PFRMAT TS TARGET T0475 AUTHOR SAM-T06-server METHOD The SAM-T06 server uses methods similar to SAM_T04 in CASP6 and METHOD the SAM-T02 method in CASP5. METHOD METHOD We start with a fully automated method: METHOD METHOD Use the SAM-T2K and SAM-T04 methods for finding homologs of the METHOD target and aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. Different neural nets are used for the METHOD SAM-T2K alignments and the SAM-T04 alignments. METHOD We currently use 8 local-structure alphabets: METHOD DSSP METHOD STRIDE METHOD STR2 an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD ALPHA an discretization of the alpha torsion angle: METHOD CA(i-i), CA(i), CA(i+1), CA(i+2) METHOD BYS a discretization of Ramachandran plots, due to Bystroff METHOD CB_burial_14_7 a 7-state discretization of the number of C_beta METHOD atoms in a 14 Angstrom radius sphere around the C_beta. METHOD near-backbone-11 an 11-state discretization of the number of METHOD residues (represented by near-backbone points) in a METHOD 9.65 Angstrom radius sphere around the sidechain proxy METHOD spot for the residue. METHOD DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD DSSP_EHL2 is not predicted directly by a METHOD neural net, but is computed as a weighted METHOD average of the other backbone alphabet predictions. METHOD METHOD We make 2-track HMMs with each alphabet (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of 6400 (t04) or 9900 (t2k) templates METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD We also made a few 3-track HMMs (AA, str2, CB_burial_14_7 and METHOD AA, str2, near-backbone-11) for finding and aligning more remote METHOD homologs. METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence (for early targets, only METHOD t2k template library was searched this way). METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we did not have time to METHOD optimize them), and the best templates ranked. Ranking was METHOD separate for predictions from the t2k and t04 multiple alignments. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment methods (mainly using the SAM hmmscore METHOD program, but a few alignments were made with Bob Edgar's MUSCLE METHOD profile-profile aligner). METHOD METHOD Generate fragments (short 9-residue alignments for each position) METHOD using SAM's "fragfinder" program and the 3-track HMM. METHOD METHOD Then the "undertaker" program (named because it optimizes burial) METHOD is used to try to combine the alignments and the fragments into METHOD a consistent 3D model. No single alignment or parent template METHOD