOM 2364 CE MET A 180 83.015 84.574 -16.574 1.00 10.97 C ATOM 2365 HA MET A 180 83.521 83.456 -11.004 1.00 0.00 H ATOM 2366 HB2 MET A 180 83.759 86.098 -12.556 1.00 0.00 H ATOM 2367 HB3 MET A 180 84.993 84.818 -12.493 1.00 0.00 H ATOM 2368 HG2 MET A 180 82.285 84.478 -13.786 1.00 0.00 H ATOM 2369 HG3 MET A 180 83.689 83.388 -13.882 1.00 0.00 H ATOM 2370 HE1 MET A 180 83.234 83.507 -16.604 1.00 0.00 H ATOM 2371 HE2 MET A 180 81.954 84.723 -16.374 1.00 0.00 H ATOM 2372 HE3 MET A 180 83.272 85.026 -17.532 1.00 0.00 H ATOM 2373 H MET A 180 81.440 85.581 -11.114 1.00 0.00 H ATOM 2374 N PHE A 181 85.224 84.966 -9.729 1.00 9.35 N ATOM 2375 CA PHE A 181 86.095 85.710 -8.793 1.00 8.57 C ATOM 2376 C PHE A 181 87.567 85.436 -9.150 1.00 8.96 C ATOM 2377 O PHE A 181 87.893 84.383 -9.731 1.00 8.86 O ATOM 2378 CB PHE A 181 85.815 85.438 -7.289 1.00 9.74 C ATOM 2379 CG PHE A 181 86.285 84.072 -6.772 1.00 9.72 C ATOM 2380 CD1 PHE A 181 85.383 83.011 -6.653 1.00 10.47 C ATOM 2381 CD2 PHE A 181 87.598 83.881 -6.331 1.00 9.84 C ATOM 2382 CE1 PHE A 181 85.778 81.784 -6.105 1.00 10.85 C ATOM 2383 CE2 PHE A 181 88.004 82.652 -5.778 1.00 10.91 C ATOM 2384 CZ PHE A 181 87.086 81.605 -5.668 1.00 9.86 C ATOM 2385 HA PHE A 181 85.864 86.767 -8.921 1.00 0.00 H ATOM 2386 HB2 PHE A 181 86.318 86.210 -6.707 1.00 0.00 H ATOM 2387 HB3 PHE A 181 84.739 85.507 -7.128 1.00 0.00 H ATOM 2388 HD2 PHE A 181 88.317 84.695 -6.417 1.00 0.00 H ATOM 2389 HE2 PHE A 181 89.031 82.518 -5.437 1.00 0.00 H ATOM 2390 HZ PHE A 181 87.394 80.651 -5.241 1.00 0.00 H ATOM 2391 HE1 PHE A 181 85.059 80.969 -6.021 1.00 0.00 H ATOM 2392 HD1 PHE A 181 84.355 83.141 -6.992 1.00 0.00 H ATOM 2393 H PHE A 181 85.594 84.084 -10.139 1.00 0.00 H ATOM 2394 N CYS A 182 88.429 86.423 -8.899 1.00 8.15 N ATOM 2395 CA CYS A 182 89.867 86.300 -9.149 1.00 8.72 C ATOM 2396 C CYS A 182 90.557 85.969 -7.813 1.00 8.51 C ATOM 2397 O CYS A 182 90.096 86.380 -6.741 1.00 8.15 O ATOM 2398 CB CYS A 182 90.468 87.617 -9.684 1.00 8.37 C ATOM 2399 SG CYS A 182 90.066 88.127 -11.391 1.00 10.38 S ATOM 2400 HA CYS A 182 90.023 85.521 -9.895 1.00 0.00 H ATOM 2401 HB2 CYS A 182 91.552 87.525 -9.622 1.00 0.00 H ATOM 2402 HB3 CYS A 182 90.134 88.416 -9.022 1.00 0.00 H ATOM 2403 H CYS A 182 88.065 87.316 -8.510 1.00 0.00 H ATOM 2404 N ALA A 183 91.645 85.202 -7.887 1.00 9.23 N ATOM 2405 CA ALA A 183 92.434 84.821 -6.704 1.00 9.54 C ATOM 2406 C ALA A 183 93.884 84.629 -7.152 1.00 10.25 C ATOM 2407 O ALA A 183 94.143 84.169 -8.280 1.00 11.18 O ATOM 2408 CB ALA A 183 91.886 83.548 -6.049 1.00 8.98 C ATOM 2409 HA ALA A 183 92.373 85.606 -5.950 1.00 0.00 H ATOM 2410 HB1 ALA A 183 90.855 83.716 -5.737 1.00 0.00 H ATOM 2411 HB2 ALA A 183 91.921 82.728 -6.766 1.00 0.00 H ATOM 2412 HB3 ALA A 183 92.494 83.298 -5.179 1.00 0.00 H ATOM 2413 H ALA A 183 91.949 84.858 -8.820 1.00 0.00 H ATOM 2414 N GLY A 184 94.824 85.021 -6.296 1.00 10.21 N ATOM 2415 CA GLY A 184 96.227 84.921 -6.645 1.00 11.16 C ATOM 2416 C GLY A 184 97.018 86.188 -6.322 1.00 12.80 C ATOM 2417 O GLY A 184 96.718 86.889 -5.343 1.00 11.56 O ATOM 2418 HA3 GLY A 184 96.305 84.726 -7.715 1.00 0.00 H ATOM 2419 HA2 GLY A 184 96.664 84.089 -6.092 1.00 0.00 H ATOM 2420 H GLY A 184 94.550 85.403 -5.368 1.00 0.00 H ATOM 2421 N TYR A 184A 98.002 86.492 -7.175 1.00 14.15 N ATOM 2422 CA TYR A 184A 98.904 87.640 -6.986 1.00 15.98 C ATOM 2423 C TYR A 184A 99.096 88.423 -8.283 1.00 15.75 C ATOM 2424 O TYR A 184A 99.498 87.853 -9.297 1.00 16.01 O ATOM 2425 CB TYR A 184A 100.293 87.147 -6.502 1.00 17.45 C ATOM 2426 CG TYR A 184A 100.267 86.255 -5.273 1.00 18.40 C ATOM 2427 CD1 TYR A 184A 100.338 86.800 -3.992 1.00 20.00 C ATOM 2428 CD2 TYR A 184A 100.100 84.872 -5.391 1.00 20.38 C ATOM 2429 CE1 TYR A 184A 100.234 85.993 -2.858 1.00 20.57 C ATOM 2430 CE2 TYR A 184A 99.991 84.056 -4.261 1.00 20.50 C ATOM 2431 CZ TYR A 184A 100.055 84.627 -3.002 1.00 20.95 C ATOM 2432 OH TYR A 184A 99.896 83.840 -1.884 1.00 23.40 O ATOM 2433 HA TYR A 184A 98.448 88.293 -6.242 1.00 0.00 H ATOM 2434 HB3 TYR A 184A 100.901 88.022 -6.272 1.00 0.00 H ATOM 2435 HB2 TYR A 184A 100.756 86.588 -7.316 1.00 0.00 H ATOM 2436 HD2 TYR A 184A 100.054 84.422 -6.382 1.00 0.00 H ATOM 2437 HE2 TYR A 184A 99.857 82.980 -4.371 1.00 0.00 H ATOM 2438 HE1 TYR A 184A 100.293 86.436 -1.864 1.00 0.00 H ATOM 2439 HD1 TYR A 184A 100.477 87.875 -3.874 1.00 0.00 H ATOM 2440 HH TYR A 184A 100.600 83.144 -1.869 1.00 0.00 H ATOM 2441 H TYR A 184A 98.136 85.889 -8.012 1.00 0.00 H ATOM 2442 N LEU A 185 98.882 89.735 -8.233 1.00 15.58 N ATOM 2443 CA LEU A 185 99.049 90.584 -9.414 1.00 16.47 C ATOM 2444 C LEU A 185 100.501 90.664 -9.905 1.00 16.80 C ATOM 2445 O LEU A 185 100.758 90.947 -11.071 1.00 16.36 O ATOM 2446 CB LEU A 185 98.507 91.986 -9.132 1.00 17.78 C ATOM 2447 CG LEU A 185 96.992 92.068 -8.918 1.00 19.16 C ATOM 2448 CD1 LEU A 185 96.582 93.517 -8.634 1.00 20.50 C ATOM 2449 CD2 LEU A 185 96.267 91.533 -10.155 1.00 20.29 C ATOM 2450 HA LEU A 185 98.478 90.119 -10.217 1.00 0.00 H ATOM 2451 HB2 LEU A 185 98.996 92.363 -8.233 1.00 0.00 H ATOM 2452 HB3 LEU A 185 98.764 92.624 -9.978 1.00 0.00 H ATOM 2453 HG LEU A 185 96.713 91.457 -8.059 1.00 0.00 H ATOM 2454 HD21 LEU A 185 96.543 92.131 -11.023 1.00 0.00 H ATOM 2455 HD22 LEU A 185 96.553 90.495 -10.322 1.00 0.00 H ATOM 2456 HD23 LEU A 185 95.190 91.593 -9.998 1.00 0.00 H ATOM 2457 HD11 LEU A 185 97.092 93.868 -7.737 1.00 0.00 H ATOM 2458 HD12 LEU A 185 96.860 94.145 -9.481 1.00 0.00 H ATOM 2459 HD13 LEU A 185 95.504 93.565 -8.483 1.00 0.00 H ATOM 2460 H LEU A 185 98.589 90.168 -7.334 1.00 0.00 H ATOM 2461 N GLU A 186 101.439 90.379 -9.011 1.00 18.25 N ATOM 2462 CA GLU A 186 102.868 90.391 -9.322 1.00 20.47 C ATOM 2463 C GLU A 186 103.293 89.190 -10.186 1.00 21.16 C ATOM 2464 O GLU A 186 104.361 89.215 -10.815 1.00 22.17 O ATOM 2465 CB GLU A 186 103.690 90.382 -8.022 1.00 21.77 C ATOM 2466 CG GLU A 186 103.438 91.561 -7.071 1.00 24.63 C ATOM 2467 CD GLU A 186 102.019 91.602 -6.509 1.00 24.14 C ATOM 2468 OE1 GLU A 186 101.546 90.580 -5.960 1.00 25.16 O ATOM 2469 OE2 GLU A 186 101.371 92.664 -6.623 1.00 24.36 O ATOM 2470 HA GLU A 186 103.059 91.301 -9.891 1.00 0.00 H ATOM 2471 HB2 GLU A 186 103.459 89.462 -7.485 1.00 0.00 H ATOM 2472 HB3 GLU A 186 104.746 90.388 -8.292 1.00 0.00 H ATOM 2473 HG2 GLU A 186 104.137 91.487 -6.238 1.00 0.00 H ATOM 2474 HG3 GLU A 186 103.620 92.488 -7.615 1.00 0.00 H ATOM 2475 H GLU A 186 101.144 90.136 -8.044 1.00 0.00 H ATOM 2476 N GLY A 187 102.467 88.143 -10.202 1.00 20.09 N ATOM 2477 CA GLY A 187 102.777 86.951 -10.975 1.00 19.70 C ATOM 2478 C GLY A 187 103.630 85.966 -10.185 1.00 18.98 C ATOM 2479 O GLY A 187 103.901 86.180 -9.001 1.00 19.83 O ATOM 2480 HA3 GLY A 187 103.319 87.245 -11.874 1.00 0.00 H ATOM 2481 HA2 GLY A 187 101.845 86.462 -11.258 1.00 0.00 H ATOM 2482 H GLY A 187 101.585 88.180 -9.652 1.00 0.00 H ATOM 2483 N GLY A 188 104.009 84.860 -10.819 1.00 18.47 N ATOM 2484 CA GLY A 188 104.839 83.865 -10.156 1.00 18.43 C ATOM 2485 C GLY A 188 104.170 82.669 -9.481 1.00 18.29 C ATOM 2486 O GLY A 188 104.820 81.635 -9.304 1.00 19.07 O ATOM 2487 HA3 GLY A 188 105.410 84.386 -9.388 1.00 0.00 H ATOM 2488 HA2 GLY A 188 105.521 83.467 -10.907 1.00 0.00 H ATOM 2489 H GLY A 188 103.708 84.704 -11.802 1.00 0.00 H ATOM 2490 N LYS A 188A 102.905 82.804 -9.081 1.00 17.00 N ATOM 2491 CA LYS A 188A 102.163 81.727 -8.408 1.00 16.09 C ATOM 2492 C LYS A 188A 100.757 81.697 -9.008 1.00 15.03 C ATOM 2493 O LYS A 188A 