REMARK FILENAME="/u/lytle/bc019267/9valid/c74c/refined_input/refined_1.pdb" REMARK Structure ACCEPTED REMARK E-overall: -2049.03 REMARK E-NOE_restraints: 42.8185 REMARK E-CDIH_restraints: 0.148103 REMARK E-COUP_restraints: 0 REMARK E-SANI_restraints: 0 REMARK E-VEAN_restraints: 0 REMARK RMS-NOE_restraints: 3.241544E-02 REMARK RMS-CDIH_restraints: 0.229885 REMARK RMS-COUP_restraints: 0 REMARK RMS-SANI_restraints: 0 REMARK RMS-VEAN_restraints: 0 REMARK NOE Acceptance criterium: 0.5 REMARK NOE violations > 0.5: 0 REMARK All NOE viol. (>0.5,0.4,0.3,0.2,0.1A): 0 0 1 4 20 REMARK CDIH Acceptance criterium: 5 REMARK CDIH violations > 5: 0 REMARK COUP Acceptance criterium: 1 REMARK COUP violations > 1: 0 REMARK SANI Acceptance criterium: 0 REMARK SANI violations > 0: 0 REMARK VEAN Acceptance criterium: 5 REMARK VEAN violations > 5: 0 REMARK DATE:23-Mar-05 23:47:55 created by user: ATOM 10 N ASP 1 1.495 .673 -.579 1.00 .00 ATOM 14 CA ASP 1 2.404 .231 -1.635 1.00 .00 ATOM 8 C ASP 1 2.819 -1.178 -1.322 1.00 .00 ATOM 9 O ASP 1 2.997 -1.507 -.145 1.00 .00 ATOM 2 CB ASP 1 3.655 1.140 -1.685 1.00 .00 ATOM 5 CG ASP 1 4.589 .820 -2.822 1.00 .00 ATOM 6 OD1 ASP 1 4.304 1.241 -3.962 1.00 .00 ATOM 7 OD2 ASP 1 5.633 .179 -2.599 1.00 .00 ATOM 1 HA ASP 1 1.889 0.262 -2.583 1.00 0.00 ATOM 3 HB1 ASP 1 4.205 1.029 -0.762 1.00 0.00 ATOM 4 HB2 ASP 1 3.374 2.173 -1.804 1.00 0.00 ATOM 11 HT1 ASP 1 1.973 0.631 0.343 1.00 0.00 ATOM 12 HT2 ASP 1 0.685 0.021 -0.543 1.00 0.00 ATOM 13 HT3 ASP 1 1.136 1.633 -0.743 1.00 0.00 ATOM 15 N PRO 2 2.931 -2.062 -2.332 1.00 .00 ATOM 16 CA PRO 2 3.414 -3.434 -2.128 1.00 .00 ATOM 27 C PRO 2 4.798 -3.478 -1.450 1.00 .00 ATOM 28 O PRO 2 5.406 -2.447 -1.148 1.00 .00 ATOM 18 CB PRO 2 3.505 -4.001 -3.550 1.00 .00 ATOM 21 CG PRO 2 2.547 -3.189 -4.345 1.00 .00 ATOM 24 CD PRO 2 2.560 -1.815 -3.742 1.00 .00 ATOM 17 HA PRO 2 2.733 -4.030 -1.539 1.00 0.00 ATOM 19 HB1 PRO 2 3.224 -5.044 -3.540 1.00 0.00 ATOM 20 HB2 PRO 2 4.516 -3.905 -3.915 1.00 0.00 ATOM 22 HG1 PRO 2 1.559 -3.620 -4.274 1.00 0.00 ATOM 23 HG2 PRO 2 2.865 -3.151 -5.377 1.00 0.00 ATOM 25 HD1 PRO 2 1.578 -1.372 -3.810 1.00 0.00 ATOM 26 HD2 PRO 2 3.290 -1.189 -4.234 1.00 0.00 ATOM 29 N ASN 3 5.277 -4.664 -1.218 1.00 .00 ATOM 31 CA ASN 3 6.573 -4.882 -.570 1.00 .00 ATOM 41 C ASN 3 7.712 -4.329 -1.419 1.00 .00 ATOM 42 O ASN 3 8.797 -4.028 -.903 1.00 .00 ATOM 33 CB ASN 3 6.775 -6.384 -.316 1.00 .00 ATOM 36 CG ASN 3 8.071 -6.720 .401 1.00 .00 ATOM 37 OD1 ASN 3 8.123 -6.724 1.626 1.00 .00 ATOM 38 ND2 ASN 3 9.104 -7.042 -.343 1.00 .00 ATOM 30 HN ASN 3 4.729 -5.435 -1.477 1.00 0.00 ATOM 32 HA ASN 3 6.560 -4.372 0.379 1.00 0.00 ATOM 34 HB1 ASN 3 6.771 -6.888 -1.269 1.00 0.00 ATOM 35 HB2 ASN 3 5.959 -6.757 0.281 1.00 0.00 ATOM 39 HD21 ASN 3 9.004 -7.050 -1.318 1.00 0.00 ATOM 40 HD22 ASN 3 9.941 -7.278 0.110 1.00 0.00 ATOM 43 N ALA 4 7.431 -4.165 -2.711 1.00 .00 ATOM 45 CA ALA 4 8.389 -3.719 -3.703 1.00 .00 ATOM 51 C ALA 4 9.498 -4.734 -3.834 1.00 .00 ATOM 52 O ALA 4 10.568 -4.602 -3.238 1.00 .00 ATOM 47 CB ALA 4 8.915 -2.293 -3.436 1.00 .00 ATOM 44 HN ALA 4 6.516 -4.350 -3.005 1.00 0.00 ATOM 46 HA ALA 4 7.854 -3.722 -4.644 1.00 0.00 ATOM 48 HB1 ALA 4 9.512 -2.292 -2.536 1.00 0.00 ATOM 49 HB2 ALA 4 8.080 -1.621 -3.292 1.00 0.00 ATOM 50 HB3 ALA 4 9.512 -1.955 -4.270 1.00 0.00 ATOM 53 N GLU 5 9.194 -5.798 -4.540 1.00 .00 ATOM 55 CA GLU 5 10.110 -6.865 -4.715 1.00 .00 ATOM 66 C GLU 5 10.998 -6.605 -5.905 1.00 .00 ATOM 67 O GLU 5 12.163 -6.336 -5.740 1.00 .00 ATOM 57 CB GLU 5 9.382 -8.201 -4.810 1.00 .00 ATOM 60 CG GLU 5 10.298 -9.395 -4.954 1.00 .00 ATOM 63 CD GLU 5 9.550 -10.686 -4.895 1.00 .00 ATOM 64 OE1 GLU 5 9.010 -11.125 -5.915 1.00 .00 ATOM 65 OE2 GLU 5 9.498 -11.301 -3.803 1.00 .00 ATOM 54 HN GLU 5 8.316 -5.864 -4.961 1.00 0.00 ATOM 56 HA GLU 5 10.704 -6.860 -3.818 1.00 0.00 ATOM 58 HB1 GLU 5 8.722 -8.172 -5.664 1.00 0.00 ATOM 59 HB2 GLU 5 8.788 -8.334 -3.918 1.00 0.00 ATOM 61 HG1 GLU 5 11.024 -9.375 -4.156 1.00 0.00 ATOM 62 HG2 GLU 5 10.807 -9.334 -5.905 1.00 0.00 ATOM 68 N PHE 6 10.456 -6.676 -7.100 1.00 .00 ATOM 70 CA PHE 6 11.241 -6.348 -8.234 1.00 .00 ATOM 86 C PHE 6 10.742 -5.086 -8.893 1.00 .00 ATOM 87 O PHE 6 9.553 -4.963 -9.235 1.00 .00 ATOM 72 CB PHE 6 11.315 -7.488 -9.237 1.00 .00 ATOM 75 CG PHE 6 12.229 -7.165 -10.401 1.00 .00 ATOM 76 CD1 PHE 6 13.605 -7.205 -10.248 1.00 .00 ATOM 78 CD2 PHE 6 11.711 -6.796 -11.631 1.00 .00 ATOM 80 CE1 PHE 6 14.442 -6.884 -11.300 1.00 .00 ATOM 82 CE2 PHE 6 12.542 -6.479 -12.684 1.00 .00 ATOM 84 CZ PHE 6 13.911 -6.521 -12.518 1.00 .00 ATOM 69 HN PHE 6 9.535 -6.971 -7.248 1.00 0.00 ATOM 71 HA PHE 6 12.240 -6.154 -7.869 1.00 0.00 ATOM 73 HB1 PHE 6 10.323 -7.674 -9.621 1.00 0.00 ATOM 74 HB2 PHE 6 11.645 -8.368 -8.710 1.00 0.00 ATOM 77 HD1 PHE 6 14.023 -7.491 -9.295 1.00 0.00 ATOM 79 HD2 PHE 6 10.641 -6.764 -11.761 1.00 0.00 ATOM 81 HE1 PHE 6 15.513 -6.919 -11.167 1.00 0.00 ATOM 83 HE2 PHE 6 12.123 -6.193 -13.637 1.00 0.00 ATOM 85 HZ PHE 6 14.563 -6.266 -13.340 1.00 0.00 ATOM 88 N ASP 7 11.634 -4.156 -9.046 1.00 .00 ATOM 90 CA ASP 7 11.372 -2.923 -9.743 1.00 .00 ATOM 98 C ASP 7 12.610 -2.572 -10.554 1.00 .00 ATOM 99 O ASP 7 13.706 -2.563 -10.013 1.00 .00 ATOM 92 CB ASP 7 11.065 -1.789 -8.770 1.00 .00 ATOM 95 CG ASP 7 10.713 -.523 -9.496 1.00 .00 ATOM 96 OD1 ASP 7 11.612 .161 -9.980 1.00 .00 OD2 ATOM 97 OD2 ASP 7 9.513 -.215 -9.619 1.00 .00 OD1 ATOM 89 HN ASP 7 12.532 -4.298 -8.666 1.00 0.00 ATOM 91 HA ASP 7 10.525 -3.090 -10.390 1.00 0.00 ATOM 93 HB1 ASP 7 11.941 -1.598 -8.167 1.00 0.00 ATOM 94 HB2 ASP 7 10.239 -2.067 -8.132 1.00 0.00 ATOM 100 N PRO 8 12.481 -2.303 -11.859 1.00 .00 ATOM 101 CA PRO 8 13.629 -2.001 -12.694 1.00 .00 ATOM 112 C PRO 8 14.071 -.528 -12.663 1.00 .00 ATOM 113 O PRO 8 15.135 -.186 -13.191 1.00 .00 ATOM 103 CB PRO 8 13.184 -2.409 -14.102 1.00 .00 ATOM 106 CG PRO 8 11.703 -2.680 -14.019 1.00 .00 ATOM 109 CD PRO 8 11.242 -2.301 -12.634 1.00 .00 ATOM 102 HA PRO 8 14.472 -2.602 -12.398 1.00 0.00 ATOM 104 HB1 PRO 8 13.726 -3.289 -14.415 1.00 0.00 ATOM 105 HB2 PRO 8 13.395 -1.598 -14.782 1.00 0.00 ATOM 107 HG1 PRO 8 11.516 -3.727 -14.204 1.00 0.00 ATOM 108 HG2 PRO 8 11.186 -2.081 -14.752 1.00 0.00 ATOM 110 HD1 PRO 8 10.555 -3.053 -12.281 1.00 0.00 ATOM 111 HD2 PRO 8 10.778 -1.325 -12.637 1.00 0.00 ATOM 114 N ASP 9 13.291 .334 -12.045 1.00 .00 ATOM 116 CA ASP 9 13.652 1.744 -11.984 1.00 .00 