was used, though in many cases one had much more influence than METHOD the others. The alignment scores were not passed to undertaker, METHOD but were used only to pick the set of alignments and fragments METHOD that undertaker would see. Helix and strand constraints METHOD generated from the secondary-structure predictions are passed to METHOD undertaker to use in the cost function. METHOD METHOD One important change in this server over previous methods is that METHOD sheet constraints are extracted from the top few alignments and METHOD passed to undertaker. REMARK 6 REMARK 6 T0475 model 3 Thu Jun 26 12:55:10 2008 MODEL 3 PARENT N/A ATOM 2 N ASN 2 -20.035 1.815 -3.603 1.00 0.00 ATOM 3 CA ASN 2 -20.318 0.395 -3.663 1.00 0.00 ATOM 4 CB ASN 2 -20.720 -0.012 -5.081 1.00 0.00 ATOM 5 CG ASN 2 -22.099 0.488 -5.462 1.00 0.00 ATOM 6 ND2 ASN 2 -22.405 0.451 -6.753 1.00 0.00 ATOM 7 OD1 ASN 2 -22.880 0.902 -4.604 1.00 0.00 ATOM 8 O ASN 2 -17.946 0.264 -3.330 1.00 0.00 ATOM 9 C ASN 2 -19.041 -0.313 -3.247 1.00 0.00 ATOM 10 N SER 3 -19.164 -1.559 -2.772 1.00 0.00 ATOM 11 CA SER 3 -18.003 -2.346 -2.354 1.00 0.00 ATOM 12 CB SER 3 -18.447 -3.689 -1.770 1.00 0.00 ATOM 13 OG SER 3 -19.060 -4.499 -2.758 1.00 0.00 ATOM 14 O SER 3 -15.907 -2.621 -3.520 1.00 0.00 ATOM 15 C SER 3 -17.136 -2.574 -3.601 1.00 0.00 ATOM 16 N GLU 4 -17.792 -2.712 -4.755 1.00 0.00 ATOM 17 CA GLU 4 -17.077 -2.924 -6.016 1.00 0.00 ATOM 18 CB GLU 4 -18.064 -3.039 -7.179 1.00 0.00 ATOM 19 CG GLU 4 -18.999 -4.234 -7.084 1.00 0.00 ATOM 20 CD GLU 4 -20.022 -4.264 -8.202 1.00 0.00 ATOM 21 OE1 GLU 4 -20.012 -3.340 -9.041 1.00 0.00 ATOM 22 OE2 GLU 4 -20.832 -5.214 -8.240 1.00 0.00 ATOM 23 O GLU 4 -14.960 -1.937 -6.545 1.00 0.00 ATOM 24 C GLU 4 -16.141 -1.751 -6.280 1.00 0.00 ATOM 25 N ILE 5 -14.987 0.594 -4.169 1.00 0.00 ATOM 26 CA ILE 5 -13.938 0.681 -3.161 1.00 0.00 ATOM 27 CB ILE 5 -14.494 0.429 -1.746 1.00 0.00 ATOM 28 CG1 ILE 5 -15.423 1.570 -1.327 1.00 0.00 ATOM 29 CG2 ILE 5 -13.359 0.338 -0.738 1.00 0.00 ATOM 30 CD1 ILE 5 -16.218 1.281 -0.073 1.00 0.00 ATOM 31 O ILE 5 -11.660 -0.035 -3.309 1.00 0.00 ATOM 32 C ILE 5 -12.841 -0.348 -3.412 1.00 0.00 ATOM 33 N GLU 6 -13.233 -1.566 -3.763 1.00 0.00 ATOM 34 CA GLU 6 -12.272 -2.615 -4.068 1.00 0.00 ATOM 35 CB GLU 6 -12.990 -3.935 -4.351 1.00 0.00 ATOM 36 CG GLU 6 -13.624 -4.573 -3.127 1.00 0.00 ATOM 37 CD GLU 6 -14.429 -5.812 -3.465 1.00 0.00 ATOM 38 OE1 GLU 6 -14.555 -6.129 -4.667 1.00 0.00 ATOM 39 OE2 GLU 6 -14.938 -6.466 -2.531 1.00 0.00 ATOM 40 O GLU 6 -10.249 -2.372 -5.344 1.00 0.00 ATOM 41 C GLU 6 -11.459 -2.206 -5.305 1.00 0.00 ATOM 42 N LEU 7 -12.139 -1.660 -6.309 1.00 0.00 ATOM 43 CA LEU 7 -11.469 -1.234 -7.535 1.00 0.00 ATOM 44 CB LEU 7 -12.469 -0.588 -8.495 1.00 0.00 ATOM 45 CG LEU 7 -13.500 -1.524 -9.129 1.00 0.00 ATOM 46 CD1 LEU 7 -14.537 -0.731 -9.912 1.00 0.00 ATOM 47 CD2 LEU 7 -12.828 -2.499 -10.083 1.00 0.00 ATOM 48 O LEU 7 -9.283 -0.272 -7.781 1.00 0.00 ATOM 49 C LEU 7 -10.381 -0.220 -7.216 1.00 0.00 ATOM 50 N PRO 8 -10.693 0.702 -6.306 1.00 0.00 ATOM 51 CA PRO 8 -9.754 1.735 -5.894 1.00 0.00 ATOM 52 CB PRO 8 -10.585 2.651 -4.994 1.00 0.00 ATOM 53 CG PRO 8 -11.994 2.417 -5.421 1.00 0.00 ATOM 54 CD PRO 8 -12.078 0.967 -5.808 1.00 0.00 ATOM 55 O PRO 8 -7.430 1.443 -5.369 1.00 0.00 ATOM 56 C PRO 8 -8.592 1.092 -5.145 1.00 0.00 ATOM 57 N VAL 9 -8.899 0.146 -4.264 1.00 0.00 ATOM 58 CA VAL 9 -7.855 -0.560 -3.517 1.00 0.00 ATOM 59 CB VAL 9 -8.445 -1.695 -2.659 1.00 0.00 ATOM 60 CG1 VAL 9 -7.333 -2.544 -2.063 1.00 0.00 ATOM 61 CG2 VAL 9 -9.279 -1.125 -1.522 1.00 0.00 ATOM 62 O VAL 9 -5.635 -1.030 -4.326 1.00 0.00 ATOM 63 C VAL 9 -6.845 -1.167 -4.496 1.00 0.00 ATOM 64 N GLN 10 -7.353 -1.834 -5.526 1.00 0.00 ATOM 65 CA GLN 10 -6.484 -2.460 -6.510 1.00 0.00 ATOM 66 CB GLN 10 -7.299 -3.329 -7.469 1.00 0.00 ATOM 67 CG GLN 10 -6.457 -4.120 -8.458 1.00 0.00 ATOM 68 CD GLN 10 -5.541 -5.116 -7.777 1.00 0.00 ATOM 69 OE1 GLN 10 -5.956 -5.839 -6.871 1.00 0.00 ATOM 70 NE2 GLN 10 -4.286 -5.156 -8.211 1.00 0.00 ATOM 71 O GLN 10 -4.546 -1.690 -7.688 1.00 0.00 ATOM 72 C GLN 10 -5.713 -1.461 -7.370 1.00 0.00 ATOM 73 N LYS 11 -6.350 -0.354 -7.744 1.00 0.00 ATOM 74 CA LYS 11 -5.660 0.658 -8.541 1.00 0.00 ATOM 75 CB LYS 11 -6.626 1.776 -8.940 1.00 0.00 ATOM 76 CG LYS 11 -7.675 1.355 -9.956 1.00 0.00 ATOM 77 CD LYS 11 -7.042 1.029 -11.300 1.00 0.00 ATOM 78 CE LYS 11 -8.097 0.671 -12.334 1.00 0.00 ATOM 79 NZ LYS 11 -7.490 0.332 -13.651 1.00 0.00 ATOM 80 O LYS 11 -3.492 1.680 -8.269 1.00 0.00 ATOM 81 C LYS 11 -4.517 1.256 -7.719 1.00 0.00 ATOM 82 N GLN 12 -4.709 1.283 -6.400 1.00 0.00 ATOM 83 CA GLN 12 -3.720 1.811 -5.459 1.00 0.00 ATOM 84 CB GLN 12 -4.294 1.846 -4.041 1.00 0.00 ATOM 85 CG GLN 12 -5.420 2.850 -3.852 1.00 0.00 ATOM 86 CD GLN 12 -4.982 4.275 -4.128 1.00 0.00 ATOM 87 OE1 GLN 12 -3.928 4.711 -3.665 1.00 0.00 ATOM 88 NE2 GLN 12 -5.792 5.004 -4.887 1.00 0.00 ATOM 89 O GLN 12 -1.348 1.381 -5.610 1.00 0.00 ATOM 90 C GLN 12 -2.480 0.913 -5.476 1.00 0.00 ATOM 91 N LEU 13 -2.717 -0.385 -5.343 1.00 0.00 ATOM 92 CA LEU 13 -1.639 -1.357 -5.349 1.00 0.00 ATOM 93 CB LEU 13 -2.188 -2.768 -5.129 1.00 0.00 ATOM 94 CG LEU 13 -1.162 -3.903 -5.128 1.00 0.00 ATOM 95 CD1 LEU 13 -0.161 -3.719 -3.997 1.00 0.00 ATOM 96 CD2 LEU 