REMARK Coordinates of 1f7e rotated and translated as follows: REMARK | -0.67320 0.71324 -0.19517 | | x | | -2.000 | REMARK | -0.66321 -0.46563 0.58595 | * | y | + | 9.000 | REMARK | 0.32705 0.52390 0.78649 | | z | | 8.000 | REMARK REMARK HOH and TIP residues excluded. Only first MODEL passed through. REMARK HEADER BLOOD CLOTTING 19-FEB-99 1F7E TITLE THE FIRST EGF-LIKE DOMAIN FROM HUMAN BLOOD COAGULATION FVII, TITLE 2 NMR, 20 STRUCTURES COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN (BLOOD COAGULATION FACTOR VII); COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: FIRST EGF-LIKE DOMAIN (RESIDUES 45-87); COMPND 5 ENGINEERED: YES; COMPND 6 OTHER_DETAILS: CALCIUM BOUND FORM AUTHOR Y.-H.KAO,G.F.LEE,Y.WANG,M.A.STAROVASNIK,R.F.KELLEY, AUTHOR 2 M.W.SPELLMAN,L.LERNER SHEET 1 S1 2 SER A 60 ASP A 63 0 SHEET 2 S1 2 TYR A 68 PHE A 71 -1 SHEET 1 S2 2 PHE A 76 GLU A 77 0 SHEET 2 S2 2 THR A 83 HIS A 84 -1 ATOM 1 N SER A 45 -14.020 13.283 -11.206 1.00 0.00 N ATOM 2 CA SER A 45 -12.855 13.030 -12.102 1.00 0.00 C ATOM 3 C SER A 45 -11.643 13.838 -11.640 1.00 0.00 C ATOM 4 O SER A 45 -11.653 15.054 -11.671 1.00 0.00 O ATOM 5 CB SER A 45 -13.308 13.488 -13.483 1.00 0.00 C ATOM 6 OG SER A 45 -12.343 13.100 -14.455 1.00 0.00 O ATOM 7 H1 SER A 45 -14.182 14.307 -11.145 1.00 0.00 H ATOM 8 H2 SER A 45 -14.864 12.814 -11.601 1.00 0.00 H ATOM 9 H3 SER A 45 -13.812 12.904 -10.262 1.00 0.00 H ATOM 10 HA SER A 45 -12.615 11.978 -12.123 1.00 0.00 H ATOM 11 HB2 SER A 45 -14.255 13.034 -13.724 1.00 0.00 H ATOM 12 HB3 SER A 45 -13.418 14.563 -13.485 1.00 0.00 H ATOM 13 HG SER A 45 -12.687 12.341 -14.929 1.00 0.00 H ATOM 14 N ASP A 46 -10.599 13.169 -11.213 1.00 0.00 N ATOM 15 CA ASP A 46 -9.377 13.897 -10.740 1.00 0.00 C ATOM 16 C ASP A 46 -8.175 12.944 -10.686 1.00 0.00 C ATOM 17 O ASP A 46 -7.514 12.816 -9.676 1.00 0.00 O ATOM 18 CB ASP A 46 -9.729 14.414 -9.344 1.00 0.00 C ATOM 19 CG ASP A 46 -10.095 13.243 -8.435 1.00 0.00 C ATOM 20 OD1 ASP A 46 -11.189 12.715 -8.580 1.00 0.00 O ATOM 21 OD2 ASP A 46 -9.284 12.885 -7.586 1.00 0.00 O ATOM 22 H ASP A 46 -10.613 12.194 -11.202 1.00 0.00 H ATOM 23 HA ASP A 46 -9.165 14.729 -11.397 1.00 0.00 H ATOM 24 HB2 ASP A 46 -8.873 14.938 -8.937 1.00 0.00 H ATOM 25 HB3 ASP A 46 -10.559 15.091 -9.406 1.00 0.00 H ATOM 26 N GLY A 47 -7.901 12.264 -11.777 1.00 0.00 N ATOM 27 CA GLY A 47 -6.753 11.313 -11.800 1.00 0.00 C ATOM 28 C GLY A 47 -7.174 9.990 -11.161 1.00 0.00 C ATOM 29 O GLY A 47 -7.219 9.860 -9.956 1.00 0.00 O ATOM 30 H GLY A 47 -8.454 12.386 -12.577 1.00 0.00 H ATOM 31 HA2 GLY A 47 -6.447 11.147 -12.822 1.00 0.00 H ATOM 32 HA3 GLY A 47 -5.926 11.733 -11.234 1.00 0.00 H ATOM 33 N ASP A 48 -7.460 9.005 -11.973 1.00 0.00 N ATOM 34 CA ASP A 48 -7.876 7.680 -11.419 1.00 0.00 C ATOM 35 C ASP A 48 -6.652 6.782 -11.210 1.00 0.00 C ATOM 36 O ASP A 48 -6.370 5.905 -12.012 1.00 0.00 O ATOM 37 CB ASP A 48 -8.800 7.081 -12.487 1.00 0.00 C ATOM 38 CG ASP A 48 -10.260 7.224 -12.053 1.00 0.00 C ATOM 39 OD1 ASP A 48 -10.658 8.319 -11.721 1.00 0.00 O ATOM 40 OD2 ASP A 48 -10.947 6.220 -12.048 1.00 0.00 O ATOM 41 H ASP A 48 -7.405 9.133 -12.945 1.00 0.00 H ATOM 42 HA ASP A 48 -8.413 7.804 -10.501 1.00 0.00 H ATOM 43 HB2 ASP A 48 -8.655 7.603 -13.424 1.00 0.00 H ATOM 44 HB3 ASP A 48 -8.566 6.035 -12.629 1.00 0.00 H ATOM 45 N GLN A 49 -5.925 7.004 -10.152 1.00 0.00 N ATOM 46 CA GLN A 49 -4.706 6.172 -9.878 1.00 0.00 C ATOM 47 C GLN A 49 -5.098 4.930 -9.075 1.00 0.00 C ATOM 48 O GLN A 49 -4.527 3.865 -9.234 1.00 0.00 O ATOM 49 CB GLN A 49 -3.789 7.075 -9.065 1.00 0.00 C ATOM 50 CG GLN A 49 -3.399 8.305 -9.897 1.00 0.00 C ATOM 51 CD GLN A 49 -2.533 7.854 -11.075 1.00 0.00 C ATOM 52 OE1 GLN A 49 -1.321 7.883 -11.000 1.00 0.00 O ATOM 53 NE2 GLN A 49 -3.112 7.448 -12.175 1.00 0.00 N ATOM 54 H GLN A 49 -6.174 7.716 -9.524 1.00 0.00 H ATOM 55 HA GLN A 49 -4.233 5.888 -10.795 1.00 0.00 H ATOM 56 HB2 GLN A 49 -4.296 7.401 -8.162 1.00 0.00 H ATOM 57 HB3 GLN A 49 -2.899 6.531 -8.794 1.00 0.00 H ATOM 58 HG2 GLN A 49 -4.287 8.781 -10.269 1.00 0.00 H ATOM 59 HG3 GLN A 49 -2.842 8.993 -9.280 1.00 0.00 H ATOM 60 HE21 GLN A 49 -4.089 7.428 -12.237 1.00 0.00 H ATOM 61 HE22 GLN A 49 -2.567 7.167 -12.937 1.00 0.00 H ATOM 62 N CYS A 50 -6.050 5.066 -8.192 1.00 0.00 N ATOM 63 CA CYS A 50 -6.484 