REMARK FILENAME="/u/lytle/bc019267/9valid/c74c/refined_input/refined_17.pdb" REMARK Structure ACCEPTED REMARK E-overall: -1816.6 REMARK E-NOE_restraints: 46.7888 REMARK E-CDIH_restraints: 0.608943 REMARK E-COUP_restraints: 0 REMARK E-SANI_restraints: 0 REMARK E-VEAN_restraints: 0 REMARK RMS-NOE_restraints: 3.388498E-02 REMARK RMS-CDIH_restraints: 0.466141 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 6 26 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 23:48:57 created by user: ATOM 10 N ASP 1 4.691 -.919 1.462 1.00 .00 ATOM 14 CA ASP 1 3.693 -.955 .399 1.00 .00 ATOM 8 C ASP 1 3.664 -2.333 -.211 1.00 .00 ATOM 9 O ASP 1 4.720 -2.952 -.376 1.00 .00 ATOM 2 CB ASP 1 3.992 .100 -.673 1.00 .00 ATOM 5 CG ASP 1 3.889 1.504 -.142 1.00 .00 ATOM 6 OD1 ASP 1 4.859 2.000 .435 1.00 .00 ATOM 7 OD2 ASP 1 2.828 2.134 -.286 1.00 .00 ATOM 1 HA ASP 1 2.741 -0.739 0.858 1.00 0.00 ATOM 3 HB1 ASP 1 3.294 -0.017 -1.490 1.00 0.00 ATOM 4 HB2 ASP 1 4.999 -0.046 -1.033 1.00 0.00 ATOM 11 HT1 ASP 1 4.786 0.027 1.884 1.00 0.00 ATOM 12 HT2 ASP 1 5.613 -1.244 1.112 1.00 0.00 ATOM 13 HT3 ASP 1 4.402 -1.577 2.216 1.00 0.00 ATOM 15 N PRO 2 2.472 -2.867 -.543 1.00 .00 ATOM 16 CA PRO 2 2.351 -4.193 -1.145 1.00 .00 ATOM 27 C PRO 2 2.889 -4.203 -2.566 1.00 .00 ATOM 28 O PRO 2 2.601 -3.288 -3.348 1.00 .00 ATOM 18 CB PRO 2 .840 -4.466 -1.161 1.00 .00 ATOM 21 CG PRO 2 .241 -3.421 -.287 1.00 .00 ATOM 24 CD PRO 2 1.155 -2.239 -.362 1.00 .00 ATOM 17 HA PRO 2 2.857 -4.942 -0.557 1.00 0.00 ATOM 19 HB1 PRO 2 0.644 -5.459 -0.783 1.00 0.00 ATOM 20 HB2 PRO 2 0.478 -4.391 -2.176 1.00 0.00 ATOM 22 HG1 PRO 2 0.177 -3.780 0.730 1.00 0.00 ATOM 23 HG2 PRO 2 -0.741 -3.160 -0.652 1.00 0.00 ATOM 25 HD1 PRO 2 1.106 -1.685 0.561 1.00 0.00 ATOM 26 HD2 PRO 2 0.893 -1.612 -1.202 1.00 0.00 ATOM 29 N ASN 3 3.673 -5.234 -2.885 1.00 .00 ATOM 31 CA ASN 3 4.276 -5.427 -4.203 1.00 .00 ATOM 41 C ASN 3 5.136 -4.200 -4.613 1.00 .00 ATOM 42 O ASN 3 5.374 -3.937 -5.774 1.00 .00 ATOM 33 CB ASN 3 3.142 -5.754 -5.194 1.00 .00 ATOM 36 CG ASN 3 3.570 -6.060 -6.628 1.00 .00 ATOM 37 OD1 ASN 3 3.639 -5.170 -7.484 1.00 .00 ATOM 38 ND2 ASN 3 3.861 -7.320 -6.899 1.00 .00 ATOM 30 HN ASN 3 3.821 -5.934 -2.222 1.00 0.00 ATOM 32 HA ASN 3 4.940 -6.275 -4.138 1.00 0.00 ATOM 34 HB1 ASN 3 2.476 -4.912 -5.148 1.00 0.00 ATOM 35 HB2 ASN 3 2.632 -6.625 -4.808 1.00 0.00 ATOM 39 HD21 ASN 3 3.785 -7.979 -6.175 1.00 0.00 ATOM 40 HD22 ASN 3 4.138 -7.579 -7.803 1.00 0.00 ATOM 43 N ALA 4 5.644 -3.504 -3.619 1.00 .00 ATOM 45 CA ALA 4 6.477 -2.348 -3.816 1.00 .00 ATOM 51 C ALA 4 7.505 -2.311 -2.711 1.00 .00 ATOM 52 O ALA 4 7.210 -1.907 -1.586 1.00 .00 ATOM 47 CB ALA 4 5.645 -1.070 -3.839 1.00 .00 ATOM 44 HN ALA 4 5.487 -3.777 -2.693 1.00 0.00 ATOM 46 HA ALA 4 6.983 -2.462 -4.764 1.00 0.00 ATOM 48 HB1 ALA 4 5.123 -0.972 -2.900 1.00 0.00 ATOM 49 HB2 ALA 4 4.930 -1.120 -4.647 1.00 0.00 ATOM 50 HB3 ALA 4 6.292 -0.217 -3.984 1.00 0.00 ATOM 53 N GLU 5 8.672 -2.803 -3.027 1.00 .00 ATOM 55 CA GLU 5 9.779 -2.933 -2.100 1.00 .00 ATOM 66 C GLU 5 10.263 -1.603 -1.535 1.00 .00 ATOM 67 O GLU 5 10.703 -1.538 -.382 1.00 .00 ATOM 57 CB GLU 5 10.911 -3.688 -2.765 1.00 .00 ATOM 60 CG GLU 5 11.452 -3.030 -4.023 1.00 .00 ATOM 63 CD GLU 5 12.535 -3.837 -4.669 1.00 .00 ATOM 64 OE1 GLU 5 12.224 -4.679 -5.522 1.00 .00 OE2 ATOM 65 OE2 GLU 5 13.714 -3.633 -4.340 1.00 .00 OE1 ATOM 54 HN GLU 5 8.798 -3.126 -3.943 1.00 0.00 ATOM 56 HA GLU 5 9.430 -3.524 -1.272 1.00 0.00 ATOM 58 HB1 GLU 5 10.523 -4.655 -3.040 1.00 0.00 ATOM 59 HB2 GLU 5 11.719 -3.809 -2.064 1.00 0.00 ATOM 61 HG1 GLU 5 11.849 -2.060 -3.760 1.00 0.00 ATOM 62 HG2 GLU 5 10.646 -2.904 -4.729 1.00 0.00 ATOM 68 N PHE 6 10.186 -.567 -2.333 1.00 .00 ATOM 70 CA PHE 6 10.607 .754 -1.910 1.00 .00 ATOM 86 C PHE 6 9.798 1.209 -.696 1.00 .00 ATOM 87 O PHE 6 8.556 1.188 -.718 1.00 .00 ATOM 72 CB PHE 6 10.464 1.755 -3.066 1.00 .00 ATOM 75 CG PHE 6 10.844 3.167 -2.713 1.00 .00 ATOM 76 CD1 PHE 6 12.158 3.586 -2.801 1.00 .00 ATOM 78 CD2 PHE 6 9.883 4.068 -2.295 1.00 .00 ATOM 80 CE1 PHE 6 12.508 4.884 -2.478 1.00 .00 ATOM 82 CE2 PHE 6 10.221 5.363 -1.968 1.00 .00 ATOM 84 CZ PHE 6 11.536 5.775 -2.060 1.00 .00 ATOM 69 HN PHE 6 9.826 -0.717 -3.235 1.00 0.00 ATOM 71 HA PHE 6 11.648 0.693 -1.628 1.00 0.00 ATOM 73 HB1 PHE 6 9.438 1.756 -3.398 1.00 0.00 ATOM 74 HB2 PHE 6 11.099 1.442 -3.881 1.00 0.00 ATOM 77 HD1 PHE 6 12.905 2.877 -3.128 1.00 0.00 ATOM 79 HD2 PHE 6 8.859 3.732 -2.227 1.00 0.00 ATOM 81 HE1 PHE 6 13.538 5.202 -2.550 1.00 0.00 ATOM 83 HE2 PHE 6 9.459 6.054 -1.641 1.00 0.00 ATOM 85 HZ PHE 6 11.798 6.791 -1.804 1.00 0.00 ATOM 88 N ASP 7 10.490 1.583 .359 1.00 .00 ATOM 90 CA ASP 7 9.833 2.062 1.558 1.00 .00 ATOM 98 C ASP 7 9.917 3.581 1.587 1.00 .00 ATOM 99 O ASP 7 11.006 4.136 1.483 1.00 .00 ATOM 92 CB ASP 7 10.504 1.507 2.821 1.00 .00 ATOM 95 CG ASP 7 9.709 1.831 4.060 1.00 .00 ATOM 96 OD1 ASP 7 9.822 2.926 4.564 1.00 .00 OD2 ATOM 97 OD2 ASP 7 8.927 .968 4.534 1.00 .00 OD1 ATOM 89 HN ASP 7 11.468 1.551 0.345 1.00 0.00 ATOM 91 HA ASP 7 8.802 1.746 1.529 1.00 0.00 ATOM 93 HB1 ASP 7 11.457 2.004 2.921 1.00 0.00 ATOM 94 HB2 ASP 7 10.694 0.447 2.779 1.00 0.00 ATOM 100 N PRO 8 8.782 4.283 1.698 1.00 .00 ATOM 101 CA PRO 8 8.763 5.738 1.738 1.00 .00 ATOM 112 C PRO 8 8.738 6.300 3.171 1.00 .00 ATOM 113 O PRO 8 8.477 7.494 3.384 1.00 .00 ATOM 103 CB PRO 8 7.464 6.050 1.026 1.00 .00 ATOM 106 CG PRO 8 6.544 4.943 1.447 1.00 .00 ATOM 109 CD PRO 8 7.415 3.734 1.744 1.00 .00 ATOM 102 HA PRO 8 9.591 6.165 1.195 1.00 0.00 ATOM 104 HB1 PRO 8 7.621 6.042 -0.042 1.00 0.00 ATOM 105 HB2 PRO 8 7.104 7.018 1.342 1.00 0.00 ATOM 107 HG1 PRO 8 5.848 4.719 0.652 1.00 0.00 ATOM 108 HG2 PRO 8 6.007 5.240 2.336 1.00 0.00 ATOM 110 HD1 PRO 8 7.273 2.980 0.984 1.00 0.00 ATOM 111 HD2 PRO 8 7.191 3.336 2.722 1.00 0.00 ATOM 114 N ASP 9 8.989 5.458 4.132 1.00 .00 ATOM 116 CA ASP 9 9.056 5.873 5.520 1.00 .00 ATOM 124 C ASP 9 10.509 5.955 5.890 1.00 .00 ATOM 125 O ASP 9 10.942 6.846 6.620 1.00 .00 ATOM 118 CB ASP 9 8.351 4.856 6.412 1.00 .00 ATOM 121 CG ASP 9 8.283 5.267 7.863 1.00 .00 ATOM 122 OD1 ASP 9 9.239 5.031 8.605 1.00 .00 ATOM 123 OD2 ASP 9 7.245 5.819 8.281 1.00 .00 ATOM 115 HN ASP 9 9.157 4.509 3.922 1.00 0.00 ATOM 117 HA ASP 9 8.594 6.844 5.624 1.00 0.00 ATOM 119 HB1 