13 -1.847 -5.248 -4.942 1.00 0.00 ATOM 97 O LEU 13 0.308 -1.228 -6.736 1.00 0.00 ATOM 98 C LEU 13 -0.916 -1.315 -6.683 1.00 0.00 ATOM 99 N GLU 14 -1.691 -1.383 -7.761 1.00 0.00 ATOM 100 CA GLU 14 -1.141 -1.361 -9.110 1.00 0.00 ATOM 101 CB GLU 14 -2.266 -1.354 -10.147 1.00 0.00 ATOM 102 CG GLU 14 -3.025 -2.667 -10.248 1.00 0.00 ATOM 103 CD GLU 14 -4.207 -2.587 -11.194 1.00 0.00 ATOM 104 OE1 GLU 14 -4.477 -1.484 -11.714 1.00 0.00 ATOM 105 OE2 GLU 14 -4.862 -3.626 -11.414 1.00 0.00 ATOM 106 O GLU 14 0.772 -0.196 -9.972 1.00 0.00 ATOM 107 C GLU 14 -0.283 -0.119 -9.337 1.00 0.00 ATOM 108 N ALA 15 -0.736 1.022 -8.821 1.00 0.00 ATOM 109 CA ALA 15 0.004 2.270 -8.983 1.00 0.00 ATOM 110 CB ALA 15 -0.802 3.439 -8.437 1.00 0.00 ATOM 111 O ALA 15 2.340 2.760 -8.711 1.00 0.00 ATOM 112 C ALA 15 1.334 2.220 -8.239 1.00 0.00 ATOM 113 N TYR 16 1.341 1.577 -7.072 1.00 0.00 ATOM 114 CA TYR 16 2.569 1.463 -6.296 1.00 0.00 ATOM 115 CB TYR 16 2.280 0.858 -4.922 1.00 0.00 ATOM 116 CG TYR 16 1.595 1.808 -3.965 1.00 0.00 ATOM 117 CD1 TYR 16 0.242 1.676 -3.681 1.00 0.00 ATOM 118 CD2 TYR 16 2.304 2.831 -3.350 1.00 0.00 ATOM 119 CE1 TYR 16 -0.393 2.540 -2.808 1.00 0.00 ATOM 120 CE2 TYR 16 1.688 3.703 -2.475 1.00 0.00 ATOM 121 CZ TYR 16 0.327 3.551 -2.207 1.00 0.00 ATOM 122 OH TYR 16 -0.302 4.412 -1.337 1.00 0.00 ATOM 123 O TYR 16 4.762 0.861 -7.089 1.00 0.00 ATOM 124 C TYR 16 3.559 0.565 -7.035 1.00 0.00 ATOM 125 N ASN 17 3.046 -0.519 -7.618 1.00 0.00 ATOM 126 CA ASN 17 3.879 -1.460 -8.373 1.00 0.00 ATOM 127 CB ASN 17 3.085 -2.721 -8.718 1.00 0.00 ATOM 128 CG ASN 17 2.845 -3.608 -7.511 1.00 0.00 ATOM 129 ND2 ASN 17 1.839 -4.469 -7.601 1.00 0.00 ATOM 130 OD1 ASN 17 3.560 -3.518 -6.512 1.00 0.00 ATOM 131 O ASN 17 5.434 -1.177 -10.178 1.00 0.00 ATOM 132 C ASN 17 4.364 -0.836 -9.671 1.00 0.00 ATOM 133 N ALA 18 3.561 0.064 -10.224 1.00 0.00 ATOM 134 CA ALA 18 3.919 0.726 -11.471 1.00 0.00 ATOM 135 CB ALA 18 2.667 1.109 -12.246 1.00 0.00 ATOM 136 O ALA 18 5.267 2.594 -12.147 1.00 0.00 ATOM 137 C ALA 18 4.723 1.998 -11.217 1.00 0.00 ATOM 138 N ARG 19 4.802 2.405 -9.955 1.00 0.00 ATOM 139 CA ARG 19 5.534 3.612 -9.621 1.00 0.00 ATOM 140 CB ARG 19 6.937 3.573 -10.230 1.00 0.00 ATOM 141 CG ARG 19 7.792 2.413 -9.744 1.00 0.00 ATOM 142 CD ARG 19 9.246 2.592 -10.150 1.00 0.00 ATOM 143 NE ARG 19 9.407 2.644 -11.601 1.00 0.00 ATOM 144 CZ ARG 19 9.498 1.572 -12.381 1.00 0.00 ATOM 145 NH1 ARG 19 9.643 1.715 -13.691 1.00 0.00 ATOM 146 NH2 ARG 19 9.445 0.359 -11.849 1.00 0.00 ATOM 147 O ARG 19 5.399 5.826 -10.512 1.00 0.00 ATOM 148 C ARG 19 4.795 4.814 -10.165 1.00 0.00 ATOM 149 N ASP 20 3.475 4.703 -10.240 1.00 0.00 ATOM 150 CA ASP 20 2.642 5.783 -10.753 1.00 0.00 ATOM 151 CB ASP 20 1.376 5.221 -11.404 1.00 0.00 ATOM 152 CG ASP 20 1.643 4.602 -12.761 1.00 0.00 ATOM 153 OD1 ASP 20 2.765 4.777 -13.283 1.00 0.00 ATOM 154 OD2 ASP 20 0.733 3.941 -13.302 1.00 0.00 ATOM 155 O ASP 20 1.195 6.522 -8.980 1.00 0.00 ATOM 156 C ASP 20 2.221 6.729 -9.624 1.00 0.00 ATOM 157 N ILE 21 3.022 7.767 -9.392 1.00 0.00 ATOM 158 CA ILE 21 2.734 8.746 -8.346 1.00 0.00 ATOM 159 CB ILE 21 3.876 9.770 -8.202 1.00 0.00 ATOM 160 CG1 ILE 21 5.137 9.091 -7.664 1.00 0.00 ATOM 161 CG2 ILE 21 3.478 10.879 -7.242 1.00 0.00 ATOM 162 CD1 ILE 21 6.376 9.957 -7.738 1.00 0.00 ATOM 163 O ILE 21 0.640 9.771 -7.751 1.00 0.00 ATOM 164 C ILE 21 1.455 9.528 -8.645 1.00 0.00 ATOM 165 N ASP 22 1.284 9.929 -9.902 1.00 0.00 ATOM 166 CA ASP 22 0.096 10.684 -10.290 1.00 0.00 ATOM 167 CB ASP 22 0.158 11.052 -11.773 1.00 0.00 ATOM 168 CG ASP 22 1.177 12.136 -12.064 1.00 0.00 ATOM 169 OD1 ASP 22 1.663 12.767 -11.102 1.00 0.00 ATOM 170 OD2 ASP 22 1.492 12.353 -13.254 1.00 0.00 ATOM 171 O ASP 22 -2.141 10.364 -9.474 1.00 0.00 ATOM 172 C ASP 22 -1.171 9.867 -10.053 1.00 0.00 ATOM 173 N ALA 23 -1.148 8.612 -10.493 1.00 0.00 ATOM 174 CA ALA 23 -2.297 7.741 -10.325 1.00 0.00 ATOM 175 CB ALA 23 -2.028 6.381 -10.951 1.00 0.00 ATOM 176 O ALA 23 -3.791 7.450 -8.482 1.00 0.00 ATOM 177 C ALA 23 -2.621 7.527 -8.861 1.00 0.00 ATOM 178 N PHE 24 -1.586 7.429 -8.033 1.00 0.00 ATOM 179 CA PHE 24 -1.791 7.237 -6.603 1.00 0.00 ATOM 180 CB PHE 24 -0.448 7.099 -5.883 1.00 0.00 ATOM 181 CG PHE 24 -0.570 6.972 -4.392 1.00 0.00 ATOM 182 CD1 PHE 24 -0.946 5.771 -3.812 1.00 0.00 ATOM 183 CD2 PHE 24 -0.309 8.052 -3.566 1.00 0.00 ATOM 184 CE1 PHE 24 -1.058 5.655 -2.441 1.00 0.00 ATOM 185 CE2 PHE 24 -0.423 7.935 -2.194 1.00 0.00 ATOM 186 CZ PHE 24 -0.794 6.742 -1.631 1.00 0.00 ATOM 187 O PHE 24 -3.651 8.328 -5.530 1.00 0.00 ATOM 188 C PHE 24 -2.540 8.449 -6.049 1.00 0.00 ATOM 189 N MET 25 -1.927 9.619 -6.189 1.00 0.00 ATOM 190 CA MET 25 -2.509 10.866 -5.710 1.00 0.00 ATOM 191 CB MET 25 -1.664 12.058 -6.163 1.00 0.00 ATOM 192 CG MET 25 -2.207 13.407 -5.720 1.00 0.00 ATOM 193 SD MET 25 -1.208 14.787 -6.311 1.00 0.00 ATOM 194 CE MET 25 -1.660 14.814 -8.044 1.00 0.00 ATOM 195 O MET 25 -4.756 11.653 -5.473 1.00 0.00 ATOM 196 C MET 25 -3.930 11.123 -6.209 1.00 0.00 ATOM 197 N ALA 26 -4.212 10.755 -7.456 1.00 0.00 ATOM 198 CA ALA 26 -5.537 10.962 -8.046 1.00 0.00 ATOM 199 CB ALA 26 -5.532 10.564 -9.513 1.00 0.00 ATOM 200 O ALA 26 -7.830 10.350 -7.619 1.00 0.00 ATOM 201 C ALA 26 -6.639 10.146 -7.364 1.00 0.00 ATOM 202 N TRP 27 -6.247 9.214 -6.505 