Browse entries in the PDBbind-CN Database
HEADER 4A6S_COMPLEX COMPND 4A6S_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 121 ALA TRP LYS GLY GLU VAL LEU ALA ASN ASN GLU ALA GLY SEQRES 2 A 121 GLN VAL THR SER ILE ILE TYR ASN PRO GLY ASP VAL ILE SEQRES 3 A 121 THR ILE VAL ALA ALA GLY TRP ALA SER TYR GLY PRO THR SEQRES 4 A 121 GLN LYS TRP GLY PRO GLN GLY ASP ARG GLU HIS PRO ASP SEQRES 5 A 121 GLN GLY LEU ILE CYS HIS ASP ALA PHE CYS GLY ALA LEU SEQRES 6 A 121 VAL MET LYS ILE GLY ASN SER GLY THR ILE PRO VAL ASN SEQRES 7 A 121 THR GLY LEU PHE ARG TRP VAL ALA PRO ASN ASN VAL GLN SEQRES 8 A 121 GLY ALA ILE THR LEU ILE TYR ASN ASP VAL PRO GLY THR SEQRES 9 A 121 TYR GLY ASN ASN SER GLY SER PHE SER VAL ASN ILE GLY SEQRES 10 A 121 LYS ASP GLN SER SEQRES 1 B 121 ALA TRP LYS GLY GLU VAL LEU ALA ASN ASN GLU ALA GLY SEQRES 2 B 121 GLN VAL THR SER ILE ILE TYR ASN PRO GLY ASP VAL ILE SEQRES 3 B 121 THR ILE VAL ALA ALA GLY TRP ALA SER TYR GLY PRO THR SEQRES 4 B 121 GLN LYS TRP GLY PRO GLN GLY ASP ARG GLU HIS PRO ASP SEQRES 5 B 121 GLN GLY LEU ILE CYS HIS ASP ALA PHE CYS GLY ALA LEU SEQRES 6 B 121 VAL MET LYS ILE GLY ASN SER GLY THR ILE PRO VAL ASN SEQRES 7 B 121 THR GLY LEU PHE ARG TRP VAL ALA PRO ASN ASN VAL GLN SEQRES 8 B 121 GLY ALA ILE THR LEU ILE TYR ASN ASP VAL PRO GLY THR SEQRES 9 B 121 TYR GLY ASN ASN SER GLY SER PHE SER VAL ASN ILE GLY SEQRES 10 B 121 LYS ASP GLN SER HET CA A 1 1 HET CA A 2 1 HET GS A 9 40 ATOM 1 N ALA A 1 -8.660 12.016 40.252 1.00 39.94 N ATOM 2 CA ALA A 1 -7.982 12.762 41.314 1.00 38.63 C ATOM 3 C ALA A 1 -7.945 11.830 42.515 1.00 38.88 C ATOM 4 O ALA A 1 -8.643 10.842 42.551 1.00 39.85 O ATOM 5 CB ALA A 1 -8.770 14.000 41.652 1.00 39.16 C ATOM 6 HA ALA A 1 -6.982 13.074 41.014 1.00 0.00 H ATOM 7 HB1 ALA A 1 -8.853 14.629 40.766 1.00 0.00 H ATOM 8 HB2 ALA A 1 -9.766 13.714 41.991 1.00 0.00 H ATOM 9 HB3 ALA A 1 -8.259 14.550 42.443 1.00 0.00 H ATOM 10 HN3 ALA A 1 -9.619 11.764 40.565 1.00 0.00 H ATOM 11 HN2 ALA A 1 -8.124 11.150 40.042 1.00 0.00 H ATOM 12 HN1 ALA A 1 -8.716 12.606 39.397 1.00 0.00 H ATOM 13 N TRP A 2 -7.129 12.174 43.502 1.00 38.23 N ATOM 14 CA TRP A 2 -7.051 11.464 44.755 1.00 38.59 C ATOM 15 C TRP A 2 -7.013 12.553 45.794 1.00 38.84 C ATOM 16 O TRP A 2 -6.320 13.554 45.615 1.00 37.66 O ATOM 17 CB TRP A 2 -5.776 10.665 44.783 1.00 37.08 C ATOM 18 CG TRP A 2 -5.484 9.993 46.107 1.00 37.85 C ATOM 19 CD1 TRP A 2 -5.782 8.681 46.485 1.00 38.88 C ATOM 20 CD2 TRP A 2 -4.793 10.575 47.272 1.00 36.98 C ATOM 21 NE1 TRP A 2 -5.349 8.428 47.750 1.00 38.86 N ATOM 22 CE2 TRP A 2 -4.747 9.536 48.279 1.00 37.68 C ATOM 23 CE3 TRP A 2 -4.233 11.830 47.564 1.00 35.99 C ATOM 24 CZ2 TRP A 2 -4.161 9.739 49.510 1.00 37.35 C ATOM 25 CZ3 TRP A 2 -3.644 12.006 48.816 1.00 35.18 C ATOM 26 CH2 TRP A 2 -3.612 10.990 49.755 1.00 36.53 C ATOM 27 HA TRP A 2 -7.878 10.772 44.917 1.00 0.00 H ATOM 28 HB2 TRP A 2 -5.841 9.893 44.016 1.00 0.00 H ATOM 29 HB3 TRP A 2 -4.949 11.336 44.552 1.00 0.00 H ATOM 30 HE1 TRP A 2 -5.460 7.520 48.245 1.00 0.00 H ATOM 31 HD1 TRP A 2 -6.293 7.957 45.851 1.00 0.00 H ATOM 32 HZ2 TRP A 2 -4.130 8.949 50.261 1.00 0.00 H ATOM 33 HH2 TRP A 2 -3.140 11.178 50.719 1.00 0.00 H ATOM 34 HZ3 TRP A 2 -3.197 12.969 49.061 1.00 0.00 H ATOM 35 HE3 TRP A 2 -4.258 12.640 46.835 1.00 0.00 H ATOM 36 H TRP A 2 -6.512 13.000 43.365 1.00 0.00 H ATOM 37 N LYS A 3 -7.775 12.353 46.868 1.00 40.78 N ATOM 38 CA LYS A 3 -7.715 13.150 48.084 1.00 40.68 C ATOM 39 C LYS A 3 -7.576 12.206 49.305 1.00 41.58 C ATOM 40 O LYS A 3 -8.192 11.135 49.342 1.00 42.49 O ATOM 41 CB LYS A 3 -8.997 13.942 48.210 1.00 42.63 C ATOM 42 CG LYS A 3 -8.946 14.842 49.410 1.00 43.84 C ATOM 43 CD LYS A 3 -10.279 15.524 49.678 1.00 46.85 C ATOM 44 CE LYS A 3 -10.124 16.446 50.896 1.00 47.50 C ATOM 45 NZ LYS A 3 -11.450 16.980 51.337 1.00 51.32 N ATOM 46 HA LYS A 3 -6.861 13.826 48.046 1.00 0.00 H ATOM 47 HB2 LYS A 3 -9.134 14.547 47.314 1.00 0.00 H ATOM 48 HB3 LYS A 3 -9.835 13.253 48.314 1.00 0.00 H ATOM 49 HG2 LYS A 3 -8.674 14.248 50.283 1.00 0.00 H ATOM 50 HG3 LYS A 3 -8.188 15.607 49.243 1.00 0.00 H ATOM 51 HD2 LYS A 3 -10.572 16.111 48.808 1.00 0.00 H ATOM 52 HD3 LYS A 3 -11.042 14.772 49.881 1.00 0.00 H ATOM 53 HE2 LYS A 3 -9.474 17.280 50.632 1.00 0.00 H ATOM 54 HE3 LYS A 3 -9.676 15.883 51.715 1.00 0.00 H ATOM 55 HZ1 LYS A 3 -11.880 17.522 50.560 1.00 0.00 H ATOM 56 HZ2 LYS A 3 -12.073 16.188 51.595 1.00 0.00 H ATOM 57 HZ3 LYS A 3 -11.316 17.600 52.161 1.00 0.00 H ATOM 58 H LYS A 3 -8.461 11.572 46.835 1.00 0.00 H ATOM 59 N GLY A 4 -6.784 12.590 50.308 1.00 40.89 N ATOM 60 CA GLY A 4 -6.570 11.716 51.471 1.00 41.12 C ATOM 61 C GLY A 4 -5.664 12.356 52.505 1.00 40.68 C ATOM 62 O GLY A 4 -5.162 13.456 52.270 1.00 40.21 O ATOM 63 HA3 GLY A 4 -6.115 10.785 51.133 1.00 0.00 H ATOM 64 HA2 GLY A 4 -7.534 11.501 51.932 1.00 0.00 H ATOM 65 H GLY A 4 -6.313 13.517 50.267 1.00 0.00 H ATOM 66 N GLU A 5 -5.501 11.714 53.661 1.00 41.35 N ATOM 67 CA GLU A 5 -4.575 12.171 54.698 1.00 41.08 C ATOM 68 C GLU A 5 -3.263 11.436 54.610 1.00 39.87 C ATOM 69 O GLU A 5 -3.224 10.227 54.299 1.00 40.07 O ATOM 70 CB GLU A 5 -5.125 11.939 56.104 1.00 43.92 C ATOM 71 CG GLU A 5 -6.416 12.665 56.413 1.00 47.11 C ATOM 72 CD GLU A 5 -6.251 14.187 56.565 1.00 49.56 C ATOM 73 OE1 GLU A 5 -5.126 14.720 56.876 1.00 48.81 O ATOM 74 OE2 GLU A 5 -7.294 14.874 56.397 1.00 51.47 O ATOM 75 HA GLU A 5 -4.438 13.239 54.526 1.00 0.00 H ATOM 76 HB2 GLU A 5 -5.300 10.870 56.227 1.00 0.00 H ATOM 77 HB3 GLU A 5 -4.372 12.267 56.820 1.00 0.00 H ATOM 78 HG2 GLU A 5 -7.120 12.474 55.603 1.00 0.00 H ATOM 79 HG3 GLU A 5 -6.820 12.268 57.344 1.00 0.00 H ATOM 80 H GLU A 5 -6.055 10.851 53.834 1.00 0.00 H ATOM 81 N VAL A 6 -2.196 12.155 54.926 1.00 37.81 N ATOM 82 CA VAL A 6 -0.856 11.561 55.013 1.00 36.55 C ATOM 83 C VAL A 6 -0.451 11.699 56.470 1.00 37.08 C ATOM 84 O VAL A 6 -0.259 12.802 56.939 1.00 36.40 O ATOM 85 CB VAL A 6 0.132 12.339 54.114 1.00 34.78 C ATOM 86 CG1 VAL A 6 1.570 11.797 54.207 1.00 33.79 C ATOM 87 CG2 VAL A 6 -0.395 12.370 52.670 1.00 34.09 C ATOM 88 HA VAL A 6 -0.849 10.523 54.682 1.00 0.00 H ATOM 89 HB VAL A 6 0.191 13.364 54.479 1.00 0.00 H ATOM 90 HG11 VAL A 6 1.920 11.875 55.236 1.00 0.00 H ATOM 91 HG12 VAL A 6 1.584 10.753 53.895 1.00 0.00 H ATOM 92 HG13 VAL A 6 2.220 12.381 53.555 1.00 0.00 H ATOM 93 HG21 VAL A 6 -0.495 11.350 52.299 1.00 0.00 H ATOM 94 HG22 VAL A 6 -1.367 12.862 52.650 1.00 0.00 H ATOM 95 HG23 VAL A 6 0.305 12.920 52.041 1.00 0.00 H ATOM 96 H VAL A 6 -2.311 13.171 55.118 1.00 0.00 H ATOM 97 N LEU A 7 -0.346 10.598 57.196 1.00 37.83 N ATOM 98 CA LEU A 7 -0.101 10.678 58.613 1.00 38.94 C ATOM 99 C LEU A 7 1.363 10.851 58.867 1.00 38.32 C ATOM 100 O LEU A 7 2.192 10.256 58.173 1.00 38.13 O ATOM 101 CB LEU A 7 -0.647 9.488 59.345 1.00 40.88 C ATOM 102 CG LEU A 7 -2.042 9.582 59.944 1.00 42.57 C ATOM 103 CD1 LEU A 7 -3.110 9.687 58.870 1.00 43.00 C ATOM 104 CD2 LEU A 7 -2.224 8.317 60.756 1.00 44.22 C ATOM 105 HA LEU A 7 -0.629 11.549 59.000 1.00 0.00 H ATOM 106 HB2 LEU A 7 -0.653 8.653 58.644 1.00 0.00 H ATOM 107 HB3 LEU A 7 0.040 9.269 60.162 1.00 0.00 H ATOM 108 HG LEU A 7 -2.143 10.479 60.556 1.00 0.00 H ATOM 109 HD21 LEU A 7 -2.130 7.450 60.102 1.00 0.00 H ATOM 110 HD22 LEU A 7 -1.460 8.272 61.533 1.00 0.00 H ATOM 111 HD23 LEU A 7 -3.212 8.321 61.216 1.00 0.00 H ATOM 112 HD11 LEU A 7 -2.933 10.580 58.270 1.00 0.00 H ATOM 113 HD12 LEU A 7 -3.069 8.804 58.232 1.00 0.00 H ATOM 114 HD13 LEU A 7 -4.091 9.752 59.340 1.00 0.00 H ATOM 115 H LEU A 7 -0.441 9.668 56.740 1.00 0.00 H ATOM 116 N ALA A 8 1.672 11.728 59.826 1.00 38.26 N ATOM 117 CA ALA A 8 3.038 12.074 60.142 1.00 37.67 C ATOM 118 C ALA A 8 3.775 10.891 60.706 1.00 38.76 C ATOM 119 O ALA A 8 4.975 10.777 60.520 1.00 39.68 O ATOM 120 CB ALA A 8 3.102 13.274 61.102 1.00 38.07 C ATOM 121 HA ALA A 8 3.530 12.367 59.214 1.00 0.00 H ATOM 122 HB1 ALA A 8 2.624 14.136 60.637 1.00 0.00 H ATOM 123 HB2 ALA A 8 2.583 13.025 62.028 1.00 0.00 H ATOM 124 HB3 ALA A 8 4.144 13.508 61.320 1.00 0.00 H ATOM 125 H ALA A 8 0.903 12.177 60.363 1.00 0.00 H ATOM 126 N ASN A 9 3.082 9.994 61.388 1.00 39.91 N ATOM 127 CA ASN A 9 3.776 8.850 61.972 1.00 40.85 C ATOM 128 C ASN A 9 3.860 7.634 61.016 1.00 41.64 C ATOM 129 O ASN A 9 4.220 6.528 61.455 1.00 42.90 O ATOM 130 CB ASN A 9 3.080 8.447 63.277 1.00 42.69 C ATOM 131 CG ASN A 9 1.724 7.781 63.025 1.00 43.81 C ATOM 132 OD1 ASN A 9 1.210 7.810 61.896 1.00 42.82 O ATOM 133 ND2 ASN A 9 1.127 7.208 64.079 1.00 45.54 N ATOM 134 HA ASN A 9 4.803 9.160 62.167 1.00 0.00 H ATOM 135 HB2 ASN A 9 3.720 7.749 63.816 1.00 0.00 H ATOM 136 HB3 ASN A 9 2.926 9.339 63.884 1.00 0.00 H ATOM 137 HD22 ASN A 9 1.597 7.208 65.007 1.00 0.00 H ATOM 138 HD21 ASN A 9 0.193 6.763 63.969 1.00 0.00 H ATOM 139 H ASN A 9 2.055 10.103 61.507 1.00 0.00 H ATOM 140 N ASN A 10 3.514 7.838 59.737 1.00 40.81 N ATOM 141 CA ASN A 10 3.451 6.746 58.746 1.00 41.38 C ATOM 142 C ASN A 10 4.792 6.753 58.012 1.00 40.51 C ATOM 143 O ASN A 10 4.983 7.443 57.012 1.00 38.89 O ATOM 144 CB ASN A 10 2.288 6.993 57.776 1.00 41.08 C ATOM 145 CG ASN A 10 2.188 5.927 56.704 1.00 42.07 C ATOM 146 OD1 ASN A 10 3.039 5.025 56.657 1.00 43.24 O ATOM 147 ND2 ASN A 10 1.160 6.030 55.822 1.00 41.04 N ATOM 148 HA ASN A 10 3.278 5.778 59.217 1.00 0.00 H ATOM 149 HB2 ASN A 10 1.357 7.007 58.343 1.00 0.00 H ATOM 150 HB3 ASN A 10 2.434 7.960 57.295 1.00 0.00 H ATOM 151 HD22 ASN A 10 0.475 6.808 55.910 1.00 0.00 H ATOM 152 HD21 ASN A 10 1.057 5.331 55.059 1.00 0.00 H ATOM 153 H ASN A 10 3.281 8.804 59.431 1.00 0.00 H ATOM 154 N GLU A 11 5.741 6.015 58.555 1.00 41.36 N ATOM 155 CA GLU A 11 7.056 5.991 57.992 1.00 41.45 C ATOM 156 C GLU A 11 7.014 5.391 56.558 1.00 42.50 C ATOM 157 O GLU A 11 7.788 5.837 55.708 1.00 41.74 O ATOM 158 CB GLU A 11 7.983 5.167 58.889 1.00 42.25 C ATOM 159 CG GLU A 11 9.429 5.201 58.430 1.00 42.06 C ATOM 160 CD GLU A 11 10.387 4.616 59.473 1.00 43.91 C ATOM 161 OE1 GLU A 11 10.009 3.693 60.271 1.00 46.23 O ATOM 162 OE2 GLU A 11 11.536 5.061 59.467 1.00 42.68 O ATOM 163 HA GLU A 11 7.438 7.010 57.928 1.00 0.00 H ATOM 164 HB2 GLU A 11 7.930 5.564 59.903 1.00 0.00 H ATOM 165 HB3 GLU A 11 7.641 4.132 58.887 1.00 0.00 H ATOM 166 HG2 GLU A 11 9.518 4.624 57.510 1.00 0.00 H ATOM 167 HG3 GLU A 11 9.711 6.236 58.237 1.00 0.00 H ATOM 168 H GLU A 11 5.531 5.446 59.400 1.00 0.00 H ATOM 169 N ALA A 12 6.152 4.377 56.313 1.00 43.67 N ATOM 170 CA ALA A 12 6.018 3.805 54.966 1.00 44.86 C ATOM 171 C ALA A 12 5.375 4.743 53.961 1.00 43.23 C ATOM 172 O ALA A 12 5.450 4.454 52.779 1.00 45.68 O ATOM 173 CB ALA A 12 5.293 2.447 54.975 1.00 45.36 C ATOM 174 HA ALA A 12 7.044 3.645 54.634 1.00 0.00 H ATOM 175 HB1 ALA A 12 5.854 1.741 55.587 1.00 0.00 H ATOM 176 HB2 ALA A 12 4.293 2.573 55.389 1.00 0.00 H ATOM 177 HB3 ALA A 12 5.221 2.068 53.955 1.00 0.00 H ATOM 178 H ALA A 12 5.575 3.997 57.090 1.00 0.00 H ATOM 179 N GLY A 13 4.749 5.833 54.393 1.00 41.64 N ATOM 180 CA GLY A 13 4.146 6.772 53.432 1.00 39.93 C ATOM 181 C GLY A 13 2.779 6.269 52.959 1.00 40.49 C ATOM 182 O GLY A 13 2.477 5.089 53.075 1.00 40.89 O ATOM 183 HA3 GLY A 13 4.806 6.874 52.571 1.00 0.00 H ATOM 184 HA2 GLY A 13 4.023 7.743 53.911 1.00 0.00 H ATOM 185 H GLY A 13 4.685 6.023 55.413 1.00 0.00 H ATOM 186 N GLN A 14 1.968 7.177 52.437 1.00 39.18 N ATOM 187 CA GLN A 14 0.590 6.923 52.055 1.00 39.34 C ATOM 188 C GLN A 14 0.598 6.734 50.553 1.00 39.06 C ATOM 189 O GLN A 14 0.935 7.670 49.805 1.00 37.44 O ATOM 190 CB GLN A 14 -0.247 8.182 52.386 1.00 38.57 C ATOM 191 CG GLN A 14 -1.715 8.111 51.966 1.00 39.12 C ATOM 192 CD GLN A 14 -2.397 6.902 52.554 1.00 41.28 C ATOM 193 OE1 GLN A 14 -2.373 6.694 53.753 1.00 42.59 O ATOM 194 NE2 GLN A 14 -2.966 6.087 51.717 1.00 41.54 N ATOM 195 HA GLN A 14 0.176 6.057 52.572 1.00 0.00 H ATOM 196 HB2 GLN A 14 -0.211 8.339 53.464 1.00 0.00 H ATOM 197 HB3 GLN A 14 0.209 9.034 51.881 1.00 0.00 H ATOM 198 HG2 GLN A 14 -2.227 9.010 52.310 1.00 0.00 H ATOM 199 HG3 GLN A 14 -1.771 8.057 50.879 1.00 0.00 H ATOM 200 HE22 GLN A 14 -2.964 6.302 50.699 1.00 0.00 H ATOM 201 HE21 GLN A 14 -3.423 5.220 52.065 1.00 0.00 H ATOM 202 H GLN A 14 2.343 8.136 52.291 1.00 0.00 H ATOM 203 N VAL A 15 0.256 5.525 50.104 1.00 39.62 N ATOM 204 CA VAL A 15 0.146 5.245 48.683 1.00 39.88 C ATOM 205 C VAL A 15 -1.129 5.922 48.194 1.00 39.61 C ATOM 206 O VAL A 15 -2.144 5.888 48.885 1.00 39.96 O ATOM 207 CB VAL A 15 0.019 3.728 48.433 1.00 42.13 C ATOM 208 CG1 VAL A 15 -0.079 3.441 46.928 1.00 42.80 C ATOM 209 CG2 VAL A 15 1.208 3.011 49.028 1.00 43.13 C ATOM 210 HA VAL A 15 1.032 5.609 48.162 1.00 0.00 H ATOM 211 HB VAL A 15 -0.890 3.365 48.912 1.00 0.00 H ATOM 212 HG11 VAL A 15 -0.956 3.944 46.520 1.00 0.00 H ATOM 213 HG12 VAL A 15 0.818 3.810 46.430 1.00 0.00 H ATOM 214 HG13 VAL A 15 -0.168 2.366 46.769 1.00 0.00 H ATOM 215 HG21 VAL A 15 2.123 3.379 48.563 1.00 0.00 H ATOM 216 HG22 VAL A 15 1.244 3.199 50.101 1.00 0.00 H ATOM 217 HG23 VAL A 15 1.112 1.940 48.848 1.00 0.00 H ATOM 218 H VAL A 15 0.064 4.765 50.788 1.00 0.00 H ATOM 219 N THR A 16 -1.066 6.610 47.056 1.00 39.35 N ATOM 220 CA THR A 16 -2.257 7.251 46.459 1.00 38.99 C ATOM 221 C THR A 16 -2.775 6.421 45.247 1.00 41.14 C ATOM 222 O THR A 16 -2.220 5.404 44.936 1.00 41.86 O ATOM 223 CB THR A 16 -1.945 8.653 45.988 1.00 36.95 C ATOM 224 OG1 THR A 16 -1.101 8.594 44.839 1.00 35.99 O ATOM 225 CG2 THR A 16 -1.261 9.496 47.080 1.00 35.64 C ATOM 226 HA THR A 16 -3.023 7.295 47.233 1.00 0.00 H ATOM 227 HB THR A 16 -2.892 9.134 45.742 1.00 0.00 H ATOM 228 HG1 THR A 16 -0.259 8.130 45.073 1.00 0.00 H ATOM 229 HG23 THR A 16 -1.905 9.542 47.958 1.00 0.00 H ATOM 230 HG21 THR A 16 -0.310 9.037 47.349 1.00 0.00 H ATOM 231 HG22 THR A 16 -1.086 10.504 46.703 1.00 0.00 H ATOM 232 H THR A 16 -0.150 6.699 46.572 1.00 0.00 H ATOM 233 N SER A 17 -3.851 6.881 44.610 1.00 42.47 N ATOM 234 CA SER A 17 -4.395 6.380 43.347 1.00 43.41 C ATOM 235 C SER A 17 -3.561 6.818 42.180 1.00 42.05 C ATOM 236 O SER A 17 -3.716 6.282 41.119 1.00 42.70 O ATOM 237 CB SER A 17 -5.722 7.102 43.034 1.00 44.75 C ATOM 238 OG SER A 17 -6.789 6.651 43.820 1.00 47.85 O ATOM 239 HA SER A 17 -4.461 5.298 43.463 1.00 0.00 H ATOM 240 HB2 SER A 17 -5.969 6.937 41.985 1.00 0.00 H ATOM 241 HB3 SER A 17 -5.587 8.169 43.210 1.00 0.00 H ATOM 242 HG SER A 17 -7.610 7.148 43.576 1.00 0.00 H ATOM 243 H SER A 17 -4.354 7.675 45.054 1.00 0.00 H ATOM 244 N ILE A 18 -2.788 7.884 42.307 1.00 39.69 N ATOM 245 CA ILE A 18 -2.236 8.454 41.100 1.00 38.76 C ATOM 246 C ILE A 18 -1.079 7.606 40.592 1.00 38.98 C ATOM 247 O ILE A 18 -0.194 7.280 41.348 1.00 38.40 O ATOM 248 CB ILE A 18 -1.762 9.906 41.276 1.00 36.88 C ATOM 249 CG1 ILE A 18 -2.867 10.796 41.919 1.00 36.27 C ATOM 250 CG2 ILE A 18 -1.251 10.420 39.931 1.00 36.30 C ATOM 251 CD1 ILE A 18 -4.211 10.843 41.199 1.00 37.16 C ATOM 252 HA ILE A 18 -3.047 8.463 40.372 1.00 0.00 H ATOM 253 HB ILE A 18 -0.933 9.950 41.982 1.00 0.00 H ATOM 254 HG12 ILE A 18 -3.045 10.425 42.928 1.00 0.00 H ATOM 255 HG13 ILE A 18 -2.483 11.815 41.970 1.00 0.00 H ATOM 256 HD11 ILE A 18 -4.068 11.229 40.190 1.00 0.00 H ATOM 257 HD12 ILE A 18 -4.630 9.838 41.149 1.00 0.00 H ATOM 258 HD13 ILE A 18 -4.892 11.495 41.746 1.00 0.00 H ATOM 259 HG21 ILE A 18 -0.422 9.797 39.597 1.00 0.00 H ATOM 260 HG22 ILE A 18 -2.057 10.379 39.198 1.00 0.00 H ATOM 261 HG23 ILE A 18 -0.912 11.450 40.042 1.00 0.00 H ATOM 262 H ILE A 18 -2.585 8.296 43.240 1.00 0.00 H ATOM 263 N ILE A 19 -1.094 7.246 39.312 1.00 40.17 N ATOM 264 CA ILE A 19 0.081 6.609 38.731 1.00 41.98 C ATOM 265 C ILE A 19 0.625 7.683 37.825 1.00 40.60 C ATOM 266 O ILE A 19 -0.070 8.126 36.934 1.00 40.19 O ATOM 267 CB ILE A 19 -0.261 5.350 37.879 1.00 44.48 C ATOM 268 CG1 ILE A 19 -1.157 4.327 38.619 1.00 46.85 C ATOM 269 CG2 ILE A 19 0.977 4.774 37.192 1.00 45.36 C ATOM 270 CD1 ILE A 19 -0.565 3.523 39.771 1.00 49.12 C ATOM 271 HA ILE A 19 0.765 6.257 39.503 1.00 0.00 H ATOM 272 HB ILE A 19 -0.902 5.677 37.060 1.00 0.00 H ATOM 273 HG12 ILE A 19 -2.009 4.878 39.018 1.00 0.00 H ATOM 274 HG13 ILE A 19 -1.506 3.611 37.875 1.00 0.00 H ATOM 275 HD11 ILE A 19 0.278 2.936 39.407 1.00 0.00 H ATOM 276 HD12 ILE A 19 -0.225 4.204 40.551 1.00 0.00 H ATOM 277 HD13 ILE A 19 -1.326 2.856 40.176 1.00 0.00 H ATOM 278 HG21 ILE A 19 1.408 5.527 36.532 1.00 0.00 H ATOM 279 HG22 ILE A 19 1.710 4.488 37.947 1.00 0.00 H ATOM 280 HG23 ILE A 19 0.693 3.898 36.609 1.00 0.00 H ATOM 281 H ILE A 19 -1.938 7.418 38.730 1.00 0.00 H ATOM 282 N TYR A 20 1.843 8.141 38.052 1.00 40.04 N ATOM 283 CA TYR A 20 2.345 9.204 37.173 1.00 39.49 C ATOM 284 C TYR A 20 2.835 8.528 35.904 1.00 40.85 C ATOM 285 O TYR A 20 3.632 7.608 35.979 1.00 42.36 O ATOM 286 CB TYR A 20 3.461 10.025 37.820 1.00 38.35 C ATOM 287 CG TYR A 20 3.921 11.181 36.936 1.00 38.56 C ATOM 288 CD1 TYR A 20 4.841 10.960 35.911 1.00 39.65 C ATOM 289 CD2 TYR A 20 3.410 12.472 37.095 1.00 37.45 C ATOM 290 CE1 TYR A 20 5.250 11.969 35.065 1.00 39.93 C ATOM 291 CE2 TYR A 20 3.836 13.511 36.257 1.00 38.09 C ATOM 292 CZ TYR A 20 4.763 13.240 35.235 1.00 38.94 C ATOM 293 OH TYR A 20 5.207 14.209 34.375 1.00 39.38 O ATOM 294 HA TYR A 20 1.546 9.915 36.963 1.00 0.00 H ATOM 295 HB3 TYR A 20 4.311 9.371 38.011 1.00 0.00 H ATOM 296 HB2 TYR A 20 3.096 10.430 38.764 1.00 0.00 H ATOM 297 HD2 TYR A 20 2.676 12.672 37.875 1.00 0.00 H ATOM 298 HE2 TYR A 20 3.452 14.521 36.396 1.00 0.00 H ATOM 299 HE1 TYR A 20 5.958 11.757 34.264 1.00 0.00 H ATOM 300 HD1 TYR A 20 5.249 9.959 35.775 1.00 0.00 H ATOM 301 HH TYR A 20 5.851 13.812 33.736 1.00 0.00 H ATOM 302 H TYR A 20 2.425 7.762 38.826 1.00 0.00 H ATOM 303 N ASN A 21 2.376 8.982 34.744 1.00 41.32 N ATOM 304 CA ASN A 21 2.799 8.388 33.465 1.00 42.37 C ATOM 305 C ASN A 21 3.597 9.446 32.716 1.00 42.16 C ATOM 306 O ASN A 21 3.315 10.600 32.893 1.00 40.91 O ATOM 307 CB ASN A 21 1.564 7.996 32.681 1.00 43.34 C ATOM 308 CG ASN A 21 0.780 6.897 33.365 1.00 44.02 C ATOM 309 OD1 ASN A 21 1.362 5.936 33.819 1.00 45.12 O ATOM 310 ND2 ASN A 21 -0.538 7.047 33.466 1.00 44.10 N ATOM 311 HA ASN A 21 3.412 7.499 33.614 1.00 0.00 H ATOM 312 HB2 ASN A 21 0.923 8.871 32.574 1.00 0.00 H ATOM 313 HB3 ASN A 21 1.870 7.648 31.694 1.00 0.00 H ATOM 314 HD22 ASN A 21 -0.998 7.888 33.062 1.00 0.00 H ATOM 315 HD21 ASN A 21 -1.108 6.324 33.949 1.00 0.00 H ATOM 316 H ASN A 21 1.703 9.775 34.739 1.00 0.00 H ATOM 317 N PRO A 22 4.589 9.057 31.874 1.00 43.62 N ATOM 318 CA PRO A 22 5.351 10.041 31.091 1.00 43.97 C ATOM 319 C PRO A 22 4.442 11.119 30.449 1.00 43.31 C ATOM 320 O PRO A 22 3.393 10.801 29.896 1.00 43.53 O ATOM 321 CB PRO A 22 5.993 9.190 29.989 1.00 46.09 C ATOM 322 CG PRO A 22 6.077 7.818 30.544 1.00 46.51 C ATOM 323 CD PRO A 22 5.133 7.699 31.713 1.00 45.13 C ATOM 324 HA PRO A 22 6.061 10.588 31.712 1.00 0.00 H ATOM 325 HD3 PRO A 22 4.337 6.986 31.497 1.00 0.00 H ATOM 326 HD2 PRO A 22 5.666 7.386 32.611 1.00 0.00 H ATOM 327 HG3 PRO A 22 7.096 7.620 30.876 1.00 0.00 H ATOM 328 HG2 PRO A 22 5.800 7.096 29.776 1.00 0.00 H ATOM 329 HB2 PRO A 22 5.375 9.201 29.091 1.00 0.00 H ATOM 330 HB3 PRO A 22 6.988 9.565 29.749 1.00 0.00 H ATOM 331 N GLY A 23 4.832 12.385 30.535 1.00 42.80 N ATOM 332 CA GLY A 23 4.019 13.456 29.967 1.00 41.98 C ATOM 333 C GLY A 23 2.861 13.918 30.851 1.00 40.35 C ATOM 334 O GLY A 23 2.218 14.882 30.512 1.00 40.15 O ATOM 335 HA3 GLY A 23 3.605 13.104 29.022 1.00 0.00 H ATOM 336 HA2 GLY A 23 4.667 14.312 29.781 1.00 0.00 H ATOM 337 H GLY A 23 5.727 12.616 31.012 1.00 0.00 H ATOM 338 N ASP A 24 2.575 13.261 31.978 1.00 39.14 N ATOM 339 CA ASP A 24 1.502 13.766 32.841 1.00 38.19 C ATOM 340 C ASP A 24 1.814 15.184 33.348 1.00 37.56 C ATOM 341 O ASP A 24 2.982 15.569 33.552 1.00 37.67 O ATOM 342 CB ASP A 24 1.210 12.814 34.005 1.00 37.45 C ATOM 343 CG ASP A 24 0.369 11.616 33.582 1.00 38.24 C ATOM 344 OD1 ASP A 24 -0.141 11.658 32.474 1.00 39.18 O ATOM 345 OD2 ASP A 24 0.184 10.641 34.358 1.00 38.33 O ATOM 346 HA ASP A 24 0.599 13.819 32.233 1.00 0.00 H ATOM 347 HB2 ASP A 24 2.156 12.453 34.407 1.00 0.00 H ATOM 348 HB3 ASP A 24 0.673 13.362 34.779 1.00 0.00 H ATOM 349 H ASP A 24 3.105 12.405 32.239 1.00 0.00 H ATOM 350 N VAL A 25 0.776 15.982 33.514 1.00 37.31 N ATOM 351 CA VAL A 25 0.947 17.270 34.197 1.00 36.74 C ATOM 352 C VAL A 25 0.139 17.145 35.473 1.00 35.92 C ATOM 353 O VAL A 25 -1.044 16.848 35.415 1.00 36.78 O ATOM 354 CB VAL A 25 0.526 18.459 33.293 1.00 37.41 C ATOM 355 CG1 VAL A 25 0.517 19.781 34.059 1.00 36.89 C ATOM 356 CG2 VAL A 25 1.460 18.569 32.092 1.00 37.97 C ATOM 357 HA VAL A 25 1.989 17.489 34.430 1.00 0.00 H ATOM 358 HB VAL A 25 -0.489 18.261 32.950 1.00 0.00 H ATOM 359 HG11 VAL A 25 -0.188 19.715 34.888 1.00 0.00 H ATOM 360 HG12 VAL A 25 1.516 19.982 34.446 1.00 0.00 H ATOM 361 HG13 VAL A 25 0.217 20.586 33.388 1.00 0.00 H ATOM 362 HG21 VAL A 25 2.480 18.730 32.440 1.00 0.00 H ATOM 363 HG22 VAL A 25 1.414 17.647 31.512 1.00 0.00 H ATOM 364 HG23 VAL A 25 1.151 19.408 31.468 1.00 0.00 H ATOM 365 H VAL A 25 -0.161 15.699 33.162 1.00 0.00 H ATOM 366 N ILE A 26 0.751 17.315 36.634 1.00 35.17 N ATOM 367 CA ILE A 26 -0.041 17.109 37.867 1.00 34.63 C ATOM 368 C ILE A 26 -0.075 18.330 38.773 1.00 34.94 C ATOM 369 O ILE A 26 0.817 19.183 38.708 1.00 35.09 O ATOM 370 CB ILE A 26 0.379 15.882 38.672 1.00 34.15 C ATOM 371 CG1 ILE A 26 1.826 16.014 39.161 1.00 33.86 C ATOM 372 CG2 ILE A 26 0.122 14.584 37.876 1.00 34.10 C ATOM 373 CD1 ILE A 26 2.180 15.005 40.255 1.00 33.20 C ATOM 374 HA ILE A 26 -1.050 16.932 37.496 1.00 0.00 H ATOM 375 HB ILE A 26 -0.241 15.821 39.566 1.00 0.00 H ATOM 376 HG12 ILE A 26 2.495 15.858 38.315 1.00 0.00 H ATOM 377 HG13 ILE A 26 1.969 17.020 39.556 1.00 0.00 H ATOM 378 HD11 ILE A 26 1.524 15.156 41.113 1.00 0.00 H ATOM 379 HD12 ILE A 26 2.050 13.993 39.870 1.00 0.00 H ATOM 380 HD13 ILE A 26 3.217 15.149 40.559 1.00 0.00 H ATOM 381 HG21 ILE A 26 -0.940 14.505 37.646 1.00 0.00 H ATOM 382 HG22 ILE A 26 0.695 14.608 36.949 1.00 0.00 H ATOM 383 HG23 ILE A 26 0.430 13.726 38.473 1.00 0.00 H ATOM 384 H ILE A 26 1.755 17.584 36.678 1.00 0.00 H ATOM 385 N THR A 27 -1.149 18.441 39.554 1.00 34.53 N ATOM 386 CA THR A 27 -1.187 19.405 40.597 1.00 34.60 C ATOM 387 C THR A 27 -1.485 18.790 41.948 1.00 34.54 C ATOM 388 O THR A 27 -2.458 18.055 42.121 1.00 34.72 O ATOM 389 CB THR A 27 -2.170 20.572 40.249 1.00 35.57 C ATOM 390 OG1 THR A 27 -1.570 21.385 39.238 1.00 36.06 O ATOM 391 CG2 THR A 27 -2.427 21.422 41.465 1.00 35.72 C ATOM 392 HA THR A 27 -0.186 19.830 40.677 1.00 0.00 H ATOM 393 HB THR A 27 -3.115 20.154 39.901 1.00 0.00 H ATOM 394 HG1 THR A 27 -1.399 20.835 38.433 1.00 0.00 H ATOM 395 HG23 THR A 27 -2.885 20.812 42.243 1.00 0.00 H ATOM 396 HG21 THR A 27 -1.483 21.829 41.829 1.00 0.00 H ATOM 397 HG22 THR A 27 -3.098 22.239 41.200 1.00 0.00 H ATOM 398 H THR A 27 -1.966 17.817 39.399 1.00 0.00 H ATOM 399 N ILE A 28 -0.636 19.115 42.919 1.00 34.73 N ATOM 400 CA ILE A 28 -0.867 18.786 44.317 1.00 33.82 C ATOM 401 C ILE A 28 -1.030 20.020 45.218 1.00 34.53 C ATOM 402 O ILE A 28 -0.284 21.014 45.083 1.00 33.73 O ATOM 403 CB ILE A 28 0.313 18.014 44.831 1.00 33.42 C ATOM 404 CG1 ILE A 28 0.504 16.720 44.007 1.00 33.28 C ATOM 405 CG2 ILE A 28 0.107 17.662 46.294 1.00 33.45 C ATOM 406 CD1 ILE A 28 1.943 16.293 43.986 1.00 32.61 C ATOM 407 HA ILE A 28 -1.795 18.216 44.353 1.00 0.00 H ATOM 408 HB ILE A 28 1.205 18.633 44.733 1.00 0.00 H ATOM 409 HG12 ILE A 28 -0.096 15.925 44.450 1.00 0.00 H ATOM 410 HG13 ILE A 28 0.171 16.898 42.984 1.00 0.00 H ATOM 411 HD11 ILE A 28 2.548 17.082 43.539 1.00 0.00 H ATOM 412 HD12 ILE A 28 2.281 16.108 45.006 1.00 0.00 H ATOM 413 HD13 ILE A 28 2.041 15.380 43.398 1.00 0.00 H ATOM 414 HG21 ILE A 28 -0.003 18.578 46.875 1.00 0.00 H ATOM 415 HG22 ILE A 28 -0.792 17.054 46.397 1.00 0.00 H ATOM 416 HG23 ILE A 28 0.969 17.102 46.657 1.00 0.00 H ATOM 417 H ILE A 28 0.233 19.628 42.667 1.00 0.00 H ATOM 418 N VAL A 29 -2.004 19.954 46.134 1.00 34.88 N ATOM 419 CA VAL A 29 -2.164 20.960 47.192 1.00 35.40 C ATOM 420 C VAL A 29 -2.205 20.218 48.534 1.00 35.64 C ATOM 421 O VAL A 29 -2.935 19.211 48.685 1.00 35.80 O ATOM 422 CB VAL A 29 -3.436 21.784 47.003 1.00 36.78 C ATOM 423 CG1 VAL A 29 -3.647 22.755 48.173 1.00 37.83 C ATOM 424 CG2 VAL A 29 -3.346 22.550 45.690 1.00 37.50 C ATOM 425 HA VAL A 29 -1.329 21.660 47.158 1.00 0.00 H ATOM 426 HB VAL A 29 -4.291 21.108 46.976 1.00 0.00 H ATOM 427 HG11 VAL A 29 -3.732 22.190 49.101 1.00 0.00 H ATOM 428 HG12 VAL A 29 -2.798 23.435 48.237 1.00 0.00 H ATOM 429 HG13 VAL A 29 -4.560 23.327 48.009 1.00 0.00 H ATOM 430 HG21 VAL A 29 -2.481 23.212 45.716 1.00 0.00 H ATOM 431 HG22 VAL A 29 -3.241 21.845 44.866 1.00 0.00 H ATOM 432 HG23 VAL A 29 -4.252 23.139 45.552 1.00 0.00 H ATOM 433 H VAL A 29 -2.674 19.159 46.095 1.00 0.00 H ATOM 434 N ALA A 30 -1.396 20.693 49.482 1.00 35.45 N ATOM 435 CA ALA A 30 -1.236 20.077 50.814 1.00 35.31 C ATOM 436 C ALA A 30 -1.556 21.104 51.855 1.00 36.33 C ATOM 437 O ALA A 30 -1.003 22.158 51.825 1.00 36.20 O ATOM 438 CB ALA A 30 0.196 19.638 51.001 1.00 34.72 C ATOM 439 HA ALA A 30 -1.899 19.217 50.902 1.00 0.00 H ATOM 440 HB1 ALA A 30 0.455 18.911 50.232 1.00 0.00 H ATOM 441 HB2 ALA A 30 0.854 20.504 50.921 1.00 0.00 H ATOM 442 HB3 ALA A 30 0.310 19.184 51.985 1.00 0.00 H ATOM 443 H ALA A 30 -0.845 21.549 49.270 1.00 0.00 H ATOM 444 N ALA A 31 -2.424 20.764 52.808 1.00 37.82 N ATOM 445 CA ALA A 31 -2.792 21.632 53.938 1.00 38.33 C ATOM 446 C ALA A 31 -2.664 20.904 55.295 1.00 38.64 C ATOM 447 O ALA A 31 -2.585 19.651 55.329 1.00 37.13 O ATOM 448 CB ALA A 31 -4.206 22.118 53.756 1.00 39.53 C ATOM 449 HA ALA A 31 -2.101 22.475 53.950 1.00 0.00 H ATOM 450 HB1 ALA A 31 -4.278 22.681 52.825 1.00 0.00 H ATOM 451 HB2 ALA A 31 -4.881 21.263 53.718 1.00 0.00 H ATOM 452 HB3 ALA A 31 -4.478 22.761 54.593 1.00 0.00 H ATOM 453 H ALA A 31 -2.869 19.826 52.749 1.00 0.00 H ATOM 454 N GLY A 32 -2.596 21.686 56.388 1.00 38.68 N ATOM 455 CA GLY A 32 -2.650 21.161 57.781 1.00 39.29 C ATOM 456 C GLY A 32 -1.398 21.205 58.630 1.00 38.18 C ATOM 457 O GLY A 32 -0.386 21.776 58.241 1.00 37.10 O ATOM 458 HA3 GLY A 32 -2.957 20.117 57.718 1.00 0.00 H ATOM 459 HA2 GLY A 32 -3.414 21.732 58.308 1.00 0.00 H ATOM 460 H GLY A 32 -2.501 22.713 56.253 1.00 0.00 H ATOM 461 N TRP A 33 -1.469 20.543 59.786 1.00 38.86 N ATOM 462 CA TRP A 33 -0.440 20.598 60.830 1.00 38.32 C ATOM 463 C TRP A 33 0.015 19.268 61.364 1.00 38.27 C ATOM 464 O TRP A 33 -0.799 