REMARK FILENAME="/u/lytle/bc019267/9valid/c74c/refined_input/refined_9.pdb" REMARK Structure ACCEPTED REMARK E-overall: -1960.4 REMARK E-NOE_restraints: 47.4043 REMARK E-CDIH_restraints: 0.882364 REMARK E-COUP_restraints: 0 REMARK E-SANI_restraints: 0 REMARK E-VEAN_restraints: 0 REMARK RMS-NOE_restraints: 3.410711E-02 REMARK RMS-CDIH_restraints: 0.561116 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 0 8 24 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 23:48:24 created by user: ATOM 10 N ASP 1 .482 1.985 .216 1.00 .00 ATOM 14 CA ASP 1 .839 1.280 -1.006 1.00 .00 ATOM 8 C ASP 1 .803 -.203 -.783 1.00 .00 ATOM 9 O ASP 1 1.139 -.681 .307 1.00 .00 ATOM 2 CB ASP 1 2.221 1.708 -1.492 1.00 .00 ATOM 5 CG ASP 1 2.246 3.140 -1.928 1.00 .00 ATOM 6 OD1 ASP 1 2.090 4.022 -1.077 1.00 .00 OD2 ATOM 7 OD2 ASP 1 2.405 3.404 -3.134 1.00 .00 OD1 ATOM 1 HA ASP 1 0.110 1.528 -1.762 1.00 0.00 ATOM 3 HB1 ASP 1 2.511 1.086 -2.325 1.00 0.00 ATOM 4 HB2 ASP 1 2.934 1.580 -0.692 1.00 0.00 ATOM 11 HT1 ASP 1 1.128 1.710 0.982 1.00 0.00 ATOM 12 HT2 ASP 1 -0.484 1.746 0.515 1.00 0.00 ATOM 13 HT3 ASP 1 0.569 3.012 0.074 1.00 0.00 ATOM 15 N PRO 2 .370 -.968 -1.792 1.00 .00 ATOM 16 CA PRO 2 .344 -2.423 -1.712 1.00 .00 ATOM 27 C PRO 2 1.759 -2.992 -1.831 1.00 .00 ATOM 28 O PRO 2 2.680 -2.280 -2.258 1.00 .00 ATOM 18 CB PRO 2 -.494 -2.826 -2.931 1.00 .00 ATOM 21 CG PRO 2 -.284 -1.725 -3.911 1.00 .00 ATOM 24 CD PRO 2 -.139 -.473 -3.095 1.00 .00 ATOM 17 HA PRO 2 -0.124 -2.765 -0.802 1.00 0.00 ATOM 19 HB1 PRO 2 -1.533 -2.908 -2.649 1.00 0.00 ATOM 20 HB2 PRO 2 -0.144 -3.774 -3.315 1.00 0.00 ATOM 22 HG1 PRO 2 -1.135 -1.647 -4.571 1.00 0.00 ATOM 23 HG2 PRO 2 0.617 -1.907 -4.480 1.00 0.00 ATOM 25 HD1 PRO 2 -1.097 0.011 -2.974 1.00 0.00 ATOM 26 HD2 PRO 2 0.568 0.200 -3.558 1.00 0.00 ATOM 29 N ASN 3 1.926 -4.251 -1.430 1.00 .00 ATOM 31 CA ASN 3 3.189 -4.999 -1.504 1.00 .00 ATOM 41 C ASN 3 4.297 -4.494 -.537 1.00 .00 ATOM 42 O ASN 3 5.193 -5.254 -.163 1.00 .00 ATOM 33 CB ASN 3 3.661 -5.044 -2.958 1.00 .00 ATOM 36 CG ASN 3 5.027 -5.684 -3.173 1.00 .00 ATOM 37 OD1 ASN 3 5.129 -6.899 -3.346 1.00 .00 ATOM 38 ND2 ASN 3 6.064 -4.886 -3.217 1.00 .00 ATOM 30 HN ASN 3 1.158 -4.733 -1.076 1.00 0.00 ATOM 32 HA ASN 3 2.957 -6.011 -1.205 1.00 0.00 ATOM 34 HB1 ASN 3 3.650 -4.013 -3.264 1.00 0.00 ATOM 35 HB2 ASN 3 2.920 -5.595 -3.521 1.00 0.00 ATOM 39 HD21 ASN 3 5.948 -3.917 -3.116 1.00 0.00 ATOM 40 HD22 ASN 3 6.952 -5.280 -3.346 1.00 0.00 ATOM 43 N ALA 4 4.201 -3.262 -.096 1.00 .00 ATOM 45 CA ALA 4 5.209 -2.659 .718 1.00 .00 ATOM 51 C ALA 4 4.565 -1.829 1.800 1.00 .00 ATOM 52 O ALA 4 4.065 -.728 1.552 1.00 .00 ATOM 47 CB ALA 4 6.154 -1.809 -.127 1.00 .00 ATOM 44 HN ALA 4 3.406 -2.721 -0.272 1.00 0.00 ATOM 46 HA ALA 4 5.781 -3.450 1.179 1.00 0.00 ATOM 48 HB1 ALA 4 5.599 -1.004 -0.585 1.00 0.00 ATOM 49 HB2 ALA 4 6.600 -2.423 -0.896 1.00 0.00 ATOM 50 HB3 ALA 4 6.931 -1.400 0.501 1.00 0.00 ATOM 53 N GLU 5 4.520 -2.394 2.975 1.00 .00 ATOM 55 CA GLU 5 3.987 -1.747 4.150 1.00 .00 ATOM 66 C GLU 5 4.815 -.534 4.539 1.00 .00 ATOM 67 O GLU 5 4.299 .438 5.094 1.00 .00 ATOM 57 CB GLU 5 3.940 -2.725 5.319 1.00 .00 ATOM 60 CG GLU 5 5.294 -3.319 5.689 1.00 .00 ATOM 63 CD GLU 5 5.262 -4.127 6.956 1.00 .00 ATOM 64 OE1 GLU 5 4.631 -5.201 6.975 1.00 .00 OE2 ATOM 65 OE2 GLU 5 5.867 -3.693 7.961 1.00 .00 OE1 ATOM 54 HN GLU 5 4.844 -3.310 3.046 1.00 0.00 ATOM 56 HA GLU 5 2.980 -1.439 3.923 1.00 0.00 ATOM 58 HB1 GLU 5 3.288 -3.534 5.033 1.00 0.00 ATOM 59 HB2 GLU 5 3.535 -2.221 6.178 1.00 0.00 ATOM 61 HG1 GLU 5 6.002 -2.512 5.809 1.00 0.00 ATOM 62 HG2 GLU 5 5.623 -3.959 4.885 1.00 0.00 ATOM 68 N PHE 6 6.088 -.593 4.257 1.00 .00 ATOM 70 CA PHE 6 6.959 .472 4.610 1.00 .00 ATOM 86 C PHE 6 6.898 1.597 3.608 1.00 .00 ATOM 87 O PHE 6 7.386 1.482 2.475 1.00 .00 ATOM 72 CB PHE 6 8.400 -.003 4.815 1.00 .00 ATOM 75 CG PHE 6 9.339 1.107 5.220 1.00 .00 ATOM 76 CD1 PHE 6 9.384 1.545 6.529 1.00 .00 ATOM 78 CD2 PHE 6 10.170 1.712 4.289 1.00 .00 ATOM 80 CE1 PHE 6 10.235 2.562 6.906 1.00 .00 ATOM 82 CE2 PHE 6 11.023 2.731 4.660 1.00 .00 ATOM 84 CZ PHE 6 11.056 3.156 5.971 1.00 .00 ATOM 69 HN PHE 6 6.428 -1.388 3.791 1.00 0.00 ATOM 71 HA PHE 6 6.599 0.853 5.554 1.00 0.00 ATOM 73 HB1 PHE 6 8.765 -0.438 3.897 1.00 0.00 ATOM 74 HB2 PHE 6 8.415 -0.754 5.592 1.00 0.00 ATOM 77 HD1 PHE 6 8.738 1.076 7.257 1.00 0.00 ATOM 79 HD2 PHE 6 10.139 1.376 3.263 1.00 0.00 ATOM 81 HE1 PHE 6 10.260 2.893 7.934 1.00 0.00 ATOM 83 HE2 PHE 6 11.664 3.196 3.926 1.00 0.00 ATOM 85 HZ PHE 6 11.724 3.953 6.265 1.00 0.00 ATOM 88 N ASP 7 6.265 2.652 4.014 1.00 .00 ATOM 90 CA ASP 7 6.235 3.870 3.263 1.00 .00 ATOM 98 C ASP 7 7.505 4.651 3.632 1.00 .00 ATOM 99 O ASP 7 7.710 4.961 4.792 1.00 .00 ATOM 92 CB ASP 7 5.001 4.683 3.664 1.00 .00 ATOM 95 CG ASP 7 4.801 5.910 2.813 1.00 .00 ATOM 96 OD1 ASP 7 5.654 6.805 2.817 1.00 .00 OD2 ATOM 97 OD2 ASP 7 3.779 5.983 2.092 1.00 .00 OD1 ATOM 89 HN ASP 7 5.770 2.613 4.855 1.00 0.00 ATOM 91 HA ASP 7 6.208 3.646 2.208 1.00 0.00 ATOM 93 HB1 ASP 7 5.104 4.993 4.693 1.00 0.00 ATOM 94 HB2 ASP 7 4.122 4.062 3.570 1.00 0.00 ATOM 100 N PRO 8 8.383 4.943 2.673 1.00 .00 ATOM 101 CA PRO 8 9.646 5.657 2.947 1.00 .00 ATOM 112 C PRO 8 9.461 7.162 3.208 1.00 .00 ATOM 113 O PRO 8 10.413 7.868 3.586 1.00 .00 ATOM 103 CB PRO 8 10.454 5.431 1.676 1.00 .00 ATOM 106 CG PRO 8 9.430 5.263 .612 1.00 .00 ATOM 109 CD PRO 8 8.255 4.580 1.256 1.00 .00 ATOM 102 HA PRO 8 10.163 5.220 3.788 1.00 0.00 ATOM 104 HB1 PRO 8 11.060 4.543 1.781 1.00 0.00 ATOM 105 HB2 PRO 8 11.083 6.289 1.494 1.00 0.00 ATOM 107 HG1 PRO 8 9.828 4.648 -0.179 1.00 0.00 ATOM 108 HG2 PRO 8 9.139 6.229 0.226 1.00 0.00 ATOM 110 HD1 PRO 8 8.328 3.511 1.128 1.00 0.00 ATOM 111 HD2 PRO 8 7.327 4.940 0.841 1.00 0.00 ATOM 114 N ASP 9 8.263 7.655 3.003 1.00 .00 ATOM 116 CA ASP 9 7.971 9.060 3.235 1.00 .00 ATOM 124 C ASP 9 7.472 9.217 4.650 1.00 .00 ATOM 125 O ASP 9 7.653 10.256 5.282 1.00 .00 ATOM 118 CB ASP 9 6.953 9.581 2.207 1.00 .00 ATOM 121 CG ASP 9 6.599 11.047 2.374 1.00 .00 ATOM 122 OD1 ASP 9 7.492 11.906 2.231 1.00 .00 ATOM 123 OD2 ASP 9 5.395 11.367 2.581 1.00 .00 ATOM 115 HN ASP 9 7.526 7.066 2.716 1.00 0.00 ATOM 117 HA ASP 9 8.897 9.608 3.138 1.00 0.00 ATOM 119 HB1 ASP 9 6.052 8.995 2.296 1.00 0.00 ATOM 120 HB2 ASP 9 