ATOM 124 C ASP 9 14.477 1.976 -10.749 1.00 .00 ATOM 125 O ASP 9 15.404 2.791 -10.746 1.00 .00 ATOM 118 CB ASP 9 12.425 2.664 -12.001 1.00 .00 ATOM 121 CG ASP 9 12.800 4.136 -12.033 1.00 .00 ATOM 122 OD1 ASP 9 13.228 4.625 -13.100 1.00 .00 ATOM 123 OD2 ASP 9 12.644 4.838 -11.010 1.00 .00 ATOM 115 HN ASP 9 12.477 0.030 -11.578 1.00 0.00 ATOM 117 HA ASP 9 14.273 1.951 -12.843 1.00 0.00 ATOM 119 HB1 ASP 9 11.837 2.484 -11.113 1.00 0.00 ATOM 120 HB2 ASP 9 11.826 2.448 -12.872 1.00 0.00 ATOM 126 N LEU 10 14.168 1.226 -9.718 1.00 .00 ATOM 128 CA LEU 10 14.926 1.248 -8.483 1.00 .00 ATOM 143 C LEU 10 16.125 .307 -8.654 1.00 .00 ATOM 144 O LEU 10 15.961 -.906 -8.686 1.00 .00 ATOM 130 CB LEU 10 14.050 .841 -7.262 1.00 .00 ATOM 133 CG LEU 10 12.982 1.859 -6.732 1.00 .00 ATOM 135 CD1 LEU 10 12.047 2.362 -7.817 1.00 .00 ATOM 139 CD2 LEU 10 12.162 1.214 -5.624 1.00 .00 ATOM 127 HN LEU 10 13.395 0.618 -9.820 1.00 0.00 ATOM 129 HA LEU 10 15.288 2.257 -8.356 1.00 0.00 ATOM 131 HB1 LEU 10 14.727 0.635 -6.446 1.00 0.00 ATOM 132 HB2 LEU 10 13.536 -0.080 -7.484 1.00 0.00 ATOM 134 HG LEU 10 13.484 2.713 -6.304 1.00 0.00 ATOM 136 HD11 LEU 10 12.617 2.872 -8.580 1.00 0.00 ATOM 137 HD12 LEU 10 11.325 3.041 -7.389 1.00 0.00 ATOM 138 HD13 LEU 10 11.531 1.522 -8.259 1.00 0.00 ATOM 140 HD21 LEU 10 11.434 1.921 -5.254 1.00 0.00 ATOM 141 HD22 LEU 10 12.816 0.912 -4.819 1.00 0.00 ATOM 142 HD23 LEU 10 11.651 0.347 -6.016 1.00 0.00 ATOM 145 N PRO 11 17.351 .873 -8.766 1.00 .00 ATOM 146 CA PRO 11 18.589 .131 -9.146 1.00 .00 ATOM 157 C PRO 11 18.911 -1.143 -8.367 1.00 .00 ATOM 158 O PRO 11 19.655 -1.992 -8.859 1.00 .00 ATOM 148 CB PRO 11 19.703 1.154 -8.999 1.00 .00 ATOM 151 CG PRO 11 19.027 2.470 -9.123 1.00 .00 ATOM 154 CD PRO 11 17.643 2.301 -8.548 1.00 .00 ATOM 147 HA PRO 11 18.517 -0.162 -10.177 1.00 0.00 ATOM 149 HB1 PRO 11 20.432 1.012 -9.782 1.00 0.00 ATOM 150 HB2 PRO 11 20.175 1.037 -8.034 1.00 0.00 ATOM 152 HG1 PRO 11 18.970 2.759 -10.163 1.00 0.00 ATOM 153 HG2 PRO 11 19.582 3.207 -8.563 1.00 0.00 ATOM 155 HD1 PRO 11 16.952 2.917 -9.106 1.00 0.00 ATOM 156 HD2 PRO 11 17.610 2.544 -7.495 1.00 0.00 ATOM 159 N GLY 12 18.380 -1.292 -7.194 1.00 .00 ATOM 161 CA GLY 12 18.631 -2.507 -6.461 1.00 .00 ATOM 164 C GLY 12 17.552 -3.500 -6.678 1.00 .00 ATOM 165 O GLY 12 17.107 -4.156 -5.737 1.00 .00 ATOM 160 HN GLY 12 17.807 -0.582 -6.842 1.00 0.00 ATOM 162 HA1 GLY 12 18.730 -2.328 -5.402 1.00 0.00 ATOM 163 HA2 GLY 12 19.557 -2.932 -6.817 1.00 0.00 ATOM 166 N GLY 13 17.098 -3.588 -7.918 1.00 .00 ATOM 168 CA GLY 13 16.005 -4.459 -8.270 1.00 .00 ATOM 171 C GLY 13 14.756 -4.088 -7.534 1.00 .00 ATOM 172 O GLY 13 13.840 -4.866 -7.453 1.00 .00 ATOM 167 HN GLY 13 17.522 -3.045 -8.616 1.00 0.00 ATOM 169 HA1 GLY 13 16.264 -5.478 -8.024 1.00 0.00 ATOM 170 HA2 GLY 13 15.805 -4.378 -9.325 1.00 0.00 ATOM 173 N GLY 14 14.730 -2.864 -7.011 1.00 .00 ATOM 175 CA GLY 14 13.638 -2.413 -6.150 1.00 .00 ATOM 178 C GLY 14 13.647 -3.055 -4.758 1.00 .00 ATOM 179 O GLY 14 13.020 -2.545 -3.828 1.00 .00 ATOM 174 HN GLY 14 15.464 -2.264 -7.291 1.00 0.00 ATOM 176 HA1 GLY 14 12.698 -2.651 -6.624 1.00 0.00 ATOM 177 HA2 GLY 14 13.705 -1.345 -6.014 1.00 0.00 ATOM 180 N LEU 15 14.388 -4.129 -4.611 1.00 .00 ATOM 182 CA LEU 15 14.393 -4.910 -3.442 1.00 .00 ATOM 197 C LEU 15 15.521 -4.523 -2.474 1.00 .00 ATOM 198 O LEU 15 15.381 -4.636 -1.254 1.00 .00 ATOM 184 CB LEU 15 14.547 -6.350 -3.891 1.00 .00 ATOM 187 CG LEU 15 14.668 -7.361 -2.816 1.00 .00 ATOM 189 CD1 LEU 15 13.389 -7.443 -1.981 1.00 .00 ATOM 193 CD2 LEU 15 15.079 -8.713 -3.359 1.00 .00 ATOM 181 HN LEU 15 14.972 -4.484 -5.314 1.00 0.00 ATOM 183 HA LEU 15 13.441 -4.827 -2.948 1.00 0.00 ATOM 185 HB1 LEU 15 15.425 -6.409 -4.516 1.00 0.00 ATOM 186 HB2 LEU 15 13.687 -6.605 -4.494 1.00 0.00 ATOM 188 HG LEU 15 15.505 -6.925 -2.300 1.00 0.00 ATOM 190 HD11 LEU 15 12.558 -7.698 -2.621 1.00 0.00 ATOM 191 HD12 LEU 15 13.202 -6.493 -1.503 1.00 0.00 ATOM 192 HD13 LEU 15 13.509 -8.209 -1.229 1.00 0.00 ATOM 194 HD21 LEU 15 14.338 -9.063 -4.063 1.00 0.00 ATOM 195 HD22 LEU 15 15.168 -9.413 -2.541 1.00 0.00 ATOM 196 HD23 LEU 15 16.035 -8.622 -3.854 1.00 0.00 ATOM 199 N HIS 16 16.616 -4.056 -3.005 1.00 .00 ATOM 201 CA HIS 16 17.790 -3.784 -2.184 1.00 .00 ATOM 215 C HIS 16 17.871 -2.322 -1.871 1.00 .00 ATOM 216 O HIS 16 18.392 -1.518 -2.662 1.00 .00 ATOM 203 CB HIS 16 19.079 -4.241 -2.858 1.00 .00 ATOM 206 CG HIS 16 19.010 -5.616 -3.412 1.00 .00 ATOM 207 ND1 HIS 16 18.763 -6.722 -2.654 1.00 .00 ATOM 209 CD2 HIS 16 19.121 -6.045 -4.671 1.00 .00 ATOM 211 CE1 HIS 16 18.726 -7.781 -3.420 1.00 .00 ATOM 213 NE2 HIS 16 18.939 -7.397 -4.659 1.00 .00 ATOM 200 HN HIS 16 16.606 -3.875 -3.967 1.00 0.00 ATOM 202 HA HIS 16 17.667 -4.323 -1.257 1.00 0.00 ATOM 204 HB1 HIS 16 19.885 -4.220 -2.142 1.00 0.00 ATOM 205 HB2 HIS 16 19.333 -3.553 -3.646 1.00 0.00 ATOM 208 HD1 HIS 16 18.611 -6.744 -1.681 1.00 0.00 ATOM 210 HD2 HIS 16 19.321 -5.389 -5.507 1.00 0.00 ATOM 212 HE1 HIS 16 18.587 -8.785 -3.044 1.00 0.00 ATOM 214 HE2 HIS 16 18.653 -7.906 -5.452 1.00 0.00 ATOM 217 N ARG 17 17.318 -1.977 -.760 1.00 .00 ATOM 219 CA ARG 17 17.252 -.616 -.318 1.00 .00 ATOM 239 C ARG 17 17.309 -.498 1.187 1.00 .00 ATOM 240 O ARG 17 16.625 -1.219 1.911 1.00 .00 ATOM 221 CB ARG 17 16.000 .034 -.901 1.00 .00 ATOM 224 CG ARG 17 14.736 -.828 -.765 1.00 .00 ATOM 227 CD ARG 17 13.578 -.317 -1.619 1.00 .00 ATOM 230 NE ARG 17 13.076 .996 -1.215 1.00 .00 ATOM 232 CZ ARG 17 11.814 1.411 -1.403 1.00 .00 ATOM 233 NH1 ARG 17 10.904 .580 -1.922 1.00 .00 ATOM 236 NH2 ARG 17 11.466 2.643 -1.065 1.00 .00 ATOM 218 HN ARG 17 16.907 -2.679 -0.214 1.00 0.00 ATOM 220 HA ARG 17 18.108 -0.106 -0.731 1.00 0.00 ATOM 222 HB1 ARG 17 16.200 0.253 -1.934 1.00 0.00 ATOM 223 HB2 ARG 17 15.847 0.956 -0.359 1.00 0.00 ATOM 225 HG1 ARG 17 14.434 -0.837 0.272 1.00 0.00 ATOM 226 HG2 ARG 17 14.974 -1.835 -1.074 1.00 0.00 ATOM 228 HD1 ARG 17 12.768 -1.029 -1.651 1.00 0.00 ATOM 229 HD2 ARG 17 13.961 -0.225 -2.624 1.00 0.00 ATOM 231 HE ARG 17 13.728 1.612 -0.805 1.00 0.00 ATOM 234 HH11 ARG 17 11.131 -0.360 -2.180 1.00 0.00 ATOM 235 HH12 ARG 17 9.949 0.851 -2.081 1.00 0.00 ATOM 237 HH21 ARG 17 12.138 3.275 -0.673 1.00 0.00 ATOM 238 HH22 ARG 17 10.532 2.993 -1.177 1.00 0.00 ATOM 241 N CYS 18 18.147 .400 1.642 1.00 .00 ATOM 243 CA CYS 18 18.280 .687 3.066 1.00 .00 ATOM 249 C CYS 18 17.308 1.785 3.385 1.00 .00 ATOM 