3.894 -7.364 1.00 0.00 C ATOM 64 C CYS A 50 -7.475 3.024 -8.143 1.00 0.00 C ATOM 65 O CYS A 50 -7.627 1.846 -7.876 1.00 0.00 O ATOM 66 CB CYS A 50 -7.149 4.508 -6.142 1.00 0.00 C ATOM 67 SG CYS A 50 -7.625 3.198 -4.979 1.00 0.00 S ATOM 68 H CYS A 50 -6.499 5.924 -8.079 1.00 0.00 H ATOM 69 HA CYS A 50 -5.620 3.312 -7.072 1.00 0.00 H ATOM 70 HB2 CYS A 50 -6.464 5.186 -5.651 1.00 0.00 H ATOM 71 HB3 CYS A 50 -8.034 5.046 -6.445 1.00 0.00 H ATOM 72 N ALA A 51 -8.154 3.594 -9.118 1.00 0.00 N ATOM 73 CA ALA A 51 -9.139 2.799 -9.915 1.00 0.00 C ATOM 74 C ALA A 51 -8.470 1.578 -10.555 1.00 0.00 C ATOM 75 O ALA A 51 -9.133 0.610 -10.914 1.00 0.00 O ATOM 76 CB ALA A 51 -9.649 3.750 -10.991 1.00 0.00 C ATOM 77 H ALA A 51 -8.022 4.537 -9.318 1.00 0.00 H ATOM 78 HA ALA A 51 -9.963 2.482 -9.285 1.00 0.00 H ATOM 79 HB1 ALA A 51 -9.516 4.772 -10.664 1.00 0.00 H ATOM 80 HB2 ALA A 51 -9.092 3.593 -11.906 1.00 0.00 H ATOM 81 HB3 ALA A 51 -10.692 3.570 -11.180 1.00 0.00 H ATOM 82 N SER A 52 -7.175 1.604 -10.711 1.00 0.00 N ATOM 83 CA SER A 52 -6.460 0.448 -11.338 1.00 0.00 C ATOM 84 C SER A 52 -6.038 -0.586 -10.273 1.00 0.00 C ATOM 85 O SER A 52 -5.420 -1.580 -10.586 1.00 0.00 O ATOM 86 CB SER A 52 -5.233 1.057 -12.009 1.00 0.00 C ATOM 87 OG SER A 52 -4.976 0.365 -13.222 1.00 0.00 O ATOM 88 H SER A 52 -6.656 2.380 -10.423 1.00 0.00 H ATOM 89 HA SER A 52 -7.083 -0.021 -12.071 1.00 0.00 H ATOM 90 HB2 SER A 52 -5.416 2.092 -12.215 1.00 0.00 H ATOM 91 HB3 SER A 52 -4.376 0.966 -11.347 1.00 0.00 H ATOM 92 HG SER A 52 -5.708 0.528 -13.818 1.00 0.00 H ATOM 93 N SER A 53 -6.359 -0.349 -9.015 1.00 0.00 N ATOM 94 CA SER A 53 -5.969 -1.328 -7.935 1.00 0.00 C ATOM 95 C SER A 53 -4.458 -1.642 -8.000 1.00 0.00 C ATOM 96 O SER A 53 -4.079 -2.788 -8.044 1.00 0.00 O ATOM 97 CB SER A 53 -6.797 -2.583 -8.210 1.00 0.00 C ATOM 98 OG SER A 53 -8.179 -2.278 -8.081 1.00 0.00 O ATOM 99 H SER A 53 -6.852 0.449 -8.779 1.00 0.00 H ATOM 100 HA SER A 53 -6.222 -0.924 -6.964 1.00 0.00 H ATOM 101 HB2 SER A 53 -6.605 -2.939 -9.207 1.00 0.00 H ATOM 102 HB3 SER A 53 -6.520 -3.359 -7.500 1.00 0.00 H ATOM 103 HG SER A 53 -8.651 -3.094 -7.895 1.00 0.00 H ATOM 104 N PRO A 54 -3.646 -0.609 -7.996 1.00 0.00 N ATOM 105 CA PRO A 54 -2.181 -0.813 -8.053 1.00 0.00 C ATOM 106 C PRO A 54 -1.647 -1.342 -6.712 1.00 0.00 C ATOM 107 O PRO A 54 -0.626 -1.987 -6.652 1.00 0.00 O ATOM 108 CB PRO A 54 -1.640 0.580 -8.334 1.00 0.00 C ATOM 109 CG PRO A 54 -2.677 1.524 -7.819 1.00 0.00 C ATOM 110 CD PRO A 54 -4.002 0.819 -7.941 1.00 0.00 C ATOM 111 HA PRO A 54 -1.915 -1.477 -8.852 1.00 0.00 H ATOM 112 HB2 PRO A 54 -0.698 0.729 -7.804 1.00 0.00 H ATOM 113 HB3 PRO A 54 -1.502 0.717 -9.393 1.00 0.00 H ATOM 114 HG2 PRO A 54 -2.470 1.767 -6.779 1.00 0.00 H ATOM 115 HG3 PRO A 54 -2.692 2.422 -8.415 1.00 0.00 H ATOM 116 HD2 PRO A 54 -4.618 1.030 -7.068 1.00 0.00 H ATOM 117 HD3 PRO A 54 -4.507 1.113 -8.844 1.00 0.00 H ATOM 118 N CYS A 55 -2.352 -1.061 -5.635 1.00 0.00 N ATOM 119 CA CYS A 55 -1.889 -1.547 -4.293 1.00 0.00 C ATOM 120 C CYS A 55 -1.817 -3.076 -4.280 1.00 0.00 C ATOM 121 O CYS A 55 -2.831 -3.756 -4.229 1.00 0.00 O ATOM 122 CB CYS A 55 -2.952 -1.049 -3.300 1.00 0.00 C ATOM 123 SG CYS A 55 -3.030 0.758 -3.344 1.00 0.00 S ATOM 124 H CYS A 55 -3.174 -0.535 -5.709 1.00 0.00 H ATOM 125 HA CYS A 55 -0.931 -1.121 -4.055 1.00 0.00 H ATOM 126 HB2 CYS A 55 -3.910 -1.459 -3.563 1.00 0.00 H ATOM 127 HB3 CYS A 55 -2.679 -1.377 -2.302 1.00 0.00 H ATOM 128 N GLN A 56 -0.638 -3.616 -4.323 1.00 0.00 N ATOM 129 CA GLN A 56 -0.484 -5.111 -4.315 1.00 0.00 C ATOM 130 C GLN A 56 -0.510 -5.644 -2.882 1.00 0.00 C ATOM 131 O GLN A 56 -0.938 -4.980 -1.957 1.00 0.00 O ATOM 132 CB GLN A 56 0.877 -5.362 -4.960 1.00 0.00 C ATOM 133 CG GLN A 56 0.798 -6.608 -5.844 1.00 0.00 C ATOM 134 CD GLN A 56 0.400 -6.197 -7.266 1.00 0.00 C ATOM 135 OE1 GLN A 56 -0.636 -6.590 -7.752 1.00 0.00 O ATOM 136 NE2 GLN A 56 1.197 -5.431 -7.957 1.00 0.00 N ATOM 137 H GLN A 56 0.160 -3.048 -4.370 1.00 0.00 H ATOM 138 HA GLN A 56 -1.265 -5.572 -4.903 1.00 0.00 H ATOM 139 HB2 GLN A 56 1.159 -4.513 -5.561 1.00 0.00 H ATOM 140 HB3 GLN A 56 1.606 -5.525 -4.187 1.00 0.00 H ATOM 141 HG2 GLN A 56 1.758 -7.095 -5.866 1.00 0.00 H ATOM 142 HG3 GLN A 56 0.061 -7.295 -5.452 1.00 0.00 H ATOM 143 HE21 GLN A 56 2.041 -5.114 -7.564 1.00 0.00 H ATOM 144 HE22 GLN A 56 0.956 -5.166 -8.863 1.00 0.00 H ATOM 145 N ASN A 57 -0.047 -6.862 -2.686 1.00 0.00 N ATOM 146 CA ASN A 57 -0.024 -7.478 -1.319 1.00 0.00 C ATOM 147 C ASN A 57 -1.412 -7.440 -0.674 1.00 0.00 C ATOM 148 O ASN A 57 -1.545 -7.506 0.537 1.00 0.00 O ATOM 149 CB ASN A 57 0.958 -6.636 -0.495 1.00 0.00 C ATOM 150 CG ASN A 57 2.320 -6.539 -1.195 1.00 0.00 C ATOM 151 OD1 ASN A 57 3.012 -5.547 -1.063 1.00 0.00 O ATOM 152 ND2 ASN A 57 2.748 -7.535 -1.936 1.00 0.00 N ATOM 153 H ASN A 57 0.293 -7.374 -3.453 1.00 0.00 H ATOM 154 HA ASN A 57 0.331 -8.487 -1.382 1.00 0.00 H ATOM 155 HB2 ASN A 57 0.559 -5.636 -0.360 1.00 0.00 H ATOM 156 HB3 ASN A 57 1.095 -7.093 0.478 1.00 0.00 H ATOM 157 HD21 ASN A 57 2.191 -8.332 -2.040 1.00 0.00 H ATOM 158 HD22 ASN A 57 3.610 -7.468 -2.382 1.00 0.00 H ATOM 159 N GLY A 58 -2.451 -7.350 -1.470 1.00 0.00 N ATOM 160 CA GLY A 58 -3.835 -7.320 -0.895 1.00 0.00 C ATOM 161 C GLY A 58 -3.993 -6.117 0.026 1.00 0.00 C ATOM 162 O GLY A 58 -4.709 -6.184 1.018 1.00 0.00 O ATOM 163 H GLY A 58 -2.327 -7.305 -2.439 1.00 0.00 H ATOM 164 HA2 GLY A 58 -4.554 -7.245 -1.701 1.00 0.00 H ATOM 165 HA3 GLY A 58 -4.016 -8.222 -0.344 1.00 0.00 H ATOM 166 N GLY A 59 -3.342 -5.024 -0.270 1.00 0.00 N ATOM 167 CA GLY A 59 -3.450 -3.811 0.592 1.00 0.00 C ATOM 168 C GLY A 59 -4.697 -3.034 0.212 1.00 0.00 C ATOM 169 O GLY A 59 -5.290 -3.259 -0.822 1.00 0.00 O ATOM 170 H GLY A 59 -2.777 -5.000 -1.076 1.00 0.00 H ATOM 171 HA2 GLY A 59 -3.518 -4.120 1.632 1.00 0.00 H ATOM 172 HA3 GLY A 59 -2.580 -3.196 0.451 1.00 0.00 H ATOM 173 N SER A 60 -5.100 -2.096 1.041 1.00 0.00 N ATOM 174 CA SER A 60 -6.312 -1.277 0.728 1.00 0.00 C ATOM 175 C SER A 60 -5.913 -0.039 -0.070 1.00 0.00 C ATOM 176 O SER A 60 -5.080 0.738 0.346 1.00 0.00 O ATOM 177 CB SER A 60 -6.892 -0.891 2.089 1.00 0.00 C ATOM 178 OG SER A 60 -8.277 -1.232 2.126 1.00 0.00 O ATOM 179 H SER A 60 -4.599 -1.927 1.865 1.00 0.00 H ATOM 180 HA SER A 60 -7.029 -1.874 0.181 1.00 0.00 H ATOM 181 HB2 SER A 60 -6.373 -1.420 2.879 1.00 0.00 H ATOM 182 HB3 SER A 60 -6.770 0.175 2.240 1.00 0.00 H ATOM 183 HG SER A 60 -8.351 -2.165 1.913 1.00 0.00 H ATOM 184 N CYS A 61 -6.503 0.140 -1.227 1.00 0.00 N ATOM 185 CA CYS A 61 -6.164 1.327 -2.065 1.00 0.00 C ATOM 186 C CYS A 61 -7.078 2.508 -1.736 1.00 0.00 C ATOM 187 O CYS A 61 -8.286 2.374 -1.681 1.00 0.00 O ATOM 188 CB CYS A 61 -6.384 0.869 -3.508 1.00 0.00 C ATOM 189 SG CYS A 61 -5.903 2.181 -4.659 1.00 0.00 S ATOM 190 H CYS A 61 -7.168 -0.500 -1.539 1.00 0.00 H ATOM 191 HA CYS A 61 -5.127 1.608 -1.929 1.00 0.00 H ATOM 192 HB2 CYS A 61 -5.785 -0.012 -3.695 1.00 0.00 H ATOM 193 HB3 CYS A 61 -7.425 0.622 -3.646 1.00 0.00 H ATOM 194 N LYS A 62 -6.510 3.667 -1.518 1.00 0.00 N ATOM 195 CA LYS A 62 -7.333 4.862 -1.188 1.00 0.00 C ATOM 196 C LYS A 62 -6.891 6.056 -2.044 1.00 0.00 C ATOM 197 O LYS A 62 -5.712 6.256 -2.269 1.00 0.00 O ATOM 198 CB LYS A 62 -7.072 5.146 0.293 1.00 0.00 C ATOM 199 CG LYS A 62 -8.365 5.600 0.969 1.00 0.00 C ATOM 200 CD LYS A 62 -8.030 6.575 2.105 1.00 0.00 C ATOM 201 CE LYS A 62 -9.325 7.063 2.755 1.00 0.00 C ATOM 202 NZ LYS A 62 -8.906 7.642 4.056 1.00 0.00 N ATOM 203 H LYS A 62 -5.527 3.748 -1.563 1.00 0.00 H ATOM 204 HA LYS A 62 -8.385 4.659 -1.348 1.00 0.00 H ATOM 205 HB2 LYS A 62 -6.707 4.239 0.766 1.00 0.00 H ATOM 206 HB3 LYS A 62 -6.315 5.918 0.389 1.00 0.00 H ATOM 207 HG2 LYS A 62 -8.988 6.099 0.239 1.00 0.00 H ATOM 208 HG3 LYS A 62 -8.883 4.739 1.367 1.00 0.00 H ATOM 209 HD2 LYS A 62 -7.427 6.056 2.846 1.00 0.00 H ATOM 210 HD3 LYS A 62 -7.480 7.406 1.712 1.00 0.00 H ATOM 211 HE2 LYS A 62 -9.790 7.816 2.130 1.00 0.00 H ATOM 212 HE3 LYS A 62 -10.002 6.236 2.924 1.00 0.00 H ATOM 213 HZ1 LYS A 62 -8.212 8.407 3.887 1.00 0.00 H ATOM 214 HZ2 LYS A 62 -9.732 8.031 4.552 1.00 0.00 H ATOM 215 HZ3 LYS A 62 -8.474 6.907 4.647 1.00 0.00 H ATOM 216 N ASP A 63 -7.821 6.838 -2.527 1.00 0.00 N ATOM 217 CA ASP A 63 -7.443 8.013 -3.372 1.00 0.00 C ATOM 218 C ASP A 63 -7.052 9.196 -2.490 1.00 0.00 C ATOM 219 O ASP A 63 -7.689 9.490 -1.494 1.00 0.00 O ATOM 220 CB ASP A 63 -8.707 8.333 -4.191 1.00 0.00 C ATOM 221 CG ASP A 63 -9.875 8.669 -3.256 1.00 0.00 C ATOM 222 OD1 ASP A 63 -9.947 9.801 -2.821 1.00 0.00 O ATOM 223 OD2 ASP A 63 -10.673 7.782 -2.997 1.00 0.00 O