18.400 61.695 1.00 39.06 O ATOM 465 CB TRP A 33 -1.022 21.327 61.983 1.00 39.85 C ATOM 466 CG TRP A 33 -1.567 22.619 61.541 1.00 40.60 C ATOM 467 CD1 TRP A 33 -2.883 22.936 61.257 1.00 41.78 C ATOM 468 CD2 TRP A 33 -0.795 23.814 61.254 1.00 40.48 C ATOM 469 NE1 TRP A 33 -2.987 24.248 60.886 1.00 43.01 N ATOM 470 CE2 TRP A 33 -1.765 24.834 60.860 1.00 42.32 C ATOM 471 CE3 TRP A 33 0.564 24.153 61.341 1.00 39.99 C ATOM 472 CZ2 TRP A 33 -1.375 26.151 60.573 1.00 43.15 C ATOM 473 CZ3 TRP A 33 0.954 25.476 61.026 1.00 40.99 C ATOM 474 CH2 TRP A 33 0.004 26.448 60.662 1.00 42.48 C ATOM 475 HA TRP A 33 0.428 21.070 60.369 1.00 0.00 H ATOM 476 HB2 TRP A 33 -1.821 20.729 62.422 1.00 0.00 H ATOM 477 HB3 TRP A 33 -0.247 21.499 62.730 1.00 0.00 H ATOM 478 HE1 TRP A 33 -3.880 24.729 60.656 1.00 0.00 H ATOM 479 HD1 TRP A 33 -3.719 22.239 61.320 1.00 0.00 H ATOM 480 HZ2 TRP A 33 -2.104 26.912 60.294 1.00 0.00 H ATOM 481 HH2 TRP A 33 0.342 27.461 60.442 1.00 0.00 H ATOM 482 HZ3 TRP A 33 2.009 25.747 61.066 1.00 0.00 H ATOM 483 HE3 TRP A 33 1.304 23.412 61.645 1.00 0.00 H ATOM 484 H TRP A 33 -2.306 19.951 59.958 1.00 0.00 H ATOM 485 N ALA A 34 1.320 19.117 61.515 1.00 37.43 N ATOM 486 CA ALA A 34 1.881 17.835 61.959 1.00 38.01 C ATOM 487 C ALA A 34 3.133 18.177 62.715 1.00 38.10 C ATOM 488 O ALA A 34 3.572 19.352 62.661 1.00 38.46 O ATOM 489 CB ALA A 34 2.180 16.912 60.789 1.00 35.90 C ATOM 490 HA ALA A 34 1.170 17.293 62.583 1.00 0.00 H ATOM 491 HB1 ALA A 34 1.259 16.711 60.242 1.00 0.00 H ATOM 492 HB2 ALA A 34 2.901 17.390 60.126 1.00 0.00 H ATOM 493 HB3 ALA A 34 2.593 15.975 61.163 1.00 0.00 H ATOM 494 H ALA A 34 1.956 19.916 61.317 1.00 0.00 H ATOM 495 N SER A 35 3.648 17.198 63.454 1.00 37.78 N ATOM 496 CA SER A 35 4.879 17.367 64.203 1.00 38.46 C ATOM 497 C SER A 35 5.734 16.111 64.101 1.00 38.30 C ATOM 498 O SER A 35 5.211 14.972 64.180 1.00 38.60 O ATOM 499 CB SER A 35 4.594 17.683 65.677 1.00 40.11 C ATOM 500 OG SER A 35 5.791 17.558 66.426 1.00 41.12 O ATOM 501 HA SER A 35 5.420 18.209 63.771 1.00 0.00 H ATOM 502 HB2 SER A 35 3.850 16.985 66.061 1.00 0.00 H ATOM 503 HB3 SER A 35 4.215 18.701 65.764 1.00 0.00 H ATOM 504 HG SER A 35 5.607 17.762 67.377 1.00 0.00 H ATOM 505 H SER A 35 3.153 16.284 63.496 1.00 0.00 H ATOM 506 N TYR A 36 7.035 16.319 63.908 1.00 37.71 N ATOM 507 CA TYR A 36 8.001 15.258 64.059 1.00 38.21 C ATOM 508 C TYR A 36 8.353 14.918 65.549 1.00 39.50 C ATOM 509 O TYR A 36 9.346 14.251 65.816 1.00 39.98 O ATOM 510 CB TYR A 36 9.242 15.619 63.285 1.00 37.31 C ATOM 511 CG TYR A 36 9.828 16.964 63.684 1.00 37.43 C ATOM 512 CD1 TYR A 36 9.305 18.154 63.205 1.00 37.24 C ATOM 513 CD2 TYR A 36 10.934 17.033 64.527 1.00 38.14 C ATOM 514 CE1 TYR A 36 9.868 19.390 63.581 1.00 37.55 C ATOM 515 CE2 TYR A 36 11.491 18.244 64.911 1.00 38.76 C ATOM 516 CZ TYR A 36 10.952 19.420 64.439 1.00 38.38 C ATOM 517 OH TYR A 36 11.555 20.605 64.785 1.00 39.41 O ATOM 518 HA TYR A 36 7.547 14.350 63.662 1.00 0.00 H ATOM 519 HB3 TYR A 36 8.992 15.651 62.225 1.00 0.00 H ATOM 520 HB2 TYR A 36 9.994 14.849 63.457 1.00 0.00 H ATOM 521 HD2 TYR A 36 11.376 16.107 64.896 1.00 0.00 H ATOM 522 HE2 TYR A 36 12.350 18.265 65.582 1.00 0.00 H ATOM 523 HE1 TYR A 36 9.450 20.320 63.196 1.00 0.00 H ATOM 524 HD1 TYR A 36 8.449 18.134 62.530 1.00 0.00 H ATOM 525 HH TYR A 36 11.060 21.358 64.375 1.00 0.00 H ATOM 526 H TYR A 36 7.363 17.269 63.642 1.00 0.00 H ATOM 527 N GLY A 37 7.524 15.351 66.512 1.00 41.24 N ATOM 528 CA GLY A 37 7.764 14.981 67.936 1.00 42.90 C ATOM 529 C GLY A 37 7.497 16.085 68.960 1.00 44.18 C ATOM 530 O GLY A 37 6.652 15.929 69.870 1.00 45.00 O ATOM 531 HA3 GLY A 37 8.807 14.678 68.033 1.00 0.00 H ATOM 532 HA2 GLY A 37 7.118 14.137 68.177 1.00 0.00 H ATOM 533 H GLY A 37 6.710 15.948 66.263 1.00 0.00 H ATOM 534 N PRO A 38 8.205 17.219 68.815 1.00 44.22 N ATOM 535 CA PRO A 38 7.958 18.410 69.592 1.00 45.20 C ATOM 536 C PRO A 38 6.490 18.772 69.672 1.00 46.05 C ATOM 537 O PRO A 38 5.684 18.322 68.860 1.00 44.86 O ATOM 538 CB PRO A 38 8.707 19.483 68.821 1.00 44.36 C ATOM 539 CG PRO A 38 9.847 18.780 68.216 1.00 43.34 C ATOM 540 CD PRO A 38 9.289 17.430 67.835 1.00 43.29 C ATOM 541 HA PRO A 38 8.276 18.285 70.627 1.00 0.00 H ATOM 542 HD3 PRO A 38 8.898 17.442 66.817 1.00 0.00 H ATOM 543 HD2 PRO A 38 10.050 16.654 67.922 1.00 0.00 H ATOM 544 HG3 PRO A 38 10.661 18.674 68.933 1.00 0.00 H ATOM 545 HG2 PRO A 38 10.207 19.312 67.336 1.00 0.00 H ATOM 546 HB2 PRO A 38 8.071 19.918 68.051 1.00 0.00 H ATOM 547 HB3 PRO A 38 9.052 20.269 69.492 1.00 0.00 H ATOM 548 N THR A 39 6.179 19.567 70.691 1.00 48.26 N ATOM 549 CA THR A 39 4.840 20.092 70.971 1.00 50.67 C ATOM 550 C THR A 39 4.311 21.032 69.894 1.00 49.72 C ATOM 551 O THR A 39 3.112 21.102 69.654 1.00 49.80 O ATOM 552 CB THR A 39 4.880 20.976 72.249 1.00 54.04 C ATOM 553 OG1 THR A 39 5.998 20.592 73.070 1.00 55.20 O ATOM 554 CG2 THR A 39 3.542 20.914 73.015 1.00 55.86 C ATOM 555 HA THR A 39 4.207 19.208 71.052 1.00 0.00 H ATOM 556 HB THR A 39 5.018 22.017 71.958 1.00 0.00 H ATOM 557 HG1 THR A 39 6.838 20.714 72.560 1.00 0.00 H ATOM 558 HG23 THR A 39 2.731 21.213 72.351 1.00 0.00 H ATOM 559 HG21 THR A 39 3.371 19.895 73.364 1.00 0.00 H ATOM 560 HG22 THR A 39 3.582 21.590 73.869 1.00 0.00 H ATOM 561 H THR A 39 6.946 19.837 71.340 1.00 0.00 H ATOM 562 N GLN A 40 5.190 21.833 69.310 1.00 49.72 N ATOM 563 CA GLN A 40 4.737 22.731 68.279 1.00 49.83 C ATOM 564 C GLN A 40 4.340 21.843 67.052 1.00 47.70 C ATOM 565 O GLN A 40 4.663 20.655 67.010 1.00 45.88 O ATOM 566 CB GLN A 40 5.807 23.793 67.967 1.00 51.95 C ATOM 567 CG GLN A 40 5.382 24.776 66.854 1.00 54.77 C ATOM 568 CD GLN A 40 6.425 25.844 66.404 1.00 56.18 C ATOM 569 OE1 GLN A 40 6.086 26.778 65.644 1.00 55.49 O ATOM 570 NE2 GLN A 40 7.682 25.705 66.871 1.00 57.98 N ATOM 571 HA GLN A 40 3.866 23.308 68.591 1.00 0.00 H ATOM 572 HB2 GLN A 40 6.006 24.362 68.875 1.00 0.00 H ATOM 573 HB3 GLN A 40 6.718 23.285 67.651 1.00 0.00 H ATOM 574 HG2 GLN A 40 5.120 24.184 65.977 1.00 0.00 H ATOM 575 HG3 GLN A 40 4.499 25.309 67.208 1.00 0.00 H ATOM 576 HE22 GLN A 40 7.918 24.912 67.501 1.00 0.00 H ATOM 577 HE21 GLN A 40 8.416 26.391 66.601 1.00 0.00 H ATOM 578 H GLN A 40 6.191 21.814 69.591 1.00 0.00 H ATOM 579 N LYS A 41 3.569 22.417 66.125 1.00 46.47 N ATOM 580 CA LYS A 41 3.249 21.811 64.832 1.00 44.46 C ATOM 581 C LYS A 41 3.646 22.751 63.732 1.00 43.08 C ATOM 582 O LYS A 41 3.667 23.991 63.926 1.00 43.81 O ATOM 583 CB LYS A 41 1.757 21.509 64.715 1.00 45.43 C ATOM 584 CG LYS A 41 1.388 20.244 65.467 1.00 46.21 C ATOM 585 CD LYS A 41 -0.109 20.005 65.582 1.00 48.03 C ATOM 586 CE LYS A 41 -0.391 18.477 65.591 1.00 47.81 C ATOM 587 NZ LYS A 41 -0.067 17.863 66.906 1.00 49.39 N ATOM 588 HA LYS A 41 3.799 20.873 64.750 1.00 0.00 H ATOM 589 HB2 LYS A 41 1.192 22.345 65.128 1.00 0.00 H ATOM 590 HB3 LYS A 41 1.502 21.384 63.663 1.00 0.00 H ATOM 591 HG2 LYS A 41 1.832 19.395 64.947 1.00 0.00 H ATOM 592 HG3 LYS A 41 1.803 20.310 66.473 1.00 0.00 H ATOM 593 HD2 LYS A 41 -0.478 20.448 66.507 1.00 0.00 H ATOM 594 HD3 LYS A 41 -0.617 20.463 64.733 1.00 0.00 H ATOM 595 HE2 LYS A 41 0.216 18.001 64.820 1.00 0.00 H ATOM 596 HE3 LYS A 41 -1.446 18.311 65.375 1.00 0.00 H ATOM 597 HZ1 LYS A 41 0.940 18.011 67.117 1.00 0.00 H ATOM 598 HZ2 LYS A 41 -0.647 18.307 67.647 1.00 0.00 H ATOM 599 HZ3 LYS A 41 -0.269 16.843 66.870 1.00 0.00 H ATOM 600 H LYS A 41 3.171 23.354 66.335 1.00 0.00 H ATOM 601 N TRP A 42 3.952 22.154 62.590 1.00 41.44 N ATOM 602 CA TRP A 42 4.370 22.851 61.359 1.00 40.90 C ATOM 603 C TRP A 42 3.525 22.410 60.197 1.00 39.34 C ATOM 604 O TRP A 42 2.996 21.304 60.197 1.00 38.05 O ATOM 605 CB TRP A 42 5.792 22.461 61.063 1.00 40.30 C ATOM 606 CG TRP A 42 6.735 22.971 62.099 1.00 41.44 C ATOM 607 CD1 TRP A 42 7.436 24.150 62.066 1.00 42.16 C ATOM 608 CD2 TRP A 42 7.128 22.323 63.367 1.00 42.35 C ATOM 609 NE1 TRP A 42 8.217 24.286 63.174 1.00 43.54 N ATOM 610 CE2 TRP A 42 8.088 23.224 63.993 1.00 43.16 C ATOM 611 CE3 TRP A 42 6.822 21.114 63.996 1.00 42.17 C ATOM 612 CZ2 TRP A 42 8.669 22.951 65.223 1.00 44.01 C ATOM 613 CZ3 TRP A 42 7.417 20.841 65.245 1.00 42.90 C ATOM 614 CH2 TRP A 42 8.327 21.736 65.831 1.00 44.23 C ATOM 615 HA TRP A 42 4.265 23.927 61.501 1.00 0.00 H ATOM 616 HB2 TRP A 42 5.860 21.374 61.029 1.00 0.00 H ATOM 617 HB3 TRP A 42 6.076 22.872 60.094 1.00 0.00 H ATOM 618 HE1 TRP A 42 8.832 25.103 63.363 1.00 0.00 H ATOM 619 HD1 TRP A 42 7.376 24.881 61.260 1.00 0.00 H ATOM 620 HZ2 TRP A 42 9.360 23.650 65.695 1.00 0.00 H ATOM 621 HH2 TRP A 42 8.781 21.478 66.788 1.00 0.00 H ATOM 622 HZ3 TRP A 42 7.166 19.917 65.766 1.00 0.00 H ATOM 623 HE3 TRP A 42 6.141 20.400 63.533 1.00 0.00 H ATOM 624 H TRP A 42 3.893 21.116 62.559 1.00 0.00 H ATOM 625 N GLY A 43 3.386 23.285 59.208 1.00 39.44 N ATOM 626 CA GLY A 43 2.711 22.937 57.943 1.00 38.44 C ATOM 627 C GLY A 43 3.543 22.063 56.987 1.00 37.38 C ATOM 628 O GLY A 43 4.710 21.710 57.267 1.00 36.78 O ATOM 629 HA3 GLY A 43 2.461 23.863 57.426 1.00 0.00 H ATOM 630 HA2 GLY A 43 1.794 22.399 58.184 1.00 0.00 H ATOM 631 H GLY A 43 3.765 24.246 59.329 1.00 0.00 H ATOM 632 N PRO A 44 2.957 21.730 55.820 1.00 36.38 N ATOM 633 CA PRO A 44 3.603 20.951 54.781 1.00 34.90 C ATOM 634 C PRO A 44 5.050 21.374 54.398 1.00 34.38 C ATOM 635 O PRO A 44 5.798 20.550 53.866 1.00 32.97 O ATOM 636 CB PRO A 44 2.662 21.131 53.586 1.00 35.14 C ATOM 637 CG PRO A 44 1.340 21.428 54.164 1.00 36.03 C ATOM 638 CD PRO A 44 1.608 22.185 55.424 1.00 37.05 C ATOM 639 HA PRO A 44 3.746 19.926 55.124 1.00 0.00 H ATOM 640 HD3 PRO A 44 1.597 23.260 55.243 1.00 0.00 H ATOM 641 HD2 PRO A 44 0.873 21.939 56.190 1.00 0.00 H ATOM 642 HG3 PRO A 44 0.804 20.504 54.382 1.00 0.00 H ATOM 643 HG2 PRO A 44 0.751 22.033 53.475 1.00 0.00 H ATOM 644 HB2 PRO A 44 2.997 21.957 52.958 1.00 0.00 H ATOM 645 HB3 PRO A 44 2.622 20.218 52.992 1.00 0.00 H ATOM 646 N GLN A 45 5.421 22.635 54.612 1.00 34.83 N ATOM 647 CA GLN A 45 6.811 23.089 54.415 1.00 35.31 C ATOM 648 C GLN A 45 7.824 22.507 55.455 1.00 35.77 C ATOM 649 O GLN A 45 9.040 22.662 55.283 1.00 37.21 O ATOM 650 CB GLN A 45 6.878 24.649 54.340 1.00 36.22 C ATOM 651 CG GLN A 45 6.273 25.160 53.040 1.00 36.00 C ATOM 652 CD GLN A 45 6.367 26.659 52.807 1.00 38.36 C ATOM 653 OE1 GLN A 45 6.352 27.112 51.648 1.00 38.69 O ATOM 654 NE2 GLN A 45 6.395 27.442 53.875 1.00 38.69 N ATOM 655 HA GLN A 45 7.132 22.682 53.456 1.00 0.00 H ATOM 656 HB2 GLN A 45 6.326 25.070 55.180 1.00 0.00 H ATOM 657 HB3 GLN A 45 7.920 24.964 54.397 1.00 0.00 H ATOM 658 HG2 GLN A 45 6.783 24.661 52.216 1.00 0.00 H ATOM 659 HG3 GLN A 45 5.218 24.886 53.032 1.00 0.00 H ATOM 660 HE22 GLN A 45 6.407 27.023 54.827 1.00 0.00 H ATOM 661 HE21 GLN A 45 6.405 28.476 53.762 1.00 0.00 H ATOM 662 H GLN A 45 4.708 23.322 54.928 1.00 0.00 H ATOM 663 N GLY A 46 7.350 21.879 56.538 1.00 35.49 N ATOM 664 CA GLY A 46 8.240 21.493 57.665 1.00 35.55 C ATOM 665 C GLY A 46 8.749 22.691 58.532 1.00 37.20 C ATOM 666 O GLY A 46 8.209 23.821 58.502 1.00 37.26 O ATOM 667 HA3 GLY A 46 9.108 20.979 57.252 1.00 0.00 H ATOM 668 HA2 GLY A 46 7.690 20.812 58.315 1.00 0.00 H ATOM 669 H GLY A 46 6.336 21.656 56.592 1.00 0.00 H ATOM 670 N ASP A 47 9.841 22.409 59.254 1.00 38.11 N ATOM 671 CA ASP A 47 10.468 23.310 60.183 1.00 39.15 C ATOM 672 C ASP A 47 11.827 23.838 59.702 1.00 39.61 C ATOM 673 O ASP A 47 12.851 23.183 59.809 1.00 38.51 O ATOM 674 CB ASP A 47 10.614 22.580 61.502 1.00 40.05 C ATOM 675 CG ASP A 47 11.270 23.411 62.557 1.00 41.37 C ATOM 676 OD1 ASP A 47 11.486 24.613 62.309 1.00 42.10 O ATOM 677 OD2 ASP A 47 11.594 22.821 63.614 1.00 42.14 O ATOM 678 HA ASP A 47 9.838 24.193 60.285 1.00 0.00 H ATOM 679 HB2 ASP A 47 9.623 22.292 61.852 1.00 0.00 H ATOM 680 HB3 ASP A 47 11.215 21.685 61.340 1.00 0.00 H ATOM 681 H ASP A 47 10.267 21.468 59.134 1.00 0.00 H ATOM 682 N ARG A 48 11.822 25.084 59.263 1.00 40.22 N ATOM 683 CA ARG A 48 12.933 25.624 58.569 1.00 41.25 C ATOM 684 C ARG A 48 14.080 25.776 59.543 1.00 42.88 C ATOM 685 O ARG A 48 15.199 26.078 59.146 1.00 43.76 O ATOM 686 CB ARG A 48 12.518 26.973 57.974 1.00 41.71 C ATOM 687 CG ARG A 48 12.299 28.001 59.063 1.00 44.05 C ATOM 688 CD ARG A 48 11.563 29.186 58.531 1.00 45.71 C ATOM 689 NE ARG A 48 12.361 29.997 57.627 1.00 46.90 N ATOM 690 CZ ARG A 48 13.199 30.934 58.051 1.00 50.40 C ATOM 691 NH1 ARG A 48 13.363 31.117 59.360 1.00 51.18 N ATOM 692 NH2 ARG A 48 13.869 31.698 57.178 1.00 52.42 N ATOM 693 HA ARG A 48 13.256 24.971 57.758 1.00 0.00 H ATOM 694 HB2 ARG A 48 13.303 27.324 57.304 1.00 0.00 H ATOM 695 HB3 ARG A 48 11.593 26.846 57.412 1.00 0.00 H ATOM 696 HG2 ARG A 48 11.719 27.551 59.868 1.00 0.00 H ATOM 697 HG3 ARG A 48 13.265 28.324 59.450 1.00 0.00 H ATOM 698 HD2 ARG A 48 11.252 29.807 59.371 1.00 0.00 H ATOM 699 HD3 ARG A 48 10.681 28.835 57.995 1.00 0.00 H ATOM 700 HE ARG A 48 12.271 29.836 56.603 1.00 0.00 H ATOM 701 HH12 ARG A 48 14.017 31.848 59.705 1.00 0.00 H ATOM 702 HH11 ARG A 48 12.837 30.529 60.037 1.00 0.00 H ATOM 703 HH22 ARG A 48 14.523 32.429 57.522 1.00 0.00 H ATOM 704 HH21 ARG A 48 13.735 31.560 56.156 1.00 0.00 H ATOM 705 H ARG A 48 10.986 25.680 59.430 1.00 0.00 H ATOM 706 N GLU A 49 13.808 25.604 60.833 1.00 44.04 N ATOM 707 CA GLU A 49 14.874 25.812 61.805 1.00 46.02 C ATOM 708 C GLU A 49 15.534 24.525 62.215 1.00 44.94 C ATOM 709 O GLU A 49 16.628 24.547 62.750 1.00 46.40 O ATOM 710 CB GLU A 49 14.401 26.600 63.018 1.00 48.33 C ATOM 711 CG GLU A 49 13.420 27.697 62.685 1.00 50.69 C ATOM 712 CD GLU A 49 13.348 28.729 63.778 1.00 55.35 C ATOM 713 OE1 GLU A 49 13.707 28.410 64.938 1.00 57.25 O ATOM 714 OE2 GLU A 49 12.962 29.886 63.486 1.00 59.90 O ATOM 715 HA GLU A 49 15.629 26.414 61.300 1.00 0.00 H ATOM 716 HB2 GLU A 49 13.922 25.909 63.712 1.00 0.00 H ATOM 717 HB3 GLU A 49 15.271 27.050 63.497 1.00 0.00 H ATOM 718 HG2 GLU A 49 13.733 28.182 61.760 1.00 0.00 H ATOM 719 HG3 GLU A 49 12.432 27.258 62.547 1.00 0.00 H ATOM 720 H GLU A 49 12.854 25.327 61.142 1.00 0.00 H ATOM 721 N HIS A 50 14.911 23.388 61.941 1.00 43.31 N ATOM 722 CA HIS A 50 15.460 22.111 62.422 1.00 42.54 C ATOM 723 C HIS A 50 16.502 21.535 61.493 1.00 42.51 C ATOM 724 O HIS A 50 16.256 21.433 60.321 1.00 42.17 O ATOM 725 CB HIS A 50 14.330 21.138 62.625 1.00 41.04 C ATOM 726 CG HIS A 50 14.704 19.909 63.420 1.00 41.34 C ATOM 727 ND1 HIS A 50 15.012 19.954 64.739 1.00 41.70 N ATOM 728 CD2 HIS A 50 14.788 18.557 63.041 1.00 40.29 C ATOM 729 CE1 HIS A 50 15.264 18.708 65.187 1.00 41.71 C ATOM 730 NE2 HIS A 50 15.143 17.853 64.143 1.00 41.23 N ATOM 731 HA HIS A 50 15.969 22.298 63.368 1.00 0.00 H ATOM 732 HB2 HIS A 50 13.526 21.653 63.150 1.00 0.00 H ATOM 733 HB3 HIS A 50 13.975 20.817 61.646 1.00 0.00 H ATOM 734 HD2 HIS A 50 14.602 18.151 62.046 1.00 0.00 H ATOM 735 HE1 HIS A 50 15.520 18.436 66.211 1.00 0.00 H ATOM 736 H HIS A 50 14.032 23.399 61.385 1.00 0.00 H ATOM 737 N PRO A 51 17.684 21.129 62.006 1.00 44.05 N ATOM 738 CA PRO A 51 18.770 20.673 61.149 1.00 44.49 C ATOM 739 C PRO A 51 18.415 19.315 60.579 1.00 43.27 C ATOM 740 O PRO A 51 17.549 18.630 61.143 1.00 42.13 O ATOM 741 CB PRO A 51 19.937 20.494 62.118 1.00 46.33 C ATOM 742 CG PRO A 51 19.527 21.225 63.382 1.00 47.39 C ATOM 743 CD PRO A 51 18.048 20.934 63.419 1.00 45.43 C ATOM 744 HA PRO A 51 18.980 21.355 60.325 1.00 0.00 H ATOM 745 HD3 PRO A 51 17.849 19.913 63.746 1.00 0.00 H ATOM 746 HD2 PRO A 51 17.519 21.632 64.068 1.00 0.00 H ATOM 747 HG3 PRO A 51 19.723 22.295 63.307 1.00 0.00 H ATOM 748 HG2 PRO A 51 20.036 20.824 64.259 1.00 0.00 H ATOM 749 HB2 PRO A 51 20.102 19.437 62.325 1.00 0.00 H ATOM 750 HB3 PRO A 51 20.847 20.928 61.704 1.00 0.00 H ATOM 751 N ASP A 52 19.086 18.943 59.486 1.00 42.77 N ATOM 752 CA ASP A 52 18.850 17.671 58.809 1.00 42.16 C ATOM 753 C ASP A 52 19.738 16.614 59.476 1.00 43.12 C ATOM 754 O ASP A 52 20.954 16.635 59.322 1.00 44.90 O ATOM 755 CB ASP A 52 19.135 17.833 57.295 1.00 41.75 C ATOM 756 CG ASP A 52 19.028 16.529 56.501 1.00 41.82 C ATOM 757 OD1 ASP A 52 18.978 15.426 57.120 1.00 41.28 O ATOM 758 OD2 ASP A 52 19.036 16.624 55.239 1.00 41.57 O ATOM 759 HA ASP A 52 17.812 17.350 58.897 1.00 0.00 H ATOM 760 HB2 ASP A 52 18.419 18.545 56.885 1.00 0.00 H ATOM 761 HB3 ASP A 52 20.145 18.226 57.176 1.00 0.00 H ATOM 762 H ASP A 52 19.807 19.586 59.101 1.00 0.00 H ATOM 763 N GLN A 53 19.139 15.714 60.245 1.00 42.83 N ATOM 764 CA GLN A 53 19.919 14.704 60.967 1.00 44.03 C ATOM 765 C GLN A 53 19.829 13.302 60.319 1.00 44.11 C ATOM 766 O GLN A 53 19.797 12.252 61.037 1.00 44.73 O ATOM 767 CB GLN A 53 19.479 14.670 62.430 1.00 43.87 C ATOM 768 CG GLN A 53 20.658 14.656 63.387 1.00 45.76 C ATOM 769 CD GLN A 53 21.559 15.871 63.165 1.00 46.85 C ATOM 770 OE1 GLN A 53 21.058 16.982 62.909 1.00 45.83 O ATOM 771 NE2 GLN A 53 22.891 15.673 63.263 1.00 48.55 N ATOM 772 HA GLN A 53 20.969 14.991 60.912 1.00 0.00 H ATOM 773 HB2 GLN A 53 18.872 15.552 62.634 1.00 0.00 H ATOM 774 HB3 GLN A 53 18.882 13.773 62.596 1.00 0.00 H ATOM 775 HG2 GLN A 53 20.286 14.670 64.411 1.00 0.00 H ATOM 776 HG3 GLN A 53 21.238 13.747 63.225 1.00 0.00 H ATOM 777 HE22 GLN A 53 23.261 14.725 63.479 1.00 0.00 H ATOM 778 HE21 GLN A 53 23.547 16.468 63.123 1.00 0.00 H ATOM 779 H GLN A 53 18.103 15.725 60.337 1.00 0.00 H ATOM 780 N GLY A 54 19.811 13.306 58.984 1.00 42.80 N ATOM 781 CA GLY A 54 19.564 12.104 58.162 1.00 43.32 C ATOM 782 C GLY A 54 18.099 11.883 57.757 1.00 41.29 C ATOM 783 O GLY A 54 17.523 10.807 57.981 1.00 41.42 O ATOM 784 HA3 GLY A 54 19.893 11.233 58.729 1.00 0.00 H ATOM 785 HA2 GLY A 54 20.157 12.189 57.252 1.00 0.00 H ATOM 786 H GLY A 54 19.981 14.208 58.495 1.00 0.00 H ATOM 787 N LEU A 55 17.499 12.901 57.153 1.00 39.45 N ATOM 788 CA LEU A 55 16.104 12.840 56.715 1.00 38.01 C ATOM 789 C LEU A 55 16.009 12.081 55.385 1.00 38.56 C ATOM 790 O LEU A 55 16.939 12.148 54.565 1.00 38.97 O ATOM 791 CB LEU A 55 15.585 14.271 56.498 1.00 36.59 C ATOM 792 CG LEU A 55 15.580 15.237 57.699 1.00 36.17 C ATOM 793 CD1 LEU A 55 15.329 16.647 57.191 1.00 36.08 C ATOM 794 CD2 LEU A 55 14.479 14.819 58.644 1.00 35.17 C ATOM 795 HA LEU A 55 15.511 12.329 57.474 1.00 0.00 H ATOM 796 HB2 LEU A 55 16.202 14.724 55.722 1.00 0.00 H ATOM 797 HB3 LEU A 55 14.557 14.191 56.143 1.00 0.00 H ATOM 798 HG LEU A 55 16.536 15.211 58.222 1.00 0.00 H ATOM 799 HD21 LEU A 55 13.521 14.863 58.126 1.00 0.00 H ATOM 800 HD22 LEU A 55 14.662 13.800 58.985 1.00 0.00 H ATOM 801 HD23 LEU A 55 14.462 15.493 59.500 1.00 0.00 H ATOM 802 HD11 LEU A 55 16.119 16.927 56.494 1.00 0.00 H ATOM 803 HD12 LEU A 55 14.365 16.683 56.683 1.00 0.00 H ATOM 804 HD13 LEU A 55 15.323 17.339 58.033 1.00 0.00 H ATOM 805 H LEU A 55 18.040 13.773 56.985 1.00 0.00 H ATOM 806 N ILE A 56 14.882 11.395 55.167 1.00 38.23 N ATOM 807 CA ILE A 56 14.597 10.680 53.913 1.00 39.17 C ATOM 808 C ILE A 56 14.627 11.603 52.704 1.00 39.02 C ATOM 809 O ILE A 56 14.702 11.134 51.615 1.00 40.11 O ATOM 810 CB ILE A 56 13.227 9.944 53.932 1.00 38.43 C ATOM 811 CG1 ILE A 56 12.048 10.927 54.208 1.00 36.46 C ATOM 812 CG2 ILE A 56 13.269 8.815 54.948 1.00 38.70 C ATOM 813 CD1 ILE A 56 10.686 10.352 53.755 1.00 35.86 C ATOM 814 HA ILE A 56 15.394 9.941 53.830 1.00 0.00 H ATOM 815 HB ILE A 56 13.046 9.517 52.945 1.00 0.00 H ATOM 816 HG12 ILE A 56 12.004 11.131 55.278 1.00 0.00 H ATOM 817 HG13 ILE A 56 12.233 11.857 53.670 1.00 0.00 H ATOM 818 HD11 ILE A 56 10.716 10.152 52.684 1.00 0.00 H ATOM 819 HD12 ILE A 56 10.487 9.426 54.294 1.00 0.00 H ATOM 820 HD13 ILE A 56 9.899 11.075 53.969 1.00 0.00 H ATOM 821 HG21 ILE A 56 14.055 8.111 54.675 1.00 0.00 H ATOM 822 HG22 ILE A 56 13.474 9.225 55.937 1.00 0.00 H ATOM 823 HG23 ILE A 56 12.308 8.302 54.959 1.00 0.00 H ATOM 824 H ILE A 56 14.169 11.365 55.924 1.00 0.00 H ATOM 825 N CYS A 57 14.563 12.904 52.903 1.00 38.96 N ATOM 826 CA CYS A 57 14.705 13.842 51.819 1.00 39.43 C ATOM 827 C CYS A 57 15.575 14.956 52.335 1.00 39.61 C ATOM 828 O CYS A 57 15.203 15.649 53.282 1.00 39.24 O ATOM 829 CB CYS A 57 13.335 14.399 51.395 1.00 38.73 C ATOM 830 SG CYS A 57 13.365 15.389 49.862 1.00 41.31 S ATOM 831 HA CYS A 57 15.143 13.361 50.945 1.00 0.00 H ATOM 832 HB2 CYS A 57 12.959 15.029 52.201 1.00 0.00 H ATOM 833 HB3 CYS A 57 12.657 13.559 51.245 1.00 0.00 H ATOM 834 HG CYS A 57 13.822 14.608 48.821 1.00 0.00 H ATOM 835 H CYS A 57 14.406 13.263 53.867 1.00 0.00 H ATOM 836 N HIS A 58 16.737 15.137 51.726 1.00 41.18 N ATOM 837 CA HIS A 58 17.662 16.172 52.161 1.00 42.59 C ATOM 838 C HIS A 58 17.355 17.485 51.514 1.00 42.86 C ATOM 839 O HIS A 58 17.989 18.473 51.793 1.00 43.78 O ATOM 840 CB HIS A 58 19.093 15.765 51.845 1.00 44.51 C ATOM 841 CG HIS A 58 19.537 14.512 52.562 1.00 45.17 C ATOM 842 ND1 HIS A 58 19.443 14.371 53.911 1.00 44.36 N ATOM 843 CD2 HIS A 58 20.089 13.313 52.071 1.00 46.75 C ATOM 844 CE1 HIS A 58 19.906 13.157 54.267 1.00 45.62 C ATOM 845 NE2 HIS A 58 20.311 12.509 53.138 1.00 47.24 N ATOM 846 HA HIS A 58 17.548 16.288 53.239 1.00 0.00 H ATOM 847 HB2 HIS A 58 19.174 15.595 50.771 1.00 0.00 H ATOM 848 HB3 HIS A 58 19.756 16.581 52.134 1.00 0.00 H ATOM 849 HD2 HIS A 58 20.298 13.076 51.028 1.00 0.00 H ATOM 850 HE1 HIS A 58 19.949 12.761 55.282 1.00 0.00 H ATOM 851 H HIS A 58 16.993 14.528 50.922 1.00 0.00 H ATOM 852 N ASP A 59 16.377 17.519 50.624 1.00 42.56 N ATOM 853 CA ASP A 59 16.086 18.752 49.896 1.00 42.35 C ATOM 854 C ASP A 59 14.823 19.378 50.435 1.00 40.39 C ATOM 855 O ASP A 59 14.265 20.275 49.820 1.00 40.60 O ATOM 856 CB ASP A 59 15.867 18.468 48.399 1.00 43.26 C ATOM 857 CG ASP A 59 17.084 17.930 47.729 1.00 46.35 C ATOM 858 OD1 ASP A 59 18.146 18.564 47.791 1.00 48.12 O ATOM 859 OD2 ASP A 59 16.979 16.831 47.142 1.00 48.77 O ATOM 860 HA ASP A 59 16.937 19.421 50.024 1.00 0.00 H ATOM 861 HB2 ASP A 59 15.062 17.740 48.296 1.00 0.00 H ATOM 862 HB3 ASP A 59 15.580 19.397 47.906 1.00 0.00 H ATOM 863 H ASP A 59 15.813 16.665 50.442 1.00 0.00 H ATOM 864 N ALA A 60 14.321 18.862 51.536 1.00 39.14 N ATOM 865 CA ALA A 60 13.211 19.527 52.215 1.00 37.72 C ATOM 866 C ALA A 60 13.470 19.502 53.733 1.00 37.45 C ATOM 867 O ALA A 60 14.246 18.681 54.226 1.00 37.21 O ATOM 868 CB ALA A 60 11.891 18.839 51.866 1.00 36.26 C ATOM 869 HA ALA A 60 13.139 20.564 51.886 1.00 0.00 H ATOM 870 HB1 ALA A 60 11.732 18.887 50.789 1.00 0.00 H ATOM 871 HB2 ALA A 60 11.931 17.797 52.183 1.00 0.00 H ATOM 872 HB3 ALA A 60 11.073 19.345 52.379 1.00 0.00 H ATOM 873 H ALA A 60 14.714 17.981 51.923 1.00 0.00 H ATOM 874 N PHE A 61 12.840 20.422 54.465 1.00 37.01 N ATOM 875 CA PHE A 61 12.929 20.446 55.939 1.00 36.91 C ATOM 876 C PHE A 61 12.318 19.231 56.617 1.00 36.10 C ATOM 877 O PHE A 61 11.356 18.605 56.101 1.00 35.61 O ATOM 878 CB PHE A 61 12.276 21.698 56.502 1.00 37.09 C ATOM 879 CG PHE A 61 12.913 22.975 56.026 1.00 38.06 C ATOM 880 CD1 PHE A 61 14.275 23.164 56.167 1.00 39.14 C ATOM 881 CD2 PHE A 61 12.160 23.948 55.413 1.00 38.39 C ATOM 882 CE1 PHE A 61 14.885 24.315 55.735 1.00 40.69 C ATOM 883 CE2 PHE A 61 12.755 25.133 54.958 1.00 39.93 C ATOM 884 CZ PHE A 61 14.128 25.325 55.125 1.00 41.00 C ATOM 885 HA PHE A 61 13.997 20.437 56.156 1.00 0.00 H ATOM 886 HB2 PHE A 61 11.227 21.704 56.204 1.00 0.00 H ATOM 887 HB3 PHE A 61 12.344 21.663 57.589 1.00 0.00 H ATOM 888 HD2 PHE A 61 11.089 23.797 55.279 1.00 0.00 H ATOM 889 HE2 PHE A 61 12.149 25.900 54.476 1.00 0.00 H ATOM 890 HZ PHE A 61 14.604 26.246 54.786 1.00 0.00 H ATOM 891 HE1 PHE A 61 15.959 24.444 55.866 1.00 0.00 H ATOM 892 HD1 PHE A 61 14.877 22.383 56.631 1.00 0.00 H ATOM 893 H PHE A 61 12.268 21.145 53.983 1.00 0.00 H ATOM 894 N CYS A 62 12.873 18.904 57.777 1.00 36.23 N ATOM 895 CA CYS A 62 12.232 17.971 58.691 1.00 36.53 C ATOM 896 C CYS A 62 10.755 18.393 58.861 1.00 36.27 C ATOM 897 O CYS A 62 10.450 19.577 59.016 1.00 36.71 O ATOM 898 CB CYS A 62 12.922 17.995 60.050 1.00 36.87 C ATOM 899 SG CYS A 62 12.271 16.662 61.077 1.00 36.28 S ATOM 900 HA CYS A 62 12.300 16.961 58.286 1.00 0.00 H ATOM 901 HB2 CYS A 62 12.736 18.953 60.536 1.00 0.00 H ATOM 902 HB3 CYS A 62 13.995 17.860 59.916 1.00 0.00 H ATOM 903 HG CYS A 62 12.896 16.684 62.307 1.00 0.00 H ATOM 904 H CYS A 62 13.787 19.324 58.039 1.00 0.00 H ATOM 905 N GLY A 63 9.827 17.447 58.802 1.00 35.66 N ATOM 906 CA GLY A 63 8.423 17.834 58.847 1.00 35.37 C ATOM 907 C GLY A 63 7.761 18.331 57.557 1.00 34.77 C ATOM 908 O GLY A 63 6.571 18.619 57.545 1.00 34.85 O ATOM 909 HA3 GLY A 63 8.332 18.632 59.584 1.00 0.00 H ATOM 910 HA2 GLY A 63 7.859 16.964 59.184 1.00 0.00 H ATOM 911 H GLY A 63 10.097 16.446 58.725 1.00 0.00 H ATOM 912 N ALA A 64 8.493 18.403 56.446 1.00 35.26 N ATOM 913 CA ALA A 64 7.843 18.758 55.168 1.00 35.01 C ATOM 914 C ALA A 64 7.101 17.557 54.506 1.00 34.86 C ATOM 915 O ALA A 64 7.458 16.399 54.750 1.00 33.82 O ATOM 916 CB ALA A 64 8.885 19.309 54.209 1.00 34.91 C ATOM 917 HA ALA A 64 7.087 19.512 55.389 1.00 0.00 H ATOM 918 HB1 ALA A 64 9.344 20.197 54.644 1.00 0.00 H ATOM 919 HB2 ALA A 64 9.650 18.553 54.032 1.00 0.00 H ATOM 920 HB3 ALA A 64 8.406 19.571 53.266 1.00 0.00 H ATOM 921 H ALA A 64 9.515 18.211 56.478 1.00 0.00 H ATOM 922 N LEU A 65 6.107 17.838 53.640 1.00 34.78 N ATOM 923 CA LEU A 65 5.594 16.738 52.773 1.00 34.16 C ATOM 924 C LEU A 65 6.519 16.474 51.578 1.00 34.04 C ATOM 925 O LEU A 65 6.907 17.426 50.862 1.00 33.45 O ATOM 926 CB LEU A 65 4.192 17.052 52.269 1.00 34.04 C ATOM 927 CG LEU A 65 3.522 15.938 51.463 1.00 33.44 C ATOM 928 CD1 LEU A 65 3.301 14.664 52.283 1.00 33.17 C ATOM 929 CD2 LEU A 65 2.211 16.499 50.953 1.00 33.17 C ATOM 930 HA LEU A 65 5.564 15.839 53.389 1.00 0.00 H ATOM 931 HB2 LEU A 65 3.564 17.267 53.133 1.00 0.00 H ATOM 932 HB3 LEU A 65 4.252 17.937 51.635 1.00 0.00 H ATOM 933 HG LEU A 65 4.170 15.636 50.640 1.00 0.00 H ATOM 934 HD21 LEU A 65 1.590 16.794 51.799 1.00 0.00 H ATOM 935 HD22 LEU A 65 2.409 17.368 50.325 1.00 0.00 H ATOM 936 HD23 LEU A 65 1.694 15.737 50.369 1.00 0.00 H ATOM 937 HD11 LEU A 65 4.262 14.289 52.636 1.00 0.00 H ATOM 938 HD12 LEU A 65 2.662 14.889 53.137 1.00 0.00 H ATOM 939 HD13 LEU A 65 2.823 13.910 51.658 1.00 0.00 H ATOM 940 H LEU A 65 5.708 18.797 53.578 1.00 0.00 H ATOM 941 N VAL A 66 6.900 15.208 51.373 1.00 33.35 N ATOM 942 CA VAL A 66 7.638 14.798 50.172 1.00 33.42 C ATOM 943 C VAL A 66 6.922 13.610 49.472 1.00 33.98 C ATOM 944 O VAL A 66 5.923 13.080 49.999 1.00 32.96 O ATOM 945 CB VAL A 66 9.085 14.381 50.509 1.00 34.22 C ATOM 946 CG1 VAL A 66 9.820 15.502 51.222 1.00 34.74 C ATOM 