250 O CYS 18 17.443 2.890 2.864 1.00 .00 ATOM 245 CB CYS 18 19.739 1.128 3.428 1.00 .00 ATOM 248 SG CYS 18 20.002 1.669 5.184 1.00 .00 ATOM 242 HN CYS 18 18.649 0.892 0.957 1.00 0.00 ATOM 244 HA CYS 18 18.014 -0.201 3.621 1.00 0.00 ATOM 246 HB1 CYS 18 20.033 1.917 2.759 1.00 0.00 ATOM 247 HB2 CYS 18 20.406 0.300 3.230 1.00 0.00 ATOM 251 N LEU 19 16.349 1.496 4.234 1.00 .00 ATOM 253 CA LEU 19 15.278 2.435 4.568 1.00 .00 ATOM 268 C LEU 19 15.820 3.721 5.160 1.00 .00 ATOM 269 O LEU 19 15.332 4.802 4.864 1.00 .00 ATOM 255 CB LEU 19 14.291 1.785 5.532 1.00 .00 ATOM 258 CG LEU 19 13.607 .526 5.024 1.00 .00 ATOM 260 CD1 LEU 19 12.714 -.067 6.100 1.00 .00 ATOM 264 CD2 LEU 19 12.813 .820 3.757 1.00 .00 ATOM 252 HN LEU 19 16.353 0.616 4.671 1.00 0.00 ATOM 254 HA LEU 19 14.753 2.679 3.656 1.00 0.00 ATOM 256 HB1 LEU 19 13.517 2.500 5.762 1.00 0.00 ATOM 257 HB2 LEU 19 14.810 1.542 6.447 1.00 0.00 ATOM 259 HG LEU 19 14.373 -0.191 4.783 1.00 0.00 ATOM 261 HD11 LEU 19 11.962 0.654 6.381 1.00 0.00 ATOM 262 HD12 LEU 19 13.311 -0.317 6.965 1.00 0.00 ATOM 263 HD13 LEU 19 12.237 -0.959 5.722 1.00 0.00 ATOM 265 HD21 LEU 19 12.059 1.566 3.963 1.00 0.00 ATOM 266 HD22 LEU 19 12.342 -0.091 3.420 1.00 0.00 ATOM 267 HD23 LEU 19 13.479 1.176 2.985 1.00 0.00 ATOM 270 N ALA 20 16.846 3.600 5.966 1.00 .00 ATOM 272 CA ALA 20 17.446 4.750 6.619 1.00 .00 ATOM 278 C ALA 20 18.212 5.642 5.644 1.00 .00 ATOM 279 O ALA 20 18.486 6.797 5.944 1.00 .00 ATOM 274 CB ALA 20 18.353 4.303 7.739 1.00 .00 ATOM 271 HN ALA 20 17.197 2.697 6.137 1.00 0.00 ATOM 273 HA ALA 20 16.645 5.330 7.054 1.00 0.00 ATOM 275 HB1 ALA 20 18.724 5.168 8.268 1.00 0.00 ATOM 276 HB2 ALA 20 19.181 3.744 7.328 1.00 0.00 ATOM 277 HB3 ALA 20 17.795 3.678 8.420 1.00 0.00 ATOM 280 N CYS 21 18.544 5.121 4.475 1.00 .00 ATOM 282 CA CYS 21 19.323 5.895 3.537 1.00 .00 ATOM 288 C CYS 21 18.554 6.215 2.285 1.00 .00 ATOM 289 O CYS 21 18.895 7.142 1.557 1.00 .00 ATOM 284 CB CYS 21 20.698 5.244 3.269 1.00 .00 ATOM 287 SG CYS 21 21.634 5.127 4.735 1.00 .00 ATOM 281 HN CYS 21 18.230 4.224 4.231 1.00 0.00 ATOM 283 HA CYS 21 19.497 6.841 4.031 1.00 0.00 ATOM 285 HB1 CYS 21 21.284 5.893 2.637 1.00 0.00 ATOM 286 HB2 CYS 21 20.755 4.227 2.910 1.00 0.00 ATOM 290 N ALA 22 17.498 5.442 2.052 1.00 .00 ATOM 292 CA ALA 22 16.595 5.597 .915 1.00 .00 ATOM 298 C ALA 22 17.324 5.401 -.419 1.00 .00 ATOM 299 O ALA 22 16.819 5.758 -1.480 1.00 .00 ATOM 294 CB ALA 22 15.863 6.942 .964 1.00 .00 ATOM 291 HN ALA 22 17.292 4.707 2.670 1.00 0.00 ATOM 293 HA ALA 22 15.875 4.808 1.060 1.00 0.00 ATOM 295 HB1 ALA 22 16.576 7.743 0.834 1.00 0.00 ATOM 296 HB2 ALA 22 15.373 7.052 1.920 1.00 0.00 ATOM 297 HB3 ALA 22 15.128 6.984 0.175 1.00 0.00 ATOM 300 N ARG 23 18.484 4.789 -.353 1.00 .00 ATOM 302 CA ARG 23 19.294 4.574 -1.516 1.00 .00 ATOM 322 C ARG 23 19.222 3.135 -1.918 1.00 .00 ATOM 323 O ARG 23 19.061 2.240 -1.061 1.00 .00 ATOM 304 CB ARG 23 20.739 5.007 -1.272 1.00 .00 ATOM 307 CG ARG 23 20.858 6.476 -.917 1.00 .00 ATOM 310 CD ARG 23 22.290 6.894 -.691 1.00 .00 ATOM 313 NE ARG 23 22.367 8.288 -.263 1.00 .00 ATOM 315 CZ ARG 23 23.482 9.009 -.170 1.00 .00 ATOM 316 NH1 ARG 23 24.652 8.487 -.535 1.00 .00 ATOM 319 NH2 ARG 23 23.418 10.260 .275 1.00 .00 ATOM 301 HN ARG 23 18.782 4.454 0.515 1.00 0.00 ATOM 303 HA ARG 23 18.879 5.175 -2.312 1.00 0.00 ATOM 305 HB1 ARG 23 21.319 4.824 -2.164 1.00 0.00 ATOM 306 HB2 ARG 23 21.145 4.424 -0.458 1.00 0.00 ATOM 308 HG1 ARG 23 20.289 6.657 -0.016 1.00 0.00 ATOM 309 HG2 ARG 23 20.447 7.066 -1.722 1.00 0.00 ATOM 311 HD1 ARG 23 22.838 6.782 -1.614 1.00 0.00 ATOM 312 HD2 ARG 23 22.731 6.262 0.066 1.00 0.00 ATOM 314 HE ARG 23 21.505 8.696 -0.015 1.00 0.00 ATOM 317 HH11 ARG 23 24.722 7.550 -0.887 1.00 0.00 ATOM 318 HH12 ARG 23 25.520 8.989 -0.488 1.00 0.00 ATOM 320 HH21 ARG 23 22.541 10.674 0.540 1.00 0.00 ATOM 321 HH22 ARG 23 24.235 10.834 0.372 1.00 0.00 ATOM 324 N TYR 24 19.330 2.913 -3.188 1.00 .00 ATOM 326 CA TYR 24 19.177 1.650 -3.764 1.00 .00 ATOM 343 C TYR 24 20.527 1.111 -4.155 1.00 .00 ATOM 344 O TYR 24 21.299 1.778 -4.842 1.00 .00 ATOM 328 CB TYR 24 18.289 1.818 -4.977 1.00 .00 ATOM 331 CG TYR 24 16.971 2.481 -4.633 1.00 .00 ATOM 332 CD1 TYR 24 15.944 1.761 -4.064 1.00 .00 CD2 ATOM 334 CD2 TYR 24 16.775 3.847 -4.842 1.00 .00 CD1 ATOM 336 CE1 TYR 24 14.759 2.365 -3.717 1.00 .00 CE2 ATOM 338 CE2 TYR 24 15.588 4.460 -4.489 1.00 .00 CE1 ATOM 340 CZ TYR 24 14.584 3.710 -3.927 1.00 .00 ATOM 341 OH TYR 24 13.398 4.302 -3.567 1.00 .00 ATOM 325 HN TYR 24 19.522 3.614 -3.843 1.00 0.00 ATOM 327 HA TYR 24 18.683 0.987 -3.070 1.00 0.00 ATOM 329 HB1 TYR 24 18.097 0.848 -5.390 1.00 0.00 ATOM 330 HB2 TYR 24 18.808 2.428 -5.702 1.00 0.00 ATOM 333 HD1 TYR 24 17.567 4.430 -5.287 1.00 0.00 ATOM 335 HD2 TYR 24 16.080 0.702 -3.901 1.00 0.00 ATOM 337 HE1 TYR 24 15.452 5.518 -4.657 1.00 0.00 ATOM 339 HE2 TYR 24 13.965 1.784 -3.274 1.00 0.00 ATOM 342 HH TYR 24 13.118 4.900 -4.266 1.00 0.00 ATOM 345 N PHE 25 20.816 -.072 -3.716 1.00 .00 ATOM 347 CA PHE 25 22.100 -.679 -3.965 1.00 .00 ATOM 363 C PHE 25 21.937 -1.779 -4.956 1.00 .00 ATOM 364 O PHE 25 20.980 -2.524 -4.870 1.00 .00 ATOM 349 CB PHE 25 22.680 -1.222 -2.671 1.00 .00 ATOM 352 CG PHE 25 22.823 -.179 -1.610 1.00 .00 ATOM 353 CD1 PHE 25 21.759 .133 -.790 1.00 .00 ATOM 355 CD2 PHE 25 24.011 .490 -1.436 1.00 .00 ATOM 357 CE1 PHE 25 21.873 1.089 .182 1.00 .00 ATOM 359 CE2 PHE 25 24.136 1.452 -.462 1.00 .00 ATOM 361 CZ PHE 25 23.057 1.752 .351 1.00 .00 ATOM 346 HN PHE 25 20.135 -0.577 -3.218 1.00 0.00 ATOM 348 HA PHE 25 22.766 0.071 -4.363 1.00 0.00 ATOM 350 HB1 PHE 25 23.655 -1.643 -2.868 1.00 0.00 ATOM 351 HB2 PHE 25 22.027 -1.997 -2.300 1.00 0.00 ATOM 354 HD1 PHE 25 20.823 -0.389 -0.925 1.00 0.00 ATOM 356 HD2 PHE 25 24.850 0.251 -2.072 1.00 0.00 ATOM 358 HE1 PHE 25 21.024 1.309 0.810 1.00 0.00 ATOM 360 HE2 PHE 25 25.079 1.961 -0.344 1.00 0.00 ATOM 362 HZ PHE 25 23.129 2.502 1.125 1.00 0.00 ATOM 365 N ILE 26 22.904 -1.899 -5.853 1.00 .00 ATOM 367 CA ILE 26 22.862 -2.829 -6.999 1.00 .00 ATOM 382 C ILE 26 22.400 -4.236 -6.598 1.00 .00 ATOM 383 O ILE 26 21.442 -4.779 -7.159 1.00 .00 ATOM 369 CB ILE 26 24.255 -2.937 -7.658 1.00 .00 ATOM 371 CG1 ILE 26 24.802 -1.548 -8.042 1.00 .00 ATOM 374 CG2 ILE 26 24.224 -3.867 -8.873 1.00 .00 ATOM 378 CD1 ILE 26 23.924 -.758 -8.986 1.00 .00 ATOM 366 HN ILE 26 23.694 -1.327 -5.744 1.00 0.00 ATOM 368 HA ILE 26 