7.360 9.443 1.217 1.00 0.00 ATOM 126 N LEU 10 6.855 8.164 5.152 1.00 .00 ATOM 128 CA LEU 10 6.423 8.107 6.526 1.00 .00 ATOM 143 C LEU 10 7.210 7.028 7.264 1.00 .00 ATOM 144 O LEU 10 6.818 5.856 7.252 1.00 .00 ATOM 130 CB LEU 10 4.924 7.798 6.667 1.00 .00 ATOM 133 CG LEU 10 3.887 8.813 6.141 1.00 .00 ATOM 135 CD1 LEU 10 3.920 8.945 4.634 1.00 .00 ATOM 139 CD2 LEU 10 2.502 8.427 6.611 1.00 .00 ATOM 127 HN LEU 10 6.668 7.392 4.574 1.00 0.00 ATOM 129 HA LEU 10 6.632 9.066 6.976 1.00 0.00 ATOM 131 HB1 LEU 10 4.741 7.617 7.714 1.00 0.00 ATOM 132 HB2 LEU 10 4.779 6.865 6.149 1.00 0.00 ATOM 134 HG LEU 10 4.110 9.789 6.544 1.00 0.00 ATOM 136 HD11 LEU 10 4.893 9.297 4.324 1.00 0.00 ATOM 137 HD12 LEU 10 3.158 9.638 4.311 1.00 0.00 ATOM 138 HD13 LEU 10 3.734 7.979 4.190 1.00 0.00 ATOM 140 HD21 LEU 10 1.780 9.129 6.225 1.00 0.00 ATOM 141 HD22 LEU 10 2.470 8.439 7.691 1.00 0.00 ATOM 142 HD23 LEU 10 2.269 7.435 6.253 1.00 0.00 ATOM 145 N PRO 11 8.351 7.394 7.874 1.00 .00 ATOM 146 CA PRO 11 9.200 6.454 8.617 1.00 .00 ATOM 157 C PRO 11 8.408 5.586 9.588 1.00 .00 ATOM 158 O PRO 11 7.538 6.074 10.332 1.00 .00 ATOM 148 CB PRO 11 10.181 7.352 9.358 1.00 .00 ATOM 151 CG PRO 11 10.266 8.579 8.517 1.00 .00 ATOM 154 CD PRO 11 8.914 8.747 7.868 1.00 .00 ATOM 147 HA PRO 11 9.727 5.795 7.946 1.00 0.00 ATOM 149 HB1 PRO 11 11.139 6.860 9.431 1.00 0.00 ATOM 150 HB2 PRO 11 9.806 7.560 10.348 1.00 0.00 ATOM 152 HG1 PRO 11 11.031 8.453 7.765 1.00 0.00 ATOM 153 HG2 PRO 11 10.488 9.434 9.138 1.00 0.00 ATOM 155 HD1 PRO 11 9.013 9.098 6.852 1.00 0.00 ATOM 156 HD2 PRO 11 8.263 9.402 8.427 1.00 0.00 ATOM 159 N GLY 12 8.699 4.301 9.549 1.00 .00 ATOM 161 CA GLY 12 7.991 3.348 10.358 1.00 .00 ATOM 164 C GLY 12 6.842 2.763 9.611 1.00 .00 ATOM 165 O GLY 12 5.994 2.073 10.186 1.00 .00 ATOM 160 HN GLY 12 9.424 4.001 8.964 1.00 0.00 ATOM 162 HA1 GLY 12 7.618 3.846 11.240 1.00 0.00 ATOM 163 HA2 GLY 12 8.667 2.560 10.655 1.00 0.00 ATOM 166 N GLY 13 6.784 3.083 8.331 1.00 .00 ATOM 168 CA GLY 13 5.769 2.563 7.463 1.00 .00 ATOM 171 C GLY 13 4.463 3.254 7.640 1.00 .00 ATOM 172 O GLY 13 3.452 2.825 7.091 1.00 .00 ATOM 167 HN GLY 13 7.440 3.716 7.968 1.00 0.00 ATOM 169 HA1 GLY 13 5.637 1.508 7.649 1.00 0.00 ATOM 170 HA2 GLY 13 6.071 2.719 6.443 1.00 0.00 ATOM 173 N GLY 14 4.469 4.314 8.415 1.00 .00 ATOM 175 CA GLY 14 3.244 5.020 8.716 1.00 .00 ATOM 178 C GLY 14 2.393 4.303 9.771 1.00 .00 ATOM 179 O GLY 14 1.787 4.953 10.627 1.00 .00 ATOM 174 HN GLY 14 5.341 4.620 8.753 1.00 0.00 ATOM 176 HA1 GLY 14 2.663 5.117 7.811 1.00 0.00 ATOM 177 HA2 GLY 14 3.495 6.005 9.080 1.00 0.00 ATOM 180 N LEU 15 2.365 2.961 9.715 1.00 .00 ATOM 182 CA LEU 15 1.568 2.156 10.626 1.00 .00 ATOM 197 C LEU 15 2.022 2.278 12.078 1.00 .00 ATOM 198 O LEU 15 1.210 2.219 12.998 1.00 .00 ATOM 184 CB LEU 15 1.461 .665 10.196 1.00 .00 ATOM 187 CG LEU 15 2.737 -.222 10.185 1.00 .00 ATOM 189 CD1 LEU 15 2.351 -1.673 9.974 1.00 .00 ATOM 193 CD2 LEU 15 3.686 .179 9.081 1.00 .00 ATOM 181 HN LEU 15 2.878 2.507 9.010 1.00 0.00 ATOM 183 HA LEU 15 0.579 2.584 10.592 1.00 0.00 ATOM 185 HB1 LEU 15 1.023 0.640 9.209 1.00 0.00 ATOM 186 HB2 LEU 15 0.763 0.210 10.874 1.00 0.00 ATOM 188 HG LEU 15 3.245 -0.137 11.134 1.00 0.00 ATOM 190 HD11 LEU 15 1.831 -1.768 9.032 1.00 0.00 ATOM 191 HD12 LEU 15 1.713 -2.003 10.780 1.00 0.00 ATOM 192 HD13 LEU 15 3.244 -2.280 9.949 1.00 0.00 ATOM 194 HD21 LEU 15 4.537 -0.484 9.084 1.00 0.00 ATOM 195 HD22 LEU 15 4.029 1.188 9.252 1.00 0.00 ATOM 196 HD23 LEU 15 3.187 0.118 8.125 1.00 0.00 ATOM 199 N HIS 16 3.302 2.446 12.291 1.00 .00 ATOM 201 CA HIS 16 3.795 2.622 13.641 1.00 .00 ATOM 215 C HIS 16 4.324 3.989 13.956 1.00 .00 ATOM 216 O HIS 16 5.505 4.279 13.790 1.00 .00 ATOM 203 CB HIS 16 4.614 1.450 14.246 1.00 .00 ATOM 206 CG HIS 16 5.642 .776 13.411 1.00 .00 ATOM 207 ND1 HIS 16 5.487 -.522 12.980 1.00 .00 ATOM 209 CD2 HIS 16 6.871 1.128 13.074 1.00 .00 ATOM 211 CE1 HIS 16 6.589 -.932 12.422 1.00 .00 ATOM 213 NE2 HIS 16 7.454 .051 12.453 1.00 .00 ATOM 200 HN HIS 16 3.895 2.478 11.512 1.00 0.00 ATOM 202 HA HIS 16 2.852 2.647 14.173 1.00 0.00 ATOM 204 HB1 HIS 16 3.982 0.677 14.625 1.00 0.00 ATOM 205 HB2 HIS 16 5.164 1.829 15.092 1.00 0.00 ATOM 208 HD1 HIS 16 4.693 -1.100 13.062 1.00 0.00 ATOM 210 HD2 HIS 16 7.309 2.069 13.341 1.00 0.00 ATOM 212 HE1 HIS 16 6.762 -1.946 12.100 1.00 0.00 ATOM 214 HE2 HIS 16 8.326 0.020 11.996 1.00 0.00 ATOM 217 N ARG 17 3.404 4.829 14.401 1.00 .00 ATOM 219 CA ARG 17 3.654 6.205 14.790 1.00 .00 ATOM 239 C ARG 17 2.830 6.520 16.035 1.00 .00 ATOM 240 O ARG 17 1.854 5.828 16.328 1.00 .00 ATOM 221 CB ARG 17 3.197 7.161 13.681 1.00 .00 ATOM 224 CG ARG 17 3.942 7.051 12.369 1.00 .00 ATOM 227 CD ARG 17 3.301 7.941 11.315 1.00 .00 ATOM 230 NE ARG 17 3.274 9.374 11.693 1.00 .00 ATOM 232 CZ ARG 17 2.355 10.262 11.237 1.00 .00 ATOM 233 NH1 ARG 17 1.323 9.840 10.524 1.00 .00 ATOM 236 NH2 ARG 17 2.462 11.559 11.518 1.00 .00 ATOM 218 HN ARG 17 2.480 4.512 14.490 1.00 0.00 ATOM 220 HA ARG 17 4.707 6.346 14.977 1.00 0.00 ATOM 222 HB1 ARG 17 3.296 8.172 14.045 1.00 0.00 ATOM 223 HB2 ARG 17 2.153 6.974 13.480 1.00 0.00 ATOM 225 HG1 ARG 17 3.910 6.025 12.031 1.00 0.00 ATOM 226 HG2 ARG 17 4.969 7.351 12.516 1.00 0.00 ATOM 228 HD1 ARG 17 2.288 7.603 11.162 1.00 0.00 ATOM 229 HD2 ARG 17 3.852 7.839 10.391 1.00 0.00 ATOM 231 HE ARG 17 4.014 9.654 12.279 1.00 0.00 ATOM 234 HH11 ARG 17 1.170 8.875 10.292 1.00 0.00 ATOM 235 HH12 ARG 17 0.621 10.465 10.172 1.00 0.00 ATOM 237 HH21 ARG 17 3.195 11.982 12.060 1.00 0.00 ATOM 238 HH22 ARG 17 1.774 12.218 11.189 1.00 0.00 ATOM 241 N CYS 18 3.217 7.546 16.759 1.00 .00 ATOM 243 CA CYS 18 2.446 7.999 17.905 1.00 .00 ATOM 249 C CYS 18 1.540 9.111 17.438 1.00 .00 ATOM 250 O CYS 18 2.025 10.153 16.998 1.00 .00 ATOM 245 CB CYS 18 3.388 8.507 19.021 1.00 .00 ATOM 248 SG CYS 18 2.590 9.204 20.522 1.00 .00 ATOM 242 HN CYS 18 4.037 8.015 16.501 1.00 0.00 ATOM 244 HA CYS 18 1.858 7.172 18.271 1.00 0.00 ATOM 246 HB1 CYS 18 4.036 9.260 18.601 1.00 0.00 ATOM 247 HB2 CYS 18 4.004 7.684 19.350 1.00 0.00 ATOM 251 N LEU 19 .243 8.896 17.528 1.00 .00 ATOM 253 CA LEU 19 -.755 9.860 17.092 1.00 .00 ATOM 268 C LEU 19 -.673 11.101 17.958 1.00 .00 ATOM 269 O LEU 19 -.844 12.220 17.492 1.00 .00 ATOM 255 CB LEU 19 -2.144 9.234 