ATOM 224 H ASP A 63 -8.760 6.652 -2.329 1.00 0.00 H ATOM 225 HA ASP A 63 -6.634 7.755 -4.034 1.00 0.00 H ATOM 226 HB2 ASP A 63 -8.505 9.182 -4.837 1.00 0.00 H ATOM 227 HB3 ASP A 63 -8.960 7.477 -4.798 1.00 0.00 H ATOM 228 N GLN A 64 -6.003 9.886 -2.846 1.00 0.00 N ATOM 229 CA GLN A 64 -5.564 11.061 -2.036 1.00 0.00 C ATOM 230 C GLN A 64 -5.205 12.237 -2.950 1.00 0.00 C ATOM 231 O GLN A 64 -4.048 12.552 -3.139 1.00 0.00 O ATOM 232 CB GLN A 64 -4.326 10.572 -1.275 1.00 0.00 C ATOM 233 CG GLN A 64 -4.758 9.639 -0.141 1.00 0.00 C ATOM 234 CD GLN A 64 -5.499 10.435 0.926 1.00 0.00 C ATOM 235 OE1 GLN A 64 -6.707 10.554 0.881 1.00 0.00 O ATOM 236 NE2 GLN A 64 -4.829 11.001 1.891 1.00 0.00 N ATOM 237 H GLN A 64 -5.506 9.632 -3.653 1.00 0.00 H ATOM 238 HA GLN A 64 -6.332 11.344 -1.331 1.00 0.00 H ATOM 239 HB2 GLN A 64 -3.669 10.035 -1.959 1.00 0.00 H ATOM 240 HB3 GLN A 64 -3.799 11.418 -0.859 1.00 0.00 H ATOM 241 HG2 GLN A 64 -5.406 8.865 -0.539 1.00 0.00 H ATOM 242 HG3 GLN A 64 -3.883 9.181 0.303 1.00 0.00 H ATOM 243 HE21 GLN A 64 -3.854 10.903 1.927 1.00 0.00 H ATOM 244 HE22 GLN A 64 -5.291 11.523 2.583 1.00 0.00 H ATOM 245 N LEU A 65 -6.202 12.871 -3.530 1.00 0.00 N ATOM 246 CA LEU A 65 -5.939 14.022 -4.449 1.00 0.00 C ATOM 247 C LEU A 65 -4.955 13.625 -5.550 1.00 0.00 C ATOM 248 O LEU A 65 -3.757 13.634 -5.360 1.00 0.00 O ATOM 249 CB LEU A 65 -5.336 15.129 -3.561 1.00 0.00 C ATOM 250 CG LEU A 65 -6.087 16.453 -3.767 1.00 0.00 C ATOM 251 CD1 LEU A 65 -6.004 16.881 -5.236 1.00 0.00 C ATOM 252 CD2 LEU A 65 -7.563 16.283 -3.359 1.00 0.00 C ATOM 253 H LEU A 65 -7.121 12.577 -3.361 1.00 0.00 H ATOM 254 HA LEU A 65 -6.864 14.368 -4.886 1.00 0.00 H ATOM 255 HB2 LEU A 65 -5.420 14.836 -2.524 1.00 0.00 H ATOM 256 HB3 LEU A 65 -4.296 15.274 -3.817 1.00 0.00 H ATOM 257 HG LEU A 65 -5.635 17.221 -3.146 1.00 0.00 H ATOM 258 HD11 LEU A 65 -4.979 16.841 -5.561 1.00 0.00 H ATOM 259 HD12 LEU A 65 -6.609 16.216 -5.843 1.00 0.00 H ATOM 260 HD13 LEU A 65 -6.380 17.893 -5.333 1.00 0.00 H ATOM 261 HD21 LEU A 65 -7.824 15.233 -3.365 1.00 0.00 H ATOM 262 HD22 LEU A 65 -7.703 16.686 -2.371 1.00 0.00 H ATOM 263 HD23 LEU A 65 -8.188 16.813 -4.061 1.00 0.00 H ATOM 264 N GLN A 66 -5.468 13.272 -6.711 1.00 0.00 N ATOM 265 CA GLN A 66 -4.582 12.861 -7.863 1.00 0.00 C ATOM 266 C GLN A 66 -3.795 11.588 -7.508 1.00 0.00 C ATOM 267 O GLN A 66 -4.127 10.506 -7.941 1.00 0.00 O ATOM 268 CB GLN A 66 -3.631 14.042 -8.126 1.00 0.00 C ATOM 269 CG GLN A 66 -3.852 14.577 -9.545 1.00 0.00 C ATOM 270 CD GLN A 66 -2.651 15.426 -9.969 1.00 0.00 C ATOM 271 OE1 GLN A 66 -1.653 14.898 -10.422 1.00 0.00 O ATOM 272 NE2 GLN A 66 -2.704 16.724 -9.830 1.00 0.00 N ATOM 273 H GLN A 66 -6.438 13.274 -6.839 1.00 0.00 H ATOM 274 HA GLN A 66 -5.182 12.675 -8.738 1.00 0.00 H ATOM 275 HB2 GLN A 66 -3.823 14.830 -7.413 1.00 0.00 H ATOM 276 HB3 GLN A 66 -2.602 13.709 -8.029 1.00 0.00 H ATOM 277 HG2 GLN A 66 -3.969 13.754 -10.233 1.00 0.00 H ATOM 278 HG3 GLN A 66 -4.745 15.189 -9.562 1.00 0.00 H ATOM 279 HE21 GLN A 66 -3.508 17.146 -9.467 1.00 0.00 H ATOM 280 HE22 GLN A 66 -1.936 17.274 -10.100 1.00 0.00 H ATOM 281 N SER A 67 -2.756 11.719 -6.725 1.00 0.00 N ATOM 282 CA SER A 67 -1.940 10.522 -6.342 1.00 0.00 C ATOM 283 C SER A 67 -2.811 9.528 -5.563 1.00 0.00 C ATOM 284 O SER A 67 -4.025 9.624 -5.543 1.00 0.00 O ATOM 285 CB SER A 67 -0.815 11.054 -5.455 1.00 0.00 C ATOM 286 OG SER A 67 -1.351 11.436 -4.194 1.00 0.00 O ATOM 287 H SER A 67 -2.513 12.605 -6.384 1.00 0.00 H ATOM 288 HA SER A 67 -1.533 10.055 -7.216 1.00 0.00 H ATOM 289 HB2 SER A 67 -0.077 10.286 -5.310 1.00 0.00 H ATOM 290 HB3 SER A 67 -0.363 11.908 -5.941 1.00 0.00 H ATOM 291 HG SER A 67 -1.071 10.793 -3.544 1.00 0.00 H ATOM 292 N TYR A 68 -2.190 8.570 -4.912 1.00 0.00 N ATOM 293 CA TYR A 68 -2.973 7.565 -4.129 1.00 0.00 C ATOM 294 C TYR A 68 -2.145 7.053 -2.944 1.00 0.00 C ATOM 295 O TYR A 68 -0.988 7.386 -2.791 1.00 0.00 O ATOM 296 CB TYR A 68 -3.268 6.415 -5.112 1.00 0.00 C ATOM 297 CG TYR A 68 -1.972 5.866 -5.666 1.00 0.00 C ATOM 298 CD1 TYR A 68 -1.382 6.447 -6.792 1.00 0.00 C ATOM 299 CD2 TYR A 68 -1.361 4.766 -5.051 1.00 0.00 C ATOM 300 CE1 TYR A 68 -0.183 5.927 -7.302 1.00 0.00 C ATOM 301 CE2 TYR A 68 -0.162 4.246 -5.561 1.00 0.00 C ATOM 302 CZ TYR A 68 0.427 4.827 -6.687 1.00 0.00 