947 CG2 VAL A 66 9.136 13.071 51.316 1.00 34.68 C ATOM 948 HA VAL A 66 7.667 15.659 49.504 1.00 0.00 H ATOM 949 HB VAL A 66 9.596 14.189 49.566 1.00 0.00 H ATOM 950 HG11 VAL A 66 9.849 16.382 50.580 1.00 0.00 H ATOM 951 HG12 VAL A 66 9.300 15.744 52.149 1.00 0.00 H ATOM 952 HG13 VAL A 66 10.837 15.182 51.448 1.00 0.00 H ATOM 953 HG21 VAL A 66 8.592 13.201 52.252 1.00 0.00 H ATOM 954 HG22 VAL A 66 8.677 12.270 50.736 1.00 0.00 H ATOM 955 HG23 VAL A 66 10.174 12.818 51.530 1.00 0.00 H ATOM 956 H VAL A 66 6.666 14.490 52.088 1.00 0.00 H ATOM 957 N MET A 67 7.421 13.189 48.304 1.00 34.15 N ATOM 958 CA MET A 67 6.838 12.036 47.663 1.00 34.64 C ATOM 959 C MET A 67 7.880 11.206 46.993 1.00 35.88 C ATOM 960 O MET A 67 9.022 11.623 46.835 1.00 36.47 O ATOM 961 CB MET A 67 5.810 12.489 46.612 1.00 34.20 C ATOM 962 CG MET A 67 6.459 13.226 45.453 1.00 33.97 C ATOM 963 SD MET A 67 5.345 13.786 44.159 1.00 34.90 S ATOM 964 CE MET A 67 6.431 14.929 43.284 1.00 34.00 C ATOM 965 HA MET A 67 6.352 11.436 48.432 1.00 0.00 H ATOM 966 HB2 MET A 67 5.294 11.611 46.225 1.00 0.00 H ATOM 967 HB3 MET A 67 5.088 13.152 47.090 1.00 0.00 H ATOM 968 HG2 MET A 67 7.190 12.557 44.999 1.00 0.00 H ATOM 969 HG3 MET A 67 6.970 14.100 45.856 1.00 0.00 H ATOM 970 HE1 MET A 67 6.751 15.717 43.965 1.00 0.00 H ATOM 971 HE2 MET A 67 7.303 14.389 42.915 1.00 0.00 H ATOM 972 HE3 MET A 67 5.893 15.369 42.444 1.00 0.00 H ATOM 973 H MET A 67 8.220 13.688 47.863 1.00 0.00 H ATOM 974 N LYS A 68 7.440 10.008 46.639 1.00 37.25 N ATOM 975 CA LYS A 68 8.183 9.076 45.810 1.00 38.82 C ATOM 976 C LYS A 68 7.271 8.699 44.653 1.00 38.72 C ATOM 977 O LYS A 68 6.105 8.314 44.860 1.00 38.79 O ATOM 978 CB LYS A 68 8.536 7.808 46.580 1.00 40.42 C ATOM 979 CG LYS A 68 9.680 7.920 47.586 1.00 41.18 C ATOM 980 CD LYS A 68 9.963 6.532 48.174 1.00 42.90 C ATOM 981 CE LYS A 68 11.096 6.538 49.200 1.00 44.09 C ATOM 982 NZ LYS A 68 12.363 5.938 48.645 1.00 46.75 N ATOM 983 HA LYS A 68 9.112 9.538 45.477 1.00 0.00 H ATOM 984 HB2 LYS A 68 7.646 7.491 47.124 1.00 0.00 H ATOM 985 HB3 LYS A 68 8.807 7.043 45.853 1.00 0.00 H ATOM 986 HG2 LYS A 68 10.573 8.294 47.085 1.00 0.00 H ATOM 987 HG3 LYS A 68 9.399 8.606 48.385 1.00 0.00 H ATOM 988 HD2 LYS A 68 9.057 6.168 48.659 1.00 0.00 H ATOM 989 HD3 LYS A 68 10.234 5.859 47.361 1.00 0.00 H ATOM 990 HE2 LYS A 68 10.785 5.961 50.071 1.00 0.00 H ATOM 991 HE3 LYS A 68 11.295 7.567 49.499 1.00 0.00 H ATOM 992 HZ1 LYS A 68 12.184 4.953 48.363 1.00 0.00 H ATOM 993 HZ2 LYS A 68 12.671 6.486 47.817 1.00 0.00 H ATOM 994 HZ3 LYS A 68 13.105 5.962 49.374 1.00 0.00 H ATOM 995 H LYS A 68 6.501 9.716 46.977 1.00 0.00 H ATOM 996 N ILE A 69 7.778 8.817 43.444 1.00 38.77 N ATOM 997 CA ILE A 69 6.987 8.422 42.280 1.00 38.70 C ATOM 998 C ILE A 69 7.639 7.144 41.767 1.00 40.41 C ATOM 999 O ILE A 69 8.795 7.150 41.347 1.00 41.41 O ATOM 1000 CB ILE A 69 6.980 9.494 41.196 1.00 38.03 C ATOM 1001 CG1 ILE A 69 6.054 10.674 41.582 1.00 36.84 C ATOM 1002 CG2 ILE A 69 6.490 8.922 39.873 1.00 38.85 C ATOM 1003 CD1 ILE A 69 6.170 11.868 40.650 1.00 36.47 C ATOM 1004 HA ILE A 69 5.942 8.276 42.552 1.00 0.00 H ATOM 1005 HB ILE A 69 8.005 9.849 41.094 1.00 0.00 H ATOM 1006 HG12 ILE A 69 5.022 10.323 41.566 1.00 0.00 H ATOM 1007 HG13 ILE A 69 6.310 10.998 42.591 1.00 0.00 H ATOM 1008 HD11 ILE A 69 7.195 12.240 40.663 1.00 0.00 H ATOM 1009 HD12 ILE A 69 5.906 11.564 39.637 1.00 0.00 H ATOM 1010 HD13 ILE A 69 5.493 12.654 40.983 1.00 0.00 H ATOM 1011 HG21 ILE A 69 7.150 8.112 39.562 1.00 0.00 H ATOM 1012 HG22 ILE A 69 5.477 8.540 39.997 1.00 0.00 H ATOM 1013 HG23 ILE A 69 6.494 9.706 39.116 1.00 0.00 H ATOM 1014 H ILE A 69 8.740 9.191 43.317 1.00 0.00 H ATOM 1015 N GLY A 70 6.888 6.054 41.796 1.00 41.24 N ATOM 1016 CA GLY A 70 7.437 4.744 41.435 1.00 43.81 C ATOM 1017 C GLY A 70 8.668 4.502 42.278 1.00 45.38 C ATOM 1018 O GLY A 70 8.671 4.755 43.509 1.00 44.79 O ATOM 1019 HA3 GLY A 70 7.705 4.734 40.378 1.00 0.00 H ATOM 1020 HA2 GLY A 70 6.698 3.967 41.629 1.00 0.00 H ATOM 1021 H GLY A 70 5.890 6.129 42.080 1.00 0.00 H ATOM 1022 N ASN A 71 9.736 4.136 41.587 1.00 48.08 N ATOM 1023 CA ASN A 71 11.047 3.877 42.172 1.00 49.95 C ATOM 1024 C ASN A 71 11.983 5.104 42.322 1.00 48.50 C ATOM 1025 O ASN A 71 13.188 4.972 42.474 1.00 49.49 O ATOM 1026 CB ASN A 71 11.692 2.738 41.366 1.00 54.94 C ATOM 1027 CG ASN A 71 11.136 1.384 41.791 1.00 57.64 C ATOM 1028 OD1 ASN A 71 11.016 1.121 42.989 1.00 61.80 O ATOM 1029 ND2 ASN A 71 10.757 0.553 40.847 1.00 60.72 N ATOM 1030 HA ASN A 71 10.891 3.591 43.212 1.00 0.00 H ATOM 1031 HB2 ASN A 71 11.487 2.891 40.306 1.00 0.00 H ATOM 1032 HB3 ASN A 71 12.769 2.749 41.532 1.00 0.00 H ATOM 1033 HD22 ASN A 71 10.876 0.813 39.847 1.00 0.00 H ATOM 1034 HD21 ASN A 71 10.338 -0.365 41.100 1.00 0.00 H ATOM 1035 H ASN A 71 9.634 4.026 40.558 1.00 0.00 H ATOM 1036 N SER A 72 11.427 6.308 42.299 1.00 45.00 N ATOM 1037 CA SER A 72 12.283 7.464 42.393 1.00 44.11 C ATOM 1038 C SER A 72 12.819 7.621 43.807 1.00 43.23 C ATOM 1039 O SER A 72 12.281 7.030 44.741 1.00 42.58 O ATOM 1040 CB SER A 72 11.504 8.697 42.055 1.00 42.50 C ATOM 1041 OG SER A 72 10.539 8.950 43.063 1.00 40.28 O ATOM 1042 HA SER A 72 13.111 7.328 41.698 1.00 0.00 H ATOM 1043 HB2 SER A 72 11.000 8.556 41.099 1.00 0.00 H ATOM 1044 HB3 SER A 72 12.184 9.546 41.984 1.00 0.00 H ATOM 1045 HG SER A 72 10.997 9.080 43.931 1.00 0.00 H ATOM 1046 H SER A 72 10.396 6.416 42.215 1.00 0.00 H ATOM 1047 N GLY A 73 13.870 8.419 43.959 1.00 43.15 N ATOM 1048 CA GLY A 73 14.222 8.921 45.288 1.00 42.82 C ATOM 1049 C GLY A 73 13.123 9.880 45.738 1.00 39.90 C ATOM 1050 O GLY A 73 12.204 10.157 44.975 1.00 38.71 O ATOM 1051 HA3 GLY A 73 15.176 9.446 45.244 1.00 0.00 H ATOM 1052 HA2 GLY A 73 14.298 8.090 45.989 1.00 0.00 H ATOM 1053 H GLY A 73 14.443 8.687 43.133 1.00 0.00 H ATOM 1054 N THR A 74 13.182 10.370 46.970 1.00 38.75 N ATOM 1055 CA THR A 74 12.107 11.270 47.454 1.00 37.03 C ATOM 1056 C THR A 74 12.190 12.612 46.744 1.00 36.27 C ATOM 1057 O THR A 74 13.286 13.102 46.443 1.00 36.49 O ATOM 1058 CB THR A 74 12.220 11.612 48.957 1.00 36.92 C ATOM 1059 OG1 THR A 74 13.516 12.170 49.202 1.00 38.34 O ATOM 1060 CG2 THR A 74 11.989 10.409 49.869 1.00 37.19 C ATOM 1061 HA THR A 74 11.181 10.730 47.259 1.00 0.00 H ATOM 1062 HB THR A 74 11.433 12.328 49.193 1.00 0.00 H ATOM 1063 HG1 THR A 74 13.601 12.394 50.163 1.00 0.00 H ATOM 1064 HG23 THR A 74 11.001 9.992 49.675 1.00 0.00 H ATOM 1065 HG21 THR A 74 12.749 9.653 49.671 1.00 0.00 H ATOM 1066 HG22 THR A 74 12.053 10.726 50.910 1.00 0.00 H ATOM 1067 H THR A 74 13.978 10.124 47.593 1.00 0.00 H ATOM 1068 N ILE A 75 11.028 13.205 46.490 1.00 35.05 N ATOM 1069 CA ILE A 75 10.968 14.500 45.854 1.00 34.91 C ATOM 1070 C ILE A 75 10.167 15.458 46.745 1.00 34.05 C ATOM 1071 O ILE A 75 9.091 15.078 47.232 1.00 33.55 O ATOM 1072 CB ILE A 75 10.247 14.399 44.515 1.00 34.61 C ATOM 1073 CG1 ILE A 75 10.902 13.356 43.631 1.00 36.10 C ATOM 1074 CG2 ILE A 75 10.207 15.760 43.814 1.00 34.67 C ATOM 1075 CD1 ILE A 75 10.061 13.021 42.394 1.00 36.32 C ATOM 1076 HA ILE A 75 11.985 14.861 45.702 1.00 0.00 H ATOM 1077 HB ILE A 75 9.220 14.087 44.705 1.00 0.00 H ATOM 1078 HG12 ILE A 75 11.871 13.734 43.303 1.00 0.00 H ATOM 1079 HG13 ILE A 75 11.046 12.446 44.213 1.00 0.00 H ATOM 1080 HD11 ILE A 75 9.092 12.634 42.709 1.00 0.00 H ATOM 1081 HD12 ILE A 75 9.917 13.923 41.799 1.00 0.00 H ATOM 1082 HD13 ILE A 75 10.578 12.269 41.797 1.00 0.00 H ATOM 1083 HG21 ILE A 75 9.680 16.476 44.444 1.00 0.00 H ATOM 1084 HG22 ILE A 75 11.225 16.108 43.640 1.00 0.00 H ATOM 1085 HG23 ILE A 75 9.687 15.661 42.861 1.00 0.00 H ATOM 1086 H ILE A 75 10.143 12.726 46.755 1.00 0.00 H ATOM 1087 N PRO A 76 10.660 16.703 46.927 1.00 34.56 N ATOM 1088 CA PRO A 76 9.880 17.642 47.766 1.00 34.23 C ATOM 1089 C PRO A 76 8.532 17.956 47.166 1.00 34.01 C ATOM 1090 O PRO A 76 8.464 18.306 45.990 1.00 34.95 O ATOM 1091 CB PRO A 76 10.765 18.904 47.805 1.00 34.61 C ATOM 1092 CG PRO A 76 12.161 18.367 47.594 1.00 35.73 C ATOM 1093 CD PRO A 76 11.946 17.304 46.520 1.00 35.58 C ATOM 1094 HA PRO A 76 9.663 17.230 48.751 1.00 0.00 H ATOM 1095 HD3 PRO A 76 11.877 17.752 45.529 1.00 0.00 H ATOM 1096 HD2 PRO A 76 12.748 16.566 46.529 1.00 0.00 H ATOM 1097 HG3 PRO A 76 12.557 17.928 48.510 1.00 0.00 H ATOM 1098 HG2 PRO A 76 12.836 19.149 47.246 1.00 0.00 H ATOM 1099 HB2 PRO A 76 10.490 19.597 47.010 1.00 0.00 H ATOM 1100 HB3 PRO A 76 10.683 19.407 48.768 1.00 0.00 H ATOM 1101 N VAL A 77 7.486 17.847 47.984 1.00 33.13 N ATOM 1102 CA VAL A 77 6.180 18.455 47.687 1.00 32.34 C ATOM 1103 C VAL A 77 5.961 19.779 48.446 1.00 33.29 C ATOM 1104 O VAL A 77 5.549 20.809 47.844 1.00 33.73 O ATOM 1105 CB VAL A 77 5.074 17.452 48.046 1.00 31.81 C ATOM 1106 CG1 VAL A 77 3.691 17.975 47.700 1.00 30.85 C ATOM 1107 CG2 VAL A 77 5.345 16.115 47.324 1.00 32.05 C ATOM 1108 HA VAL A 77 6.151 18.693 46.624 1.00 0.00 H ATOM 1109 HB VAL A 77 5.091 17.300 49.125 1.00 0.00 H ATOM 1110 HG11 VAL A 77 3.504 18.897 48.250 1.00 0.00 H ATOM 1111 HG12 VAL A 77 3.636 18.172 46.629 1.00 0.00 H ATOM 1112 HG13 VAL A 77 2.944 17.230 47.973 1.00 0.00 H ATOM 1113 HG21 VAL A 77 5.353 16.280 46.247 1.00 0.00 H ATOM 1114 HG22 VAL A 77 6.312 15.722 47.640 1.00 0.00 H ATOM 1115 HG23 VAL A 77 4.561 15.401 47.577 1.00 0.00 H ATOM 1116 H VAL A 77 7.597 17.311 48.868 1.00 0.00 H ATOM 1117 N ASN A 78 6.236 19.785 49.764 1.00 33.13 N ATOM 1118 CA ASN A 78 6.005 20.985 50.556 1.00 33.34 C ATOM 1119 C ASN A 78 4.507 21.328 50.446 1.00 32.89 C ATOM 1120 O ASN A 78 3.694 20.421 50.494 1.00 32.16 O ATOM 1121 CB ASN A 78 6.916 22.137 50.063 1.00 34.10 C ATOM 1122 CG ASN A 78 8.393 21.890 50.349 1.00 34.85 C ATOM 1123 OD1 ASN A 78 9.240 21.941 49.446 1.00 35.42 O ATOM 1124 ND2 ASN A 78 8.710 21.595 51.598 1.00 35.25 N ATOM 1125 HA ASN A 78 6.258 20.825 51.604 1.00 0.00 H ATOM 1126 HB2 ASN A 78 6.784 22.249 48.987 1.00 0.00 H ATOM 1127 HB3 ASN A 78 6.614 23.058 50.563 1.00 0.00 H ATOM 1128 HD22 ASN A 78 7.970 21.562 52.328 1.00 0.00 H ATOM 1129 HD21 ASN A 78 9.699 21.396 51.850 1.00 0.00 H ATOM 1130 H ASN A 78 6.615 18.929 50.218 1.00 0.00 H ATOM 1131 N THR A 79 4.153 22.607 50.262 1.00 32.45 N ATOM 1132 CA THR A 79 2.750 23.022 50.137 1.00 33.20 C ATOM 1133 C THR A 79 2.021 22.478 48.892 1.00 33.23 C ATOM 1134 O THR A 79 0.772 22.487 48.798 1.00 33.28 O ATOM 1135 CB THR A 79 2.606 24.546 50.085 1.00 33.79 C ATOM 1136 OG1 THR A 79 3.276 25.059 48.946 1.00 34.30 O ATOM 1137 CG2 THR A 79 3.187 25.260 51.313 1.00 34.60 C ATOM 1138 HA THR A 79 2.291 22.597 51.030 1.00 0.00 H ATOM 1139 HB THR A 79 1.533 24.736 50.050 1.00 0.00 H ATOM 1140 HG1 THR A 79 3.177 26.044 48.922 1.00 0.00 H ATOM 1141 HG23 THR A 79 2.695 24.891 52.213 1.00 0.00 H ATOM 1142 HG21 THR A 79 4.257 25.061 51.375 1.00 0.00 H ATOM 1143 HG22 THR A 79 3.020 26.333 51.220 1.00 0.00 H ATOM 1144 H THR A 79 4.898 23.331 50.206 1.00 0.00 H ATOM 1145 N GLY A 80 2.804 22.065 47.903 1.00 33.47 N ATOM 1146 CA GLY A 80 2.260 21.488 46.686 1.00 33.21 C ATOM 1147 C GLY A 80 3.029 21.841 45.441 1.00 33.90 C ATOM 1148 O GLY A 80 4.090 22.464 45.496 1.00 35.12 O ATOM 1149 HA3 GLY A 80 1.236 21.841 46.568 1.00 0.00 H ATOM 1150 HA2 GLY A 80 2.259 20.403 46.792 1.00 0.00 H ATOM 1151 H GLY A 80 3.835 22.157 48.002 1.00 0.00 H ATOM 1152 N LEU A 81 2.449 21.491 44.297 1.00 33.93 N ATOM 1153 CA LEU A 81 3.137 21.529 43.011 1.00 33.79 C ATOM 1154 C LEU A 81 2.097 21.937 42.015 1.00 34.32 C ATOM 1155 O LEU A 81 1.023 21.319 41.939 1.00 33.65 O ATOM 1156 CB LEU A 81 3.664 20.122 42.680 1.00 32.97 C ATOM 1157 CG LEU A 81 4.844 19.681 43.555 1.00 32.71 C ATOM 1158 CD1 LEU A 81 5.161 18.225 43.218 1.00 32.84 C ATOM 1159 CD2 LEU A 81 6.075 20.576 43.366 1.00 32.95 C ATOM 1160 HA LEU A 81 3.984 22.215 43.010 1.00 0.00 H ATOM 1161 HB2 LEU A 81 2.850 19.409 42.815 1.00 0.00 H ATOM 1162 HB3 LEU A 81 3.985 20.111 41.638 1.00 0.00 H ATOM 1163 HG LEU A 81 4.567 19.775 44.605 1.00 0.00 H ATOM 1164 HD21 LEU A 81 6.394 20.538 42.324 1.00 0.00 H ATOM 1165 HD22 LEU A 81 5.821 21.602 43.633 1.00 0.00 H ATOM 1166 HD23 LEU A 81 6.882 20.222 44.007 1.00 0.00 H ATOM 1167 HD11 LEU A 81 4.287 17.607 43.424 1.00 0.00 H ATOM 1168 HD12 LEU A 81 5.423 18.146 42.163 1.00 0.00 H ATOM 1169 HD13 LEU A 81 5.998 17.886 43.828 1.00 0.00 H ATOM 1170 H LEU A 81 1.458 21.175 44.320 1.00 0.00 H ATOM 1171 N PHE A 82 2.391 23.024 41.299 1.00 35.48 N ATOM 1172 CA PHE A 82 1.460 23.572 40.322 1.00 36.57 C ATOM 1173 C PHE A 82 1.732 23.161 38.836 1.00 36.58 C ATOM 1174 O PHE A 82 2.704 23.619 38.241 1.00 36.97 O ATOM 1175 CB PHE A 82 1.418 25.085 40.466 1.00 37.96 C ATOM 1176 CG PHE A 82 0.362 25.742 39.644 1.00 39.85 C ATOM 1177 CD1 PHE A 82 -0.990 25.691 40.026 1.00 39.93 C ATOM 1178 CD2 PHE A 82 0.708 26.457 38.508 1.00 41.35 C ATOM 1179 CE1 PHE A 82 -1.970 26.325 39.268 1.00 42.03 C ATOM 1180 CE2 PHE A 82 -0.273 27.110 37.760 1.00 43.18 C ATOM 1181 CZ PHE A 82 -1.614 27.045 38.136 1.00 43.30 C ATOM 1182 HA PHE A 82 0.489 23.131 40.549 1.00 0.00 H ATOM 1183 HB2 PHE A 82 1.237 25.325 41.514 1.00 0.00 H ATOM 1184 HB3 PHE A 82 2.386 25.485 40.165 1.00 0.00 H ATOM 1185 HD2 PHE A 82 1.751 26.510 38.197 1.00 0.00 H ATOM 1186 HE2 PHE A 82 0.012 27.676 36.873 1.00 0.00 H ATOM 1187 HZ PHE A 82 -2.376 27.555 37.546 1.00 0.00 H ATOM 1188 HE1 PHE A 82 -3.017 26.256 39.563 1.00 0.00 H ATOM 1189 HD1 PHE A 82 -1.274 25.148 40.927 1.00 0.00 H ATOM 1190 H PHE A 82 3.309 23.492 41.442 1.00 0.00 H ATOM 1191 N ARG A 83 0.822 22.389 38.237 1.00 36.48 N ATOM 1192 CA ARG A 83 0.957 21.936 36.827 1.00 37.35 C ATOM 1193 C ARG A 83 2.393 21.511 36.577 1.00 37.06 C ATOM 1194 O ARG A 83 3.147 22.164 35.852 1.00 38.41 O ATOM 1195 CB ARG A 83 0.542 23.032 35.846 1.00 39.04 C ATOM 1196 CG ARG A 83 -0.903 23.405 36.064 1.00 40.43 C ATOM 1197 CD ARG A 83 -1.306 24.663 35.331 1.00 42.86 C ATOM 1198 NE ARG A 83 -2.739 24.869 35.514 1.00 43.97 N ATOM 1199 CZ ARG A 83 -3.444 25.808 34.889 1.00 46.23 C ATOM 1200 NH1 ARG A 83 -2.855 26.642 34.052 1.00 47.08 N ATOM 1201 NH2 ARG A 83 -4.756 25.898 35.092 1.00 47.84 N ATOM 1202 HA ARG A 83 0.291 21.089 36.665 1.00 0.00 H ATOM 1203 HB2 ARG A 83 1.168 23.910 36.001 1.00 0.00 H ATOM 1204 HB3 ARG A 83 0.671 22.670 34.826 1.00 0.00 H ATOM 1205 HG2 ARG A 83 -1.530 22.584 35.716 1.00 0.00 H ATOM 1206 HG3 ARG A 83 -1.065 23.557 37.131 1.00 0.00 H ATOM 1207 HD2 ARG A 83 -1.082 24.558 34.269 1.00 0.00 H ATOM 1208 HD3 ARG A 83 -0.758 25.515 35.734 1.00 0.00 H ATOM 1209 HE ARG A 83 -3.241 24.242 36.175 1.00 0.00 H ATOM 1210 HH12 ARG A 83 -3.414 27.373 33.567 1.00 0.00 H ATOM 1211 HH11 ARG A 83 -1.832 26.568 33.877 1.00 0.00 H ATOM 1212 HH22 ARG A 83 -5.309 26.632 34.604 1.00 0.00 H ATOM 1213 HH21 ARG A 83 -5.229 25.235 35.739 1.00 0.00 H ATOM 1214 H ARG A 83 -0.015 22.093 38.778 1.00 0.00 H ATOM 1215 N TRP A 84 2.767 20.462 37.266 1.00 35.94 N ATOM 1216 CA TRP A 84 4.143 20.026 37.402 1.00 36.52 C ATOM 1217 C TRP A 84 4.368 18.767 36.595 1.00 36.97 C ATOM 1218 O TRP A 84 3.477 17.922 36.475 1.00 36.25 O ATOM 1219 CB TRP A 84 4.379 19.797 38.883 1.00 35.35 C ATOM 1220 CG TRP A 84 5.717 19.253 39.273 1.00 35.56 C ATOM 1221 CD1 TRP A 84 6.835 19.967 39.649 1.00 36.31 C ATOM 1222 CD2 TRP A 84 6.103 17.846 39.386 1.00 35.39 C ATOM 1223 NE1 TRP A 84 7.859 19.125 39.972 1.00 36.51 N ATOM 1224 CE2 TRP A 84 7.487 17.839 39.828 1.00 35.94 C ATOM 1225 CE3 TRP A 84 5.461 16.632 39.164 1.00 35.11 C ATOM 1226 CZ2 TRP A 84 8.185 16.657 40.036 1.00 36.14 C ATOM 1227 CZ3 TRP A 84 6.174 15.443 39.380 1.00 35.19 C ATOM 1228 CH2 TRP A 84 7.497 15.454 39.797 1.00 35.78 C ATOM 1229 HA TRP A 84 4.845 20.769 37.022 1.00 0.00 H ATOM 1230 HB2 TRP A 84 4.250 20.753 39.390 1.00 0.00 H ATOM 1231 HB3 TRP A 84 3.622 19.096 39.234 1.00 0.00 H ATOM 1232 HE1 TRP A 84 8.800 19.435 40.287 1.00 0.00 H ATOM 1233 HD1 TRP A 84 6.893 21.055 39.683 1.00 0.00 H ATOM 1234 HZ2 TRP A 84 9.222 16.661 40.370 1.00 0.00 H ATOM 1235 HH2 TRP A 84 8.016 14.507 39.943 1.00 0.00 H ATOM 1236 HZ3 TRP A 84 5.676 14.487 39.216 1.00 0.00 H ATOM 1237 HE3 TRP A 84 4.424 16.605 38.829 1.00 0.00 H ATOM 1238 H TRP A 84 2.030 19.907 37.746 1.00 0.00 H ATOM 1239 N VAL A 85 5.551 18.678 35.997 1.00 38.91 N ATOM 1240 CA VAL A 85 5.977 17.582 35.122 1.00 40.05 C ATOM 1241 C VAL A 85 7.215 16.947 35.767 1.00 41.02 C ATOM 1242 O VAL A 85 8.151 17.685 36.193 1.00 41.30 O ATOM 1243 CB VAL A 85 6.333 18.089 33.706 1.00 41.61 C ATOM 1244 CG1 VAL A 85 6.841 16.940 32.810 1.00 42.59 C ATOM 1245 CG2 VAL A 85 5.115 18.701 33.054 1.00 41.05 C ATOM 1246 HA VAL A 85 5.165 16.863 35.012 1.00 0.00 H ATOM 1247 HB VAL A 85 7.122 18.834 33.813 1.00 0.00 H ATOM 1248 HG11 VAL A 85 7.733 16.500 33.256 1.00 0.00 H ATOM 1249 HG12 VAL A 85 6.065 16.180 32.722 1.00 0.00 H ATOM 1250 HG13 VAL A 85 7.082 17.331 31.822 1.00 0.00 H ATOM 1251 HG21 VAL A 85 4.329 17.950 32.979 1.00 0.00 H ATOM 1252 HG22 VAL A 85 4.764 19.538 33.657 1.00 0.00 H ATOM 1253 HG23 VAL A 85 5.377 19.055 32.057 1.00 0.00 H ATOM 1254 H VAL A 85 6.230 19.448 36.163 1.00 0.00 H ATOM 1255 N ALA A 86 7.221 15.605 35.853 1.00 40.32 N ATOM 1256 CA ALA A 86 8.325 14.894 36.491 1.00 40.85 C ATOM 1257 C ALA A 86 9.546 14.931 35.620 1.00 43.26 C ATOM 1258 O ALA A 86 9.423 15.189 34.424 1.00 44.53 O ATOM 1259 CB ALA A 86 7.953 13.449 36.803 1.00 40.04 C ATOM 1260 HA ALA A 86 8.541 15.399 37.432 1.00 0.00 H ATOM 1261 HB1 ALA A 86 7.096 13.433 37.477 1.00 0.00 H ATOM 1262 HB2 ALA A 86 7.698 12.933 35.877 1.00 0.00 H ATOM 1263 HB3 ALA A 86 8.799 12.952 37.277 1.00 0.00 H ATOM 1264 H ALA A 86 6.425 15.064 35.458 1.00 0.00 H ATOM 1265 N PRO A 87 10.730 14.672 36.217 1.00 44.27 N ATOM 1266 CA PRO A 87 11.984 14.647 35.486 1.00 46.90 C ATOM 1267 C PRO A 87 12.014 13.476 34.557 1.00 49.51 C ATOM 1268 O PRO A 87 11.264 12.509 34.716 1.00 49.08 O ATOM 1269 CB PRO A 87 13.033 14.422 36.580 1.00 46.73 C ATOM 1270 CG PRO A 87 12.420 14.949 37.829 1.00 44.13 C ATOM 1271 CD PRO A 87 10.958 14.598 37.682 1.00 43.36 C ATOM 1272 HA PRO A 87 12.141 15.550 34.896 1.00 0.00 H ATOM 1273 HD3 PRO A 87 10.758 13.594 38.058 1.00 0.00 H ATOM 1274 HD2 PRO A 87 10.330 15.314 38.211 1.00 0.00 H ATOM 1275 HG3 PRO A 87 12.556 16.028 37.905 1.00 0.00 H ATOM 1276 HG2 PRO A 87 12.850 14.467 38.707 1.00 0.00 H ATOM 1277 HB2 PRO A 87 13.256 13.360 36.683 1.00 0.00 H ATOM 1278 HB3 PRO A 87 13.950 14.963 36.347 1.00 0.00 H ATOM 1279 N ASN A 88 12.907 13.547 33.593 1.00 52.85 N ATOM 1280 CA ASN A 88 12.990 12.499 32.615 1.00 55.76 C ATOM 1281 C ASN A 88 13.045 11.110 33.280 1.00 55.80 C ATOM 1282 O ASN A 88 13.759 10.912 34.278 1.00 54.48 O ATOM 1283 CB ASN A 88 14.207 12.742 31.734 1.00 59.80 C ATOM 1284 CG ASN A 88 14.307 11.737 30.640 1.00 64.09 C ATOM 1285 OD1 ASN A 88 13.287 11.169 30.227 1.00 64.20 O ATOM 1286 ND2 ASN A 88 15.533 11.483 30.159 1.00 68.01 N ATOM 1287 HA ASN A 88 12.091 12.513 31.998 1.00 0.00 H ATOM 1288 HB2 ASN A 88 14.132 13.736 31.294 1.00 0.00 H ATOM 1289 HB3 ASN A 88 15.105 12.685 32.349 1.00 0.00 H ATOM 1290 HD22 ASN A 88 16.357 11.989 30.542 1.00 0.00 H ATOM 1291 HD21 ASN A 88 15.660 10.780 29.403 1.00 0.00 H ATOM 1292 H ASN A 88 13.552 14.361 33.540 1.00 0.00 H ATOM 1293 N ASN A 89 12.280 10.157 32.744 1.00 55.89 N ATOM 1294 CA ASN A 89 12.315 8.788 33.256 1.00 56.77 C ATOM 1295 C ASN A 89 11.645 8.527 34.596 1.00 54.50 C ATOM 1296 O ASN A 89 11.692 7.407 35.085 1.00 56.51 O ATOM 1297 CB ASN A 89 13.764 8.269 33.336 1.00 59.61 C ATOM 1298 CG ASN A 89 14.240 7.703 32.029 1.00 63.96 C ATOM 1299 OD1 ASN A 89 13.520 6.948 31.369 1.00 64.61 O ATOM 1300 ND2 ASN A 89 15.449 8.071 31.631 1.00 66.73 N ATOM 1301 HA ASN A 89 11.716 8.249 32.522 1.00 0.00 H ATOM 1302 HB2 ASN A 89 14.417 9.094 33.619 1.00 0.00 H ATOM 1303 HB3 ASN A 89 13.816 7.489 34.096 1.00 0.00 H ATOM 1304 HD22 ASN A 89 16.019 8.709 32.222 1.00 0.00 H ATOM 1305 HD21 ASN A 89 15.828 7.721 30.728 1.00 0.00 H ATOM 1306 H ASN A 89 11.650 10.391 31.951 1.00 0.00 H ATOM 1307 N VAL A 90 11.034 9.530 35.202 1.00 50.50 N ATOM 1308 CA VAL A 90 10.327 9.312 36.463 1.00 48.02 C ATOM 1309 C VAL A 90 8.857 8.990 36.233 1.00 46.82 C ATOM 1310 O VAL A 90 8.151 9.755 35.616 1.00 46.96 O ATOM 1311 CB VAL A 90 10.464 10.541 37.381 1.00 45.75 C ATOM 1312 CG1 VAL A 90 9.548 10.442 38.590 1.00 43.42 C ATOM 1313 CG2 VAL A 90 11.906 10.668 37.827 1.00 46.91 C ATOM 1314 HA VAL A 90 10.786 8.452 36.951 1.00 0.00 H ATOM 1315 HB VAL A 90 10.168 11.427 36.820 1.00 0.00 H ATOM 1316 HG11 VAL A 90 8.513 10.376 38.255 1.00 0.00 H ATOM 1317 HG12 VAL A 90 9.803 9.552 39.165 1.00 0.00 H ATOM 1318 HG13 VAL A 90 9.674 11.328 39.213 1.00 0.00 H ATOM 1319 HG21 VAL A 90 12.197 9.769 38.370 1.00 0.00 H ATOM 1320 HG22 VAL A 90 12.546 10.789 36.953 1.00 0.00 H ATOM 1321 HG23 VAL A 90 12.009 11.537 38.477 1.00 0.00 H ATOM 1322 H VAL A 90 11.056 10.480 34.779 1.00 0.00 H ATOM 1323 N GLN A 91 8.412 7.850 36.720 1.00 47.07 N ATOM 1324 CA GLN A 91 7.052 7.370 36.513 1.00 46.68 C ATOM 1325 C GLN A 91 6.683 6.323 37.543 1.00 46.38 C ATOM 1326 O GLN A 91 7.556 5.709 38.118 1.00 47.62 O ATOM 1327 CB GLN A 91 6.890 6.763 35.120 1.00 49.56 C ATOM 1328 CG GLN A 91 7.815 5.627 34.754 1.00 52.77 C ATOM 1329 CD GLN A 91 7.741 5.342 33.261 1.00 56.55 C ATOM 1330 OE1 GLN A 91 8.663 5.662 32.506 1.00 58.95 O ATOM 1331 NE2 GLN A 91 6.632 4.751 32.822 1.00 57.92 N ATOM 1332 HA GLN A 91 6.390 8.230 36.614 1.00 0.00 H ATOM 1333 HB2 GLN A 91 5.868 6.394 35.039 1.00 0.00 H ATOM 1334 HB3 GLN A 91 7.045 7.561 34.394 1.00 0.00 H ATOM 1335 HG2 GLN A 91 8.838 5.897 35.018 1.00 0.00 H ATOM 1336 HG3 GLN A 91 7.522 4.733 35.305 1.00 0.00 H ATOM 1337 HE22 GLN A 91 5.878 4.497 33.492 1.00 0.00 H ATOM 1338 HE21 GLN A 91 6.520 4.543 31.809 1.00 0.00 H ATOM 1339 H GLN A 91 9.063 7.264 37.280 1.00 0.00 H ATOM 1340 N GLY A 92 5.392 6.119 37.774 1.00 45.16 N ATOM 1341 CA GLY A 92 4.928 5.097 38.697 1.00 44.56 C ATOM 1342 C GLY A 92 3.997 5.693 39.745 1.00 42.48 C ATOM 1343 O GLY A 92 3.764 6.885 39.779 1.00 40.87 O ATOM 1344 HA3 GLY A 92 5.788 4.650 39.196 1.00 0.00 H ATOM 1345 HA2 GLY A 92 4.393 4.329 38.139 1.00 0.00 H ATOM 1346 H GLY A 92 4.692 6.708 37.280 1.00 0.00 H ATOM 1347 N ALA A 93 3.453 4.833 40.600 1.00 43.07 N ATOM 1348 CA ALA A 93 2.557 5.234 41.694 1.00 41.25 C ATOM 1349 C ALA A 93 3.216 6.301 42.568 1.00 39.70 C ATOM 1350 O ALA A 93 4.407 6.226 42.924 1.00 39.80 O ATOM 1351 CB ALA A 93 2.199 3.994 42.532 1.00 42.42 C ATOM 1352 HA ALA A 93 1.647 5.663 41.275 1.00 0.00 H ATOM 1353 HB1 ALA A 93 1.700 3.261 41.899 1.00 0.00 H ATOM 1354 HB2 ALA A 93 3.110 3.560 42.944 1.00 0.00 H ATOM 1355 HB3 ALA A 93 1.534 4.286 43.345 1.00 0.00 H ATOM 1356 H ALA A 93 3.673 3.823 40.489 1.00 0.00 H ATOM 1357 N ILE A 94 2.428 7.301 42.915 1.00 38.06 N ATOM 1358 CA ILE A 94 2.852 8.311 43.832 1.00 37.07 C ATOM 1359 C ILE A 94 2.597 7.915 45.291 1.00 36.82 C ATOM 1360 O ILE A 94 1.444 7.703 45.712 1.00 36.70 O ATOM 1361 CB ILE A 94 2.176 9.666 43.544 1.00 35.60 C ATOM 1362 CG1 ILE A 94 2.498 10.120 42.123 1.00 35.74 C ATOM 1363 CG2 ILE A 94 2.659 10.681 44.552 1.00 34.64 C ATOM 1364 CD1 ILE A 94 2.025 11.539 41.799 1.00 35.10 C ATOM 1365 HA ILE A 94 3.927 8.414 43.685 1.00 0.00 H ATOM 1366 HB ILE A 94 1.094 9.565 43.630 1.00 0.00 H ATOM 1367 HG12 ILE A 94 3.579 10.079 41.987 1.00 0.00 H ATOM 1368 HG13 ILE A 94 2.019 9.432 41.426 1.00 0.00 H ATOM 1369 HD11 ILE A 94 0.943 11.596 41.918 1.00 0.00 H ATOM 1370 HD12 ILE A 94 2.504 12.244 42.478 1.00 0.00 H ATOM 1371 HD13 ILE A 94 2.293 11.784 40.771 1.00 0.00 H ATOM 1372 HG21 ILE A 94 2.399 10.346 45.556 1.00 0.00 H ATOM 1373 HG22 ILE A 94 3.741 10.785 44.471 1.00 0.00 H ATOM 1374 HG23 ILE A 94 2.185 11.642 44.354 1.00 0.00 H ATOM 1375 H ILE A 94 1.472 7.355 42.510 1.00 0.00 H ATOM 1376 N THR A 95 3.684 7.863 46.058 1.00 36.69 N ATOM 1377 CA THR A 95 3.582 7.650 47.510 1.00 37.59 C ATOM 1378 C THR A 95 3.898 8.934 48.188 1.00 35.93 C ATOM 1379 O THR A 95 4.918 9.550 47.845 1.00 35.99 O ATOM 1380 CB THR A 95 4.575 6.569 47.957 1.00 38.57 C ATOM 1381 OG1 THR A 95 4.113 5.380 47.406 1.00 41.24 O ATOM 1382 CG2 THR A 95 4.564 6.370 49.484 1.00 38.88 C ATOM 1383 HA THR A 95 2.576 7.320 47.769 1.00 0.00 H ATOM 1384 HB THR A 95 5.580 6.855 47.648 1.00 0.00 H ATOM 1385 HG1 THR A 95 4.090 5.462 46.420 1.00 0.00 H ATOM 1386 HG23 THR A 95 4.920 7.278 49.970 1.00 0.00 H ATOM 1387 HG21 THR A 95 3.548 6.154 49.814 1.00 0.00 H ATOM 1388 HG22 THR A 95 5.217 5.537 49.745 1.00 0.00 H ATOM 1389 H THR A 95 4.622 7.975 45.623 1.00 0.00 H ATOM 1390 N LEU A 96 3.004 9.369 49.093 1.00 35.58 N ATOM 1391 CA LEU A 96 3.212 10.600 49.887 1.00 34.28 C ATOM 1392 C LEU A 96 3.867 10.276 51.224 1.00 34.77 C ATOM 1393 O LEU A 96 3.462 9.331 51.905 1.00 35.33 O ATOM 1394 CB LEU A 96 1.891 11.315 50.148 1.00 33.51 C ATOM 1395 CG LEU A 96 1.298 11.895 48.874 1.00 32.93 C ATOM 1396 CD1 LEU A 96 -0.088 12.498 49.042 1.00 32.86 C ATOM 1397 CD2 LEU A 96 2.280 12.855 48.265 1.00 32.12 C ATOM 1398 HA LEU A 96 3.866 11.252 49.307 1.00 0.00 H ATOM 1399 HB2 LEU A 96 1.183 10.604 50.574 1.00 0.00 H ATOM 1400 HB3 LEU A 96 2.062 12.125 50.857 1.00 0.00 H ATOM 1401 HG LEU A 96 1.130 11.066 48.186 1.00 0.00 H ATOM 1402 HD21 LEU A 96 2.487 13.658 48.972 1.00 0.00 H ATOM 1403 HD22 LEU A 96 3.205 12.328 48.032 1.00 0.00 H ATOM 1404 HD23 LEU A 96 1.858 13.273 47.351 1.00 0.00 H ATOM 1405 HD11 LEU A 96 -0.777 11.730 49.392 1.00 0.00 H ATOM 1406 HD12 LEU A 96 -0.045 13.308 49.770 1.00 0.00 H ATOM 1407 HD13 LEU A 96 -0.432 12.887 48.084 1.00 0.00 H ATOM 1408 H LEU A 96 2.133 8.820 49.241 1.00 0.00 H ATOM 1409 N ILE A 97 4.867 11.058 51.614 1.00 34.26 N ATOM 1410 CA ILE A 97 5.543 10.786 52.884 1.00 35.18 C ATOM 1411 C ILE A 97 5.862 12.035 53.694 1.00 34.71 C ATOM 1412 O ILE A 97 6.310 13.053 53.143 1.00 34.35 O ATOM 1413 CB ILE A 97 6.834 9.962 52.694 1.00 36.05 C ATOM 1414 CG1 ILE A 97 6.652 8.893 51.571 1.00 36.69 C ATOM 1415 CG2 ILE A 97 7.203 9.294 54.004 1.00 36.85 C ATOM 1416 CD1 ILE A 97 7.940 8.264 51.083 1.00 37.71 C ATOM 1417 HA ILE A 97 4.819 10.201 53.452 1.00 0.00 H ATOM 1418 HB ILE A 97 7.638 10.632 52.391 1.00 0.00 H ATOM 1419 HG12 ILE A 97 6.011 8.100 51.957 1.00 0.00 H ATOM 1420 HG13 ILE A 97 6.164 9.372 50.722 1.00 0.00 H ATOM 1421 HD11 ILE A 97 8.591 9.039 50.679 1.00 0.00 H ATOM 1422 HD12 ILE A 97 8.438 7.767 51.915 1.00 0.00 H ATOM 1423 HD13 ILE A 97 7.715 7.535 50.305 1.00 0.00 H ATOM 1424 HG21 ILE A 97 7.366 10.056 54.766 1.00 0.00 H ATOM 1425 HG22 ILE A 97 6.393 