17.198 1.00 .00 ATOM 258 CG LEU 19 -3.314 10.085 16.732 1.00 .00 ATOM 260 CD1 LEU 19 -3.184 10.443 15.254 1.00 .00 ATOM 264 CD2 LEU 19 -4.635 9.385 17.008 1.00 .00 ATOM 252 HN LEU 19 -0.087 8.053 17.905 1.00 0.00 ATOM 254 HA LEU 19 -0.559 10.119 16.063 1.00 0.00 ATOM 256 HB1 LEU 19 -2.307 8.983 18.235 1.00 0.00 ATOM 257 HB2 LEU 19 -2.138 8.317 16.636 1.00 0.00 ATOM 259 HG LEU 19 -3.279 10.986 17.319 1.00 0.00 ATOM 261 HD11 LEU 19 -4.037 11.035 14.957 1.00 0.00 ATOM 262 HD12 LEU 19 -3.146 9.539 14.664 1.00 0.00 ATOM 263 HD13 LEU 19 -2.282 11.016 15.101 1.00 0.00 ATOM 265 HD21 LEU 19 -4.664 8.444 16.479 1.00 0.00 ATOM 266 HD22 LEU 19 -5.451 10.008 16.675 1.00 0.00 ATOM 267 HD23 LEU 19 -4.735 9.204 18.068 1.00 0.00 ATOM 270 N ALA 20 -.366 10.876 19.210 1.00 .00 ATOM 272 CA ALA 20 -.203 11.934 20.196 1.00 .00 ATOM 278 C ALA 20 .989 12.847 19.870 1.00 .00 ATOM 279 O ALA 20 1.114 13.938 20.422 1.00 .00 ATOM 274 CB ALA 20 -.050 11.339 21.580 1.00 .00 ATOM 271 HN ALA 20 -0.266 9.934 19.473 1.00 0.00 ATOM 273 HA ALA 20 -1.103 12.531 20.185 1.00 0.00 ATOM 275 HB1 ALA 20 -0.896 10.703 21.795 1.00 0.00 ATOM 276 HB2 ALA 20 0.000 12.132 22.312 1.00 0.00 ATOM 277 HB3 ALA 20 0.857 10.753 21.624 1.00 0.00 ATOM 280 N CYS 21 1.875 12.392 19.003 1.00 .00 ATOM 282 CA CYS 21 3.025 13.185 18.643 1.00 .00 ATOM 288 C CYS 21 3.027 13.562 17.191 1.00 .00 ATOM 289 O CYS 21 3.625 14.559 16.811 1.00 .00 ATOM 284 CB CYS 21 4.345 12.527 19.079 1.00 .00 ATOM 287 SG CYS 21 4.507 12.489 20.814 1.00 .00 ATOM 281 HN CYS 21 1.728 11.523 18.573 1.00 0.00 ATOM 283 HA CYS 21 2.918 14.106 19.197 1.00 0.00 ATOM 285 HB1 CYS 21 5.175 13.126 18.738 1.00 0.00 ATOM 286 HB2 CYS 21 4.507 11.491 18.818 1.00 0.00 ATOM 290 N ALA 22 2.339 12.759 16.385 1.00 .00 ATOM 292 CA ALA 22 2.241 12.943 14.944 1.00 .00 ATOM 298 C ALA 22 3.624 12.852 14.292 1.00 .00 ATOM 299 O ALA 22 3.835 13.293 13.160 1.00 .00 ATOM 294 CB ALA 22 1.539 14.254 14.590 1.00 .00 ATOM 291 HN ALA 22 1.861 11.989 16.763 1.00 0.00 ATOM 293 HA ALA 22 1.629 12.116 14.619 1.00 0.00 ATOM 295 HB1 ALA 22 0.572 14.291 15.068 1.00 0.00 ATOM 296 HB2 ALA 22 1.415 14.316 13.519 1.00 0.00 ATOM 297 HB3 ALA 22 2.142 15.083 14.926 1.00 0.00 ATOM 300 N ARG 23 4.528 12.186 14.966 1.00 .00 ATOM 302 CA ARG 23 5.879 12.064 14.496 1.00 .00 ATOM 322 C ARG 23 6.082 10.691 13.932 1.00 .00 ATOM 323 O ARG 23 5.210 9.820 14.061 1.00 .00 ATOM 304 CB ARG 23 6.893 12.341 15.618 1.00 .00 ATOM 307 CG ARG 23 6.814 13.750 16.189 1.00 .00 ATOM 310 CD ARG 23 7.882 13.993 17.243 1.00 .00 ATOM 313 NE ARG 23 7.793 15.349 17.793 1.00 .00 ATOM 315 CZ ARG 23 8.670 15.908 18.641 1.00 .00 ATOM 316 NH1 ARG 23 9.745 15.246 19.038 1.00 .00 ATOM 319 NH2 ARG 23 8.467 17.138 19.081 1.00 .00 ATOM 301 HN ARG 23 4.260 11.752 15.799 1.00 0.00 ATOM 303 HA ARG 23 6.019 12.791 13.709 1.00 0.00 ATOM 305 HB1 ARG 23 7.889 12.182 15.232 1.00 0.00 ATOM 306 HB2 ARG 23 6.716 11.642 16.423 1.00 0.00 ATOM 308 HG1 ARG 23 5.841 13.888 16.638 1.00 0.00 ATOM 309 HG2 ARG 23 6.939 14.464 15.389 1.00 0.00 ATOM 311 HD1 ARG 23 8.857 13.861 16.797 1.00 0.00 ATOM 312 HD2 ARG 23 7.751 13.281 18.045 1.00 0.00 ATOM 314 HE ARG 23 7.004 15.860 17.498 1.00 0.00 ATOM 317 HH11 ARG 23 9.957 14.317 18.724 1.00 0.00 ATOM 318 HH12 ARG 23 10.393 15.654 19.685 1.00 0.00 ATOM 320 HH21 ARG 23 7.671 17.681 18.804 1.00 0.00 ATOM 321 HH22 ARG 23 9.107 17.588 19.711 1.00 0.00 ATOM 324 N TYR 24 7.182 10.502 13.295 1.00 .00 ATOM 326 CA TYR 24 7.490 9.305 12.645 1.00 .00 ATOM 343 C TYR 24 8.528 8.556 13.435 1.00 .00 ATOM 344 O TYR 24 9.441 9.159 14.000 1.00 .00 ATOM 328 CB TYR 24 8.004 9.652 11.271 1.00 .00 ATOM 331 CG TYR 24 7.011 10.445 10.457 1.00 .00 ATOM 332 CD1 TYR 24 5.990 9.812 9.784 1.00 .00 CD2 ATOM 334 CD2 TYR 24 7.078 11.832 10.394 1.00 .00 CD1 ATOM 336 CE1 TYR 24 5.064 10.528 9.065 1.00 .00 CE2 ATOM 338 CE2 TYR 24 6.148 12.556 9.683 1.00 .00 CE1 ATOM 340 CZ TYR 24 5.144 11.895 9.019 1.00 .00 ATOM 341 OH TYR 24 4.203 12.604 8.325 1.00 .00 ATOM 325 HN TYR 24 7.892 11.171 13.211 1.00 0.00 ATOM 327 HA TYR 24 6.596 8.714 12.534 1.00 0.00 ATOM 329 HB1 TYR 24 8.216 8.734 10.761 1.00 0.00 ATOM 330 HB2 TYR 24 8.912 10.229 11.370 1.00 0.00 ATOM 333 HD1 TYR 24 7.873 12.340 10.918 1.00 0.00 ATOM 335 HD2 TYR 24 5.929 8.735 9.821 1.00 0.00 ATOM 337 HE1 TYR 24 6.213 13.634 9.644 1.00 0.00 ATOM 339 HE2 TYR 24 4.274 10.009 8.545 1.00 0.00 ATOM 342 HH TYR 24 4.668 13.227 7.751 1.00 0.00 ATOM 345 N PHE 25 8.385 7.265 13.501 1.00 .00 ATOM 347 CA PHE 25 9.301 6.437 14.243 1.00 .00 ATOM 363 C PHE 25 9.729 5.330 13.379 1.00 .00 ATOM 364 O PHE 25 8.930 4.777 12.671 1.00 .00 ATOM 349 CB PHE 25 8.642 5.871 15.491 1.00 .00 ATOM 352 CG PHE 25 8.232 6.912 16.475 1.00 .00 ATOM 353 CD1 PHE 25 7.032 7.593 16.339 1.00 .00 ATOM 355 CD2 PHE 25 9.050 7.215 17.531 1.00 .00 ATOM 357 CE1 PHE 25 6.669 8.557 17.243 1.00 .00 ATOM 359 CE2 PHE 25 8.695 8.171 18.437 1.00 .00 ATOM 361 CZ PHE 25 7.500 8.850 18.295 1.00 .00 ATOM 346 HN PHE 25 7.660 6.812 13.018 1.00 0.00 ATOM 348 HA PHE 25 10.156 7.028 14.532 1.00 0.00 ATOM 350 HB1 PHE 25 9.341 5.203 15.973 1.00 0.00 ATOM 351 HB2 PHE 25 7.781 5.299 15.188 1.00 0.00 ATOM 354 HD1 PHE 25 6.383 7.360 15.509 1.00 0.00 ATOM 356 HD2 PHE 25 9.986 6.689 17.647 1.00 0.00 ATOM 358 HE1 PHE 25 5.732 9.081 17.124 1.00 0.00 ATOM 360 HE2 PHE 25 9.363 8.378 19.258 1.00 0.00 ATOM 362 HZ PHE 25 7.220 9.607 19.012 1.00 0.00 ATOM 365 N ILE 26 10.969 4.981 13.466 1.00 .00 ATOM 367 CA ILE 26 11.530 3.993 12.639 1.00 .00 ATOM 382 C ILE 26 10.996 2.591 12.934 1.00 .00 ATOM 383 O ILE 26 10.845 1.787 12.026 1.00 .00 ATOM 369 CB ILE 26 13.061 4.028 12.726 1.00 .00 ATOM 371 CG1 ILE 26 13.554 3.862 14.177 1.00 .00 ATOM 374 CG2 ILE 26 13.598 5.310 12.105 1.00 .00 ATOM 378 CD1 ILE 26 15.065 3.855 14.321 1.00 .00 ATOM 366 HN ILE 26 11.585 5.390 14.101 1.00 0.00 ATOM 368 HA ILE 26 11.264 4.248 11.624 1.00 0.00 ATOM 370 HB ILE 26 13.395 3.191 12.147 1.00 0.00 ATOM 379 HD11 ILE 26 15.461 4.798 13.974 1.00 0.00 ATOM 380 HD12 ILE 26 15.477 3.055 13.724 1.00 0.00 ATOM 381 HD13 ILE 26 15.336 3.707 15.355 1.00 0.00 ATOM 384 N ASP 27 10.663 2.306 14.187 1.00 .00 ATOM 386 CA ASP 27 10.224 .957 14.518 1.00 .00 ATOM 394 C ASP 27 9.195 .953 15.623 1.00 .00 ATOM 395 O ASP 27 9.145 1.868 16.435 