ASP 9 8.886 3.920 6.344 1.00 0.00 ATOM 120 HB2 ASP 9 7.348 4.708 6.045 1.00 0.00 ATOM 126 N LEU 10 11.262 5.026 5.352 1.00 .00 ATOM 128 CA LEU 10 12.681 4.977 5.530 1.00 .00 ATOM 143 C LEU 10 13.293 5.728 4.345 1.00 .00 ATOM 144 O LEU 10 13.286 5.229 3.236 1.00 .00 ATOM 130 CB LEU 10 13.166 3.518 5.560 1.00 .00 ATOM 133 CG LEU 10 12.414 2.562 6.498 1.00 .00 ATOM 135 CD1 LEU 10 13.020 1.168 6.454 1.00 .00 ATOM 139 CD2 LEU 10 12.370 3.089 7.924 1.00 .00 ATOM 127 HN LEU 10 10.820 4.334 4.801 1.00 0.00 ATOM 129 HA LEU 10 12.932 5.476 6.454 1.00 0.00 ATOM 131 HB1 LEU 10 14.195 3.515 5.876 1.00 0.00 ATOM 132 HB2 LEU 10 13.186 3.107 4.564 1.00 0.00 ATOM 134 HG LEU 10 11.401 2.480 6.133 1.00 0.00 ATOM 136 HD11 LEU 10 12.963 0.783 5.447 1.00 0.00 ATOM 137 HD12 LEU 10 12.473 0.518 7.121 1.00 0.00 ATOM 138 HD13 LEU 10 14.053 1.208 6.766 1.00 0.00 ATOM 140 HD21 LEU 10 13.379 3.214 8.291 1.00 0.00 ATOM 141 HD22 LEU 10 11.848 2.378 8.547 1.00 0.00 ATOM 142 HD23 LEU 10 11.856 4.038 7.943 1.00 0.00 ATOM 145 N PRO 11 13.808 6.940 4.595 1.00 .00 ATOM 146 CA PRO 11 14.239 7.912 3.570 1.00 .00 ATOM 157 C PRO 11 14.805 7.383 2.249 1.00 .00 ATOM 158 O PRO 11 14.158 7.514 1.206 1.00 .00 ATOM 148 CB PRO 11 15.201 8.813 4.304 1.00 .00 ATOM 151 CG PRO 11 14.672 8.841 5.698 1.00 .00 ATOM 154 CD PRO 11 14.019 7.493 5.944 1.00 .00 ATOM 147 HA PRO 11 13.386 8.485 3.275 1.00 0.00 ATOM 149 HB1 PRO 11 15.189 9.796 3.860 1.00 0.00 ATOM 150 HB2 PRO 11 16.196 8.395 4.255 1.00 0.00 ATOM 152 HG1 PRO 11 13.945 9.631 5.805 1.00 0.00 ATOM 153 HG2 PRO 11 15.484 8.996 6.393 1.00 0.00 ATOM 155 HD1 PRO 11 13.075 7.592 6.459 1.00 0.00 ATOM 156 HD2 PRO 11 14.676 6.852 6.511 1.00 0.00 ATOM 159 N GLY 12 15.977 6.802 2.274 1.00 .00 ATOM 161 CA GLY 12 16.584 6.317 1.041 1.00 .00 ATOM 164 C GLY 12 16.062 4.969 .643 1.00 .00 ATOM 165 O GLY 12 16.844 4.054 .356 1.00 .00 ATOM 160 HN GLY 12 16.454 6.718 3.124 1.00 0.00 ATOM 162 HA1 GLY 12 17.652 6.250 1.184 1.00 0.00 ATOM 163 HA2 GLY 12 16.382 7.022 0.250 1.00 0.00 ATOM 166 N GLY 13 14.739 4.834 .670 1.00 .00 ATOM 168 CA GLY 13 14.075 3.590 .366 1.00 .00 ATOM 171 C GLY 13 14.316 2.575 1.437 1.00 .00 ATOM 172 O GLY 13 13.934 1.417 1.309 1.00 .00 ATOM 167 HN GLY 13 14.189 5.613 0.914 1.00 0.00 ATOM 169 HA1 GLY 13 14.451 3.203 -0.571 1.00 0.00 ATOM 170 HA2 GLY 13 13.013 3.757 0.287 1.00 0.00 ATOM 173 N GLY 14 14.904 3.031 2.526 1.00 .00 ATOM 175 CA GLY 14 15.374 2.120 3.541 1.00 .00 ATOM 178 C GLY 14 16.726 1.503 3.185 1.00 .00 ATOM 179 O GLY 14 17.364 .878 4.022 1.00 .00 ATOM 174 HN GLY 14 14.930 4.016 2.627 1.00 0.00 ATOM 176 HA1 GLY 14 14.653 1.324 3.665 1.00 0.00 ATOM 177 HA2 GLY 14 15.475 2.654 4.473 1.00 0.00 ATOM 180 N LEU 15 17.162 1.680 1.943 1.00 .00 ATOM 182 CA LEU 15 18.418 1.134 1.487 1.00 .00 ATOM 197 C LEU 15 19.600 2.038 1.788 1.00 .00 ATOM 198 O LEU 15 20.676 1.558 2.151 1.00 .00 ATOM 184 CB LEU 15 18.391 .765 -.006 1.00 .00 ATOM 187 CG LEU 15 17.492 -.417 -.439 1.00 .00 ATOM 189 CD1 LEU 15 16.017 -.102 -.339 1.00 .00 ATOM 193 CD2 LEU 15 17.846 -.894 -1.829 1.00 .00 ATOM 181 HN LEU 15 16.619 2.169 1.289 1.00 0.00 ATOM 183 HA LEU 15 18.575 0.229 2.048 1.00 0.00 ATOM 185 HB1 LEU 15 19.405 0.544 -0.295 1.00 0.00 ATOM 186 HB2 LEU 15 18.070 1.641 -0.551 1.00 0.00 ATOM 188 HG LEU 15 17.677 -1.227 0.247 1.00 0.00 ATOM 190 HD11 LEU 15 15.441 -0.957 -0.657 1.00 0.00 ATOM 191 HD12 LEU 15 15.787 0.746 -0.967 1.00 0.00 ATOM 192 HD13 LEU 15 15.772 0.136 0.685 1.00 0.00 ATOM 194 HD21 LEU 15 17.199 -1.719 -2.093 1.00 0.00 ATOM 195 HD22 LEU 15 18.877 -1.215 -1.859 1.00 0.00 ATOM 196 HD23 LEU 15 17.697 -0.089 -2.533 1.00 0.00 ATOM 199 N HIS 16 19.421 3.333 1.650 1.00 .00 ATOM 201 CA HIS 16 20.530 4.246 1.905 1.00 .00 ATOM 215 C HIS 16 20.588 4.600 3.354 1.00 .00 ATOM 216 O HIS 16 19.916 5.533 3.825 1.00 .00 ATOM 203 CB HIS 16 20.532 5.520 1.055 1.00 .00 ATOM 206 CG HIS 16 20.489 5.302 -.415 1.00 .00 ATOM 207 ND1 HIS 16 21.469 4.645 -1.112 1.00 .00 ATOM 209 CD2 HIS 16 19.575 5.672 -1.317 1.00 .00 ATOM 211 CE1 HIS 16 21.160 4.628 -2.388 1.00 .00 ATOM 213 NE2 HIS 16 20.008 5.243 -2.539 1.00 .00 ATOM 200 HN HIS 16 18.525 3.630 1.397 1.00 0.00 ATOM 202 HA HIS 16 21.422 3.677 1.692 1.00 0.00 ATOM 204 HB1 HIS 16 21.446 6.055 1.259 1.00 0.00 ATOM 205 HB2 HIS 16 19.746 6.185 1.363 1.00 0.00 ATOM 208 HD1 HIS 16 22.273 4.230 -0.723 1.00 0.00 ATOM 210 HD2 HIS 16 18.690 6.242 -1.079 1.00 0.00 ATOM 212 HE1 HIS 16 21.779 4.210 -3.167 1.00 0.00 ATOM 214 HE2 HIS 16 19.707 5.644 -3.390 1.00 0.00 ATOM 217 N ARG 17 21.324 3.821 4.057 1.00 .00 ATOM 219 CA ARG 17 21.536 3.991 5.448 1.00 .00 ATOM 239 C ARG 17 22.900 3.486 5.868 1.00 .00 ATOM 240 O ARG 17 23.297 2.365 5.542 1.00 .00 ATOM 221 CB ARG 17 20.397 3.366 6.255 1.00 .00 ATOM 224 CG ARG 17 19.975 1.962 5.830 1.00 .00 ATOM 227 CD ARG 17 18.785 1.476 6.654 1.00 .00 ATOM 230 NE ARG 17 19.116 1.314 8.068 1.00 .00 ATOM 232 CZ ARG 17 18.345 .708 8.980 1.00 .00 ATOM 233 NH1 ARG 17 17.227 .098 8.616 1.00 .00 ATOM 236 NH2 ARG 17 18.723 .681 10.249 1.00 .00 ATOM 218 HN ARG 17 21.743 3.063 3.600 1.00 0.00 ATOM 220 HA ARG 17 21.524 5.055 5.626 1.00 0.00 ATOM 222 HB1 ARG 17 19.556 4.037 6.208 1.00 0.00 ATOM 223 HB2 ARG 17 20.749 3.310 7.272 1.00 0.00 ATOM 225 HG1 ARG 17 20.804 1.284 5.974 1.00 0.00 ATOM 226 HG2 ARG 17 19.699 1.980 4.786 1.00 0.00 ATOM 228 HD1 ARG 17 18.346 0.574 6.255 1.00 0.00 ATOM 229 HD2 ARG 17 18.042 2.258 6.582 1.00 0.00 ATOM 231 HE ARG 17 19.979 1.711 8.324 1.00 0.00 ATOM 234 HH11 ARG 17 16.916 0.056 7.663 1.00 0.00 ATOM 235 HH12 ARG 17 16.631 -0.360 9.283 1.00 0.00 ATOM 237 HH21 ARG 17 19.576 1.101 10.563 1.00 0.00 ATOM 238 HH22 ARG 17 18.178 0.237 10.967 1.00 0.00 ATOM 241 N CYS 18 23.614 4.336 6.573 1.00 .00 ATOM 243 CA CYS 18 24.969 4.036 7.048 1.00 .00 ATOM 249 C CYS 18 24.906 2.993 8.123 1.00 .00 ATOM 250 O CYS 18 24.319 3.223 9.174 1.00 .00 ATOM 245 CB CYS 18 25.662 5.325 7.562 1.00 .00 ATOM 248 SG CYS 18 27.285 5.127 8.426 1.00 .00 ATOM 242 HN CYS 18 23.159 5.178 6.787 1.00 0.00 ATOM 244 HA CYS 18 25.533 3.642 6.215 1.00 0.00 ATOM 246 HB1 CYS 18 24.973 5.847 8.201 1.00 0.00 ATOM 247 HB2 CYS 18 25.842 5.954 6.702 1.00 0.00 ATOM 251 N LEU 19 25.528 1.863 7.862 1.00 .00 ATOM 253 CA LEU 19 25.522 .712 8.758 1.00 .00 ATOM 268 C