1.00 0.00 ATOM 203 CA TRP 27 -7.229 8.400 -5.794 1.00 0.00 ATOM 204 CB TRP 27 -6.600 7.086 -5.328 1.00 0.00 ATOM 205 CG TRP 27 -6.261 6.152 -6.449 1.00 0.00 ATOM 206 CD1 TRP 27 -5.020 5.896 -6.957 1.00 0.00 ATOM 207 CD2 TRP 27 -7.177 5.346 -7.201 1.00 0.00 ATOM 208 CE2 TRP 27 -6.420 4.629 -8.148 1.00 0.00 ATOM 209 CE3 TRP 27 -8.562 5.160 -7.165 1.00 0.00 ATOM 210 NE1 TRP 27 -5.104 4.983 -7.979 1.00 0.00 ATOM 211 CZ2 TRP 27 -7.002 3.742 -9.052 1.00 0.00 ATOM 212 CZ3 TRP 27 -9.135 4.280 -8.063 1.00 0.00 ATOM 213 CH2 TRP 27 -8.359 3.581 -8.995 1.00 0.00 ATOM 214 O TRP 27 -8.881 8.945 -4.139 1.00 0.00 ATOM 215 C TRP 27 -7.750 9.151 -4.573 1.00 0.00 ATOM 216 N TRP 28 -6.913 10.026 -4.031 1.00 0.00 ATOM 217 CA TRP 28 -7.250 10.798 -2.842 1.00 0.00 ATOM 218 CB TRP 28 -5.984 11.167 -2.066 1.00 0.00 ATOM 219 CG TRP 28 -5.281 9.984 -1.472 1.00 0.00 ATOM 220 CD1 TRP 28 -4.180 9.348 -1.972 1.00 0.00 ATOM 221 CD2 TRP 28 -5.630 9.295 -0.265 1.00 0.00 ATOM 222 CE2 TRP 28 -4.697 8.252 -0.095 1.00 0.00 ATOM 223 CE3 TRP 28 -6.638 9.456 0.690 1.00 0.00 ATOM 224 NE1 TRP 28 -3.821 8.306 -1.152 1.00 0.00 ATOM 225 CZ2 TRP 28 -4.743 7.376 0.988 1.00 0.00 ATOM 226 CZ3 TRP 28 -6.681 8.586 1.762 1.00 0.00 ATOM 227 CH2 TRP 28 -5.741 7.559 1.905 1.00 0.00 ATOM 228 O TRP 28 -7.824 12.690 -4.190 1.00 0.00 ATOM 229 C TRP 28 -7.973 12.107 -3.122 1.00 0.00 ATOM 230 N ALA 29 -8.754 12.561 -2.145 1.00 0.00 ATOM 231 CA ALA 29 -9.472 13.830 -2.256 1.00 0.00 ATOM 232 CB ALA 29 -10.612 13.884 -1.250 1.00 0.00 ATOM 233 O ALA 29 -7.377 14.641 -1.427 1.00 0.00 ATOM 234 C ALA 29 -8.448 14.923 -1.968 1.00 0.00 ATOM 235 N ASP 30 -8.768 16.163 -2.319 1.00 0.00 ATOM 236 CA ASP 30 -7.839 17.265 -2.082 1.00 0.00 ATOM 237 CB ASP 30 -8.314 18.530 -2.798 1.00 0.00 ATOM 238 CG ASP 30 -8.135 18.450 -4.302 1.00 0.00 ATOM 239 OD1 ASP 30 -7.428 17.533 -4.769 1.00 0.00 ATOM 240 OD2 ASP 30 -8.704 19.304 -5.014 1.00 0.00 ATOM 241 O ASP 30 -6.795 18.239 -0.159 1.00 0.00 ATOM 242 C ASP 30 -7.728 17.576 -0.593 1.00 0.00 ATOM 243 N ASP 31 -8.680 17.082 0.189 1.00 0.00 ATOM 244 CA ASP 31 -8.683 17.322 1.629 1.00 0.00 ATOM 245 CB ASP 31 -10.072 17.754 2.099 1.00 0.00 ATOM 246 CG ASP 31 -11.128 16.696 1.845 1.00 0.00 ATOM 247 OD1 ASP 31 -10.786 15.640 1.273 1.00 0.00 ATOM 248 OD2 ASP 31 -12.298 16.923 2.222 1.00 0.00 ATOM 249 O ASP 31 -8.333 16.091 3.660 1.00 0.00 ATOM 250 C ASP 31 -8.297 16.078 2.430 1.00 0.00 ATOM 251 N CYS 32 -7.916 15.014 1.728 1.00 0.00 ATOM 252 CA CYS 32 -7.563 13.743 2.358 1.00 0.00 ATOM 253 CB CYS 32 -7.226 12.694 1.297 1.00 0.00 ATOM 254 SG CYS 32 -5.646 12.961 0.459 1.00 0.00 ATOM 255 O CYS 