100.070 82.723 -8.973 1.00 15.43 O ATOM 2494 CB LYS A 188A 102.074 82.001 -6.903 1.00 17.43 C ATOM 2495 CG LYS A 188A 103.414 82.083 -6.182 1.00 19.67 C ATOM 2496 CD LYS A 188A 103.198 82.345 -4.697 1.00 23.61 C ATOM 2497 CE LYS A 188A 104.508 82.599 -3.957 1.00 27.02 C ATOM 2498 NZ LYS A 188A 105.418 81.415 -3.953 1.00 29.47 N ATOM 2499 HA LYS A 188A 102.670 80.772 -8.550 1.00 0.00 H ATOM 2500 HB2 LYS A 188A 101.555 82.949 -6.762 1.00 0.00 H ATOM 2501 HB3 LYS A 188A 101.493 81.199 -6.447 1.00 0.00 H ATOM 2502 HG2 LYS A 188A 103.949 81.142 -6.308 1.00 0.00 H ATOM 2503 HG3 LYS A 188A 104.004 82.894 -6.609 1.00 0.00 H ATOM 2504 HD2 LYS A 188A 102.556 83.219 -4.585 1.00 0.00 H ATOM 2505 HD3 LYS A 188A 102.708 81.477 -4.255 1.00 0.00 H ATOM 2506 HE2 LYS A 188A 104.278 82.864 -2.925 1.00 0.00 H ATOM 2507 HE3 LYS A 188A 105.023 83.431 -4.438 1.00 0.00 H ATOM 2508 HZ1 LYS A 188A 104.943 80.616 -3.488 1.00 0.00 H ATOM 2509 HZ2 LYS A 188A 105.654 81.157 -4.933 1.00 0.00 H ATOM 2510 HZ3 LYS A 188A 106.289 81.651 -3.436 1.00 0.00 H ATOM 2511 H LYS A 188A 102.423 83.709 -9.252 1.00 0.00 H ATOM 2512 N ASP A 189 100.302 80.531 -9.486 1.00 12.66 N ATOM 2513 CA ASP A 189 98.991 80.435 -10.148 1.00 11.27 C ATOM 2514 C ASP A 189 98.660 78.970 -10.491 1.00 11.72 C ATOM 2515 O ASP A 189 99.516 78.082 -10.375 1.00 12.46 O ATOM 2516 CB ASP A 189 99.106 81.238 -11.473 1.00 10.90 C ATOM 2517 CG ASP A 189 97.754 81.619 -12.109 1.00 11.69 C ATOM 2518 OD1 ASP A 189 96.664 81.368 -11.540 1.00 11.33 O ATOM 2519 OD2 ASP A 189 97.797 82.203 -13.221 1.00 11.82 O ATOM 2520 HA ASP A 189 98.208 80.820 -9.495 1.00 0.00 H ATOM 2521 HB2 ASP A 189 99.657 82.156 -11.268 1.00 0.00 H ATOM 2522 HB3 ASP A 189 99.662 80.634 -12.190 1.00 0.00 H ATOM 2523 H ASP A 189 100.887 79.677 -9.387 1.00 0.00 H ATOM 2524 N SER A 190 97.404 78.709 -10.847 1.00 10.70 N ATOM 2525 CA SER A 190 96.987 77.381 -11.316 1.00 11.50 C ATOM 2526 C SER A 190 97.285 77.421 -12.827 1.00 12.06 C ATOM 2527 O SER A 190 97.462 78.512 -13.388 1.00 12.78 O ATOM 2528 CB SER A 190 95.489 77.150 -11.052 1.00 10.39 C ATOM 2529 OG SER A 190 94.692 78.233 -11.511 1.00 11.84 O ATOM 2530 HA SER A 190 97.504 76.568 -10.806 1.00 0.00 H ATOM 2531 HB2 SER A 190 95.335 77.030 -9.980 1.00 0.00 H ATOM 2532 HB3 SER A 190 95.177 76.241 -11.566 1.00 0.00 H ATOM 2533 HG SER A 190 94.964 79.062 -11.044 1.00 0.00 H ATOM 2534 H SER A 190 96.696 79.469 -10.791 1.00 0.00 H ATOM 2535 N CYS A 191 97.317 76.275 -13.503 1.00 11.91 N ATOM 2536 CA CYS A 191 97.639 76.278 -14.933 1.00 13.34 C ATOM 2537 C CYS A 191 96.892 75.172 -15.690 1.00 14.48 C ATOM 2538 O CYS A 191 95.960 74.556 -15.150 1.00 14.26 O ATOM 2539 CB CYS A 191 99.176 76.162 -15.109 1.00 13.96 C ATOM 2540 SG CYS A 191 99.899 76.660 -16.723 1.00 17.14 S ATOM 2541 HA CYS A 191 97.304 77.219 -15.368 1.00 0.00 H ATOM 2542 HB2 CYS A 191 99.444 75.119 -14.941 1.00 0.00 H ATOM 2543 HB3 CYS A 191 99.638 76.782 -14.341 1.00 0.00 H ATOM 2544 H CYS A 191 97.114 75.378 -13.017 1.00 0.00 H ATOM 2545 N GLN A 192 97.262 74.952 -16.952 1.00 16.01 N ATOM 2546 CA GLN A 192 96.632 73.914 -17.772 1.00 17.41 C ATOM 2547 C GLN A 192 96.829 72.536 -17.109 1.00 16.51 C ATOM 2548 O GLN A 192 97.956 72.165 -16.717 1.00 17.63 O ATOM 2549 CB GLN A 192 97.222 73.919 -19.194 1.00 19.26 C ATOM 2550 CG GLN A 192 96.614 72.884 -20.138 1.00 20.00 C ATOM 2551 CD GLN A 192 95.119 73.068 -20.338 1.00 20.69 C ATOM 2552 OE1 GLN A 192 94.331 72.904 -19.405 1.00 20.97 O ATOM 2553 NE2 GLN A 192 94.722 73.403 -21.558 1.00 20.79 N ATOM 2554 HA GLN A 192 95.564 74.121 -17.847 1.00 0.00 H ATOM 2555 HB2 GLN A 192 97.063 74.908 -19.625 1.00 0.00 H ATOM 2556 HB3 GLN A 192 98.292 73.724 -19.119 1.00 0.00 H ATOM 2557 HG2 GLN A 192 97.107 72.965 -21.107 1.00 0.00 H ATOM 2558 HG3 GLN A 192 96.790 71.891 -19.725 1.00 0.00 H ATOM 2559 HE22 GLN A 192 95.423 73.531 -22.316 1.00 0.00 H ATOM 2560 HE21 GLN A 192 93.710 73.538 -21.757 1.00 0.00 H ATOM 2561 H GLN A 192 98.019 75.533 -17.366 1.00 0.00 H ATOM 2562 N GLY A 193 95.734 71.788 -17.003 1.00 13.57 N ATOM 2563 CA GLY A 193 95.773 70.482 -16.367 1.00 12.55 C ATOM 2564 C GLY A 193 95.134 70.531 -14.982 1.00 12.02 C ATOM 2565 O GLY A 193 94.742 69.486 -14.438 1.00 11.09 O ATOM 2566 HA3 GLY A 193 96.811 70.163 -16.270 1.00 0.00 H ATOM 2567 HA2 GLY A 193 95.230 69.767 -16.986 1.00 0.00 H ATOM 2568 H GLY A 193 94.834 72.144 -17.382 1.00 0.00 H ATOM 2569 N ASP A 194 95.069 71.736 -14.395 1.00 10.61 N ATOM 2570 CA ASP A 194 94.456 71.956 -13.079 1.00 9.00 C ATOM 2571 C ASP A 194 92.949 72.233 -13.195 1.00 8.30 C ATOM 2572 O ASP A 194 92.233 72.201 -12.179 1.00 8.48 O ATOM 2573 CB ASP A 194 95.130 73.129 -12.340 1.00 8.69 C ATOM 2574 CG ASP A 194 96.578 72.842 -11.951 1.00 9.32 C ATOM 2575 OD1 ASP A 194 96.871 71.696 -11.531 1.00 9.07 O ATOM 2576 OD2 ASP A 194 97.421 73.770 -12.048 1.00 9.05 O ATOM 2577 HA ASP A 194 94.602 71.039 -12.508 1.00 0.00 H ATOM 2578 HB2 ASP A 194 95.112 74.004 -12.990 1.00 0.00 H ATOM 2579 HB3 ASP A 194 94.563 73.340 -11.433 1.00 0.00 H ATOM 2580 H ASP A 194 95.472 72.553 -14.896 1.00 0.00 H ATOM 2581 N SER A 195 92.487 72.532 -14.420 1.00 8.75 N ATOM 2582 CA SER A 195 91.072 72.831 -14.725 1.00 8.11 C ATOM 2583 C SER A 195 90.082 71.893 -14.038 1.00 8.66 C ATOM 2584 O SER A 195 90.265 70.662 -14.075 1.00 8.56 O ATOM 2585 CB SER A 195 90.800 72.723 -16.235 1.00 10.45 C ATOM 2586 OG SER A 195 91.376 73.772 -16.985 1.00 13.03 O ATOM 2587 HA SER A 195 90.921 73.844 -14.353 1.00 0.00 H ATOM 2588 HB2 SER A 195 89.722 72.736 -16.394 1.00 0.00 H ATOM 2589 HB3 SER A 195 91.208 71.778 -16.593 1.00 0.00 H ATOM 2590 HG SER A 195 91.165 73.645 -17.944 1.00 0.00 H ATOM 2591 H SER A 195 93.169 72.555 -15.205 1.00 0.00 H ATOM 2592 N GLY A 196 89.006 72.462 -13.485 1.00 7.53 N ATOM 2593 CA GLY A 196 87.990 71.658 -12.809 1.00 6.90 C ATOM 2594 C GLY A 196 88.262 71.335 -11.345 1.00 6.54 C ATOM 2595 O GLY A 196 87.343 70.919 -10.633 1.00 8.21 O ATOM 2596 HA3 GLY A 196 87.897 70.715 -13.348 1.00 0.00 H ATOM 2597 HA2 GLY A 196 87.046 72.200 -12.862 1.00 0.00 H ATOM 2598 H GLY A 196 88.890 73.494 -13.537 1.00 0.00 H ATOM 2599 N GLY A 197 89.504 71.557 -10.900 1.00 7.53 N ATOM 2600 CA GLY A 197 89.917 71.289 -9.524 1.00 7.78 C ATOM 2601 C GLY A 197 89.363 72.223 -8.451 1.00 7.57 C ATOM 2602 O GLY A 197 88.757 73.252 -8.778 1.00 8.01 O ATOM 2603 HA3 GLY A 197 91.005 71.350 -9.487 1.00 0.00 H ATOM 2604 HA2 GLY A 197 89.603 70.275 -9.275 1.00 0.00 H ATOM 2605 H GLY A 197 90.208 71.938 -11.564 1.00 0.00 H ATOM 2606 N PRO A 198 89.634 71.934 -7.164 1.00 7.56 N ATOM 2607 CA PRO A 198 89.152 72.737 -6.022 1.00 7.60 C ATOM 2608 C PRO A 198 89.925 73.954 -5.522 1.00 7.43 C ATOM 2609 O PRO A 198 91.152 74.030 -5.641 1.00 7.43 O ATOM 2610 CB PRO A 198 89.108 71.704 -4.892 1.00 7.98 C ATOM 2611 CG PRO A 198 90.334 70.846 -5.181 1.00 9.55 C ATOM 2612 CD PRO A 198 90.268 70.674 -6.701 1.00 8.65 C ATOM 2613 HA PRO A 198 88.233 73.218 -6.356 1.00 0.00 H ATOM 2614 HD3 PRO A 198 91.266 70.561 -7.125 1.00 0.00 H ATOM 2615 HD2 PRO A 198 89.660 69.810 -6.970 1.00 0.00 H ATOM 2616 HG3 PRO A 198 90.271 69.884 -4.672 1.00 0.00 H ATOM 2617 HG2 PRO A 198 91.250 71.354 -4.881 1.00 0.00 H ATOM 2618 HB2 PRO A 198 89.184 72.184 -3.916 1.00 0.00 H ATOM 2619 HB3 PRO A 198 88.194 71.112 -4.934 1.00 0.00 H ATOM 2620 N VAL A 199 89.161 74.905 -4.975 1.00 8.05 N ATOM 2621 CA VAL A 199 89.702 76.075 -4.266 1.00 7.65 C ATOM 2622 C VAL A 199 88.926 75.987 -2.935 