LEU 19 26.129 1.074 10.098 1.00 .00 ATOM 269 O LEU 19 25.713 .581 11.140 1.00 .00 ATOM 255 CB LEU 19 26.279 -.491 8.135 1.00 .00 ATOM 258 CG LEU 19 25.697 -1.126 6.849 1.00 .00 ATOM 260 CD1 LEU 19 25.764 -.196 5.639 1.00 .00 ATOM 264 CD2 LEU 19 26.365 -2.451 6.547 1.00 .00 ATOM 252 HN LEU 19 26.041 1.799 7.027 1.00 0.00 ATOM 254 HA LEU 19 24.491 0.429 8.910 1.00 0.00 ATOM 256 HB1 LEU 19 26.352 -1.262 8.886 1.00 0.00 ATOM 257 HB2 LEU 19 27.275 -0.161 7.887 1.00 0.00 ATOM 259 HG LEU 19 24.658 -1.318 7.055 1.00 0.00 ATOM 261 HD11 LEU 19 25.364 -0.705 4.774 1.00 0.00 ATOM 262 HD12 LEU 19 26.790 0.082 5.452 1.00 0.00 ATOM 263 HD13 LEU 19 25.180 0.692 5.831 1.00 0.00 ATOM 265 HD21 LEU 19 27.427 -2.297 6.426 1.00 0.00 ATOM 266 HD22 LEU 19 25.953 -2.860 5.635 1.00 0.00 ATOM 267 HD23 LEU 19 26.190 -3.139 7.360 1.00 0.00 ATOM 270 N ALA 20 27.087 1.964 10.055 1.00 .00 ATOM 272 CA ALA 20 27.762 2.431 11.248 1.00 .00 ATOM 278 C ALA 20 26.880 3.383 12.082 1.00 .00 ATOM 279 O ALA 20 27.158 3.618 13.255 1.00 .00 ATOM 274 CB ALA 20 29.084 3.099 10.887 1.00 .00 ATOM 271 HN ALA 20 27.347 2.293 9.167 1.00 0.00 ATOM 273 HA ALA 20 27.982 1.563 11.852 1.00 0.00 ATOM 275 HB1 ALA 20 29.688 2.418 10.306 1.00 0.00 ATOM 276 HB2 ALA 20 29.611 3.366 11.791 1.00 0.00 ATOM 277 HB3 ALA 20 28.886 3.989 10.309 1.00 0.00 ATOM 280 N CYS 21 25.818 3.923 11.484 1.00 .00 ATOM 282 CA CYS 21 24.986 4.889 12.185 1.00 .00 ATOM 288 C CYS 21 23.584 4.412 12.417 1.00 .00 ATOM 289 O CYS 21 22.918 4.882 13.337 1.00 .00 ATOM 284 CB CYS 21 24.995 6.275 11.505 1.00 .00 ATOM 287 SG CYS 21 26.521 7.075 11.636 1.00 .00 ATOM 281 HN CYS 21 25.554 3.630 10.583 1.00 0.00 ATOM 283 HA CYS 21 25.438 5.007 13.158 1.00 0.00 ATOM 285 HB1 CYS 21 24.303 6.924 12.019 1.00 0.00 ATOM 286 HB2 CYS 21 24.833 6.333 10.437 1.00 0.00 ATOM 290 N ALA 22 23.131 3.495 11.573 1.00 .00 ATOM 292 CA ALA 22 21.773 2.956 11.613 1.00 .00 ATOM 298 C ALA 22 20.742 4.063 11.323 1.00 .00 ATOM 299 O ALA 22 19.546 3.915 11.586 1.00 .00 ATOM 294 CB ALA 22 21.484 2.244 12.939 1.00 .00 ATOM 291 HN ALA 22 23.725 3.143 10.873 1.00 0.00 ATOM 293 HA ALA 22 21.780 2.235 10.813 1.00 0.00 ATOM 295 HB1 ALA 22 22.225 1.478 13.111 1.00 0.00 ATOM 296 HB2 ALA 22 20.505 1.792 12.895 1.00 0.00 ATOM 297 HB3 ALA 22 21.511 2.961 13.745 1.00 0.00 ATOM 300 N ARG 23 21.225 5.130 10.714 1.00 .00 ATOM 302 CA ARG 23 20.430 6.294 10.395 1.00 .00 ATOM 322 C ARG 23 20.158 6.275 8.919 1.00 .00 ATOM 323 O ARG 23 20.949 5.710 8.153 1.00 .00 ATOM 304 CB ARG 23 21.194 7.577 10.772 1.00 .00 ATOM 307 CG ARG 23 21.549 7.661 12.249 1.00 .00 ATOM 310 CD ARG 23 22.401 8.882 12.574 1.00 .00 ATOM 313 NE ARG 23 22.809 8.874 13.987 1.00 .00 ATOM 315 CZ ARG 23 24.003 9.283 14.459 1.00 .00 ATOM 316 NH1 ARG 23 24.889 9.875 13.651 1.00 .00 ATOM 319 NH2 ARG 23 24.287 9.123 15.752 1.00 .00 ATOM 301 HN ARG 23 22.162 5.109 10.441 1.00 0.00 ATOM 303 HA ARG 23 19.501 6.251 10.944 1.00 0.00 ATOM 305 HB1 ARG 23 20.581 8.430 10.521 1.00 0.00 ATOM 306 HB2 ARG 23 22.110 7.618 10.201 1.00 0.00 ATOM 308 HG1 ARG 23 22.090 6.769 12.528 1.00 0.00 ATOM 309 HG2 ARG 23 20.637 7.716 12.823 1.00 0.00 ATOM 311 HD1 ARG 23 21.828 9.776 12.380 1.00 0.00 ATOM 312 HD2 ARG 23 23.280 8.873 11.947 1.00 0.00 ATOM 314 HE ARG 23 22.137 8.503 14.606 1.00 0.00 ATOM 317 HH11 ARG 23 24.697 10.043 12.679 1.00 0.00 ATOM 318 HH12 ARG 23 25.790 10.178 13.966 1.00 0.00 ATOM 320 HH21 ARG 23 23.615 8.708 16.376 1.00 0.00 ATOM 321 HH22 ARG 23 25.160 9.368 16.180 1.00 0.00 ATOM 324 N TYR 24 19.094 6.898 8.520 1.00 .00 ATOM 326 CA TYR 24 18.644 6.863 7.186 1.00 .00 ATOM 343 C TYR 24 18.973 8.168 6.512 1.00 .00 ATOM 344 O TYR 24 18.975 9.219 7.153 1.00 .00 ATOM 328 CB TYR 24 17.148 6.730 7.203 1.00 .00 ATOM 331 CG TYR 24 16.591 5.562 7.977 1.00 .00 ATOM 332 CD1 TYR 24 16.470 4.311 7.404 1.00 .00 ATOM 334 CD2 TYR 24 16.159 5.728 9.286 1.00 .00 ATOM 336 CE1 TYR 24 15.931 3.258 8.114 1.00 .00 ATOM 338 CE2 TYR 24 15.629 4.685 10.003 1.00 .00 ATOM 340 CZ TYR 24 15.515 3.454 9.416 1.00 .00 ATOM 341 OH TYR 24 14.962 2.418 10.124 1.00 .00 ATOM 325 HN TYR 24 18.537 7.440 9.114 1.00 0.00 ATOM 327 HA TYR 24 19.055 6.017 6.659 1.00 0.00 ATOM 329 HB1 TYR 24 16.828 6.659 6.183 1.00 0.00 ATOM 330 HB2 TYR 24 16.735 7.629 7.637 1.00 0.00 ATOM 333 HD1 TYR 24 16.801 4.165 6.385 1.00 0.00 ATOM 335 HD2 TYR 24 16.252 6.701 9.743 1.00 0.00 ATOM 337 HE1 TYR 24 15.842 2.285 7.655 1.00 0.00 ATOM 339 HE2 TYR 24 15.303 4.839 11.021 1.00 0.00 ATOM 342 HH TYR 24 15.476 1.608 10.032 1.00 0.00 ATOM 345 N PHE 25 19.248 8.109 5.237 1.00 .00 ATOM 347 CA PHE 25 19.561 9.290 4.477 1.00 .00 ATOM 363 C PHE 25 18.677 9.350 3.265 1.00 .00 ATOM 364 O PHE 25 18.317 8.309 2.727 1.00 .00 ATOM 349 CB PHE 25 21.034 9.297 4.091 1.00 .00 ATOM 352 CG PHE 25 21.930 9.280 5.288 1.00 .00 ATOM 353 CD1 PHE 25 22.282 10.455 5.915 1.00 .00 CD2 ATOM 355 CD2 PHE 25 22.393 8.084 5.803 1.00 .00 CD1 ATOM 357 CE1 PHE 25 23.081 10.441 7.030 1.00 .00 CE2 ATOM 359 CE2 PHE 25 23.190 8.062 6.920 1.00 .00 CE1 ATOM 361 CZ PHE 25 23.536 9.239 7.536 1.00 .00 ATOM 346 HN PHE 25 19.255 7.249 4.761 1.00 0.00 ATOM 348 HA PHE 25 19.355 10.143 5.104 1.00 0.00 ATOM 350 HB1 PHE 25 21.248 10.191 3.526 1.00 0.00 ATOM 351 HB2 PHE 25 21.250 8.426 3.491 1.00 0.00 ATOM 354 HD1 PHE 25 22.122 7.159 5.316 1.00 0.00 ATOM 356 HD2 PHE 25 21.927 11.395 5.518 1.00 0.00 ATOM 358 HE1 PHE 25 23.542 7.118 7.307 1.00 0.00 ATOM 360 HE2 PHE 25 23.348 11.372 7.506 1.00 0.00 ATOM 362 HZ PHE 25 24.164 9.221 8.415 1.00 0.00 ATOM 365 N ILE 26 18.317 10.566 2.859 1.00 .00 ATOM 367 CA ILE 26 17.399 10.813 1.731 1.00 .00 ATOM 382 C ILE 26 17.842 10.092 .456 1.00 .00 ATOM 383 O ILE 26 17.068 9.362 -.161 1.00 .00 ATOM 369 CB ILE 26 17.293 12.336 1.428 1.00 .00 ATOM 371 CG1 ILE 26 16.782 13.135 2.644 1.00 .00 ATOM 374 CG2 ILE 26 16.421 12.609 .201 1.00 .00 ATOM 378 CD1 ILE 26 15.393 12.754 3.118 1.00 .00 ATOM 366 HN ILE 26 18.688 11.335 3.345 1.00 0.00 ATOM 368 HA ILE 26 16.421 10.464 2.006 1.00 0.00 ATOM 370 HB ILE 26 18.301 12.640 1.211 1.00 0.00 ATOM 379 HD11 ILE 26 15.389 11.720 3.424 1.00 0.00 ATOM 380 HD12 ILE 26 14.687 12.892 2.312 1.00 0.00 ATOM 381 HD13 ILE 26 15.116 13.379 3.953 1.00 0.00 ATOM 384 N ASP 27 19.075 10.287 .094 1.00 .00 ATOM 386 CA ASP 27 