8.635 54.315 1.00 0.00 H ATOM 1426 HG23 ILE A 97 8.115 8.712 53.869 1.00 0.00 H ATOM 1427 H ILE A 97 5.168 11.858 51.021 1.00 0.00 H ATOM 1428 N TYR A 98 5.668 11.918 55.012 1.00 35.56 N ATOM 1429 CA TYR A 98 6.165 12.898 56.007 1.00 35.72 C ATOM 1430 C TYR A 98 7.710 12.814 56.078 1.00 35.65 C ATOM 1431 O TYR A 98 8.277 11.707 56.185 1.00 37.17 O ATOM 1432 CB TYR A 98 5.499 12.624 57.363 1.00 36.31 C ATOM 1433 CG TYR A 98 5.645 13.784 58.361 1.00 36.90 C ATOM 1434 CD1 TYR A 98 4.970 14.969 58.191 1.00 36.32 C ATOM 1435 CD2 TYR A 98 6.438 13.646 59.491 1.00 37.55 C ATOM 1436 CE1 TYR A 98 5.109 16.023 59.093 1.00 37.06 C ATOM 1437 CE2 TYR A 98 6.555 14.655 60.421 1.00 38.00 C ATOM 1438 CZ TYR A 98 5.887 15.854 60.206 1.00 37.32 C ATOM 1439 OH TYR A 98 6.014 16.838 61.109 1.00 37.23 O ATOM 1440 HA TYR A 98 5.905 13.915 55.714 1.00 0.00 H ATOM 1441 HB3 TYR A 98 5.954 11.734 57.798 1.00 0.00 H ATOM 1442 HB2 TYR A 98 4.437 12.443 57.196 1.00 0.00 H ATOM 1443 HD2 TYR A 98 6.983 12.715 59.647 1.00 0.00 H ATOM 1444 HE2 TYR A 98 7.164 14.515 61.314 1.00 0.00 H ATOM 1445 HE1 TYR A 98 4.603 16.972 58.914 1.00 0.00 H ATOM 1446 HD1 TYR A 98 4.311 15.088 57.331 1.00 0.00 H ATOM 1447 HH TYR A 98 5.483 17.622 60.818 1.00 0.00 H ATOM 1448 H TYR A 98 5.138 11.093 55.359 1.00 0.00 H ATOM 1449 N ASN A 99 8.395 13.942 55.952 1.00 34.47 N ATOM 1450 CA ASN A 99 9.859 13.940 55.991 1.00 34.92 C ATOM 1451 C ASN A 99 10.315 13.857 57.474 1.00 35.71 C ATOM 1452 O ASN A 99 10.031 14.757 58.294 1.00 34.76 O ATOM 1453 CB ASN A 99 10.428 15.191 55.283 1.00 34.65 C ATOM 1454 CG ASN A 99 11.908 15.048 54.937 1.00 35.20 C ATOM 1455 OD1 ASN A 99 12.434 13.956 54.920 1.00 35.82 O ATOM 1456 ND2 ASN A 99 12.583 16.156 54.687 1.00 34.93 N ATOM 1457 HA ASN A 99 10.246 13.074 55.454 1.00 0.00 H ATOM 1458 HB2 ASN A 99 9.868 15.356 54.362 1.00 0.00 H ATOM 1459 HB3 ASN A 99 10.305 16.051 55.941 1.00 0.00 H ATOM 1460 HD22 ASN A 99 12.099 17.076 54.710 1.00 0.00 H ATOM 1461 HD21 ASN A 99 13.598 16.108 54.467 1.00 0.00 H ATOM 1462 H ASN A 99 7.886 14.840 55.824 1.00 0.00 H ATOM 1463 N ASP A 100 10.910 12.731 57.849 1.00 36.45 N ATOM 1464 CA ASP A 100 11.519 12.597 59.192 1.00 37.24 C ATOM 1465 C ASP A 100 12.741 11.689 59.015 1.00 38.33 C ATOM 1466 O ASP A 100 13.021 11.301 57.872 1.00 38.56 O ATOM 1467 CB ASP A 100 10.496 12.079 60.216 1.00 36.65 C ATOM 1468 CG ASP A 100 10.881 12.408 61.669 1.00 37.88 C ATOM 1469 OD1 ASP A 100 12.043 12.806 61.911 1.00 39.32 O ATOM 1470 OD2 ASP A 100 10.045 12.254 62.605 1.00 37.67 O ATOM 1471 HA ASP A 100 11.838 13.556 59.600 1.00 0.00 H ATOM 1472 HB2 ASP A 100 9.529 12.533 60.001 1.00 0.00 H ATOM 1473 HB3 ASP A 100 10.419 10.997 60.113 1.00 0.00 H ATOM 1474 H ASP A 100 10.949 11.929 57.188 1.00 0.00 H ATOM 1475 N VAL A 101 13.477 11.406 60.097 1.00 39.16 N ATOM 1476 CA VAL A 101 14.650 10.522 60.086 1.00 40.51 C ATOM 1477 C VAL A 101 14.164 9.082 60.229 1.00 41.63 C ATOM 1478 O VAL A 101 13.321 8.808 61.102 1.00 42.12 O ATOM 1479 CB VAL A 101 15.640 10.805 61.254 1.00 41.48 C ATOM 1480 CG1 VAL A 101 16.588 9.619 61.462 1.00 43.20 C ATOM 1481 CG2 VAL A 101 16.440 12.062 60.983 1.00 40.94 C ATOM 1482 HA VAL A 101 15.179 10.698 59.149 1.00 0.00 H ATOM 1483 HB VAL A 101 15.055 10.949 62.162 1.00 0.00 H ATOM 1484 HG11 VAL A 101 16.007 8.728 61.701 1.00 0.00 H ATOM 1485 HG12 VAL A 101 17.159 9.448 60.550 1.00 0.00 H ATOM 1486 HG13 VAL A 101 17.270 9.840 62.283 1.00 0.00 H ATOM 1487 HG21 VAL A 101 17.008 11.938 60.061 1.00 0.00 H ATOM 1488 HG22 VAL A 101 15.761 12.909 60.882 1.00 0.00 H ATOM 1489 HG23 VAL A 101 17.125 12.241 61.812 1.00 0.00 H ATOM 1490 H VAL A 101 13.201 11.839 61.001 1.00 0.00 H ATOM 1491 N PRO A 102 14.687 8.155 59.384 1.00 42.00 N ATOM 1492 CA PRO A 102 14.242 6.760 59.509 1.00 43.36 C ATOM 1493 C PRO A 102 14.324 6.275 60.938 1.00 45.00 C ATOM 1494 O PRO A 102 15.363 6.510 61.619 1.00 44.40 O ATOM 1495 CB PRO A 102 15.223 5.974 58.620 1.00 43.63 C ATOM 1496 CG PRO A 102 15.664 6.980 57.618 1.00 43.47 C ATOM 1497 CD PRO A 102 15.686 8.325 58.323 1.00 41.91 C ATOM 1498 HA PRO A 102 13.200 6.637 59.212 1.00 0.00 H ATOM 1499 HD3 PRO A 102 16.671 8.533 58.741 1.00 0.00 H ATOM 1500 HD2 PRO A 102 15.404 9.129 57.643 1.00 0.00 H ATOM 1501 HG3 PRO A 102 14.966 7.007 56.781 1.00 0.00 H ATOM 1502 HG2 PRO A 102 16.660 6.732 57.251 1.00 0.00 H ATOM 1503 HB2 PRO A 102 16.068 5.607 59.202 1.00 0.00 H ATOM 1504 HB3 PRO A 102 14.724 5.134 58.136 1.00 0.00 H ATOM 1505 N GLY A 103 13.239 5.579 61.344 1.00 46.07 N ATOM 1506 CA GLY A 103 13.053 5.012 62.684 1.00 46.55 C ATOM 1507 C GLY A 103 12.670 6.057 63.758 1.00 45.83 C ATOM 1508 O GLY A 103 12.654 5.755 64.961 1.00 46.01 O ATOM 1509 HA3 GLY A 103 13.984 4.533 62.987 1.00 0.00 H ATOM 1510 HA2 GLY A 103 12.261 4.265 62.634 1.00 0.00 H ATOM 1511 H GLY A 103 12.476 5.434 60.652 1.00 0.00 H ATOM 1512 N THR A 104 12.364 7.295 63.397 1.00 43.97 N ATOM 1513 CA THR A 104 12.084 8.220 64.502 1.00 43.31 C ATOM 1514 C THR A 104 10.684 8.783 64.374 1.00 42.19 C ATOM 1515 O THR A 104 10.378 9.909 64.868 1.00 39.94 O ATOM 1516 CB THR A 104 13.105 9.354 64.592 1.00 43.15 C ATOM 1517 OG1 THR A 104 12.914 10.231 63.485 1.00 42.08 O ATOM 1518 CG2 THR A 104 14.528 8.824 64.591 1.00 44.53 C ATOM 1519 HA THR A 104 12.162 7.646 65.426 1.00 0.00 H ATOM 1520 HB THR A 104 12.953 9.888 65.530 1.00 0.00 H ATOM 1521 HG1 THR A 104 13.042 9.729 62.642 1.00 0.00 H ATOM 1522 HG23 THR A 104 14.666 8.155 65.440 1.00 0.00 H ATOM 1523 HG21 THR A 104 14.711 8.280 63.664 1.00 0.00 H ATOM 1524 HG22 THR A 104 15.225 9.658 64.668 1.00 0.00 H ATOM 1525 H THR A 104 12.325 7.590 62.401 1.00 0.00 H ATOM 1526 N TYR A 105 9.871 7.950 63.720 1.00 41.41 N ATOM 1527 CA TYR A 105 8.567 8.299 63.198 1.00 42.22 C ATOM 1528 C TYR A 105 7.492 8.058 64.216 1.00 43.45 C ATOM 1529 O TYR A 105 6.415 8.647 64.113 1.00 43.56 O ATOM 1530 CB TYR A 105 8.231 7.456 61.945 1.00 42.47 C ATOM 1531 CG TYR A 105 8.603 8.082 60.627 1.00 40.83 C ATOM 1532 CD1 TYR A 105 9.920 7.993 60.151 1.00 40.97 C ATOM 1533 CD2 TYR A 105 7.651 8.770 59.853 1.00 39.66 C ATOM 1534 CE1 TYR A 105 10.295 8.575 58.945 1.00 40.01 C ATOM 1535 CE2 TYR A 105 8.015 9.347 58.647 1.00 38.82 C ATOM 1536 CZ TYR A 105 9.341 9.223 58.180 1.00 38.78 C ATOM 1537 OH TYR A 105 9.741 9.826 56.980 1.00 36.99 O ATOM 1538 HA TYR A 105 8.604 9.358 62.941 1.00 0.00 H ATOM 1539 HB3 TYR A 105 7.156 7.274 61.940 1.00 0.00 H ATOM 1540 HB2 TYR A 105 8.759 6.506 62.027 1.00 0.00 H ATOM 1541 HD2 TYR A 105 6.622 8.850 60.204 1.00 0.00 H ATOM 1542 HE2 TYR A 105 7.279 9.896 58.060 1.00 0.00 H ATOM 1543 HE1 TYR A 105 11.329 8.521 58.606 1.00 0.00 H ATOM 1544 HD1 TYR A 105 10.665 7.456 60.739 1.00 0.00 H ATOM 1545 HH TYR A 105 9.608 10.805 57.044 1.00 0.00 H ATOM 1546 H TYR A 105 10.200 6.974 63.574 1.00 0.00 H ATOM 1547 N GLY A 106 7.801 7.222 65.200 1.00 44.89 N ATOM 1548 CA GLY A 106 6.852 6.777 66.214 1.00 46.07 C ATOM 1549 C GLY A 106 6.379 7.887 67.132 1.00 45.60 C ATOM 1550 O GLY A 106 5.269 7.825 67.642 1.00 46.85 O ATOM 1551 HA3 GLY A 106 7.331 6.008 66.821 1.00 0.00 H ATOM 1552 HA2 GLY A 106 5.983 6.352 65.711 1.00 0.00 H ATOM 1553 H GLY A 106 8.776 6.864 65.251 1.00 0.00 H ATOM 1554 N ASN A 107 7.184 8.921 67.342 1.00 44.53 N ATOM 1555 CA ASN A 107 6.720 10.007 68.181 1.00 44.47 C ATOM 1556 C ASN A 107 6.101 11.118 67.356 1.00 43.04 C ATOM 1557 O ASN A 107 5.948 12.246 67.840 1.00 43.12 O ATOM 1558 CB ASN A 107 7.849 10.540 69.085 1.00 44.49 C ATOM 1559 CG ASN A 107 8.858 11.405 68.322 1.00 43.15 C ATOM 1560 OD1 ASN A 107 8.997 11.301 67.101 1.00 42.25 O ATOM 1561 ND2 ASN A 107 9.600 12.217 69.051 1.00 42.71 N ATOM 1562 HA ASN A 107 5.940 9.609 68.831 1.00 0.00 H ATOM 1563 HB2 ASN A 107 7.406 11.140 69.880 1.00 0.00 H ATOM 1564 HB3 ASN A 107 8.376 9.692 69.522 1.00 0.00 H ATOM 1565 HD22 ASN A 107 9.451 12.276 70.079 1.00 0.00 H ATOM 1566 HD21 ASN A 107 10.334 12.798 68.598 1.00 0.00 H ATOM 1567 H ASN A 107 8.131 8.951 66.912 1.00 0.00 H ATOM 1568 N ASN A 108 5.788 10.838 66.090 1.00 41.86 N ATOM 1569 CA ASN A 108 5.163 11.869 65.241 1.00 39.70 C ATOM 1570 C ASN A 108 3.665 11.959 65.495 1.00 40.15 C ATOM 1571 O ASN A 108 3.052 10.986 65.934 1.00 40.41 O ATOM 1572 CB ASN A 108 5.452 11.565 63.763 1.00 38.22 C ATOM 1573 CG ASN A 108 6.929 11.696 63.447 1.00 37.57 C ATOM 1574 OD1 ASN A 108 7.787 11.948 64.355 1.00 37.97 O ATOM 1575 ND2 ASN A 108 7.252 11.526 62.192 1.00 35.54 N ATOM 1576 HA ASN A 108 5.593 12.838 65.495 1.00 0.00 H ATOM 1577 HB2 ASN A 108 5.131 10.547 63.541 1.00 0.00 H ATOM 1578 HB3 ASN A 108 4.893 12.265 63.141 1.00 0.00 H ATOM 1579 HD22 ASN A 108 6.514 11.322 61.488 1.00 0.00 H ATOM 1580 HD21 ASN A 108 8.247 11.595 61.897 1.00 0.00 H ATOM 1581 H ASN A 108 5.985 9.893 65.702 1.00 0.00 H ATOM 1582 N SER A 109 3.072 13.102 65.182 1.00 39.25 N ATOM 1583 CA SER A 109 1.620 13.292 65.341 1.00 40.52 C ATOM 1584 C SER A 109 1.037 14.214 64.253 1.00 39.58 C ATOM 1585 O SER A 109 1.762 14.981 63.638 1.00 38.07 O ATOM 1586 CB SER A 109 1.317 13.897 66.726 1.00 42.16 C ATOM 1587 OG SER A 109 2.018 15.143 66.905 1.00 41.21 O ATOM 1588 HA SER A 109 1.153 12.312 65.245 1.00 0.00 H ATOM 1589 HB2 SER A 109 1.631 13.196 67.499 1.00 0.00 H ATOM 1590 HB3 SER A 109 0.245 14.074 66.812 1.00 0.00 H ATOM 1591 HG SER A 109 1.809 15.512 67.799 1.00 0.00 H ATOM 1592 H SER A 109 3.647 13.886 64.814 1.00 0.00 H ATOM 1593 N GLY A 110 -0.281 14.128 64.063 1.00 40.64 N ATOM 1594 CA GLY A 110 -1.028 14.964 63.131 1.00 40.43 C ATOM 1595 C GLY A 110 -0.828 14.461 61.701 1.00 39.90 C ATOM 1596 O GLY A 110 -0.237 13.384 61.467 1.00 39.54 O ATOM 1597 HA3 GLY A 110 -0.674 15.992 63.205 1.00 0.00 H ATOM 1598 HA2 GLY A 110 -2.088 14.927 63.382 1.00 0.00 H ATOM 1599 H GLY A 110 -0.808 13.421 64.614 1.00 0.00 H ATOM 1600 N SER A 111 -1.312 15.238 60.733 1.00 39.31 N ATOM 1601 CA SER A 111 -1.343 14.783 59.363 1.00 38.84 C ATOM 1602 C SER A 111 -1.495 15.927 58.369 1.00 38.87 C ATOM 1603 O SER A 111 -1.853 17.056 58.747 1.00 40.53 O ATOM 1604 CB SER A 111 -2.527 13.824 59.180 1.00 39.69 C ATOM 1605 OG SER A 111 -3.719 14.561 59.362 1.00 39.96 O ATOM 1606 HA SER A 111 -0.392 14.289 59.165 1.00 0.00 H ATOM 1607 HB2 SER A 111 -2.471 13.022 59.917 1.00 0.00 H ATOM 1608 HB3 SER A 111 -2.506 13.397 58.178 1.00 0.00 H ATOM 1609 HG SER A 111 -3.761 15.289 58.692 1.00 0.00 H ATOM 1610 H SER A 111 -1.672 16.185 60.967 1.00 0.00 H ATOM 1611 N PHE A 112 -1.279 15.623 57.084 1.00 37.93 N ATOM 1612 CA PHE A 112 -1.677 16.571 56.030 1.00 36.89 C ATOM 1613 C PHE A 112 -2.799 16.057 55.137 1.00 37.22 C ATOM 1614 O PHE A 112 -2.839 14.873 54.735 1.00 36.29 O ATOM 1615 CB PHE A 112 -0.509 16.925 55.141 1.00 35.25 C ATOM 1616 CG PHE A 112 0.651 17.496 55.865 1.00 34.88 C ATOM 1617 CD1 PHE A 112 0.502 18.616 56.713 1.00 35.50 C ATOM 1618 CD2 PHE A 112 1.914 16.986 55.626 1.00 33.75 C ATOM 1619 CE1 PHE A 112 1.603 19.170 57.360 1.00 35.48 C ATOM 1620 CE2 PHE A 112 3.027 17.547 56.251 1.00 34.43 C ATOM 1621 CZ PHE A 112 2.877 18.626 57.125 1.00 34.80 C ATOM 1622 HA PHE A 112 -2.038 17.447 56.569 1.00 0.00 H ATOM 1623 HB2 PHE A 112 -0.182 16.020 54.629 1.00 0.00 H ATOM 1624 HB3 PHE A 112 -0.847 17.655 54.406 1.00 0.00 H ATOM 1625 HD2 PHE A 112 2.040 16.143 54.947 1.00 0.00 H ATOM 1626 HE2 PHE A 112 4.020 17.141 56.056 1.00 0.00 H ATOM 1627 HZ PHE A 112 3.749 19.047 57.625 1.00 0.00 H ATOM 1628 HE1 PHE A 112 1.479 20.014 58.039 1.00 0.00 H ATOM 1629 HD1 PHE A 112 -0.486 19.051 56.862 1.00 0.00 H ATOM 1630 H PHE A 112 -0.831 14.719 56.830 1.00 0.00 H ATOM 1631 N SER A 113 -3.687 16.976 54.803 1.00 37.39 N ATOM 1632 CA SER A 113 -4.699 16.724 53.835 1.00 38.20 C ATOM 1633 C SER A 113 -4.077 17.008 52.486 1.00 36.85 C ATOM 1634 O SER A 113 -3.577 18.086 52.270 1.00 36.64 O ATOM 1635 CB SER A 113 -5.818 17.717 54.068 1.00 40.33 C ATOM 1636 OG SER A 113 -7.049 17.070 53.901 1.00 42.16 O ATOM 1637 HA SER A 113 -5.082 15.705 53.893 1.00 0.00 H ATOM 1638 HB2 SER A 113 -5.735 18.535 53.352 1.00 0.00 H ATOM 1639 HB3 SER A 113 -5.749 18.114 55.081 1.00 0.00 H ATOM 1640 HG SER A 113 -7.121 16.328 54.552 1.00 0.00 H ATOM 1641 H SER A 113 -3.645 17.909 55.260 1.00 0.00 H ATOM 1642 N VAL A 114 -4.080 16.048 51.581 1.00 36.21 N ATOM 1643 CA VAL A 114 -3.478 16.316 50.286 1.00 35.50 C ATOM 1644 C VAL A 114 -4.478 16.002 49.166 1.00 36.12 C ATOM 1645 O VAL A 114 -5.140 14.933 49.184 1.00 36.18 O ATOM 1646 CB VAL A 114 -2.179 15.485 50.042 1.00 34.78 C ATOM 1647 CG1 VAL A 114 -1.491 15.985 48.784 1.00 33.86 C ATOM 1648 CG2 VAL A 114 -1.215 15.578 51.233 1.00 33.75 C ATOM 1649 HA VAL A 114 -3.209 17.372 50.280 1.00 0.00 H ATOM 1650 HB VAL A 114 -2.462 14.439 49.924 1.00 0.00 H ATOM 1651 HG11 VAL A 114 -2.163 15.870 47.934 1.00 0.00 H ATOM 1652 HG12 VAL A 114 -1.234 17.037 48.906 1.00 0.00 H ATOM 1653 HG13 VAL A 114 -0.584 15.405 48.613 1.00 0.00 H ATOM 1654 HG21 VAL A 114 -0.933 16.619 51.390 1.00 0.00 H ATOM 1655 HG22 VAL A 114 -1.706 15.194 52.127 1.00 0.00 H ATOM 1656 HG23 VAL A 114 -0.324 14.986 51.024 1.00 0.00 H ATOM 1657 H VAL A 114 -4.503 15.121 51.790 1.00 0.00 H ATOM 1658 N ASN A 115 -4.595 16.943 48.217 1.00 35.41 N ATOM 1659 CA ASN A 115 -5.274 16.681 46.932 1.00 35.98 C ATOM 1660 C ASN A 115 -4.260 16.538 45.785 1.00 35.44 C ATOM 1661 O ASN A 115 -3.370 17.381 45.664 1.00 34.81 O ATOM 1662 CB ASN A 115 -6.211 17.828 46.545 1.00 36.63 C ATOM 1663 CG ASN A 115 -7.517 17.839 47.332 1.00 38.01 C ATOM 1664 OD1 ASN A 115 -8.542 17.315 46.879 1.00 38.79 O ATOM 1665 ND2 ASN A 115 -7.492 18.474 48.498 1.00 38.13 N ATOM 1666 HA ASN A 115 -5.836 15.758 47.074 1.00 0.00 H ATOM 1667 HB2 ASN A 115 -5.694 18.771 46.722 1.00 0.00 H ATOM 1668 HB3 ASN A 115 -6.448 17.738 45.485 1.00 0.00 H ATOM 1669 HD22 ASN A 115 -6.607 18.900 48.839 1.00 0.00 H ATOM 1670 HD21 ASN A 115 -8.358 18.546 49.070 1.00 0.00 H ATOM 1671 H ASN A 115 -4.195 17.887 48.392 1.00 0.00 H ATOM 1672 N ILE A 116 -4.390 15.464 44.983 1.00 34.86 N ATOM 1673 CA ILE A 116 -3.657 15.304 43.718 1.00 34.67 C ATOM 1674 C ILE A 116 -4.647 15.136 42.543 1.00 35.26 C ATOM 1675 O ILE A 116 -5.619 14.337 42.612 1.00 36.12 O ATOM 1676 CB ILE A 116 -2.694 14.072 43.694 1.00 34.74 C ATOM 1677 CG1 ILE A 116 -2.019 13.888 45.055 1.00 34.57 C ATOM 1678 CG2 ILE A 116 -1.660 14.195 42.553 1.00 33.50 C ATOM 1679 CD1 ILE A 116 -0.839 12.950 45.068 1.00 35.14 C ATOM 1680 HA ILE A 116 -3.056 16.208 43.621 1.00 0.00 H ATOM 1681 HB ILE A 116 -3.286 13.178 43.495 1.00 0.00 H ATOM 1682 HG12 ILE A 116 -1.677 14.865 45.396 1.00 0.00 H ATOM 1683 HG13 ILE A 116 -2.764 13.502 45.751 1.00 0.00 H ATOM 1684 HD11 ILE A 116 -1.160 11.960 44.745 1.00 0.00 H ATOM 1685 HD12 ILE A 116 -0.072 13.324 44.390 1.00 0.00 H ATOM 1686 HD13 ILE A 116 -0.435 12.891 46.079 1.00 0.00 H ATOM 1687 HG21 ILE A 116 -2.181 14.249 41.597 1.00 0.00 H ATOM 1688 HG22 ILE A 116 -1.067 15.098 42.697 1.00 0.00 H ATOM 1689 HG23 ILE A 116 -1.005 13.324 42.562 1.00 0.00 H ATOM 1690 H ILE A 116 -5.043 14.708 45.273 1.00 0.00 H ATOM 1691 N GLY A 117 -4.380 15.871 41.466 1.00 35.03 N ATOM 1692 CA GLY A 117 -5.239 15.875 40.240 1.00 35.76 C ATOM 1693 C GLY A 117 -4.345 15.859 39.021 1.00 35.72 C ATOM 1694 O GLY A 117 -3.240 16.428 39.077 1.00 35.14 O ATOM 1695 HA3 GLY A 117 -5.859 16.772 40.229 1.00 0.00 H ATOM 1696 HA2 GLY A 117 -5.879 14.993 40.237 1.00 0.00 H ATOM 1697 H GLY A 117 -3.532 16.473 41.477 1.00 0.00 H ATOM 1698 N LYS A 118 -4.760 15.181 37.936 1.00 36.35 N ATOM 1699 CA LYS A 118 -3.976 15.275 36.698 1.00 36.87 C ATOM 1700 C LYS A 118 -4.461 16.496 35.950 1.00 37.46 C ATOM 1701 O LYS A 118 -5.646 16.738 35.901 1.00 38.69 O ATOM 1702 CB LYS A 118 -4.065 14.020 35.825 1.00 37.03 C ATOM 1703 CG LYS A 118 -3.321 12.866 36.441 1.00 37.18 C ATOM 1704 CD LYS A 118 -3.152 11.658 35.514 1.00 38.16 C ATOM 1705 CE LYS A 118 -2.388 10.545 36.260 1.00 37.95 C ATOM 1706 NZ LYS A 118 -2.065 9.385 35.378 1.00 38.60 N ATOM 1707 HA LYS A 118 -2.920 15.363 36.954 1.00 0.00 H ATOM 1708 HB2 LYS A 118 -5.113 13.744 35.707 1.00 0.00 H ATOM 1709 HB3 LYS A 118 -3.635 14.237 34.847 1.00 0.00 H ATOM 1710 HG2 LYS A 118 -2.330 13.215 36.732 1.00 0.00 H ATOM 1711 HG3 LYS A 118 -3.866 12.543 37.328 1.00 0.00 H ATOM 1712 HD2 LYS A 118 -4.133 11.289 35.214 1.00 0.00 H ATOM 1713 HD3 LYS A 118 -2.591 11.954 34.628 1.00 0.00 H ATOM 1714 HE2 LYS A 118 -3.002 10.194 37.089 1.00 0.00 H ATOM 1715 HE3 LYS A 118 -1.458 10.959 36.649 1.00 0.00 H ATOM 1716 HZ1 LYS A 118 -2.947 8.977 35.008 1.00 0.00 H ATOM 1717 HZ2 LYS A 118 -1.472 9.707 34.587 1.00 0.00 H ATOM 1718 HZ3 LYS A 118 -1.552 8.666 35.927 1.00 0.00 H ATOM 1719 H LYS A 118 -5.622 14.600 37.973 1.00 0.00 H ATOM 1720 N ASP A 119 -3.561 17.278 35.384 1.00 38.03 N ATOM 1721 CA ASP A 119 -3.991 18.482 34.643 1.00 39.34 C ATOM 1722 C ASP A 119 -4.119 18.196 33.141 1.00 41.12 C ATOM 1723 O ASP A 119 -3.595 17.237 32.654 1.00 41.08 O ATOM 1724 CB ASP A 119 -3.037 19.618 34.912 1.00 39.15 C ATOM 1725 CG ASP A 119 -2.985 20.009 36.416 1.00 39.51 C ATOM 1726 OD1 ASP A 119 -4.050 20.025 37.106 1.00 39.84 O ATOM 1727 OD2 ASP A 119 -1.862 20.294 36.914 1.00 38.99 O ATOM 1728 HA ASP A 119 -4.980 18.774 34.995 1.00 0.00 H ATOM 1729 HB2 ASP A 119 -2.038 19.319 34.594 1.00 0.00 H ATOM 1730 HB3 ASP A 119 -3.356 20.486 34.336 1.00 0.00 H ATOM 1731 H ASP A 119 -2.550 17.047 35.459 1.00 0.00 H ATOM 1732 N GLN A 120 -4.870 19.017 32.424 1.00 43.16 N ATOM 1733 CA GLN A 120 -4.880 19.025 30.979 1.00 45.25 C ATOM 1734 C GLN A 120 -3.442 19.054 30.446 1.00 46.18 C ATOM 1735 O GLN A 120 -2.606 19.711 31.034 1.00 46.23 O ATOM 1736 CB GLN A 120 -5.595 20.292 30.544 1.00 46.53 C ATOM 1737 CG GLN A 120 -6.723 20.031 29.591 1.00 48.03 C ATOM 1738 CD GLN A 120 -7.730 21.164 29.551 1.00 49.39 C ATOM 1739 OE1 GLN A 120 -7.382 22.288 29.156 1.00 49.56 O ATOM 1740 NE2 GLN A 120 -9.005 20.866 29.943 1.00 48.55 N ATOM 1741 HA GLN A 120 -5.377 18.135 30.595 1.00 0.00 H ATOM 1742 HB2 GLN A 120 -5.995 20.787 31.429 1.00 0.00 H ATOM 1743 HB3 GLN A 120 -4.874 20.949 30.057 1.00 0.00 H ATOM 1744 HG2 GLN A 120 -6.311 19.895 28.591 1.00 0.00 H ATOM 1745 HG3 GLN A 120 -7.235 19.119 29.898 1.00 0.00 H ATOM 1746 HE22 GLN A 120 -9.239 19.905 30.265 1.00 0.00 H ATOM 1747 HE21 GLN A 120 -9.741 21.600 29.919 1.00 0.00 H ATOM 1748 H GLN A 120 -5.484 19.690 32.926 1.00 0.00 H ATOM 1749 N SER A 121 -3.138 18.276 29.405 1.00 47.64 N ATOM 1750 CA SER A 121 -1.894 18.441 28.632 1.00 49.25 C ATOM 1751 C SER A 121 -2.181 18.099 27.182 1.00 51.68 C ATOM 1752 O SER A 121 -1.976 18.875 26.253 1.00 54.04 O ATOM 1753 CB SER A 121 -0.778 17.572 29.160 1.00 48.54 C ATOM 1754 OG SER A 121 -1.257 16.282 29.448 1.00 48.50 O ATOM 1755 HA SER A 121 -1.561 19.475 28.724 1.00 0.00 H ATOM 1756 OXT SER A 121 -2.705 17.045 26.908 1.00 52.78 O ATOM 1757 HB2 SER A 121 -0.375 18.017 30.070 1.00 0.00 H ATOM 1758 HB3 SER A 121 0.010 17.504 28.410 1.00 0.00 H ATOM 1759 HG SER A 121 -0.515 15.725 29.793 1.00 0.00 H ATOM 1760 H SER A 121 -3.803 17.526 29.129 1.00 0.00 H TER 1761 SER A 121 ATOM 1762 N ALA B 1 -3.388 31.781 33.404 1.00 45.65 N ATOM 1763 CA ALA B 1 -2.781 31.480 34.736 1.00 44.51 C ATOM 1764 C ALA B 1 -1.996 32.688 35.183 1.00 44.68 C ATOM 1765 O ALA B 1 -1.477 33.427 34.358 1.00 46.86 O ATOM 1766 CB ALA B 1 -1.854 30.280 34.628 1.00 44.01 C ATOM 1767 HA ALA B 1 -3.565 31.249 35.457 1.00 0.00 H ATOM 1768 HB1 ALA B 1 -2.421 29.413 34.289 1.00 0.00 H ATOM 1769 HB2 ALA B 1 -1.060 30.499 33.914 1.00 0.00 H ATOM 1770 HB3 ALA B 1 -1.418 30.070 35.605 1.00 0.00 H ATOM 1771 HN3 ALA B 1 -2.633 31.990 32.720 1.00 0.00 H ATOM 1772 HN2 ALA B 1 -4.018 32.604 33.489 1.00 0.00 H ATOM 1773 HN1 ALA B 1 -3.934 30.958 33.079 1.00 0.00 H ATOM 1774 N TRP B 2 -1.873 32.884 36.478 1.00 43.69 N ATOM 1775 CA TRP B 2 -1.105 34.021 36.984 1.00 43.82 C ATOM 1776 C TRP B 2 -0.018 33.480 37.855 1.00 42.62 C ATOM 1777 O TRP B 2 -0.225 32.519 38.576 1.00 40.26 O ATOM 1778 CB TRP B 2 -2.009 34.932 37.798 1.00 43.40 C ATOM 1779 CG TRP B 2 -1.283 36.108 38.427 1.00 44.69 C ATOM 1780 CD1 TRP B 2 -1.019 37.362 37.855 1.00 46.25 C ATOM 1781 CD2 TRP B 2 -0.713 36.182 39.768 1.00 43.74 C ATOM 1782 NE1 TRP B 2 -0.336 38.163 38.722 1.00 46.66 N ATOM 1783 CE2 TRP B 2 -0.121 37.533 39.888 1.00 45.44 C ATOM 1784 CE3 TRP B 2 -0.630 35.308 40.839 1.00 42.67 C ATOM 1785 CZ2 TRP B 2 0.517 37.961 41.049 1.00 45.59 C ATOM 1786 CZ3 TRP B 2 0.033 35.733 41.994 1.00 42.97 C ATOM 1787 CH2 TRP B 2 0.590 37.041 42.101 1.00 44.33 C ATOM 1788 HA TRP B 2 -0.686 34.598 36.159 1.00 0.00 H ATOM 1789 HB2 TRP B 2 -2.789 35.319 37.142 1.00 0.00 H ATOM 1790 HB3 TRP B 2 -2.465 34.343 38.594 1.00 0.00 H ATOM 1791 HE1 TRP B 2 -0.024 39.132 38.509 1.00 0.00 H ATOM 1792 HD1 TRP B 2 -1.320 37.657 36.850 1.00 0.00 H ATOM 1793 HZ2 TRP B 2 0.939 38.963 41.134 1.00 0.00 H ATOM 1794 HH2 TRP B 2 1.086 37.332 43.027 1.00 0.00 H ATOM 1795 HZ3 TRP B 2 0.127 35.046 42.835 1.00 0.00 H ATOM 1796 HE3 TRP B 2 -1.071 34.313 40.783 1.00 0.00 H ATOM 1797 H TRP B 2 -2.324 32.227 37.146 1.00 0.00 H ATOM 1798 N LYS B 3 1.147 34.101 37.825 1.00 43.78 N ATOM 1799 CA LYS B 3 2.145 33.800 38.849 1.00 44.53 C ATOM 1800 C LYS B 3 2.859 35.083 39.342 1.00 44.85 C ATOM 1801 O LYS B 3 3.160 35.928 38.528 1.00 46.44 O ATOM 1802 CB LYS B 3 3.171 32.788 38.317 1.00 45.93 C ATOM 1803 CG LYS B 3 4.263 32.459 39.328 1.00 46.88 C ATOM 1804 CD LYS B 3 5.427 31.705 38.706 1.00 48.63 C ATOM 1805 CE LYS B 3 6.369 31.242 39.822 1.00 49.78 C ATOM 1806 NZ LYS B 3 7.433 30.316 39.323 1.00 53.11 N ATOM 1807 HA LYS B 3 1.624 33.361 39.700 1.00 0.00 H ATOM 1808 HB2 LYS B 3 2.649 31.867 38.058 1.00 0.00 H ATOM 1809 HB3 LYS B 3 3.638 33.203 37.424 1.00 0.00 H ATOM 1810 HG2 LYS B 3 4.637 33.390 39.754 1.00 0.00 H ATOM 1811 HG3 LYS B 3 3.833 31.846 40.120 1.00 0.00 H ATOM 1812 HD2 LYS B 3 5.053 30.839 38.159 1.00 0.00 H ATOM 1813 HD3 LYS B 3 5.965 32.361 38.021 1.00 0.00 H ATOM 1814 HE2 LYS B 3 5.784 30.725 40.583 1.00 0.00 H ATOM 1815 HE3 LYS B 3 6.845 32.117 40.264 1.00 0.00 H ATOM 1816 HZ1 LYS B 3 6.989 29.473 38.906 1.00 0.00 H ATOM 1817 HZ2 LYS B 3 8.003 30.802 38.602 1.00 0.00 H ATOM 1818 HZ3 LYS B 3 8.043 30.032 40.116 1.00 0.00 H ATOM 1819 H LYS B 3 1.352 34.797 37.080 1.00 0.00 H ATOM 1820 N GLY B 4 3.139 35.201 40.645 1.00 44.34 N ATOM 1821 CA GLY B 4 3.935 36.327 41.197 1.00 45.62 C ATOM 1822 C GLY B 4 4.171 36.195 42.686 1.00 45.15 C ATOM 1823 O GLY B 4 3.739 35.181 43.274 1.00 44.67 O ATOM 1824 HA3 GLY B 4 3.401 37.258 41.009 1.00 0.00 H ATOM 1825 HA2 GLY B 4 4.900 36.354 40.691 1.00 0.00 H ATOM 1826 H GLY B 4 2.784 34.474 41.299 1.00 0.00 H ATOM 1827 N GLU B 5 4.883 37.163 43.284 1.00 45.97 N ATOM 1828 CA GLU B 5 5.146 37.231 44.735 1.00 45.95 C ATOM 1829 C GLU B 5 4.079 38.061 45.427 1.00 46.30 C ATOM 1830 O GLU B 5 3.617 39.047 44.860 1.00 47.26 O ATOM 1831 CB GLU B 5 6.460 37.952 45.041 1.00 48.86 C ATOM 1832 CG GLU B 5 7.734 37.299 44.577 1.00 51.56 C ATOM 1833 CD GLU B 5 7.833 35.841 45.008 1.00 52.12 C ATOM 1834 OE1 GLU B 5 7.890 35.576 46.235 1.00 52.45 O ATOM 1835 OE2 GLU B 5 7.854 34.945 44.114 1.00 52.80 O ATOM 1836 HA GLU B 5 5.169 36.198 45.083 1.00 0.00 H ATOM 1837 HB2 GLU B 5 6.409 38.936 44.576 1.00 0.00 H ATOM 1838 HB3 GLU B 5 6.526 38.066 46.123 1.00 0.00 H ATOM 1839 HG2 GLU B 5 7.775 37.346 43.489 1.00 0.00 H ATOM 1840 HG3 GLU B 5 8.580 37.845 44.995 1.00 0.00 H ATOM 1841 H GLU B 5 5.276 37.916 42.684 1.00 0.00 H ATOM 1842 N VAL B 6 3.726 37.698 46.662 1.00 44.96 N ATOM 1843 CA VAL B 6 2.869 38.538 47.512 1.00 45.01 C ATOM 1844 C VAL B 6 3.708 38.948 48.719 1.00 45.06 C ATOM 1845 O VAL B 6 4.041 38.082 49.585 1.00 43.42 O ATOM 1846 CB VAL B 6 1.651 37.724 48.020 1.00 44.72 C ATOM 1847 CG1 VAL B 6 0.723 38.592 48.848 1.00 44.90 C ATOM 1848 CG2 VAL B 6 0.897 37.120 46.832 1.00 45.20 C ATOM 1849 HA VAL B 6 2.508 39.399 46.950 1.00 0.00 H ATOM 1850 HB VAL B 6 2.016 36.919 48.658 1.00 0.00 H ATOM 1851 HG11 VAL B 6 1.265 38.984 49.709 1.00 0.00 H ATOM 1852 HG12 VAL B 6 0.361 39.419 48.238 1.00 0.00 H ATOM 1853 HG13 VAL B 6 -0.122 37.995 49.191 1.00 0.00 H ATOM 1854 HG21 VAL B 6 0.549 37.921 46.179 1.00 0.00 H ATOM 1855 HG22 VAL B 6 1.565 36.461 46.277 1.00 0.00 H ATOM 1856 HG23 VAL B 6 0.043 36.550 47.197 1.00 0.00 H ATOM 1857 H VAL B 6 4.069 36.790 47.036 1.00 0.00 H ATOM 1858 N LEU B 7 4.079 40.231 48.793 1.00 44.31 N ATOM 1859 CA LEU B 7 4.943 40.660 49.887 1.00 44.92 C ATOM 1860 C LEU B 7 4.157 40.735 51.227 1.00 43.98 C ATOM 1861 O LEU B 7 2.997 41.183 51.281 1.00 44.63 O ATOM 1862 CB LEU B 7 5.669 41.983 49.577 1.00 46.15 C ATOM 1863 CG LEU B 7 6.936 41.887 48.730 1.00 47.68 C ATOM 1864 CD1 LEU B 7 6.592 41.687 47.253 1.00 47.60 C ATOM 1865 CD2 LEU B 7 7.820 43.140 48.888 1.00 50.42 C ATOM 1866 HA LEU B 7 5.718 39.902 49.998 1.00 0.00 H ATOM 1867 HB2 LEU B 7 4.967 42.630 49.050 1.00 0.00 H ATOM 1868 HB3 LEU B 7 5.941 42.442 50.528 1.00 0.00 H ATOM 1869 HG LEU B 7 7.495 41.022 49.088 1.00 0.00 H ATOM 1870 HD21 LEU B 7 7.260 44.020 48.572 1.00 0.00 H ATOM 1871 HD22 LEU B 7 8.111 43.248 49.933 1.00 0.00 H ATOM 1872 HD23 LEU B 7 8.712 43.034 48.270 1.00 0.00 H ATOM 1873 HD11 LEU B 7 6.021 40.766 47.136 1.00 0.00 H ATOM 1874 HD12 LEU B 7 5.998 42.531 46.902 1.00 0.00 H ATOM 1875 HD13 LEU B 7 7.512 41.622 46.673 1.00 0.00 H ATOM 1876 H LEU B 7 3.755 40.914 48.079 1.00 0.00 H ATOM 1877 N ALA B 8 4.792 40.291 52.305 1.00 43.22 N ATOM 1878 CA ALA B 8 4.118 40.235 53.570 1.00 42.77 C ATOM 1879 C ALA B 8 3.895 41.670 54.003 1.00 44.59 C ATOM 1880 O ALA B 8 2.858 41.976 54.593 1.00 44.12 O ATOM 1881 CB ALA B 8 4.937 39.488 54.602 1.00 42.67 C ATOM 1882 HA ALA B 8 3.175 39.697 53.477 1.00 0.00 H ATOM 1883 HB1 ALA B 8 5.111 38.469 54.257 1.00 0.00 H ATOM 1884 HB2 ALA B 8 5.892 39.994 54.741 1.00 0.00 H ATOM 1885 HB3 ALA B 8 4.395 39.466 55.547 1.00 0.00 H ATOM 1886 H ALA B 8 5.782 39.982 52.232 1.00 0.00 H ATOM 1887 N ASN B 9 4.838 42.550 53.666 1.00 45.83 N ATOM 1888 CA ASN B 9 4.696 43.950 54.052 1.00 48.13 C ATOM 1889 C ASN B 9 3.808 44.754 53.126 1.00 49.05 C ATOM 1890 O ASN B 9 3.710 45.959 53.282 1.00 50.77 O ATOM 1891 CB ASN B 9 6.054 44.655 54.236 1.00 49.33 C ATOM 1892 CG ASN B 9 6.625 45.162 52.932 1.00 50.32 C ATOM 1893 OD1 ASN B 9 6.139 44.844 51.847 1.00 49.83 O ATOM 1894 ND2 ASN B 9 7.654 45.975 53.038 1.00 51.94 N ATOM 1895 HA ASN B 9 4.195 43.913 55.019 1.00 0.00 H ATOM 1896 HB2 ASN B 9 5.921 45.500 54.911 1.00 0.00 H ATOM 1897 HB3 ASN B 9 6.758 43.948 54.675 1.00 0.00 H ATOM 1898 HD22 