1.00 7.85 C ATOM 2623 O VAL A 199 87.704 76.197 -2.911 1.00 8.23 O ATOM 2624 CB VAL A 199 89.403 77.439 -4.957 1.00 8.90 C ATOM 2625 CG1 VAL A 199 89.859 78.597 -4.049 1.00 8.70 C ATOM 2626 CG2 VAL A 199 90.140 77.533 -6.274 1.00 9.75 C ATOM 2627 HA VAL A 199 90.790 76.051 -4.202 1.00 0.00 H ATOM 2628 HB VAL A 199 88.330 77.507 -5.135 1.00 0.00 H ATOM 2629 HG11 VAL A 199 89.322 78.547 -3.102 1.00 0.00 H ATOM 2630 HG12 VAL A 199 90.930 78.513 -3.866 1.00 0.00 H ATOM 2631 HG13 VAL A 199 89.646 79.547 -4.539 1.00 0.00 H ATOM 2632 HG21 VAL A 199 91.212 77.451 -6.096 1.00 0.00 H ATOM 2633 HG22 VAL A 199 89.817 76.724 -6.928 1.00 0.00 H ATOM 2634 HG23 VAL A 199 89.921 78.492 -6.744 1.00 0.00 H ATOM 2635 H VAL A 199 88.128 74.813 -5.055 1.00 0.00 H ATOM 2636 N VAL A 200 89.614 75.595 -1.858 1.00 7.60 N ATOM 2637 CA VAL A 200 88.999 75.433 -0.535 1.00 8.46 C ATOM 2638 C VAL A 200 89.370 76.555 0.447 1.00 8.66 C ATOM 2639 O VAL A 200 90.555 76.879 0.619 1.00 8.37 O ATOM 2640 CB VAL A 200 89.453 74.080 0.098 1.00 8.41 C ATOM 2641 CG1 VAL A 200 88.856 73.897 1.491 1.00 7.14 C ATOM 2642 CG2 VAL A 200 89.074 72.917 -0.812 1.00 8.32 C ATOM 2643 HA VAL A 200 87.922 75.462 -0.697 1.00 0.00 H ATOM 2644 HB VAL A 200 90.538 74.099 0.203 1.00 0.00 H ATOM 2645 HG11 VAL A 200 89.185 74.712 2.136 1.00 0.00 H ATOM 2646 HG12 VAL A 200 87.768 73.903 1.422 1.00 0.00 H ATOM 2647 HG13 VAL A 200 89.190 72.946 1.906 1.00 0.00 H ATOM 2648 HG21 VAL A 200 87.993 72.902 -0.949 1.00 0.00 H ATOM 2649 HG22 VAL A 200 89.562 73.040 -1.779 1.00 0.00 H ATOM 2650 HG23 VAL A 200 89.397 71.981 -0.357 1.00 0.00 H ATOM 2651 H VAL A 200 90.629 75.396 -1.962 1.00 0.00 H ATOM 2652 N CYS A 201 88.360 77.127 1.102 1.00 9.80 N ATOM 2653 CA CYS A 201 88.588 78.206 2.073 1.00 11.29 C ATOM 2654 C CYS A 201 87.785 77.897 3.338 1.00 11.95 C ATOM 2655 O CYS A 201 86.589 77.595 3.261 1.00 11.45 O ATOM 2656 CB CYS A 201 88.147 79.580 1.520 1.00 11.61 C ATOM 2657 SG CYS A 201 88.451 79.946 -0.245 1.00 11.87 S ATOM 2658 HA CYS A 201 89.656 78.258 2.285 1.00 0.00 H ATOM 2659 HB2 CYS A 201 88.665 80.343 2.101 1.00 0.00 H ATOM 2660 HB3 CYS A 201 87.073 79.665 1.687 1.00 0.00 H ATOM 2661 H CYS A 201 87.389 76.802 0.922 1.00 0.00 H ATOM 2662 N ASN A 202 88.442 77.970 4.493 1.00 13.71 N ATOM 2663 CA ASN A 202 87.784 77.702 5.785 1.00 15.45 C ATOM 2664 C ASN A 202 87.053 76.359 5.782 1.00 15.60 C ATOM 2665 O ASN A 202 85.929 76.257 6.283 1.00 16.33 O ATOM 2666 CB ASN A 202 86.775 78.806 6.145 1.00 17.25 C ATOM 2667 CG ASN A 202 87.431 80.148 6.418 1.00 19.94 C ATOM 2668 OD1 ASN A 202 88.606 80.225 6.776 1.00 21.26 O ATOM 2669 ND2 ASN A 202 86.665 81.219 6.251 1.00 23.01 N ATOM 2670 HA ASN A 202 88.579 77.678 6.530 1.00 0.00 H ATOM 2671 HB2 ASN A 202 86.078 78.923 5.315 1.00 0.00 H ATOM 2672 HB3 ASN A 202 86.228 78.499 7.037 1.00 0.00 H ATOM 2673 HD22 ASN A 202 85.676 81.109 5.947 1.00 0.00 H ATOM 2674 HD21 ASN A 202 87.053 82.168 6.424 1.00 0.00 H ATOM 2675 H ASN A 202 89.451 78.224 4.484 1.00 0.00 H ATOM 2676 N GLY A 203 87.650 75.370 5.125 1.00 14.49 N ATOM 2677 CA GLY A 203 87.064 74.045 5.078 1.00 14.53 C ATOM 2678 C GLY A 203 85.870 73.810 4.169 1.00 14.40 C ATOM 2679 O GLY A 203 85.208 72.775 4.295 1.00 15.70 O ATOM 2680 HA3 GLY A 203 86.750 73.796 6.092 1.00 0.00 H ATOM 2681 HA2 GLY A 203 87.849 73.357 4.763 1.00 0.00 H ATOM 2682 H GLY A 203 88.551 75.549 4.637 1.00 0.00 H ATOM 2683 N GLU A 204 85.607 74.730 3.242 1.00 12.44 N ATOM 2684 CA GLU A 204 84.481 74.593 2.310 1.00 11.47 C ATOM 2685 C GLU A 204 84.918 74.851 0.857 1.00 10.36 C ATOM 2686 O GLU A 204 85.885 75.581 0.614 1.00 9.86 O ATOM 2687 CB GLU A 204 83.361 75.575 2.683 1.00 12.88 C ATOM 2688 CG GLU A 204 82.752 75.331 4.070 1.00 14.67 C ATOM 2689 CD GLU A 204 81.702 76.367 4.448 1.00 16.97 C ATOM 2690 OE1 GLU A 204 81.666 77.457 3.827 1.00 17.65 O ATOM 2691 OE2 GLU A 204 80.920 76.097 5.381 1.00 18.19 O ATOM 2692 HA GLU A 204 84.115 73.569 2.385 1.00 0.00 H ATOM 2693 HB2 GLU A 204 83.769 76.585 2.661 1.00 0.00 H ATOM 2694 HB3 GLU A 204 82.568 75.489 1.940 1.00 0.00 H ATOM 2695 HG2 GLU A 204 82.287 74.345 4.077 1.00 0.00 H ATOM 2696 HG3 GLU A 204 83.551 75.359 4.811 1.00 0.00 H ATOM 2697 H GLU A 204 86.217 75.570 3.177 1.00 0.00 H ATOM 2698 N LEU A 209 84.216 74.242 -0.102 1.00 9.60 N ATOM 2699 CA LEU A 209 84.526 74.428 -1.526 1.00 9.40 C ATOM 2700 C LEU A 209 83.969 75.769 -2.023 1.00 9.61 C ATOM 2701 O LEU A 209 82.761 75.885 -2.262 1.00 9.91 O ATOM 2702 CB LEU A 209 83.927 73.284 -2.362 1.00 9.42 C ATOM 2703 CG LEU A 209 84.238 73.267 -3.871 1.00 9.13 C ATOM 2704 CD1 LEU A 209 85.707 72.943 -4.106 1.00 9.24 C ATOM 2705 CD2 LEU A 209 83.359 72.245 -4.592 1.00 9.74 C ATOM 2706 HA LEU A 209 85.610 74.424 -1.641 1.00 0.00 H ATOM 2707 HB2 LEU A 209 84.293 72.347 -1.942 1.00 0.00 H ATOM 2708 HB3 LEU A 209 82.844 73.332 -2.252 1.00 0.00 H ATOM 2709 HG LEU A 209 84.024 74.257 -4.273 1.00 0.00 H ATOM 2710 HD21 LEU A 209 83.546 71.253 -4.182 1.00 0.00 H ATOM 2711 HD22 LEU A 209 82.310 72.506 -4.451 1.00 0.00 H ATOM 2712 HD23 LEU A 209 83.596 72.250 -5.656 1.00 0.00 H ATOM 2713 HD11 LEU A 209 86.326 73.699 -3.624 1.00 0.00 H ATOM 2714 HD12 LEU A 209 85.934 71.963 -3.685 1.00 0.00 H ATOM 2715 HD13 LEU A 209 85.909 72.935 -5.177 1.00 0.00 H ATOM 2716 H LEU A 209 83.428 73.619 0.167 1.00 0.00 H ATOM 2717 N GLN A 210 84.844 76.765 -2.194 1.00 8.85 N ATOM 2718 CA GLN A 210 84.418 78.100 -2.665 1.00 8.62 C ATOM 2719 C GLN A 210 84.616 78.324 -4.170 1.00 8.42 C ATOM 2720 O GLN A 210 83.896 79.142 -4.774 1.00 8.30 O ATOM 2721 CB GLN A 210 85.140 79.228 -1.895 1.00 9.16 C ATOM 2722 CG GLN A 210 84.767 79.381 -0.408 1.00 12.23 C ATOM 2723 CD GLN A 210 83.405 80.066 -0.141 1.00 14.48 C ATOM 2724 OE1 GLN A 210 82.790 79.858 0.918 1.00 16.26 O ATOM 2725 NE2 GLN A 210 82.955 80.898 -1.071 1.00 12.85 N ATOM 2726 HA GLN A 210 83.347 78.133 -2.467 1.00 0.00 H ATOM 2727 HB2 GLN A 210 86.212 79.037 -1.952 1.00 0.00 H ATOM 2728 HB3 GLN A 210 84.913 80.170 -2.394 1.00 0.00 H ATOM 2729 HG2 GLN A 210 84.739 78.387 0.038 1.00 0.00 H ATOM 2730 HG3 GLN A 210 85.544 79.973 0.076 1.00 0.00 H ATOM 2731 HE22 GLN A 210 83.500 81.045 -1.945 1.00 0.00 H ATOM 2732 HE21 GLN A 210 82.058 81.403 -0.926 1.00 0.00 H ATOM 2733 H GLN A 210 85.850 76.596 -1.991 1.00 0.00 H ATOM 2734 N GLY A 211 85.581 77.629 -4.781 1.00 7.73 N ATOM 2735 CA GLY A 211 85.817 77.813 -6.211 1.00 7.36 C ATOM 2736 C GLY A 211 86.203 76.583 -7.031 1.00 7.92 C ATOM 2737 O GLY A 211 86.525 75.528 -6.466 1.00 8.38 O ATOM 2738 HA3 GLY A 211 86.621 78.541 -6.318 1.00 0.00 H ATOM 2739 HA2 GLY A 211 84.902 78.218 -6.643 1.00 0.00 H ATOM 2740 H GLY A 211 86.163 76.958 -4.239 1.00 0.00 H ATOM 2741 N VAL A 212 86.113 76.716 -8.361 1.00 6.77 N ATOM 2742 CA VAL A 212 86.478 75.666 -9.335 1.00 7.27 C ATOM 2743 C VAL A 212 87.451 76.314 -10.360 1.00 7.35 C ATOM 2744 O VAL A 212 87.147 77.390 -10.901 1.00 7.05 O ATOM 2745 CB VAL A 212 85.213 75.128 -10.107 1.00 7.22 C ATOM 2746 CG1 VAL A 212 85.625 74.170 -11.237 1.00 8.44 C ATOM 2747 CG2 VAL A 212 84.235 74.443 -9.144 1.00 9.03 C ATOM 2748 HA VAL A 212 86.931 74.825 -8.811 1.00 0.00 H ATOM 2749 HB VAL A 212 84.706 75.982 -10.556 1.00 0.00 H ATOM 2750 HG11 VAL A 212 86.268 74.697 -11.942 1.00 0.00 H ATOM 2751 HG12 VAL A 212 86.165 73.322 -10.814 1.00 0.00 H ATOM 2752 HG13 VAL A 212 84.733 73.814 -11.753 1.00 0.00 H ATOM 2753 HG21 VAL A 212 84.733 73.604 -8.658 1.00 0.00 H ATOM 2754 HG22 VAL A 212 83.908 75.159 -8.390 