19.624 9.745 -1.133 1.00 .00 ATOM 394 C ASP 27 21.015 9.200 -.845 1.00 .00 ATOM 395 O ASP 27 21.540 9.400 .263 1.00 .00 ATOM 388 CB ASP 27 19.677 10.885 -2.183 1.00 .00 ATOM 391 CG ASP 27 20.237 10.497 -3.534 1.00 .00 ATOM 392 OD1 ASP 27 19.470 10.072 -4.413 1.00 .00 ATOM 393 OD2 ASP 27 21.457 10.613 -3.733 1.00 .00 ATOM 385 HN ASP 27 19.659 10.820 0.675 1.00 0.00 ATOM 387 HA ASP 27 18.989 8.950 -1.496 1.00 0.00 ATOM 389 HB1 ASP 27 20.273 11.687 -1.776 1.00 0.00 ATOM 390 HB2 ASP 27 18.672 11.245 -2.338 1.00 0.00 ATOM 396 N SER 28 21.613 8.519 -1.813 1.00 .00 ATOM 398 CA SER 28 22.940 7.972 -1.673 1.00 .00 ATOM 405 C SER 28 23.936 9.107 -1.481 1.00 .00 ATOM 406 O SER 28 24.929 8.950 -.797 1.00 .00 ATOM 400 CB SER 28 23.286 7.160 -2.924 1.00 .00 ATOM 403 OG SER 28 23.259 7.979 -4.082 1.00 .00 ATOM 397 HN SER 28 21.171 8.390 -2.681 1.00 0.00 ATOM 399 HA SER 28 22.964 7.322 -0.809 1.00 0.00 ATOM 401 HB1 SER 28 22.520 6.407 -3.038 1.00 0.00 ATOM 402 HB2 SER 28 24.229 6.645 -2.833 1.00 0.00 ATOM 404 HG SER 28 23.139 7.422 -4.861 1.00 0.00 ATOM 407 N THR 29 23.622 10.261 -2.072 1.00 .00 ATOM 409 CA THR 29 24.446 11.443 -1.978 1.00 .00 ATOM 419 C THR 29 24.602 11.862 -.514 1.00 .00 ATOM 420 O THR 29 25.710 12.071 -.042 1.00 .00 ATOM 411 CB THR 29 23.813 12.601 -2.760 1.00 .00 ATOM 413 OG1 THR 29 23.489 12.169 -4.097 1.00 .00 ATOM 415 CG2 THR 29 24.764 13.790 -2.835 1.00 .00 ATOM 408 HN THR 29 22.795 10.299 -2.611 1.00 0.00 ATOM 410 HA THR 29 25.412 11.231 -2.399 1.00 0.00 ATOM 412 HB THR 29 22.925 12.888 -2.225 1.00 0.00 ATOM 414 HG1 THR 29 22.735 11.553 -4.026 1.00 0.00 ATOM 421 N ASN 30 23.479 11.934 .202 1.00 .00 ATOM 423 CA ASN 30 23.456 12.320 1.593 1.00 .00 ATOM 433 C ASN 30 24.276 11.362 2.406 1.00 .00 ATOM 434 O ASN 30 25.050 11.763 3.272 1.00 .00 ATOM 425 CB ASN 30 22.025 12.301 2.103 1.00 .00 ATOM 428 CG ASN 30 21.109 13.256 1.393 1.00 .00 ATOM 429 OD1 ASN 30 20.522 12.905 .381 1.00 .00 ATOM 430 ND2 ASN 30 20.950 14.441 1.922 1.00 .00 ATOM 422 HN ASN 30 22.603 11.724 -0.180 1.00 0.00 ATOM 424 HA ASN 30 23.852 13.316 1.694 1.00 0.00 ATOM 426 HB1 ASN 30 22.034 12.533 3.150 1.00 0.00 ATOM 427 HB2 ASN 30 21.628 11.308 1.951 1.00 0.00 ATOM 431 HD21 ASN 30 21.412 14.680 2.752 1.00 0.00 ATOM 432 HD22 ASN 30 20.349 15.049 1.439 1.00 0.00 ATOM 435 N LEU 31 24.099 10.102 2.112 1.00 .00 ATOM 437 CA LEU 31 24.805 9.038 2.758 1.00 .00 ATOM 452 C LEU 31 26.320 9.134 2.493 1.00 .00 ATOM 453 O LEU 31 27.121 9.074 3.425 1.00 .00 ATOM 439 CB LEU 31 24.163 7.689 2.325 1.00 .00 ATOM 442 CG LEU 31 24.791 6.381 2.802 1.00 .00 ATOM 444 CD1 LEU 31 25.993 5.997 1.979 1.00 .00 ATOM 448 CD2 LEU 31 25.132 6.468 4.272 1.00 .00 ATOM 436 HN LEU 31 23.446 9.882 1.415 1.00 0.00 ATOM 438 HA LEU 31 24.649 9.162 3.820 1.00 0.00 ATOM 440 HB1 LEU 31 24.144 7.677 1.244 1.00 0.00 ATOM 441 HB2 LEU 31 23.139 7.692 2.667 1.00 0.00 ATOM 443 HG LEU 31 24.114 5.563 2.684 1.00 0.00 ATOM 445 HD11 LEU 31 26.719 6.794 2.036 1.00 0.00 ATOM 446 HD12 LEU 31 25.696 5.853 0.950 1.00 0.00 ATOM 447 HD13 LEU 31 26.427 5.087 2.365 1.00 0.00 ATOM 449 HD21 LEU 31 24.239 6.698 4.834 1.00 0.00 ATOM 450 HD22 LEU 31 25.875 7.234 4.438 1.00 0.00 ATOM 451 HD23 LEU 31 25.513 5.511 4.596 1.00 0.00 ATOM 454 N LYS 32 26.687 9.293 1.249 1.00 .00 ATOM 456 CA LYS 32 28.104 9.439 .864 1.00 .00 ATOM 474 C LYS 32 28.743 10.711 1.456 1.00 .00 ATOM 475 O LYS 32 29.857 10.659 1.986 1.00 .00 ATOM 458 CB LYS 32 28.278 9.405 -.662 1.00 .00 ATOM 461 CG LYS 32 27.901 8.071 -1.304 1.00 .00 ATOM 464 CD LYS 32 28.020 8.111 -2.831 1.00 .00 ATOM 467 CE LYS 32 29.443 8.409 -3.297 1.00 .00 ATOM 470 NZ LYS 32 29.541 8.463 -4.774 1.00 .00 ATOM 455 HN LYS 32 25.961 9.274 0.583 1.00 0.00 ATOM 457 HA LYS 32 28.623 8.593 1.289 1.00 0.00 ATOM 459 HB1 LYS 32 29.315 9.609 -0.885 1.00 0.00 ATOM 460 HB2 LYS 32 27.665 10.178 -1.101 1.00 0.00 ATOM 462 HG1 LYS 32 26.882 7.834 -1.037 1.00 0.00 ATOM 463 HG2 LYS 32 28.556 7.301 -0.924 1.00 0.00 ATOM 465 HD1 LYS 32 27.358 8.876 -3.205 1.00 0.00 ATOM 466 HD2 LYS 32 27.713 7.157 -3.232 1.00 0.00 ATOM 468 HE1 LYS 32 30.101 7.638 -2.925 1.00 0.00 ATOM 469 HE2 LYS 32 29.749 9.366 -2.903 1.00 0.00 ATOM 471 HZ1 LYS 32 28.923 9.208 -5.154 1.00 0.00 ATOM 472 HZ2 LYS 32 29.264 7.568 -5.225 1.00 0.00 ATOM 473 HZ3 LYS 32 30.511 8.681 -5.078 1.00 0.00 ATOM 476 N THR 33 28.027 11.835 1.396 1.00 .00 ATOM 478 CA THR 33 28.507 13.093 1.970 1.00 .00 ATOM 488 C THR 33 28.673 12.942 3.492 1.00 .00 ATOM 489 O THR 33 29.555 13.543 4.111 1.00 .00 ATOM 480 CB THR 33 27.537 14.243 1.644 1.00 .00 ATOM 482 OG1 THR 33 27.372 14.333 .218 1.00 .00 ATOM 484 CG2 THR 33 28.051 15.575 2.168 1.00 .00 ATOM 477 HN THR 33 27.155 11.839 0.939 1.00 0.00 ATOM 479 HA THR 33 29.466 13.310 1.535 1.00 0.00 ATOM 481 HB THR 33 26.608 13.996 2.121 1.00 0.00 ATOM 483 HG1 THR 33 26.792 15.077 0.011 1.00 0.00 ATOM 490 N HIS 34 27.841 12.094 4.062 1.00 .00 ATOM 492 CA HIS 34 27.876 11.760 5.472 1.00 .00 ATOM 505 C HIS 34 29.235 11.160 5.907 1.00 .00 ATOM 506 O HIS 34 29.643 11.313 7.061 1.00 .00 ATOM 494 CB HIS 34 26.678 10.834 5.822 1.00 .00 ATOM 497 CG HIS 34 26.797 10.087 7.107 1.00 .00 ATOM 498 ND1 HIS 34 26.574 10.632 8.343 1.00 .00 ATOM 500 CD2 HIS 34 27.174 8.813 7.330 1.00 .00 ATOM 502 CE1 HIS 34 26.822 9.726 9.251 1.00 .00 ATOM 504 NE2 HIS 34 27.174 8.635 8.669 1.00 .00 ATOM 491 HN HIS 34 27.160 11.674 3.492 1.00 0.00 ATOM 493 HA HIS 34 27.749 12.688 6.010 1.00 0.00 ATOM 495 HB1 HIS 34 26.557 10.115 5.024 1.00 0.00 ATOM 496 HB2 HIS 34 25.780 11.430 5.885 1.00 0.00 ATOM 499 HD1 HIS 34 26.284 11.552 8.544 1.00 0.00 ATOM 501 HD2 HIS 34 27.430 8.075 6.583 1.00 0.00 ATOM 503 HE1 HIS 34 26.808 9.739 10.331 1.00 0.00 ATOM 507 N PHE 35 29.942 10.490 5.003 1.00 .00 ATOM 509 CA PHE 35 31.222 9.924 5.396 1.00 .00 ATOM 525 C PHE 35 32.337 10.908 5.084 1.00 .00 ATOM 526 O PHE 35 33.491 10.651 5.360 1.00 .00 ATOM 511 CB PHE 35 31.542 8.590 4.717 1.00 .00 ATOM 514 CG PHE 35 30.421 7.610 4.655 1.00 .00 ATOM 515 CD1 PHE 35 29.842 7.099 5.803 1.00 .00 CD2 ATOM 517 CD2 PHE 35 29.936 7.217 3.433 1.00 .00 CD1 ATOM 519 CE1 PHE 35 28.793 6.205 5.721 1.00 .00 CE2 ATOM 521 CE2 PHE 35 28.897 6.340 3.336 1.00 .00 CE1 ATOM 523 CZ PHE 35 28.312 5.824 4.470 1.00 .00 ATOM 508 HN PHE 35 29.616 10.387 