ASN B 9 8.032 46.216 53.977 1.00 0.00 H ATOM 1899 HD21 ASN B 9 8.090 46.377 52.183 1.00 0.00 H ATOM 1900 H ASN B 9 5.673 42.239 53.129 1.00 0.00 H ATOM 1901 N ASN B 10 3.176 44.106 52.161 1.00 48.34 N ATOM 1902 CA ASN B 10 2.322 44.835 51.211 1.00 49.30 C ATOM 1903 C ASN B 10 0.861 44.960 51.682 1.00 49.18 C ATOM 1904 O ASN B 10 -0.033 44.210 51.299 1.00 48.77 O ATOM 1905 CB ASN B 10 2.408 44.211 49.819 1.00 49.20 C ATOM 1906 CG ASN B 10 1.455 44.844 48.836 1.00 50.21 C ATOM 1907 OD1 ASN B 10 0.701 45.758 49.165 1.00 52.01 O ATOM 1908 ND2 ASN B 10 1.496 44.365 47.597 1.00 49.89 N ATOM 1909 HA ASN B 10 2.708 45.853 51.161 1.00 0.00 H ATOM 1910 HB2 ASN B 10 3.425 44.331 49.445 1.00 0.00 H ATOM 1911 HB3 ASN B 10 2.174 43.149 49.898 1.00 0.00 H ATOM 1912 HD22 ASN B 10 2.149 43.591 47.360 1.00 0.00 H ATOM 1913 HD21 ASN B 10 0.875 44.764 46.864 1.00 0.00 H ATOM 1914 H ASN B 10 3.284 43.075 52.074 1.00 0.00 H ATOM 1915 N GLU B 11 0.605 45.943 52.501 1.00 50.34 N ATOM 1916 CA GLU B 11 -0.688 46.016 53.118 1.00 50.19 C ATOM 1917 C GLU B 11 -1.849 45.988 52.138 1.00 49.82 C ATOM 1918 O GLU B 11 -2.832 45.334 52.381 1.00 48.89 O ATOM 1919 CB GLU B 11 -0.747 47.303 53.948 1.00 52.02 C ATOM 1920 CG GLU B 11 -2.135 47.670 54.399 1.00 52.29 C ATOM 1921 CD GLU B 11 -2.071 48.184 55.940 1.00 51.67 C ATOM 1922 OE1 GLU B 11 -1.029 48.783 56.320 1.00 54.49 O ATOM 1923 OE2 GLU B 11 -3.037 47.950 56.652 1.00 52.38 O ATOM 1924 HA GLU B 11 -0.802 45.125 53.735 1.00 0.00 H ATOM 1925 HB2 GLU B 11 -0.121 47.172 54.831 1.00 0.00 H ATOM 1926 HB3 GLU B 11 -0.354 48.121 53.344 1.00 0.00 H ATOM 1927 HG2 GLU B 11 -2.528 48.464 53.764 1.00 0.00 H ATOM 1928 HG3 GLU B 11 -2.785 46.797 54.331 1.00 0.00 H ATOM 1929 H GLU B 11 1.328 46.663 52.703 1.00 0.00 H ATOM 1930 N ALA B 12 -1.749 46.748 51.064 1.00 51.00 N ATOM 1931 CA ALA B 12 -2.858 46.910 50.122 1.00 51.50 C ATOM 1932 C ALA B 12 -3.122 45.604 49.345 1.00 49.95 C ATOM 1933 O ALA B 12 -4.237 45.377 48.862 1.00 49.64 O ATOM 1934 CB ALA B 12 -2.563 48.072 49.152 1.00 53.96 C ATOM 1935 HA ALA B 12 -3.759 47.146 50.689 1.00 0.00 H ATOM 1936 HB1 ALA B 12 -2.437 48.994 49.719 1.00 0.00 H ATOM 1937 HB2 ALA B 12 -1.650 47.857 48.597 1.00 0.00 H ATOM 1938 HB3 ALA B 12 -3.395 48.183 48.456 1.00 0.00 H ATOM 1939 H ALA B 12 -0.855 47.247 50.881 1.00 0.00 H ATOM 1940 N GLY B 13 -2.118 44.739 49.248 1.00 47.93 N ATOM 1941 CA GLY B 13 -2.301 43.476 48.562 1.00 47.31 C ATOM 1942 C GLY B 13 -1.635 43.417 47.201 1.00 47.70 C ATOM 1943 O GLY B 13 -1.054 44.366 46.735 1.00 49.21 O ATOM 1944 HA3 GLY B 13 -3.370 43.308 48.430 1.00 0.00 H ATOM 1945 HA2 GLY B 13 -1.884 42.683 49.184 1.00 0.00 H ATOM 1946 H GLY B 13 -1.195 44.970 49.667 1.00 0.00 H ATOM 1947 N GLN B 14 -1.714 42.265 46.573 1.00 46.90 N ATOM 1948 CA GLN B 14 -1.010 42.038 45.329 1.00 47.26 C ATOM 1949 C GLN B 14 -2.114 41.691 44.361 1.00 46.83 C ATOM 1950 O GLN B 14 -2.731 40.628 44.470 1.00 45.50 O ATOM 1951 CB GLN B 14 0.019 40.916 45.526 1.00 46.23 C ATOM 1952 CG GLN B 14 0.802 40.504 44.279 1.00 46.60 C ATOM 1953 CD GLN B 14 1.228 41.695 43.473 1.00 48.67 C ATOM 1954 OE1 GLN B 14 2.193 42.377 43.809 1.00 48.96 O ATOM 1955 NE2 GLN B 14 0.513 41.956 42.399 1.00 49.53 N ATOM 1956 HA GLN B 14 -0.432 42.887 44.964 1.00 0.00 H ATOM 1957 HB2 GLN B 14 0.736 41.248 46.277 1.00 0.00 H ATOM 1958 HB3 GLN B 14 -0.510 40.037 45.894 1.00 0.00 H ATOM 1959 HG2 GLN B 14 1.689 39.949 44.586 1.00 0.00 H ATOM 1960 HG3 GLN B 14 0.171 39.866 43.660 1.00 0.00 H ATOM 1961 HE22 GLN B 14 -0.296 41.351 42.153 1.00 0.00 H ATOM 1962 HE21 GLN B 14 0.757 42.768 41.796 1.00 0.00 H ATOM 1963 H GLN B 14 -2.293 41.502 46.978 1.00 0.00 H ATOM 1964 N VAL B 15 -2.455 42.649 43.507 1.00 48.41 N ATOM 1965 CA VAL B 15 -3.449 42.410 42.499 1.00 48.64 C ATOM 1966 C VAL B 15 -2.931 41.306 41.583 1.00 48.21 C ATOM 1967 O VAL B 15 -1.724 41.212 41.337 1.00 49.00 O ATOM 1968 CB VAL B 15 -3.671 43.627 41.634 1.00 51.44 C ATOM 1969 CG1 VAL B 15 -4.933 43.393 40.837 1.00 51.99 C ATOM 1970 CG2 VAL B 15 -3.748 44.905 42.495 1.00 52.99 C ATOM 1971 HA VAL B 15 -4.383 42.147 42.996 1.00 0.00 H ATOM 1972 HB VAL B 15 -2.835 43.777 40.951 1.00 0.00 H ATOM 1973 HG11 VAL B 15 -4.812 42.503 40.220 1.00 0.00 H ATOM 1974 HG12 VAL B 15 -5.771 43.252 41.519 1.00 0.00 H ATOM 1975 HG13 VAL B 15 -5.124 44.256 40.199 1.00 0.00 H ATOM 1976 HG21 VAL B 15 -4.576 44.818 43.199 1.00 0.00 H ATOM 1977 HG22 VAL B 15 -2.814 45.029 43.044 1.00 0.00 H ATOM 1978 HG23 VAL B 15 -3.908 45.768 41.849 1.00 0.00 H ATOM 1979 H VAL B 15 -1.998 43.581 43.569 1.00 0.00 H ATOM 1980 N THR B 16 -3.825 40.454 41.092 1.00 46.80 N ATOM 1981 CA THR B 16 -3.423 39.438 40.107 1.00 45.86 C ATOM 1982 C THR B 16 -4.056 39.742 38.748 1.00 47.25 C ATOM 1983 O THR B 16 -4.797 40.734 38.606 1.00 47.64 O ATOM 1984 CB THR B 16 -3.779 37.992 40.517 1.00 43.18 C ATOM 1985 OG1 THR B 16 -5.178 37.764 40.320 1.00 42.53 O ATOM 1986 CG2 THR B 16 -3.399 37.694 41.966 1.00 41.72 C ATOM 1987 HA THR B 16 -2.336 39.493 40.052 1.00 0.00 H ATOM 1988 HB THR B 16 -3.201 37.318 39.885 1.00 0.00 H ATOM 1989 HG1 THR B 16 -5.696 38.400 40.875 1.00 0.00 H ATOM 1990 HG23 THR B 16 -2.332 37.871 42.104 1.00 0.00 H ATOM 1991 HG21 THR B 16 -3.966 38.346 42.630 1.00 0.00 H ATOM 1992 HG22 THR B 16 -3.628 36.653 42.194 1.00 0.00 H ATOM 1993 H THR B 16 -4.815 40.506 41.406 1.00 0.00 H ATOM 1994 N SER B 17 -3.763 38.878 37.766 1.00 46.49 N ATOM 1995 CA SER B 17 -4.382 38.983 36.441 1.00 48.01 C ATOM 1996 C SER B 17 -5.689 38.204 36.371 1.00 46.25 C ATOM 1997 O SER B 17 -6.330 38.170 35.332 1.00 47.01 O ATOM 1998 CB SER B 17 -3.423 38.522 35.314 1.00 48.20 C ATOM 1999 OG SER B 17 -3.009 37.191 35.549 1.00 46.77 O ATOM 2000 HA SER B 17 -4.601 40.039 36.284 1.00 0.00 H ATOM 2001 HB2 SER B 17 -2.550 39.174 35.293 1.00 0.00 H ATOM 2002 HB3 SER B 17 -3.939 38.576 34.355 1.00 0.00 H ATOM 2003 HG SER B 17 -2.397 36.904 34.825 1.00 0.00 H ATOM 2004 H SER B 17 -3.080 38.115 37.948 1.00 0.00 H ATOM 2005 N ILE B 18 -6.072 37.587 37.476 1.00 44.60 N ATOM 2006 CA ILE B 18 -7.144 36.606 37.471 1.00 44.08 C ATOM 2007 C ILE B 18 -8.491 37.204 37.774 1.00 44.94 C ATOM 2008 O ILE B 18 -8.715 37.718 38.868 1.00 44.96 O ATOM 2009 CB ILE B 18 -6.899 35.534 38.523 1.00 42.94 C ATOM 2010 CG1 ILE B 18 -5.647 34.705 38.160 1.00 43.17 C ATOM 2011 CG2 ILE B 18 -8.101 34.599 38.598 1.00 43.22 C ATOM 2012 CD1 ILE B 18 -5.698 33.998 36.804 1.00 43.86 C ATOM 2013 HA ILE B 18 -7.148 36.192 36.463 1.00 0.00 H ATOM 2014 HB ILE B 18 -6.747 36.023 39.485 1.00 0.00 H ATOM 2015 HG12 ILE B 18 -4.788 35.376 38.157 1.00 0.00 H ATOM 2016 HG13 ILE B 18 -5.511 33.946 38.930 1.00 0.00 H ATOM 2017 HD11 ILE B 18 -6.541 33.308 36.787 1.00 0.00 H ATOM 2018 HD12 ILE B 18 -5.818 34.739 36.014 1.00 0.00 H ATOM 2019 HD13 ILE B 18 -4.771 33.446 36.649 1.00 0.00 H ATOM 2020 HG21 ILE B 18 -8.989 35.172 38.866 1.00 0.00 H ATOM 2021 HG22 ILE B 18 -8.252 34.125 37.628 1.00 0.00 H ATOM 2022 HG23 ILE B 18 -7.918 33.834 39.353 1.00 0.00 H ATOM 2023 H ILE B 18 -5.593 37.810 38.372 1.00 0.00 H ATOM 2024 N ILE B 19 -9.398 37.147 36.812 1.00 46.04 N ATOM 2025 CA ILE B 19 -10.743 37.631 37.068 1.00 47.23 C ATOM 2026 C ILE B 19 -11.593 36.401 37.315 1.00 46.23 C ATOM 2027 O ILE B 19 -11.805 35.585 36.421 1.00 46.71 O ATOM 2028 CB ILE B 19 -11.305 38.478 35.899 1.00 49.69 C ATOM 2029 CG1 ILE B 19 -10.305 39.559 35.426 1.00 50.77 C ATOM 2030 CG2 ILE B 19 -12.698 39.008 36.221 1.00 50.30 C ATOM 2031 CD1 ILE B 19 -10.105 40.757 36.326 1.00 52.18 C ATOM 2032 HA ILE B 19 -10.746 38.301 37.928 1.00 0.00 H ATOM 2033 HB ILE B 19 -11.430 37.824 35.036 1.00 0.00 H ATOM 2034 HG12 ILE B 19 -9.335 39.077 35.301 1.00 0.00 H ATOM 2035 HG13 ILE B 19 -10.653 39.928 34.461 1.00 0.00 H ATOM 2036 HD11 ILE B 19 -11.055 41.275 36.455 1.00 0.00 H ATOM 2037 HD12 ILE B 19 -9.737 40.424 37.296 1.00 0.00 H ATOM 2038 HD13 ILE B 19 -9.380 41.433 35.873 1.00 0.00 H ATOM 2039 HG21 ILE B 19 -13.372 38.170 36.399 1.00 0.00 H ATOM 2040 HG22 ILE B 19 -12.650 39.633 37.112 1.00 0.00 H ATOM 2041 HG23 ILE B 19 -13.064 39.598 35.381 1.00 0.00 H ATOM 2042 H ILE B 19 -9.149 36.759 35.880 1.00 0.00 H ATOM 2043 N TYR B 20 -12.026 36.216 38.557 1.00 45.71 N ATOM 2044 CA TYR B 20 -12.859 35.043 38.883 1.00 44.45 C ATOM 2045 C TYR B 20 -14.262 35.363 38.419 1.00 46.24 C ATOM 2046 O TYR B 20 -14.783 36.445 38.737 1.00 47.76 O ATOM 2047 CB TYR B 20 -12.850 34.706 40.392 1.00 43.38 C ATOM 2048 CG TYR B 20 -13.778 33.547 40.665 1.00 43.36 C ATOM 2049 CD1 TYR B 20 -15.156 33.743 40.855 1.00 44.92 C ATOM 2050 CD2 TYR B 20 -13.310 32.255 40.644 1.00 42.03 C ATOM 2051 CE1 TYR B 20 -16.033 32.673 41.038 1.00 45.03 C ATOM 2052 CE2 TYR B 20 -14.169 31.184 40.849 1.00 42.44 C ATOM 2053 CZ TYR B 20 -15.521 31.398 41.027 1.00 43.85 C ATOM 2054 OH TYR B 20 -16.335 30.309 41.201 1.00 45.13 O ATOM 2055 HA TYR B 20 -12.459 34.161 38.382 1.00 0.00 H ATOM 2056 HB3 TYR B 20 -13.181 35.576 40.959 1.00 0.00 H ATOM 2057 HB2 TYR B 20 -11.838 34.439 40.697 1.00 0.00 H ATOM 2058 HD2 TYR B 20 -12.251 32.069 40.464 1.00 0.00 H ATOM 2059 HE2 TYR B 20 -13.774 30.168 40.870 1.00 0.00 H ATOM 2060 HE1 TYR B 20 -17.099 32.845 41.186 1.00 0.00 H ATOM 2061 HD1 TYR B 20 -15.551 34.759 40.860 1.00 0.00 H ATOM 2062 HH TYR B 20 -17.270 30.613 41.316 1.00 0.00 H ATOM 2063 H TYR B 20 -11.777 36.899 39.301 1.00 0.00 H ATOM 2064 N ASN B 21 -14.860 34.467 37.646 1.00 46.04 N ATOM 2065 CA ASN B 21 -16.249 34.649 37.171 1.00 47.86 C ATOM 2066 C ASN B 21 -17.215 33.537 37.649 1.00 47.56 C ATOM 2067 O ASN B 21 -16.778 32.418 37.850 1.00 45.93 O ATOM 2068 CB ASN B 21 -16.281 34.632 35.640 1.00 48.90 C ATOM 2069 CG ASN B 21 -15.381 35.667 35.019 1.00 49.83 C ATOM 2070 OD1 ASN B 21 -15.375 36.838 35.428 1.00 50.98 O ATOM 2071 ND2 ASN B 21 -14.643 35.263 33.991 1.00 49.67 N ATOM 2072 HA ASN B 21 -16.578 35.602 37.585 1.00 0.00 H ATOM 2073 HB2 ASN B 21 -15.965 33.647 35.297 1.00 0.00 H ATOM 2074 HB3 ASN B 21 -17.303 34.819 35.312 1.00 0.00 H ATOM 2075 HD22 ASN B 21 -14.680 34.270 33.683 1.00 0.00 H ATOM 2076 HD21 ASN B 21 -14.028 35.939 33.495 1.00 0.00 H ATOM 2077 H ASN B 21 -14.338 33.612 37.366 1.00 0.00 H ATOM 2078 N PRO B 22 -18.545 33.815 37.719 1.00 49.45 N ATOM 2079 CA PRO B 22 -19.514 32.766 38.084 1.00 49.72 C ATOM 2080 C PRO B 22 -19.233 31.453 37.367 1.00 49.28 C ATOM 2081 O PRO B 22 -19.078 31.438 36.162 1.00 50.04 O ATOM 2082 CB PRO B 22 -20.850 33.348 37.611 1.00 52.03 C ATOM 2083 CG PRO B 22 -20.677 34.813 37.755 1.00 52.71 C ATOM 2084 CD PRO B 22 -19.231 35.094 37.416 1.00 51.15 C ATOM 2085 HA PRO B 22 -19.483 32.529 39.147 1.00 0.00 H ATOM 2086 HD3 PRO B 22 -19.122 35.354 36.363 1.00 0.00 H ATOM 2087 HD2 PRO B 22 -18.837 35.902 38.032 1.00 0.00 H ATOM 2088 HG3 PRO B 22 -20.894 35.122 38.777 1.00 0.00 H ATOM 2089 HG2 PRO B 22 -21.338 35.343 37.069 1.00 0.00 H ATOM 2090 HB2 PRO B 22 -21.043 33.081 36.572 1.00 0.00 H ATOM 2091 HB3 PRO B 22 -21.670 32.992 38.234 1.00 0.00 H ATOM 2092 N GLY B 23 -19.120 30.368 38.135 1.00 48.84 N ATOM 2093 CA GLY B 23 -18.967 29.004 37.613 1.00 48.05 C ATOM 2094 C GLY B 23 -17.522 28.578 37.520 1.00 46.02 C ATOM 2095 O GLY B 23 -17.247 27.420 37.319 1.00 46.38 O ATOM 2096 HA3 GLY B 23 -19.410 28.959 36.618 1.00 0.00 H ATOM 2097 HA2 GLY B 23 -19.493 28.315 38.275 1.00 0.00 H ATOM 2098 H GLY B 23 -19.142 30.496 39.167 1.00 0.00 H ATOM 2099 N ASP B 24 -16.592 29.509 37.648 1.00 44.94 N ATOM 2100 CA ASP B 24 -15.189 29.175 37.522 1.00 43.57 C ATOM 2101 C ASP B 24 -14.679 28.248 38.602 1.00 42.51 C ATOM 2102 O ASP B 24 -15.013 28.391 39.776 1.00 42.28 O ATOM 2103 CB ASP B 24 -14.334 30.423 37.542 1.00 43.10 C ATOM 2104 CG ASP B 24 -14.327 31.143 36.203 1.00 44.63 C ATOM 2105 OD1 ASP B 24 -14.910 30.600 35.223 1.00 45.12 O ATOM 2106 OD2 ASP B 24 -13.751 32.271 36.161 1.00 44.87 O ATOM 2107 HA ASP B 24 -15.111 28.656 36.567 1.00 0.00 H ATOM 2108 HB2 ASP B 24 -14.722 31.101 38.302 1.00 0.00 H ATOM 2109 HB3 ASP B 24 -13.311 30.143 37.794 1.00 0.00 H ATOM 2110 H ASP B 24 -16.871 30.492 37.841 1.00 0.00 H ATOM 2111 N VAL B 25 -13.831 27.323 38.177 1.00 42.10 N ATOM 2112 CA VAL B 25 -13.074 26.453 39.064 1.00 40.62 C ATOM 2113 C VAL B 25 -11.632 26.936 39.008 1.00 39.79 C ATOM 2114 O VAL B 25 -11.105 27.208 37.914 1.00 39.60 O ATOM 2115 CB VAL B 25 -13.169 25.003 38.595 1.00 40.90 C ATOM 2116 CG1 VAL B 25 -12.371 24.074 39.514 1.00 40.04 C ATOM 2117 CG2 VAL B 25 -14.620 24.572 38.586 1.00 41.89 C ATOM 2118 HA VAL B 25 -13.463 26.490 40.081 1.00 0.00 H ATOM 2119 HB VAL B 25 -12.751 24.938 37.590 1.00 0.00 H ATOM 2120 HG11 VAL B 25 -11.323 24.374 39.511 1.00 0.00 H ATOM 2121 HG12 VAL B 25 -12.766 24.140 40.528 1.00 0.00 H ATOM 2122 HG13 VAL B 25 -12.457 23.048 39.155 1.00 0.00 H ATOM 2123 HG21 VAL B 25 -15.029 24.657 39.593 1.00 0.00 H ATOM 2124 HG22 VAL B 25 -15.184 25.212 37.908 1.00 0.00 H ATOM 2125 HG23 VAL B 25 -14.688 23.537 38.251 1.00 0.00 H ATOM 2126 H VAL B 25 -13.699 27.213 37.151 1.00 0.00 H ATOM 2127 N ILE B 26 -10.995 27.075 40.176 1.00 38.39 N ATOM 2128 CA ILE B 26 -9.645 27.589 40.198 1.00 37.49 C ATOM 2129 C ILE B 26 -8.792 26.787 41.152 1.00 36.58 C ATOM 2130 O ILE B 26 -9.295 26.194 42.088 1.00 37.28 O ATOM 2131 CB ILE B 26 -9.574 29.080 40.581 1.00 37.61 C ATOM 2132 CG1 ILE B 26 -10.072 29.321 42.018 1.00 37.41 C ATOM 2133 CG2 ILE B 26 -10.354 29.978 39.617 1.00 38.47 C ATOM 2134 CD1 ILE B 26 -9.779 30.720 42.511 1.00 37.99 C ATOM 2135 HA ILE B 26 -9.265 27.494 39.181 1.00 0.00 H ATOM 2136 HB ILE B 26 -8.520 29.349 40.515 1.00 0.00 H ATOM 2137 HG12 ILE B 26 -11.150 29.160 42.045 1.00 0.00 H ATOM 2138 HG13 ILE B 26 -9.582 28.608 42.681 1.00 0.00 H ATOM 2139 HD11 ILE B 26 -8.703 30.891 42.497 1.00 0.00 H ATOM 2140 HD12 ILE B 26 -10.271 31.443 41.861 1.00 0.00 H ATOM 2141 HD13 ILE B 26 -10.153 30.831 43.529 1.00 0.00 H ATOM 2142 HG21 ILE B 26 -9.945 29.872 38.612 1.00 0.00 H ATOM 2143 HG22 ILE B 26 -11.403 29.683 39.617 1.00 0.00 H ATOM 2144 HG23 ILE B 26 -10.267 31.016 39.938 1.00 0.00 H ATOM 2145 H ILE B 26 -11.469 26.814 41.064 1.00 0.00 H ATOM 2146 N THR B 27 -7.487 26.796 40.923 1.00 36.27 N ATOM 2147 CA THR B 27 -6.534 26.168 41.810 1.00 35.36 C ATOM 2148 C THR B 27 -5.451 27.138 42.155 1.00 35.44 C ATOM 2149 O THR B 27 -5.000 27.906 41.291 1.00 36.92 O ATOM 2150 CB THR B 27 -5.878 24.998 41.121 1.00 35.33 C ATOM 2151 OG1 THR B 27 -6.852 23.985 40.955 1.00 35.40 O ATOM 2152 CG2 THR B 27 -4.762 24.489 41.994 1.00 35.19 C ATOM 2153 HA THR B 27 -7.066 25.841 42.703 1.00 0.00 H ATOM 2154 HB THR B 27 -5.475 25.291 40.152 1.00 0.00 H ATOM 2155 HG1 THR B 27 -6.442 23.205 40.503 1.00 0.00 H ATOM 2156 HG23 THR B 27 -4.014 25.272 42.119 1.00 0.00 H ATOM 2157 HG21 THR B 27 -5.163 24.209 42.968 1.00 0.00 H ATOM 2158 HG22 THR B 27 -4.303 23.619 41.525 1.00 0.00 H ATOM 2159 H THR B 27 -7.134 27.275 40.070 1.00 0.00 H ATOM 2160 N ILE B 28 -5.052 27.156 43.424 1.00 35.11 N ATOM 2161 CA ILE B 28 -4.003 28.063 43.845 1.00 34.91 C ATOM 2162 C ILE B 28 -3.028 27.254 44.646 1.00 34.81 C ATOM 2163 O ILE B 28 -3.452 26.413 45.430 1.00 34.94 O ATOM 2164 CB ILE B 28 -4.563 29.157 44.744 1.00 35.00 C ATOM 2165 CG1 ILE B 28 -5.651 29.912 43.980 1.00 35.18 C ATOM 2166 CG2 ILE B 28 -3.427 30.024 45.314 1.00 34.71 C ATOM 2167 CD1 ILE B 28 -6.219 31.077 44.754 1.00 35.42 C ATOM 2168 HA ILE B 28 -3.543 28.530 42.974 1.00 0.00 H ATOM 2169 HB ILE B 28 -5.047 28.741 45.627 1.00 0.00 H ATOM 2170 HG12 ILE B 28 -5.225 30.288 43.050 1.00 0.00 H ATOM 2171 HG13 ILE B 28 -6.461 29.218 43.753 1.00 0.00 H ATOM 2172 HD11 ILE B 28 -6.659 30.714 45.683 1.00 0.00 H ATOM 2173 HD12 ILE B 28 -5.422 31.785 44.980 1.00 0.00 H ATOM 2174 HD13 ILE B 28 -6.986 31.570 44.156 1.00 0.00 H ATOM 2175 HG21 ILE B 28 -2.752 29.398 45.897 1.00 0.00 H ATOM 2176 HG22 ILE B 28 -2.878 30.487 44.494 1.00 0.00 H ATOM 2177 HG23 ILE B 28 -3.849 30.799 45.953 1.00 0.00 H ATOM 2178 H ILE B 28 -5.494 26.517 44.116 1.00 0.00 H ATOM 2179 N VAL B 29 -1.741 27.464 44.398 1.00 35.19 N ATOM 2180 CA VAL B 29 -0.671 26.868 45.185 1.00 36.16 C ATOM 2181 C VAL B 29 0.248 28.007 45.633 1.00 36.77 C ATOM 2182 O VAL B 29 0.740 28.759 44.782 1.00 38.33 O ATOM 2183 CB VAL B 29 0.185 25.881 44.390 1.00 36.75 C ATOM 2184 CG1 VAL B 29 1.348 25.342 45.246 1.00 37.23 C ATOM 2185 CG2 VAL B 29 -0.664 24.736 43.876 1.00 37.07 C ATOM 2186 HA VAL B 29 -1.128 26.322 46.010 1.00 0.00 H ATOM 2187 HB VAL B 29 0.608 26.413 43.538 1.00 0.00 H ATOM 2188 HG11 VAL B 29 1.978 26.172 45.565 1.00 0.00 H ATOM 2189 HG12 VAL B 29 0.947 24.831 46.121 1.00 0.00 H ATOM 2190 HG13 VAL B 29 1.939 24.643 44.655 1.00 0.00 H ATOM 2191 HG21 VAL B 29 -1.117 24.214 44.719 1.00 0.00 H ATOM 2192 HG22 VAL B 29 -1.447 25.129 43.227 1.00 0.00 H ATOM 2193 HG23 VAL B 29 -0.037 24.045 43.313 1.00 0.00 H ATOM 2194 H VAL B 29 -1.485 28.084 43.603 1.00 0.00 H ATOM 2195 N ALA B 30 0.486 28.098 46.946 1.00 35.92 N ATOM 2196 CA ALA B 30 1.293 29.164 47.550 1.00 35.91 C ATOM 2197 C ALA B 30 2.442 28.570 48.366 1.00 36.77 C ATOM 2198 O ALA B 30 2.326 27.468 48.941 1.00 36.75 O ATOM 2199 CB ALA B 30 0.432 30.037 48.398 1.00 34.70 C ATOM 2200 HA ALA B 30 1.726 29.773 46.756 1.00 0.00 H ATOM 2201 HB1 ALA B 30 -0.349 30.483 47.782 1.00 0.00 H ATOM 2202 HB2 ALA B 30 -0.023 29.439 49.188 1.00 0.00 H ATOM 2203 HB3 ALA B 30 1.041 30.825 48.842 1.00 0.00 H ATOM 2204 H ALA B 30 0.077 27.375 47.572 1.00 0.00 H ATOM 2205 N ALA B 31 3.583 29.237 48.342 1.00 36.93 N ATOM 2206 CA ALA B 31 4.784 28.620 48.886 1.00 37.75 C ATOM 2207 C ALA B 31 5.635 29.737 49.457 1.00 38.27 C ATOM 2208 O ALA B 31 5.512 30.876 49.023 1.00 38.32 O ATOM 2209 CB ALA B 31 5.515 27.857 47.812 1.00 37.69 C ATOM 2210 HA ALA B 31 4.540 27.900 49.667 1.00 0.00 H ATOM 2211 HB1 ALA B 31 4.864 27.078 47.414 1.00 0.00 H ATOM 2212 HB2 ALA B 31 5.798 28.540 47.011 1.00 0.00 H ATOM 2213 HB3 ALA B 31 6.410 27.402 48.236 1.00 0.00 H ATOM 2214 H ALA B 31 3.622 30.194 47.938 1.00 0.00 H ATOM 2215 N GLY B 32 6.476 29.444 50.434 1.00 38.43 N ATOM 2216 CA GLY B 32 7.355 30.473 50.933 1.00 39.70 C ATOM 2217 C GLY B 32 7.261 30.740 52.433 1.00 39.39 C ATOM 2218 O GLY B 32 6.516 30.047 53.163 1.00 38.63 O ATOM 2219 HA3 GLY B 32 7.120 31.400 50.410 1.00 0.00 H ATOM 2220 HA2 GLY B 32 8.380 30.180 50.706 1.00 0.00 H ATOM 2221 H GLY B 32 6.503 28.486 50.837 1.00 0.00 H ATOM 2222 N TRP B 33 8.046 31.731 52.858 1.00 39.96 N ATOM 2223 CA TRP B 33 8.329 32.036 54.274 1.00 40.62 C ATOM 2224 C TRP B 33 8.210 33.483 54.502 1.00 40.93 C ATOM 2225 O TRP B 33 8.993 34.261 53.910 1.00 41.78 O ATOM 2226 CB TRP B 33 9.742 31.641 54.651 1.00 42.06 C ATOM 2227 CG TRP B 33 9.947 30.163 54.558 1.00 43.05 C ATOM 2228 CD1 TRP B 33 10.717 29.467 53.635 1.00 44.01 C ATOM 2229 CD2 TRP B 33 9.329 29.129 55.400 1.00 42.92 C ATOM 2230 NE1 TRP B 33 10.635 28.126 53.851 1.00 44.49 N ATOM 2231 CE2 TRP B 33 9.823 27.849 54.892 1.00 43.64 C ATOM 2232 CE3 TRP B 33 8.474 29.137 56.510 1.00 42.26 C ATOM 2233 CZ2 TRP B 33 9.458 26.648 55.461 1.00 43.91 C ATOM 2234 CZ3 TRP B 33 8.104 27.902 57.062 1.00 42.69 C ATOM 2235 CH2 TRP B 33 8.597 26.693 56.547 1.00 43.41 C ATOM 2236 HA TRP B 33 7.614 31.476 54.876 1.00 0.00 H ATOM 2237 HB2 TRP B 33 10.440 32.138 53.977 1.00 0.00 H ATOM 2238 HB3 TRP B 33 9.937 31.961 55.674 1.00 0.00 H ATOM 2239 HE1 TRP B 33 11.133 27.408 53.287 1.00 0.00 H ATOM 2240 HD1 TRP B 33 11.307 29.932 52.845 1.00 0.00 H ATOM 2241 HZ2 TRP B 33 9.831 25.700 55.073 1.00 0.00 H ATOM 2242 HH2 TRP B 33 8.293 25.758 57.017 1.00 0.00 H ATOM 2243 HZ3 TRP B 33 7.419 27.881 57.909 1.00 0.00 H ATOM 2244 HE3 TRP B 33 8.108 30.073 56.931 1.00 0.00 H ATOM 2245 H TRP B 33 8.492 32.334 52.138 1.00 0.00 H ATOM 2246 N ALA B 34 7.256 33.866 55.356 1.00 40.35 N ATOM 2247 CA ALA B 34 7.099 35.265 55.734 1.00 40.86 C ATOM 2248 C ALA B 34 6.977 35.460 57.249 1.00 41.49 C ATOM 2249 O ALA B 34 6.849 34.468 57.998 1.00 41.21 O ATOM 2250 CB ALA B 34 5.907 35.878 54.999 1.00 40.04 C ATOM 2251 HA ALA B 34 8.008 35.787 55.434 1.00 0.00 H ATOM 2252 HB1 ALA B 34 6.073 35.814 53.924 1.00 0.00 H ATOM 2253 HB2 ALA B 34 5.001 35.332 55.261 1.00 0.00 H ATOM 2254 HB3 ALA B 34 5.801 36.923 55.290 1.00 0.00 H ATOM 2255 H ALA B 34 6.614 33.153 55.758 1.00 0.00 H ATOM 2256 N SER B 35 6.988 36.731 57.681 1.00 41.21 N ATOM 2257 CA SER B 35 6.769 37.106 59.092 1.00 41.69 C ATOM 2258 C SER B 35 5.896 38.369 59.214 1.00 41.57 C ATOM 2259 O SER B 35 5.946 39.248 58.373 1.00 41.98 O ATOM 2260 CB SER B 35 8.113 37.385 59.786 1.00 43.08 C ATOM 2261 OG SER B 35 7.921 37.842 61.103 1.00 42.95 O ATOM 2262 HA SER B 35 6.259 36.269 59.568 1.00 0.00 H ATOM 2263 HB2 SER B 35 8.654 38.144 59.221 1.00 0.00 H ATOM 2264 HB3 SER B 35 8.698 36.466 59.810 1.00 0.00 H ATOM 2265 HG SER B 35 8.801 38.013 61.523 1.00 0.00 H ATOM 2266 H SER B 35 7.159 37.488 56.988 1.00 0.00 H ATOM 2267 N TYR B 36 5.113 38.451 60.270 1.00 41.59 N ATOM 2268 CA TYR B 36 4.378 39.695 60.648 1.00 41.72 C ATOM 2269 C TYR B 36 5.171 40.551 61.606 1.00 43.11 C ATOM 2270 O TYR B 36 4.642 41.564 62.220 1.00 43.89 O ATOM 2271 CB TYR B 36 3.037 39.303 61.265 1.00 40.98 C ATOM 2272 CG TYR B 36 3.158 38.305 62.418 1.00 41.03 C ATOM 2273 CD1 TYR B 36 3.294 38.745 63.748 1.00 42.00 C ATOM 2274 CD2 TYR B 36 3.106 36.893 62.185 1.00 39.92 C ATOM 2275 CE1 TYR B 36 3.377 37.845 64.808 1.00 42.13 C ATOM 2276 CE2 TYR B 36 3.195 35.985 63.231 1.00 40.22 C ATOM 2277 CZ TYR B 36 3.333 36.464 64.547 1.00 41.66 C ATOM 2278 OH TYR B 36 3.411 35.539 65.577 1.00 41.51 O ATOM 2279 HA TYR B 36 4.219 40.292 59.750 1.00 0.00 H ATOM 2280 HB3 TYR B 36 2.417 38.857 60.487 1.00 0.00 H ATOM 2281 HB2 TYR B 36 2.554 40.205 61.640 1.00 0.00 H ATOM 2282 HD2 TYR B 36 2.994 36.524 61.166 1.00 0.00 H ATOM 2283 HE2 TYR B 36 3.158 34.913 63.035 1.00 0.00 H ATOM 2284 HE1 TYR B 36 3.475 38.208 65.831 1.00 0.00 H ATOM 2285 HD1 TYR B 36 3.335 39.815 63.953 1.00 0.00 H ATOM 2286 HH TYR B 36 2.587 34.991 65.590 1.00 0.00 H ATOM 2287 H TYR B 36 5.001 37.609 60.870 1.00 0.00 H ATOM 2288 N GLY B 37 6.440 40.194 61.789 1.00 43.35 N ATOM 2289 CA GLY B 37 7.244 41.063 62.636 1.00 45.28 C ATOM 2290 C GLY B 37 8.357 40.311 63.301 1.00 46.10 C ATOM 2291 O GLY B 37 9.510 40.675 63.148 1.00 45.95 O ATOM 2292 HA3 GLY B 37 6.604 41.500 63.403 1.00 0.00 H ATOM 2293 HA2 GLY B 37 7.670 41.858 62.024 1.00 0.00 H ATOM 2294 H GLY B 37 6.837 39.339 61.350 1.00 0.00 H ATOM 2295 N PRO B 38 8.012 39.271 64.072 1.00 47.03 N ATOM 2296 CA PRO B 38 9.029 38.468 64.761 1.00 48.46 C ATOM 2297 C PRO B 38 10.057 37.978 63.768 1.00 48.78 C ATOM 2298 O PRO B 38 9.788 37.950 62.551 1.00 47.02 O ATOM 2299 CB PRO B 38 8.222 37.301 65.327 1.00 47.86 C ATOM 2300 CG PRO B 38 6.880 37.945 65.601 1.00 47.28 C ATOM 2301 CD PRO B 38 6.648 38.785 64.379 1.00 45.87 C ATOM 2302 HA PRO B 38 9.577 39.016 65.527 1.00 0.00 H ATOM 2303 HD3 PRO B 38 6.246 38.189 63.559 1.00 0.00 H ATOM 2304 HD2 PRO B 38 5.971 39.613 64.590 1.00 0.00 H ATOM 2305 HG3 PRO B 38 6.918 38.562 66.499 1.00 0.00 H ATOM 2306 HG2 PRO B 38 6.100 37.192 65.712 1.00 0.00 H ATOM 2307 HB2 PRO B 38 8.132 36.493 64.601 1.00 0.00 H ATOM 2308 HB3 PRO B 38 8.671 36.917 66.243 1.00 0.00 H ATOM 2309 N THR B 39 11.236 37.632 64.278 1.00 50.70 N ATOM 2310 CA THR B 39 12.348 37.267 63.416 1.00 51.91 C ATOM 2311 C THR B 39 12.031 35.926 62.674 1.00 50.98 C ATOM 2312 O THR B 39 12.165 35.849 61.441 1.00 49.93 O ATOM 2313 CB THR B 39 13.675 37.222 64.201 1.00 54.44 C ATOM 2314 OG1 THR B 39 13.702 36.048 65.014 1.00 54.92 O ATOM 2315 CG2 THR B 39 13.840 38.444 65.107 1.00 55.42 C ATOM 2316 HA THR B 39 12.478 38.037 62.655 1.00 0.00 H ATOM 2317 HB THR B 39 14.489 37.216 63.477 1.00 0.00 H ATOM 2318 HG1 THR B 39 14.553 36.017 65.519 1.00 0.00 H ATOM 2319 HG23 THR B 39 13.821 39.350 64.501 1.00 0.00 H ATOM 2320 HG21 THR B 39 13.024 38.472 65.829 1.00 0.00 H ATOM 2321 HG22 THR B 39 14.792 38.378 65.634 1.00 0.00 H ATOM 2322 H THR B 39 11.364 37.623 65.310 1.00 0.00 H ATOM 2323 N GLN B 40 11.524 34.942 63.422 1.00 51.20 N ATOM 2324 CA GLN B 40 10.974 33.685 62.865 1.00 51.29 C ATOM 2325 C GLN B 40 10.078 33.964 61.663 1.00 49.05 C ATOM 2326 O GLN B 40 9.438 35.030 61.567 1.00 48.30 O ATOM 2327 CB GLN B 40 10.184 32.884 63.919 1.00 51.60 C ATOM 2328 CG GLN B 40 10.992 32.484 65.162 1.00 55.23 C ATOM 2329 CD GLN B 40 11.404 33.658 66.092 1.00 57.14 C ATOM 2330 OE1 GLN B 40 10.620 34.597 66.355 1.00 57.04 O ATOM 2331 NE2 GLN B 40 12.649 33.598 66.601 1.00 59.09 N ATOM 2332 HA GLN B 40 11.827 33.085 62.547 1.00 0.00 H ATOM 2333 HB2 GLN B 40 9.339 33.492 64.244 1.00 0.00 H ATOM 2334 HB3 GLN B 40 9.815 31.974 63.447 1.00 0.00 H ATOM 2335 HG2 GLN B 40 10.390 31.787 65.745 1.00 0.00 H ATOM 2336 HG3 GLN B 40 11.901 31.985 64.827 1.00 0.00 H ATOM 2337 HE22 GLN B 40 13.272 32.801 66.359 1.00 0.00 H ATOM 2338 HE21 GLN B 40 12.988 34.349 67.236 1.00 0.00 H ATOM 2339 H GLN B 40 11.515 35.066 64.455 1.00 0.00 H ATOM 2340 N LYS B 41 10.043 33.019 60.745 1.00 47.98 N ATOM 2341 CA LYS B 41 9.166 33.137 59.594 1.00 46.79 C ATOM 2342 C LYS B 41 8.180 31.958 59.576 1.00 45.30 C ATOM 2343 O LYS B 41 8.433 30.943 60.200 1.00 45.46 O ATOM 2344 CB LYS B 41 9.989 33.267 58.290 1.00 47.50 C ATOM 2345 CG LYS B 41 10.975 34.453 58.306 1.00 49.70 C ATOM 2346 CD LYS B 41 12.122 34.317 57.287 1.00 51.71 C ATOM 2347 CE LYS B 41 13.357 35.178 57.651 1.00 54.38 C ATOM 2348 NZ LYS B 41 14.605 34.788 56.891 1.00 55.61 N ATOM 2349 HA LYS B 41 8.575 34.050 59.668 1.00 0.00 H ATOM 2350 HB2 LYS B 41 10.556 32.347 58.145 1.00 0.00 H ATOM 2351 HB3 LYS B 41 9.299 33.402 57.457 1.00 0.00 H ATOM 2352 HG2 LYS B 41 10.421 35.365 58.082 1.00 0.00 H ATOM 2353 HG3 LYS B 41 11.407 34.528 59.304 1.00 0.00 H ATOM 2354 HD2 LYS B 41 12.427 33.271 57.244 1.00 0.00 H ATOM 2355 HD3 LYS B 41 11.757 34.628 56.308 1.00 0.00 H ATOM 2356 HE2 LYS B 41 13.553 35.068 58.718 1.00 0.00 H ATOM 2357 HE3 LYS B 41 13.129 36.221 57.430 1.00 0.00 H ATOM 2358 HZ1 LYS B 41 14.841 33.797 57.100 1.00 0.00 H ATOM 2359 HZ2 LYS B 41 14.436 34.898 55.871 1.00 0.00 H ATOM 2360 HZ3 LYS B 41 15.392 35.402 57.181 1.00 0.00 H ATOM 2361 H LYS B 41 10.650 32.180 60.846 1.00 0.00 H ATOM 2362 N TRP B 42 7.041 32.139 58.907 1.00 43.80 N ATOM 2363 CA TRP B 42 5.998 31.128 58.769 1.00 42.71 C ATOM 2364 C TRP B 42 5.619 30.986 57.345 1.00 41.33 C ATOM 2365 O TRP B 42 5.724 31.929 56.555 1.00 40.12 O ATOM 2366 CB TRP B 42 4.732 31.453 59.568 1.00 42.95 C ATOM 2367 CG TRP B 42 4.987 31.484 61.049 1.00 45.17 C ATOM 2368 CD1 TRP B 42 4.800 30.450 