1.00 0.00 H ATOM 2755 HG23 VAL A 212 83.371 74.081 -9.702 1.00 0.00 H ATOM 2756 H VAL A 212 85.762 77.621 -8.734 1.00 0.00 H ATOM 2757 N VAL A 213 88.608 75.694 -10.609 1.00 6.15 N ATOM 2758 CA VAL A 213 89.596 76.243 -11.566 1.00 6.53 C ATOM 2759 C VAL A 213 88.953 76.405 -12.967 1.00 7.00 C ATOM 2760 O VAL A 213 88.544 75.419 -13.589 1.00 6.96 O ATOM 2761 CB VAL A 213 90.882 75.347 -11.650 1.00 6.88 C ATOM 2762 CG1 VAL A 213 91.919 75.987 -12.570 1.00 6.46 C ATOM 2763 CG2 VAL A 213 91.485 75.118 -10.244 1.00 6.97 C ATOM 2764 HA VAL A 213 89.904 77.223 -11.202 1.00 0.00 H ATOM 2765 HB VAL A 213 90.595 74.380 -12.063 1.00 0.00 H ATOM 2766 HG11 VAL A 213 91.497 76.098 -13.569 1.00 0.00 H ATOM 2767 HG12 VAL A 213 92.194 76.967 -12.180 1.00 0.00 H ATOM 2768 HG13 VAL A 213 92.804 75.352 -12.616 1.00 0.00 H ATOM 2769 HG21 VAL A 213 91.753 76.079 -9.804 1.00 0.00 H ATOM 2770 HG22 VAL A 213 90.750 74.620 -9.612 1.00 0.00 H ATOM 2771 HG23 VAL A 213 92.375 74.494 -10.329 1.00 0.00 H ATOM 2772 H VAL A 213 88.820 74.802 -10.118 1.00 0.00 H ATOM 2773 N SER A 214 88.894 77.643 -13.466 1.00 7.66 N ATOM 2774 CA SER A 214 88.231 77.948 -14.741 1.00 8.89 C ATOM 2775 C SER A 214 89.078 78.485 -15.906 1.00 10.79 C ATOM 2776 O SER A 214 89.274 77.767 -16.893 1.00 12.67 O ATOM 2777 CB SER A 214 87.042 78.898 -14.474 1.00 8.59 C ATOM 2778 OG SER A 214 86.254 79.139 -15.630 1.00 7.24 O ATOM 2779 HA SER A 214 87.929 76.967 -15.108 1.00 0.00 H ATOM 2780 HB2 SER A 214 87.432 79.850 -14.114 1.00 0.00 H ATOM 2781 HB3 SER A 214 86.407 78.454 -13.707 1.00 0.00 H ATOM 2782 HG SER A 214 85.886 78.282 -15.962 1.00 0.00 H ATOM 2783 H SER A 214 89.334 78.420 -12.932 1.00 0.00 H ATOM 2784 N TRP A 215 89.516 79.752 -15.837 1.00 10.82 N ATOM 2785 CA TRP A 215 90.310 80.355 -16.927 1.00 11.64 C ATOM 2786 C TRP A 215 91.303 81.470 -16.512 1.00 12.32 C ATOM 2787 O TRP A 215 91.456 81.774 -15.328 1.00 12.15 O ATOM 2788 CB TRP A 215 89.378 80.872 -18.051 1.00 10.84 C ATOM 2789 CG TRP A 215 88.485 82.057 -17.676 1.00 12.05 C ATOM 2790 CD1 TRP A 215 87.273 82.004 -17.043 1.00 11.91 C ATOM 2791 CD2 TRP A 215 88.734 83.456 -17.940 1.00 12.64 C ATOM 2792 NE1 TRP A 215 86.752 83.272 -16.899 1.00 12.27 N ATOM 2793 CE2 TRP A 215 87.627 84.180 -17.439 1.00 12.96 C ATOM 2794 CE3 TRP A 215 89.786 84.164 -18.552 1.00 12.65 C ATOM 2795 CZ2 TRP A 215 87.536 85.581 -17.529 1.00 12.86 C ATOM 2796 CZ3 TRP A 215 89.695 85.560 -18.641 1.00 13.01 C ATOM 2797 CH2 TRP A 215 88.577 86.247 -18.130 1.00 12.50 C ATOM 2798 HA TRP A 215 90.940 79.539 -17.281 1.00 0.00 H ATOM 2799 HB2 TRP A 215 90.002 81.175 -18.892 1.00 0.00 H ATOM 2800 HB3 TRP A 215 88.732 80.049 -18.357 1.00 0.00 H ATOM 2801 HE1 TRP A 215 85.842 83.503 -16.453 1.00 0.00 H ATOM 2802 HD1 TRP A 215 86.789 81.089 -16.701 1.00 0.00 H ATOM 2803 HZ2 TRP A 215 86.672 86.118 -17.137 1.00 0.00 H ATOM 2804 HH2 TRP A 215 88.536 87.333 -18.213 1.00 0.00 H ATOM 2805 HZ3 TRP A 215 90.501 86.122 -19.113 1.00 0.00 H ATOM 2806 HE3 TRP A 215 90.654 83.637 -18.949 1.00 0.00 H ATOM 2807 H TRP A 215 89.291 80.322 -14.997 1.00 0.00 H ATOM 2808 N GLY A 216 92.014 82.017 -17.499 1.00 13.60 N ATOM 2809 CA GLY A 216 92.973 83.096 -17.276 1.00 14.12 C ATOM 2810 C GLY A 216 93.797 83.317 -18.542 1.00 15.54 C ATOM 2811 O GLY A 216 93.668 82.556 -19.505 1.00 15.90 O ATOM 2812 HA3 GLY A 216 93.636 82.829 -16.453 1.00 0.00 H ATOM 2813 HA2 GLY A 216 92.438 84.012 -17.026 1.00 0.00 H ATOM 2814 H GLY A 216 91.880 81.661 -18.467 1.00 0.00 H ATOM 2815 N TYR A 217 94.596 84.384 -18.586 1.00 15.86 N ATOM 2816 CA TYR A 217 95.453 84.640 -19.749 1.00 15.49 C ATOM 2817 C TYR A 217 96.871 84.171 -19.368 1.00 16.31 C ATOM 2818 O TYR A 217 97.578 84.832 -18.588 1.00 15.80 O ATOM 2819 CB TYR A 217 95.437 86.130 -20.137 1.00 16.35 C ATOM 2820 CG TYR A 217 94.228 86.546 -20.946 1.00 15.99 C ATOM 2821 CD1 TYR A 217 92.935 86.281 -20.496 1.00 16.05 C ATOM 2822 CD2 TYR A 217 94.377 87.202 -22.167 1.00 15.97 C ATOM 2823 CE1 TYR A 217 91.821 86.657 -21.242 1.00 16.00 C ATOM 2824 CE2 TYR A 217 93.271 87.582 -22.922 1.00 15.95 C ATOM 2825 CZ TYR A 217 91.996 87.306 -22.453 1.00 15.86 C ATOM 2826 OH TYR A 217 90.901 87.676 -23.199 1.00 15.81 O ATOM 2827 HA TYR A 217 95.092 84.098 -20.623 1.00 0.00 H ATOM 2828 HB3 TYR A 217 96.331 86.340 -20.724 1.00 0.00 H ATOM 2829 HB2 TYR A 217 95.457 86.722 -19.222 1.00 0.00 H ATOM 2830 HD2 TYR A 217 95.378 87.421 -22.537 1.00 0.00 H ATOM 2831 HE2 TYR A 217 93.407 88.093 -23.875 1.00 0.00 H ATOM 2832 HE1 TYR A 217 90.817 86.442 -20.875 1.00 0.00 H ATOM 2833 HD1 TYR A 217 92.794 85.770 -19.543 1.00 0.00 H ATOM 2834 HH TYR A 217 90.074 87.407 -22.725 1.00 0.00 H ATOM 2835 H TYR A 217 94.612 85.045 -17.783 1.00 0.00 H ATOM 2836 N GLY A 219 97.251 82.999 -19.882 1.00 16.55 N ATOM 2837 CA GLY A 219 98.546 82.411 -19.570 1.00 16.12 C ATOM 2838 C GLY A 219 98.523 81.855 -18.150 1.00 15.80 C ATOM 2839 O GLY A 219 97.443 81.655 -17.582 1.00 16.14 O ATOM 2840 HA3 GLY A 219 99.320 83.174 -19.649 1.00 0.00 H ATOM 2841 HA2 GLY A 219 98.758 81.605 -20.273 1.00 0.00 H ATOM 2842 H GLY A 219 96.606 82.493 -20.522 1.00 0.00 H ATOM 2843 N CYS A 220 99.698 81.622 -17.573 1.00 15.71 N ATOM 2844 CA CYS A 220 99.806 81.120 -16.206 1.00 15.40 C ATOM 2845 C CYS A 220 100.899 81.892 -15.488 1.00 15.46 C ATOM 2846 O CYS A 220 102.025 81.987 -15.987 1.00 15.62 O ATOM 2847 CB CYS A 220 100.198 79.636 -16.177 1.00 16.60 C ATOM 2848 SG CYS A 220 99.101 78.508 -17.081 1.00 18.28 S ATOM 2849 HA CYS A 220 98.835 81.243 -15.727 1.00 0.00 H ATOM 2850 HB2 CYS A 220 100.221 79.317 -15.135 1.00 0.00 H ATOM 2851 HB3 CYS A 220 101.196 79.546 -16.605 1.00 0.00 H ATOM 2852 H CYS A 220 100.568 81.803 -18.113 1.00 0.00 H ATOM 2853 N ALA A 221 100.569 82.425 -14.315 1.00 14.21 N ATOM 2854 CA ALA A 221 101.516 83.157 -13.470 1.00 14.65 C ATOM 2855 C ALA A 221 102.132 84.429 -14.066 1.00 15.07 C ATOM 2856 O ALA A 221 103.189 84.881 -13.607 1.00 15.68 O ATOM 2857 CB ALA A 221 102.616 82.204 -12.966 1.00 14.46 C ATOM 2858 HA ALA A 221 100.909 83.531 -12.645 1.00 0.00 H ATOM 2859 HB1 ALA A 221 102.161 81.401 -12.385 1.00 0.00 H ATOM 2860 HB2 ALA A 221 103.147 81.781 -13.819 1.00 0.00 H ATOM 2861 HB3 ALA A 221 103.315 82.757 -12.339 1.00 0.00 H ATOM 2862 H ALA A 221 99.590 82.317 -13.981 1.00 0.00 H ATOM 2863 N GLU A 221A 101.456 85.026 -15.047 1.00 15.79 N ATOM 2864 CA GLU A 221A 101.935 86.260 -15.681 1.00 16.19 C ATOM 2865 C GLU A 221A 101.527 87.491 -14.851 1.00 16.03 C ATOM 2866 O GLU A 221A 100.412 87.557 -14.320 1.00 15.94 O ATOM 2867 CB GLU A 221A 101.367 86.377 -17.101 1.00 16.78 C ATOM 2868 CG GLU A 221A 101.714 85.211 -18.020 1.00 16.57 C ATOM 2869 CD GLU A 221A 103.210 85.027 -18.205 1.00 16.36 C ATOM 2870 OE1 GLU A 221A 103.835 85.863 -18.892 1.00 16.31 O ATOM 2871 OE2 GLU A 221A 103.759 84.042 -17.667 1.00 16.31 O ATOM 2872 HA GLU A 221A 103.023 86.220 -15.732 1.00 0.00 H ATOM 2873 HB2 GLU A 221A 100.281 86.443 -17.029 1.00 0.00 H ATOM 2874 HB3 GLU A 221A 101.756 87.291 -17.549 1.00 0.00 H ATOM 2875 HG2 GLU A 221A 101.301 84.297 -17.593 1.00 0.00 H ATOM 2876 HG3 GLU A 221A 101.262 85.391 -18.996 1.00 0.00 H ATOM 2877 H GLU A 221A 100.563 84.605 -15.373 1.00 0.00 H ATOM 2878 N PRO A 222 102.431 88.474 -14.698 1.00 16.44 N ATOM 2879 CA PRO A 222 102.049 89.652 -13.911 1.00 15.47 C ATOM 2880 C PRO A 222 100.847 90.350 -14.557 1.00 15.13 C ATOM 2881 O PRO A 222 100.756 90.433 -15.787 1.00 15.38 O ATOM 2882 CB PRO A 222 103.301 90.534 -13.975 1.00 16.90 C ATOM 2883 CG PRO A 222 104.423 89.546 -14.157 1.00 18.40 C ATOM 2884 CD PRO A 222 103.826 88.576 -15.163 1.00 17.09 C ATOM 2885 HA PRO A 222 101.750 89.419 -12.889 1.00 0.00 H ATOM 2886 HD3 PRO A 222 103.878 88.974 -16.177 1.00 0.00 H ATOM 2887 HD2 PRO A 222 104.328 87.609 -15.127 1.00 0.00 H ATOM 2888 HG3 PRO A 222 104.667 89.046 -13.220 1.00 0.00 H ATOM 2889 HG2 PRO A 222 105.316 90.029 -14.553 1.00 0.00 H ATOM 2890 HB2 PRO A 222 103.249 91.223 -14.818 1.00 0.00 H ATOM 2891 HB3 PRO A 222 103.426 91.100 -13.052 1.00 0.00 H ATOM 2892 N GLY A 223 99.909 90.804 -13.729 1.00 14.15 N ATOM 2893 CA GLY A 223 98.733 91.497 -14.228 1.00 13.87 C ATOM 2894 C GLY A 223 97.619 90.615 -14.766 1.00 14.24 C ATOM 2895 O GLY A 223 96.588 91.122 -15.232 1.00 14.14 O ATOM 2896 HA3 GLY A 223 99.052 92.160 -15.032 1.00 0.00 H ATOM 2897 HA2 GLY A 223 98.324 92.091 -13.411 1.00 0.00 H ATOM 2898 H GLY A 223 100.020 90.660 -12.705 1.00 0.00 H ATOM 2899 N ASN A 224 97.784 89.300 -14.658 1.00 13.31 N ATOM 2900 CA ASN A 224 96.780 88.371 -15.161 1.00 12.82 C ATOM 2901 C ASN A 224 96.546 87.245 -14.151 1.00 12.39 C ATOM 2902 O ASN A 224 97.062 86.126 -14.314 1.00 12.38 O ATOM 2903 CB ASN A 224 97.227 87.795 -16.515 1.00 13.78 C ATOM 2904 CG ASN A 224 97.376 88.869 -17.594 1.00 14.37 C ATOM 2905 OD1 ASN A 224 98.475 89.369 -17.840 1.00 18.83 O ATOM 2906 ND2 ASN A 224 96.278 89.223 -18.233 1.00 13.77 N ATOM 2907 HA ASN A 224 95.842 88.908 -15.302 1.00 0.00 H ATOM 2908 HB2 ASN A 224 98.188 87.298 -16.383 1.00 0.00 H ATOM 2909 HB3 ASN A 224 96.486 87.068 -16.847 1.00 0.00 H ATOM 2910 HD22 ASN A 224 95.370 88.776 -17.994 1.00 0.00 H ATOM 2911 HD21 ASN A 224 96.320 89.950 -18.976 1.00 0.00 H ATOM 2912 H ASN A 224 98.644 88.928 -14.207 1.00 0.00 H ATOM 2913 N PRO A 225 95.766 87.525 -13.092 1.00 11.72 N ATOM 2914 CA PRO A 225 95.481 86.518 -12.059 1.00 11.43 C ATOM 2915 C PRO A 225 94.506 85.432 -12.548 1.00 10.31 C ATOM 2916 O PRO A 225 93.840 85.603 -13.569 1.00 10.20 O ATOM 2917 CB PRO A 225 94.887 87.355 -10.921 1.00 11.63 C ATOM 2918 CG PRO A 225 94.148 88.456 -11.657 1.00 11.87 C ATOM 2919 CD PRO A 225 95.111 88.818 -12.781 1.00 12.22 C ATOM 2920 HA PRO A 225 96.366 85.956 -11.762 1.00 0.00 H ATOM 2921 HD3 PRO A 225 94.574 89.204 -13.648 1.00 0.00 H ATOM 2922 HD2 PRO A 225 95.841 89.557 -12.449 1.00 0.00 H ATOM 2923 HG3 PRO A 225 93.966 89.311 -11.005 1.00 0.00 H ATOM 2924 HG2 PRO A 225 93.199 88.095 -12.054 1.00 0.00 H ATOM 2925 HB2 PRO A 225 94.203 86.762 -10.314 1.00 0.00 H ATOM 2926 HB3 PRO A 225 95.672 87.766 -10.286 1.00 0.00 H ATOM 2927 N GLY A 226 94.453 84.305 -11.840 1.00 10.16 N ATOM 2928 CA GLY A 226 93.533 83.248 -12.229 1.00 8.74 C ATOM 2929 C GLY A 226 92.079 83.589 -11.920 1.00 8.06 C ATOM 2930 O GLY A 226 91.805 84.314 -10.960 1.00 8.70 O ATOM 2931 HA3 GLY A 226 93.800 82.338 -11.692 1.00 0.00 H ATOM 2932 HA2 GLY A 226 93.631 83.077 -13.301 1.00 0.00 H ATOM 2933 H GLY A 226 95.068 84.181 -11.011 1.00 0.00 H ATOM 2934 N VAL A 227 91.157 83.083 -12.743 1.00 7.35 N ATOM 2935 CA VAL A 227 89.712 83.285 -12.575 1.00 7.38 C ATOM 2936 C VAL A 227 89.080 81.930 -12.218 1.00 7.55 C ATOM 2937 O VAL A 227 89.428 80.889 -12.799 1.00 7.90 O ATOM 2938 CB VAL A 227 89.044 83.882 -13.841 1.00 7.85 C ATOM 2939 CG1 VAL A 227 87.590 84.253 -13.548 1.00 8.39 C ATOM 2940 CG2 VAL A 227 89.817 85.133 -14.297 1.00 9.00 C ATOM 2941 HA VAL A 227 89.550 84.010 -11.777 1.00 0.00 H ATOM 2942 HB VAL A 227 89.064 83.135 -14.634 1.00 0.00 H ATOM 2943 HG11 VAL A 227 87.043 83.361 -13.243 1.00 0.00 H ATOM 2944 HG12 VAL A 227 87.559 84.991 -12.747 1.00 0.00 H ATOM 2945 HG13 VAL A 227 87.135 84.671 -14.446 1.00 0.00 H ATOM 2946 HG21 VAL A 227 89.807 85.876 -13.499 1.00 0.00 H ATOM 2947 HG22 VAL A 227 90.847 84.859 -14.527 1.00 0.00 H ATOM 2948 HG23 VAL A 227 89.343 85.547 -15.187 1.00 0.00 H ATOM 2949 H VAL A 227 91.481 82.513 -13.550 1.00 0.00 H ATOM 2950 N TYR A 228 88.127 81.968 -11.292 1.00 7.01 N ATOM 2951 CA TYR A 228 87.471 80.781 -10.744 1.00 6.55 C ATOM 2952 C TYR A 228 85.931 80.900 -10.722 1.00 7.50 C ATOM 2953 O TYR A 228 85.389 82.006 -10.564 1.00 7.71 O ATOM 2954 CB TYR A 228 87.986 80.595 -9.297 1.00 6.85 C ATOM 2955 CG TYR A 228 89.494 80.405 -9.200 1.00 5.96 C ATOM 2956 CD1 TYR A 228 90.375 81.502 -9.087 1.00 6.12 C ATOM 2957 CD2 TYR A 228 90.051 79.133 -9.324 1.00 5.97 C ATOM 2958 CE1 TYR A 228 91.785 81.319 -9.118 1.00 7.19 C ATOM 2959 CE2 TYR A 228 91.438 78.941 -9.357 1.00 6.75 C ATOM 2960 CZ TYR A 228 92.305 80.025 -9.260 1.00 7.12 C ATOM 2961 OH TYR A 228 93.664 79.787 -9.347 1.00 8.72 O ATOM 2962 HA TYR A 228 87.710 79.929 -11.381 1.00 0.00 H ATOM 2963 HB3 TYR A 228 87.501 79.718 -8.869 1.00 0.00 H ATOM 2964 HB2 TYR A 228 87.713 81.478 -8.719 1.00 0.00 H ATOM 2965 HD2 TYR A 228 89.392 78.268 -9.397 1.00 0.00 H ATOM 2966 HE2 TYR A 228 91.842 77.934 -9.460 1.00 0.00 H ATOM 2967 HE1 TYR A 228 92.454 82.175 -9.032 1.00 0.00 H ATOM 2968 HD1 TYR A 228 89.968 82.507 -8.974 1.00 0.00 H ATOM 2969 HH TYR A 228 94.154 80.643 -9.262 1.00 0.00 H ATOM 2970 H TYR A 228 87.830 82.899 -10.935 1.00 0.00 H ATOM 2971 N ALA A 229 85.227 79.774 -10.907 1.00 6.30 N ATOM 2972 CA ALA A 229 83.754 79.770 -10.844 1.00 7.11 C ATOM 2973 C ALA A 229 83.341 79.933 -9.364 1.00 7.38 C ATOM 2974 O ALA A 229 83.886 79.261 -8.489 1.00 7.62 O ATOM 2975 CB ALA A 229 83.176 78.463 -11.435 1.00 6.80 C ATOM 2976 HA ALA A 229 83.355 80.592 -11.438 1.00 0.00 H ATOM 2977 HB1 ALA A 229 83.482 78.371 -12.477 1.00 0.00 H ATOM 2978 HB2 ALA A 229 83.552 77.612 -10.868 1.00 0.00 H ATOM 2979 HB3 ALA A 229 82.088 78.489 -11.375 1.00 0.00 H ATOM 2980 H ALA A 229 85.731 78.885 -11.099 1.00 0.00 H ATOM 2981 N LYS A 230 82.375 80.820 -9.102 1.00 7.39 N ATOM 2982 CA LYS A 230 81.913 81.150 -7.740 1.00 7.63 C ATOM 2983 C LYS A 230 80.822 80.184 -7.253 1.00 8.07 C ATOM 2984 O LYS A 230 79.627 80.440 -7.404 1.00 8.00 O ATOM 2985 CB LYS A 230 81.397 82.600 -7.707 1.00 8.47 C ATOM 2986 CG LYS A 230 81.084 83.126 -6.308 1.00 9.26 C ATOM 2987 CD LYS A 230 80.453 84.517 -6.363 1.00 10.91 C ATOM 2988 CE LYS A 230 81.417 85.562 -6.905 1.00 10.94 C ATOM 2989 NZ LYS A 230 80.723 86.863 -7.156 1.00 13.66 N ATOM 2990 HA LYS A 230 82.761 81.046 -7.063 1.00 0.00 H ATOM 2991 HB2 LYS A 230 82.157 83.243 -8.151 1.00 0.00 H ATOM 2992 HB3 LYS A 230 80.486 82.652 -8.303 1.00 0.00 H ATOM 2993 HG2 LYS A 230 80.392 82.441 -5.818 1.00 0.00 H ATOM 2994 HG3 LYS A 230 82.009 83.178 -5.733 1.00 0.00 H ATOM 2995 HD2 LYS A 230 79.575 84.480 -7.008 1.00 0.00 H ATOM 2996 HD3 LYS A 230 80.150 84.806 -5.357 1.00 0.00 H ATOM 2997 HE2 LYS A 230 81.844 85.201 -7.841 1.00 0.00 H ATOM 2998 HE3 LYS A 230 82.215 85.719 -6.180 1.00 0.00 H ATOM 2999 HZ1 LYS A 230 79.963 86.721 -7.852 1.00 0.00 H ATOM 3000 HZ2 LYS A 230 80.318 87.216 -6.266 1.00 0.00 H ATOM 3001 HZ3 LYS A 230 81.407 87.554 -7.525 1.00 0.00 H ATOM 3002 H LYS A 230 81.924 81.305 -9.904 1.00 0.00 H ATOM 3003 N VAL A 231 81.240 79.112 -6.579 1.00 7.95 N ATOM 3004 CA VAL A 231 80.315 78.059 -6.139 1.00 8.45 C ATOM 3005 C VAL A 231 79.112 78.475 -5.277 1.00 9.08 C ATOM 3006 O VAL A 231 77.997 77.972 -5.480 1.00 9.34 O ATOM 3007 CB VAL A 231 81.097 76.882 -5.439 1.00 8.51 C ATOM 3008 CG1 VAL A 231 80.134 75.783 -4.962 1.00 8.41 C ATOM 3009 CG2 VAL A 231 82.154 76.295 -6.392 1.00 7.65 C ATOM 3010 HA VAL A 231 79.859 77.739 -7.076 1.00 0.00 H ATOM 3011 HB VAL A 231 81.604 77.289 -4.564 1.00 0.00 H ATOM 3012 HG11 VAL A 231 