C ATOM 303 OH TYR A 68 1.602 4.322 -7.189 1.00 0.00 O ATOM 304 H TYR A 68 -1.211 8.511 -4.943 1.00 0.00 H ATOM 305 HA TYR A 68 -3.898 7.993 -3.787 1.00 0.00 H ATOM 306 HB2 TYR A 68 -3.792 5.633 -4.596 1.00 0.00 H ATOM 307 HB3 TYR A 68 -3.870 6.791 -5.924 1.00 0.00 H ATOM 308 HD1 TYR A 68 -1.853 7.291 -7.271 1.00 0.00 H ATOM 309 HD2 TYR A 68 -1.817 4.316 -4.180 1.00 0.00 H ATOM 310 HE1 TYR A 68 0.273 6.377 -8.172 1.00 0.00 H ATOM 311 HE2 TYR A 68 0.302 3.395 -5.079 1.00 0.00 H ATOM 312 HH TYR A 68 2.200 5.051 -7.355 1.00 0.00 H ATOM 313 N ILE A 69 -2.740 6.244 -2.108 1.00 0.00 N ATOM 314 CA ILE A 69 -2.015 5.700 -0.925 1.00 0.00 C ATOM 315 C ILE A 69 -2.450 4.256 -0.681 1.00 0.00 C ATOM 316 O ILE A 69 -3.614 3.981 -0.486 1.00 0.00 O ATOM 317 CB ILE A 69 -2.405 6.612 0.244 1.00 0.00 C ATOM 318 CG1 ILE A 69 -1.702 6.132 1.514 1.00 0.00 C ATOM 319 CG2 ILE A 69 -3.916 6.576 0.456 1.00 0.00 C ATOM 320 CD1 ILE A 69 -1.949 7.138 2.648 1.00 0.00 C ATOM 321 H ILE A 69 -3.679 5.993 -2.255 1.00 0.00 H ATOM 322 HA ILE A 69 -0.953 5.746 -1.090 1.00 0.00 H ATOM 323 HB ILE A 69 -2.100 7.625 0.023 1.00 0.00 H ATOM 324 HG12 ILE A 69 -2.082 5.169 1.806 1.00 0.00 H ATOM 325 HG13 ILE A 69 -0.640 6.049 1.330 1.00 0.00 H ATOM 326 HG21 ILE A 69 -4.409 6.682 -0.496 1.00 0.00 H ATOM 327 HG22 ILE A 69 -4.186 5.640 0.908 1.00 0.00 H ATOM 328 HG23 ILE A 69 -4.204 7.389 1.113 1.00 0.00 H ATOM 329 HD11 ILE A 69 -2.128 8.118 2.217 1.00 0.00 H ATOM 330 HD12 ILE A 69 -2.795 6.834 3.225 1.00 0.00 H ATOM 331 HD13 ILE A 69 -1.070 7.177 3.282 1.00 0.00 H ATOM 332 N CYS A 70 -1.508 3.335 -0.702 1.00 0.00 N ATOM 333 CA CYS A 70 -1.870 1.900 -0.473 1.00 0.00 C ATOM 334 C CYS A 70 -1.765 1.562 1.012 1.00 0.00 C ATOM 335 O CYS A 70 -0.811 1.898 1.672 1.00 0.00 O ATOM 336 CB CYS A 70 -0.841 1.107 -1.280 1.00 0.00 C ATOM 337 SG CYS A 70 -1.117 1.358 -3.049 1.00 0.00 S ATOM 338 H CYS A 70 -0.583 3.584 -0.862 1.00 0.00 H ATOM 339 HA CYS A 70 -2.864 1.703 -0.840 1.00 0.00 H ATOM 340 HB2 CYS A 70 0.148 1.439 -1.015 1.00 0.00 H ATOM 341 HB3 CYS A 70 -0.949 0.062 -1.050 1.00 0.00 H ATOM 342 N PHE A 71 -2.751 0.875 1.534 1.00 0.00 N ATOM 343 CA PHE A 71 -2.727 0.489 2.972 1.00 0.00 C ATOM 344 C PHE A 71 -2.340 -0.987 3.099 1.00 0.00 C ATOM 345 O PHE A 71 -3.130 -1.815 3.495 1.00 0.00 O ATOM 346 CB PHE A 71 -4.145 0.716 3.481 1.00 0.00 C ATOM 347 CG PHE A 71 -4.345 2.181 3.776 1.00 0.00 C ATOM 348 CD1 PHE A 71 -3.818 2.745 4.936 1.00 0.00 C ATOM 349 CD2 PHE A 71 -5.067 2.981 2.874 1.00 0.00 C ATOM 350 CE1 PHE A 71 -4.001 4.107 5.211 1.00 0.00 C ATOM 351 CE2 PHE A 71 -5.249 4.342 3.149 1.00 0.00 C ATOM 352 CZ PHE A 71 -4.715 4.903 4.314 1.00 0.00 C ATOM 353 H PHE A 71 -3.515 0.609 0.983 1.00 0.00 H ATOM 354 HA PHE A 71 -2.036 1.111 3.519 1.00 0.00 H ATOM 355 HB2 PHE A 71 -4.851 0.398 2.728 1.00 0.00 H ATOM 356 HB3 PHE A 71 -4.308 0.150 4.383 1.00 0.00 H ATOM 357 HD1 PHE A 71 -3.267 2.136 5.629 1.00 0.00 H ATOM 358 HD2 PHE A 71 -5.476 2.547 1.977 1.00 0.00 H ATOM 359 HE1 PHE A 71 -3.585 4.548 6.105 1.00 0.00 H ATOM 360 HE2 PHE A 71 -5.808 4.957 2.451 1.00 0.00 H ATOM 361 HZ PHE A 71 -4.860 5.963 4.518 1.00 0.00 H ATOM 362 N CYS A 72 -1.125 -1.312 2.740 1.00 0.00 N ATOM 363 CA CYS A 72 -0.665 -2.739 2.811 1.00 0.00 C ATOM 364 C CYS A 72 -0.263 -3.091 4.241 1.00 0.00 C ATOM 365 O CYS A 72 -0.507 -2.355 5.171 1.00 0.00 O ATOM 366 CB CYS A 72 0.538 -2.808 1.877 1.00 0.00 C ATOM 367 SG CYS A 72 -0.003 -2.491 0.184 1.00 0.00 S ATOM 368 H CYS A 72 -0.514 -0.617 2.412 1.00 0.00 H ATOM 369 HA CYS A 72 -1.438 -3.395 2.460 1.00 0.00 H ATOM 370 HB2 CYS A 72 1.269 -2.061 2.175 1.00 0.00 H ATOM 371 HB3 CYS A 72 0.987 -3.794 1.934 1.00 0.00 H ATOM 372 N LEU A 73 0.353 -4.237 4.408 1.00 0.00 N ATOM 373 CA LEU A 73 0.790 -4.668 5.779 1.00 0.00 C ATOM 374 C LEU A 73 2.056 -3.895 6.191 1.00 0.00 C ATOM 375 O LEU A 73 2.768 -3.392 5.345 1.00 0.00 O ATOM 376 CB LEU A 73 1.071 -6.162 5.652 1.00 0.00 C ATOM 377 CG LEU A 73 -0.060 -6.969 6.303 1.00 0.00 C ATOM 378 CD1 LEU A 73 -1.314 -6.876 5.440 1.00 0.00 C ATOM 379 CD2 LEU A 73 0.361 -8.434 6.431 1.00 0.00 C ATOM 380 H LEU A 73 0.537 -4.817 3.641 1.00 0.00 H ATOM 381 HA LEU A 73 -0.001 -4.492 6.495 1.00 0.00 H ATOM 382 HB2 LEU A 73 1.142 -6.430 4.611 1.00 0.00 H ATOM 383 HB3 LEU A 73 2.001 -6.395 6.145 1.00 