22.183 -2.433 -7.732 1.00 0.00 ATOM 370 HB ILE 26 24.891 -3.363 -6.904 1.00 0.00 ATOM 379 HD11 ILE 26 24.396 0.188 -9.202 1.00 0.00 ATOM 380 HD12 ILE 26 22.963 -0.587 -8.524 1.00 0.00 ATOM 381 HD13 ILE 26 23.795 -1.317 -9.900 1.00 0.00 ATOM 384 N ASP 27 23.052 -4.784 -5.610 1.00 .00 ATOM 386 CA ASP 27 22.778 -6.133 -5.150 1.00 .00 ATOM 394 C ASP 27 22.678 -6.139 -3.639 1.00 .00 ATOM 395 O ASP 27 23.118 -5.178 -2.987 1.00 .00 ATOM 388 CB ASP 27 23.879 -7.098 -5.644 1.00 .00 ATOM 391 CG ASP 27 23.728 -8.509 -5.119 1.00 .00 ATOM 392 OD1 ASP 27 22.793 -9.208 -5.524 1.00 .00 OD2 ATOM 393 OD2 ASP 27 24.525 -8.909 -4.254 1.00 .00 OD1 ATOM 385 HN ASP 27 23.722 -4.235 -5.156 1.00 0.00 ATOM 387 HA ASP 27 21.827 -6.438 -5.562 1.00 0.00 ATOM 389 HB1 ASP 27 24.845 -6.720 -5.343 1.00 0.00 ATOM 390 HB2 ASP 27 23.843 -7.144 -6.722 1.00 0.00 ATOM 396 N SER 28 22.117 -7.204 -3.083 1.00 .00 ATOM 398 CA SER 28 21.919 -7.346 -1.653 1.00 .00 ATOM 405 C SER 28 23.256 -7.314 -.925 1.00 .00 ATOM 406 O SER 28 23.351 -6.807 .193 1.00 .00 ATOM 400 CB SER 28 21.163 -8.657 -1.392 1.00 .00 ATOM 403 OG SER 28 21.860 -9.770 -1.926 1.00 .00 ATOM 397 HN SER 28 21.840 -7.964 -3.643 1.00 0.00 ATOM 399 HA SER 28 21.315 -6.519 -1.301 1.00 0.00 ATOM 401 HB1 SER 28 20.239 -8.579 -1.944 1.00 0.00 ATOM 402 HB2 SER 28 20.881 -8.810 -0.366 1.00 0.00 ATOM 404 HG SER 28 21.301 -10.545 -1.779 1.00 0.00 ATOM 407 N THR 29 24.292 -7.821 -1.592 1.00 .00 ATOM 409 CA THR 29 25.625 -7.821 -1.051 1.00 .00 ATOM 419 C THR 29 26.086 -6.382 -.800 1.00 .00 ATOM 420 O THR 29 26.569 -6.069 .270 1.00 .00 ATOM 411 CB THR 29 26.594 -8.507 -2.016 1.00 .00 ATOM 413 OG1 THR 29 26.064 -9.798 -2.382 1.00 .00 ATOM 415 CG2 THR 29 27.967 -8.684 -1.382 1.00 .00 ATOM 408 HN THR 29 24.140 -8.226 -2.477 1.00 0.00 ATOM 410 HA THR 29 25.623 -8.359 -0.120 1.00 0.00 ATOM 412 HB THR 29 26.673 -7.875 -2.882 1.00 0.00 ATOM 414 HG1 THR 29 25.449 -9.599 -3.114 1.00 0.00 ATOM 421 N ASN 30 25.882 -5.505 -1.790 1.00 .00 ATOM 423 CA ASN 30 26.265 -4.112 -1.697 1.00 .00 ATOM 433 C ASN 30 25.509 -3.417 -.587 1.00 .00 ATOM 434 O ASN 30 26.095 -2.690 .212 1.00 .00 ATOM 425 CB ASN 30 26.021 -3.401 -3.023 1.00 .00 ATOM 428 CG ASN 30 26.936 -3.860 -4.140 1.00 .00 ATOM 429 OD1 ASN 30 28.033 -3.328 -4.317 1.00 .00 ATOM 430 ND2 ASN 30 26.492 -4.818 -4.920 1.00 .00 ATOM 422 HN ASN 30 25.452 -5.768 -2.624 1.00 0.00 ATOM 424 HA ASN 30 27.321 -4.072 -1.475 1.00 0.00 ATOM 426 HB1 ASN 30 26.156 -2.350 -2.863 1.00 0.00 ATOM 427 HB2 ASN 30 25.002 -3.586 -3.328 1.00 0.00 ATOM 431 HD21 ASN 30 25.609 -5.213 -4.782 1.00 0.00 ATOM 432 HD22 ASN 30 27.083 -5.124 -5.644 1.00 0.00 ATOM 435 N LEU 31 24.209 -3.654 -.542 1.00 .00 ATOM 437 CA LEU 31 23.349 -3.127 .498 1.00 .00 ATOM 452 C LEU 31 23.858 -3.528 1.888 1.00 .00 ATOM 453 O LEU 31 23.996 -2.685 2.776 1.00 .00 ATOM 439 CB LEU 31 21.871 -3.557 .211 1.00 .00 ATOM 442 CG LEU 31 20.785 -3.277 1.265 1.00 .00 ATOM 444 CD1 LEU 31 20.794 -4.302 2.354 1.00 .00 ATOM 448 CD2 LEU 31 20.925 -1.881 1.828 1.00 .00 ATOM 436 HN LEU 31 23.802 -4.197 -1.248 1.00 0.00 ATOM 438 HA LEU 31 23.411 -2.050 0.427 1.00 0.00 ATOM 440 HB1 LEU 31 21.884 -4.620 0.021 1.00 0.00 ATOM 441 HB2 LEU 31 21.554 -3.072 -0.699 1.00 0.00 ATOM 443 HG LEU 31 19.794 -3.362 0.871 1.00 0.00 ATOM 445 HD11 LEU 31 20.634 -5.286 1.942 1.00 0.00 ATOM 446 HD12 LEU 31 20.013 -4.075 3.064 1.00 0.00 ATOM 447 HD13 LEU 31 21.754 -4.275 2.848 1.00 0.00 ATOM 449 HD21 LEU 31 20.133 -1.703 2.539 1.00 0.00 ATOM 450 HD22 LEU 31 20.862 -1.158 1.030 1.00 0.00 ATOM 451 HD23 LEU 31 21.879 -1.789 2.327 1.00 0.00 ATOM 454 N LYS 32 24.132 -4.786 2.065 1.00 .00 ATOM 456 CA LYS 32 24.686 -5.261 3.326 1.00 .00 ATOM 474 C LYS 32 26.131 -4.782 3.577 1.00 .00 ATOM 475 O LYS 32 26.513 -4.545 4.720 1.00 .00 ATOM 458 CB LYS 32 24.507 -6.764 3.492 1.00 .00 ATOM 461 CG LYS 32 23.040 -7.143 3.600 1.00 .00 ATOM 464 CD LYS 32 22.827 -8.624 3.794 1.00 .00 ATOM 467 CE LYS 32 21.350 -8.918 4.007 1.00 .00 ATOM 470 NZ LYS 32 21.088 -10.348 4.217 1.00 .00 ATOM 455 HN LYS 32 23.909 -5.406 1.335 1.00 0.00 ATOM 457 HA LYS 32 24.089 -4.766 4.078 1.00 0.00 ATOM 459 HB1 LYS 32 25.009 -7.086 4.392 1.00 0.00 ATOM 460 HB2 LYS 32 24.940 -7.266 2.639 1.00 0.00 ATOM 462 HG1 LYS 32 22.542 -6.827 2.695 1.00 0.00 ATOM 463 HG2 LYS 32 22.608 -6.622 4.442 1.00 0.00 ATOM 465 HD1 LYS 32 23.380 -8.953 4.661 1.00 0.00 ATOM 466 HD2 LYS 32 23.174 -9.150 2.918 1.00 0.00 ATOM 468 HE1 LYS 32 20.805 -8.582 3.136 1.00 0.00 ATOM 469 HE2 LYS 32 21.005 -8.375 4.874 1.00 0.00 ATOM 471 HZ1 LYS 32 21.680 -10.711 4.992 1.00 0.00 ATOM 472 HZ2 LYS 32 21.223 -10.912 3.354 1.00 0.00 ATOM 473 HZ3 LYS 32 20.095 -10.453 4.525 1.00 0.00 ATOM 476 N THR 33 26.916 -4.603 2.507 1.00 .00 ATOM 478 CA THR 33 28.268 -4.042 2.621 1.00 .00 ATOM 488 C THR 33 28.175 -2.612 3.176 1.00 .00 ATOM 489 O THR 33 29.040 -2.146 3.928 1.00 .00 ATOM 480 CB THR 33 28.979 -4.023 1.251 1.00 .00 ATOM 482 OG1 THR 33 29.078 -5.357 .726 1.00 .00 ATOM 484 CG2 THR 33 30.373 -3.421 1.343 1.00 .00 ATOM 477 HN THR 33 26.577 -4.866 1.622 1.00 0.00 ATOM 479 HA THR 33 28.827 -4.657 3.304 1.00 0.00 ATOM 481 HB THR 33 28.364 -3.412 0.616 1.00 0.00 ATOM 483 HG1 THR 33 28.308 -5.866 1.016 1.00 0.00 ATOM 490 N HIS 34 27.103 -1.951 2.807 1.00 .00 ATOM 492 CA HIS 34 26.770 -.629 3.278 1.00 .00 ATOM 505 C HIS 34 26.569 -.583 4.806 1.00 .00 ATOM 506 O HIS 34 26.908 .413 5.448 1.00 .00 ATOM 494 CB HIS 34 25.527 -.103 2.506 1.00 .00 ATOM 497 CG HIS 34 24.782 1.010 3.178 1.00 .00 ATOM 498 ND1 HIS 34 25.266 2.277 3.318 1.00 .00 ATOM 500 CD2 HIS 34 23.585 1.002 3.816 1.00 .00 ATOM 502 CE1 HIS 34 24.417 2.980 4.011 1.00 .00 ATOM 504 NE2 HIS 34 23.408 2.250 4.313 1.00 .00 ATOM 491 HN HIS 34 26.498 -2.384 2.163 1.00 0.00 ATOM 493 HA HIS 34 27.605 0.012 3.034 1.00 0.00 ATOM 495 HB1 HIS 34 24.843 -0.926 2.358 1.00 0.00 ATOM 496 HB2 HIS 34 25.841 0.264 1.540 1.00 0.00 ATOM 499 HD1 HIS 34 26.120 2.639 2.980 1.00 0.00 ATOM 501 HD2 HIS 34 22.908 0.164 3.909 1.00 0.00 ATOM 503 HE1 HIS 34 24.428 3.992 4.388 1.00 0.00 ATOM 507 N PHE 35 26.049 -1.650 5.396 1.00 .00 ATOM 509 CA PHE 35 25.786 -1.612 6.826 1.00 .00 ATOM 525 C PHE 35 27.026 -1.978 7.617 1.00 .00 ATOM 526 O PHE 35 27.000 -1.975 8.821 1.00 .00 ATOM 511 CB PHE 35 24.649 -2.529 7.267 1.00 .00 ATOM 514 CG PHE 35 23.387 -2.435 6.498 1.00 .00 ATOM 515 CD1 PHE 35 22.732 -1.231 6.329 1.00 .00 ATOM 