79.427 76.206 -4.248 1.00 0.00 H ATOM 3013 HG12 VAL A 231 79.591 75.381 -5.817 1.00 0.00 H ATOM 3014 HG13 VAL A 231 80.703 74.986 -4.484 1.00 0.00 H ATOM 3015 HG21 VAL A 231 81.662 75.912 -7.286 1.00 0.00 H ATOM 3016 HG22 VAL A 231 82.863 77.075 -6.671 1.00 0.00 H ATOM 3017 HG23 VAL A 231 82.683 75.484 -5.891 1.00 0.00 H ATOM 3018 H VAL A 231 82.252 79.019 -6.358 1.00 0.00 H ATOM 3019 N CYS A 232 79.314 79.416 -4.360 1.00 8.58 N ATOM 3020 CA CYS A 232 78.229 79.831 -3.471 1.00 10.60 C ATOM 3021 C CYS A 232 76.942 80.306 -4.164 1.00 12.30 C ATOM 3022 O CYS A 232 75.849 80.041 -3.652 1.00 13.96 O ATOM 3023 CB CYS A 232 78.713 80.854 -2.427 1.00 10.57 C ATOM 3024 SG CYS A 232 79.213 82.471 -3.110 1.00 11.12 S ATOM 3025 HA CYS A 232 77.937 78.911 -2.964 1.00 0.00 H ATOM 3026 HB2 CYS A 232 79.570 80.427 -1.906 1.00 0.00 H ATOM 3027 HB3 CYS A 232 77.904 81.022 -1.716 1.00 0.00 H ATOM 3028 H CYS A 232 80.250 79.860 -4.274 1.00 0.00 H ATOM 3029 N ILE A 233 77.030 80.942 -5.338 1.00 11.72 N ATOM 3030 CA ILE A 233 75.792 81.393 -5.988 1.00 12.38 C ATOM 3031 C ILE A 233 75.054 80.293 -6.775 1.00 11.98 C ATOM 3032 O ILE A 233 73.952 80.531 -7.278 1.00 11.88 O ATOM 3033 CB ILE A 233 75.961 82.668 -6.886 1.00 13.91 C ATOM 3034 CG1 ILE A 233 76.793 82.354 -8.117 1.00 13.58 C ATOM 3035 CG2 ILE A 233 76.544 83.865 -6.080 1.00 13.18 C ATOM 3036 CD1 ILE A 233 76.707 83.438 -9.142 1.00 18.43 C ATOM 3037 HA ILE A 233 75.167 81.669 -5.139 1.00 0.00 H ATOM 3038 HB ILE A 233 74.971 82.972 -7.226 1.00 0.00 H ATOM 3039 HG12 ILE A 233 77.834 82.234 -7.817 1.00 0.00 H ATOM 3040 HG13 ILE A 233 76.434 81.424 -8.557 1.00 0.00 H ATOM 3041 HD11 ILE A 233 75.670 83.560 -9.454 1.00 0.00 H ATOM 3042 HD12 ILE A 233 77.071 84.372 -8.713 1.00 0.00 H ATOM 3043 HD13 ILE A 233 77.318 83.170 -10.004 1.00 0.00 H ATOM 3044 HG21 ILE A 233 75.871 84.110 -5.258 1.00 0.00 H ATOM 3045 HG22 ILE A 233 77.522 83.592 -5.682 1.00 0.00 H ATOM 3046 HG23 ILE A 233 76.646 84.729 -6.737 1.00 0.00 H ATOM 3047 H ILE A 233 77.955 81.113 -5.781 1.00 0.00 H ATOM 3048 N PHE A 234 75.642 79.095 -6.845 1.00 11.24 N ATOM 3049 CA PHE A 234 75.036 77.960 -7.553 1.00 11.71 C ATOM 3050 C PHE A 234 74.337 76.946 -6.607 1.00 12.85 C ATOM 3051 O PHE A 234 73.810 75.919 -7.070 1.00 12.78 O ATOM 3052 CB PHE A 234 76.099 77.214 -8.394 1.00 10.56 C ATOM 3053 CG PHE A 234 76.621 78.002 -9.581 1.00 11.90 C ATOM 3054 CD1 PHE A 234 75.895 78.068 -10.771 1.00 13.24 C ATOM 3055 CD2 PHE A 234 77.851 78.660 -9.516 1.00 11.61 C ATOM 3056 CE1 PHE A 234 76.387 78.779 -11.883 1.00 13.06 C ATOM 3057 CE2 PHE A 234 78.351 79.372 -10.621 1.00 12.02 C ATOM 3058 CZ PHE A 234 77.619 79.431 -11.803 1.00 11.85 C ATOM 3059 HA PHE A 234 74.269 78.387 -8.199 1.00 0.00 H ATOM 3060 HB2 PHE A 234 76.942 76.975 -7.745 1.00 0.00 H ATOM 3061 HB3 PHE A 234 75.655 76.291 -8.766 1.00 0.00 H ATOM 3062 HD2 PHE A 234 78.432 78.621 -8.595 1.00 0.00 H ATOM 3063 HE2 PHE A 234 79.314 79.879 -10.551 1.00 0.00 H ATOM 3064 HZ PHE A 234 78.005 79.982 -12.660 1.00 0.00 H ATOM 3065 HE1 PHE A 234 75.807 78.820 -12.805 1.00 0.00 H ATOM 3066 HD1 PHE A 234 74.932 77.562 -10.841 1.00 0.00 H ATOM 3067 H PHE A 234 76.563 78.961 -6.381 1.00 0.00 H ATOM 3068 N ASN A 235 74.314 77.229 -5.301 1.00 12.90 N ATOM 3069 CA ASN A 235 73.711 76.299 -4.336 1.00 15.24 C ATOM 3070 C ASN A 235 72.321 75.744 -4.681 1.00 15.26 C ATOM 3071 O ASN A 235 72.098 74.541 -4.545 1.00 15.62 O ATOM 3072 CB ASN A 235 73.741 76.862 -2.906 1.00 19.57 C ATOM 3073 CG ASN A 235 75.089 76.608 -2.185 1.00 24.37 C ATOM 3074 OD1 ASN A 235 75.982 75.927 -2.706 1.00 27.54 O ATOM 3075 ND2 ASN A 235 75.231 77.168 -0.980 1.00 26.19 N ATOM 3076 HA ASN A 235 74.361 75.427 -4.403 1.00 0.00 H ATOM 3077 HB2 ASN A 235 73.568 77.937 -2.952 1.00 0.00 H ATOM 3078 HB3 ASN A 235 72.944 76.391 -2.330 1.00 0.00 H ATOM 3079 HD22 ASN A 235 74.458 77.734 -0.575 1.00 0.00 H ATOM 3080 HD21 ASN A 235 76.115 77.038 -0.447 1.00 0.00 H ATOM 3081 H ASN A 235 74.729 78.121 -4.963 1.00 0.00 H ATOM 3082 N ASP A 236 71.398 76.586 -5.144 1.00 15.03 N ATOM 3083 CA ASP A 236 70.059 76.101 -5.504 1.00 16.42 C ATOM 3084 C ASP A 236 70.072 75.088 -6.649 1.00 15.84 C ATOM 3085 O ASP A 236 69.337 74.100 -6.613 1.00 16.31 O ATOM 3086 CB ASP A 236 69.128 77.257 -5.881 1.00 20.01 C ATOM 3087 CG ASP A 236 68.678 78.066 -4.682 1.00 24.08 C ATOM 3088 OD1 ASP A 236 68.721 77.554 -3.541 1.00 27.30 O ATOM 3089 OD2 ASP A 236 68.272 79.230 -4.887 1.00 27.61 O ATOM 3090 HA ASP A 236 69.687 75.598 -4.611 1.00 0.00 H ATOM 3091 HB2 ASP A 236 69.655 77.918 -6.569 1.00 0.00 H ATOM 3092 HB3 ASP A 236 68.247 76.848 -6.375 1.00 0.00 H ATOM 3093 H ASP A 236 71.627 77.595 -5.251 1.00 0.00 H ATOM 3094 N TRP A 237 70.884 75.343 -7.674 1.00 14.74 N ATOM 3095 CA TRP A 237 70.973 74.425 -8.814 1.00 13.94 C ATOM 3096 C TRP A 237 71.642 73.109 -8.397 1.00 13.34 C ATOM 3097 O TRP A 237 71.207 72.024 -8.796 1.00 13.43 O ATOM 3098 CB TRP A 237 71.762 75.062 -9.975 1.00 14.26 C ATOM 3099 CG TRP A 237 71.906 74.142 -11.175 1.00 14.70 C ATOM 3100 CD1 TRP A 237 70.933 73.826 -12.085 1.00 15.48 C ATOM 3101 CD2 TRP A 237 73.082 73.416 -11.577 1.00 15.23 C ATOM 3102 NE1 TRP A 237 71.428 72.947 -13.024 1.00 16.70 N ATOM 3103 CE2 TRP A 237 72.742 72.681 -12.739 1.00 16.27 C ATOM 3104 CE3 TRP A 237 74.386 73.321 -11.073 1.00 15.23 C ATOM 3105 CZ2 TRP A 237 73.665 71.852 -13.403 1.00 16.09 C ATOM 3106 CZ3 TRP A 237 75.302 72.498 -11.733 1.00 16.32 C ATOM 3107 CH2 TRP A 237 74.933 71.776 -12.888 1.00 15.92 C ATOM 3108 HA TRP A 237 69.958 74.217 -9.153 1.00 0.00 H ATOM 3109 HB2 TRP A 237 71.243 75.967 -10.292 1.00 0.00 H ATOM 3110 HB3 TRP A 237 72.758 75.322 -9.616 1.00 0.00 H ATOM 3111 HE1 TRP A 237 70.891 72.549 -13.821 1.00 0.00 H ATOM 3112 HD1 TRP A 237 69.914 74.214 -12.069 1.00 0.00 H ATOM 3113 HZ2 TRP A 237 73.382 71.291 -14.294 1.00 0.00 H ATOM 3114 HH2 TRP A 237 75.672 71.144 -13.381 1.00 0.00 H ATOM 3115 HZ3 TRP A 237 76.319 72.412 -11.349 1.00 0.00 H ATOM 3116 HE3 TRP A 237 74.680 73.878 -10.184 1.00 0.00 H ATOM 3117 H TRP A 237 71.464 76.206 -7.665 1.00 0.00 H ATOM 3118 N LEU A 238 72.699 73.211 -7.598 1.00 12.94 N ATOM 3119 CA LEU A 238 73.435 72.033 -7.133 1.00 14.02 C ATOM 3120 C LEU A 238 72.576 71.077 -6.295 1.00 15.48 C ATOM 3121 O LEU A 238 72.487 69.874 -6.594 1.00 15.48 O ATOM 3122 CB LEU A 238 74.680 72.457 -6.327 1.00 13.66 C ATOM 3123 CG LEU A 238 75.837 73.119 -7.091 1.00 13.56 C ATOM 3124 CD1 LEU A 238 76.840 73.694 -6.110 1.00 14.28 C ATOM 3125 CD2 LEU A 238 76.511 72.113 -8.037 1.00 14.48 C ATOM 3126 HA LEU A 238 73.739 71.490 -8.028 1.00 0.00 H ATOM 3127 HB2 LEU A 238 74.349 73.161 -5.564 1.00 0.00 H ATOM 3128 HB3 LEU A 238 75.077 71.563 -5.847 1.00 0.00 H ATOM 3129 HG LEU A 238 75.438 73.931 -7.699 1.00 0.00 H ATOM 3130 HD21 LEU A 238 76.904 71.278 -7.457 1.00 0.00 H ATOM 3131 HD22 LEU A 238 75.779 71.745 -8.756 1.00 0.00 H ATOM 3132 HD23 LEU A 238 77.327 72.605 -8.567 1.00 0.00 H ATOM 3133 HD11 LEU A 238 76.348 74.439 -5.484 1.00 0.00 H ATOM 3134 HD12 LEU A 238 77.233 72.894 -5.483 1.00 0.00 H ATOM 3135 HD13 LEU A 238 77.657 74.161 -6.660 1.00 0.00 H ATOM 3136 H LEU A 238 73.013 74.155 -7.294 1.00 0.00 H ATOM 3137 N THR A 239 71.917 71.617 -5.273 1.00 16.51 N ATOM 3138 CA THR A 239 71.094 70.793 -4.396 1.00 18.14 C ATOM 3139 C THR A 239 69.871 70.203 -5.100 1.00 18.73 C ATOM 3140 O THR A 239 69.563 69.024 -4.912 1.00 18.94 O ATOM 3141 CB THR A 239 70.683 71.550 -3.105 1.00 18.70 C ATOM 3142 OG1 