1.00 .00 ATOM 388 CB ASP 27 11.431 .066 14.863 1.00 .00 ATOM 391 CG ASP 27 11.070 -1.361 15.190 1.00 .00 ATOM 392 OD1 ASP 27 10.813 -1.659 16.370 1.00 .00 ATOM 393 OD2 ASP 27 11.031 -2.202 14.262 1.00 .00 ATOM 385 HN ASP 27 10.691 2.995 14.884 1.00 0.00 ATOM 387 HA ASP 27 9.728 0.563 13.646 1.00 0.00 ATOM 389 HB1 ASP 27 11.949 0.495 15.708 1.00 0.00 ATOM 390 HB2 ASP 27 12.098 0.048 14.015 1.00 0.00 ATOM 396 N SER 28 8.388 -.094 15.637 1.00 .00 ATOM 398 CA SER 28 7.305 -.263 16.558 1.00 .00 ATOM 405 C SER 28 7.778 -.444 18.015 1.00 .00 ATOM 406 O SER 28 7.132 .040 18.935 1.00 .00 ATOM 400 CB SER 28 6.373 -1.401 16.053 1.00 .00 ATOM 403 OG SER 28 5.388 -1.759 16.988 1.00 .00 ATOM 397 HN SER 28 8.540 -0.823 14.994 1.00 0.00 ATOM 399 HA SER 28 6.741 0.657 16.524 1.00 0.00 ATOM 401 HB1 SER 28 6.882 -2.263 15.649 1.00 0.00 ATOM 402 HB2 SER 28 5.848 -0.959 15.218 1.00 0.00 ATOM 404 HG SER 28 5.721 -2.547 17.439 1.00 0.00 ATOM 407 N THR 29 8.918 -1.083 18.220 1.00 .00 ATOM 409 CA THR 29 9.436 -1.250 19.561 1.00 .00 ATOM 419 C THR 29 10.069 .064 20.046 1.00 .00 ATOM 420 O THR 29 10.045 .390 21.238 1.00 .00 ATOM 411 CB THR 29 10.436 -2.407 19.622 1.00 .00 ATOM 413 OG1 THR 29 9.786 -3.593 19.139 1.00 .00 ATOM 415 CG2 THR 29 10.922 -2.654 21.046 1.00 .00 ATOM 408 HN THR 29 9.447 -1.447 17.468 1.00 0.00 ATOM 410 HA THR 29 8.598 -1.474 20.199 1.00 0.00 ATOM 412 HB THR 29 11.262 -2.135 18.992 1.00 0.00 ATOM 414 HG1 THR 29 8.928 -3.311 18.793 1.00 0.00 ATOM 421 N ASN 30 10.600 .828 19.109 1.00 .00 ATOM 423 CA ASN 30 11.162 2.115 19.399 1.00 .00 ATOM 433 C ASN 30 10.043 3.097 19.727 1.00 .00 ATOM 434 O ASN 30 10.127 3.856 20.684 1.00 .00 ATOM 425 CB ASN 30 12.008 2.574 18.222 1.00 .00 ATOM 428 CG ASN 30 13.245 1.703 18.030 1.00 .00 ATOM 429 OD1 ASN 30 13.777 1.138 18.982 1.00 .00 ATOM 430 ND2 ASN 30 13.712 1.592 16.820 1.00 .00 ATOM 422 HN ASN 30 10.635 0.545 18.174 1.00 0.00 ATOM 424 HA ASN 30 11.792 2.006 20.270 1.00 0.00 ATOM 426 HB1 ASN 30 12.299 3.596 18.352 1.00 0.00 ATOM 427 HB2 ASN 30 11.400 2.498 17.332 1.00 0.00 ATOM 431 HD21 ASN 30 13.274 2.065 16.086 1.00 0.00 ATOM 432 HD22 ASN 30 14.497 1.021 16.667 1.00 0.00 ATOM 435 N LEU 31 8.991 3.053 18.928 1.00 .00 ATOM 437 CA LEU 31 7.764 3.780 19.189 1.00 .00 ATOM 452 C LEU 31 7.204 3.396 20.575 1.00 .00 ATOM 453 O LEU 31 6.799 4.257 21.351 1.00 .00 ATOM 439 CB LEU 31 6.758 3.529 18.008 1.00 .00 ATOM 442 CG LEU 31 5.292 3.988 18.156 1.00 .00 ATOM 444 CD1 LEU 31 4.496 3.022 18.989 1.00 .00 ATOM 448 CD2 LEU 31 5.229 5.396 18.712 1.00 .00 ATOM 436 HN LEU 31 9.044 2.530 18.100 1.00 0.00 ATOM 438 HA LEU 31 8.020 4.829 19.213 1.00 0.00 ATOM 440 HB1 LEU 31 6.759 2.466 17.816 1.00 0.00 ATOM 441 HB2 LEU 31 7.158 4.015 17.131 1.00 0.00 ATOM 443 HG LEU 31 4.723 3.969 17.249 1.00 0.00 ATOM 445 HD11 LEU 31 4.501 2.051 18.517 1.00 0.00 ATOM 446 HD12 LEU 31 3.479 3.374 19.074 1.00 0.00 ATOM 447 HD13 LEU 31 4.943 2.946 19.969 1.00 0.00 ATOM 449 HD21 LEU 31 5.686 5.421 19.691 1.00 0.00 ATOM 450 HD22 LEU 31 4.196 5.702 18.780 1.00 0.00 ATOM 451 HD23 LEU 31 5.758 6.067 18.051 1.00 0.00 ATOM 454 N LYS 32 7.179 2.120 20.851 1.00 .00 ATOM 456 CA LYS 32 6.784 1.607 22.167 1.00 .00 ATOM 474 C LYS 32 7.676 2.195 23.289 1.00 .00 ATOM 475 O LYS 32 7.180 2.605 24.342 1.00 .00 ATOM 458 CB LYS 32 6.860 .086 22.161 1.00 .00 ATOM 461 CG LYS 32 6.449 -.579 23.461 1.00 .00 ATOM 464 CD LYS 32 6.495 -2.096 23.347 1.00 .00 ATOM 467 CE LYS 32 5.564 -2.613 22.246 1.00 .00 ATOM 470 NZ LYS 32 4.156 -2.222 22.477 1.00 .00 ATOM 455 HN LYS 32 7.380 1.506 20.110 1.00 0.00 ATOM 457 HA LYS 32 5.762 1.908 22.346 1.00 0.00 ATOM 459 HB1 LYS 32 7.876 -0.202 21.934 1.00 0.00 ATOM 460 HB2 LYS 32 6.214 -0.274 21.376 1.00 0.00 ATOM 462 HG1 LYS 32 5.445 -0.274 23.711 1.00 0.00 ATOM 463 HG2 LYS 32 7.122 -0.263 24.244 1.00 0.00 ATOM 465 HD1 LYS 32 6.195 -2.521 24.293 1.00 0.00 ATOM 466 HD2 LYS 32 7.507 -2.397 23.121 1.00 0.00 ATOM 468 HE1 LYS 32 5.626 -3.691 22.230 1.00 0.00 ATOM 469 HE2 LYS 32 5.887 -2.236 21.288 1.00 0.00 ATOM 471 HZ1 LYS 32 4.046 -1.192 22.566 1.00 0.00 ATOM 472 HZ2 LYS 32 3.764 -2.682 23.322 1.00 0.00 ATOM 473 HZ3 LYS 32 3.585 -2.523 21.660 1.00 0.00 ATOM 476 N THR 33 8.984 2.247 23.040 1.00 .00 ATOM 478 CA THR 33 9.939 2.841 23.971 1.00 .00 ATOM 488 C THR 33 9.607 4.321 24.197 1.00 .00 ATOM 489 O THR 33 9.717 4.840 25.309 1.00 .00 ATOM 480 CB THR 33 11.374 2.697 23.439 1.00 .00 ATOM 482 OG1 THR 33 11.704 1.292 23.299 1.00 .00 ATOM 484 CG2 THR 33 12.386 3.374 24.353 1.00 .00 ATOM 477 HN THR 33 9.316 1.864 22.198 1.00 0.00 ATOM 479 HA THR 33 9.863 2.321 24.908 1.00 0.00 ATOM 481 HB THR 33 11.372 3.176 22.477 1.00 0.00 ATOM 483 HG1 THR 33 11.046 0.867 22.727 1.00 0.00 ATOM 490 N HIS 34 9.165 4.961 23.138 1.00 .00 ATOM 492 CA HIS 34 8.735 6.341 23.158 1.00 .00 ATOM 505 C HIS 34 7.614 6.606 24.195 1.00 .00 ATOM 506 O HIS 34 7.520 7.710 24.735 1.00 .00 ATOM 494 CB HIS 34 8.328 6.786 21.725 1.00 .00 ATOM 497 CG HIS 34 7.509 8.033 21.664 1.00 .00 ATOM 498 ND1 HIS 34 8.027 9.301 21.723 1.00 .00 ATOM 500 CD2 HIS 34 6.169 8.184 21.616 1.00 .00 ATOM 502 CE1 HIS 34 7.037 10.155 21.725 1.00 .00 ATOM 504 NE2 HIS 34 5.923 9.510 21.655 1.00 .00 ATOM 491 HN HIS 34 9.142 4.470 22.287 1.00 0.00 ATOM 493 HA HIS 34 9.592 6.928 23.456 1.00 0.00 ATOM 495 HB1 HIS 34 7.758 5.990 21.268 1.00 0.00 ATOM 496 HB2 HIS 34 9.216 6.955 21.136 1.00 0.00 ATOM 499 HD1 HIS 34 8.973 9.565 21.774 1.00 0.00 ATOM 501 HD2 HIS 34 5.433 7.394 21.559 1.00 0.00 ATOM 503 HE1 HIS 34 7.009 11.230 21.814 1.00 0.00 ATOM 507 N PHE 35 6.770 5.624 24.476 1.00 .00 ATOM 509 CA PHE 35 5.718 5.877 25.449 1.00 .00 ATOM 525 C PHE 35 6.203 5.544 26.834 1.00 .00 ATOM 526 O PHE 35 5.595 5.916 27.803 1.00 .00 ATOM 511 CB PHE 35 4.442 5.101 25.189 1.00 .00 ATOM 514 CG PHE 35 3.954 5.130 23.791 1.00 .00 ATOM 515 CD1 PHE 35 3.617 6.316 23.177 1.00 .00 ATOM 517 CD2 PHE 35 3.824 3.957 23.091 1.00 .00 ATOM 519 CE1 PHE 35 3.169 6.331 21.878 1.00 .00 ATOM 521 CE2 PHE 35 3.375 3.955 21.806 1.00 .00 ATOM 523 CZ PHE 35 3.046 5.138 21.181 1.00 .00 ATOM 508 HN PHE 35 6.854 4.742 24.049 1.00 0.00 ATOM 510 HA PHE 35 5.506 6.935 25.414 1.00 0.00 ATOM 512 HB1 PHE 35 3.707 5.619 25.790 1.00 0.00 ATOM 513 HB2 PHE 35 4.532 4.076 25.512 1.00 0.00 ATOM 516 