61.961 1.00 45.96 C ATOM 2369 CD2 TRP B 42 5.522 32.603 61.846 1.00 45.82 C ATOM 2370 NE1 TRP B 42 5.156 30.837 63.218 1.00 46.69 N ATOM 2371 CE2 TRP B 42 5.610 32.104 63.229 1.00 47.19 C ATOM 2372 CE3 TRP B 42 5.917 33.909 61.568 1.00 46.31 C ATOM 2373 CZ2 TRP B 42 6.091 32.891 64.273 1.00 48.23 C ATOM 2374 CZ3 TRP B 42 6.389 34.708 62.626 1.00 47.19 C ATOM 2375 CH2 TRP B 42 6.461 34.211 63.950 1.00 48.45 C ATOM 2376 HA TRP B 42 6.418 30.203 59.164 1.00 0.00 H ATOM 2377 HB2 TRP B 42 4.360 32.429 59.255 1.00 0.00 H ATOM 2378 HB3 TRP B 42 3.979 30.694 59.357 1.00 0.00 H ATOM 2379 HE1 TRP B 42 5.086 30.231 64.061 1.00 0.00 H ATOM 2380 HD1 TRP B 42 4.419 29.462 61.704 1.00 0.00 H ATOM 2381 HZ2 TRP B 42 6.177 32.505 65.289 1.00 0.00 H ATOM 2382 HH2 TRP B 42 6.814 34.870 64.743 1.00 0.00 H ATOM 2383 HZ3 TRP B 42 6.706 35.731 62.422 1.00 0.00 H ATOM 2384 HE3 TRP B 42 5.862 34.304 60.553 1.00 0.00 H ATOM 2385 H TRP B 42 6.886 33.062 58.453 1.00 0.00 H ATOM 2386 N GLY B 43 5.166 29.781 57.006 1.00 40.37 N ATOM 2387 CA GLY B 43 4.602 29.525 55.707 1.00 38.96 C ATOM 2388 C GLY B 43 3.250 30.164 55.530 1.00 37.75 C ATOM 2389 O GLY B 43 2.804 30.896 56.408 1.00 37.92 O ATOM 2390 HA3 GLY B 43 4.500 28.448 55.576 1.00 0.00 H ATOM 2391 HA2 GLY B 43 5.278 29.920 54.948 1.00 0.00 H ATOM 2392 H GLY B 43 5.221 29.006 57.697 1.00 0.00 H ATOM 2393 N PRO B 44 2.596 29.899 54.383 1.00 37.43 N ATOM 2394 CA PRO B 44 1.313 30.512 54.006 1.00 36.50 C ATOM 2395 C PRO B 44 0.081 30.147 54.868 1.00 36.46 C ATOM 2396 O PRO B 44 -0.987 30.759 54.673 1.00 35.32 O ATOM 2397 CB PRO B 44 1.095 30.016 52.574 1.00 36.27 C ATOM 2398 CG PRO B 44 1.978 28.859 52.427 1.00 36.49 C ATOM 2399 CD PRO B 44 3.177 29.129 53.253 1.00 37.32 C ATOM 2400 HA PRO B 44 1.386 31.591 54.141 1.00 0.00 H ATOM 2401 HD3 PRO B 44 3.639 28.204 53.598 1.00 0.00 H ATOM 2402 HD2 PRO B 44 3.912 29.719 52.706 1.00 0.00 H ATOM 2403 HG3 PRO B 44 2.262 28.734 51.382 1.00 0.00 H ATOM 2404 HG2 PRO B 44 1.476 27.957 52.777 1.00 0.00 H ATOM 2405 HB2 PRO B 44 0.055 29.725 52.425 1.00 0.00 H ATOM 2406 HB3 PRO B 44 1.360 30.792 51.856 1.00 0.00 H ATOM 2407 N GLN B 45 0.217 29.174 55.778 1.00 36.25 N ATOM 2408 CA GLN B 45 -0.800 28.873 56.804 1.00 36.07 C ATOM 2409 C GLN B 45 -0.710 29.846 57.998 1.00 37.32 C ATOM 2410 O GLN B 45 -1.661 29.948 58.824 1.00 37.33 O ATOM 2411 CB GLN B 45 -0.666 27.406 57.283 1.00 36.69 C ATOM 2412 CG GLN B 45 -1.190 26.432 56.240 1.00 36.20 C ATOM 2413 CD GLN B 45 -1.162 24.969 56.620 1.00 37.28 C ATOM 2414 OE1 GLN B 45 -2.112 24.241 56.313 1.00 37.39 O ATOM 2415 NE2 GLN B 45 -0.079 24.515 57.270 1.00 36.60 N ATOM 2416 HA GLN B 45 -1.781 29.005 56.348 1.00 0.00 H ATOM 2417 HB2 GLN B 45 0.385 27.190 57.474 1.00 0.00 H ATOM 2418 HB3 GLN B 45 -1.235 27.280 58.204 1.00 0.00 H ATOM 2419 HG2 GLN B 45 -2.224 26.700 56.024 1.00 0.00 H ATOM 2420 HG3 GLN B 45 -0.589 26.554 55.339 1.00 0.00 H ATOM 2421 HE22 GLN B 45 0.696 25.166 57.507 1.00 0.00 H ATOM 2422 HE21 GLN B 45 -0.015 23.512 57.537 1.00 0.00 H ATOM 2423 H GLN B 45 1.085 28.601 55.761 1.00 0.00 H ATOM 2424 N GLY B 46 0.429 30.541 58.101 1.00 37.80 N ATOM 2425 CA GLY B 46 0.670 31.529 59.181 1.00 38.55 C ATOM 2426 C GLY B 46 1.047 30.895 60.517 1.00 39.92 C ATOM 2427 O GLY B 46 1.540 29.759 60.573 1.00 40.83 O ATOM 2428 HA3 GLY B 46 -0.238 32.115 59.321 1.00 0.00 H ATOM 2429 HA2 GLY B 46 1.481 32.188 58.871 1.00 0.00 H ATOM 2430 H GLY B 46 1.176 30.382 57.395 1.00 0.00 H ATOM 2431 N ASP B 47 0.815 31.626 61.612 1.00 40.26 N ATOM 2432 CA ASP B 47 1.262 31.170 62.916 1.00 41.14 C ATOM 2433 C ASP B 47 0.086 30.662 63.753 1.00 41.84 C ATOM 2434 O ASP B 47 -0.715 31.463 64.210 1.00 41.40 O ATOM 2435 CB ASP B 47 1.992 32.302 63.635 1.00 41.78 C ATOM 2436 CG ASP B 47 2.480 31.908 65.023 1.00 42.85 C ATOM 2437 OD1 ASP B 47 2.373 30.699 65.458 1.00 42.03 O ATOM 2438 OD2 ASP B 47 2.954 32.849 65.695 1.00 43.10 O ATOM 2439 HA ASP B 47 1.951 30.337 62.778 1.00 0.00 H ATOM 2440 HB2 ASP B 47 2.853 32.597 63.035 1.00 0.00 H ATOM 2441 HB3 ASP B 47 1.311 33.148 63.733 1.00 0.00 H ATOM 2442 H ASP B 47 0.309 32.531 61.529 1.00 0.00 H ATOM 2443 N ARG B 48 -0.021 29.336 63.923 1.00 42.21 N ATOM 2444 CA ARG B 48 -1.166 28.762 64.611 1.00 43.20 C ATOM 2445 C ARG B 48 -1.235 29.206 66.085 1.00 44.77 C ATOM 2446 O ARG B 48 -2.310 29.229 66.674 1.00 46.04 O ATOM 2447 CB ARG B 48 -1.168 27.239 64.485 1.00 44.22 C ATOM 2448 CG ARG B 48 0.075 26.622 65.110 1.00 46.19 C ATOM 2449 CD ARG B 48 0.403 25.232 64.595 1.00 47.13 C ATOM 2450 NE ARG B 48 -0.444 24.191 65.175 1.00 49.22 N ATOM 2451 CZ ARG B 48 -0.436 23.839 66.458 1.00 51.49 C ATOM 2452 NH1 ARG B 48 0.351 24.470 67.324 1.00 51.67 N ATOM 2453 NH2 ARG B 48 -1.244 22.871 66.875 1.00 53.48 N ATOM 2454 HA ARG B 48 -2.065 29.142 64.125 1.00 0.00 H ATOM 2455 HB2 ARG B 48 -2.050 26.844 64.988 1.00 0.00 H ATOM 2456 HB3 ARG B 48 -1.203 26.971 63.429 1.00 0.00 H ATOM 2457 HG2 ARG B 48 0.923 27.274 64.901 1.00 0.00 H ATOM 2458 HG3 ARG B 48 -0.078 26.561 66.188 1.00 0.00 H ATOM 2459 HD2 ARG B 48 1.442 25.009 64.836 1.00 0.00 H ATOM 2460 HD3 ARG B 48 0.273 25.223 63.513 1.00 0.00 H ATOM 2461 HE ARG B 48 -1.099 23.691 64.540 1.00 0.00 H ATOM 2462 HH12 ARG B 48 0.352 24.190 68.325 1.00 0.00 H ATOM 2463 HH11 ARG B 48 0.965 25.244 67.000 1.00 0.00 H ATOM 2464 HH22 ARG B 48 -1.244 22.589 67.876 1.00 0.00 H ATOM 2465 HH21 ARG B 48 -1.876 22.395 66.200 1.00 0.00 H ATOM 2466 H ARG B 48 0.725 28.710 63.558 1.00 0.00 H ATOM 2467 N GLU B 49 -0.102 29.577 66.675 1.00 45.74 N ATOM 2468 CA GLU B 49 -0.056 29.951 68.071 1.00 47.85 C ATOM 2469 C GLU B 49 -0.420 31.403 68.323 1.00 47.50 C ATOM 2470 O GLU B 49 -0.404 31.840 69.454 1.00 48.39 O ATOM 2471 CB GLU B 49 1.325 29.703 68.635 1.00 49.80 C ATOM 2472 CG GLU B 49 1.821 28.278 68.408 1.00 52.02 C ATOM 2473 CD GLU B 49 3.180 28.070 69.026 1.00 55.16 C ATOM 2474 OE1 GLU B 49 3.756 29.086 69.504 1.00 57.54 O ATOM 2475 OE2 GLU B 49 3.670 26.919 69.062 1.00 57.00 O ATOM 2476 HA GLU B 49 -0.802 29.330 68.567 1.00 0.00 H ATOM 2477 HB2 GLU B 49 2.022 30.393 68.160 1.00 0.00 H ATOM 2478 HB3 GLU B 49 1.301 29.895 69.708 1.00 0.00 H ATOM 2479 HG2 GLU B 49 1.115 27.579 68.857 1.00 0.00 H ATOM 2480 HG3 GLU B 49 1.885 28.090 67.336 1.00 0.00 H ATOM 2481 H GLU B 49 0.775 29.599 66.117 1.00 0.00 H ATOM 2482 N HIS B 50 -0.771 32.149 67.288 1.00 45.70 N ATOM 2483 CA HIS B 50 -0.792 33.616 67.453 1.00 45.42 C ATOM 2484 C HIS B 50 -2.166 34.194 67.701 1.00 44.89 C ATOM 2485 O HIS B 50 -3.063 34.019 66.908 1.00 43.33 O ATOM 2486 CB HIS B 50 -0.069 34.311 66.301 1.00 44.55 C ATOM 2487 CG HIS B 50 0.281 35.726 66.621 1.00 45.33 C ATOM 2488 ND1 HIS B 50 1.216 36.030 67.526 1.00 47.07 N ATOM 2489 CD2 HIS B 50 -0.322 36.919 66.246 1.00 45.36 C ATOM 2490 CE1 HIS B 50 1.256 37.382 67.694 1.00 48.10 C ATOM 2491 NE2 HIS B 50 0.315 37.924 66.905 1.00 47.36 N ATOM 2492 HA HIS B 50 -0.241 33.820 68.371 1.00 0.00 H ATOM 2493 HB2 HIS B 50 0.848 33.764 66.082 1.00 0.00 H ATOM 2494 HB3 HIS B 50 -0.716 34.300 65.424 1.00 0.00 H ATOM 2495 HD2 HIS B 50 -1.154 37.030 65.551 1.00 0.00 H ATOM 2496 HE1 HIS B 50 1.932 37.927 68.353 1.00 0.00 H ATOM 2497 H HIS B 50 -1.026 31.712 66.379 1.00 0.00 H ATOM 2498 N PRO B 51 -2.371 34.858 68.830 1.00 47.66 N ATOM 2499 CA PRO B 51 -3.743 35.322 69.000 1.00 48.86 C ATOM 2500 C PRO B 51 -4.155 36.222 67.815 1.00 48.05 C ATOM 2501 O PRO B 51 -3.292 36.817 67.138 1.00 47.24 O ATOM 2502 CB PRO B 51 -3.700 36.142 70.330 1.00 51.17 C ATOM 2503 CG PRO B 51 -2.286 36.070 70.832 1.00 51.31 C ATOM 2504 CD PRO B 51 -1.419 35.545 69.718 1.00 49.24 C ATOM 2505 HA PRO B 51 -4.467 34.508 69.034 1.00 0.00 H ATOM 2506 HD3 PRO B 51 -0.919 36.361 69.196 1.00 0.00 H ATOM 2507 HD2 PRO B 51 -0.672 34.849 70.101 1.00 0.00 H ATOM 2508 HG3 PRO B 51 -2.232 35.400 71.690 1.00 0.00 H ATOM 2509 HG2 PRO B 51 -1.948 37.063 71.127 1.00 0.00 H ATOM 2510 HB2 PRO B 51 -3.981 37.178 70.143 1.00 0.00 H ATOM 2511 HB3 PRO B 51 -4.382 35.709 71.062 1.00 0.00 H ATOM 2512 N ASP B 52 -5.462 36.337 67.590 1.00 48.85 N ATOM 2513 CA ASP B 52 -5.995 37.239 66.562 1.00 48.59 C ATOM 2514 C ASP B 52 -6.448 38.605 67.164 1.00 50.60 C ATOM 2515 O ASP B 52 -7.424 38.678 67.894 1.00 52.07 O ATOM 2516 CB ASP B 52 -7.146 36.544 65.858 1.00 47.75 C ATOM 2517 CG ASP B 52 -7.892 37.456 64.942 1.00 47.83 C ATOM 2518 OD1 ASP B 52 -7.464 38.604 64.707 1.00 48.62 O ATOM 2519 OD2 ASP B 52 -8.953 37.023 64.474 1.00 47.97 O ATOM 2520 HA ASP B 52 -5.206 37.466 65.845 1.00 0.00 H ATOM 2521 HB2 ASP B 52 -6.749 35.712 65.276 1.00 0.00 H ATOM 2522 HB3 ASP B 52 -7.837 36.162 66.610 1.00 0.00 H ATOM 2523 H ASP B 52 -6.124 35.772 68.159 1.00 0.00 H ATOM 2524 N GLN B 53 -5.744 39.669 66.810 1.00 50.94 N ATOM 2525 CA GLN B 53 -6.016 41.006 67.374 1.00 54.06 C ATOM 2526 C GLN B 53 -6.404 42.028 66.297 1.00 53.55 C ATOM 2527 O GLN B 53 -5.745 43.012 66.168 1.00 54.32 O ATOM 2528 CB GLN B 53 -4.773 41.526 68.091 1.00 55.59 C ATOM 2529 CG GLN B 53 -4.152 40.582 69.115 1.00 57.04 C ATOM 2530 CD GLN B 53 -2.771 41.081 69.564 1.00 58.65 C ATOM 2531 OE1 GLN B 53 -1.904 41.427 68.697 1.00 58.35 O ATOM 2532 NE2 GLN B 53 -2.543 41.119 70.933 1.00 58.08 N ATOM 2533 HA GLN B 53 -6.853 40.893 68.063 1.00 0.00 H ATOM 2534 HB2 GLN B 53 -4.018 41.744 67.336 1.00 0.00 H ATOM 2535 HB3 GLN B 53 -5.045 42.447 68.607 1.00 0.00 H ATOM 2536 HG2 GLN B 53 -4.807 40.518 69.984 1.00 0.00 H ATOM 2537 HG3 GLN B 53 -4.045 39.593 68.669 1.00 0.00 H ATOM 2538 HE22 GLN B 53 -3.290 40.824 71.593 1.00 0.00 H ATOM 2539 HE21 GLN B 53 -1.625 41.443 71.298 1.00 0.00 H ATOM 2540 H GLN B 53 -4.978 39.560 66.115 1.00 0.00 H ATOM 2541 N GLY B 54 -7.465 41.763 65.537 1.00 53.13 N ATOM 2542 CA GLY B 54 -7.935 42.618 64.449 1.00 52.45 C ATOM 2543 C GLY B 54 -7.273 42.265 63.125 1.00 50.56 C ATOM 2544 O GLY B 54 -7.044 43.132 62.301 1.00 50.59 O ATOM 2545 HA3 GLY B 54 -7.707 43.656 64.692 1.00 0.00 H ATOM 2546 HA2 GLY B 54 -9.014 42.499 64.347 1.00 0.00 H ATOM 2547 H GLY B 54 -7.995 40.889 65.731 1.00 0.00 H ATOM 2548 N LEU B 55 -6.978 40.968 62.911 1.00 48.65 N ATOM 2549 CA LEU B 55 -6.508 40.453 61.626 1.00 46.31 C ATOM 2550 C LEU B 55 -7.450 40.824 60.476 1.00 46.61 C ATOM 2551 O LEU B 55 -8.664 40.918 60.693 1.00 47.10 O ATOM 2552 CB LEU B 55 -6.389 38.951 61.704 1.00 44.39 C ATOM 2553 CG LEU B 55 -5.276 38.472 62.626 1.00 44.28 C ATOM 2554 CD1 LEU B 55 -5.237 36.914 62.636 1.00 43.03 C ATOM 2555 CD2 LEU B 55 -3.978 39.095 62.119 1.00 44.23 C ATOM 2556 HA LEU B 55 -5.538 40.907 61.422 1.00 0.00 H ATOM 2557 HB2 LEU B 55 -7.335 38.549 62.068 1.00 0.00 H ATOM 2558 HB3 LEU B 55 -6.195 38.568 60.702 1.00 0.00 H ATOM 2559 HG LEU B 55 -5.436 38.779 63.659 1.00 0.00 H ATOM 2560 HD21 LEU B 55 -3.797 38.771 61.094 1.00 0.00 H ATOM 2561 HD22 LEU B 55 -4.062 40.181 62.148 1.00 0.00 H ATOM 2562 HD23 LEU B 55 -3.151 38.776 62.754 1.00 0.00 H ATOM 2563 HD11 LEU B 55 -6.193 36.530 62.992 1.00 0.00 H ATOM 2564 HD12 LEU B 55 -5.052 36.550 61.625 1.00 0.00 H ATOM 2565 HD13 LEU B 55 -4.439 36.576 63.297 1.00 0.00 H ATOM 2566 H LEU B 55 -7.090 40.299 63.700 1.00 0.00 H ATOM 2567 N ILE B 56 -6.900 41.033 59.263 1.00 45.26 N ATOM 2568 CA ILE B 56 -7.775 41.409 58.137 1.00 46.26 C ATOM 2569 C ILE B 56 -8.662 40.219 57.776 1.00 45.12 C ATOM 2570 O ILE B 56 -9.700 40.385 57.150 1.00 46.30 O ATOM 2571 CB ILE B 56 -7.012 41.986 56.894 1.00 45.96 C ATOM 2572 CG1 ILE B 56 -5.921 41.009 56.404 1.00 44.19 C ATOM 2573 CG2 ILE B 56 -6.433 43.364 57.232 1.00 47.83 C ATOM 2574 CD1 ILE B 56 -5.805 40.887 54.884 1.00 43.50 C ATOM 2575 HA ILE B 56 -8.398 42.240 58.468 1.00 0.00 H ATOM 2576 HB ILE B 56 -7.718 42.106 56.072 1.00 0.00 H ATOM 2577 HG12 ILE B 56 -4.961 41.350 56.791 1.00 0.00 H ATOM 2578 HG13 ILE B 56 -6.144 40.021 56.808 1.00 0.00 H ATOM 2579 HD11 ILE B 56 -6.751 40.532 54.476 1.00 0.00 H ATOM 2580 HD12 ILE B 56 -5.568 41.863 54.460 1.00 0.00 H ATOM 2581 HD13 ILE B 56 -5.013 40.180 54.637 1.00 0.00 H ATOM 2582 HG21 ILE B 56 -7.243 44.041 57.503 1.00 0.00 H ATOM 2583 HG22 ILE B 56 -5.740 43.270 58.069 1.00 0.00 H ATOM 2584 HG23 ILE B 56 -5.905 43.758 56.364 1.00 0.00 H ATOM 2585 H ILE B 56 -5.874 40.931 59.123 1.00 0.00 H ATOM 2586 N CYS B 57 -8.244 39.014 58.151 1.00 43.67 N ATOM 2587 CA CYS B 57 -9.080 37.841 57.986 1.00 42.61 C ATOM 2588 C CYS B 57 -9.110 37.117 59.314 1.00 42.87 C ATOM 2589 O CYS B 57 -8.064 36.729 59.816 1.00 42.91 O ATOM 2590 CB CYS B 57 -8.524 36.911 56.908 1.00 41.62 C ATOM 2591 SG CYS B 57 -9.555 35.450 56.535 1.00 39.75 S ATOM 2592 HA CYS B 57 -10.080 38.143 57.675 1.00 0.00 H ATOM 2593 HB2 CYS B 57 -7.546 36.559 57.237 1.00 0.00 H ATOM 2594 HB3 CYS B 57 -8.411 37.488 55.990 1.00 0.00 H ATOM 2595 HG CYS B 57 -10.796 35.865 56.096 1.00 0.00 H ATOM 2596 H CYS B 57 -7.298 38.911 58.571 1.00 0.00 H ATOM 2597 N HIS B 58 -10.295 36.903 59.872 1.00 43.73 N ATOM 2598 CA HIS B 58 -10.421 36.164 61.144 1.00 44.72 C ATOM 2599 C HIS B 58 -10.576 34.656 61.016 1.00 44.75 C ATOM 2600 O HIS B 58 -10.767 33.950 62.048 1.00 46.09 O ATOM 2601 CB HIS B 58 -11.594 36.708 61.939 1.00 46.30 C ATOM 2602 CG HIS B 58 -11.476 38.159 62.250 1.00 47.32 C ATOM 2603 ND1 HIS B 58 -10.457 38.662 62.981 1.00 47.35 N ATOM 2604 CD2 HIS B 58 -12.321 39.228 61.967 1.00 48.72 C ATOM 2605 CE1 HIS B 58 -10.626 39.979 63.120 1.00 47.86 C ATOM 2606 NE2 HIS B 58 -11.774 40.319 62.512 1.00 48.97 N ATOM 2607 HA HIS B 58 -9.470 36.323 61.652 1.00 0.00 H ATOM 2608 HB2 HIS B 58 -12.505 36.551 61.362 1.00 0.00 H ATOM 2609 HB3 HIS B 58 -11.661 36.158 62.877 1.00 0.00 H ATOM 2610 HD2 HIS B 58 -13.254 39.184 61.406 1.00 0.00 H ATOM 2611 HE1 HIS B 58 -9.950 40.660 63.637 1.00 0.00 H ATOM 2612 H HIS B 58 -11.151 37.263 59.404 1.00 0.00 H ATOM 2613 N ASP B 59 -10.470 34.156 59.777 1.00 43.14 N ATOM 2614 CA ASP B 59 -10.700 32.761 59.464 1.00 42.35 C ATOM 2615 C ASP B 59 -9.391 32.131 59.083 1.00 40.72 C ATOM 2616 O ASP B 59 -9.361 31.047 58.544 1.00 40.50 O ATOM 2617 CB ASP B 59 -11.662 32.661 58.297 1.00 42.75 C ATOM 2618 CG ASP B 59 -13.021 33.212 58.636 1.00 45.19 C ATOM 2619 OD1 ASP B 59 -13.249 33.536 59.819 1.00 46.38 O ATOM 2620 OD2 ASP B 59 -13.868 33.330 57.733 1.00 46.05 O ATOM 2621 HA ASP B 59 -11.124 32.249 60.328 1.00 0.00 H ATOM 2622 HB2 ASP B 59 -11.255 33.222 57.456 1.00 0.00 H ATOM 2623 HB3 ASP B 59 -11.767 31.613 58.016 1.00 0.00 H ATOM 2624 H ASP B 59 -10.210 34.801 59.003 1.00 0.00 H ATOM 2625 N ALA B 60 -8.299 32.806 59.375 1.00 39.89 N ATOM 2626 CA ALA B 60 -7.004 32.279 59.065 1.00 38.68 C ATOM 2627 C ALA B 60 -6.029 32.795 60.106 1.00 39.39 C ATOM 2628 O ALA B 60 -6.203 33.904 60.666 1.00 39.49 O ATOM 2629 CB ALA B 60 -6.561 32.699 57.646 1.00 37.39 C ATOM 2630 HA ALA B 60 -7.032 31.190 59.083 1.00 0.00 H ATOM 2631 HB1 ALA B 60 -7.277 32.321 56.916 1.00 0.00 H ATOM 2632 HB2 ALA B 60 -6.520 33.787 57.587 1.00 0.00 H ATOM 2633 HB3 ALA B 60 -5.575 32.285 57.437 1.00 0.00 H ATOM 2634 H ALA B 60 -8.378 33.734 59.837 1.00 0.00 H ATOM 2635 N PHE B 61 -4.974 32.025 60.370 1.00 39.27 N ATOM 2636 CA PHE B 61 -3.949 32.541 61.285 1.00 40.32 C ATOM 2637 C PHE B 61 -3.314 33.907 60.867 1.00 40.56 C ATOM 2638 O PHE B 61 -3.264 34.271 59.672 1.00 40.31 O ATOM 2639 CB PHE B 61 -2.917 31.477 61.634 1.00 39.71 C ATOM 2640 CG PHE B 61 -3.535 30.246 62.291 1.00 40.92 C ATOM 2641 CD1 PHE B 61 -4.167 30.349 63.545 1.00 41.81 C ATOM 2642 CD2 PHE B 61 -3.516 29.015 61.669 1.00 39.92 C ATOM 2643 CE1 PHE B 61 -4.760 29.260 64.149 1.00 42.53 C ATOM 2644 CE2 PHE B 61 -4.107 27.911 62.271 1.00 41.08 C ATOM 2645 CZ PHE B 61 -4.717 28.026 63.540 1.00 42.57 C ATOM 2646 HA PHE B 61 -4.484 32.786 62.203 1.00 0.00 H ATOM 2647 HB2 PHE B 61 -2.413 31.167 60.719 1.00 0.00 H ATOM 2648 HB3 PHE B 61 -2.189 31.910 62.320 1.00 0.00 H ATOM 2649 HD2 PHE B 61 -3.034 28.907 60.698 1.00 0.00 H ATOM 2650 HE2 PHE B 61 -4.100 26.948 61.760 1.00 0.00 H ATOM 2651 HZ PHE B 61 -5.147 27.152 64.029 1.00 0.00 H ATOM 2652 HE1 PHE B 61 -5.263 29.376 65.109 1.00 0.00 H ATOM 2653 HD1 PHE B 61 -4.188 31.314 64.051 1.00 0.00 H ATOM 2654 H PHE B 61 -4.879 31.083 59.939 1.00 0.00 H ATOM 2655 N CYS B 62 -2.852 34.664 61.855 1.00 41.00 N ATOM 2656 CA CYS B 62 -1.978 35.778 61.578 1.00 41.63 C ATOM 2657 C CYS B 62 -0.824 35.292 60.686 1.00 40.66 C ATOM 2658 O CYS B 62 -0.228 34.236 60.953 1.00 40.47 O ATOM 2659 CB CYS B 62 -1.431 36.344 62.895 1.00 42.23 C ATOM 2660 SG CYS B 62 -0.220 37.622 62.607 1.00 42.90 S ATOM 2661 HA CYS B 62 -2.527 36.566 61.063 1.00 0.00 H ATOM 2662 HB2 CYS B 62 -0.966 35.537 63.461 1.00 0.00 H ATOM 2663 HB3 CYS B 62 -2.257 36.762 63.471 1.00 0.00 H ATOM 2664 HG CYS B 62 0.241 38.098 63.818 1.00 0.00 H ATOM 2665 H CYS B 62 -3.122 34.452 62.837 1.00 0.00 H ATOM 2666 N GLY B 63 -0.499 36.041 59.623 1.00 40.45 N ATOM 2667 CA GLY B 63 0.621 35.625 58.718 1.00 39.47 C ATOM 2668 C GLY B 63 0.402 34.578 57.625 1.00 37.62 C ATOM 2669 O GLY B 63 1.376 34.151 56.963 1.00 36.68 O ATOM 2670 HA3 GLY B 63 1.413 35.241 59.361 1.00 0.00 H ATOM 2671 HA2 GLY B 63 0.967 36.529 58.217 1.00 0.00 H ATOM 2672 H GLY B 63 -1.027 36.915 59.425 1.00 0.00 H ATOM 2673 N ALA B 64 -0.861 34.161 57.479 1.00 37.01 N ATOM 2674 CA ALA B 64 -1.379 33.321 56.393 1.00 36.49 C ATOM 2675 C ALA B 64 -1.679 34.097 55.145 1.00 36.78 C ATOM 2676 O ALA B 64 -1.887 35.354 55.178 1.00 38.67 O ATOM 2677 CB ALA B 64 -2.672 32.620 56.824 1.00 36.40 C ATOM 2678 HA ALA B 64 -0.591 32.599 56.177 1.00 0.00 H ATOM 2679 HB1 ALA B 64 -2.471 31.992 57.692 1.00 0.00 H ATOM 2680 HB2 ALA B 64 -3.421 33.369 57.081 1.00 0.00 H ATOM 2681 HB3 ALA B 64 -3.039 32.002 56.005 1.00 0.00 H ATOM 2682 H ALA B 64 -1.542 34.461 58.206 1.00 0.00 H ATOM 2683 N LEU B 65 -1.772 33.366 54.041 1.00 35.57 N ATOM 2684 CA LEU B 65 -2.226 33.962 52.782 1.00 35.23 C ATOM 2685 C LEU B 65 -3.772 34.025 52.684 1.00 34.92 C ATOM 2686 O LEU B 65 -4.523 33.033 52.870 1.00 34.55 O ATOM 2687 CB LEU B 65 -1.597 33.230 51.566 1.00 34.50 C ATOM 2688 CG LEU B 65 -1.959 33.706 50.167 1.00 34.19 C ATOM 2689 CD1 LEU B 65 -1.692 35.200 50.016 1.00 34.62 C ATOM 2690 CD2 LEU B 65 -1.098 32.967 49.208 1.00 33.97 C ATOM 2691 HA LEU B 65 -1.878 34.995 52.766 1.00 0.00 H ATOM 2692 HB2 LEU B 65 -0.515 33.313 51.665 1.00 0.00 H ATOM 2693 HB3 LEU B 65 -1.888 32.182 51.635 1.00 0.00 H ATOM 2694 HG LEU B 65 -3.018 33.525 49.980 1.00 0.00 H ATOM 2695 HD21 LEU B 65 -0.051 33.179 49.424 1.00 0.00 H ATOM 2696 HD22 LEU B 65 -1.282 31.897 49.307 1.00 0.00 H ATOM 2697 HD23 LEU B 65 -1.332 33.285 48.192 1.00 0.00 H ATOM 2698 HD11 LEU B 65 -2.292 35.750 50.741 1.00 0.00 H ATOM 2699 HD12 LEU B 65 -0.635 35.399 50.192 1.00 0.00 H ATOM 2700 HD13 LEU B 65 -1.959 35.515 49.007 1.00 0.00 H ATOM 2701 H LEU B 65 -1.519 32.358 54.070 1.00 0.00 H ATOM 2702 N VAL B 66 -4.263 35.196 52.396 1.00 35.14 N ATOM 2703 CA VAL B 66 -5.683 35.314 52.166 1.00 35.82 C ATOM 2704 C VAL B 66 -5.900 36.052 50.832 1.00 36.52 C ATOM 2705 O VAL B 66 -4.945 36.510 50.217 1.00 36.51 O ATOM 2706 CB VAL B 66 -6.393 35.988 53.358 1.00 36.46 C ATOM 2707 CG1 VAL B 66 -5.934 35.369 54.691 1.00 35.67 C ATOM 2708 CG2 VAL B 66 -6.226 37.557 53.299 1.00 37.53 C ATOM 2709 HA VAL B 66 -6.136 34.326 52.088 1.00 0.00 H ATOM 2710 HB VAL B 66 -7.464 35.796 53.289 1.00 0.00 H ATOM 2711 HG11 VAL B 66 -6.171 34.305 54.697 1.00 0.00 H ATOM 2712 HG12 VAL B 66 -4.858 35.504 54.801 1.00 0.00 H ATOM 2713 HG13 VAL B 66 -6.449 35.862 55.515 1.00 0.00 H ATOM 2714 HG21 VAL B 66 -5.166 37.810 53.333 1.00 0.00 H ATOM 2715 HG22 VAL B 66 -6.661 37.933 52.373 1.00 0.00 H ATOM 2716 HG23 VAL B 66 -6.736 38.008 54.151 1.00 0.00 H ATOM 2717 H VAL B 66 -3.644 36.030 52.333 1.00 0.00 H ATOM 2718 N MET B 67 -7.143 36.135 50.382 1.00 37.29 N ATOM 2719 CA MET B 67 -7.431 36.796 49.146 1.00 38.66 C ATOM 2720 C MET B 67 -8.679 37.611 49.305 1.00 39.97 C ATOM 2721 O MET B 67 -9.381 37.443 50.284 1.00 40.43 O ATOM 2722 CB MET B 67 -7.609 35.836 47.980 1.00 37.99 C ATOM 2723 CG MET B 67 -8.787 34.873 48.088 1.00 38.73 C ATOM 2724 SD MET B 67 -8.846 33.822 46.600 1.00 38.44 S ATOM 2725 CE MET B 67 -9.972 32.532 47.140 1.00 38.23 C ATOM 2726 HA MET B 67 -6.573 37.426 48.913 1.00 0.00 H ATOM 2727 HB2 MET B 67 -7.743 36.429 47.075 1.00 0.00 H ATOM 2728 HB3 MET B 67 -6.699 35.243 47.892 1.00 0.00 H ATOM 2729 HG2 MET B 67 -9.714 35.440 48.171 1.00 0.00 H ATOM 2730 HG3 MET B 67 -8.666 34.247 48.972 1.00 0.00 H ATOM 2731 HE1 MET B 67 -9.555 32.030 48.013 1.00 0.00 H ATOM 2732 HE2 MET B 67 -10.933 32.976 47.399 1.00 0.00 H ATOM 2733 HE3 MET B 67 -10.109 31.810 46.335 1.00 0.00 H ATOM 2734 H MET B 67 -7.918 35.715 50.933 1.00 0.00 H ATOM 2735 N LYS B 68 -8.924 38.482 48.333 1.00 40.48 N ATOM 2736 CA LYS B 68 -10.254 39.055 48.129 1.00 41.84 C ATOM 2737 C LYS B 68 -10.643 38.854 46.683 1.00 41.99 C ATOM 2738 O LYS B 68 -9.820 38.952 45.798 1.00 41.10 O ATOM 2739 CB LYS B 68 -10.275 40.544 48.422 1.00 43.12 C ATOM 2740 CG LYS B 68 -10.070 40.908 49.873 1.00 43.40 C ATOM 2741 CD LYS B 68 -10.819 42.201 50.204 1.00 46.45 C ATOM 2742 CE LYS B 68 -9.931 43.153 50.983 1.00 47.19 C ATOM 2743 NZ LYS B 68 -10.679 44.227 51.703 1.00 48.97 N ATOM 2744 HA LYS B 68 -10.948 38.559 48.808 1.00 0.00 H ATOM 2745 HB2 LYS B 68 -9.484 41.016 47.839 1.00 0.00 H ATOM 2746 HB3 LYS B 68 -11.241 40.938 48.107 1.00 0.00 H ATOM 2747 HG2 LYS B 68 -10.446 40.102 50.503 1.00 0.00 H ATOM 2748 HG3 LYS B 68 -9.006 41.049 50.062 1.00 0.00 H ATOM 2749 HD2 LYS B 68 -11.131 42.681 49.277 1.00 0.00 H ATOM 2750 HD3 LYS B 68 -11.698 41.962 50.802 1.00 0.00 H ATOM 2751 HE2 LYS B 68 -9.239 43.625 50.286 1.00 0.00 H ATOM 2752 HE3 LYS B 68 -9.369 42.575 51.717 1.00 0.00 H ATOM 2753 HZ1 LYS B 68 -11.213 44.796 51.016 1.00 0.00 H ATOM 2754 HZ2 LYS B 68 -11.337 43.794 52.382 1.00 0.00 H ATOM 2755 HZ3 LYS B 68 -10.006 44.836 52.211 1.00 0.00 H ATOM 2756 H LYS B 68 -8.149 38.764 47.700 1.00 0.00 H ATOM 2757 N ILE B 69 -11.911 38.557 46.454 1.00 43.02 N ATOM 2758 CA ILE B 69 -12.414 38.491 45.098 1.00 43.76 C ATOM 2759 C ILE B 69 -13.384 39.652 44.850 1.00 46.03 C ATOM 2760 O ILE B 69 -14.523 39.706 45.380 1.00 47.06 O ATOM 2761 CB ILE B 69 -13.011 37.113 44.792 1.00 43.00 C ATOM 2762 CG1 ILE B 69 -11.914 36.052 44.913 1.00 40.92 C ATOM 2763 CG2 ILE B 69 -13.616 37.095 43.404 1.00 44.18 C ATOM 2764 CD1 ILE B 69 -12.422 34.631 44.820 1.00 41.01 C ATOM 2765 HA ILE B 69 -11.589 38.609 44.395 1.00 0.00 H ATOM 2766 HB ILE B 69 -13.804 36.895 45.508 1.00 0.00 H ATOM 2767 HG12 ILE B 69 -11.192 36.212 44.112 1.00 0.00 H ATOM 2768 HG13 ILE B 69 -11.420 36.178 45.876 1.00 0.00 H ATOM 2769 HD11 ILE B 69 -13.137 34.449 45.622 1.00 0.00 H ATOM 2770 HD12 ILE B 69 -12.909 34.483 43.856 1.00 0.00 H ATOM 2771 HD13 ILE B 69 -11.584 33.940 44.915 1.00 0.00 H ATOM 2772 HG21 ILE B 69 -14.404 37.845 43.343 1.00 0.00 H ATOM 2773 HG22 ILE B 69 -12.843 37.318 42.669 1.00 0.00 H ATOM 2774 HG23 ILE B 69 -14.035 36.109 43.204 1.00 0.00 H ATOM 2775 H ILE B 69 -12.551 38.370 47.252 1.00 0.00 H ATOM 2776 N GLY B 70 -12.919 40.589 44.021 1.00 47.36 N ATOM 2777 CA GLY B 70 -13.690 41.778 43.709 1.00 49.14 C ATOM 2778 C GLY B 70 -13.950 42.464 45.032 1.00 50.17 C ATOM 2779 O GLY B 70 -12.992 42.745 45.786 1.00 47.80 O ATOM 2780 HA3 GLY B 70 -14.631 41.505 43.232 1.00 0.00 H ATOM 2781 HA2 GLY B 70 -13.125 42.434 43.047 1.00 0.00 H ATOM 2782 H GLY B 70 -11.982 40.464 43.588 1.00 0.00 H ATOM 2783 N ASN B 71 -15.242 42.702 45.310 1.00 52.40 N ATOM 2784 CA ASN B 71 -15.731 43.289 46.563 1.00 53.83 C ATOM 2785 C ASN B 71 -15.885 42.389 47.774 1.00 52.50 C ATOM 2786 O ASN B 71 -16.388 42.853 48.801 1.00 53.18 O ATOM 2787 CB ASN B 71 -17.104 43.874 46.318 1.00 57.42 C ATOM 2788 CG ASN B 71 -17.038 45.068 45.431 1.00 60.18 C ATOM 2789 OD1 ASN B 71 -17.723 45.124 44.412 1.00 62.43 O ATOM 2790 ND2 ASN B 71 -16.159 46.020 45.773 1.00 60.34 N ATOM 2791 HA ASN B 71 -14.942 43.997 46.817 1.00 0.00 H ATOM 2792 HB2 ASN B 71 -17.733 43.118 45.848 1.00 0.00 H ATOM 2793 HB3 ASN B 71 -17.541 44.166 47.273 1.00 0.00 H ATOM 2794 HD22 ASN B 71 -15.603 45.925 46.647 1.00 0.00 H ATOM 2795 HD21 ASN B 71 -16.033 46.854 45.165 1.00 0.00 H ATOM 2796 H ASN B 71 -15.946 42.453 44.586 1.00 0.00 H ATOM 2797 N SER B 72 -15.476 41.112 47.681 1.00 49.44 N ATOM 2798 CA SER B 72 -15.787 40.167 48.755 1.00 48.60 C ATOM 2799 C SER B 72 -15.028 40.499 50.041 1.00 48.17 C ATOM 2800 O SER B 72 -14.091 41.318 50.050 1.00 46.92 O ATOM 2801 CB SER B 72 -15.420 38.753 48.354 1.00 46.28 C ATOM 2802 OG SER B 72 -14.003 38.641 48.363 1.00 44.22 O ATOM 2803 HA SER B 72 -16.859 40.247 48.933 1.00 0.00 H ATOM 2804 HB2 SER B 72 -15.801 38.542 47.355 1.00 0.00 H ATOM 2805 HB3 SER B 72 -15.851 38.045 49.062 1.00 0.00 H ATOM 2806 HG SER B 72 -13.663 38.836 49.272 1.00 0.00 H ATOM 2807 H SER B 72 -14.940 40.796 46.848 1.00 0.00 H ATOM 2808 N GLY B 73 -15.401 39.843 51.129 1.00 47.96 N ATOM 2809 CA GLY B 73 -14.558 39.930 52.288 1.00 47.74 C ATOM 2810 C GLY B 73 -13.275 39.161 52.024 1.00 46.16 C ATOM 2811 O GLY B 73 -12.974 38.720 50.884 1.00 45.07 O ATOM 2812 HA3 GLY B 73 -15.072 39.500 53.148 1.00 0.00 H ATOM 2813 HA2 GLY B 73 -14.323 40.975 52.492 1.00 0.00 H ATOM 2814 H GLY B 73 -16.277 39.282 51.144 1.00 0.00 H ATOM 2815 N THR B 74 -12.470 39.026 53.060 1.00 45.63 N ATOM 2816 CA THR B 74 -11.275 38.234 52.921 1.00 43.91 C ATOM 2817 C THR B 74 -11.639 36.731 52.924 1.00 43.37 C ATOM 2818 O THR B 74 -12.614 36.281 53.557 1.00 44.44 O ATOM 2819 CB THR B 74 -10.294 38.505 54.049 1.00 43.56 C ATOM 2820 OG1 THR B 74 -10.908 38.155 55.313 1.00 44.03 O ATOM 2821 CG2 THR B 74 -9.833 39.997 54.054 1.00 44.44 C ATOM 2822 HA THR B 74 -10.804 38.508 51.977 1.00 0.00 H ATOM 2823 HB THR B 74 -9.406 37.891 53.896 1.00 0.00 H ATOM 2824 HG1 THR B 74 -10.269 38.331 56.049 1.00 0.00 H ATOM 2825 HG23 THR B 74 -9.375 40.238 53.095 1.00 0.00 H ATOM 2826 HG21 THR B 74 -10.696 40.642 54.218 1.00 0.00 H ATOM 2827 HG22 THR B 74 -9.107 40.149 54.853 1.00 0.00 H ATOM 2828 H THR B 74 -12.695 39.485 53.965 1.00 0.00 H ATOM 2829 N ILE B 75 -10.857 35.957 52.202 1.00 42.43 N ATOM 2830 CA ILE B 75 -11.085 34.518 52.126 1.00 41.29 C ATOM 2831 C ILE B 75 -9.745 33.816 52.308 1.00 40.22 C ATOM 2832 O ILE B 75 -8.756 34.212 51.686 1.00 39.76 O ATOM 2833 CB ILE B 75 -11.671 34.155 50.768 1.00 41.28 C ATOM 2834 CG1 ILE B 75 -13.044 34.806 50.609 1.00 42.26 C ATOM 2835 CG2 ILE B 75 -11.719 32.617 50.576 1.00 40.05 C ATOM 2836 CD1 ILE B 75 -13.453 34.882 49.155 1.00 42.22 C ATOM 2837 HA ILE B 75 -11.786 34.209 52.901 1.00 0.00 