517 CD2 PHE 35 22.847 -3.569 5.959 1.00 .00 ATOM 519 CE1 PHE 35 21.559 -1.170 5.610 1.00 .00 ATOM 521 CE2 PHE 35 21.688 -3.527 5.254 1.00 .00 ATOM 523 CZ PHE 35 21.028 -2.334 5.065 1.00 .00 ATOM 508 HN PHE 35 25.859 -2.468 4.888 1.00 0.00 ATOM 510 HA PHE 35 25.526 -0.593 7.070 1.00 0.00 ATOM 512 HB1 PHE 35 24.417 -2.190 8.266 1.00 0.00 ATOM 513 HB2 PHE 35 24.955 -3.562 7.297 1.00 0.00 ATOM 516 HD1 PHE 35 23.153 -0.331 6.752 1.00 0.00 ATOM 518 HD2 PHE 35 23.352 -4.512 6.100 1.00 0.00 ATOM 520 HE1 PHE 35 21.072 -0.209 5.501 1.00 0.00 ATOM 522 HE2 PHE 35 21.286 -4.439 4.839 1.00 0.00 ATOM 524 HZ PHE 35 20.120 -2.360 4.464 1.00 0.00 ATOM 527 N ARG 36 28.126 -2.269 6.930 1.00 .00 ATOM 529 CA ARG 36 29.384 -2.618 7.612 1.00 .00 ATOM 549 C ARG 36 29.931 -1.428 8.402 1.00 .00 ATOM 550 O ARG 36 30.907 -1.543 9.165 1.00 .00 ATOM 531 CB ARG 36 30.404 -3.195 6.642 1.00 .00 ATOM 534 CG ARG 36 29.957 -4.522 6.037 1.00 .00 ATOM 537 CD ARG 36 30.941 -5.041 5.005 1.00 .00 ATOM 540 NE ARG 36 32.279 -5.246 5.555 1.00 .00 ATOM 542 CZ ARG 36 33.289 -5.834 4.906 1.00 .00 ATOM 543 NH1 ARG 36 33.120 -6.304 3.677 1.00 .00 ATOM 546 NH2 ARG 36 34.463 -5.953 5.491 1.00 .00 ATOM 528 HN ARG 36 28.097 -2.252 5.950 1.00 0.00 ATOM 530 HA ARG 36 29.119 -3.371 8.341 1.00 0.00 ATOM 532 HB1 ARG 36 31.339 -3.352 7.159 1.00 0.00 ATOM 533 HB2 ARG 36 30.550 -2.487 5.841 1.00 0.00 ATOM 535 HG1 ARG 36 28.993 -4.383 5.568 1.00 0.00 ATOM 536 HG2 ARG 36 29.870 -5.254 6.826 1.00 0.00 ATOM 538 HD1 ARG 36 31.001 -4.325 4.197 1.00 0.00 ATOM 539 HD2 ARG 36 30.576 -5.981 4.617 1.00 0.00 ATOM 541 HE ARG 36 32.424 -4.913 6.472 1.00 0.00 ATOM 544 HH11 ARG 36 32.251 -6.248 3.179 1.00 0.00 ATOM 545 HH12 ARG 36 33.868 -6.755 3.179 1.00 0.00 ATOM 547 HH21 ARG 36 34.623 -5.612 6.421 1.00 0.00 ATOM 548 HH22 ARG 36 35.235 -6.393 5.024 1.00 0.00 ATOM 551 N SER 37 29.303 -.291 8.204 1.00 .00 ATOM 553 CA SER 37 29.528 .836 9.009 1.00 .00 ATOM 560 C SER 37 28.686 .661 10.293 1.00 .00 ATOM 561 O SER 37 27.487 .965 10.328 1.00 .00 ATOM 555 CB SER 37 29.193 2.132 8.230 1.00 .00 ATOM 558 OG SER 37 27.881 2.081 7.634 1.00 .00 ATOM 552 HN SER 37 28.640 -0.229 7.488 1.00 0.00 ATOM 554 HA SER 37 30.574 0.829 9.276 1.00 0.00 ATOM 556 HB1 SER 37 29.924 2.273 7.447 1.00 0.00 ATOM 557 HB2 SER 37 29.228 2.973 8.907 1.00 0.00 ATOM 559 HG SER 37 27.925 1.666 6.762 1.00 0.00 ATOM 562 N LYS 38 29.320 .089 11.316 1.00 .00 ATOM 564 CA LYS 38 28.674 -.245 12.595 1.00 .00 ATOM 582 C LYS 38 27.993 .958 13.235 1.00 .00 ATOM 583 O LYS 38 26.969 .816 13.915 1.00 .00 ATOM 566 CB LYS 38 29.687 -.870 13.552 1.00 .00 ATOM 569 CG LYS 38 30.898 .008 13.814 1.00 .00 ATOM 572 CD LYS 38 31.878 -.636 14.775 1.00 .00 ATOM 575 CE LYS 38 31.243 -.893 16.127 1.00 .00 ATOM 578 NZ LYS 38 32.200 -1.465 17.088 1.00 .00 ATOM 563 HN LYS 38 30.270 -0.121 11.194 1.00 0.00 ATOM 565 HA LYS 38 27.913 -0.979 12.384 1.00 0.00 ATOM 567 HB1 LYS 38 30.026 -1.808 13.143 1.00 0.00 ATOM 568 HB2 LYS 38 29.188 -1.054 14.491 1.00 0.00 ATOM 570 HG1 LYS 38 30.541 0.939 14.227 1.00 0.00 ATOM 571 HG2 LYS 38 31.397 0.192 12.874 1.00 0.00 ATOM 573 HD1 LYS 38 32.718 0.032 14.902 1.00 0.00 ATOM 574 HD2 LYS 38 32.220 -1.574 14.364 1.00 0.00 ATOM 576 HE1 LYS 38 30.421 -1.580 15.999 1.00 0.00 ATOM 577 HE2 LYS 38 30.863 0.039 16.514 1.00 0.00 ATOM 579 HZ1 LYS 38 32.997 -0.812 17.228 1.00 0.00 ATOM 580 HZ2 LYS 38 32.557 -2.381 16.754 1.00 0.00 ATOM 581 HZ3 LYS 38 31.729 -1.614 18.002 1.00 0.00 ATOM 584 N ASP 39 28.558 2.131 12.987 1.00 .00 ATOM 586 CA ASP 39 28.024 3.413 13.460 1.00 .00 ATOM 594 C ASP 39 26.591 3.611 12.988 1.00 .00 ATOM 595 O ASP 39 25.727 4.087 13.728 1.00 .00 ATOM 588 CB ASP 39 28.896 4.538 12.914 1.00 .00 ATOM 591 CG ASP 39 28.345 5.910 13.201 1.00 .00 ATOM 592 OD1 ASP 39 28.585 6.448 14.290 1.00 .00 ATOM 593 OD2 ASP 39 27.676 6.482 12.315 1.00 .00 ATOM 585 HN ASP 39 29.385 2.130 12.459 1.00 0.00 ATOM 587 HA ASP 39 28.061 3.437 14.538 1.00 0.00 ATOM 589 HB1 ASP 39 28.975 4.418 11.844 1.00 0.00 ATOM 590 HB2 ASP 39 29.882 4.459 13.345 1.00 0.00 ATOM 596 N HIS 40 26.350 3.207 11.770 1.00 .00 ATOM 598 CA HIS 40 25.052 3.334 11.139 1.00 .00 ATOM 611 C HIS 40 24.081 2.448 11.790 1.00 .00 ATOM 612 O HIS 40 22.984 2.854 12.113 1.00 .00 ATOM 600 CB HIS 40 25.154 2.954 9.676 1.00 .00 ATOM 603 CG HIS 40 23.938 3.041 8.878 1.00 .00 ATOM 604 ND1 HIS 40 23.045 4.078 9.022 1.00 .00 ATOM 606 CD2 HIS 40 23.685 2.450 7.748 1.00 .00 ATOM 608 CE1 HIS 40 22.313 4.144 7.965 1.00 .00 ATOM 610 NE2 HIS 40 22.669 3.182 7.159 1.00 .00 ATOM 597 HN HIS 40 27.090 2.792 11.276 1.00 0.00 ATOM 599 HA HIS 40 24.690 4.344 11.215 1.00 0.00 ATOM 601 HB1 HIS 40 25.509 1.944 9.541 1.00 0.00 ATOM 602 HB2 HIS 40 25.789 3.611 9.092 1.00 0.00 ATOM 605 HD1 HIS 40 22.953 4.704 9.778 1.00 0.00 ATOM 607 HD2 HIS 40 24.141 1.478 7.548 1.00 0.00 ATOM 609 HE1 HIS 40 21.519 4.840 7.748 1.00 0.00 ATOM 613 N LYS 41 24.479 1.245 11.979 1.00 .00 ATOM 615 CA LYS 41 23.616 .275 12.532 1.00 .00 ATOM 633 C LYS 41 23.349 .574 13.989 1.00 .00 ATOM 634 O LYS 41 22.289 .272 14.499 1.00 .00 ATOM 617 CB LYS 41 24.155 -1.098 12.304 1.00 .00 ATOM 620 CG LYS 41 24.421 -1.404 10.822 1.00 .00 ATOM 623 CD LYS 41 24.881 -2.855 10.666 1.00 .00 ATOM 626 CE LYS 41 23.790 -3.842 11.025 1.00 .00 ATOM 629 NZ LYS 41 24.217 -5.240 10.813 1.00 .00 ATOM 614 HN LYS 41 25.402 1.006 11.745 1.00 0.00 ATOM 616 HA LYS 41 22.679 0.373 12.007 1.00 0.00 ATOM 618 HB1 LYS 41 23.434 -1.812 12.672 1.00 0.00 ATOM 619 HB2 LYS 41 25.078 -1.205 12.854 1.00 0.00 ATOM 621 HG1 LYS 41 25.179 -0.743 10.417 1.00 0.00 ATOM 622 HG2 LYS 41 23.563 -1.162 10.204 1.00 0.00 ATOM 624 HD1 LYS 41 25.698 -3.001 11.357 1.00 0.00 ATOM 625 HD2 LYS 41 25.250 -3.063 9.674 1.00 0.00 ATOM 627 HE1 LYS 41 22.925 -3.637 10.414 1.00 0.00 ATOM 628 HE2 LYS 41 23.537 -3.717 12.068 1.00 0.00 ATOM 630 HZ1 LYS 41 24.484 -5.431 9.827 1.00 0.00 ATOM 631 HZ2 LYS 41 23.416 -5.876 11.009 1.00 0.00 ATOM 632 HZ3 LYS 41 25.006 -5.504 11.434 1.00 0.00 ATOM 635 N LYS 42 24.310 1.201 14.643 1.00 .00 ATOM 637 CA LYS 42 24.122 1.680 15.992 1.00 .00 ATOM 655 C LYS 42 23.043 2.761 16.018 1.00 .00 ATOM 656 O LYS 42 22.201 2.804 16.934 1.00 .00 ATOM 639 CB LYS 42 25.423 2.227 16.582 1.00 .00 ATOM 642 CG LYS 42 25.209 2.891 17.921 1.00 .00 ATOM 645 CD LYS 42 26.490 3.420 18.527 1.00 .00 ATOM 648 CE LYS 42 26.204 4.175 19.820 1.00 .00 ATOM 651 NZ LYS 42 25.507 