4.081 1.00 0.00 ATOM 510 HA PHE 35 31.192 9.782 6.467 1.00 0.00 ATOM 512 HB1 PHE 35 32.299 8.155 5.354 1.00 0.00 ATOM 513 HB2 PHE 35 31.935 8.736 3.723 1.00 0.00 ATOM 516 HD1 PHE 35 30.385 7.613 2.534 1.00 0.00 ATOM 518 HD2 PHE 35 30.220 7.400 6.769 1.00 0.00 ATOM 520 HE1 PHE 35 28.540 6.047 2.361 1.00 0.00 ATOM 522 HE2 PHE 35 28.369 5.827 6.644 1.00 0.00 ATOM 524 HZ PHE 35 27.468 5.150 4.323 1.00 0.00 ATOM 527 N ARG 36 31.994 12.050 4.520 1.00 .00 ATOM 529 CA ARG 36 33.009 13.046 4.217 1.00 .00 ATOM 549 C ARG 36 33.275 13.922 5.429 1.00 .00 ATOM 550 O ARG 36 33.979 14.936 5.358 1.00 .00 ATOM 531 CB ARG 36 32.680 13.865 2.968 1.00 .00 ATOM 534 CG ARG 36 32.596 13.018 1.703 1.00 .00 ATOM 537 CD ARG 36 32.491 13.872 .449 1.00 .00 ATOM 540 NE ARG 36 33.686 14.719 .267 1.00 .00 ATOM 542 CZ ARG 36 34.194 15.111 -.914 1.00 .00 ATOM 543 NH1 ARG 36 33.610 14.752 -2.050 1.00 .00 ATOM 546 NH2 ARG 36 35.285 15.874 -.946 1.00 .00 ATOM 528 HN ARG 36 31.052 12.239 4.310 1.00 0.00 ATOM 530 HA ARG 36 33.917 12.487 4.044 1.00 0.00 ATOM 532 HB1 ARG 36 33.446 14.612 2.827 1.00 0.00 ATOM 533 HB2 ARG 36 31.730 14.356 3.119 1.00 0.00 ATOM 535 HG1 ARG 36 31.730 12.376 1.769 1.00 0.00 ATOM 536 HG2 ARG 36 33.487 12.413 1.631 1.00 0.00 ATOM 538 HD1 ARG 36 31.619 14.505 0.525 1.00 0.00 ATOM 539 HD2 ARG 36 32.397 13.217 -0.404 1.00 0.00 ATOM 541 HE ARG 36 34.126 15.006 1.100 1.00 0.00 ATOM 544 HH11 ARG 36 32.780 14.187 -2.061 1.00 0.00 ATOM 545 HH12 ARG 36 33.983 15.032 -2.938 1.00 0.00 ATOM 547 HH21 ARG 36 35.747 16.174 -0.107 1.00 0.00 ATOM 548 HH22 ARG 36 35.706 16.184 -1.804 1.00 0.00 ATOM 551 N SER 37 32.708 13.520 6.538 1.00 .00 ATOM 553 CA SER 37 32.972 14.128 7.784 1.00 .00 ATOM 560 C SER 37 33.970 13.201 8.503 1.00 .00 ATOM 561 O SER 37 33.620 12.071 8.904 1.00 .00 ATOM 555 CB SER 37 31.672 14.298 8.570 1.00 .00 ATOM 558 OG SER 37 31.842 15.167 9.680 1.00 .00 ATOM 552 HN SER 37 32.083 12.766 6.503 1.00 0.00 ATOM 554 HA SER 37 33.429 15.084 7.598 1.00 0.00 ATOM 556 HB1 SER 37 31.389 13.323 8.929 1.00 0.00 ATOM 557 HB2 SER 37 30.901 14.694 7.925 1.00 0.00 ATOM 559 HG SER 37 32.116 14.660 10.467 1.00 0.00 ATOM 562 N LYS 38 35.210 13.663 8.624 1.00 .00 ATOM 564 CA LYS 38 36.331 12.845 9.096 1.00 .00 ATOM 582 C LYS 38 36.123 12.223 10.474 1.00 .00 ATOM 583 O LYS 38 36.578 11.114 10.705 1.00 .00 ATOM 566 CB LYS 38 37.648 13.620 9.056 1.00 .00 ATOM 569 CG LYS 38 37.677 14.829 9.955 1.00 .00 ATOM 572 CD LYS 38 39.020 15.515 9.916 1.00 .00 ATOM 575 CE LYS 38 39.053 16.681 10.878 1.00 .00 ATOM 578 NZ LYS 38 40.360 17.353 10.879 1.00 .00 ATOM 563 HN LYS 38 35.387 14.599 8.386 1.00 0.00 ATOM 565 HA LYS 38 36.415 12.032 8.391 1.00 0.00 ATOM 567 HB1 LYS 38 37.828 13.946 8.042 1.00 0.00 ATOM 568 HB2 LYS 38 38.450 12.960 9.353 1.00 0.00 ATOM 570 HG1 LYS 38 37.463 14.502 10.961 1.00 0.00 ATOM 571 HG2 LYS 38 36.909 15.511 9.621 1.00 0.00 ATOM 573 HD1 LYS 38 39.206 15.876 8.915 1.00 0.00 ATOM 574 HD2 LYS 38 39.786 14.807 10.196 1.00 0.00 ATOM 576 HE1 LYS 38 38.850 16.310 11.871 1.00 0.00 ATOM 577 HE2 LYS 38 38.290 17.393 10.602 1.00 0.00 ATOM 579 HZ1 LYS 38 40.590 17.757 9.950 1.00 0.00 ATOM 580 HZ2 LYS 38 41.110 16.678 11.129 1.00 0.00 ATOM 581 HZ3 LYS 38 40.377 18.114 11.587 1.00 0.00 ATOM 584 N ASP 39 35.396 12.918 11.362 1.00 .00 ATOM 586 CA ASP 39 35.163 12.484 12.739 1.00 .00 ATOM 594 C ASP 39 34.581 11.093 12.811 1.00 .00 ATOM 595 O ASP 39 34.845 10.352 13.739 1.00 .00 ATOM 588 CB ASP 39 34.212 13.449 13.442 1.00 .00 ATOM 591 CG ASP 39 32.809 13.504 12.844 1.00 .00 ATOM 592 OD1 ASP 39 31.927 12.716 13.258 1.00 .00 OD2 ATOM 593 OD2 ASP 39 32.573 14.349 11.961 1.00 .00 OD1 ATOM 585 HN ASP 39 34.986 13.778 11.133 1.00 0.00 ATOM 587 HA ASP 39 36.105 12.507 13.264 1.00 0.00 ATOM 589 HB1 ASP 39 34.643 14.434 13.382 1.00 0.00 ATOM 590 HB2 ASP 39 34.141 13.162 14.471 1.00 0.00 ATOM 596 N HIS 40 33.817 10.753 11.827 1.00 .00 ATOM 598 CA HIS 40 33.143 9.472 11.772 1.00 .00 ATOM 611 C HIS 40 34.110 8.395 11.557 1.00 .00 ATOM 612 O HIS 40 34.209 7.460 12.321 1.00 .00 ATOM 600 CB HIS 40 32.219 9.460 10.599 1.00 .00 ATOM 603 CG HIS 40 31.308 8.336 10.508 1.00 .00 ATOM 604 ND1 HIS 40 31.050 7.532 11.601 1.00 .00 ATOM 606 CD2 HIS 40 30.356 8.224 9.698 1.00 .00 ATOM 608 CE1 HIS 40 29.892 7.011 11.438 1.00 .00 ATOM 610 NE2 HIS 40 29.435 7.416 10.298 1.00 .00 ATOM 597 HN HIS 40 33.699 11.425 11.121 1.00 0.00 ATOM 599 HA HIS 40 32.582 9.272 12.666 1.00 0.00 ATOM 601 HB1 HIS 40 32.749 9.520 9.663 1.00 0.00 ATOM 602 HB2 HIS 40 31.492 10.265 10.673 1.00 0.00 ATOM 605 HD1 HIS 40 31.590 7.381 12.412 1.00 0.00 ATOM 607 HD2 HIS 40 30.545 8.583 8.688 1.00 0.00 ATOM 609 HE1 HIS 40 29.365 6.330 12.085 1.00 0.00 ATOM 613 N LYS 41 34.812 8.541 10.519 1.00 .00 ATOM 615 CA LYS 41 35.704 7.567 10.080 1.00 .00 ATOM 633 C LYS 41 36.870 7.510 11.052 1.00 .00 ATOM 634 O LYS 41 37.480 6.480 11.241 1.00 .00 ATOM 617 CB LYS 41 36.067 7.886 8.661 1.00 .00 ATOM 620 CG LYS 41 34.800 8.066 7.762 1.00 .00 ATOM 623 CD LYS 41 35.192 8.413 6.337 1.00 .00 ATOM 626 CE LYS 41 36.065 7.358 5.678 1.00 .00 ATOM 629 NZ LYS 41 36.443 7.761 4.313 1.00 .00 ATOM 614 HN LYS 41 34.736 9.386 10.025 1.00 0.00 ATOM 616 HA LYS 41 35.183 6.621 10.110 1.00 0.00 ATOM 618 HB1 LYS 41 36.642 7.066 8.260 1.00 0.00 ATOM 619 HB2 LYS 41 36.653 8.793 8.640 1.00 0.00 ATOM 621 HG1 LYS 41 34.228 8.904 8.144 1.00 0.00 ATOM 622 HG2 LYS 41 34.055 7.280 7.823 1.00 0.00 ATOM 624 HD1 LYS 41 35.737 9.345 6.365 1.00 0.00 ATOM 625 HD2 LYS 41 34.302 8.543 5.740 1.00 0.00 ATOM 627 HE1 LYS 41 35.520 6.428 5.633 1.00 0.00 ATOM 628 HE2 LYS 41 36.966 7.226 6.258 1.00 0.00 ATOM 630 HZ1 LYS 41 36.964 8.662 4.326 1.00 0.00 ATOM 631 HZ2 LYS 41 35.609 7.906 3.712 1.00 0.00 ATOM 632 HZ3 LYS 41 37.052 7.051 3.865 1.00 0.00 ATOM 635 N LYS 42 37.135 8.647 11.676 1.00 .00 ATOM 637 CA LYS 42 38.060 8.759 12.777 1.00 .00 ATOM 655 C LYS 42 37.572 7.941 13.976 1.00 .00 ATOM 656 O LYS 42 38.355 7.241 14.602 1.00 .00 ATOM 639 CB LYS 42 38.201 10.212 13.192 1.00 .00 ATOM 642 CG LYS 42 38.978 10.401 14.462 1.00 .00 ATOM 645 CD LYS 42 39.023 11.866 14.859 1.00 .00 ATOM 648 CE LYS 42 39.770 12.077 16.162 1.00 .00 ATOM 651 NZ LYS 42 39.774 13.500 16.555 1.00 .00 ATOM 636 HN LYS 42 36.688 9.469 11.372 1.00 0.00 