HD1 PHE 35 3.721 7.241 23.724 1.00 0.00 ATOM 518 HD2 PHE 35 4.080 3.024 23.571 1.00 0.00 ATOM 520 HE1 PHE 35 2.914 7.286 21.434 1.00 0.00 ATOM 522 HE2 PHE 35 3.282 3.020 21.274 1.00 0.00 ATOM 524 HZ PHE 35 2.719 5.090 20.145 1.00 0.00 ATOM 527 N ARG 36 7.327 4.862 26.929 1.00 .00 ATOM 529 CA ARG 36 7.873 4.484 28.226 1.00 .00 ATOM 549 C ARG 36 8.593 5.660 28.888 1.00 .00 ATOM 550 O ARG 36 9.281 5.510 29.907 1.00 .00 ATOM 531 CB ARG 36 8.758 3.236 28.127 1.00 .00 ATOM 534 CG ARG 36 7.983 1.984 27.715 1.00 .00 ATOM 537 CD ARG 36 8.846 .730 27.756 1.00 .00 ATOM 540 NE ARG 36 9.927 .733 26.765 1.00 .00 ATOM 542 CZ ARG 36 11.226 .609 27.053 1.00 .00 ATOM 543 NH1 ARG 36 11.636 .612 28.318 1.00 .00 ATOM 546 NH2 ARG 36 12.110 .503 26.073 1.00 .00 ATOM 528 HN ARG 36 7.811 4.617 26.111 1.00 0.00 ATOM 530 HA ARG 36 7.018 4.258 28.847 1.00 0.00 ATOM 532 HB1 ARG 36 9.213 3.052 29.088 1.00 0.00 ATOM 533 HB2 ARG 36 9.534 3.415 27.397 1.00 0.00 ATOM 535 HG1 ARG 36 7.611 2.123 26.710 1.00 0.00 ATOM 536 HG2 ARG 36 7.150 1.848 28.388 1.00 0.00 ATOM 538 HD1 ARG 36 8.211 -0.123 27.568 1.00 0.00 ATOM 539 HD2 ARG 36 9.274 0.630 28.741 1.00 0.00 ATOM 541 HE ARG 36 9.629 0.777 25.829 1.00 0.00 ATOM 544 HH11 ARG 36 11.004 0.702 29.093 1.00 0.00 ATOM 545 HH12 ARG 36 12.608 0.544 28.560 1.00 0.00 ATOM 547 HH21 ARG 36 11.841 0.515 25.103 1.00 0.00 ATOM 548 HH22 ARG 36 13.094 0.396 26.239 1.00 0.00 ATOM 551 N SER 37 8.410 6.816 28.305 1.00 .00 ATOM 553 CA SER 37 8.879 8.054 28.824 1.00 .00 ATOM 560 C SER 37 7.737 8.675 29.656 1.00 .00 ATOM 561 O SER 37 6.675 9.028 29.112 1.00 .00 ATOM 555 CB SER 37 9.245 8.939 27.654 1.00 .00 ATOM 558 OG SER 37 10.156 8.257 26.808 1.00 .00 ATOM 552 HN SER 37 7.905 6.832 27.465 1.00 0.00 ATOM 554 HA SER 37 9.748 7.881 29.437 1.00 0.00 ATOM 556 HB1 SER 37 9.693 9.861 27.990 1.00 0.00 ATOM 557 HB2 SER 37 8.341 9.150 27.108 1.00 0.00 ATOM 559 HG SER 37 10.228 7.362 27.163 1.00 0.00 ATOM 562 N LYS 38 7.952 8.777 30.964 1.00 .00 ATOM 564 CA LYS 38 6.924 9.236 31.916 1.00 .00 ATOM 582 C LYS 38 6.330 10.602 31.571 1.00 .00 ATOM 583 O LYS 38 5.115 10.801 31.706 1.00 .00 ATOM 566 CB LYS 38 7.470 9.249 33.349 1.00 .00 ATOM 569 CG LYS 38 8.681 10.147 33.534 1.00 .00 ATOM 572 CD LYS 38 9.181 10.171 34.971 1.00 .00 ATOM 575 CE LYS 38 8.148 10.753 35.928 1.00 .00 ATOM 578 NZ LYS 38 8.669 10.844 37.302 1.00 .00 ATOM 563 HN LYS 38 8.839 8.533 31.309 1.00 0.00 ATOM 565 HA LYS 38 6.115 8.523 31.879 1.00 0.00 ATOM 567 HB1 LYS 38 7.747 8.243 33.627 1.00 0.00 ATOM 568 HB2 LYS 38 6.688 9.592 34.010 1.00 0.00 ATOM 570 HG1 LYS 38 8.392 11.144 33.235 1.00 0.00 ATOM 571 HG2 LYS 38 9.467 9.797 32.883 1.00 0.00 ATOM 573 HD1 LYS 38 10.078 10.769 35.013 1.00 0.00 ATOM 574 HD2 LYS 38 9.410 9.161 35.280 1.00 0.00 ATOM 576 HE1 LYS 38 7.273 10.120 35.926 1.00 0.00 ATOM 577 HE2 LYS 38 7.873 11.741 35.592 1.00 0.00 ATOM 579 HZ1 LYS 38 8.942 9.913 37.677 1.00 0.00 ATOM 580 HZ2 LYS 38 7.961 11.255 37.942 1.00 0.00 ATOM 581 HZ3 LYS 38 9.508 11.458 37.328 1.00 0.00 ATOM 584 N ASP 39 7.175 11.521 31.090 1.00 .00 ATOM 586 CA ASP 39 6.754 12.903 30.801 1.00 .00 ATOM 594 C ASP 39 5.641 12.929 29.801 1.00 .00 ATOM 595 O ASP 39 4.740 13.737 29.897 1.00 .00 ATOM 588 CB ASP 39 7.918 13.734 30.258 1.00 .00 ATOM 591 CG ASP 39 7.542 15.195 30.004 1.00 .00 ATOM 592 OD1 ASP 39 7.091 15.537 28.891 1.00 .00 ATOM 593 OD2 ASP 39 7.715 16.028 30.922 1.00 .00 ATOM 585 HN ASP 39 8.109 11.265 30.917 1.00 0.00 ATOM 587 HA ASP 39 6.414 13.350 31.723 1.00 0.00 ATOM 589 HB1 ASP 39 8.250 13.299 29.326 1.00 0.00 ATOM 590 HB2 ASP 39 8.731 13.693 30.966 1.00 0.00 ATOM 596 N HIS 40 5.693 12.014 28.867 1.00 .00 ATOM 598 CA HIS 40 4.727 11.967 27.775 1.00 .00 ATOM 611 C HIS 40 3.394 11.734 28.265 1.00 .00 ATOM 612 O HIS 40 2.513 12.472 27.988 1.00 .00 ATOM 600 CB HIS 40 5.007 10.825 26.839 1.00 .00 ATOM 603 CG HIS 40 4.179 10.781 25.606 1.00 .00 ATOM 604 ND1 HIS 40 3.346 11.842 25.244 1.00 .00 ATOM 606 CD2 HIS 40 4.452 10.139 24.585 1.00 .00 ATOM 608 CE1 HIS 40 3.227 11.824 23.961 1.00 .00 ATOM 610 NE2 HIS 40 3.900 10.810 23.526 1.00 .00 ATOM 597 HN HIS 40 6.416 11.354 28.938 1.00 0.00 ATOM 599 HA HIS 40 4.727 12.881 27.211 1.00 0.00 ATOM 601 HB1 HIS 40 4.920 9.864 27.320 1.00 0.00 ATOM 602 HB2 HIS 40 5.989 10.947 26.388 1.00 0.00 ATOM 605 HD1 HIS 40 2.898 12.507 25.817 1.00 0.00 ATOM 607 HD2 HIS 40 4.800 9.131 24.788 1.00 0.00 ATOM 609 HE1 HIS 40 2.659 12.489 23.331 1.00 0.00 ATOM 613 N LYS 41 3.262 10.692 28.956 1.00 .00 ATOM 615 CA LYS 41 2.014 10.224 29.351 1.00 .00 ATOM 633 C LYS 41 1.408 11.141 30.397 1.00 .00 ATOM 634 O LYS 41 .195 11.268 30.505 1.00 .00 ATOM 617 CB LYS 41 2.139 8.776 29.705 1.00 .00 ATOM 620 CG LYS 41 2.772 7.958 28.524 1.00 .00 ATOM 623 CD LYS 41 2.817 6.477 28.850 1.00 .00 ATOM 626 CE LYS 41 3.651 6.201 30.096 1.00 .00 ATOM 629 NZ LYS 41 3.764 4.760 30.376 1.00 .00 ATOM 614 HN LYS 41 4.068 10.206 29.234 1.00 0.00 ATOM 616 HA LYS 41 1.388 10.308 28.474 1.00 0.00 ATOM 618 HB1 LYS 41 1.166 8.360 29.919 1.00 0.00 ATOM 619 HB2 LYS 41 2.780 8.694 30.573 1.00 0.00 ATOM 621 HG1 LYS 41 3.787 8.286 28.329 1.00 0.00 ATOM 622 HG2 LYS 41 2.328 8.156 27.553 1.00 0.00 ATOM 624 HD1 LYS 41 3.255 5.949 28.016 1.00 0.00 ATOM 625 HD2 LYS 41 1.815 6.113 29.017 1.00 0.00 ATOM 627 HE1 LYS 41 3.186 6.688 30.941 1.00 0.00 ATOM 628 HE2 LYS 41 4.642 6.605 29.954 1.00 0.00 ATOM 630 HZ1 LYS 41 2.833 4.336 30.552 1.00 0.00 ATOM 631 HZ2 LYS 41 4.383 4.598 31.196 1.00 0.00 ATOM 632 HZ3 LYS 41 4.200 4.263 29.572 1.00 0.00 ATOM 635 N LYS 42 2.274 11.797 31.137 1.00 .00 ATOM 637 CA LYS 42 1.871 12.859 32.021 1.00 .00 ATOM 655 C LYS 42 1.366 14.071 31.187 1.00 .00 ATOM 656 O LYS 42 .319 14.661 31.486 1.00 .00 ATOM 639 CB LYS 42 3.056 13.296 32.880 1.00 .00 ATOM 642 CG LYS 42 2.759 14.496 33.745 1.00 .00 ATOM 645 CD LYS 42 1.677 14.192 34.758 1.00 .00 ATOM 648 CE LYS 42 1.353 15.403 35.601 1.00 .00 ATOM 651 NZ LYS 42 .313 15.101 36.597 1.00 .00 ATOM 636 HN LYS 42 3.224 11.553 31.092 1.00 0.00 ATOM 638 HA LYS 42 1.079 12.495 32.659 1.00 0.00 ATOM 640 HB1 LYS 42 3.883 13.540 32.230 1.00 0.00 ATOM 641 HB2 LYS 42 3.346 12.475 33.519 1.00 0.00 ATOM 643 HG1 LYS 42 2.395 15.248 33.058 1.00 0.00 ATOM 644 HG2 LYS 42 3.659 14.830 34.237 1.00 0.00 ATOM 646 HD1 LYS 