H ATOM 2838 HB ILE B 75 -11.025 34.543 49.981 1.00 0.00 H ATOM 2839 HG12 ILE B 75 -13.781 34.217 51.155 1.00 0.00 H ATOM 2840 HG13 ILE B 75 -13.009 35.814 51.021 1.00 0.00 H ATOM 2841 HD11 ILE B 75 -12.723 35.474 48.604 1.00 0.00 H ATOM 2842 HD12 ILE B 75 -13.496 33.876 48.738 1.00 0.00 H ATOM 2843 HD13 ILE B 75 -14.434 35.350 49.079 1.00 0.00 H ATOM 2844 HG21 ILE B 75 -10.709 32.212 50.641 1.00 0.00 H ATOM 2845 HG22 ILE B 75 -12.340 32.174 51.355 1.00 0.00 H ATOM 2846 HG23 ILE B 75 -12.142 32.387 49.598 1.00 0.00 H ATOM 2847 H ILE B 75 -10.064 36.378 51.677 1.00 0.00 H ATOM 2848 N PRO B 76 -9.690 32.797 53.186 1.00 40.03 N ATOM 2849 CA PRO B 76 -8.411 32.125 53.356 1.00 39.19 C ATOM 2850 C PRO B 76 -7.975 31.365 52.104 1.00 38.60 C ATOM 2851 O PRO B 76 -8.763 30.658 51.451 1.00 39.04 O ATOM 2852 CB PRO B 76 -8.675 31.113 54.484 1.00 39.44 C ATOM 2853 CG PRO B 76 -9.992 31.482 55.059 1.00 40.59 C ATOM 2854 CD PRO B 76 -10.757 32.173 53.973 1.00 40.70 C ATOM 2855 HA PRO B 76 -7.618 32.843 53.566 1.00 0.00 H ATOM 2856 HD3 PRO B 76 -11.324 31.460 53.374 1.00 0.00 H ATOM 2857 HD2 PRO B 76 -11.435 32.922 54.383 1.00 0.00 H ATOM 2858 HG3 PRO B 76 -9.857 32.152 55.908 1.00 0.00 H ATOM 2859 HG2 PRO B 76 -10.524 30.588 55.384 1.00 0.00 H ATOM 2860 HB2 PRO B 76 -8.705 30.099 54.085 1.00 0.00 H ATOM 2861 HB3 PRO B 76 -7.897 31.180 55.244 1.00 0.00 H ATOM 2862 N VAL B 77 -6.687 31.465 51.835 1.00 38.29 N ATOM 2863 CA VAL B 77 -6.076 30.723 50.779 1.00 37.04 C ATOM 2864 C VAL B 77 -5.099 29.732 51.390 1.00 36.97 C ATOM 2865 O VAL B 77 -5.046 28.529 50.978 1.00 36.37 O ATOM 2866 CB VAL B 77 -5.330 31.669 49.821 1.00 37.25 C ATOM 2867 CG1 VAL B 77 -4.472 30.835 48.887 1.00 36.76 C ATOM 2868 CG2 VAL B 77 -6.317 32.500 49.015 1.00 37.85 C ATOM 2869 HA VAL B 77 -6.842 30.195 50.211 1.00 0.00 H ATOM 2870 HB VAL B 77 -4.704 32.350 50.397 1.00 0.00 H ATOM 2871 HG11 VAL B 77 -3.756 30.258 49.472 1.00 0.00 H ATOM 2872 HG12 VAL B 77 -5.109 30.157 48.319 1.00 0.00 H ATOM 2873 HG13 VAL B 77 -3.937 31.493 48.202 1.00 0.00 H ATOM 2874 HG21 VAL B 77 -6.957 31.838 48.432 1.00 0.00 H ATOM 2875 HG22 VAL B 77 -6.929 33.094 49.694 1.00 0.00 H ATOM 2876 HG23 VAL B 77 -5.770 33.162 48.344 1.00 0.00 H ATOM 2877 H VAL B 77 -6.100 32.103 52.409 1.00 0.00 H ATOM 2878 N ASN B 78 -4.325 30.197 52.381 1.00 36.50 N ATOM 2879 CA ASN B 78 -3.329 29.290 53.034 1.00 36.37 C ATOM 2880 C ASN B 78 -2.355 28.638 52.031 1.00 36.43 C ATOM 2881 O ASN B 78 -1.800 29.350 51.194 1.00 36.08 O ATOM 2882 CB ASN B 78 -4.032 28.243 53.916 1.00 36.72 C ATOM 2883 CG ASN B 78 -4.891 28.884 55.003 1.00 37.89 C ATOM 2884 OD1 ASN B 78 -6.110 28.769 54.983 1.00 38.41 O ATOM 2885 ND2 ASN B 78 -4.262 29.624 55.914 1.00 38.01 N ATOM 2886 HA ASN B 78 -2.712 29.915 53.679 1.00 0.00 H ATOM 2887 HB2 ASN B 78 -4.669 27.624 53.285 1.00 0.00 H ATOM 2888 HB3 ASN B 78 -3.275 27.618 54.390 1.00 0.00 H ATOM 2889 HD22 ASN B 78 -3.225 29.697 55.898 1.00 0.00 H ATOM 2890 HD21 ASN B 78 -4.808 30.129 56.641 1.00 0.00 H ATOM 2891 H ASN B 78 -4.416 31.184 52.695 1.00 0.00 H ATOM 2892 N THR B 79 -2.166 27.304 52.078 1.00 36.27 N ATOM 2893 CA THR B 79 -1.208 26.647 51.197 1.00 36.17 C ATOM 2894 C THR B 79 -1.738 26.584 49.759 1.00 36.50 C ATOM 2895 O THR B 79 -0.971 26.349 48.824 1.00 37.27 O ATOM 2896 CB THR B 79 -0.944 25.218 51.613 1.00 37.21 C ATOM 2897 OG1 THR B 79 -2.211 24.533 51.702 1.00 36.38 O ATOM 2898 CG2 THR B 79 -0.202 25.196 52.946 1.00 37.16 C ATOM 2899 HA THR B 79 -0.294 27.238 51.261 1.00 0.00 H ATOM 2900 HB THR B 79 -0.316 24.712 50.880 1.00 0.00 H ATOM 2901 HG1 THR B 79 -2.058 23.593 51.974 1.00 0.00 H ATOM 2902 HG23 THR B 79 0.747 25.721 52.841 1.00 0.00 H ATOM 2903 HG21 THR B 79 -0.809 25.688 53.706 1.00 0.00 H ATOM 2904 HG22 THR B 79 -0.017 24.163 53.240 1.00 0.00 H ATOM 2905 H THR B 79 -2.713 26.734 52.754 1.00 0.00 H ATOM 2906 N GLY B 80 -3.036 26.852 49.576 1.00 35.56 N ATOM 2907 CA GLY B 80 -3.627 26.850 48.244 1.00 34.21 C ATOM 2908 C GLY B 80 -5.046 26.342 48.324 1.00 34.00 C ATOM 2909 O GLY B 80 -5.549 26.122 49.410 1.00 33.42 O ATOM 2910 HA3 GLY B 80 -3.045 26.202 47.589 1.00 0.00 H ATOM 2911 HA2 GLY B 80 -3.626 27.864 47.844 1.00 0.00 H ATOM 2912 H GLY B 80 -3.634 27.066 50.400 1.00 0.00 H ATOM 2913 N LEU B 81 -5.670 26.150 47.161 1.00 34.00 N ATOM 2914 CA LEU B 81 -7.057 25.750 47.042 1.00 34.92 C ATOM 2915 C LEU B 81 -7.087 24.881 45.836 1.00 35.05 C ATOM 2916 O LEU B 81 -6.527 25.256 44.826 1.00 36.41 O ATOM 2917 CB LEU B 81 -7.971 26.978 46.803 1.00 34.71 C ATOM 2918 CG LEU B 81 -7.974 28.059 47.871 1.00 34.77 C ATOM 2919 CD1 LEU B 81 -8.740 29.294 47.378 1.00 34.63 C ATOM 2920 CD2 LEU B 81 -8.502 27.529 49.213 1.00 35.22 C ATOM 2921 HA LEU B 81 -7.412 25.255 47.946 1.00 0.00 H ATOM 2922 HB2 LEU B 81 -7.660 27.442 45.867 1.00 0.00 H ATOM 2923 HB3 LEU B 81 -8.993 26.612 46.703 1.00 0.00 H ATOM 2924 HG LEU B 81 -6.945 28.367 48.055 1.00 0.00 H ATOM 2925 HD21 LEU B 81 -9.523 27.170 49.084 1.00 0.00 H ATOM 2926 HD22 LEU B 81 -7.868 26.710 49.554 1.00 0.00 H ATOM 2927 HD23 LEU B 81 -8.488 28.332 49.950 1.00 0.00 H ATOM 2928 HD11 LEU B 81 -8.261 29.682 46.479 1.00 0.00 H ATOM 2929 HD12 LEU B 81 -9.769 29.015 47.151 1.00 0.00 H ATOM 2930 HD13 LEU B 81 -8.733 30.059 48.155 1.00 0.00 H ATOM 2931 H LEU B 81 -5.127 26.296 46.286 1.00 0.00 H ATOM 2932 N PHE B 82 -7.709 23.721 45.920 1.00 35.86 N ATOM 2933 CA PHE B 82 -7.668 22.729 44.846 1.00 35.85 C ATOM 2934 C PHE B 82 -9.023 22.612 44.154 1.00 35.97 C ATOM 2935 O PHE B 82 -9.981 22.202 44.773 1.00 36.19 O ATOM 2936 CB PHE B 82 -7.241 21.354 45.405 1.00 36.43 C ATOM 2937 CG PHE B 82 -7.220 20.250 44.383 1.00 37.50 C ATOM 2938 CD1 PHE B 82 -6.104 20.062 43.532 1.00 37.39 C ATOM 2939 CD2 PHE B 82 -8.285 19.359 44.293 1.00 38.75 C ATOM 2940 CE1 PHE B 82 -6.091 19.054 42.603 1.00 38.80 C ATOM 2941 CE2 PHE B 82 -8.268 18.299 43.381 1.00 39.41 C ATOM 2942 CZ PHE B 82 -7.169 18.150 42.530 1.00 40.00 C ATOM 2943 HA PHE B 82 -6.935 23.060 44.110 1.00 0.00 H ATOM 2944 HB2 PHE B 82 -6.239 21.451 45.824 1.00 0.00 H ATOM 2945 HB3 PHE B 82 -7.938 21.075 46.195 1.00 0.00 H ATOM 2946 HD2 PHE B 82 -9.148 19.490 44.945 1.00 0.00 H ATOM 2947 HE2 PHE B 82 -9.101 17.598 43.334 1.00 0.00 H ATOM 2948 HZ PHE B 82 -7.146 17.333 41.809 1.00 0.00 H ATOM 2949 HE1 PHE B 82 -5.247 18.952 41.921 1.00 0.00 H ATOM 2950 HD1 PHE B 82 -5.245 20.727 43.617 1.00 0.00 H ATOM 2951 H PHE B 82 -8.249 23.504 46.782 1.00 0.00 H ATOM 2952 N ARG B 83 -9.086 22.960 42.870 1.00 36.67 N ATOM 2953 CA ARG B 83 -10.312 22.862 42.080 1.00 37.56 C ATOM 2954 C ARG B 83 -11.512 23.466 42.802 1.00 38.09 C ATOM 2955 O ARG B 83 -12.512 22.788 43.068 1.00 38.55 O ATOM 2956 CB ARG B 83 -10.545 21.416 41.653 1.00 38.88 C ATOM 2957 CG ARG B 83 -9.453 21.004 40.694 1.00 39.23 C ATOM 2958 CD ARG B 83 -9.524 19.547 40.265 1.00 40.82 C ATOM 2959 NE ARG B 83 -8.316 19.231 39.494 1.00 40.94 N ATOM 2960 CZ ARG B 83 -8.070 18.076 38.882 1.00 42.38 C ATOM 2961 NH1 ARG B 83 -8.946 17.077 38.940 1.00 43.22 N ATOM 2962 NH2 ARG B 83 -6.925 17.931 38.216 1.00 42.71 N ATOM 2963 HA ARG B 83 -10.188 23.459 41.176 1.00 0.00 H ATOM 2964 HB2 ARG B 83 -10.526 20.768 42.529 1.00 0.00 H ATOM 2965 HB3 ARG B 83 -11.514 21.331 41.162 1.00 0.00 H ATOM 2966 HG2 ARG B 83 -9.525 21.628 39.803 1.00 0.00 H ATOM 2967 HG3 ARG B 83 -8.491 21.173 41.177 1.00 0.00 H ATOM 2968 HD2 ARG B 83 -10.408 19.388 39.647 1.00 0.00 H ATOM 2969 HD3 ARG B 83 -9.577 18.906 41.145 1.00 0.00 H ATOM 2970 HE ARG B 83 -7.591 19.973 39.420 1.00 0.00 H ATOM 2971 HH12 ARG B 83 -8.743 16.178 38.457 1.00 0.00 H ATOM 2972 HH11 ARG B 83 -9.834 17.194 39.468 1.00 0.00 H ATOM 2973 HH22 ARG B 83 -6.715 17.035 37.731 1.00 0.00 H ATOM 2974 HH21 ARG B 83 -6.241 18.714 38.181 1.00 0.00 H ATOM 2975 H ARG B 83 -8.225 23.317 42.409 1.00 0.00 H ATOM 2976 N TRP B 84 -11.397 24.764 43.068 1.00 37.51 N ATOM 2977 CA TRP B 84 -12.229 25.479 44.052 1.00 38.71 C ATOM 2978 C TRP B 84 -13.269 26.389 43.398 1.00 39.14 C ATOM 2979 O TRP B 84 -13.011 26.971 42.346 1.00 38.78 O ATOM 2980 CB TRP B 84 -11.284 26.307 44.929 1.00 38.24 C ATOM 2981 CG TRP B 84 -11.922 27.139 45.992 1.00 38.63 C ATOM 2982 CD1 TRP B 84 -12.248 26.747 47.287 1.00 39.06 C ATOM 2983 CD2 TRP B 84 -12.323 28.569 45.911 1.00 39.19 C ATOM 2984 NE1 TRP B 84 -12.808 27.812 47.987 1.00 39.77 N ATOM 2985 CE2 TRP B 84 -12.888 28.913 47.232 1.00 39.64 C ATOM 2986 CE3 TRP B 84 -12.278 29.551 44.924 1.00 39.02 C ATOM 2987 CZ2 TRP B 84 -13.373 30.183 47.521 1.00 40.42 C ATOM 2988 CZ3 TRP B 84 -12.767 30.830 45.236 1.00 39.99 C ATOM 2989 CH2 TRP B 84 -13.294 31.135 46.499 1.00 40.32 C ATOM 2990 HA TRP B 84 -12.790 24.751 44.638 1.00 0.00 H ATOM 2991 HB2 TRP B 84 -10.594 25.618 45.416 1.00 0.00 H ATOM 2992 HB3 TRP B 84 -10.725 26.976 44.275 1.00 0.00 H ATOM 2993 HE1 TRP B 84 -13.125 27.758 48.976 1.00 0.00 H ATOM 2994 HD1 TRP B 84 -12.088 25.749 47.695 1.00 0.00 H ATOM 2995 HZ2 TRP B 84 -13.794 30.425 48.497 1.00 0.00 H ATOM 2996 HH2 TRP B 84 -13.654 32.146 46.691 1.00 0.00 H ATOM 2997 HZ3 TRP B 84 -12.736 31.609 44.474 1.00 0.00 H ATOM 2998 HE3 TRP B 84 -11.874 29.332 43.936 1.00 0.00 H ATOM 2999 H TRP B 84 -10.677 25.307 42.550 1.00 0.00 H ATOM 3000 N VAL B 85 -14.459 26.471 43.982 1.00 39.91 N ATOM 3001 CA VAL B 85 -15.502 27.318 43.464 1.00 40.81 C ATOM 3002 C VAL B 85 -15.906 28.297 44.586 1.00 41.97 C ATOM 3003 O VAL B 85 -16.180 27.882 45.701 1.00 41.60 O ATOM 3004 CB VAL B 85 -16.757 26.522 43.091 1.00 42.39 C ATOM 3005 CG1 VAL B 85 -17.840 27.464 42.560 1.00 43.60 C ATOM 3006 CG2 VAL B 85 -16.450 25.406 42.089 1.00 42.75 C ATOM 3007 HA VAL B 85 -15.125 27.818 42.572 1.00 0.00 H ATOM 3008 HB VAL B 85 -17.129 26.038 43.994 1.00 0.00 H ATOM 3009 HG11 VAL B 85 -18.094 28.193 43.329 1.00 0.00 H ATOM 3010 HG12 VAL B 85 -17.468 27.981 41.676 1.00 0.00 H ATOM 3011 HG13 VAL B 85 -18.726 26.886 42.299 1.00 0.00 H ATOM 3012 HG21 VAL B 85 -16.038 25.840 41.178 1.00 0.00 H ATOM 3013 HG22 VAL B 85 -15.726 24.718 42.525 1.00 0.00 H ATOM 3014 HG23 VAL B 85 -17.368 24.868 41.853 1.00 0.00 H ATOM 3015 H VAL B 85 -14.643 25.908 44.837 1.00 0.00 H ATOM 3016 N ALA B 86 -15.967 29.587 44.262 1.00 42.71 N ATOM 3017 CA ALA B 86 -16.403 30.626 45.175 1.00 44.04 C ATOM 3018 C ALA B 86 -17.861 30.482 45.622 1.00 46.15 C ATOM 3019 O ALA B 86 -18.689 29.963 44.868 1.00 47.05 O ATOM 3020 CB ALA B 86 -16.211 31.981 44.511 1.00 44.29 C ATOM 3021 HA ALA B 86 -15.794 30.533 46.074 1.00 0.00 H ATOM 3022 HB1 ALA B 86 -15.157 32.120 44.271 1.00 0.00 H ATOM 3023 HB2 ALA B 86 -16.802 32.023 43.596 1.00 0.00 H ATOM 3024 HB3 ALA B 86 -16.537 32.767 45.192 1.00 0.00 H ATOM 3025 H ALA B 86 -15.686 29.865 43.300 1.00 0.00 H ATOM 3026 N PRO B 87 -18.185 30.997 46.831 1.00 47.63 N ATOM 3027 CA PRO B 87 -19.591 31.117 47.217 1.00 50.27 C ATOM 3028 C PRO B 87 -20.354 31.931 46.163 1.00 52.21 C ATOM 3029 O PRO B 87 -19.762 32.732 45.429 1.00 51.38 O ATOM 3030 CB PRO B 87 -19.536 31.925 48.535 1.00 51.07 C ATOM 3031 CG PRO B 87 -18.108 31.873 49.011 1.00 48.40 C ATOM 3032 CD PRO B 87 -17.298 31.747 47.751 1.00 46.94 C ATOM 3033 HA PRO B 87 -20.088 30.152 47.315 1.00 0.00 H ATOM 3034 HD3 PRO B 87 -17.058 32.729 47.344 1.00 0.00 H ATOM 3035 HD2 PRO B 87 -16.376 31.196 47.936 1.00 0.00 H ATOM 3036 HG3 PRO B 87 -17.949 31.012 49.660 1.00 0.00 H ATOM 3037 HG2 PRO B 87 -17.847 32.785 49.548 1.00 0.00 H ATOM 3038 HB2 PRO B 87 -19.836 32.958 48.357 1.00 0.00 H ATOM 3039 HB3 PRO B 87 -20.197 31.479 49.278 1.00 0.00 H ATOM 3040 N ASN B 88 -21.654 31.712 46.075 1.00 55.16 N ATOM 3041 CA ASN B 88 -22.520 32.615 45.346 1.00 57.95 C ATOM 3042 C ASN B 88 -22.050 34.055 45.223 1.00 57.53 C ATOM 3043 O ASN B 88 -21.518 34.626 46.185 1.00 56.61 O ATOM 3044 CB ASN B 88 -23.862 32.700 46.058 1.00 61.95 C ATOM 3045 CG ASN B 88 -24.946 32.103 45.246 1.00 64.77 C ATOM 3046 OD1 ASN B 88 -25.729 32.821 44.609 1.00 68.17 O ATOM 3047 ND2 ASN B 88 -24.948 30.779 45.174 1.00 64.32 N ATOM 3048 HA ASN B 88 -22.549 32.188 44.344 1.00 0.00 H ATOM 3049 HB2 ASN B 88 -23.795 32.167 47.006 1.00 0.00 H ATOM 3050 HB3 ASN B 88 -24.097 33.747 46.248 1.00 0.00 H ATOM 3051 HD22 ASN B 88 -24.266 30.227 45.732 1.00 0.00 H ATOM 3052 HD21 ASN B 88 -25.631 30.293 44.559 1.00 0.00 H ATOM 3053 H ASN B 88 -22.063 30.875 46.538 1.00 0.00 H ATOM 3054 N ASN B 89 -22.296 34.644 44.055 1.00 57.68 N ATOM 3055 CA ASN B 89 -22.231 36.099 43.897 1.00 58.72 C ATOM 3056 C ASN B 89 -20.871 36.669 44.223 1.00 56.24 C ATOM 3057 O ASN B 89 -20.727 37.866 44.333 1.00 57.84 O ATOM 3058 CB ASN B 89 -23.298 36.777 44.766 1.00 61.55 C ATOM 3059 CG ASN B 89 -24.691 36.226 44.513 1.00 64.79 C ATOM 3060 OD1 ASN B 89 -24.982 35.688 43.439 1.00 65.67 O ATOM 3061 ND2 ASN B 89 -25.560 36.346 45.503 1.00 66.88 N ATOM 3062 HA ASN B 89 -22.421 36.305 42.844 1.00 0.00 H ATOM 3063 HB2 ASN B 89 -23.045 36.622 45.815 1.00 0.00 H ATOM 3064 HB3 ASN B 89 -23.299 37.845 44.548 1.00 0.00 H ATOM 3065 HD22 ASN B 89 -25.276 36.806 46.392 1.00 0.00 H ATOM 3066 HD21 ASN B 89 -26.528 35.981 45.393 1.00 0.00 H ATOM 3067 H ASN B 89 -22.541 34.056 43.233 1.00 0.00 H ATOM 3068 N VAL B 90 -19.885 35.806 44.420 1.00 52.45 N ATOM 3069 CA VAL B 90 -18.521 36.263 44.615 1.00 50.59 C ATOM 3070 C VAL B 90 -17.816 36.288 43.232 1.00 49.78 C ATOM 3071 O VAL B 90 -17.845 35.291 42.503 1.00 48.81 O ATOM 3072 CB VAL B 90 -17.789 35.394 45.680 1.00 48.13 C ATOM 3073 CG1 VAL B 90 -16.327 35.756 45.775 1.00 46.34 C ATOM 3074 CG2 VAL B 90 -18.413 35.599 47.061 1.00 48.61 C ATOM 3075 HA VAL B 90 -18.503 37.275 45.018 1.00 0.00 H ATOM 3076 HB VAL B 90 -17.890 34.355 45.366 1.00 0.00 H ATOM 3077 HG11 VAL B 90 -15.850 35.594 44.808 1.00 0.00 H ATOM 3078 HG12 VAL B 90 -16.231 36.804 46.058 1.00 0.00 H ATOM 3079 HG13 VAL B 90 -15.847 35.130 46.528 1.00 0.00 H ATOM 3080 HG21 VAL B 90 -18.331 36.649 47.343 1.00 0.00 H ATOM 3081 HG22 VAL B 90 -19.464 35.311 47.030 1.00 0.00 H ATOM 3082 HG23 VAL B 90 -17.887 34.983 47.791 1.00 0.00 H ATOM 3083 H VAL B 90 -20.091 34.787 44.435 1.00 0.00 H ATOM 3084 N GLN B 91 -17.251 37.436 42.848 1.00 50.16 N ATOM 3085 CA GLN B 91 -16.565 37.561 41.555 1.00 50.21 C ATOM 3086 C GLN B 91 -15.717 38.809 41.418 1.00 49.88 C ATOM 3087 O GLN B 91 -15.795 39.724 42.248 1.00 50.84 O ATOM 3088 CB GLN B 91 -17.550 37.495 40.410 1.00 52.57 C ATOM 3089 CG GLN B 91 -18.390 38.736 40.280 1.00 56.83 C ATOM 3090 CD GLN B 91 -19.688 38.431 39.580 1.00 60.01 C ATOM 3091 OE1 GLN B 91 -20.645 37.936 40.182 1.00 61.83 O ATOM 3092 NE2 GLN B 91 -19.728 38.710 38.295 1.00 62.58 N ATOM 3093 HA GLN B 91 -15.882 36.712 41.515 1.00 0.00 H ATOM 3094 HB2 GLN B 91 -16.995 37.353 39.483 1.00 0.00 H ATOM 3095 HB3 GLN B 91 -18.211 36.644 40.570 1.00 0.00 H ATOM 3096 HG2 GLN B 91 -18.603 39.130 41.274 1.00 0.00 H ATOM 3097 HG3 GLN B 91 -17.840 39.482 39.706 1.00 0.00 H ATOM 3098 HE22 GLN B 91 -18.898 39.127 37.827 1.00 0.00 H ATOM 3099 HE21 GLN B 91 -20.590 38.514 37.747 1.00 0.00 H ATOM 3100 H GLN B 91 -17.298 38.261 43.480 1.00 0.00 H ATOM 3101 N GLY B 92 -14.920 38.841 40.352 1.00 48.48 N ATOM 3102 CA GLY B 92 -14.012 39.941 40.073 1.00 48.50 C ATOM 3103 C GLY B 92 -12.545 39.583 40.202 1.00 46.92 C ATOM 3104 O GLY B 92 -12.165 38.417 40.316 1.00 45.20 O ATOM 3105 HA3 GLY B 92 -14.230 40.750 40.771 1.00 0.00 H ATOM 3106 HA2 GLY B 92 -14.192 40.284 39.054 1.00 0.00 H ATOM 3107 H GLY B 92 -14.949 38.041 39.688 1.00 0.00 H ATOM 3108 N ALA B 93 -11.713 40.608 40.206 1.00 48.01 N ATOM 3109 CA ALA B 93 -10.263 40.458 40.242 1.00 47.38 C ATOM 3110 C ALA B 93 -9.824 39.808 41.566 1.00 45.82 C ATOM 3111 O ALA B 93 -10.319 40.170 42.626 1.00 47.44 O ATOM 3112 CB ALA B 93 -9.631 41.855 40.069 1.00 49.14 C ATOM 3113 HA ALA B 93 -9.929 39.805 39.436 1.00 0.00 H ATOM 3114 HB1 ALA B 93 -9.941 42.277 39.113 1.00 0.00 H ATOM 3115 HB2 ALA B 93 -9.962 42.505 40.879 1.00 0.00 H ATOM 3116 HB3 ALA B 93 -8.545 41.766 40.093 1.00 0.00 H ATOM 3117 H ALA B 93 -12.111 41.569 40.182 1.00 0.00 H ATOM 3118 N ILE B 94 -8.924 38.842 41.520 1.00 43.70 N ATOM 3119 CA ILE B 94 -8.384 38.338 42.747 1.00 41.75 C ATOM 3120 C ILE B 94 -7.217 39.149 43.225 1.00 41.78 C ATOM 3121 O ILE B 94 -6.267 39.364 42.491 1.00 42.17 O ATOM 3122 CB ILE B 94 -7.915 36.870 42.644 1.00 40.04 C ATOM 3123 CG1 ILE B 94 -9.037 35.995 42.091 1.00 39.80 C ATOM 3124 CG2 ILE B 94 -7.435 36.417 44.026 1.00 38.52 C ATOM 3125 CD1 ILE B 94 -8.608 34.554 41.836 1.00 39.44 C ATOM 3126 HA ILE B 94 -9.210 38.406 43.455 1.00 0.00 H ATOM 3127 HB ILE B 94 -7.082 36.776 41.947 1.00 0.00 H ATOM 3128 HG12 ILE B 94 -9.858 35.990 42.808 1.00 0.00 H ATOM 3129 HG13 ILE B 94 -9.380 36.426 41.150 1.00 0.00 H ATOM 3130 HD11 ILE B 94 -7.794 34.541 41.112 1.00 0.00 H ATOM 3131 HD12 ILE B 94 -8.271 34.106 42.771 1.00 0.00 H ATOM 3132 HD13 ILE B 94 -9.453 33.989 41.444 1.00 0.00 H ATOM 3133 HG21 ILE B 94 -6.609 37.051 44.348 1.00 0.00 H ATOM 3134 HG22 ILE B 94 -8.256 36.497 44.739 1.00 0.00 H ATOM 3135 HG23 ILE B 94 -7.100 35.381 43.971 1.00 0.00 H ATOM 3136 H ILE B 94 -8.612 38.454 40.607 1.00 0.00 H ATOM 3137 N THR B 95 -7.294 39.587 44.476 1.00 42.45 N ATOM 3138 CA THR B 95 -6.198 40.260 45.142 1.00 42.93 C ATOM 3139 C THR B 95 -5.714 39.358 46.274 1.00 41.81 C ATOM 3140 O THR B 95 -6.515 38.829 47.043 1.00 41.57 O ATOM 3141 CB THR B 95 -6.650 41.639 45.657 1.00 44.72 C ATOM 3142 OG1 THR B 95 -7.231 42.360 44.580 1.00 46.02 O ATOM 3143 CG2 THR B 95 -5.500 42.428 46.217 1.00 44.66 C ATOM 3144 HA THR B 95 -5.375 40.440 44.450 1.00 0.00 H ATOM 3145 HB THR B 95 -7.373 41.486 46.458 1.00 0.00 H ATOM 3146 HG1 THR B 95 -8.010 41.859 44.231 1.00 0.00 H ATOM 3147 HG23 THR B 95 -5.052 41.877 47.044 1.00 0.00 H ATOM 3148 HG21 THR B 95 -4.755 42.585 45.437 1.00 0.00 H ATOM 3149 HG22 THR B 95 -5.862 43.392 46.575 1.00 0.00 H ATOM 3150 H THR B 95 -8.180 39.440 45.001 1.00 0.00 H ATOM 3151 N LEU B 96 -4.403 39.143 46.335 1.00 41.48 N ATOM 3152 CA LEU B 96 -3.810 38.323 47.359 1.00 40.49 C ATOM 3153 C LEU B 96 -3.250 39.201 48.467 1.00 41.30 C ATOM 3154 O LEU B 96 -2.595 40.214 48.205 1.00 41.84 O ATOM 3155 CB LEU B 96 -2.723 37.411 46.770 1.00 39.67 C ATOM 3156 CG LEU B 96 -3.111 36.526 45.607 1.00 39.29 C ATOM 3157 CD1 LEU B 96 -1.857 36.026 44.918 1.00 39.32 C ATOM 3158 CD2 LEU B 96 -3.948 35.359 46.111 1.00 38.52 C ATOM 3159 HA LEU B 96 -4.581 37.680 47.784 1.00 0.00 H ATOM 3160 HB2 LEU B 96 -1.905 38.050 46.436 1.00 0.00 H ATOM 3161 HB3 LEU B 96 -2.371 36.762 47.572 1.00 0.00 H ATOM 3162 HG LEU B 96 -3.704 37.094 44.890 1.00 0.00 H ATOM 3163 HD21 LEU B 96 -3.367 34.780 46.829 1.00 0.00 H ATOM 3164 HD22 LEU B 96 -4.848 35.741 46.593 1.00 0.00 H ATOM 3165 HD23 LEU B 96 -4.226 34.723 45.270 1.00 0.00 H ATOM 3166 HD11 LEU B 96 -1.280 36.876 44.554 1.00 0.00 H ATOM 3167 HD12 LEU B 96 -1.257 35.456 45.627 1.00 0.00 H ATOM 3168 HD13 LEU B 96 -2.135 35.388 44.079 1.00 0.00 H ATOM 3169 H LEU B 96 -3.787 39.581 45.621 1.00 0.00 H ATOM 3170 N ILE B 97 -3.510 38.818 49.717 1.00 40.81 N ATOM 3171 CA ILE B 97 -3.108 39.685 50.859 1.00 41.63 C ATOM 3172 C ILE B 97 -2.557 38.813 51.984 1.00 41.28 C ATOM 3173 O ILE B 97 -3.107 37.713 52.262 1.00 40.14 O ATOM 3174 CB ILE B 97 -4.271 40.565 51.397 1.00 42.28 C ATOM 3175 CG1 ILE B 97 -5.218 40.955 50.263 1.00 42.70 C ATOM 3176 CG2 ILE B 97 -3.740 41.826 52.067 1.00 43.64 C ATOM 3177 CD1 ILE B 97 -6.613 41.256 50.744 1.00 43.85 C ATOM 3178 HA ILE B 97 -2.343 40.369 50.491 1.00 0.00 H ATOM 3179 HB ILE B 97 -4.814 39.976 52.136 1.00 0.00 H ATOM 3180 HG12 ILE B 97 -4.822 41.841 49.767 1.00 0.00 H ATOM 3181 HG13 ILE B 97 -5.265 40.132 49.550 1.00 0.00 H ATOM 3182 HD11 ILE B 97 -7.025 40.374 51.234 1.00 0.00 H ATOM 3183 HD12 ILE B 97 -6.581 42.085 51.451 1.00 0.00 H ATOM 3184 HD13 ILE B 97 -7.239 41.527 49.894 1.00 0.00 H ATOM 3185 HG21 ILE B 97 -3.097 41.549 52.902 1.00 0.00 H ATOM 3186 HG22 ILE B 97 -3.168 42.407 51.343 1.00 0.00 H ATOM 3187 HG23 ILE B 97 -4.577 42.421 52.433 1.00 0.00 H ATOM 3188 H ILE B 97 -3.993 37.914 49.895 1.00 0.00 H ATOM 3189 N TYR B 98 -1.463 39.290 52.593 1.00 41.75 N ATOM 3190 CA TYR B 98 -0.828 38.671 53.770 1.00 41.23 C ATOM 3191 C TYR B 98 -1.669 39.102 54.971 1.00 41.91 C ATOM 3192 O TYR B 98 -1.946 40.320 55.140 1.00 43.83 O ATOM 3193 CB TYR B 98 0.605 39.226 53.909 1.00 41.05 C ATOM 3194 CG TYR B 98 1.419 38.563 54.975 1.00 40.67 C ATOM 3195 CD1 TYR B 98 1.875 37.222 54.818 1.00 39.47 C ATOM 3196 CD2 TYR B 98 1.697 39.231 56.169 1.00 41.30 C ATOM 3197 CE1 TYR B 98 2.633 36.609 55.790 1.00 39.48 C ATOM 3198 CE2 TYR B 98 2.445 38.624 57.175 1.00 41.26 C ATOM 3199 CZ TYR B 98 2.898 37.295 56.984 1.00 40.51 C ATOM 3200 OH TYR B 98 3.640 36.637 57.953 1.00 40.49 O ATOM 3201 HA TYR B 98 -0.774 37.585 53.691 1.00 0.00 H ATOM 3202 HB3 TYR B 98 0.539 40.289 54.140 1.00 0.00 H ATOM 3203 HB2 TYR B 98 1.117 39.094 52.956 1.00 0.00 H ATOM 3204 HD2 TYR B 98 1.323 40.244 56.316 1.00 0.00 H ATOM 3205 HE2 TYR B 98 2.678 39.162 58.094 1.00 0.00 H ATOM 3206 HE1 TYR B 98 3.022 35.603 55.633 1.00 0.00 H ATOM 3207 HD1 TYR B 98 1.619 36.672 53.912 1.00 0.00 H ATOM 3208 HH TYR B 98 3.860 35.725 57.636 1.00 0.00 H ATOM 3209 H TYR B 98 -1.033 40.156 52.209 1.00 0.00 H ATOM 3210 N ASN B 99 -2.096 38.134 55.778 1.00 41.13 N ATOM 3211 CA ASN B 99 -3.001 38.376 56.918 1.00 41.71 C ATOM 3212 C ASN B 99 -2.299 38.972 58.142 1.00 42.82 C ATOM 3213 O ASN B 99 -1.611 38.257 58.869 1.00 43.47 O ATOM 3214 CB ASN B 99 -3.699 37.071 57.324 1.00 40.33 C ATOM 3215 CG ASN B 99 -4.922 37.290 58.160 1.00 41.49 C ATOM 3216 OD1 ASN B 99 -5.392 38.429 58.292 1.00 42.67 O ATOM 3217 ND2 ASN B 99 -5.454 36.201 58.760 1.00 40.70 N ATOM 3218 HA ASN B 99 -3.728 39.113 56.575 1.00 0.00 H ATOM 3219 HB2 ASN B 99 -3.989 36.537 56.419 1.00 0.00 H ATOM 3220 HB3 ASN B 99 -2.995 36.464 57.893 1.00 0.00 H ATOM 3221 HD22 ASN B 99 -5.022 35.266 58.618 1.00 0.00 H ATOM 3222 HD21 ASN B 99 -6.295 36.299 59.364 1.00 0.00 H ATOM 3223 H ASN B 99 -1.777 37.161 55.597 1.00 0.00 H ATOM 3224 N ASP B 100 -2.463 40.271 58.369 1.00 42.91 N ATOM 3225 CA ASP B 100 -1.936 40.898 59.582 1.00 44.60 C ATOM 3226 C ASP B 100 -2.983 41.930 60.033 1.00 45.96 C ATOM 3227 O ASP B 100 -4.060 42.010 59.396 1.00 45.89 O ATOM 3228 CB ASP B 100 -0.559 41.529 59.310 1.00 44.91 C ATOM 3229 CG ASP B 100 0.212 41.890 60.598 1.00 46.24 C ATOM 3230 OD1 ASP B 100 -0.339 41.751 61.731 1.00 45.91 O ATOM 3231 OD2 ASP B 100 1.403 42.324 60.466 1.00 46.76 O ATOM 3232 HA ASP B 100 -1.773 40.170 60.377 1.00 0.00 H ATOM 3233 HB2 ASP B 100 0.039 40.822 58.735 1.00 0.00 H ATOM 3234 HB3 ASP B 100 -0.704 42.438 58.727 1.00 0.00 H ATOM 3235 H ASP B 100 -2.974 40.851 57.674 1.00 0.00 H ATOM 3236 N VAL B 101 -2.683 42.683 61.108 1.00 46.91 N ATOM 3237 CA VAL B 101 -3.540 43.789 61.642 1.00 48.29 C ATOM 3238 C VAL B 101 -3.422 45.197 60.899 1.00 49.54 C ATOM 3239 O VAL B 101 -2.313 45.786 60.722 1.00 50.08 O ATOM 3240 CB VAL B 101 -3.243 44.066 63.153 1.00 49.91 C ATOM 3241 CG1 VAL B 101 -4.231 45.094 63.781 1.00 51.10 C ATOM 3242 CG2 VAL B 101 -3.167 42.798 63.973 1.00 46.69 C ATOM 3243 HA VAL B 101 -4.545 43.404 61.469 1.00 0.00 H ATOM 3244 HB VAL B 101 -2.253 44.521 63.179 1.00 0.00 H ATOM 3245 HG11 VAL B 101 -4.157 46.041 63.246 1.00 0.00 H ATOM 3246 HG12 VAL B 101 -5.249 44.711 63.705 1.00 0.00 H ATOM 3247 HG13 VAL B 101 -3.977 45.247 64.830 1.00 0.00 H ATOM 3248 HG21 VAL B 101 -4.118 42.268 63.910 1.00 0.00 H ATOM 3249 HG22 VAL B 101 -2.370 42.164 63.586 1.00 0.00 H ATOM 3250 HG23 VAL B 101 -2.959 43.051 65.013 1.00 0.00 H ATOM 3251 H VAL B 101 -1.791 42.482 61.604 1.00 0.00 H ATOM 3252 N PRO B 102 -4.571 45.723 60.445 1.00 49.79 N ATOM 3253 CA PRO B 102 -4.456 46.951 59.649 1.00 51.68 C ATOM 3254 C PRO B 102 -3.535 47.983 60.330 1.00 53.66 C ATOM 3255 O PRO B 102 -3.631 48.235 61.518 1.00 54.26 O ATOM 3256 CB PRO B 102 -5.898 47.442 59.604 1.00 53.32 C ATOM 3257 CG PRO B 102 -6.664 46.141 59.494 1.00 51.21 C ATOM 3258 CD PRO B 102 -5.943 45.189 60.403 1.00 49.70 C ATOM 3259 HA PRO B 102 -4.016 46.791 58.665 1.00 0.00 H ATOM 3260 HD3 PRO B 102 -6.390 45.185 61.397 1.00 0.00 H ATOM 3261 HD2 PRO B 102 -5.955 44.178 59.997 1.00 0.00 H ATOM 3262 HG3 PRO B 102 -6.652 45.775 58.468 1.00 0.00 H ATOM 3263 HG2 PRO B 102 -7.696 46.275 59.819 1.00 0.00 H ATOM 3264 HB2 PRO B 102 -6.162 47.983 60.513 1.00 0.00 H ATOM 3265 HB3 PRO B 102 -6.073 48.081 58.738 1.00 0.00 H ATOM 3266 N GLY B 103 -2.594 48.525 59.581 1.00 54.34 N ATOM 3267 CA GLY B 103 -1.606 49.404 60.168 1.00 55.98 C ATOM 3268 C GLY B 103 -0.328 48.769 60.663 1.00 55.10 C ATOM 3269 O GLY B 103 0.629 49.464 60.945 1.00 57.13 O ATOM 3270 HA3 GLY B 103 -2.074 49.905 61.016 1.00 0.00 H ATOM 3271 HA2 GLY B 103 -1.335 50.144 59.415 1.00 0.00 H ATOM 3272 H GLY B 103 -2.562 48.319 58.562 1.00 0.00 H ATOM 3273 N THR B 104 -0.287 47.452 60.790 1.00 54.40 N ATOM 3274 CA THR B 104 0.888 46.821 61.387 1.00 53.49 C ATOM 3275 C THR B 104 1.855 46.246 60.376 1.00 50.84 C ATOM 3276 O THR B 104 2.898 45.684 60.755 1.00 51.11 O ATOM 3277 CB THR B 104 0.512 45.798 62.480 1.00 52.52 C ATOM 3278 OG1 THR B 104 -0.319 44.755 61.956 1.00 51.44 O ATOM 3279 CG2 THR B 104 -0.254 46.517 63.532 1.00 55.27 C ATOM 3280 HA THR B 104 1.429 47.631 61.876 1.00 0.00 H ATOM 3281 HB THR B 104 1.425 45.350 62.872 1.00 0.00 H ATOM 3282 HG1 THR B 104 -1.152 45.149 61.594 1.00 0.00 H ATOM 3283 HG23 THR B 104 0.361 47.317 63.945 1.00 0.00 H ATOM 3284 HG21 THR B 104 -1.158 46.941 63.095 1.00 0.00 H ATOM 3285 HG22 THR B 104 -0.524 45.819 64.324 1.00 0.00 H ATOM 3286 H THR B 104 -1.086 46.870 60.467 1.00 0.00 H ATOM 3287 N TYR B 105 1.556 46.454 59.100 1.00 50.86 N ATOM 3288 CA TYR B 105 2.271 45.781 58.016 1.00 49.42 C ATOM 3289 C TYR B 105 3.723 46.196 57.832 1.00 50.29 C ATOM 3290 O TYR B 105 4.508 45.507 57.184 1.00 49.18 O ATOM 3291 CB TYR B 105 1.529 46.029 56.722 1.00 49.07 C ATOM 3292 CG TYR B 105 0.352 45.130 56.552 1.00 47.87 C ATOM 3293 CD1 TYR B 105 -0.835 45.354 57.233 1.00 47.91 C ATOM 3294 CD2 TYR B 105 0.421 44.038 55.668 1.00 45.99 C ATOM 3295 CE1 TYR B 105 -1.924 44.512 57.044 1.00 47.67 C ATOM 3296 CE2 TYR B 105 -0.661 43.234 55.468 1.00 45.04 C ATOM 3297 CZ TYR B 105 -1.822 43.459 56.161 1.00 45.02 C ATOM 3298 OH TYR B 105 -2.885 42.629 55.952 1.00 44.56 O ATOM 3299 HA TYR B 105 2.301 44.727 58.293 1.00 0.00 H ATOM 3300 HB3 TYR B 105 2.215 45.867 55.890 1.00 0.00 H ATOM 3301 HB2 TYR B 105 1.183 47.063 56.711 1.00 0.00 H ATOM 3302 HD2 TYR B 105 1.350 43.833 55.137 1.00 0.00 H ATOM 3303 