ATOM 638 HA LYS 42 39.023 8.393 12.457 1.00 0.00 ATOM 640 HB1 LYS 42 37.213 10.625 13.333 1.00 0.00 ATOM 641 HB2 LYS 42 38.701 10.756 12.404 1.00 0.00 ATOM 643 HG1 LYS 42 39.969 9.999 14.329 1.00 0.00 ATOM 644 HG2 LYS 42 38.447 9.805 15.193 1.00 0.00 ATOM 646 HD1 LYS 42 38.013 12.232 14.968 1.00 0.00 ATOM 647 HD2 LYS 42 39.522 12.424 14.081 1.00 0.00 ATOM 649 HE1 LYS 42 40.789 11.742 16.035 1.00 0.00 ATOM 650 HE2 LYS 42 39.292 11.501 16.940 1.00 0.00 ATOM 652 HZ1 LYS 42 40.267 14.076 15.842 1.00 0.00 ATOM 653 HZ2 LYS 42 40.232 13.645 17.476 1.00 0.00 ATOM 654 HZ3 LYS 42 38.803 13.863 16.627 1.00 0.00 ATOM 657 N ARG 43 36.273 8.031 14.292 1.00 .00 ATOM 659 CA ARG 43 35.717 7.278 15.408 1.00 .00 ATOM 679 C ARG 43 35.900 5.785 15.141 1.00 .00 ATOM 680 O ARG 43 36.289 5.023 16.017 1.00 .00 ATOM 661 CB ARG 43 34.231 7.617 15.600 1.00 .00 ATOM 664 CG ARG 43 33.579 6.921 16.783 1.00 .00 ATOM 667 CD ARG 43 34.216 7.338 18.100 1.00 .00 ATOM 670 NE ARG 43 33.649 6.601 19.223 1.00 .00 ATOM 672 CZ ARG 43 33.949 6.790 20.508 1.00 .00 ATOM 673 NH1 ARG 43 34.792 7.756 20.872 1.00 .00 ATOM 676 NH2 ARG 43 33.398 6.017 21.432 1.00 .00 ATOM 658 HN ARG 43 35.652 8.612 13.786 1.00 0.00 ATOM 660 HA ARG 43 36.271 7.552 16.293 1.00 0.00 ATOM 662 HB1 ARG 43 33.701 7.334 14.703 1.00 0.00 ATOM 663 HB2 ARG 43 34.133 8.685 15.737 1.00 0.00 ATOM 665 HG1 ARG 43 33.690 5.852 16.661 1.00 0.00 ATOM 666 HG2 ARG 43 32.530 7.177 16.810 1.00 0.00 ATOM 668 HD1 ARG 43 34.047 8.393 18.256 1.00 0.00 ATOM 669 HD2 ARG 43 35.277 7.141 18.063 1.00 0.00 ATOM 671 HE ARG 43 33.006 5.900 18.968 1.00 0.00 ATOM 674 HH11 ARG 43 35.234 8.373 20.214 1.00 0.00 ATOM 675 HH12 ARG 43 35.012 7.907 21.841 1.00 0.00 ATOM 677 HH21 ARG 43 32.753 5.279 21.213 1.00 0.00 ATOM 678 HH22 ARG 43 33.612 6.143 22.405 1.00 0.00 ATOM 681 N LEU 44 35.680 5.408 13.907 1.00 .00 ATOM 683 CA LEU 44 35.839 4.045 13.461 1.00 .00 ATOM 698 C LEU 44 37.315 3.647 13.507 1.00 .00 ATOM 699 O LEU 44 37.655 2.543 13.893 1.00 .00 ATOM 685 CB LEU 44 35.252 3.883 12.048 1.00 .00 ATOM 688 CG LEU 44 33.710 3.681 11.916 1.00 .00 ATOM 690 CD1 LEU 44 32.905 4.770 12.599 1.00 .00 ATOM 694 CD2 LEU 44 33.307 3.590 10.449 1.00 .00 ATOM 682 HN LEU 44 35.412 6.088 13.254 1.00 0.00 ATOM 684 HA LEU 44 35.297 3.406 14.144 1.00 0.00 ATOM 686 HB1 LEU 44 35.754 3.054 11.586 1.00 0.00 ATOM 687 HB2 LEU 44 35.513 4.773 11.495 1.00 0.00 ATOM 689 HG LEU 44 33.453 2.746 12.385 1.00 0.00 ATOM 691 HD11 LEU 44 33.136 5.727 12.153 1.00 0.00 ATOM 692 HD12 LEU 44 33.149 4.799 13.650 1.00 0.00 ATOM 693 HD13 LEU 44 31.851 4.568 12.478 1.00 0.00 ATOM 695 HD21 LEU 44 33.571 4.510 9.946 1.00 0.00 ATOM 696 HD22 LEU 44 32.238 3.454 10.380 1.00 0.00 ATOM 697 HD23 LEU 44 33.814 2.761 9.979 1.00 0.00 ATOM 700 N LYS 45 38.159 4.579 13.139 1.00 .00 ATOM 702 CA LYS 45 39.616 4.447 13.176 1.00 .00 ATOM 720 C LYS 45 40.106 4.176 14.603 1.00 .00 ATOM 721 O LYS 45 40.967 3.322 14.824 1.00 .00 ATOM 704 CB LYS 45 40.223 5.753 12.556 1.00 .00 ATOM 707 CG LYS 45 41.738 6.007 12.652 1.00 .00 ATOM 710 CD LYS 45 42.168 6.433 14.054 1.00 .00 ATOM 713 CE LYS 45 43.624 6.839 14.108 1.00 .00 ATOM 716 NZ LYS 45 43.903 8.023 13.263 1.00 .00 ATOM 701 HN LYS 45 37.784 5.420 12.800 1.00 0.00 ATOM 703 HA LYS 45 39.894 3.611 12.553 1.00 0.00 ATOM 705 HB1 LYS 45 39.711 6.577 13.031 1.00 0.00 ATOM 706 HB2 LYS 45 39.969 5.776 11.509 1.00 0.00 ATOM 708 HG1 LYS 45 42.008 6.784 11.951 1.00 0.00 ATOM 709 HG2 LYS 45 42.263 5.099 12.395 1.00 0.00 ATOM 711 HD1 LYS 45 42.004 5.610 14.734 1.00 0.00 ATOM 712 HD2 LYS 45 41.566 7.275 14.360 1.00 0.00 ATOM 714 HE1 LYS 45 44.232 6.011 13.774 1.00 0.00 ATOM 715 HE2 LYS 45 43.871 7.082 15.130 1.00 0.00 ATOM 717 HZ1 LYS 45 43.280 8.818 13.516 1.00 0.00 ATOM 718 HZ2 LYS 45 43.789 7.860 12.240 1.00 0.00 ATOM 719 HZ3 LYS 45 44.872 8.354 13.436 1.00 0.00 ATOM 722 N GLN 46 39.551 4.896 15.560 1.00 .00 ATOM 724 CA GLN 46 39.949 4.759 16.952 1.00 .00 ATOM 737 C GLN 46 39.399 3.480 17.568 1.00 .00 ATOM 738 O GLN 46 40.015 2.890 18.469 1.00 .00 ATOM 726 CB GLN 46 39.518 5.979 17.759 1.00 .00 ATOM 729 CG GLN 46 40.151 7.277 17.284 1.00 .00 ATOM 732 CD GLN 46 39.716 8.468 18.099 1.00 .00 ATOM 733 OE1 GLN 46 38.724 9.122 17.788 1.00 .00 ATOM 734 NE2 GLN 46 40.446 8.761 19.135 1.00 .00 ATOM 723 HN GLN 46 38.860 5.553 15.315 1.00 0.00 ATOM 725 HA GLN 46 41.027 4.701 16.966 1.00 0.00 ATOM 727 HB1 GLN 46 39.785 5.827 18.794 1.00 0.00 ATOM 728 HB2 GLN 46 38.444 6.077 17.688 1.00 0.00 ATOM 730 HG1 GLN 46 39.873 7.440 16.253 1.00 0.00 ATOM 731 HG2 GLN 46 41.225 7.186 17.358 1.00 0.00 ATOM 739 N LEU 47 38.257 3.053 17.087 1.00 .00 ATOM 741 CA LEU 47 37.621 1.853 17.551 1.00 .00 ATOM 756 C LEU 47 38.134 .596 16.858 1.00 .00 ATOM 757 O LEU 47 37.935 -.510 17.353 1.00 .00 ATOM 743 CB LEU 47 36.105 1.977 17.472 1.00 .00 ATOM 746 CG LEU 47 35.380 2.619 18.684 1.00 .00 ATOM 748 CD1 LEU 47 35.554 1.765 19.929 1.00 .00 ATOM 752 CD2 LEU 47 35.873 4.030 18.954 1.00 .00 ATOM 740 HN LEU 47 37.777 3.556 16.394 1.00 0.00 ATOM 742 HA LEU 47 37.887 1.776 18.593 1.00 0.00 ATOM 744 HB1 LEU 47 35.674 1.021 17.239 1.00 0.00 ATOM 745 HB2 LEU 47 35.949 2.628 16.626 1.00 0.00 ATOM 747 HG LEU 47 34.322 2.658 18.472 1.00 0.00 ATOM 749 HD11 LEU 47 35.031 2.225 20.754 1.00 0.00 ATOM 750 HD12 LEU 47 36.602 1.682 20.177 1.00 0.00 ATOM 751 HD13 LEU 47 35.146 0.782 19.749 1.00 0.00 ATOM 753 HD21 LEU 47 35.345 4.437 19.803 1.00 0.00 ATOM 754 HD22 LEU 47 35.692 4.645 18.085 1.00 0.00 ATOM 755 HD23 LEU 47 36.932 4.006 19.166 1.00 0.00 ATOM 758 N SER 48 38.768 .763 15.729 1.00 .00 ATOM 760 CA SER 48 39.356 -.347 15.007 1.00 .00 ATOM 767 C SER 48 40.875 -.311 15.189 1.00 .00 ATOM 768 O SER 48 41.409 .628 15.793 1.00 .00 ATOM 762 CB SER 48 39.015 -.239 13.518 1.00 .00 ATOM 765 OG SER 48 37.608 -.175 13.314 1.00 .00 ATOM 759 HN SER 48 38.857 1.662 15.348 1.00 0.00 ATOM 761 HA SER 48 38.955 -1.267 15.404 1.00 0.00 ATOM 763 HB1 SER 48 39.407 -1.097 12.994 1.00 0.00 ATOM 764 HB2 SER 48 39.459 0.660 13.117 1.00 0.00 ATOM 766 HG SER 48 37.355 0.729 13.545 1.00 0.00 ATOM 769 N VAL 49 41.562 -1.315 14.702 1.00 .00 ATOM 771 CA VAL 49 43.009 -1.316 14.751 1.00 .00 ATOM 783 C VAL 49 43.519 -.614 13.503 1.00 .00 ATOM 784 O VAL 49 44.257 .377 13.589 1.00 .00 