42 2.014 13.391 35.399 1.00 0.00 ATOM 647 HD2 LYS 42 0.781 13.887 34.238 1.00 0.00 ATOM 649 HE1 LYS 42 1.007 16.196 34.956 1.00 0.00 ATOM 650 HE2 LYS 42 2.250 15.719 36.113 1.00 0.00 ATOM 652 HZ1 LYS 42 0.078 15.961 37.129 1.00 0.00 ATOM 653 HZ2 LYS 42 0.672 14.408 37.284 1.00 0.00 ATOM 654 HZ3 LYS 42 -0.557 14.723 36.175 1.00 0.00 ATOM 657 N ARG 43 2.117 14.408 30.130 1.00 .00 ATOM 659 CA ARG 43 1.826 15.539 29.254 1.00 .00 ATOM 679 C ARG 43 .558 15.228 28.447 1.00 .00 ATOM 680 O ARG 43 -.200 16.111 28.056 1.00 .00 ATOM 661 CB ARG 43 3.006 15.682 28.280 1.00 .00 ATOM 664 CG ARG 43 3.073 16.972 27.503 1.00 .00 ATOM 667 CD ARG 43 3.451 18.117 28.416 1.00 .00 ATOM 670 NE ARG 43 4.761 17.885 29.072 1.00 .00 ATOM 672 CZ ARG 43 5.434 18.795 29.783 1.00 .00 ATOM 673 NH1 ARG 43 4.970 20.043 29.896 1.00 .00 ATOM 676 NH2 ARG 43 6.582 18.461 30.378 1.00 .00 ATOM 658 HN ARG 43 2.927 13.896 29.880 1.00 0.00 ATOM 660 HA ARG 43 1.722 16.447 29.828 1.00 0.00 ATOM 662 HB1 ARG 43 2.972 14.858 27.583 1.00 0.00 ATOM 663 HB2 ARG 43 3.918 15.596 28.852 1.00 0.00 ATOM 665 HG1 ARG 43 2.107 17.173 27.066 1.00 0.00 ATOM 666 HG2 ARG 43 3.817 16.877 26.726 1.00 0.00 ATOM 668 HD1 ARG 43 2.694 18.237 29.176 1.00 0.00 ATOM 669 HD2 ARG 43 3.515 19.013 27.821 1.00 0.00 ATOM 671 HE ARG 43 5.138 16.979 28.970 1.00 0.00 ATOM 674 HH11 ARG 43 4.119 20.350 29.463 1.00 0.00 ATOM 675 HH12 ARG 43 5.465 20.739 30.423 1.00 0.00 ATOM 677 HH21 ARG 43 6.987 17.534 30.326 1.00 0.00 ATOM 678 HH22 ARG 43 7.101 19.138 30.908 1.00 0.00 ATOM 681 N LEU 44 .355 13.951 28.252 1.00 .00 ATOM 683 CA LEU 44 -.667 13.378 27.462 1.00 .00 ATOM 698 C LEU 44 -2.005 13.605 28.122 1.00 .00 ATOM 699 O LEU 44 -3.004 13.837 27.455 1.00 .00 ATOM 685 CB LEU 44 -.362 11.896 27.382 1.00 .00 ATOM 688 CG LEU 44 -1.162 11.083 26.437 1.00 .00 ATOM 690 CD1 LEU 44 -.838 11.470 25.003 1.00 .00 ATOM 694 CD2 LEU 44 -.937 9.607 26.669 1.00 .00 ATOM 682 HN LEU 44 0.943 13.290 28.669 1.00 0.00 ATOM 684 HA LEU 44 -0.646 13.784 26.463 1.00 0.00 ATOM 686 HB1 LEU 44 -0.493 11.491 28.375 1.00 0.00 ATOM 687 HB2 LEU 44 0.678 11.791 27.119 1.00 0.00 ATOM 689 HG LEU 44 -2.163 11.334 26.724 1.00 0.00 ATOM 691 HD11 LEU 44 -1.435 10.880 24.325 1.00 0.00 ATOM 692 HD12 LEU 44 0.209 11.258 24.821 1.00 0.00 ATOM 693 HD13 LEU 44 -1.027 12.521 24.844 1.00 0.00 ATOM 695 HD21 LEU 44 -1.233 9.341 27.673 1.00 0.00 ATOM 696 HD22 LEU 44 0.116 9.398 26.537 1.00 0.00 ATOM 697 HD23 LEU 44 -1.509 9.037 25.952 1.00 0.00 ATOM 700 N LYS 45 -2.001 13.557 29.446 1.00 .00 ATOM 702 CA LYS 45 -3.190 13.820 30.244 1.00 .00 ATOM 720 C LYS 45 -3.685 15.234 29.954 1.00 .00 ATOM 721 O LYS 45 -4.873 15.476 29.839 1.00 .00 ATOM 704 CB LYS 45 -2.867 13.675 31.741 1.00 .00 ATOM 707 CG LYS 45 -2.349 12.293 32.139 1.00 .00 ATOM 710 CD LYS 45 -1.991 12.221 33.628 1.00 .00 ATOM 713 CE LYS 45 -3.215 12.326 34.544 1.00 .00 ATOM 716 NZ LYS 45 -4.130 11.163 34.396 1.00 .00 ATOM 701 HN LYS 45 -1.157 13.323 29.889 1.00 0.00 ATOM 703 HA LYS 45 -3.955 13.109 29.971 1.00 0.00 ATOM 705 HB1 LYS 45 -3.754 13.890 32.314 1.00 0.00 ATOM 706 HB2 LYS 45 -2.111 14.404 31.995 1.00 0.00 ATOM 708 HG1 LYS 45 -1.470 12.069 31.553 1.00 0.00 ATOM 709 HG2 LYS 45 -3.115 11.560 31.935 1.00 0.00 ATOM 711 HD1 LYS 45 -1.310 13.028 33.856 1.00 0.00 ATOM 712 HD2 LYS 45 -1.499 11.279 33.821 1.00 0.00 ATOM 714 HE1 LYS 45 -3.752 13.234 34.314 1.00 0.00 ATOM 715 HE2 LYS 45 -2.874 12.369 35.567 1.00 0.00 ATOM 717 HZ1 LYS 45 -3.619 10.281 34.607 1.00 0.00 ATOM 718 HZ2 LYS 45 -4.553 11.095 33.444 1.00 0.00 ATOM 719 HZ3 LYS 45 -4.897 11.249 35.095 1.00 0.00 ATOM 722 N GLN 46 -2.740 16.144 29.798 1.00 .00 ATOM 724 CA GLN 46 -3.033 17.537 29.501 1.00 .00 ATOM 737 C GLN 46 -3.374 17.734 28.020 1.00 .00 ATOM 738 O GLN 46 -3.983 18.737 27.638 1.00 .00 ATOM 726 CB GLN 46 -1.867 18.425 29.919 1.00 .00 ATOM 729 CG GLN 46 -1.587 18.386 31.412 1.00 .00 ATOM 732 CD GLN 46 -.404 19.236 31.814 1.00 .00 ATOM 733 OE1 GLN 46 -.099 20.246 31.181 1.00 .00 ATOM 734 NE2 GLN 46 .257 18.841 32.868 1.00 .00 ATOM 723 HN GLN 46 -1.806 15.859 29.877 1.00 0.00 ATOM 725 HA GLN 46 -3.901 17.808 30.082 1.00 0.00 ATOM 727 HB1 GLN 46 -2.088 19.446 29.643 1.00 0.00 ATOM 728 HB2 GLN 46 -0.979 18.103 29.397 1.00 0.00 ATOM 730 HG1 GLN 46 -1.391 17.363 31.697 1.00 0.00 ATOM 731 HG2 GLN 46 -2.460 18.742 31.940 1.00 0.00 ATOM 739 N LEU 47 -2.949 16.800 27.191 1.00 .00 ATOM 741 CA LEU 47 -3.280 16.820 25.777 1.00 .00 ATOM 756 C LEU 47 -4.720 16.348 25.599 1.00 .00 ATOM 757 O LEU 47 -5.452 16.825 24.728 1.00 .00 ATOM 743 CB LEU 47 -2.318 15.937 24.994 1.00 .00 ATOM 746 CG LEU 47 -2.515 15.873 23.471 1.00 .00 ATOM 748 CD1 LEU 47 -2.341 17.251 22.838 1.00 .00 ATOM 752 CD2 LEU 47 -1.552 14.872 22.852 1.00 .00 ATOM 740 HN LEU 47 -2.388 16.081 27.550 1.00 0.00 ATOM 742 HA LEU 47 -3.194 17.835 25.433 1.00 0.00 ATOM 744 HB1 LEU 47 -2.471 14.954 25.399 1.00 0.00 ATOM 745 HB2 LEU 47 -1.308 16.253 25.206 1.00 0.00 ATOM 747 HG LEU 47 -3.523 15.545 23.266 1.00 0.00 ATOM 749 HD11 LEU 47 -1.350 17.625 23.049 1.00 0.00 ATOM 750 HD12 LEU 47 -3.075 17.930 23.243 1.00 0.00 ATOM 751 HD13 LEU 47 -2.474 17.174 21.769 1.00 0.00 ATOM 753 HD21 LEU 47 -1.736 13.892 23.265 1.00 0.00 ATOM 754 HD22 LEU 47 -0.536 15.168 23.066 1.00 0.00 ATOM 755 HD23 LEU 47 -1.700 14.843 21.782 1.00 0.00 ATOM 758 N SER 48 -5.113 15.414 26.436 1.00 .00 ATOM 760 CA SER 48 -6.466 14.932 26.471 1.00 .00 ATOM 767 C SER 48 -7.305 15.855 27.360 1.00 .00 ATOM 768 O SER 48 -6.793 16.864 27.864 1.00 .00 ATOM 762 CB SER 48 -6.480 13.484 26.993 1.00 .00 ATOM 765 OG SER 48 -5.831 13.374 28.259 1.00 .00 ATOM 759 HN SER 48 -4.456 15.023 27.054 1.00 0.00 ATOM 761 HA SER 48 -6.859 14.953 25.466 1.00 0.00 ATOM 763 HB1 SER 48 -5.983 12.836 26.286 1.00 0.00 ATOM 764 HB2 SER 48 -7.504 13.166 27.116 1.00 0.00 ATOM 766 HG SER 48 -5.704 14.259 28.630 1.00 0.00 ATOM 769 N VAL 49 -8.570 15.548 27.539 1.00 .00 ATOM 771 CA VAL 49 -9.399 16.352 28.412 1.00 .00 ATOM 783 C VAL 49 -9.089 15.959 29.850 1.00 .00 ATOM 784 O VAL 49 -8.894 16.827 30.708 1.00 .00 ATOM 773 CB VAL 49 -10.909 16.179 28.098 1.00 .00 ATOM 775 CG1 VAL 49 -11.763 17.070 28.983 1.00 .00 ATOM 779 CG2 VAL 49 -11.182 16.470 26.627 1.00 .00 ATOM 770 HN VAL 49 -8.965 14.768 27.096 1.00 0.00 ATOM 