32 -5.543 14.688 3.267 1.00 0.00 ATOM 256 C CYS 32 -6.366 13.769 3.298 1.00 0.00 ATOM 257 N GLN 33 -6.281 12.739 4.138 1.00 0.00 ATOM 258 CA GLN 33 -5.189 12.592 5.091 1.00 0.00 ATOM 259 CB GLN 33 -5.680 12.861 6.515 1.00 0.00 ATOM 260 CG GLN 33 -6.051 14.312 6.778 1.00 0.00 ATOM 261 CD GLN 33 -7.396 14.687 6.185 1.00 0.00 ATOM 262 OE1 GLN 33 -8.340 13.899 6.217 1.00 0.00 ATOM 263 NE2 GLN 33 -7.484 15.895 5.641 1.00 0.00 ATOM 264 O GLN 33 -5.364 10.212 4.829 1.00 0.00 ATOM 265 C GLN 33 -4.628 11.176 5.032 1.00 0.00 ATOM 266 N TYR 34 -3.317 11.074 5.224 1.00 0.00 ATOM 267 CA TYR 34 -2.594 9.806 5.216 1.00 0.00 ATOM 268 CB TYR 34 -1.609 9.759 4.046 1.00 0.00 ATOM 269 CG TYR 34 -0.810 8.477 3.971 1.00 0.00 ATOM 270 CD1 TYR 34 -1.382 7.310 3.481 1.00 0.00 ATOM 271 CD2 TYR 34 0.514 8.440 4.390 1.00 0.00 ATOM 272 CE1 TYR 34 -0.659 6.134 3.408 1.00 0.00 ATOM 273 CE2 TYR 34 1.253 7.273 4.324 1.00 0.00 ATOM 274 CZ TYR 34 0.653 6.116 3.829 1.00 0.00 ATOM 275 OH TYR 34 1.376 4.947 3.757 1.00 0.00 ATOM 276 O TYR 34 -0.984 10.499 6.873 1.00 0.00 ATOM 277 C TYR 34 -1.816 9.654 6.529 1.00 0.00 ATOM 278 N TYR 35 -2.101 8.584 7.266 1.00 0.00 ATOM 279 CA TYR 35 -1.407 8.315 8.519 1.00 0.00 ATOM 280 CB TYR 35 -2.404 8.232 9.677 1.00 0.00 ATOM 281 CG TYR 35 -1.759 8.010 11.026 1.00 0.00 ATOM 282 CD1 TYR 35 -1.031 9.021 11.642 1.00 0.00 ATOM 283 CD2 TYR 35 -1.879 6.790 11.681 1.00 0.00 ATOM 284 CE1 TYR 35 -0.439 8.828 12.876 1.00 0.00 ATOM 285 CE2 TYR 35 -1.292 6.580 12.914 1.00 0.00 ATOM 286 CZ TYR 35 -0.569 7.612 13.509 1.00 0.00 ATOM 287 OH TYR 35 0.021 7.417 14.737 1.00 0.00 ATOM 288 O TYR 35 -1.224 5.929 8.665 1.00 0.00 ATOM 289 C TYR 35 -0.668 6.987 8.390 1.00 0.00 ATOM 290 N ALA 36 0.589 7.057 7.963 1.00 0.00 ATOM 291 CA ALA 36 1.410 5.869 7.774 1.00 0.00 ATOM 292 CB ALA 36 1.599 5.584 6.292 1.00 0.00 ATOM 293 O ALA 36 3.616 6.815 7.925 1.00 0.00 ATOM 294 C ALA 36 2.796 6.027 8.397 1.00 0.00 ATOM 295 N PHE 37 3.085 5.247 9.453 1.00 0.00 ATOM 296 CA PHE 37 2.150 4.273 10.024 1.00 0.00 ATOM 297 CB PHE 37 2.913 3.118 10.678 1.00 0.00 ATOM 298 CG PHE 37 3.726 3.529 11.872 1.00 0.00 ATOM 299 CD1 PHE 37 3.161 3.553 13.136 1.00 0.00 ATOM 300 CD2 PHE 37 5.054 3.892 11.732 1.00 0.00 ATOM 301 CE1 PHE 37 3.910 3.930 14.236 1.00 0.00 ATOM 302 CE2 PHE 37 5.801 4.270 12.831 1.00 0.00 ATOM 303 CZ PHE 37 5.235 4.290 14.080 1.00 0.00 ATOM 304 O PHE 37 1.441 6.045 11.475 1.00 0.00 ATOM 305 C PHE 37 1.254 4.887 11.085 1.00 0.00 ATOM 306 N PRO 38 0.281 4.098 11.543 1.00 0.00 ATOM 307 CA PRO 38 -0.652 4.513 12.580 1.00 0.00 ATOM 308 CB PRO 38 -1.485 3.258 12.849 1.00 0.00 ATOM 309 CG PRO 