3.334 20.827 1.00 .00 ATOM 636 HN LYS 42 25.181 1.329 14.205 1.00 0.00 ATOM 638 HA LYS 42 23.789 0.844 16.589 1.00 0.00 ATOM 640 HB1 LYS 42 25.837 2.957 15.902 1.00 0.00 ATOM 641 HB2 LYS 42 26.127 1.417 16.700 1.00 0.00 ATOM 643 HG1 LYS 42 24.751 2.169 18.579 1.00 0.00 ATOM 644 HG2 LYS 42 24.513 3.700 17.748 1.00 0.00 ATOM 646 HD1 LYS 42 26.964 4.089 17.825 1.00 0.00 ATOM 647 HD2 LYS 42 27.147 2.590 18.739 1.00 0.00 ATOM 649 HE1 LYS 42 25.589 5.032 19.589 1.00 0.00 ATOM 650 HE2 LYS 42 27.142 4.511 20.239 1.00 0.00 ATOM 652 HZ1 LYS 42 25.281 3.889 21.677 1.00 0.00 ATOM 653 HZ2 LYS 42 26.108 2.539 21.128 1.00 0.00 ATOM 654 HZ3 LYS 42 24.620 2.941 20.450 1.00 0.00 ATOM 657 N ARG 43 23.048 3.613 15.002 1.00 .00 ATOM 659 CA ARG 43 22.066 4.671 14.900 1.00 .00 ATOM 679 C ARG 43 20.706 3.999 14.577 1.00 .00 ATOM 680 O ARG 43 19.652 4.470 14.977 1.00 .00 ATOM 661 CB ARG 43 22.499 5.642 13.772 1.00 .00 ATOM 664 CG ARG 43 21.982 7.099 13.849 1.00 .00 ATOM 667 CD ARG 43 20.471 7.230 13.861 1.00 .00 ATOM 670 NE ARG 43 20.054 8.642 13.814 1.00 .00 ATOM 672 CZ ARG 43 18.958 9.155 14.400 1.00 .00 ATOM 673 NH1 ARG 43 18.221 8.410 15.227 1.00 .00 ATOM 676 NH2 ARG 43 18.622 10.423 14.177 1.00 .00 ATOM 658 HN ARG 43 23.738 3.549 14.299 1.00 0.00 ATOM 660 HA ARG 43 22.008 5.192 15.844 1.00 0.00 ATOM 662 HB1 ARG 43 22.177 5.216 12.833 1.00 0.00 ATOM 663 HB2 ARG 43 23.578 5.686 13.763 1.00 0.00 ATOM 665 HG1 ARG 43 22.380 7.647 13.008 1.00 0.00 ATOM 666 HG2 ARG 43 22.356 7.545 14.758 1.00 0.00 ATOM 668 HD1 ARG 43 20.092 6.780 14.766 1.00 0.00 ATOM 669 HD2 ARG 43 20.071 6.710 13.004 1.00 0.00 ATOM 671 HE ARG 43 20.637 9.213 13.261 1.00 0.00 ATOM 674 HH11 ARG 43 18.458 7.461 15.438 1.00 0.00 ATOM 675 HH12 ARG 43 17.396 8.761 15.682 1.00 0.00 ATOM 677 HH21 ARG 43 19.165 11.021 13.581 1.00 0.00 ATOM 678 HH22 ARG 43 17.807 10.843 14.583 1.00 0.00 ATOM 681 N LEU 44 20.771 2.857 13.894 1.00 .00 ATOM 683 CA LEU 44 19.606 2.092 13.513 1.00 .00 ATOM 698 C LEU 44 18.987 1.407 14.709 1.00 .00 ATOM 699 O LEU 44 17.785 1.182 14.742 1.00 .00 ATOM 685 CB LEU 44 19.961 1.060 12.458 1.00 .00 ATOM 688 CG LEU 44 20.436 1.583 11.101 1.00 .00 ATOM 690 CD1 LEU 44 20.694 .433 10.136 1.00 .00 ATOM 694 CD2 LEU 44 19.430 2.551 10.518 1.00 .00 ATOM 682 HN LEU 44 21.644 2.499 13.628 1.00 0.00 ATOM 684 HA LEU 44 18.869 2.766 13.098 1.00 0.00 ATOM 686 HB1 LEU 44 19.093 0.448 12.328 1.00 0.00 ATOM 687 HB2 LEU 44 20.744 0.446 12.880 1.00 0.00 ATOM 689 HG LEU 44 21.370 2.108 11.242 1.00 0.00 ATOM 691 HD11 LEU 44 21.436 -0.238 10.542 1.00 0.00 ATOM 692 HD12 LEU 44 21.050 0.833 9.198 1.00 0.00 ATOM 693 HD13 LEU 44 19.773 -0.106 9.966 1.00 0.00 ATOM 695 HD21 LEU 44 18.477 2.058 10.397 1.00 0.00 ATOM 696 HD22 LEU 44 19.788 2.885 9.555 1.00 0.00 ATOM 697 HD23 LEU 44 19.321 3.406 11.169 1.00 0.00 ATOM 700 N LYS 45 19.811 1.069 15.684 1.00 .00 ATOM 702 CA LYS 45 19.340 .477 16.942 1.00 .00 ATOM 720 C LYS 45 18.394 1.468 17.627 1.00 .00 ATOM 721 O LYS 45 17.450 1.084 18.301 1.00 .00 ATOM 704 CB LYS 45 20.521 .194 17.890 1.00 .00 ATOM 707 CG LYS 45 21.642 -.665 17.311 1.00 .00 ATOM 710 CD LYS 45 21.201 -2.074 16.963 1.00 .00 ATOM 713 CE LYS 45 22.337 -2.852 16.290 1.00 .00 ATOM 716 NZ LYS 45 23.562 -2.920 17.129 1.00 .00 ATOM 701 HN LYS 45 20.769 1.202 15.522 1.00 0.00 ATOM 703 HA LYS 45 18.814 -0.441 16.725 1.00 0.00 ATOM 705 HB1 LYS 45 20.133 -0.300 18.768 1.00 0.00 ATOM 706 HB2 LYS 45 20.952 1.138 18.186 1.00 0.00 ATOM 708 HG1 LYS 45 22.450 -0.709 18.025 1.00 0.00 ATOM 709 HG2 LYS 45 21.993 -0.196 16.404 1.00 0.00 ATOM 711 HD1 LYS 45 20.363 -2.021 16.285 1.00 0.00 ATOM 712 HD2 LYS 45 20.904 -2.586 17.866 1.00 0.00 ATOM 714 HE1 LYS 45 22.577 -2.371 15.354 1.00 0.00 ATOM 715 HE2 LYS 45 21.996 -3.857 16.091 1.00 0.00 ATOM 717 HZ1 LYS 45 24.302 -3.466 16.645 1.00 0.00 ATOM 718 HZ2 LYS 45 23.403 -3.376 18.049 1.00 0.00 ATOM 719 HZ3 LYS 45 23.964 -1.977 17.310 1.00 0.00 ATOM 722 N GLN 46 18.661 2.750 17.404 1.00 .00 ATOM 724 CA GLN 46 17.877 3.839 17.965 1.00 .00 ATOM 737 C GLN 46 16.538 3.951 17.232 1.00 .00 ATOM 738 O GLN 46 15.533 4.346 17.808 1.00 .00 ATOM 726 CB GLN 46 18.663 5.138 17.843 1.00 .00 ATOM 729 CG GLN 46 20.024 5.065 18.503 1.00 .00 ATOM 732 CD GLN 46 20.871 6.291 18.283 1.00 .00 ATOM 733 OE1 GLN 46 20.760 6.974 17.262 1.00 .00 ATOM 734 NE2 GLN 46 21.734 6.571 19.221 1.00 .00 ATOM 723 HN GLN 46 19.425 2.972 16.831 1.00 0.00 ATOM 725 HA GLN 46 17.704 3.627 19.009 1.00 0.00 ATOM 727 HB1 GLN 46 18.103 5.932 18.313 1.00 0.00 ATOM 728 HB2 GLN 46 18.799 5.370 16.797 1.00 0.00 ATOM 730 HG1 GLN 46 20.547 4.205 18.110 1.00 0.00 ATOM 731 HG2 GLN 46 19.886 4.943 19.567 1.00 0.00 ATOM 739 N LEU 47 16.546 3.610 15.951 1.00 .00 ATOM 741 CA LEU 47 15.348 3.572 15.150 1.00 .00 ATOM 756 C LEU 47 14.562 2.316 15.433 1.00 .00 ATOM 757 O LEU 47 13.341 2.282 15.287 1.00 .00 ATOM 743 CB LEU 47 15.688 3.639 13.659 1.00 .00 ATOM 746 CG LEU 47 15.915 5.018 13.014 1.00 .00 ATOM 748 CD1 LEU 47 14.673 5.882 13.126 1.00 .00 ATOM 752 CD2 LEU 47 17.115 5.726 13.594 1.00 .00 ATOM 740 HN LEU 47 17.379 3.373 15.497 1.00 0.00 ATOM 742 HA LEU 47 14.754 4.434 15.401 1.00 0.00 ATOM 744 HB1 LEU 47 14.961 3.079 13.102 1.00 0.00 ATOM 745 HB2 LEU 47 16.627 3.113 13.600 1.00 0.00 ATOM 747 HG LEU 47 16.086 4.864 11.957 1.00 0.00 ATOM 749 HD11 LEU 47 14.861 6.838 12.661 1.00 0.00 ATOM 750 HD12 LEU 47 14.429 6.036 14.166 1.00 0.00 ATOM 751 HD13 LEU 47 13.848 5.396 12.628 1.00 0.00 ATOM 753 HD21 LEU 47 16.972 5.867 14.655 1.00 0.00 ATOM 754 HD22 LEU 47 17.230 6.689 13.118 1.00 0.00 ATOM 755 HD23 LEU 47 18.002 5.133 13.426 1.00 0.00 ATOM 758 N SER 48 15.257 1.291 15.843 1.00 .00 ATOM 760 CA SER 48 14.647 .039 16.115 1.00 .00 ATOM 767 C SER 48 14.065 .017 17.528 1.00 .00 ATOM 768 O SER 48 14.707 -.433 18.490 1.00 .00 ATOM 762 CB SER 48 15.641 -1.100 15.889 1.00 .00 ATOM 765 OG SER 48 16.195 -1.019 14.570 1.00 .00 ATOM 759 HN SER 48 16.222 1.396 15.974 1.00 0.00 ATOM 761 HA SER 48 13.834 -0.074 15.413 1.00 0.00 ATOM 763 HB1 SER 48 15.137 -2.049 15.995 1.00 0.00 ATOM 764 HB2 SER 48 16.439 -1.029 16.613 1.00 0.00 ATOM 766 HG SER 48 16.681 -0.181 14.531 1.00 0.00 ATOM 769 N VAL 49 12.874 .571 17.650 1.00 .00 ATOM 771 CA VAL 49 12.150 .599 18.907 1.00 .00 ATOM 783 C VAL 49 11.580 -.794 19.142 1.00 .00 ATOM 784 O VAL 49 11.335 -1.225 20.280 1.00 .00 ATOM 773 CB VAL 49 10.999 1.645 18.861 1.00 .00 ATOM 775 CG1 VAL 49 10.268 1.728 20.192 1.00 .00 ATOM 779 CG2 VAL 49 11.531 3.016 18.458 1.00 .00 ATOM 770 HN VAL 49 12.478 0.977 16.846 1.00 0.00 ATOM 772 HA VAL 49 12.839 0.847 19.700 1.00 0.00 ATOM 774 HB VAL 49 10.294 1.324 18.109 1.00 0.00 ATOM 785 N GLU 50 11.393 -1.486 18.050 1.00 .00 ATOM 787 CA GLU 50 10.944 -2.838 18.031 1.00 .00 ATOM 798 C GLU 50 11.892 -3.622 17.147 1.00 .00 ATOM 799 O GLU 50 11.870 -3.472 15.915 1.00 .00 ATOM 789 CB GLU 50 9.528 -2.907 17.489 1.00 .00 ATOM 792 CG GLU 50 8.545 -2.120 18.320 1.00 .00 ATOM 795 CD GLU 50 7.176 -2.135 17.755 1.00 .00 ATOM 796 OE1 GLU 50 6.421 -3.089 18.041 1.00 .00 ATOM 797 OE2 GLU 50 6.815 -1.187 17.037 1.00 .00 ATOM 786 HN GLU 50 11.576 -1.057 17.186 1.00 0.00 ATOM 788 HA GLU 50 10.966 -3.221 19.041 1.00 0.00 ATOM 790 HB1 GLU 50 9.208 -3.939 17.471 1.00 0.00 ATOM 791 HB2 GLU 50 9.520 -2.517 16.482 1.00 0.00 ATOM 793 HG1 GLU 50 8.886 -1.098 18.389 1.00 0.00 ATOM 794 HG2 GLU 50 8.511 -2.554 19.307 1.00 0.00 ATOM 800 N PRO 51 12.793 -4.407 17.753 1.00 .00 ATOM 801 CA PRO 51 13.774 -5.186 17.020 1.00 .00 ATOM 812 C PRO 51 13.158 -6.359 16.248 1.00 .00 ATOM 813 O PRO 51 13.066 -7.489 16.752 1.00 .00 ATOM 803 CB PRO 51 14.749 -5.690 18.094 1.00 .00 ATOM 806 CG PRO 51 14.391 -4.946 19.337 1.00 .00 ATOM 809 CD PRO 51 12.947 -4.583 19.201 1.00 .00 ATOM 802 HA PRO 51 14.304 -4.552 16.327 1.00 0.00 ATOM 804 HB1 PRO 51 15.766 -5.492 17.790 1.00 0.00 ATOM 805 HB2 PRO 51 14.599 -6.750 18.227 1.00 0.00 ATOM 807 HG1 PRO 51 14.997 -4.055 19.417 1.00 0.00 ATOM 808 HG2 PRO 51 14.540 -5.578 20.201 1.00 0.00 ATOM 810 HD1 PRO 51 12.754 -3.661 19.730 1.00 0.00 ATOM 811 HD2 PRO 51 12.321 -5.384 19.568 1.00 0.00 ATOM 814 N TYR 52 12.682 -6.058 15.067 1.00 .00 ATOM 816 CA TYR 52 12.107 -7.024 14.164 1.00 .00 ATOM 833 C TYR 52 12.127 -6.404 12.782 1.00 .00 ATOM 834 O TYR 52 11.515 -5.345 12.551 1.00 .00 ATOM 818 CB TYR 52 10.678 -7.367 14.590 1.00 .00 ATOM 821 CG TYR 52 10.047 -8.523 13.838 1.00 .00 ATOM 822 CD1 TYR 52 10.490 -9.823 14.044 1.00 .00 ATOM 824 CD2 TYR 52 8.995 -8.322 12.953 1.00 .00 ATOM 826 CE1 TYR 52 9.911 -10.889 13.390 1.00 .00 ATOM 828 CE2 TYR 52 8.411 -9.388 12.290 1.00 .00 ATOM 830 CZ TYR 52 8.875 -10.671 12.515 1.00 .00 ATOM 831 OH TYR 52 8.285 -11.747 11.868 1.00 .00 ATOM 815 HN TYR 52 12.705 -5.119 14.783 1.00 0.00 ATOM 817 HA TYR 52 12.723 -7.911 14.169 1.00 0.00 ATOM 819 HB1 TYR 52 10.074 -6.488 14.427 1.00 0.00 ATOM 820 HB2 TYR 52 10.682 -7.614 15.640 1.00 0.00 ATOM 823 HD1 TYR 52 11.307 -9.993 14.730 1.00 0.00 ATOM 825 HD2 TYR 52 8.637 -7.318 12.779 1.00 0.00 ATOM 827 HE1 TYR 52 10.273 -11.891 13.566 1.00 0.00 ATOM 829 HE2 TYR 52 7.596 -9.217 11.602 1.00 0.00 ATOM 832 HH TYR 52 8.161 -11.499 10.943 1.00 0.00 ATOM 835 N SER 53 12.832 -7.016 11.899 1.00 .00 ATOM 837 CA SER 53 13.059 -6.488 10.605 1.00 .00 ATOM 844 C SER 53 12.701 -7.527 9.530 1.00 .00 ATOM 845 O SER 53 12.166 -8.611 9.825 1.00 .00 ATOM 839 CB SER 53 14.552 -6.073 10.511 1.00 .00 ATOM 842 OG SER 53 14.870 -5.455 9.274 1.00 .00 ATOM 836 HN SER 53 13.241 -7.889 12.108 1.00 0.00 ATOM 838 HA SER 53 12.455 -5.603 10.473 1.00 0.00 ATOM 840 HB1 SER 53 15.167 -6.953 10.631 1.00 0.00 ATOM 841 HB2 SER 53 14.776 -5.375 11.304 1.00 0.00 ATOM 843 HG SER 53 15.284 -4.609 9.497 1.00 0.00 ATOM 846 N GLN 54 13.030 -7.197 8.310 1.00 .00 ATOM 848 CA GLN 54 12.734 -7.993 7.137 1.00 .00 ATOM 861 C GLN 54 13.902 -8.986 6.849 1.00 .00 ATOM 862 O GLN 54 14.113 -9.435 5.729 1.00 .00 ATOM 850 CB GLN 54 12.446 -7.029 5.955 1.00 .00 ATOM 853 CG GLN 54 12.019 -7.691 4.659 1.00 .00 ATOM 856 CD GLN 54 11.591 -6.703 3.611 1.00 .00 ATOM 857 OE1 GLN 54 12.404 -6.217 2.817 1.00 .00 ATOM 858 NE2 GLN 54 10.318 -6.431 3.566 1.00 .00 ATOM 847 HN GLN 54 13.523 -6.351 8.220 1.00 0.00 ATOM 849 HA GLN 54 11.845 -8.567 7.353 1.00 0.00 ATOM 851 HB1 GLN 54 13.332 -6.445 5.761 1.00 0.00 ATOM 852 HB2 GLN 54 11.656 -6.356 6.248 1.00 0.00 ATOM 854 HG1 GLN 54 11.181 -8.334 4.873 1.00 0.00 ATOM 855 HG2 GLN 54 12.832 -8.282 4.266 1.00 0.00 ATOM 863 N GLU 55 14.649 -9.310 7.887 1.00 .00 ATOM 865 CA GLU 55 15.680 -10.343 7.798 1.00 .00 ATOM 876 C GLU 55 15.269 -11.577 8.586 1.00 .00 ATOM 877 O GLU 55 15.607 -12.709 8.219 1.00 .00 ATOM 867 CB GLU 55 17.059 -9.846 8.242 1.00 .00 ATOM 870 CG GLU 55 17.739 -8.886 7.272 1.00 .00 ATOM 873 CD GLU 55 17.986 -9.522 5.913 1.00 .00 ATOM 874 OE1 GLU 55 18.844 -10.438 5.805 1.00 .00 ATOM 875 OE2 GLU 55 17.335 -9.120 4.931 1.00 .00 ATOM 864 HN GLU 55 14.484 -8.833 8.723 1.00 0.00 ATOM 866 HA GLU 55 15.724 -10.635 6.760 1.00 0.00 ATOM 868 HB1 GLU 55 17.703 -10.701 8.386 1.00 0.00 ATOM 869 HB2 GLU 55 16.939 -9.333 9.184 1.00 0.00 ATOM 871 HG1 GLU 55 18.688 -8.582 7.690 1.00 0.00 ATOM 872 HG2 GLU 55 17.109 -8.019 7.138 1.00 0.00 ATOM 878 N GLU 56 14.530 -11.357 9.666 1.00 .00 ATOM 880 CA GLU 56 14.010 -12.450 10.491 1.00 .00 ATOM 891 C GLU 56 12.979 -13.238 9.698 1.00 .00 ATOM 892 O GLU 56 12.912 -14.466 9.761 1.00 .00 ATOM 882 CB GLU 56 13.371 -11.925 11.798 1.00 .00 ATOM 885 CG GLU 56 14.334 -11.318 12.831 1.00 .00 ATOM 888 CD GLU 56 15.102 -10.116 12.342 1.00 .00 ATOM 889 OE1 GLU 56 14.515 -9.034 12.233 1.00 .00 OE2 ATOM 890 OE2 GLU 56 16.309 -10.244 12.058 1.00 .00 OE1 ATOM 879 HN GLU 56 14.339 -10.433 9.922 1.00 0.00 ATOM 881 HA GLU 56 14.833 -13.105 10.734 1.00 0.00 ATOM 883 HB1 GLU 56 12.844 -12.742 12.267 1.00 0.00 ATOM 884 HB2 GLU 56 12.652 -11.162 11.541 1.00 0.00 ATOM 886 HG1 GLU 56 15.038 -12.083 13.124 1.00 0.00 ATOM 887 HG2 GLU 56 13.765 -11.018 13.697 1.00 0.00 ATOM 893 N ALA 57 12.214 -12.522 8.928 1.00 .00 ATOM 895 CA ALA 57 11.189 -13.083 8.093 1.00 .00 ATOM 901 C ALA 57 11.137 -12.267 6.830 1.00 .00 ATOM 902 O ALA 57 11.991 -11.407 6.643 1.00 .00 ATOM 897 CB ALA 57 9.847 -13.042 8.811 1.00 .00 ATOM 894 HN ALA 57 12.350 -11.552 8.879 1.00 0.00 ATOM 896 HA ALA 57 11.443 -14.107 7.863 1.00 0.00 ATOM 898 HB1 ALA 57 9.600 -12.021 9.059 1.00 0.00 ATOM 899 HB2 ALA 57 9.910 -13.628 9.715 1.00 0.00 ATOM 900 HB3 ALA 57 9.082 -13.455 8.169 1.00 0.00 ATOM 903 N GLU 58 10.147 -12.534 5.986 1.00 .00 ATOM 905 CA GLU 58 9.938 -11.806 4.731 1.00 .00 ATOM 916 C GLU 58 10.997 -12.120 3.677 1.00 .00 ATOM 917 O GLU 58 12.003 -11.429 3.549 1.00 .00 ATOM 907 CB GLU 58 9.804 -10.293 4.944 1.00 .00 ATOM 910 CG GLU 58 8.575 -9.844 5.715 1.00 .00 ATOM 913 CD GLU 58 8.581 -8.351 5.969 1.00 .00 