772 HA VAL 49 -9.111 17.384 28.273 1.00 0.00 ATOM 774 HB VAL 49 -11.181 15.155 28.298 1.00 0.00 ATOM 785 N GLU 50 -9.041 14.627 30.065 1.00 .00 ATOM 787 CA GLU 50 -8.627 13.961 31.317 1.00 .00 ATOM 798 C GLU 50 -9.261 14.567 32.576 1.00 .00 ATOM 799 O GLU 50 -8.812 15.601 33.078 1.00 .00 ATOM 789 CB GLU 50 -7.105 13.968 31.459 1.00 .00 ATOM 792 CG GLU 50 -6.575 13.184 32.656 1.00 .00 ATOM 795 CD GLU 50 -6.648 11.696 32.491 1.00 .00 ATOM 796 OE1 GLU 50 -7.677 11.091 32.823 1.00 .00 ATOM 797 OE2 GLU 50 -5.641 11.099 32.066 1.00 .00 ATOM 786 HN GLU 50 -9.317 14.054 29.320 1.00 0.00 ATOM 788 HA GLU 50 -8.946 12.932 31.244 1.00 0.00 ATOM 790 HB1 GLU 50 -6.772 14.991 31.550 1.00 0.00 ATOM 791 HB2 GLU 50 -6.671 13.540 30.567 1.00 0.00 ATOM 793 HG1 GLU 50 -7.197 13.442 33.502 1.00 0.00 ATOM 794 HG2 GLU 50 -5.553 13.450 32.870 1.00 0.00 ATOM 800 N PRO 51 -10.300 13.952 33.098 1.00 .00 ATOM 801 CA PRO 51 -10.907 14.409 34.325 1.00 .00 ATOM 812 C PRO 51 -9.993 14.117 35.521 1.00 .00 ATOM 813 O PRO 51 -9.882 12.968 35.962 1.00 .00 ATOM 803 CB PRO 51 -12.211 13.592 34.427 1.00 .00 ATOM 806 CG PRO 51 -12.359 12.917 33.101 1.00 .00 ATOM 809 CD PRO 51 -10.978 12.782 32.545 1.00 .00 ATOM 802 HA PRO 51 -11.126 15.465 34.291 1.00 0.00 ATOM 804 HB1 PRO 51 -13.040 14.255 34.624 1.00 0.00 ATOM 805 HB2 PRO 51 -12.122 12.873 35.227 1.00 0.00 ATOM 807 HG1 PRO 51 -12.970 13.523 32.447 1.00 0.00 ATOM 808 HG2 PRO 51 -12.802 11.940 33.231 1.00 0.00 ATOM 810 HD1 PRO 51 -11.004 12.824 31.466 1.00 0.00 ATOM 811 HD2 PRO 51 -10.517 11.866 32.883 1.00 0.00 ATOM 814 N TYR 52 -9.289 15.125 35.988 1.00 .00 ATOM 816 CA TYR 52 -8.423 14.963 37.139 1.00 .00 ATOM 833 C TYR 52 -8.585 16.127 38.078 1.00 .00 ATOM 834 O TYR 52 -9.305 17.081 37.773 1.00 .00 ATOM 818 CB TYR 52 -6.928 14.762 36.752 1.00 .00 ATOM 821 CG TYR 52 -6.230 15.922 36.018 1.00 .00 ATOM 822 CD1 TYR 52 -5.769 17.047 36.703 1.00 .00 ATOM 824 CD2 TYR 52 -6.000 15.863 34.657 1.00 .00 ATOM 826 CE1 TYR 52 -5.107 18.063 36.044 1.00 .00 ATOM 828 CE2 TYR 52 -5.346 16.874 33.990 1.00 .00 ATOM 830 CZ TYR 52 -4.902 17.970 34.683 1.00 .00 ATOM 831 OH TYR 52 -4.232 18.977 34.012 1.00 .00 ATOM 815 HN TYR 52 -9.361 16.003 35.553 1.00 0.00 ATOM 817 HA TYR 52 -8.769 14.079 37.654 1.00 0.00 ATOM 819 HB1 TYR 52 -6.859 13.884 36.128 1.00 0.00 ATOM 820 HB2 TYR 52 -6.363 14.581 37.654 1.00 0.00 ATOM 823 HD1 TYR 52 -5.937 17.117 37.768 1.00 0.00 ATOM 825 HD2 TYR 52 -6.345 15.007 34.102 1.00 0.00 ATOM 827 HE1 TYR 52 -4.758 18.925 36.593 1.00 0.00 ATOM 829 HE2 TYR 52 -5.184 16.803 32.925 1.00 0.00 ATOM 832 HH TYR 52 -4.720 19.135 33.194 1.00 0.00 ATOM 835 N SER 53 -7.922 16.070 39.192 1.00 .00 ATOM 837 CA SER 53 -7.995 17.089 40.158 1.00 .00 ATOM 844 C SER 53 -6.612 17.217 40.745 1.00 .00 ATOM 845 O SER 53 -5.816 16.256 40.681 1.00 .00 ATOM 839 CB SER 53 -9.028 16.692 41.229 1.00 .00 ATOM 842 OG SER 53 -9.227 17.717 42.180 1.00 .00 ATOM 836 HN SER 53 -7.322 15.327 39.425 1.00 0.00 ATOM 838 HA SER 53 -8.292 18.014 39.688 1.00 0.00 ATOM 840 HB1 SER 53 -8.686 15.803 41.737 1.00 0.00 ATOM 841 HB2 SER 53 -9.972 16.485 40.747 1.00 0.00 ATOM 843 HG SER 53 -10.162 17.702 42.421 1.00 0.00 ATOM 846 N GLN 54 -6.289 18.353 41.286 1.00 .00 ATOM 848 CA GLN 54 -4.987 18.543 41.856 1.00 .00 ATOM 861 C GLN 54 -4.940 18.023 43.282 1.00 .00 ATOM 862 O GLN 54 -4.906 18.768 44.251 1.00 .00 ATOM 850 CB GLN 54 -4.490 19.985 41.743 1.00 .00 ATOM 853 CG GLN 54 -3.073 20.177 42.257 1.00 .00 ATOM 856 CD GLN 54 -2.582 21.582 42.086 1.00 .00 ATOM 857 OE1 GLN 54 -1.994 21.920 41.056 1.00 .00 ATOM 858 NE2 GLN 54 -2.808 22.407 43.073 1.00 .00 ATOM 847 HN GLN 54 -6.954 19.072 41.305 1.00 0.00 ATOM 849 HA GLN 54 -4.334 17.904 41.280 1.00 0.00 ATOM 851 HB1 GLN 54 -5.146 20.626 42.314 1.00 0.00 ATOM 852 HB2 GLN 54 -4.522 20.286 40.707 1.00 0.00 ATOM 854 HG1 GLN 54 -2.414 19.510 41.721 1.00 0.00 ATOM 855 HG2 GLN 54 -3.048 19.932 43.309 1.00 0.00 ATOM 863 N GLU 55 -5.061 16.737 43.376 1.00 .00 ATOM 865 CA GLU 55 -4.951 16.019 44.615 1.00 .00 ATOM 876 C GLU 55 -3.705 15.171 44.514 1.00 .00 ATOM 877 O GLU 55 -3.025 14.879 45.494 1.00 .00 ATOM 867 CB GLU 55 -6.153 15.078 44.768 1.00 .00 ATOM 870 CG GLU 55 -7.525 15.741 44.732 1.00 .00 ATOM 873 CD GLU 55 -7.747 16.709 45.860 1.00 .00 ATOM 874 OE1 GLU 55 -8.004 16.259 47.000 1.00 .00 ATOM 875 OE2 GLU 55 -7.702 17.922 45.632 1.00 .00 ATOM 864 HN GLU 55 -5.274 16.261 42.544 1.00 0.00 ATOM 866 HA GLU 55 -4.907 16.702 45.450 1.00 0.00 ATOM 868 HB1 GLU 55 -6.053 14.553 45.706 1.00 0.00 ATOM 869 HB2 GLU 55 -6.116 14.358 43.965 1.00 0.00 ATOM 871 HG1 GLU 55 -8.283 14.973 44.779 1.00 0.00 ATOM 872 HG2 GLU 55 -7.622 16.282 43.802 1.00 0.00 ATOM 878 N GLU 56 -3.393 14.845 43.280 1.00 .00 ATOM 880 CA GLU 56 -2.341 13.927 42.912 1.00 .00 ATOM 891 C GLU 56 -.952 14.569 42.949 1.00 .00 ATOM 892 O GLU 56 .034 13.928 42.615 1.00 .00 ATOM 882 CB GLU 56 -2.651 13.392 41.510 1.00 .00 ATOM 885 CG GLU 56 -3.963 12.638 41.427 1.00 .00 ATOM 888 CD GLU 56 -4.284 12.184 40.030 1.00 .00 ATOM 889 OE1 GLU 56 -3.884 11.075 39.655 1.00 .00 OE2 ATOM 890 OE2 GLU 56 -4.955 12.932 39.288 1.00 .00 OE1 ATOM 879 HN GLU 56 -3.898 15.247 42.546 1.00 0.00 ATOM 881 HA GLU 56 -2.364 13.089 43.593 1.00 0.00 ATOM 883 HB1 GLU 56 -1.860 12.743 41.164 1.00 0.00 ATOM 884 HB2 GLU 56 -2.760 14.237 40.843 1.00 0.00 ATOM 886 HG1 GLU 56 -4.753 13.288 41.773 1.00 0.00 ATOM 887 HG2 GLU 56 -3.908 11.769 42.065 1.00 0.00 ATOM 893 N ALA 57 -.873 15.822 43.357 1.00 .00 ATOM 895 CA ALA 57 .411 16.511 43.403 1.00 .00 ATOM 901 C ALA 57 .512 17.409 44.606 1.00 .00 ATOM 902 O ALA 57 1.343 18.307 44.661 1.00 .00 ATOM 897 CB ALA 57 .631 17.294 42.132 1.00 .00 ATOM 894 HN ALA 57 -1.691 16.295 43.617 1.00 0.00 ATOM 896 HA ALA 57 1.178 15.762 43.488 1.00 0.00 ATOM 898 HB1 ALA 57 0.566 16.606 41.304 1.00 0.00 ATOM 899 HB2 ALA 57 1.606 17.757 42.156 1.00 0.00 ATOM 900 HB3 ALA 57 -0.132 18.052 42.030 1.00 0.00 ATOM 903 N GLU 58 -.280 17.124 45.591 1.00 .00 ATOM 905 CA GLU 58 -.306 17.940 46.801 1.00 .00 ATOM 916 C GLU 58 .826 17.579 47.748 1.00 .00 ATOM 917 O GLU 58 1.025 18.232 48.773 1.00 .00 ATOM 907 CB GLU 58 -1.662 17.856 47.495 1.00 .00 ATOM 910 CG GLU 58 -2.797 18.427 46.663 1.00 .00 ATOM 913 CD GLU 58 -2.612 19.902 46.362 1.00 .00 