THR A 239 69.928 72.713 -3.440 1.00 20.79 O ATOM 3143 CG2 THR A 239 71.916 71.976 -2.320 1.00 19.94 C ATOM 3144 HA THR A 239 71.724 69.952 -4.106 1.00 0.00 H ATOM 3145 HB THR A 239 70.079 70.878 -2.495 1.00 0.00 H ATOM 3146 HG1 THR A 239 70.478 73.310 -4.007 1.00 0.00 H ATOM 3147 HG23 THR A 239 72.501 71.094 -2.058 1.00 0.00 H ATOM 3148 HG21 THR A 239 72.520 72.647 -2.931 1.00 0.00 H ATOM 3149 HG22 THR A 239 71.606 72.491 -1.411 1.00 0.00 H ATOM 3150 H THR A 239 71.990 72.640 -5.098 1.00 0.00 H ATOM 3151 N SER A 240 69.206 70.987 -5.948 1.00 18.93 N ATOM 3152 CA SER A 240 68.034 70.480 -6.655 1.00 19.64 C ATOM 3153 C SER A 240 68.417 69.384 -7.644 1.00 19.60 C ATOM 3154 O SER A 240 67.700 68.383 -7.776 1.00 20.02 O ATOM 3155 CB SER A 240 67.266 71.613 -7.354 1.00 21.22 C ATOM 3156 OG SER A 240 68.006 72.176 -8.421 1.00 26.24 O ATOM 3157 HA SER A 240 67.368 70.041 -5.912 1.00 0.00 H ATOM 3158 HB2 SER A 240 67.050 72.394 -6.625 1.00 0.00 H ATOM 3159 HB3 SER A 240 66.330 71.215 -7.746 1.00 0.00 H ATOM 3160 HG SER A 240 68.855 72.547 -8.073 1.00 0.00 H ATOM 3161 H SER A 240 69.524 71.965 -6.107 1.00 0.00 H ATOM 3162 N THR A 241 69.557 69.546 -8.310 1.00 18.44 N ATOM 3163 CA THR A 241 70.023 68.549 -9.269 1.00 18.96 C ATOM 3164 C THR A 241 70.423 67.225 -8.591 1.00 20.44 C ATOM 3165 O THR A 241 70.092 66.148 -9.095 1.00 20.78 O ATOM 3166 CB THR A 241 71.195 69.093 -10.137 1.00 18.57 C ATOM 3167 OG1 THR A 241 70.747 70.238 -10.876 1.00 17.55 O ATOM 3168 CG2 THR A 241 71.702 68.026 -11.122 1.00 18.20 C ATOM 3169 HA THR A 241 69.179 68.338 -9.926 1.00 0.00 H ATOM 3170 HB THR A 241 72.014 69.366 -9.471 1.00 0.00 H ATOM 3171 HG1 THR A 241 70.448 70.940 -10.245 1.00 0.00 H ATOM 3172 HG23 THR A 241 72.044 67.153 -10.566 1.00 0.00 H ATOM 3173 HG21 THR A 241 70.892 67.737 -11.792 1.00 0.00 H ATOM 3174 HG22 THR A 241 72.528 68.434 -11.704 1.00 0.00 H ATOM 3175 H THR A 241 70.127 70.400 -8.144 1.00 0.00 H ATOM 3176 N MET A 242 71.095 67.297 -7.444 1.00 21.25 N ATOM 3177 CA MET A 242 71.511 66.083 -6.741 1.00 23.75 C ATOM 3178 C MET A 242 70.345 65.321 -6.111 1.00 26.20 C ATOM 3179 O MET A 242 70.488 64.147 -5.763 1.00 26.35 O ATOM 3180 CB MET A 242 72.564 66.393 -5.672 1.00 23.11 C ATOM 3181 CG MET A 242 73.906 66.826 -6.245 1.00 23.74 C ATOM 3182 SD MET A 242 75.194 67.055 -5.008 1.00 23.45 S ATOM 3183 CE MET A 242 75.142 68.796 -4.773 1.00 23.65 C ATOM 3184 HA MET A 242 71.947 65.437 -7.503 1.00 0.00 H ATOM 3185 HB2 MET A 242 72.185 67.194 -5.037 1.00 0.00 H ATOM 3186 HB3 MET A 242 72.719 65.497 -5.071 1.00 0.00 H ATOM 3187 HG2 MET A 242 73.765 67.770 -6.772 1.00 0.00 H ATOM 3188 HG3 MET A 242 74.239 66.064 -6.950 1.00 0.00 H ATOM 3189 HE1 MET A 242 75.356 69.295 -5.718 1.00 0.00 H ATOM 3190 HE2 MET A 242 74.151 69.085 -4.424 1.00 0.00 H ATOM 3191 HE3 MET A 242 75.888 69.084 -4.032 1.00 0.00 H ATOM 3192 H MET A 242 71.327 68.228 -7.043 1.00 0.00 H ATOM 3193 N ALA A 243 69.191 65.975 -5.986 1.00 28.05 N ATOM 3194 CA ALA A 243 68.003 65.353 -5.401 1.00 30.67 C ATOM 3195 C ALA A 243 67.367 64.356 -6.364 1.00 32.32 C ATOM 3196 O ALA A 243 66.216 63.961 -6.183 1.00 33.65 O ATOM 3197 CB ALA A 243 66.987 66.418 -4.986 1.00 29.49 C ATOM 3198 HA ALA A 243 68.318 64.806 -4.512 1.00 0.00 H ATOM 3199 HB1 ALA A 243 67.439 67.081 -4.248 1.00 0.00 H ATOM 3200 HB2 ALA A 243 66.689 66.995 -5.861 1.00 0.00 H ATOM 3201 HB3 ALA A 243 66.111 65.934 -4.553 1.00 0.00 H ATOM 3202 H ALA A 243 69.133 66.960 -6.315 1.00 0.00 H ATOM 3203 N SER A 244 68.129 63.950 -7.376 1.00 34.23 N ATOM 3204 CA SER A 244 67.682 62.997 -8.380 1.00 35.92 C ATOM 3205 C SER A 244 68.739 61.902 -8.478 1.00 36.72 C ATOM 3206 O SER A 244 69.938 62.183 -8.409 1.00 36.78 O ATOM 3207 CB SER A 244 67.543 63.690 -9.737 1.00 36.29 C ATOM 3208 OG SER A 244 66.690 64.818 -9.653 1.00 38.14 O ATOM 3209 HA SER A 244 66.713 62.582 -8.102 1.00 0.00 H ATOM 3210 HB2 SER A 244 67.128 62.984 -10.456 1.00 0.00 H ATOM 3211 HB3 SER A 244 68.528 64.013 -10.074 1.00 0.00 H ATOM 3212 HG SER A 244 66.620 65.244 -10.544 1.00 0.00 H ATOM 3213 H SER A 244 69.093 64.333 -7.453 1.00 0.00 H ATOM 3214 N TYR A 245 68.295 60.659 -8.625 1.00 37.74 N ATOM 3215 CA TYR A 245 69.201 59.523 -8.732 1.00 38.77 C ATOM 3216 C TYR A 245 68.708 58.564 -9.809 1.00 38.96 C ATOM 3217 O TYR A 245 67.475 58.419 -9.942 1.00 39.04 O ATOM 3218 CB TYR A 245 69.314 58.795 -7.388 1.00 39.60 C ATOM 3219 CG TYR A 245 70.100 59.551 -6.338 1.00 40.59 C ATOM 3220 CD1 TYR A 245 69.452 60.274 -5.336 1.00 40.89 C ATOM 3221 CD2 TYR A 245 71.493 59.545 -6.347 1.00 40.91 C ATOM 3222 CE1 TYR A 245 70.176 60.972 -4.369 1.00 41.34 C ATOM 3223 CE2 TYR A 245 72.225 60.239 -5.388 1.00 41.35 C ATOM 3224 CZ TYR A 245 71.562 60.950 -4.403 1.00 41.29 C ATOM 3225 OH TYR A 245 72.288 61.636 -3.456 1.00 41.56 O ATOM 3226 HA TYR A 245 70.189 59.891 -9.008 1.00 0.00 H ATOM 3227 OXT TYR A 245 69.558 57.990 -10.520 1.00 39.12 O ATOM 3228 HB3 TYR A 245 69.804 57.836 -7.558 1.00 0.00 H ATOM 3229 HB2 TYR A 245 68.308 58.624 -7.005 1.00 0.00 H ATOM 3230 HD2 TYR A 245 72.020 58.986 -7.120 1.00 0.00 H ATOM 3231 HE2 TYR A 245 73.315 60.223 -5.413 1.00 0.00 H ATOM 3232 HE1 TYR A 245 69.655 61.531 -3.592 1.00 0.00 H ATOM 3233 HD1 TYR A 245 68.363 60.294 -5.308 1.00 0.00 H ATOM 3234 HH TYR A 245 71.668 62.088 -2.830 1.00 0.00 H ATOM 3235 H TYR A 245 67.269 60.491 -8.665 1.00 0.00 H TER 3236 TYR A 245 HETATM 3237 CA CA A 1 98.572 56.210 -7.824 1.00 12.24 CA HETATM 3238 O HOH 2 104.137 73.670 -7.704 1.00 15.81 O HETATM 3239 O HOH 3 104.123 78.396 -2.374 1.00 34.70 O HETATM 3240 O HOH 4 107.456 67.200 -6.362 1.00 33.46 O HETATM 3241 O HOH 5 107.931 70.611 -2.425 1.00 38.12 O HETATM 3242 O HOH 6 99.973 69.765 2.228 1.00 24.54 O HETATM 3243 O HOH 7 92.226 71.110 -2.296 1.00 12.63 O HETATM 3244 O HOH 8 95.247 64.532 -1.184 1.00 11.92 O HETATM 3245 O HOH 9 92.389 71.713 2.466 1.00 41.89 O HETATM 3246 O HOH 10 90.285 61.238 -3.391 1.00 17.42 O HETATM 3247 O HOH 11 88.311 67.066 2.497 1.00 32.40 O HETATM 3248 O HOH 12 92.385 61.163 -6.286 1.00 15.72 O HETATM 3249 O HOH 13 94.405 59.729 -14.258 1.00 12.63 O HETATM 3250 O HOH 14 89.896 55.293 -18.791 1.00 31.70 O HETATM 3251 O HOH 15 98.575 57.675 -20.615 1.00 42.12 O HETATM 3252 O HOH 16 98.299 60.771 -17.723 1.00 26.64 O HETATM 3253 O HOH 17 81.192 49.702 -20.434 1.00 49.96 O HETATM 3254 O HOH 18 90.654 51.426 -15.766 1.00 41.31 O HETATM 3255 O HOH 19 95.923 57.593 -12.566 1.00 11.89 O HETATM 3256 O HOH 20 93.936 62.812 -3.290 1.00 21.86 O HETATM 3257 O HOH 21 97.583 55.468 -9.966 1.00 16.23 O HETATM 3258 O HOH 22 97.447 63.060 -2.139 1.00 12.33 O HETATM 3259 O HOH 23 106.795 59.004 -10.667 1.00 40.92 O HETATM 3260 O HOH 24 105.345 59.193 -5.571 1.00 35.98 O HETATM 3261 O HOH 25 102.789 50.696 -9.421 1.00 26.43 O HETATM 3262 O HOH 26 96.819 52.722 -9.966 1.00 26.28 O HETATM 3263 O HOH 27 97.792 51.980 0.854 1.00 33.95 O HETATM 3264 O HOH 28 103.607 57.763 -3.797 1.00 34.05 O HETATM 3265 O HOH 29 90.376 53.629 -1.089 1.00 19.15 O HETATM 3266 O HOH 30 91.353 51.303 -2.323 1.00 42.76 O HETATM 3267 O HOH 31 88.521 50.562 -7.794 1.00 31.31 O HETATM 3268 O HOH 32 99.409 89.450 -1.562 1.00 40.26 O HETATM 3269 O HOH 33 82.784 51.649 -12.437 1.00 28.06 O HETATM 3270 O HOH 34 74.164 55.943 -10.837 1.00 51.05 O HETATM 3271 O HOH 35 72.408 70.331 -18.916 1.00 33.05 O HETATM 3272 O HOH 36 81.586 72.302 -22.675 1.00 33.12 O HETATM 3273 O HOH 37 75.318 67.811 -20.012 1.00 33.49 O HETATM 3274 O HOH 38 75.076 73.692 -21.244 1.00 26.63 O HETATM 3275 O HOH 39 74.859 76.078 -23.011 1.00 38.46 O HETATM 3276 O HOH 40 84.234 81.228 -15.322 1.00 10.57 O HETATM 3277 O HOH 41 75.998 86.649 -16.806 1.00 21.30 O HETATM 3278 O HOH 42 75.747 83.836 -19.774 1.00 32.77 O HETATM 3279 O HOH 43 75.876 55.617 -7.386 1.00 34.44 O HETATM 3280 O HOH 44 79.748 54.365 0.728 1.00 32.30 O HETATM 3281 O HOH 45 81.688 54.355 2.851 1.00 31.58 O HETATM 3282 O HOH 46 88.158 51.091 2.806 1.00 42.20 O HETATM 3283 O HOH 47 93.077 61.972 4.681 1.00 17.13 O HETATM 3284 O HOH 48 90.262 55.144 8.383 1.00 34.15 O HETATM 3285 O HOH 49 93.721 61.234 -1.014 1.00 37.93 O HETATM 3286 O HOH 50 78.194 72.729 4.394 1.00 38.59 O HETATM 3287 O HOH 51 84.142 87.305 -3.490 1.00 40.85 O HETATM 3288 O HOH 52 88.510 89.790 4.851 1.00 38.82 O HETATM 3289 O HOH 53 84.436 90.818 -0.224 1.00 39.50 O HETATM 3290 O HOH 54 91.314 78.539 4.319 1.00 17.28 O HETATM 3291 O HOH 55 91.826 84.159 5.711 1.00 32.42 O HETATM 3292 O HOH 56 92.958 70.234 -10.130 1.00 8.29 O HETATM 3293 O HOH 57 100.928 65.599 -14.897 1.00 38.22 O HETATM 3294 O HOH 58 100.717 70.657 -10.481 1.00 10.66 O HETATM 3295 O HOH 59 105.335 70.569 -15.590 1.00 30.91 O HETATM 3296 O HOH 60 106.822 75.929 -9.985 1.00 34.41 O HETATM 3297 O HOH 61 115.587 68.481 -13.865 1.00 17.41 O HETATM 3298 O HOH 62 107.217 71.222 -5.535 1.00 38.86 O HETATM 3299 O HOH 63 101.808 78.456 -0.834 1.00 20.18 O HETATM 3300 O HOH 64 92.778 90.471 -1.411 1.00 44.09 O HETATM 3301 O HOH 65 85.690 89.458 -4.205 1.00 26.31 O HETATM 3302 O HOH 66 87.523 88.812 -7.465 1.00 12.32 O HETATM 3303 O HOH 67 85.055 92.530 -3.828 1.00 26.08 O HETATM 3304 O HOH 68 82.210 96.616 -13.907 1.00 32.58 O HETATM 3305 O HOH 69 91.026 98.241 -8.778 1.00 15.19 O HETATM 3306 O HOH 70 87.417 97.887 -11.977 1.00 22.71 O HETATM 3307 O HOH 71 85.798 95.866 -5.274 1.00 20.72 O HETATM 3308 O HOH 72 92.455 92.978 -4.313 1.00 15.78 O HETATM 3309 O HOH 73 94.799 96.456 -10.254 1.00 42.54 O HETATM 3310 O HOH 74 95.879 95.907 -5.216 1.00 24.76 O HETATM 3311 O HOH 75 83.104 92.836 -15.856 1.00 25.85 O HETATM 3312 O HOH 76 89.241 100.282 -14.751 1.00 37.77 O HETATM 3313 O HOH 77 94.494 94.846 -12.295 1.00 27.70 O HETATM 3314 O HOH 78 80.021 92.257 -13.476 1.00 27.83 O HETATM 3315 O HOH 79 76.842 88.806 -14.849 1.00 17.47 O HETATM 3316 O HOH 80 77.901 91.868 -11.688 1.00 25.19 O HETATM 3317 O HOH 81 76.533 84.863 -14.827 1.00 25.35 O HETATM 3318 O HOH 82 81.640 80.821 -13.994 1.00 11.66 O HETATM 3319 O HOH 83 84.637 89.298 -8.070 1.00 26.30 O HETATM 3320 O HOH 84 81.824 88.742 -9.455 1.00 29.11 O HETATM 3321 O HOH 85 97.563 89.085 -3.788 1.00 24.06 O HETATM 3322 O HOH 86 101.684 81.786 -1.227 1.00 40.98 O HETATM 3323 O HOH 87 98.403 90.919 -5.574 1.00 27.04 O HETATM 3324 O HOH 88 97.994 84.482 -9.546 1.00 14.63 O HETATM 3325 O HOH 89 94.458 68.414 -11.822 1.00 9.27 O HETATM 3326 O HOH 90 86.060 71.108 -8.045 1.00 10.29 O HETATM 3327 O HOH 91 83.865 75.154 7.960 1.00 26.88 O HETATM 3328 O HOH 92 85.053 81.823 4.146 1.00 53.89 O HETATM 3329 O HOH 93 84.845 69.973 4.559 1.00 28.26 O HETATM 3330 O HOH 94 90.574 75.317 4.222 1.00 38.40 O HETATM 3331 O HOH 95 83.167 72.077 6.861 1.00 40.03 O HETATM 3332 O HOH 96 80.142 73.588 6.161 1.00 27.04 O HETATM 3333 O HOH 97 81.898 80.683 -3.614 1.00 10.99 O HETATM 3334 O HOH 98 84.184 79.216 3.308 1.00 21.76 O HETATM 3335 O HOH 99 101.951 81.757 -19.588 1.00 32.77 O HETATM 3336 O HOH 100 98.910 87.754 -12.013 1.00 28.97 O HETATM 3337 O HOH 101 98.962 84.962 -12.287 1.00 19.98 O HETATM 3338 O HOH 102 95.427 91.874 -18.356 1.00 21.76 O HETATM 3339 O HOH 103 98.751 84.412 -15.946 1.00 12.21 O HETATM 3340 O HOH 104 95.484 81.782 -9.111 1.00 10.79 O HETATM 3341 O HOH 105 77.889 87.287 -7.227 1.00 18.59 O HETATM 3342 O HOH 106 71.855 79.560 -5.029 1.00 26.07 O HETATM 3343 O HOH 107 71.499 78.533 -8.335 1.00 29.07 O HETATM 3344 O HOH 108 71.601 56.884 -11.810 1.00 44.23 O HETATM 3345 O HOH 109 92.178 79.825 -12.865 1.00 12.16 O HETATM 3346 O HOH 110 95.714 82.610 -15.192 1.00 19.70 O HETATM 3347 C1' PEA A 111 93.935 77.883 -16.731 1.00 -0.04 C HETATM 3348 C6' PEA A 111 94.812 78.233 -17.754 1.00 -0.06 C HETATM 3349 C5' PEA A 111 94.646 77.729 -19.043 1.00 -0.07 C HETATM 3350 C4' PEA A 111 93.585 76.864 -19.316 1.00 -0.07 C HETATM 3351 C3' PEA A 111 92.704 76.511 -18.300 1.00 -0.07 C HETATM 3352 C2' PEA A 111 92.883 77.021 -17.015 1.00 -0.06 C HETATM 3353 H5 PEA A 111 92.193 76.742 -16.227 1.00 0.06 H HETATM 3354 H4 PEA A 111 91.879 75.840 -18.507 1.00 0.06 H HETATM 3355 H3 PEA A 111 93.448 76.469 -20.316 1.00 0.06 H HETATM 3356 H2 PEA A 111 95.338 78.007 -19.830 1.00 0.06 H HETATM 3357 H1 PEA A 111 95.635 78.907 -17.545 1.00 0.06 H HETATM 3358 C2 PEA A 111 94.127 78.420 -15.337 1.00 0.02 C HETATM 3359 C1 PEA A 111 94.660 79.840 -15.293 1.00 -0.03 C HETATM 3360 N PEA A 111 94.893 80.277 -13.897 1.00 0.22 N HETATM 3361 H10 PEA A 111 95.246 81.221 -13.895 1.00 0.20 H HETATM 3362 H11 PEA A 111 95.566 79.666 -13.461 1.00 0.20 H HETATM 3363 H12 PEA A 111 94.026 80.242 -13.385 1.00 0.20 H HETATM 3364 H8 PEA A 111 93.928 80.513 -15.763 1.00 0.08 H HETATM 3365 H9 PEA A 111 95.609 79.885 -15.847 1.00 0.08 H HETATM 3366 H6 PEA A 111 94.838 77.767 -14.809 1.00 0.05 H HETATM 3367 H7 PEA A 111 93.156 78.398 -14.821 1.00 0.05 H CONECT 1 2 19 20 21 CONECT 19 1 CONECT 20 1 CONECT 21 1 CONECT 93 92 2028 CONECT 370 369 586 CONECT 586 370 585 CONECT 773 772 3237 CONECT 800 799 3237 CONECT 855 854 3237 CONECT 889 888 3237 CONECT 1671 1670 3024 CONECT 1753 1752 2657 CONECT 2028 93 2027 CONECT 2197 2196 2399 CONECT 2399 2197 2398 CONECT 2540 2539 2848 CONECT 2657 1753 2656 CONECT 2848 2540 2847 CONECT 3024 1671 3023 CONECT 3237 773 800 855 889 CONECT 3347 3348 3352 3358 CONECT 3348 3347 3349 3357 CONECT 3349 3348 3350 3356 CONECT 3350 3349 3351 3355 CONECT 3351 3350 3352 3354 CONECT 3352 3347 3351 3353 CONECT 3353 3352 CONECT 3354 3351 CONECT 3355 3350 CONECT 3356 3349 CONECT 3357 3348 CONECT 3358 3347 3359 3366 3367 CONECT 3359 3358 3360 3364 3365 CONECT 3360 3359 3361 3362 3363 CONECT 3361 3360 CONECT 3362 3360 CONECT 3363 3360 CONECT 3364 3359 CONECT 3365 3359 CONECT 3366 3358 CONECT 3367 3358 MASTER 0 0 0 0 0 0 0 0 3366 1 42 18 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 1utm
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1utj
RCSB PDB
PDBbind
242aa, >1UTJ_1|Chain... *
1utl
RCSB PDB
PDBbind
242aa, >1UTL_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1tnj
RCSB PDB
PDBbind
PEA
1uto
RCSB PDB
PDBbind
PEA
Entry Information
PDB ID
1utm
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
trypsin i
Ligand Name
PEA
EC.Number
E.C.3.4.21.4
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Kd=0.972mM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
Protein Sci.v13;pp.1056
Ligand Properties
Formula
C
8
H
1
2
N
Molecular Weight
122.188
Exact Mass
122.097
No. of atoms
21
No. of bonds
21
Polar Surface Area
27.64
LOGP Value
1.24 (
Computed with XLOGP3
)
0.47 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 0
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 1
No. of Rings: 1
Canonical SMILES
[NH3+]CCc1ccccc1
InChI String
InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2/p+1
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):
P35031
Entrez Gene ID
NCBI Entrez Gene ID:
100137021
100137022
ASD
Information of known allosteric effects of PDB entries
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