0.00 H ATOM 384 HG LEU A 73 -0.265 -6.563 7.285 1.00 0.00 H ATOM 385 HD11 LEU A 73 -1.044 -7.029 4.401 1.00 0.00 H ATOM 386 HD12 LEU A 73 -2.021 -7.638 5.743 1.00 0.00 H ATOM 387 HD13 LEU A 73 -1.766 -5.895 5.551 1.00 0.00 H ATOM 388 HD21 LEU A 73 0.910 -8.730 5.555 1.00 0.00 H ATOM 389 HD22 LEU A 73 0.997 -8.547 7.297 1.00 0.00 H ATOM 390 HD23 LEU A 73 -0.513 -9.045 6.543 1.00 0.00 H ATOM 391 N PRO A 74 2.303 -3.824 7.484 1.00 0.00 N ATOM 392 CA PRO A 74 3.497 -3.088 7.982 1.00 0.00 C ATOM 393 C PRO A 74 4.797 -3.777 7.547 1.00 0.00 C ATOM 394 O PRO A 74 5.869 -3.201 7.650 1.00 0.00 O ATOM 395 CB PRO A 74 3.323 -3.125 9.504 1.00 0.00 C ATOM 396 CG PRO A 74 2.461 -4.312 9.756 1.00 0.00 C ATOM 397 CD PRO A 74 1.531 -4.414 8.584 1.00 0.00 C ATOM 398 HA PRO A 74 3.473 -2.072 7.639 1.00 0.00 H ATOM 399 HB2 PRO A 74 4.288 -3.237 9.980 1.00 0.00 H ATOM 400 HB3 PRO A 74 2.843 -2.227 9.848 1.00 0.00 H ATOM 401 HG2 PRO A 74 3.067 -5.206 9.835 1.00 0.00 H ATOM 402 HG3 PRO A 74 1.900 -4.168 10.666 1.00 0.00 H ATOM 403 HD2 PRO A 74 1.282 -5.453 8.380 1.00 0.00 H ATOM 404 HD3 PRO A 74 0.631 -3.837 8.757 1.00 0.00 H ATOM 405 N ALA A 75 4.722 -4.995 7.062 1.00 0.00 N ATOM 406 CA ALA A 75 5.960 -5.699 6.623 1.00 0.00 C ATOM 407 C ALA A 75 6.141 -5.563 5.103 1.00 0.00 C ATOM 408 O ALA A 75 6.852 -6.345 4.490 1.00 0.00 O ATOM 409 CB ALA A 75 5.738 -7.156 7.004 1.00 0.00 C ATOM 410 H ALA A 75 3.851 -5.433 6.981 1.00 0.00 H ATOM 411 HA ALA A 75 6.818 -5.306 7.140 1.00 0.00 H ATOM 412 HB1 ALA A 75 4.851 -7.535 6.520 1.00 0.00 H ATOM 413 HB2 ALA A 75 6.593 -7.750 6.705 1.00 0.00 H ATOM 414 HB3 ALA A 75 5.612 -7.238 8.077 1.00 0.00 H ATOM 415 N PHE A 76 5.501 -4.601 4.482 1.00 0.00 N ATOM 416 CA PHE A 76 5.643 -4.433 3.006 1.00 0.00 C ATOM 417 C PHE A 76 6.138 -3.018 2.673 1.00 0.00 C ATOM 418 O PHE A 76 6.046 -2.109 3.473 1.00 0.00 O ATOM 419 CB PHE A 76 4.237 -4.646 2.460 1.00 0.00 C ATOM 420 CG PHE A 76 3.837 -6.087 2.659 1.00 0.00 C ATOM 421 CD1 PHE A 76 3.509 -6.539 3.944 1.00 0.00 C ATOM 422 CD2 PHE A 76 3.792 -6.968 1.575 1.00 0.00 C ATOM 423 CE1 PHE A 76 3.130 -7.866 4.140 1.00 0.00 C ATOM 424 CE2 PHE A 76 3.412 -8.296 1.771 1.00 0.00 C ATOM 425 CZ PHE A 76 3.085 -8.747 3.056 1.00 0.00 C ATOM 426 H PHE A 76 4.928 -3.978 4.995 1.00 0.00 H ATOM 427 HA PHE A 76 6.311 -5.173 2.604 1.00 0.00 H ATOM 428 HB2 PHE A 76 3.538 -3.999 2.975 1.00 0.00 H ATOM 429 HB3 PHE A 76 4.225 -4.419 1.399 1.00 0.00 H ATOM 430 HD1 PHE A 76 3.546 -5.861 4.783 1.00 0.00 H ATOM 431 HD2 PHE A 76 4.047 -6.614 0.587 1.00 0.00 H ATOM 432 HE1 PHE A 76 2.881 -8.225 5.133 1.00 0.00 H ATOM 433 HE2 PHE A 76 3.375 -8.974 0.932 1.00 0.00 H ATOM 434 HZ PHE A 76 2.792 -9.779 3.205 1.00 0.00 H ATOM 435 N GLU A 77 6.670 -2.844 1.493 1.00 0.00 N ATOM 436 CA GLU A 77 7.178 -1.495 1.084 1.00 0.00 C ATOM 437 C GLU A 77 7.048 -1.307 -0.423 1.00 0.00 C ATOM 438 O GLU A 77 6.720 -2.225 -1.155 1.00 0.00 O ATOM 439 CB GLU A 77 8.646 -1.493 1.511 1.00 0.00 C ATOM 440 CG GLU A 77 9.022 -0.115 2.052 1.00 0.00 C ATOM 441 CD GLU A 77 8.831 -0.079 3.567 1.00 0.00 C ATOM 442 OE1 GLU A 77 7.693 -0.067 4.001 1.00 0.00 O ATOM 443 OE2 GLU A 77 9.829 -0.096 4.273 1.00 0.00 O ATOM 444 H GLU A 77 6.737 -3.588 0.856 1.00 0.00 H ATOM 445 HA GLU A 77 6.647 -0.726 1.613 1.00 0.00 H ATOM 446 HB2 GLU A 77 8.808 -2.230 2.278 1.00 0.00 H ATOM 447 HB3 GLU A 77 9.269 -1.720 0.652 1.00 0.00 H ATOM 448 HG2 GLU A 77 10.056 0.105 1.814 1.00 0.00 H ATOM 449 HG3 GLU A 77 8.388 0.638 1.601 1.00 0.00 H ATOM 450 N GLY A 78 7.307 -0.118 -0.902 1.00 0.00 N ATOM 451 CA GLY A 78 7.209 0.152 -2.361 1.00 0.00 C ATOM 452 C GLY A 78 6.015 1.063 -2.636 1.00 0.00 C ATOM 453 O GLY A 78 5.018 1.023 -1.925 1.00 0.00 O ATOM 454 H GLY A 78 7.579 0.602 -0.289 1.00 0.00 H ATOM 455 HA2 GLY A 78 8.113 0.631 -2.709 1.00 0.00 H ATOM 456 HA3 GLY A 78 7.078 -0.778 -2.895 1.00 0.00 H ATOM 457 N ARG A 79 6.094 1.881 -3.658 1.00 0.00 N ATOM 458 CA ARG A 79 4.948 2.797 -3.976 1.00 0.00 C ATOM 459 C ARG A 79 3.683 1.983 -4.256 1.00 0.00 C ATOM 460 O ARG A 79 2.616 2.287 -3.755 1.00 0.00 O ATOM 461 CB ARG A 79 5.379 3.560 -5.239 1.00 0.00 C ATOM 462 CG ARG A 79 4.317 4.585 -5.592 1.00 0.00 C ATOM 463 CD ARG A 79 4.680 5.935 -4.982 1.00 0.00 C ATOM 464 NE ARG A 79 3.376 6.531 -4.529 1.00 0.00 N ATOM 465 CZ ARG A 79 3.340 7.605 -3.774 1.00 0.00 C ATOM 466 NH1 ARG A 79 4.424 8.084 -3.201 1.00 0.00 N ATOM 467 NH2 ARG A 79 2.193 8.207 -3.567 1.00 0.00 N ATOM 468 H ARG A 79 6.898 1.895 -4.206 1.00 0.00 H ATOM 469 HA ARG A 79 4.777 3.492 -3.163 1.00 0.00 H ATOM 470 HB2 ARG A 79 6.318 4.064 -5.038 1.00 0.00 H ATOM 471 HB3 ARG A 79 5.507 2.865 -6.050 1.00 0.00 H ATOM 472 HG2 ARG A 79 4.261 4.683 -6.671 1.00 0.00 H ATOM 473 HG3 ARG A 79 3.365 4.259 -5.217 1.00 0.00 H ATOM 474 HD2 ARG A 79 5.336 5.806 -4.138 1.00 0.00 H ATOM 475 HD3 ARG A 79 5.125 6.581 -5.721 1.00 0.00 H ATOM 476 HE ARG A 79 2.531 6.108 -4.805 1.00 0.00 H ATOM 477 HH11 ARG A 79 5.309 7.628 -3.341 1.00 0.00 H ATOM 478 HH12 ARG A 79 4.363 8.896 -2.626 1.00 0.00 H ATOM 479 HH21 ARG A 79 1.367 7.845 -3.985 1.00 0.00 H ATOM 480 HH22 ARG A 79 2.155 9.022 -3.001 1.00 0.00 H ATOM 481 N ASN A 80 3.805 0.944 -5.041 1.00 0.00 N ATOM 482 CA ASN A 80 2.622 0.093 -5.349 1.00 0.00 C ATOM 483 C ASN A 80 2.672 -1.192 -4.519 1.00 0.00 C ATOM 484 O ASN A 80 2.153 -2.217 -4.914 1.00 0.00 O ATOM 485 CB ASN A 80 2.743 -0.238 -6.840 1.00 0.00 C ATOM 486 CG ASN A 80 2.477 1.030 -7.660 1.00 0.00 C ATOM 487 OD1 ASN A 80 3.251 1.372 -8.524 1.00 0.00 O ATOM 488 ND2 ASN A 80 1.410 1.739 -7.410 1.00 0.00 N ATOM 489 H ASN A 80 4.677 0.717 -5.418 1.00 0.00 H ATOM 490 HA ASN A 80 1.711 0.617 -5.152 1.00 0.00 H ATOM 491 HB2 ASN A 80 3.733 -0.594 -7.053 1.00 0.00 H ATOM 492 HB3 ASN A 80 2.023 -0.994 -7.104 1.00 0.00 H ATOM 493 HD21 ASN A 80 0.795 1.459 -6.706 1.00 0.00 H ATOM 494 HD22 ASN A 80 1.232 2.552 -7.933 1.00 0.00 H ATOM 495 N CYS A 81 3.319 -1.148 -3.374 1.00 0.00 N ATOM 496 CA CYS A 81 3.433 -2.360 -2.507 1.00 0.00 C ATOM 497 C CYS A 81 4.008 -3.541 -3.290 1.00 0.00 C ATOM 498 O CYS A 81 3.451 -4.615 -3.314 1.00 0.00 O ATOM 499 CB CYS A 81 2.010 -2.660 -2.039 1.00 0.00 C ATOM 500 SG CYS A 81 1.567 -1.567 -0.674 1.00 0.00 S ATOM 501 H CYS A 81 3.737 -0.316 -3.089 1.00 0.00 H ATOM 502 HA CYS A 81 4.052 -2.143 -1.650 1.00 0.00 H ATOM 503 HB2 CYS A 81 1.319 -2.511 -2.855 1.00 0.00 H ATOM 504 HB3 CYS A 81 1.951 -3.687 -1.707 1.00 0.00 H ATOM 505 N GLU A 82 5.130 -3.346 -3.919 1.00 0.00 N ATOM 506 CA GLU A 82 5.760 -4.461 -4.699 1.00 0.00 C ATOM 507 C GLU A 82 7.070 -4.904 -4.032 1.00 0.00 C ATOM 508 O GLU A 82 7.929 -5.486 -4.669 1.00 0.00 O ATOM 509 CB GLU A 82 6.026 -3.876 -6.086 1.00 0.00 C ATOM 510 CG GLU A 82 6.924 -2.641 -5.983 1.00 0.00 C ATOM 511 CD GLU A 82 7.880 -2.590 -7.182 1.00 0.00 C ATOM 512 OE1 GLU A 82 7.425 -2.863 -8.274 1.00 0.00 O ATOM 513 OE2 GLU A 82 9.040 -2.277 -6.975 1.00 0.00 O ATOM 514 H GLU A 82 5.562 -2.469 -3.880 1.00 0.00 H ATOM 515 HA GLU A 82 5.081 -5.286 -4.774 1.00 0.00 H ATOM 516 HB2 GLU A 82 6.523 -4.624 -6.703 1.00 0.00 H ATOM 517 HB3 GLU A 82 5.092 -3.596 -6.552 1.00 0.00 H ATOM 518 HG2 GLU A 82 6.319 -1.750 -5.970 1.00 0.00 H ATOM 519 HG3 GLU A 82 7.507 -2.690 -5.064 1.00 0.00 H ATOM 520 N THR A 83 7.226 -4.642 -2.751 1.00 0.00 N ATOM 521 CA THR A 83 8.476 -5.050 -2.048 1.00 0.00 C ATOM 522 C THR A 83 8.158 -5.578 -0.653 1.00 0.00 C ATOM 523 O THR A 83 7.648 -4.858 0.185 1.00 0.00 O ATOM 524 CB THR A 83 9.312 -3.772 -1.954 1.00 0.00 C ATOM 525 OG1 THR A 83 9.500 -3.235 -3.261 1.00 0.00 O ATOM 526 CG2 THR A 83 10.677 -4.098 -1.334 1.00 0.00 C ATOM 527 H THR A 83 6.520 -4.178 -2.255 1.00 0.00 H ATOM 528 HA THR A 83 9.002 -5.793 -2.623 1.00 0.00 H ATOM 529 HB THR A 83 8.803 -3.054 -1.331 1.00 0.00 H ATOM 530 HG1 THR A 83 9.058 -2.381 -3.294 1.00 0.00 H ATOM 531 HG21 THR A 83 10.526 -4.530 -0.350 1.00 0.00 H ATOM 532 HG22 THR A 83 11.198 -4.802 -1.964 1.00 0.00 H ATOM 533 HG23 THR A 83 11.256 -3.193 -1.242 1.00 0.00 H ATOM 534 N HIS A 84 8.440 -6.831 -0.413 1.00 0.00 N ATOM 535 CA HIS A 84 8.145 -7.421 0.933 1.00 0.00 C ATOM 536 C HIS A 84 9.295 -7.134 1.895 1.00 0.00 C ATOM 537 O HIS A 84 10.323 -7.788 1.861 1.00 0.00 O ATOM 538 CB HIS A 84 8.019 -8.923 0.686 1.00 0.00 C ATOM 539 CG HIS A 84 7.612 -9.613 1.964 1.00 0.00 C ATOM 540 ND1 HIS A 84 6.441 -10.354 2.059 1.00 0.00 N ATOM 541 CD2 HIS A 84 8.204 -9.684 3.193 1.00 0.00 C ATOM 542 CE1 HIS A 84 6.381 -10.834 3.318 1.00 0.00 C ATOM 543 NE2 HIS A 84 7.427 -10.447 4.052 1.00 0.00 N ATOM 544 H HIS A 84 8.841 -7.385 -1.108 1.00 0.00 H ATOM 545 HA HIS A 84 7.218 -7.026 