ATOM 914 OE1 GLU 58 8.227 -7.568 5.062 1.00 .00 OE2 ATOM 915 OE2 GLU 58 8.956 -7.935 7.083 1.00 .00 OE1 ATOM 904 HN GLU 58 9.536 -13.265 6.212 1.00 0.00 ATOM 906 HA GLU 58 9.004 -12.173 4.334 1.00 0.00 ATOM 908 HB1 GLU 58 9.837 -9.786 3.991 1.00 0.00 ATOM 909 HB2 GLU 58 10.660 -10.010 5.538 1.00 0.00 ATOM 911 HG1 GLU 58 8.551 -10.357 6.665 1.00 0.00 ATOM 912 HG2 GLU 58 7.694 -10.096 5.144 1.00 0.00 ATOM 918 N ARG 59 10.780 -13.197 2.962 1.00 .00 ATOM 920 CA ARG 59 11.651 -13.587 1.870 1.00 .00 ATOM 940 C ARG 59 10.815 -13.825 .631 1.00 .00 ATOM 941 O ARG 59 11.200 -13.434 -.470 1.00 .00 ATOM 922 CB ARG 59 12.464 -14.845 2.200 1.00 .00 ATOM 925 CG ARG 59 13.441 -14.710 3.365 1.00 .00 ATOM 928 CD ARG 59 14.483 -13.626 3.113 1.00 .00 ATOM 931 NE ARG 59 15.508 -13.595 4.165 1.00 .00 ATOM 933 CZ ARG 59 16.242 -12.525 4.497 1.00 .00 ATOM 934 NH1 ARG 59 15.999 -11.339 3.941 1.00 .00 ATOM 937 NH2 ARG 59 17.206 -12.642 5.403 1.00 .00 ATOM 919 HN ARG 59 9.996 -13.739 3.187 1.00 0.00 ATOM 921 HA ARG 59 12.324 -12.764 1.677 1.00 0.00 ATOM 923 HB1 ARG 59 13.024 -15.129 1.321 1.00 0.00 ATOM 924 HB2 ARG 59 11.776 -15.639 2.442 1.00 0.00 ATOM 926 HG1 ARG 59 13.938 -15.657 3.509 1.00 0.00 ATOM 927 HG2 ARG 59 12.885 -14.458 4.256 1.00 0.00 ATOM 929 HD1 ARG 59 13.984 -12.668 3.086 1.00 0.00 ATOM 930 HD2 ARG 59 14.961 -13.809 2.161 1.00 0.00 ATOM 932 HE ARG 59 15.653 -14.463 4.607 1.00 0.00 ATOM 935 HH11 ARG 59 15.271 -11.218 3.260 1.00 0.00 ATOM 936 HH12 ARG 59 16.518 -10.511 4.197 1.00 0.00 ATOM 938 HH21 ARG 59 17.398 -13.518 5.853 1.00 0.00 ATOM 939 HH22 ARG 59 17.782 -11.853 5.655 1.00 0.00 ATOM 942 N ALA 60 9.677 -14.513 .823 1.00 .00 ATOM 944 CA ALA 60 8.663 -14.780 -.226 1.00 .00 ATOM 950 C ALA 60 9.122 -15.772 -1.314 1.00 .00 ATOM 951 O ALA 60 8.291 -16.313 -2.045 1.00 .00 ATOM 946 CB ALA 60 8.134 -13.483 -.845 1.00 .00 ATOM 943 HN ALA 60 9.499 -14.884 1.714 1.00 0.00 ATOM 945 HA ALA 60 7.837 -15.254 0.287 1.00 0.00 ATOM 947 HB1 ALA 60 7.288 -13.703 -1.479 1.00 0.00 ATOM 948 HB2 ALA 60 8.914 -13.021 -1.431 1.00 0.00 ATOM 949 HB3 ALA 60 7.830 -12.809 -0.057 1.00 0.00 ATOM 952 N ALA 61 10.417 -16.008 -1.414 1.00 .00 ATOM 954 CA ALA 61 10.968 -16.904 -2.393 1.00 .00 ATOM 960 C ALA 61 12.404 -17.210 -2.054 1.00 .00 ATOM 961 O ALA 61 13.311 -16.414 -2.335 1.00 .00 ATOM 956 CB ALA 61 10.865 -16.340 -3.807 1.00 .00 ATOM 953 HN ALA 61 11.051 -15.580 -0.805 1.00 0.00 ATOM 955 HA ALA 61 10.388 -17.813 -2.339 1.00 0.00 ATOM 957 HB1 ALA 61 11.222 -17.073 -4.515 1.00 0.00 ATOM 958 HB2 ALA 61 11.485 -15.459 -3.869 1.00 0.00 ATOM 959 HB3 ALA 61 9.839 -16.082 -4.027 1.00 0.00 ATOM 962 N GLY 62 12.597 -18.302 -1.386 1.00 .00 ATOM 964 CA GLY 62 13.925 -18.752 -1.047 1.00 .00 ATOM 967 C GLY 62 13.953 -20.234 -.755 1.00 .00 ATOM 968 O GLY 62 14.670 -20.686 .140 1.00 .00 ATOM 963 HN GLY 62 11.800 -18.797 -1.098 1.00 0.00 ATOM 965 HA1 GLY 62 14.265 -18.219 -0.171 1.00 0.00 ATOM 966 HA2 GLY 62 14.589 -18.538 -1.871 1.00 0.00 ATOM 969 N MET 63 13.166 -20.989 -1.491 1.00 .00 ATOM 971 CA MET 63 13.077 -22.431 -1.291 1.00 .00 ATOM 984 C MET 63 14.044 -23.146 -2.224 1.00 .00 ATOM 985 O MET 63 14.001 -22.950 -3.450 1.00 .00 ATOM 973 CB MET 63 11.645 -22.916 -1.537 1.00 .00 ATOM 976 CG MET 63 10.615 -22.237 -.650 1.00 .00 ATOM 979 SD MET 63 8.932 -22.766 -.991 1.00 .00 ATOM 980 CE MET 63 8.012 -21.693 .115 1.00 .00 ATOM 970 HN MET 63 12.629 -20.575 -2.202 1.00 0.00 ATOM 972 HA MET 63 13.352 -22.638 -0.268 1.00 0.00 ATOM 974 HB1 MET 63 11.600 -23.980 -1.356 1.00 0.00 ATOM 975 HB2 MET 63 11.386 -22.728 -2.569 1.00 0.00 ATOM 977 HG1 MET 63 10.683 -21.170 -0.801 1.00 0.00 ATOM 978 HG2 MET 63 10.845 -22.466 0.380 1.00 0.00 ATOM 981 HE1 MET 63 8.325 -21.863 1.134 1.00 0.00 ATOM 982 HE2 MET 63 6.958 -21.908 0.025 1.00 0.00 ATOM 983 HE3 MET 63 8.190 -20.661 -0.149 1.00 0.00 ATOM 986 N GLY 64 14.906 -23.957 -1.660 1.00 .00 ATOM 988 CA GLY 64 15.897 -24.638 -2.456 1.00 .00 ATOM 991 C GLY 64 16.206 -26.016 -1.935 1.00 .00 ATOM 992 O GLY 64 17.372 -26.384 -1.771 1.00 .00 ATOM 987 HN GLY 64 14.866 -24.098 -0.689 1.00 0.00 ATOM 989 HA1 GLY 64 16.804 -24.053 -2.459 1.00 0.00 ATOM 990 HA2 GLY 64 15.531 -24.722 -3.469 1.00 0.00 ATOM 993 N SER 65 15.179 -26.767 -1.657 1.00 .00 ATOM 995 CA SER 65 15.335 -28.116 -1.183 1.00 .00 ATOM 1002 C SER 65 15.054 -29.110 -2.305 1.00 .00 ATOM 1003 O SER 65 13.892 -29.391 -2.634 1.00 .00 ATOM 997 CB SER 65 14.444 -28.359 .046 1.00 .00 ATOM 1000 OG SER 65 13.084 -28.002 -.216 1.00 .00 ATOM 994 HN SER 65 14.273 -26.408 -1.782 1.00 0.00 ATOM 996 HA SER 65 16.368 -28.232 -0.896 1.00 0.00 ATOM 998 HB1 SER 65 14.804 -27.762 0.871 1.00 0.00 ATOM 999 HB2 SER 65 14.481 -29.403 0.319 1.00 0.00 ATOM 1001 HG SER 65 12.967 -27.875 -1.168 1.00 0.00 ATOM 1004 N TYR 66 16.102 -29.611 -2.919 1.00 .00 ATOM 1006 CA TYR 66 15.949 -30.514 -4.031 1.00 .00 ATOM 1023 C TYR 66 16.513 -31.877 -3.725 1.00 .00 ATOM 1024 O TYR 66 17.730 -32.062 -3.590 1.00 .00 ATOM 1008 CB TYR 66 16.579 -29.935 -5.281 1.00 .00 ATOM 1011 CG TYR 66 16.454 -30.805 -6.510 1.00 .00 ATOM 1012 CD1 TYR 66 15.223 -31.034 -7.088 1.00 .00 ATOM 1014 CD2 TYR 66 17.571 -31.380 -7.099 1.00 .00 ATOM 1016 CE1 TYR 66 15.097 -31.810 -8.212 1.00 .00 ATOM 1018 CE2 TYR 66 17.456 -32.163 -8.227 1.00 .00 ATOM 1020 CZ TYR 66 16.214 -32.374 -8.779 1.00 .00 ATOM 1021 OH TYR 66 16.086 -33.150 -9.912 1.00 .00 ATOM 1005 HN TYR 66 17.005 -29.371 -2.617 1.00 0.00 ATOM 1007 HA TYR 66 14.889 -30.620 -4.208 1.00 0.00 ATOM 1009 HB1 TYR 66 17.626 -29.797 -5.064 1.00 0.00 ATOM 1010 HB2 TYR 66 16.102 -28.991 -5.491 1.00 0.00 ATOM 1013 HD1 TYR 66 14.349 -30.591 -6.635 1.00 0.00 ATOM 1015 HD2 TYR 66 18.541 -31.209 -6.656 1.00 0.00 ATOM 1017 HE1 TYR 66 14.123 -31.975 -8.647 1.00 0.00 ATOM 1019 HE2 TYR 66 18.334 -32.607 -8.673 1.00 0.00 ATOM 1022 HH TYR 66 16.633 -33.938 -9.803 1.00 0.00 ATOM 1025 N VAL 67 15.630 -32.805 -3.605 1.00 .00 ATOM 1038 CA VAL 67 15.946 -34.190 -3.339 1.00 .00 ATOM 1039 C VAL 67 15.035 -35.035 -4.208 1.00 .00 ATOM 1028 CB VAL 67 15.718 -34.580 -1.838 1.00 .00 ATOM 1030 CG1 VAL 67 16.133 -36.023 -1.577 1.00 .00 ATOM 1034 CG2 VAL 67 16.454 -33.646 -.898 1.00 .00 ATOM 1026 HN VAL 67 14.695 -32.539 -3.723 1.00 0.00 ATOM 1027 HA VAL 67 16.976 -34.369 -3.612 1.00 0.00 ATOM 1029 HB VAL 67 14.659 -34.505 -1.643 1.00 0.00 ATOM 1042 ZN1 ZIN 68 21.935 2.948 5.368 1.00 0.00 MASTER 1013 END