ATOM 773 CB VAL 49 43.592 -2.752 14.814 1.00 .00 ATOM 775 CG1 VAL 49 45.107 -2.708 14.947 1.00 .00 ATOM 779 CG2 VAL 49 42.982 -3.535 15.963 1.00 .00 ATOM 770 HN VAL 49 41.090 -2.074 14.297 1.00 0.00 ATOM 772 HA VAL 49 43.322 -0.757 15.620 1.00 0.00 ATOM 774 HB VAL 49 43.349 -3.252 13.888 1.00 0.00 ATOM 785 N GLU 50 43.076 -1.131 12.351 1.00 .00 ATOM 787 CA GLU 50 43.379 -.604 11.016 1.00 .00 ATOM 798 C GLU 50 44.884 -.684 10.680 1.00 .00 ATOM 799 O GLU 50 45.693 .106 11.185 1.00 .00 ATOM 789 CB GLU 50 42.864 .838 10.851 1.00 .00 ATOM 792 CG GLU 50 42.949 1.374 9.427 1.00 .00 ATOM 795 CD GLU 50 42.055 .613 8.475 1.00 .00 ATOM 796 OE1 GLU 50 40.841 .916 8.414 1.00 .00 ATOM 797 OE2 GLU 50 42.539 -.305 7.771 1.00 .00 ATOM 786 HN GLU 50 42.503 -1.927 12.403 1.00 0.00 ATOM 788 HA GLU 50 42.852 -1.234 10.313 1.00 0.00 ATOM 790 HB1 GLU 50 43.443 1.485 11.494 1.00 0.00 ATOM 791 HB2 GLU 50 41.830 0.870 11.162 1.00 0.00 ATOM 793 HG1 GLU 50 43.971 1.282 9.086 1.00 0.00 ATOM 794 HG2 GLU 50 42.661 2.415 9.417 1.00 0.00 ATOM 800 N PRO 51 45.277 -1.668 9.856 1.00 .00 ATOM 801 CA PRO 51 46.655 -1.801 9.379 1.00 .00 ATOM 812 C PRO 51 47.034 -.587 8.535 1.00 .00 ATOM 813 O PRO 51 46.542 -.433 7.414 1.00 .00 ATOM 803 CB PRO 51 46.617 -3.056 8.497 1.00 .00 ATOM 806 CG PRO 51 45.383 -3.777 8.901 1.00 .00 ATOM 809 CD PRO 51 44.411 -2.728 9.330 1.00 .00 ATOM 802 HA PRO 51 47.357 -1.920 10.190 1.00 0.00 ATOM 804 HB1 PRO 51 47.499 -3.652 8.672 1.00 0.00 ATOM 805 HB2 PRO 51 46.579 -2.761 7.459 1.00 0.00 ATOM 807 HG1 PRO 51 45.605 -4.442 9.721 1.00 0.00 ATOM 808 HG2 PRO 51 44.989 -4.331 8.062 1.00 0.00 ATOM 810 HD1 PRO 51 43.767 -3.113 10.106 1.00 0.00 ATOM 811 HD2 PRO 51 43.826 -2.377 8.493 1.00 0.00 ATOM 814 N TYR 52 47.902 .261 9.083 1.00 .00 ATOM 816 CA TYR 52 48.259 1.557 8.492 1.00 .00 ATOM 833 C TYR 52 47.020 2.429 8.522 1.00 .00 ATOM 834 O TYR 52 46.207 2.456 7.596 1.00 .00 ATOM 818 CB TYR 52 48.849 1.427 7.082 1.00 .00 ATOM 821 CG TYR 52 49.413 2.707 6.477 1.00 .00 ATOM 822 CD1 TYR 52 50.700 3.126 6.786 1.00 .00 CD2 ATOM 824 CD2 TYR 52 48.669 3.483 5.592 1.00 .00 CD1 ATOM 826 CE1 TYR 52 51.229 4.278 6.237 1.00 .00 CE2 ATOM 828 CE2 TYR 52 49.197 4.639 5.035 1.00 .00 CE1 ATOM 830 CZ TYR 52 50.477 5.030 5.362 1.00 .00 ATOM 831 OH TYR 52 51.012 6.187 4.813 1.00 .00 ATOM 815 HN TYR 52 48.312 0.008 9.936 1.00 0.00 ATOM 817 HA TYR 52 48.976 2.008 9.164 1.00 0.00 ATOM 819 HB1 TYR 52 48.045 1.073 6.456 1.00 0.00 ATOM 820 HB2 TYR 52 49.643 0.700 7.128 1.00 0.00 ATOM 823 HD1 TYR 52 47.665 3.173 5.338 1.00 0.00 ATOM 825 HD2 TYR 52 51.292 2.538 7.471 1.00 0.00 ATOM 827 HE1 TYR 52 48.610 5.231 4.349 1.00 0.00 ATOM 829 HE2 TYR 52 52.231 4.585 6.492 1.00 0.00 ATOM 832 HH TYR 52 50.368 6.908 4.826 1.00 0.00 ATOM 835 N SER 53 46.876 3.072 9.614 1.00 .00 ATOM 837 CA SER 53 45.736 3.809 9.952 1.00 .00 ATOM 844 C SER 53 45.741 5.161 9.277 1.00 .00 ATOM 845 O SER 53 46.801 5.685 8.836 1.00 .00 ATOM 839 CB SER 53 45.683 3.945 11.489 1.00 .00 ATOM 842 OG SER 53 44.518 4.605 11.934 1.00 .00 ATOM 836 HN SER 53 47.609 3.058 10.247 1.00 0.00 ATOM 838 HA SER 53 44.861 3.259 9.646 1.00 0.00 ATOM 840 HB1 SER 53 46.547 4.503 11.820 1.00 0.00 ATOM 841 HB2 SER 53 45.709 2.963 11.937 1.00 0.00 ATOM 843 HG SER 53 44.066 3.990 12.525 1.00 0.00 ATOM 846 N GLN 54 44.583 5.713 9.186 1.00 .00 ATOM 848 CA GLN 54 44.403 7.000 8.602 1.00 .00 ATOM 861 C GLN 54 44.844 8.057 9.586 1.00 .00 ATOM 862 O GLN 54 44.194 8.314 10.601 1.00 .00 ATOM 850 CB GLN 54 42.982 7.217 8.098 1.00 .00 ATOM 853 CG GLN 54 42.803 8.520 7.349 1.00 .00 ATOM 856 CD GLN 54 41.441 8.652 6.727 1.00 .00 ATOM 857 OE1 GLN 54 41.227 8.238 5.588 1.00 .00 ATOM 858 NE2 GLN 54 40.516 9.228 7.443 1.00 .00 ATOM 847 HN GLN 54 43.858 5.173 9.564 1.00 0.00 ATOM 849 HA GLN 54 45.091 7.061 7.774 1.00 0.00 ATOM 851 HB1 GLN 54 42.309 7.215 8.942 1.00 0.00 ATOM 852 HB2 GLN 54 42.718 6.405 7.435 1.00 0.00 ATOM 854 HG1 GLN 54 43.549 8.575 6.569 1.00 0.00 ATOM 855 HG2 GLN 54 42.944 9.340 8.037 1.00 0.00 ATOM 863 N GLU 55 45.963 8.621 9.260 1.00 .00 ATOM 865 CA GLU 55 46.719 9.574 10.035 1.00 .00 ATOM 876 C GLU 55 47.987 9.670 9.232 1.00 .00 ATOM 877 O GLU 55 48.453 10.736 8.870 1.00 .00 ATOM 867 CB GLU 55 47.008 9.004 11.459 1.00 .00 ATOM 870 CG GLU 55 47.552 10.000 12.502 1.00 .00 ATOM 873 CD GLU 55 48.897 10.600 12.166 1.00 .00 ATOM 874 OE1 GLU 55 49.932 9.961 12.438 1.00 .00 ATOM 875 OE2 GLU 55 48.940 11.729 11.659 1.00 .00 ATOM 864 HN GLU 55 46.331 8.409 8.376 1.00 0.00 ATOM 866 HA GLU 55 46.209 10.522 10.066 1.00 0.00 ATOM 868 HB1 GLU 55 47.717 8.196 11.357 1.00 0.00 ATOM 869 HB2 GLU 55 46.086 8.598 11.849 1.00 0.00 ATOM 871 HG1 GLU 55 47.626 9.485 13.450 1.00 0.00 ATOM 872 HG2 GLU 55 46.846 10.811 12.602 1.00 0.00 ATOM 878 N GLU 56 48.498 8.492 8.916 1.00 .00 ATOM 880 CA GLU 56 49.605 8.334 8.007 1.00 .00 ATOM 891 C GLU 56 49.026 8.292 6.606 1.00 .00 ATOM 892 O GLU 56 49.631 8.758 5.641 1.00 .00 ATOM 882 CB GLU 56 50.346 7.045 8.300 1.00 .00 ATOM 885 CG GLU 56 50.934 6.976 9.686 1.00 .00 ATOM 888 CD GLU 56 51.643 5.680 9.933 1.00 .00 ATOM 889 OE1 GLU 56 52.805 5.541 9.515 1.00 .00 ATOM 890 OE2 GLU 56 51.062 4.786 10.572 1.00 .00 ATOM 879 HN GLU 56 48.093 7.704 9.334 1.00 0.00 ATOM 881 HA GLU 56 50.268 9.181 8.105 1.00 0.00 ATOM 883 HB1 GLU 56 51.150 6.936 7.587 1.00 0.00 ATOM 884 HB2 GLU 56 49.666 6.214 8.180 1.00 0.00 ATOM 886 HG1 GLU 56 50.138 7.085 10.408 1.00 0.00 ATOM 887 HG2 GLU 56 51.644 7.781 9.806 1.00 0.00 ATOM 893 N ALA 57 47.849 7.683 6.504 1.00 .00 ATOM 895 CA ALA 57 47.074 7.725 5.292 1.00 .00 ATOM 901 C ALA 57 46.278 9.016 5.311 1.00 .00 ATOM 902 O ALA 57 45.831 9.437 6.393 1.00 .00 ATOM 897 CB ALA 57 46.144 6.516 5.196 1.00 .00 ATOM 894 HN ALA 57 47.503 7.179 7.270 1.00 0.00 ATOM 896 HA ALA 57 47.756 7.733 4.454 1.00 0.00 ATOM 898 HB1 ALA 57 45.582 6.564 4.275 1.00 0.00 ATOM 899 HB2 ALA 57 45.449 6.509 6.020 1.00 0.00 ATOM 900 HB3 ALA 57 46.723 5.604 5.211 1.00 0.00 ATOM 903 N GLU 58 46.110 9.633 4.144 1.00 .00 ATOM 905 CA GLU 58 45.460 10.944 4.009 1.00 .00 ATOM 916 C GLU 58 46.245 12.011 4.757 1.00 .00 ATOM 917 O GLU 58 45.992 12.296 5.933 1.00 .00 ATOM 907 CB GLU 58 43.977 10.937 4.442 1.00 .00 ATOM 910 CG GLU 58 43.085 10.027 3.613 1.00 .00 ATOM 913 CD GLU 