1.325 1.00 0.00 H ATOM 546 HB2 HIS A 84 7.264 -9.102 -0.068 1.00 0.00 H ATOM 547 HB3 HIS A 84 8.960 -9.320 0.351 1.00 0.00 H ATOM 548 HD1 HIS A 84 5.785 -10.505 1.348 1.00 0.00 H ATOM 549 HD2 HIS A 84 9.136 -9.202 3.460 1.00 0.00 H ATOM 550 HE1 HIS A 84 5.565 -11.450 3.689 1.00 0.00 H ATOM 551 N LYS A 85 9.128 -6.174 2.765 1.00 0.00 N ATOM 552 CA LYS A 85 10.209 -5.826 3.741 1.00 0.00 C ATOM 553 C LYS A 85 9.924 -6.485 5.089 1.00 0.00 C ATOM 554 O LYS A 85 9.261 -5.920 5.940 1.00 0.00 O ATOM 555 CB LYS A 85 10.164 -4.317 3.864 1.00 0.00 C ATOM 556 CG LYS A 85 10.893 -3.684 2.671 1.00 0.00 C ATOM 557 CD LYS A 85 12.386 -3.989 2.772 1.00 0.00 C ATOM 558 CE LYS A 85 13.177 -2.856 2.112 1.00 0.00 C ATOM 559 NZ LYS A 85 13.434 -3.322 0.717 1.00 0.00 N ATOM 560 H LYS A 85 8.290 -5.664 2.775 1.00 0.00 H ATOM 561 HA LYS A 85 11.160 -6.147 3.364 1.00 0.00 H ATOM 562 HB2 LYS A 85 9.133 -3.974 3.874 1.00 0.00 H ATOM 563 HB3 LYS A 85 10.648 -4.012 4.774 1.00 0.00 H ATOM 564 HG2 LYS A 85 10.498 -4.100 1.751 1.00 0.00 H ATOM 565 HG3 LYS A 85 10.740 -2.620 2.679 1.00 0.00 H ATOM 566 HD2 LYS A 85 12.669 -4.069 3.805 1.00 0.00 H ATOM 567 HD3 LYS A 85 12.592 -4.919 2.258 1.00 0.00 H ATOM 568 HE2 LYS A 85 12.601 -1.943 2.103 1.00 0.00 H ATOM 569 HE3 LYS A 85 14.114 -2.708 2.628 1.00 0.00 H ATOM 570 HZ1 LYS A 85 12.529 -3.539 0.248 1.00 0.00 H ATOM 571 HZ2 LYS A 85 13.937 -2.584 0.191 1.00 0.00 H ATOM 572 HZ3 LYS A 85 14.015 -4.186 0.742 1.00 0.00 H ATOM 573 N ASP A 86 10.418 -7.680 5.301 1.00 0.00 N ATOM 574 CA ASP A 86 10.174 -8.376 6.599 1.00 0.00 C ATOM 575 C ASP A 86 11.345 -8.127 7.555 1.00 0.00 C ATOM 576 O ASP A 86 11.159 -7.957 8.742 1.00 0.00 O ATOM 577 CB ASP A 86 10.091 -9.859 6.233 1.00 0.00 C ATOM 578 CG ASP A 86 9.747 -10.670 7.489 1.00 0.00 C ATOM 579 OD1 ASP A 86 8.619 -10.586 7.935 1.00 0.00 O ATOM 580 OD2 ASP A 86 10.629 -11.370 7.976 1.00 0.00 O ATOM 581 H ASP A 86 10.947 -8.112 4.597 1.00 0.00 H ATOM 582 HA ASP A 86 9.250 -8.049 7.041 1.00 0.00 H ATOM 583 HB2 ASP A 86 9.323 -10.004 5.490 1.00 0.00 H ATOM 584 HB3 ASP A 86 11.046 -10.192 5.841 1.00 0.00 H ATOM 585 N ASP A 87 12.555 -8.115 7.045 1.00 0.00 N ATOM 586 CA ASP A 87 13.739 -7.879 7.913 1.00 0.00 C ATOM 587 C ASP A 87 14.432 -6.574 7.520 1.00 0.00 C ATOM 588 O ASP A 87 14.969 -5.874 8.365 1.00 0.00 O ATOM 589 CB ASP A 87 14.672 -9.078 7.678 1.00 0.00 C ATOM 590 CG ASP A 87 15.026 -9.172 6.196 1.00 0.00 C ATOM 591 OD1 ASP A 87 14.147 -9.387 5.388 1.00 0.00 O ATOM 592 OD2 ASP A 87 16.204 -9.028 5.885 1.00 0.00 O ATOM 593 H ASP A 87 12.677 -8.262 6.079 1.00 0.00 H ATOM 594 HA ASP A 87 13.444 -7.851 8.951 1.00 0.00 H ATOM 595 HB2 ASP A 87 15.567 -8.956 8.267 1.00 0.00 H ATOM 596 HB3 ASP A 87 14.161 -9.982 7.971 1.00 0.00 H ATOM 597 N GLY A 88 14.420 -6.250 6.258 1.00 0.00 N ATOM 598 CA GLY A 88 15.077 -4.987 5.799 1.00 0.00 C ATOM 599 C GLY A 88 16.099 -5.308 4.715 1.00 0.00 C ATOM 600 O GLY A 88 16.246 -4.571 3.757 1.00 0.00 O ATOM 601 H GLY A 88 13.974 -6.825 5.610 1.00 0.00 H ATOM 602 HA2 GLY A 88 14.324 -4.312 5.401 1.00 0.00 H ATOM 603 HA3 GLY A 88 15.569 -4.515 6.637 1.00 0.00 H ATOM 604 N SER A 89 16.806 -6.407 4.857 1.00 0.00 N ATOM 605 CA SER A 89 17.835 -6.805 3.845 1.00 0.00 C ATOM 606 C SER A 89 18.867 -5.680 3.632 1.00 0.00 C ATOM 607 O SER A 89 19.901 -5.666 4.260 1.00 0.00 O ATOM 608 CB SER A 89 17.052 -7.112 2.558 1.00 0.00 C ATOM 609 OG SER A 89 17.967 -7.359 1.494 1.00 0.00 O ATOM 610 H SER A 89 16.653 -6.981 5.641 1.00 0.00 H ATOM 611 HA SER A 89 18.336 -7.710 4.173 1.00 0.00 H ATOM 612 HB2 SER A 89 16.433 -7.979 2.706 1.00 0.00 H ATOM 613 HB3 SER A 89 16.427 -6.269 2.308 1.00 0.00 H ATOM 614 HG SER A 89 18.413 -8.189 1.676 1.00 0.00 H ATOM 615 N ALA A 90 18.591 -4.748 2.754 1.00 0.00 N ATOM 616 CA ALA A 90 19.564 -3.638 2.512 1.00 0.00 C ATOM 617 C ALA A 90 18.980 -2.306 3.002 1.00 0.00 C ATOM 618 O ALA A 90 17.779 -2.232 3.158 1.00 0.00 O ATOM 619 CB ALA A 90 19.753 -3.599 0.992 1.00 0.00 C ATOM 620 OXT ALA A 90 19.756 -1.398 3.230 1.00 0.00 O ATOM 621 H ALA A 90 17.751 -4.777 2.250 1.00 0.00 H ATOM 622 HA ALA A 90 20.505 -3.841 2.998 1.00 0.00 H ATOM 623 HB1 ALA A 90 18.905 -4.060 0.514 1.00 0.00 H ATOM 624 HB2 ALA A 90 19.849 -2.578 0.662 1.00 0.00 H ATOM 625 HB3 ALA A 90 20.654 -4.144 0.731 1.00 0.00 H END