ATOM 914 OE1 GLU 58 -1.926 20.243 45.383 1.00 .00 OE2 ATOM 915 OE2 GLU 58 -3.147 20.742 47.109 1.00 .00 OE1 ATOM 904 HN GLU 58 -0.848 16.333 45.488 1.00 0.00 ATOM 906 HA GLU 58 -0.147 18.961 46.483 1.00 0.00 ATOM 908 HB1 GLU 58 -1.614 18.404 48.425 1.00 0.00 ATOM 909 HB2 GLU 58 -1.880 16.819 47.709 1.00 0.00 ATOM 911 HG1 GLU 58 -3.725 18.297 47.199 1.00 0.00 ATOM 912 HG2 GLU 58 -2.844 17.891 45.727 1.00 0.00 ATOM 918 N ARG 59 1.568 16.549 47.405 1.00 .00 ATOM 920 CA ARG 59 2.690 16.152 48.203 1.00 .00 ATOM 940 C ARG 59 3.945 16.673 47.522 1.00 .00 ATOM 941 O ARG 59 4.311 16.218 46.433 1.00 .00 ATOM 922 CB ARG 59 2.724 14.603 48.381 1.00 .00 ATOM 925 CG ARG 59 3.716 14.055 49.448 1.00 .00 ATOM 928 CD ARG 59 5.193 14.255 49.100 1.00 .00 ATOM 931 NE ARG 59 5.589 13.512 47.898 1.00 .00 ATOM 933 CZ ARG 59 6.763 13.648 47.258 1.00 .00 ATOM 934 NH1 ARG 59 7.626 14.595 47.622 1.00 .00 ATOM 937 NH2 ARG 59 7.062 12.843 46.243 1.00 .00 ATOM 919 HN ARG 59 1.356 16.065 46.582 1.00 0.00 ATOM 921 HA ARG 59 2.593 16.627 49.167 1.00 0.00 ATOM 923 HB1 ARG 59 2.980 14.165 47.427 1.00 0.00 ATOM 924 HB2 ARG 59 1.735 14.269 48.658 1.00 0.00 ATOM 926 HG1 ARG 59 3.524 13.001 49.581 1.00 0.00 ATOM 927 HG2 ARG 59 3.529 14.564 50.380 1.00 0.00 ATOM 929 HD1 ARG 59 5.792 13.921 49.935 1.00 0.00 ATOM 930 HD2 ARG 59 5.369 15.307 48.929 1.00 0.00 ATOM 932 HE ARG 59 4.934 12.847 47.587 1.00 0.00 ATOM 935 HH11 ARG 59 7.462 15.243 48.369 1.00 0.00 ATOM 936 HH12 ARG 59 8.506 14.714 47.157 1.00 0.00 ATOM 938 HH21 ARG 59 6.445 12.117 45.921 1.00 0.00 ATOM 939 HH22 ARG 59 7.924 12.915 45.734 1.00 0.00 ATOM 942 N ALA 60 4.554 17.646 48.131 1.00 .00 ATOM 944 CA ALA 60 5.792 18.214 47.655 1.00 .00 ATOM 950 C ALA 60 6.855 18.014 48.719 1.00 .00 ATOM 951 O ALA 60 7.869 17.358 48.491 1.00 .00 ATOM 946 CB ALA 60 5.609 19.694 47.349 1.00 .00 ATOM 943 HN ALA 60 4.146 18.013 48.946 1.00 0.00 ATOM 945 HA ALA 60 6.084 17.696 46.753 1.00 0.00 ATOM 947 HB1 ALA 60 6.536 20.108 46.984 1.00 0.00 ATOM 948 HB2 ALA 60 5.315 20.213 48.250 1.00 0.00 ATOM 949 HB3 ALA 60 4.839 19.817 46.602 1.00 0.00 ATOM 952 N ALA 61 6.591 18.549 49.887 1.00 .00 ATOM 954 CA ALA 61 7.467 18.421 51.029 1.00 .00 ATOM 960 C ALA 61 6.635 18.565 52.273 1.00 .00 ATOM 961 O ALA 61 6.538 17.641 53.091 1.00 .00 ATOM 956 CB ALA 61 8.577 19.469 50.994 1.00 .00 ATOM 953 HN ALA 61 5.757 19.051 50.015 1.00 0.00 ATOM 955 HA ALA 61 7.901 17.436 51.011 1.00 0.00 ATOM 957 HB1 ALA 61 9.157 19.351 50.090 1.00 0.00 ATOM 958 HB2 ALA 61 9.218 19.337 51.853 1.00 0.00 ATOM 959 HB3 ALA 61 8.144 20.458 51.020 1.00 0.00 ATOM 962 N GLY 62 6.016 19.714 52.385 1.00 .00 ATOM 964 CA GLY 62 5.112 19.997 53.466 1.00 .00 ATOM 967 C GLY 62 5.809 20.247 54.767 1.00 .00 ATOM 968 O GLY 62 7.012 20.572 54.802 1.00 .00 ATOM 963 HN GLY 62 6.199 20.388 51.699 1.00 0.00 ATOM 965 HA1 GLY 62 4.445 19.157 53.584 1.00 0.00 ATOM 966 HA2 GLY 62 4.526 20.868 53.218 1.00 0.00 ATOM 969 N MET 63 5.070 20.112 55.827 1.00 .00 ATOM 971 CA MET 63 5.581 20.266 57.151 1.00 .00 ATOM 984 C MET 63 5.768 18.874 57.703 1.00 .00 ATOM 985 O MET 63 4.791 18.170 57.973 1.00 .00 ATOM 973 CB MET 63 4.582 21.085 58.004 1.00 .00 ATOM 976 CG MET 63 5.044 21.471 59.421 1.00 .00 ATOM 979 SD MET 63 5.268 20.079 60.552 1.00 .00 ATOM 980 CE MET 63 5.758 20.942 62.036 1.00 .00 ATOM 970 HN MET 63 4.121 19.874 55.732 1.00 0.00 ATOM 972 HA MET 63 6.530 20.779 57.101 1.00 0.00 ATOM 974 HB1 MET 63 3.668 20.515 58.088 1.00 0.00 ATOM 975 HB2 MET 63 4.359 21.999 57.476 1.00 0.00 ATOM 977 HG1 MET 63 4.314 22.147 59.841 1.00 0.00 ATOM 978 HG2 MET 63 5.990 21.986 59.345 1.00 0.00 ATOM 981 HE1 MET 63 4.970 21.617 62.335 1.00 0.00 ATOM 982 HE2 MET 63 6.661 21.501 61.843 1.00 0.00 ATOM 983 HE3 MET 63 5.940 20.226 62.824 1.00 0.00 ATOM 986 N GLY 64 6.995 18.447 57.804 1.00 .00 ATOM 988 CA GLY 64 7.251 17.135 58.286 1.00 .00 ATOM 991 C GLY 64 8.684 16.913 58.623 1.00 .00 ATOM 992 O GLY 64 9.078 17.012 59.785 1.00 .00 ATOM 987 HN GLY 64 7.746 19.024 57.548 1.00 0.00 ATOM 989 HA1 GLY 64 6.961 16.424 57.526 1.00 0.00 ATOM 990 HA2 GLY 64 6.665 16.967 59.174 1.00 0.00 ATOM 993 N SER 65 9.468 16.656 57.622 1.00 .00 ATOM 995 CA SER 65 10.838 16.325 57.814 1.00 .00 ATOM 1002 C SER 65 11.730 17.547 57.654 1.00 .00 ATOM 1003 O SER 65 12.028 17.987 56.529 1.00 .00 ATOM 997 CB SER 65 11.258 15.203 56.848 1.00 .00 ATOM 1000 OG SER 65 12.598 14.779 57.075 1.00 .00 ATOM 994 HN SER 65 9.121 16.710 56.706 1.00 0.00 ATOM 996 HA SER 65 10.942 15.955 58.823 1.00 0.00 ATOM 998 HB1 SER 65 11.177 15.567 55.834 1.00 0.00 ATOM 999 HB2 SER 65 10.606 14.352 56.970 1.00 0.00 ATOM 1001 HG SER 65 12.978 14.612 56.202 1.00 0.00 ATOM 1004 N TYR 66 12.087 18.127 58.769 1.00 .00 ATOM 1006 CA TYR 66 13.003 19.166 58.843 1.00 .00 ATOM 1023 C TYR 66 13.836 18.912 60.072 1.00 .00 ATOM 1024 O TYR 66 13.294 18.452 61.078 1.00 .00 ATOM 1008 CB TYR 66 12.291 20.513 58.922 1.00 .00 ATOM 1011 CG TYR 66 11.353 20.724 60.104 1.00 .00 ATOM 1012 CD1 TYR 66 10.052 20.239 60.092 1.00 .00 ATOM 1014 CD2 TYR 66 11.776 21.429 61.225 1.00 .00 ATOM 1016 CE1 TYR 66 9.208 20.449 61.161 1.00 .00 ATOM 1018 CE2 TYR 66 10.940 21.640 62.295 1.00 .00 ATOM 1020 CZ TYR 66 9.660 21.149 62.262 1.00 .00 ATOM 1021 OH TYR 66 8.822 21.361 63.330 1.00 .00 ATOM 1005 HN TYR 66 11.738 17.901 59.653 1.00 0.00 ATOM 1007 HA TYR 66 13.631 19.135 57.965 1.00 0.00 ATOM 1009 HB1 TYR 66 11.792 20.756 57.996 1.00 0.00 ATOM 1010 HB2 TYR 66 13.114 21.170 59.111 1.00 0.00 ATOM 1013 HD1 TYR 66 9.702 19.688 59.232 1.00 0.00 ATOM 1015 HD2 TYR 66 12.783 21.817 61.249 1.00 0.00 ATOM 1017 HE1 TYR 66 8.200 20.063 61.134 1.00 0.00 ATOM 1019 HE2 TYR 66 11.292 22.189 63.157 1.00 0.00 ATOM 1022 HH TYR 66 8.940 22.272 63.628 1.00 0.00 ATOM 1025 N VAL 67 15.129 19.180 59.980 1.00 .00 ATOM 1038 CA VAL 67 16.106 18.934 61.053 1.00 .00 ATOM 1039 C VAL 67 16.022 17.493 61.631 1.00 .00 ATOM 1028 CB VAL 67 16.187 20.071 62.165 1.00 .00 ATOM 1030 CG1 VAL 67 14.882 20.300 62.917 1.00 .00 ATOM 1034 CG2 VAL 67 17.328 19.806 63.132 1.00 .00 ATOM 1026 HN VAL 67 15.462 19.552 59.137 1.00 0.00 ATOM 1027 HA VAL 67 17.041 18.926 60.508 1.00 0.00 ATOM 1029 HB VAL 67 16.407 20.995 61.649 1.00 0.00 ATOM 1042 ZN1 ZIN 68 4.195 10.399 21.665 1.00 0.00 MASTER 1013 END