58 42.993 10.444 2.163 1.00 .00 ATOM 914 OE1 GLU 58 43.899 10.103 1.375 1.00 .00 ATOM 915 OE2 GLU 58 42.011 11.103 1.789 1.00 .00 ATOM 904 HN GLU 58 46.437 9.191 3.331 1.00 0.00 ATOM 906 HA GLU 58 45.521 11.190 2.959 1.00 0.00 ATOM 908 HB1 GLU 58 43.591 11.944 4.375 1.00 0.00 ATOM 909 HB2 GLU 58 43.920 10.613 5.471 1.00 0.00 ATOM 911 HG1 GLU 58 42.093 10.023 4.042 1.00 0.00 ATOM 912 HG2 GLU 58 43.496 9.030 3.652 1.00 0.00 ATOM 918 N ARG 59 47.229 12.549 4.095 1.00 .00 ATOM 920 CA ARG 59 48.082 13.545 4.676 1.00 .00 ATOM 940 C ARG 59 47.301 14.834 4.879 1.00 .00 ATOM 941 O ARG 59 46.746 15.395 3.923 1.00 .00 ATOM 922 CB ARG 59 49.314 13.752 3.788 1.00 .00 ATOM 925 CG ARG 59 50.346 14.717 4.337 1.00 .00 ATOM 928 CD ARG 59 51.604 14.707 3.484 1.00 .00 ATOM 931 NE ARG 59 52.206 13.367 3.446 1.00 .00 ATOM 933 CZ ARG 59 53.388 13.054 2.918 1.00 .00 ATOM 934 NH1 ARG 59 54.140 13.984 2.345 1.00 .00 ATOM 937 NH2 ARG 59 53.813 11.799 2.962 1.00 .00 ATOM 919 HN ARG 59 47.383 12.260 3.171 1.00 0.00 ATOM 921 HA ARG 59 48.400 13.175 5.639 1.00 0.00 ATOM 923 HB1 ARG 59 48.988 14.118 2.825 1.00 0.00 ATOM 924 HB2 ARG 59 49.800 12.798 3.648 1.00 0.00 ATOM 926 HG1 ARG 59 50.600 14.415 5.342 1.00 0.00 ATOM 927 HG2 ARG 59 49.930 15.713 4.347 1.00 0.00 ATOM 929 HD1 ARG 59 52.323 15.399 3.899 1.00 0.00 ATOM 930 HD2 ARG 59 51.353 15.004 2.477 1.00 0.00 ATOM 932 HE ARG 59 51.669 12.651 3.860 1.00 0.00 ATOM 935 HH11 ARG 59 53.850 14.942 2.285 1.00 0.00 ATOM 936 HH12 ARG 59 55.042 13.762 1.964 1.00 0.00 ATOM 938 HH21 ARG 59 53.262 11.072 3.381 1.00 0.00 ATOM 939 HH22 ARG 59 54.703 11.522 2.588 1.00 0.00 ATOM 942 N ALA 60 47.247 15.289 6.124 1.00 .00 ATOM 944 CA ALA 60 46.490 16.482 6.506 1.00 .00 ATOM 950 C ALA 60 47.104 17.752 5.925 1.00 .00 ATOM 951 O ALA 60 46.459 18.811 5.905 1.00 .00 ATOM 946 CB ALA 60 46.387 16.575 8.021 1.00 .00 ATOM 943 HN ALA 60 47.734 14.796 6.821 1.00 0.00 ATOM 945 HA ALA 60 45.493 16.370 6.107 1.00 0.00 ATOM 947 HB1 ALA 60 47.374 16.709 8.438 1.00 0.00 ATOM 948 HB2 ALA 60 45.951 15.665 8.407 1.00 0.00 ATOM 949 HB3 ALA 60 45.762 17.414 8.290 1.00 0.00 ATOM 952 N ALA 61 48.344 17.621 5.465 1.00 .00 ATOM 954 CA ALA 61 49.116 18.668 4.829 1.00 .00 ATOM 960 C ALA 61 49.742 19.600 5.833 1.00 .00 ATOM 961 O ALA 61 49.077 20.453 6.437 1.00 .00 ATOM 956 CB ALA 61 48.354 19.418 3.723 1.00 .00 ATOM 953 HN ALA 61 48.796 16.761 5.594 1.00 0.00 ATOM 955 HA ALA 61 49.935 18.139 4.362 1.00 0.00 ATOM 957 HB1 ALA 61 47.566 20.008 4.168 1.00 0.00 ATOM 958 HB2 ALA 61 47.921 18.705 3.037 1.00 0.00 ATOM 959 HB3 ALA 61 49.034 20.067 3.191 1.00 0.00 ATOM 962 N GLY 62 51.006 19.403 6.030 1.00 .00 ATOM 964 CA GLY 62 51.801 20.238 6.880 1.00 .00 ATOM 967 C GLY 62 52.927 20.814 6.073 1.00 .00 ATOM 968 O GLY 62 54.095 20.707 6.434 1.00 .00 ATOM 963 HN GLY 62 51.429 18.646 5.566 1.00 0.00 ATOM 965 HA1 GLY 62 52.215 19.653 7.686 1.00 0.00 ATOM 966 HA2 GLY 62 51.189 21.032 7.281 1.00 0.00 ATOM 969 N MET 63 52.567 21.397 4.958 1.00 .00 ATOM 971 CA MET 63 53.520 21.947 4.016 1.00 .00 ATOM 984 C MET 63 53.924 23.364 4.374 1.00 .00 ATOM 985 O MET 63 55.047 23.782 4.084 1.00 .00 ATOM 973 CB MET 63 52.972 21.881 2.577 1.00 .00 ATOM 976 CG MET 63 51.617 22.558 2.381 1.00 .00 ATOM 979 SD MET 63 51.019 22.467 .679 1.00 .00 ATOM 980 CE MET 63 49.398 23.221 .853 1.00 .00 ATOM 970 HN MET 63 51.607 21.462 4.772 1.00 0.00 ATOM 972 HA MET 63 54.405 21.332 4.064 1.00 0.00 ATOM 974 HB1 MET 63 52.877 20.843 2.295 1.00 0.00 ATOM 975 HB2 MET 63 53.680 22.358 1.915 1.00 0.00 ATOM 977 HG1 MET 63 51.706 23.597 2.664 1.00 0.00 ATOM 978 HG2 MET 63 50.894 22.073 3.020 1.00 0.00 ATOM 981 HE1 MET 63 48.809 22.655 1.560 1.00 0.00 ATOM 982 HE2 MET 63 48.901 23.224 -0.106 1.00 0.00 ATOM 983 HE3 MET 63 49.501 24.237 1.199 1.00 0.00 ATOM 986 N GLY 64 53.040 24.086 5.017 1.00 .00 ATOM 988 CA GLY 64 53.317 25.424 5.353 1.00 .00 ATOM 991 C GLY 64 52.154 26.041 6.046 1.00 .00 ATOM 992 O GLY 64 51.004 25.721 5.751 1.00 .00 ATOM 987 HN GLY 64 52.169 23.747 5.309 1.00 0.00 ATOM 989 HA1 GLY 64 53.523 25.982 4.451 1.00 0.00 ATOM 990 HA2 GLY 64 54.184 25.451 5.997 1.00 0.00 ATOM 993 N SER 65 52.437 26.866 6.967 1.00 .00 ATOM 995 CA SER 65 51.441 27.587 7.700 1.00 .00 ATOM 1002 C SER 65 51.004 28.843 6.933 1.00 .00 ATOM 1003 O SER 65 51.713 29.865 6.907 1.00 .00 ATOM 997 CB SER 65 51.986 27.923 9.083 1.00 .00 ATOM 1000 OG SER 65 53.278 28.520 8.984 1.00 .00 ATOM 994 HN SER 65 53.388 26.988 7.165 1.00 0.00 ATOM 996 HA SER 65 50.585 26.938 7.814 1.00 0.00 ATOM 998 HB1 SER 65 52.067 27.021 9.670 1.00 0.00 ATOM 999 HB2 SER 65 51.317 28.618 9.569 1.00 0.00 ATOM 1001 HG SER 65 53.340 28.931 8.109 1.00 0.00 ATOM 1004 N TYR 66 49.874 28.752 6.282 1.00 .00 ATOM 1006 CA TYR 66 49.357 29.817 5.497 1.00 .00 ATOM 1023 C TYR 66 48.657 30.863 6.333 1.00 .00 ATOM 1024 O TYR 66 48.077 30.564 7.385 1.00 .00 ATOM 1008 CB TYR 66 48.439 29.270 4.421 1.00 .00 ATOM 1011 CG TYR 66 49.162 28.544 3.313 1.00 .00 ATOM 1012 CD1 TYR 66 49.473 27.198 3.411 1.00 .00 CD2 ATOM 1014 CD2 TYR 66 49.545 29.222 2.166 1.00 .00 CD1 ATOM 1016 CE1 TYR 66 50.143 26.548 2.394 1.00 .00 CE2 ATOM 1018 CE2 TYR 66 50.213 28.583 1.149 1.00 .00 CE1 ATOM 1020 CZ TYR 66 50.512 27.247 1.264 1.00 .00 ATOM 1021 OH TYR 66 51.187 26.604 .238 1.00 .00 ATOM 1005 HN TYR 66 49.324 27.942 6.310 1.00 0.00 ATOM 1007 HA TYR 66 50.192 30.291 5.003 1.00 0.00 ATOM 1009 HB1 TYR 66 47.889 30.091 4.001 1.00 0.00 ATOM 1010 HB2 TYR 66 47.749 28.576 4.879 1.00 0.00 ATOM 1013 HD1 TYR 66 49.311 30.272 2.075 1.00 0.00 ATOM 1015 HD2 TYR 66 49.182 26.654 4.297 1.00 0.00 ATOM 1017 HE1 TYR 66 50.499 29.133 0.266 1.00 0.00 ATOM 1019 HE2 TYR 66 50.378 25.499 2.489 1.00 0.00 ATOM 1022 HH TYR 66 51.911 27.193 -0.013 1.00 0.00 ATOM 1025 N VAL 67 48.728 32.077 5.868 1.00 .00 ATOM 1038 CA VAL 67 48.114 33.198 6.500 1.00 .00 ATOM 1039 C VAL 67 47.280 33.975 5.474 1.00 .00 ATOM 1028 CB VAL 67 49.158 34.096 7.249 1.00 .00 ATOM 1030 CG1 VAL 67 50.291 34.558 6.335 1.00 .00 ATOM 1034 CG2 VAL 67 48.481 35.282 7.928 1.00 .00 ATOM 1026 HN VAL 67 49.217 32.260 5.040 1.00 0.00 ATOM 1027 HA VAL 67 47.423 32.788 7.223 1.00 0.00 ATOM 1029 HB VAL 67 49.600 33.477 8.014 1.00 0.00 ATOM 1042 ZN1 ZIN 68 27.660 7.040 9.661 1.00 0.00 MASTER 1013 END