HE2 TYR B 105 -0.603 42.411 54.756 1.00 0.00 H ATOM 3304 HE1 TYR B 105 -2.852 44.683 57.590 1.00 0.00 H ATOM 3305 HD1 TYR B 105 -0.914 46.196 57.921 1.00 0.00 H ATOM 3306 HH TYR B 105 -2.629 41.702 56.186 1.00 0.00 H ATOM 3307 H TYR B 105 0.790 47.116 58.863 1.00 0.00 H ATOM 3308 N GLY B 106 4.066 47.351 58.376 1.00 52.02 N ATOM 3309 CA GLY B 106 5.351 47.903 58.086 1.00 53.34 C ATOM 3310 C GLY B 106 6.556 47.179 58.639 1.00 52.67 C ATOM 3311 O GLY B 106 7.658 47.367 58.142 1.00 53.85 O ATOM 3312 HA3 GLY B 106 5.369 48.918 58.482 1.00 0.00 H ATOM 3313 HA2 GLY B 106 5.457 47.935 57.002 1.00 0.00 H ATOM 3314 H GLY B 106 3.408 47.852 59.007 1.00 0.00 H ATOM 3315 N ASN B 107 6.390 46.412 59.704 1.00 51.64 N ATOM 3316 CA ASN B 107 7.519 45.637 60.213 1.00 51.42 C ATOM 3317 C ASN B 107 7.613 44.250 59.585 1.00 49.30 C ATOM 3318 O ASN B 107 8.498 43.477 59.964 1.00 49.02 O ATOM 3319 CB ASN B 107 7.533 45.507 61.756 1.00 52.42 C ATOM 3320 CG ASN B 107 6.374 44.674 62.313 1.00 50.47 C ATOM 3321 OD1 ASN B 107 5.335 44.589 61.629 1.00 49.42 O ATOM 3322 ND2 ASN B 107 6.519 44.323 63.587 1.00 51.44 N ATOM 3323 HA ASN B 107 8.395 46.214 59.918 1.00 0.00 H ATOM 3324 HB2 ASN B 107 8.470 45.036 62.054 1.00 0.00 H ATOM 3325 HB3 ASN B 107 7.477 46.507 62.187 1.00 0.00 H ATOM 3326 HD22 ASN B 107 7.439 44.440 64.057 1.00 0.00 H ATOM 3327 HD21 ASN B 107 5.712 43.931 64.114 1.00 0.00 H ATOM 3328 H ASN B 107 5.464 46.361 60.175 1.00 0.00 H ATOM 3329 N ASN B 108 6.682 43.930 58.682 1.00 47.55 N ATOM 3330 CA ASN B 108 6.621 42.586 58.018 1.00 45.88 C ATOM 3331 C ASN B 108 7.741 42.279 57.028 1.00 45.92 C ATOM 3332 O ASN B 108 8.358 43.181 56.497 1.00 46.62 O ATOM 3333 CB ASN B 108 5.302 42.406 57.289 1.00 44.61 C ATOM 3334 CG ASN B 108 4.129 42.521 58.214 1.00 44.35 C ATOM 3335 OD1 ASN B 108 4.301 42.883 59.376 1.00 45.12 O ATOM 3336 ND2 ASN B 108 2.939 42.237 57.719 1.00 43.16 N ATOM 3337 HA ASN B 108 6.735 41.889 58.848 1.00 0.00 H ATOM 3338 HB2 ASN B 108 5.219 43.172 56.518 1.00 0.00 H ATOM 3339 HB3 ASN B 108 5.288 41.420 56.824 1.00 0.00 H ATOM 3340 HD22 ASN B 108 2.847 41.935 56.728 1.00 0.00 H ATOM 3341 HD21 ASN B 108 2.094 42.316 58.320 1.00 0.00 H ATOM 3342 H ASN B 108 5.969 44.643 58.428 1.00 0.00 H ATOM 3343 N SER B 109 8.009 41.005 56.778 1.00 44.26 N ATOM 3344 CA SER B 109 9.044 40.676 55.807 1.00 44.97 C ATOM 3345 C SER B 109 8.759 39.355 55.136 1.00 43.77 C ATOM 3346 O SER B 109 7.821 38.670 55.530 1.00 42.19 O ATOM 3347 CB SER B 109 10.450 40.664 56.423 1.00 46.30 C ATOM 3348 OG SER B 109 10.530 39.840 57.560 1.00 45.98 O ATOM 3349 HA SER B 109 9.024 41.467 55.057 1.00 0.00 H ATOM 3350 HB2 SER B 109 10.716 41.682 56.708 1.00 0.00 H ATOM 3351 HB3 SER B 109 11.156 40.301 55.677 1.00 0.00 H ATOM 3352 HG SER B 109 11.452 39.865 57.920 1.00 0.00 H ATOM 3353 H SER B 109 7.487 40.251 57.268 1.00 0.00 H ATOM 3354 N GLY B 110 9.546 39.028 54.108 1.00 44.32 N ATOM 3355 CA GLY B 110 9.365 37.771 53.327 1.00 43.38 C ATOM 3356 C GLY B 110 8.162 37.881 52.416 1.00 42.29 C ATOM 3357 O GLY B 110 7.458 38.914 52.395 1.00 42.57 O ATOM 3358 HA3 GLY B 110 9.219 36.939 54.015 1.00 0.00 H ATOM 3359 HA2 GLY B 110 10.256 37.591 52.725 1.00 0.00 H ATOM 3360 H GLY B 110 10.315 39.675 53.842 1.00 0.00 H ATOM 3361 N SER B 111 7.912 36.837 51.652 1.00 41.60 N ATOM 3362 CA SER B 111 6.846 36.864 50.657 1.00 40.91 C ATOM 3363 C SER B 111 6.414 35.471 50.324 1.00 40.21 C ATOM 3364 O SER B 111 7.173 34.503 50.546 1.00 40.68 O ATOM 3365 CB SER B 111 7.326 37.520 49.361 1.00 42.13 C ATOM 3366 OG SER B 111 8.587 37.020 48.985 1.00 43.38 O ATOM 3367 HA SER B 111 6.019 37.434 51.081 1.00 0.00 H ATOM 3368 HB2 SER B 111 7.399 38.597 49.511 1.00 0.00 H ATOM 3369 HB3 SER B 111 6.608 37.312 48.568 1.00 0.00 H ATOM 3370 HG SER B 111 8.877 37.457 48.146 1.00 0.00 H ATOM 3371 H SER B 111 8.486 35.977 51.761 1.00 0.00 H ATOM 3372 N PHE B 112 5.206 35.344 49.778 1.00 38.89 N ATOM 3373 CA PHE B 112 4.884 34.070 49.171 1.00 38.18 C ATOM 3374 C PHE B 112 4.926 34.090 47.663 1.00 38.53 C ATOM 3375 O PHE B 112 4.620 35.092 47.031 1.00 38.44 O ATOM 3376 CB PHE B 112 3.542 33.535 49.651 1.00 37.08 C ATOM 3377 CG PHE B 112 3.442 33.413 51.146 1.00 36.72 C ATOM 3378 CD1 PHE B 112 4.376 32.685 51.858 1.00 37.31 C ATOM 3379 CD2 PHE B 112 2.427 34.060 51.836 1.00 36.73 C ATOM 3380 CE1 PHE B 112 4.290 32.573 53.255 1.00 38.00 C ATOM 3381 CE2 PHE B 112 2.337 33.977 53.229 1.00 36.80 C ATOM 3382 CZ PHE B 112 3.271 33.236 53.934 1.00 37.17 C ATOM 3383 HA PHE B 112 5.672 33.393 49.502 1.00 0.00 H ATOM 3384 HB2 PHE B 112 2.759 34.210 49.307 1.00 0.00 H ATOM 3385 HB3 PHE B 112 3.388 32.549 49.213 1.00 0.00 H ATOM 3386 HD2 PHE B 112 1.689 34.642 51.284 1.00 0.00 H ATOM 3387 HE2 PHE B 112 1.536 34.493 53.758 1.00 0.00 H ATOM 3388 HZ PHE B 112 3.208 33.172 55.020 1.00 0.00 H ATOM 3389 HE1 PHE B 112 5.015 31.972 53.804 1.00 0.00 H ATOM 3390 HD1 PHE B 112 5.190 32.191 51.328 1.00 0.00 H ATOM 3391 H PHE B 112 4.522 36.128 49.787 1.00 0.00 H ATOM 3392 N SER B 113 5.294 32.940 47.103 1.00 38.67 N ATOM 3393 CA SER B 113 5.256 32.730 45.679 1.00 39.46 C ATOM 3394 C SER B 113 3.975 31.974 45.370 1.00 38.51 C ATOM 3395 O SER B 113 3.732 30.907 45.934 1.00 39.15 O ATOM 3396 CB SER B 113 6.464 31.915 45.265 1.00 40.59 C ATOM 3397 OG SER B 113 6.751 32.160 43.907 1.00 42.35 O ATOM 3398 HA SER B 113 5.277 33.674 45.135 1.00 0.00 H ATOM 3399 HB2 SER B 113 6.254 30.855 45.407 1.00 0.00 H ATOM 3400 HB3 SER B 113 7.321 32.199 45.875 1.00 0.00 H ATOM 3401 HG SER B 113 6.942 33.123 43.780 1.00 0.00 H ATOM 3402 H SER B 113 5.621 32.166 47.716 1.00 0.00 H ATOM 3403 N VAL B 114 3.165 32.500 44.464 1.00 38.29 N ATOM 3404 CA VAL B 114 1.802 31.999 44.276 1.00 37.44 C ATOM 3405 C VAL B 114 1.514 31.701 42.808 1.00 37.77 C ATOM 3406 O VAL B 114 1.874 32.466 41.933 1.00 39.01 O ATOM 3407 CB VAL B 114 0.745 33.011 44.766 1.00 36.85 C ATOM 3408 CG1 VAL B 114 -0.613 32.328 44.803 1.00 35.79 C ATOM 3409 CG2 VAL B 114 1.103 33.589 46.135 1.00 37.01 C ATOM 3410 HA VAL B 114 1.737 31.084 44.865 1.00 0.00 H ATOM 3411 HB VAL B 114 0.715 33.850 44.071 1.00 0.00 H ATOM 3412 HG11 VAL B 114 -0.871 31.981 43.802 1.00 0.00 H ATOM 3413 HG12 VAL B 114 -0.572 31.478 45.485 1.00 0.00 H ATOM 3414 HG13 VAL B 114 -1.366 33.037 45.148 1.00 0.00 H ATOM 3415 HG21 VAL B 114 1.167 32.781 46.864 1.00 0.00 H ATOM 3416 HG22 VAL B 114 2.064 34.100 46.072 1.00 0.00 H ATOM 3417 HG23 VAL B 114 0.333 34.296 46.442 1.00 0.00 H ATOM 3418 H VAL B 114 3.504 33.286 43.873 1.00 0.00 H ATOM 3419 N ASN B 115 0.869 30.575 42.552 1.00 37.69 N ATOM 3420 CA ASN B 115 0.339 30.274 41.229 1.00 37.68 C ATOM 3421 C ASN B 115 -1.150 30.167 41.311 1.00 36.87 C ATOM 3422 O ASN B 115 -1.677 29.646 42.270 1.00 36.63 O ATOM 3423 CB ASN B 115 0.884 28.969 40.739 1.00 38.39 C ATOM 3424 CG ASN B 115 2.294 29.089 40.244 1.00 39.67 C ATOM 3425 OD1 ASN B 115 2.549 29.500 39.098 1.00 40.46 O ATOM 3426 ND2 ASN B 115 3.230 28.713 41.100 1.00 40.04 N ATOM 3427 HA ASN B 115 0.628 31.070 40.543 1.00 0.00 H ATOM 3428 HB2 ASN B 115 0.860 28.250 41.558 1.00 0.00 H ATOM 3429 HB3 ASN B 115 0.256 28.611 39.924 1.00 0.00 H ATOM 3430 HD22 ASN B 115 2.963 28.377 42.047 1.00 0.00 H ATOM 3431 HD21 ASN B 115 4.232 28.754 40.826 1.00 0.00 H ATOM 3432 H ASN B 115 0.736 29.884 43.318 1.00 0.00 H ATOM 3433 N ILE B 116 -1.830 30.678 40.309 1.00 37.13 N ATOM 3434 CA ILE B 116 -3.273 30.589 40.245 1.00 37.01 C ATOM 3435 C ILE B 116 -3.589 30.247 38.794 1.00 38.45 C ATOM 3436 O ILE B 116 -3.050 30.872 37.882 1.00 40.08 O ATOM 3437 CB ILE B 116 -3.935 31.959 40.522 1.00 36.98 C ATOM 3438 CG1 ILE B 116 -3.588 32.495 41.926 1.00 36.17 C ATOM 3439 CG2 ILE B 116 -5.437 31.831 40.305 1.00 37.11 C ATOM 3440 CD1 ILE B 116 -4.369 33.751 42.322 1.00 36.55 C ATOM 3441 HA ILE B 116 -3.635 29.865 40.975 1.00 0.00 H ATOM 3442 HB ILE B 116 -3.540 32.697 39.824 1.00 0.00 H ATOM 3443 HG12 ILE B 116 -3.803 31.713 42.655 1.00 0.00 H ATOM 3444 HG13 ILE B 116 -2.524 32.730 41.950 1.00 0.00 H ATOM 3445 HD11 ILE B 116 -4.157 34.549 41.610 1.00 0.00 H ATOM 3446 HD12 ILE B 116 -5.436 33.531 42.315 1.00 0.00 H ATOM 3447 HD13 ILE B 116 -4.068 34.065 43.322 1.00 0.00 H ATOM 3448 HG21 ILE B 116 -5.630 31.528 39.276 1.00 0.00 H ATOM 3449 HG22 ILE B 116 -5.839 31.081 40.987 1.00 0.00 H ATOM 3450 HG23 ILE B 116 -5.914 32.792 40.498 1.00 0.00 H ATOM 3451 H ILE B 116 -1.318 31.159 39.542 1.00 0.00 H ATOM 3452 N GLY B 117 -4.463 29.282 38.544 1.00 38.18 N ATOM 3453 CA GLY B 117 -4.912 29.113 37.164 1.00 38.61 C ATOM 3454 C GLY B 117 -6.354 28.674 37.201 1.00 38.47 C ATOM 3455 O GLY B 117 -6.839 28.265 38.268 1.00 37.68 O ATOM 3456 HA3 GLY B 117 -4.306 28.356 36.666 1.00 0.00 H ATOM 3457 HA2 GLY B 117 -4.825 30.057 36.627 1.00 0.00 H ATOM 3458 H GLY B 117 -4.817 28.667 39.304 1.00 0.00 H ATOM 3459 N LYS B 118 -7.049 28.780 36.069 1.00 39.27 N ATOM 3460 CA LYS B 118 -8.401 28.263 35.986 1.00 40.04 C ATOM 3461 C LYS B 118 -8.391 26.773 35.618 1.00 40.62 C ATOM 3462 O LYS B 118 -7.533 26.333 34.860 1.00 41.84 O ATOM 3463 CB LYS B 118 -9.237 29.051 35.006 1.00 41.07 C ATOM 3464 CG LYS B 118 -9.271 30.536 35.331 1.00 40.96 C ATOM 3465 CD LYS B 118 -10.541 31.192 34.823 1.00 42.52 C ATOM 3466 CE LYS B 118 -10.501 32.691 35.130 1.00 43.23 C ATOM 3467 NZ LYS B 118 -11.634 33.467 34.559 1.00 45.46 N ATOM 3468 HA LYS B 118 -8.857 28.372 36.970 1.00 0.00 H ATOM 3469 HB2 LYS B 118 -8.820 28.921 34.007 1.00 0.00 H ATOM 3470 HB3 LYS B 118 -10.256 28.665 35.026 1.00 0.00 H ATOM 3471 HG2 LYS B 118 -9.216 30.663 36.412 1.00 0.00 H ATOM 3472 HG3 LYS B 118 -8.412 31.020 34.865 1.00 0.00 H ATOM 3473 HD2 LYS B 118 -10.621 31.044 33.746 1.00 0.00 H ATOM 3474 HD3 LYS B 118 -11.404 30.743 35.315 1.00 0.00 H ATOM 3475 HE2 LYS B 118 -9.573 33.097 34.728 1.00 0.00 H ATOM 3476 HE3 LYS B 118 -10.512 32.818 36.213 1.00 0.00 H ATOM 3477 HZ1 LYS B 118 -11.633 33.369 33.524 1.00 0.00 H ATOM 3478 HZ2 LYS B 118 -12.530 33.103 34.942 1.00 0.00 H ATOM 3479 HZ3 LYS B 118 -11.529 34.470 34.814 1.00 0.00 H ATOM 3480 H LYS B 118 -6.619 29.237 35.240 1.00 0.00 H ATOM 3481 N ASP B 119 -9.330 26.011 36.160 1.00 40.42 N ATOM 3482 CA ASP B 119 -9.401 24.577 35.849 1.00 42.02 C ATOM 3483 C ASP B 119 -10.538 24.271 34.868 1.00 44.04 C ATOM 3484 O ASP B 119 -11.373 25.140 34.590 1.00 44.61 O ATOM 3485 CB ASP B 119 -9.491 23.764 37.138 1.00 40.55 C ATOM 3486 CG ASP B 119 -8.303 24.011 38.034 1.00 39.63 C ATOM 3487 OD1 ASP B 119 -7.138 23.985 37.515 1.00 40.23 O ATOM 3488 OD2 ASP B 119 -8.523 24.278 39.241 1.00 38.62 O ATOM 3489 HA ASP B 119 -8.483 24.280 35.342 1.00 0.00 H ATOM 3490 HB2 ASP B 119 -10.400 24.044 37.670 1.00 0.00 H ATOM 3491 HB3 ASP B 119 -9.530 22.704 36.886 1.00 0.00 H ATOM 3492 H ASP B 119 -10.023 26.432 36.811 1.00 0.00 H ATOM 3493 N GLN B 120 -10.552 23.069 34.301 1.00 44.98 N ATOM 3494 CA GLN B 120 -11.672 22.703 33.476 1.00 46.81 C ATOM 3495 C GLN B 120 -12.922 22.908 34.264 1.00 47.57 C ATOM 3496 O GLN B 120 -12.941 22.658 35.458 1.00 47.56 O ATOM 3497 CB GLN B 120 -11.663 21.258 33.230 1.00 47.11 C ATOM 3498 CG GLN B 120 -10.822 20.856 32.106 1.00 48.29 C ATOM 3499 CD GLN B 120 -10.965 19.375 31.881 1.00 49.19 C ATOM 3500 OE1 GLN B 120 -10.160 18.805 31.209 1.00 50.04 O ATOM 3501 NE2 GLN B 120 -11.988 18.750 32.474 1.00 49.13 N ATOM 3502 HA GLN B 120 -11.620 23.287 32.557 1.00 0.00 H ATOM 3503 HB2 GLN B 120 -11.299 20.759 34.128 1.00 0.00 H ATOM 3504 HB3 GLN B 120 -12.685 20.937 33.027 1.00 0.00 H ATOM 3505 HG2 GLN B 120 -11.132 21.392 31.209 1.00 0.00 H ATOM 3506 HG3 GLN B 120 -9.781 21.092 32.327 1.00 0.00 H ATOM 3507 HE22 GLN B 120 -12.664 19.291 33.050 1.00 0.00 H ATOM 3508 HE21 GLN B 120 -12.107 17.723 32.359 1.00 0.00 H ATOM 3509 H GLN B 120 -9.766 22.404 34.451 1.00 0.00 H ATOM 3510 N SER B 121 -13.987 23.309 33.596 1.00 49.47 N ATOM 3511 CA SER B 121 -15.276 23.376 34.265 1.00 51.04 C ATOM 3512 C SER B 121 -16.358 23.085 33.263 1.00 53.20 C ATOM 3513 O SER B 121 -16.122 22.588 32.142 1.00 53.53 O ATOM 3514 CB SER B 121 -15.507 24.735 34.971 1.00 50.46 C ATOM 3515 OG SER B 121 -14.870 25.840 34.319 1.00 51.22 O ATOM 3516 HA SER B 121 -15.297 22.625 35.055 1.00 0.00 H ATOM 3517 OXT SER B 121 -17.498 23.381 33.596 1.00 54.68 O ATOM 3518 HB2 SER B 121 -15.119 24.665 35.987 1.00 0.00 H ATOM 3519 HB3 SER B 121 -16.579 24.927 35.005 1.00 0.00 H ATOM 3520 HG SER B 121 -13.893 25.686 34.290 1.00 0.00 H ATOM 3521 H SER B 121 -13.905 23.576 32.594 1.00 0.00 H TER 3522 SER B 121 HETATM 3523 CA CA A 1 10.001 12.129 65.002 1.00 39.00 CA HETATM 3524 CA CA A 2 3.236 43.291 61.375 1.00 51.01 CA HETATM 3525 O HOH 3 -9.561 10.087 46.601 1.00 41.76 O HETATM 3526 O HOH 4 -8.823 8.677 50.748 1.00 46.82 O HETATM 3527 O HOH 5 -3.033 6.469 58.237 1.00 45.87 O HETATM 3528 O HOH 6 -6.077 9.015 53.606 1.00 43.65 O HETATM 3529 O HOH 7 -4.663 17.750 58.042 1.00 49.01 O HETATM 3530 O HOH 8 -0.848 8.115 56.120 1.00 39.60 O HETATM 3531 O HOH 9 4.035 9.836 56.128 1.00 35.81 O HETATM 3532 O HOH 10 0.929 11.015 62.687 1.00 41.07 O HETATM 3533 O HOH 11 4.912 4.822 63.943 1.00 43.37 O HETATM 3534 O HOH 12 5.023 2.508 57.905 1.00 45.63 O HETATM 3535 O HOH 13 -1.266 4.213 54.915 1.00 45.83 O HETATM 3536 O HOH 14 9.941 7.323 55.728 1.00 32.84 O HETATM 3537 O HOH 15 7.724 2.638 61.668 1.00 46.17 O HETATM 3538 O HOH 16 9.844 5.090 63.063 1.00 38.41 O HETATM 3539 O HOH 17 3.760 2.523 51.410 1.00 49.01 O HETATM 3540 O HOH 18 -5.956 20.432 61.462 1.00 50.90 O HETATM 3541 O HOH 19 3.371 26.279 56.237 1.00 34.76 O HETATM 3542 O HOH 20 -4.577 3.527 40.265 1.00 42.78 O HETATM 3543 O HOH 21 -8.147 6.055 46.563 1.00 49.95 O HETATM 3544 O HOH 22 -9.098 7.688 44.434 1.00 50.93 O HETATM 3545 O HOH 23 -3.561 7.495 37.332 1.00 39.86 O HETATM 3546 O HOH 24 6.560 13.151 32.307 1.00 41.63 O HETATM 3547 O HOH 25 0.433 3.565 33.846 1.00 44.04 O HETATM 3548 O HOH 26 -2.385 5.397 34.628 1.00 42.93 O HETATM 3549 O HOH 27 -1.394 9.383 31.964 1.00 32.08 O HETATM 3550 O HOH 28 2.577 8.243 28.877 1.00 35.76 O HETATM 3551 O HOH 29 0.110 14.271 28.406 1.00 41.64 O HETATM 3552 O HOH 30 -1.906 15.107 32.191 1.00 42.01 O HETATM 3553 O HOH 31 14.878 3.101 50.899 1.00 50.32 O HETATM 3554 O HOH 32 9.750 22.173 44.372 1.00 41.83 O HETATM 3555 O HOH 33 -5.343 19.923 49.656 1.00 37.35 O HETATM 3556 O HOH 34 5.459 25.853 44.722 1.00 47.77 O HETATM 3557 O HOH 35 -3.862 19.316 60.256 1.00 46.40 O HETATM 3558 O HOH 36 -3.416 24.458 64.407 1.00 47.72 O HETATM 3559 O HOH 37 5.138 19.201 60.085 1.00 35.33 O HETATM 3560 O HOH 38 3.458 16.501 69.575 1.00 42.93 O HETATM 3561 O HOH 39 8.622 19.929 72.635 1.00 44.14 O HETATM 3562 O HOH 40 8.190 22.830 70.382 1.00 49.39 O HETATM 3563 O HOH 41 4.686 26.618 63.268 1.00 40.06 O HETATM 3564 O HOH 42 4.680 29.628 65.989 1.00 38.24 O HETATM 3565 O HOH 43 8.292 3.052 66.602 1.00 46.55 O HETATM 3566 O HOH 44 12.752 10.119 71.205 1.00 51.94 O HETATM 3567 O HOH 45 2.532 24.988 67.086 1.00 24.80 O HETATM 3568 O HOH 46 10.243 26.329 63.868 1.00 40.29 O HETATM 3569 O HOH 47 5.810 25.044 58.589 1.00 36.15 O HETATM 3570 O HOH 48 10.957 22.145 53.156 1.00 38.63 O HETATM 3571 O HOH 49 -2.322 22.656 27.900 1.00 47.15 O HETATM 3572 O HOH 50 13.313 23.774 65.583 1.00 37.81 O HETATM 3573 O HOH 51 14.435 29.039 55.473 1.00 43.82 O HETATM 3574 O HOH 52 11.343 30.701 61.189 1.00 40.91 O HETATM 3575 O HOH 53 14.023 32.384 54.166 1.00 51.34 O HETATM 3576 O HOH 54 9.680 28.795 62.586 1.00 43.49 O HETATM 3577 O HOH 55 15.672 22.821 66.172 1.00 47.72 O HETATM 3578 O HOH 56 16.539 16.023 60.983 1.00 33.97 O HETATM 3579 O HOH 57 21.107 20.537 58.732 1.00 44.66 O HETATM 3580 O HOH 58 17.464 13.363 49.631 1.00 37.12 O HETATM 3581 O HOH 59 20.817 9.678 53.300 1.00 48.63 O HETATM 3582 O HOH 60 12.116 21.821 49.503 1.00 36.51 O HETATM 3583 O HOH 61 14.281 23.578 52.094 1.00 44.64 O HETATM 3584 O HOH 62 5.062 4.984 45.261 1.00 38.28 O HETATM 3585 O HOH 63 12.838 3.539 47.513 1.00 49.07 O HETATM 3586 O HOH 64 11.954 6.686 52.362 1.00 38.67 O HETATM 3587 O HOH 65 10.260 6.565 38.949 1.00 38.43 O HETATM 3588 O HOH 66 10.117 3.531 38.371 1.00 46.61 O HETATM 3589 O HOH 67 7.622 1.196 42.392 1.00 52.14 O HETATM 3590 O HOH 68 10.197 1.889 45.633 1.00 46.48 O HETATM 3591 O HOH 69 14.569 10.061 42.092 1.00 48.77 O HETATM 3592 O HOH 70 15.861 9.462 48.202 1.00 44.17 O HETATM 3593 O HOH 71 9.865 19.468 44.349 1.00 41.15 O HETATM 3594 O HOH 72 7.580 22.060 46.465 1.00 45.05 O HETATM 3595 O HOH 73 8.337 24.844 47.719 1.00 43.33 O HETATM 3596 O HOH 74 5.377 24.492 47.143 1.00 43.69 O HETATM 3597 O HOH 75 10.529 19.700 41.623 1.00 43.84 O HETATM 3598 O HOH 76 7.516 20.703 35.943 1.00 44.25 O HETATM 3599 O HOH 77 7.551 2.186 39.033 1.00 45.52 O HETATM 3600 O HOH 78 4.388 3.060 35.842 1.00 50.21 O HETATM 3601 O HOH 79 4.946 2.385 40.395 1.00 47.92 O HETATM 3602 O HOH 80 4.241 2.990 48.790 1.00 47.17 O HETATM 3603 O HOH 81 9.980 5.836 66.149 1.00 34.08 O HETATM 3604 O HOH 82 14.238 3.658 66.112 1.00 49.13 O HETATM 3605 O HOH 83 11.675 9.798 68.264 1.00 43.50 O HETATM 3606 O HOH 84 8.894 12.401 71.938 1.00 45.28 O HETATM 3607 O HOH 85 -1.733 11.957 65.126 1.00 53.04 O HETATM 3608 O HOH 86 -10.965 17.664 46.921 1.00 47.65 O HETATM 3609 O HOH 87 -4.445 8.366 34.110 1.00 36.85 O HETATM 3610 O HOH 88 -1.302 21.247 25.720 1.00 50.52 O HETATM 3611 O HOH 89 1.927 40.510 39.915 1.00 45.46 O HETATM 3612 O HOH 90 1.987 35.865 35.500 1.00 42.17 O HETATM 3613 O HOH 91 4.133 38.248 38.377 1.00 40.38 O HETATM 3614 O HOH 92 6.077 27.043 39.516 1.00 46.08 O HETATM 3615 O HOH 93 7.080 34.020 41.822 1.00 48.24 O HETATM 3616 O HOH 94 0.146 41.381 51.359 1.00 45.32 O HETATM 3617 O HOH 95 7.619 41.722 52.855 1.00 44.25 O HETATM 3618 O HOH 96 -9.217 38.169 31.751 1.00 51.39 O HETATM 3619 O HOH 97 2.961 48.728 53.070 1.00 51.55 O HETATM 3620 O HOH 98 5.751 46.339 49.559 1.00 49.21 O HETATM 3621 O HOH 99 1.138 48.605 51.158 1.00 43.56 O HETATM 3622 O HOH 100 -4.345 44.335 54.670 1.00 40.93 O HETATM 3623 O HOH 101 -5.341 46.927 56.192 1.00 45.06 O HETATM 3624 O HOH 102 -9.295 35.945 34.253 1.00 45.68 O HETATM 3625 O HOH 103 -18.781 30.426 40.963 1.00 42.53 O HETATM 3626 O HOH 104 -14.841 32.603 33.274 1.00 43.91 O HETATM 3627 O HOH 105 -17.346 29.829 34.504 1.00 39.16 O HETATM 3628 O HOH 106 -17.743 27.028 33.917 1.00 42.37 O HETATM 3629 O HOH 107 -6.433 21.681 39.556 1.00 40.25 O HETATM 3630 O HOH 108 3.084 28.455 43.985 1.00 47.18 O HETATM 3631 O HOH 109 -6.371 24.784 54.026 1.00 44.83 O HETATM 3632 O HOH 110 9.669 32.928 50.572 1.00 42.85 O HETATM 3633 O HOH 111 10.618 26.426 51.220 1.00 44.63 O HETATM 3634 O HOH 112 13.517 27.708 52.112 1.00 51.98 O HETATM 3635 O HOH 113 3.684 33.899 57.591 1.00 37.38 O HETATM 3636 O HOH 114 3.772 33.185 68.128 1.00 41.39 O HETATM 3637 O HOH 115 3.827 51.558 58.062 1.00 46.42 O HETATM 3638 O HOH 116 6.255 51.914 59.106 1.00 49.95 O HETATM 3639 O HOH 117 7.640 28.224 61.087 1.00 35.76 O HETATM 3640 O HOH 118 8.446 47.918 63.938 1.00 42.40 O HETATM 3641 O HOH 119 8.336 29.754 64.659 1.00 48.25 O HETATM 3642 O HOH 120 10.716 39.899 50.239 1.00 45.06 O HETATM 3643 O HOH 121 3.473 28.208 59.051 1.00 36.17 O HETATM 3644 O HOH 122 -4.148 29.894 58.459 1.00 38.66 O HETATM 3645 O HOH 123 -2.228 20.437 68.752 1.00 37.61 O HETATM 3646 O HOH 124 7.089 27.986 70.455 1.00 49.80 O HETATM 3647 O HOH 125 -3.193 39.211 65.799 1.00 39.53 O HETATM 3648 O HOH 126 -9.060 33.950 64.509 1.00 42.51 O HETATM 3649 O HOH 127 -6.995 47.042 65.117 1.00 25.29 O HETATM 3650 O HOH 128 -10.765 41.810 59.825 1.00 43.33 O HETATM 3651 O HOH 129 -8.304 28.951 57.166 1.00 36.27 O HETATM 3652 O HOH 130 -13.047 44.643 42.184 1.00 48.30 O HETATM 3653 O HOH 131 -13.733 47.595 47.571 1.00 53.43 O HETATM 3654 O HOH 132 -17.428 36.706 50.948 1.00 48.77 O HETATM 3655 O HOH 133 -10.759 29.346 52.152 1.00 44.06 O HETATM 3656 O HOH 134 -4.562 24.989 51.632 1.00 37.13 O HETATM 3657 O HOH 135 -8.605 22.845 48.629 1.00 37.32 O HETATM 3658 O HOH 136 -13.788 28.423 50.933 1.00 44.69 O HETATM 3659 O HOH 137 -15.000 24.448 46.127 1.00 43.67 O HETATM 3660 O HOH 138 -17.467 28.382 48.422 1.00 43.32 O HETATM 3661 O HOH 139 -22.866 29.151 47.354 1.00 52.75 O HETATM 3662 O HOH 140 -20.779 33.168 41.894 1.00 46.22 O HETATM 3663 O HOH 141 -17.609 42.716 40.649 1.00 43.84 O HETATM 3664 O HOH 142 -9.599 42.476 43.619 1.00 46.90 O HETATM 3665 O HOH 143 3.319 49.401 60.076 1.00 39.17 O HETATM 3666 O HOH 144 7.169 49.035 62.098 1.00 46.40 O HETATM 3667 O HOH 145 4.859 46.985 65.038 1.00 50.43 O HETATM 3668 O HOH 146 11.599 41.034 53.114 1.00 41.63 O HETATM 3669 O HOH 147 -11.284 33.519 31.868 1.00 37.60 O HETATM 3670 C1 GS A 9 13.604 15.027 67.228 1.00 0.15 C HETATM 3671 O5 GS A 9 13.886 15.162 65.820 1.00 -0.35 O HETATM 3672 C5 GS A 9 14.353 13.984 65.144 1.00 0.11 C HETATM 3673 C4 GS A 9 13.293 12.873 65.284 1.00 0.11 C HETATM 3674 C3 GS A 9 12.821 12.776 66.737 1.00 0.11 C HETATM 3675 C2 GS A 9 12.386 14.154 67.259 1.00 0.12 C HETATM 3676 O2 GS A 9 11.922 14.032 68.593 1.00 -0.39 O HETATM 3677 H3 GS A 9 11.150 13.478 68.609 1.00 0.21 H HETATM 3678 H2 GS A 9 11.593 14.575 66.623 1.00 0.07 H HETATM 3679 O3 GS A 9 11.670 11.954 66.861 1.00 -0.39 O HETATM 3680 H5 GS A 9 11.406 11.916 67.773 1.00 0.21 H HETATM 3681 H4 GS A 9 13.639 12.376 67.353 1.00 0.06 H HETATM 3682 O4 GS A 9 12.153 13.141 64.455 1.00 -0.39 O HETATM 3683 H7 GS A 9 12.430 13.204 63.548 1.00 0.21 H HETATM 3684 H6 GS A 9 13.742 11.915 64.982 1.00 0.06 H HETATM 3685 C6 GS A 9 14.607 14.457 63.716 1.00 0.07 C HETATM 3686 O6 GS A 9 15.755 15.348 63.735 1.00 -0.39 O HETATM 3687 H10 GS A 9 15.569 16.090 64.299 1.00 0.21 H HETATM 3688 H11 GS A 9 13.724 14.994 63.338 1.00 0.06 H HETATM 3689 H12 GS A 9 14.816 13.593 63.068 1.00 0.06 H HETATM 3690 H8 GS A 9 15.295 13.627 65.586 1.00 0.06 H HETATM 3691 S1 GS A 9 13.246 16.680 67.972 1.00 -0.07 S HETATM 3692 C7 GS A 9 14.705 17.241 68.354 1.00 0.02 C HETATM 3693 C80 GS A 9 14.773 18.362 69.204 1.00 -0.05 C HETATM 3694 C90 GS A 9 16.012 18.891 69.579 1.00 -0.06 C HETATM 3695 C14 GS A 9 17.210 18.279 69.151 1.00 -0.02 C HETATM 3696 C9 GS A 9 17.124 17.076 68.291 1.00 -0.03 C HETATM 3697 C8 GS A 9 15.878 16.594 67.913 1.00 -0.04 C HETATM 3698 H14 GS A 9 15.807 15.719 67.278 1.00 0.05 H HETATM 3699 C10 GS A 9 18.300 16.453 67.861 1.00 -0.06 C HETATM 3700 C11 GS A 9 19.528 17.007 68.272 1.00 -0.06 C HETATM 3701 C12 GS A 9 19.616 18.126 69.114 1.00 -0.06 C HETATM 3702 C13 GS A 9 18.466 18.790 69.559 1.00 -0.06 C HETATM 3703 H15 GS A 9 18.535 19.666 70.194 1.00 0.06 H HETATM 3704 H16 GS A 9 20.591 18.483 69.425 1.00 0.06 H HETATM 3705 H17 GS A 9 20.446 16.549 67.922 1.00 0.06 H HETATM 3706 H18 GS A 9 18.267 15.571 67.231 1.00 0.06 H HETATM 3707 H13 GS A 9 16.053 19.777 70.202 1.00 0.06 H HETATM 3708 H9 GS A 9 13.860 18.817 69.570 1.00 0.06 H HETATM 3709 H1 GS A 9 14.444 14.554 67.759 1.00 0.08 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 509 508 3523 CONECT 1470 1468 3523 CONECT 1515 1514 3523 CONECT 1560 1559 3523 CONECT 1762 1763 1771 1772 1773 CONECT 1771 1762 CONECT 1772 1762 CONECT 1773 1762 CONECT 2270 2269 3524 CONECT 3231 3229 3524 CONECT 3276 3275 3524 CONECT 3321 3320 3524 CONECT 3523 509 1470 1515 1560 CONECT 3524 2270 3231 3276 3321 CONECT 3670 3671 3675 3691 3709 CONECT 3671 3670 3672 CONECT 3672 3671 3673 3685 3690 CONECT 3673 3672 3674 3682 3684 CONECT 3674 3673 3675 3679 3681 CONECT 3675 3670 3674 3676 3678 CONECT 3676 3675 3677 CONECT 3677 3676 CONECT 3678 3675 CONECT 3679 3674 3680 CONECT 3680 3679 CONECT 3681 3674 CONECT 3682 3673 3683 CONECT 3683 3682 CONECT 3684 3673 CONECT 3685 3672 3686 3688 3689 CONECT 3686 3685 3687 CONECT 3687 3686 CONECT 3688 3685 CONECT 3689 3685 CONECT 3690 3672 CONECT 3691 3670 3692 CONECT 3692 3691 3693 3697 CONECT 3693 3692 3694 3708 CONECT 3694 3693 3695 3707 CONECT 3695 3694 3696 3702 CONECT 3696 3695 3697 3699 CONECT 3697 3692 3696 3698 CONECT 3698 3697 CONECT 3699 3696 3700 3706 CONECT 3700 3699 3701 3705 CONECT 3701 3700 3702 3704 CONECT 3702 3695 3701 3703 CONECT 3703 3702 CONECT 3704 3701 CONECT 3705 3700 CONECT 3706 3699 CONECT 3707 3694 CONECT 3708 3693 CONECT 3709 3670 MASTER 0 0 0 0 0 0 0 0 3707 2 58 20 END
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Related entries of code: 4a6s
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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121aa, >1OKO_1|Chains... at 100%
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121aa, >2VXJ_1|Chains... at 100%
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PDBbind
122aa, >3ZYB_1|Chains... *
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PDBbind
122aa, >3ZYF_1|Chains... at 100%
3zyh
RCSB PDB
PDBbind
122aa, >3ZYH_1|Chains... at 100%
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RCSB PDB
PDBbind
122aa, >4LJH_1|Chains... at 100%
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PDBbind
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RCSB PDB
PDBbind
121aa, >4LK7_1|Chains... at 100%
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RCSB PDB
PDBbind
121aa, >4LKD_1|Chains... at 100%
4lke
RCSB PDB
PDBbind
121aa, >4LKE_1|Chains... at 100%
4lkf
RCSB PDB
PDBbind
121aa, >4LKF_1|Chains... at 100%
4yw6
RCSB PDB
PDBbind
121aa, >4YW6_1|Chains... at 100%
4yw7
RCSB PDB
PDBbind
121aa, >4YW7_1|Chains... at 100%
4ywa
RCSB PDB
PDBbind
121aa, >4YWA_1|Chains... at 100%
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RCSB PDB
PDBbind
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4a6s
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
PA-I GALACTOPHILIC LECTIN
Ligand Name
GS9
EC.Number
E.C.-.-.-.-
Resolution
2.15(Å)
Affinity (Kd/Ki/IC50)
Kd=6.3uM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) Org.Biomol.Chem. Vol. 11: pp. 6906
Ligand Properties
Formula
C
1
6
H
1
8
O
5
S
Molecular Weight
322.376
Exact Mass
322.087
No. of atoms
40
No. of bonds
42
Polar Surface Area
115.45
LOGP Value
1.55 (
Computed with XLOGP3
)
0.73 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 3
Canonical SMILES
OC[C@H]1O[C@@H](Sc2ccc3c(c2)cccc3)[C@@H]([C@H]([C@H]1O)O)O
InChI String
InChI=1S/C16H18O5S/c17-8-12-13(18)14(19)15(20)16(21-12)22-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-20H,8H2/t12-,13+,14+,15-,16+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q05097
Entrez Gene ID
NCBI Entrez Gene ID:
882335
ASD
Information of known allosteric effects of PDB entries
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