38 -0.619 2.130 12.399 1.00 0.00 ATOM 310 CD PRO 38 0.177 2.654 11.237 1.00 0.00 ATOM 311 O PRO 38 1.053 4.298 14.268 1.00 0.00 ATOM 312 C PRO 38 0.119 4.967 13.822 1.00 0.00 ATOM 313 N ALA 39 -0.288 6.103 14.376 1.00 0.00 ATOM 314 CA ALA 39 0.379 6.633 15.547 1.00 0.00 ATOM 315 CB ALA 39 1.230 5.557 16.204 1.00 0.00 ATOM 316 O ALA 39 1.698 8.580 15.987 1.00 0.00 ATOM 317 C ALA 39 1.273 7.790 15.144 1.00 0.00 ATOM 318 N THR 40 1.559 7.890 13.847 1.00 0.00 ATOM 319 CA THR 40 2.407 8.957 13.332 1.00 0.00 ATOM 320 CB THR 40 3.181 8.507 12.079 1.00 0.00 ATOM 321 CG2 THR 40 4.005 7.264 12.379 1.00 0.00 ATOM 322 OG1 THR 40 2.259 8.210 11.025 1.00 0.00 ATOM 323 O THR 40 0.356 10.120 12.834 1.00 0.00 ATOM 324 C THR 40 1.584 10.181 12.946 1.00 0.00 ATOM 325 N LEU 41 2.282 11.294 12.747 1.00 0.00 ATOM 326 CA LEU 41 1.665 12.561 12.382 1.00 0.00 ATOM 327 CB LEU 41 2.703 13.685 12.388 1.00 0.00 ATOM 328 CG LEU 41 2.178 15.094 12.104 1.00 0.00 ATOM 329 CD1 LEU 41 1.222 15.541 13.199 1.00 0.00 ATOM 330 CD2 LEU 41 3.325 16.090 12.037 1.00 0.00 ATOM 331 O LEU 41 1.799 12.308 10.002 1.00 0.00 ATOM 332 C LEU 41 1.070 12.425 10.985 1.00 0.00 ATOM 333 N LEU 42 -0.266 12.442 10.885 1.00 0.00 ATOM 334 CA LEU 42 -0.983 12.318 9.614 1.00 0.00 ATOM 335 CB LEU 42 -2.494 12.320 9.851 1.00 0.00 ATOM 336 CG LEU 42 -3.375 12.103 8.618 1.00 0.00 ATOM 337 CD1 LEU 42 -3.184 10.702 8.061 1.00 0.00 ATOM 338 CD2 LEU 42 -4.845 12.281 8.967 1.00 0.00 ATOM 339 O LEU 42 -0.621 14.615 9.048 1.00 0.00 ATOM 340 C LEU 42 -0.677 13.454 8.650 1.00 0.00 ATOM 341 N ALA 43 -0.476 13.120 7.383 1.00 0.00 ATOM 342 CA ALA 43 -0.215 14.142 6.387 1.00 0.00 ATOM 343 CB ALA 43 0.700 13.600 5.300 1.00 0.00 ATOM 344 O ALA 43 -2.362 13.701 5.406 1.00 0.00 ATOM 345 C ALA 43 -1.554 14.550 5.785 1.00 0.00 ATOM 346 N GLY 44 -1.796 15.854 5.706 1.00 0.00 ATOM 347 CA GLY 44 -3.049 16.344 5.149 1.00 0.00 ATOM 348 O GLY 44 -1.799 17.788 3.704 1.00 0.00 ATOM 349 C GLY 44 -2.808 17.107 3.850 1.00 0.00 ATOM 350 N ASN 45 -3.727 16.973 2.901 1.00 0.00 ATOM 351 CA ASN 45 -3.598 17.688 1.644 1.00 0.00 ATOM 352 CB ASN 45 -2.859 19.011 1.852 1.00 0.00 ATOM 353 CG ASN 45 -3.678 20.016 2.639 1.00 0.00 ATOM 354 ND2 ASN 45 -2.997 20.948 3.297 1.00 0.00 ATOM 355 OD1 ASN 45 -4.908 19.956 2.652 1.00 0.00 ATOM 356 O ASN 45 -1.950 16.205 0.735 1.00 0.00 ATOM 357 C ASN 45 -2.847 17.012 0.513 1.00 0.00 ATOM 358 N ALA 46 -3.224 17.372 -0.709 1.00 0.00 ATOM 359 CA ALA 46 -2.629 16.843 -1.929 1.00 0.00 ATOM 360 CB ALA 46 -3.117 17.624 -3.139 1.00 0.00 ATOM 361 O ALA 46 -0.429 15.922 -2.162 1.00 0.00 ATOM 362 C ALA 46 -1.106 16.919 -1.924 1.00 0.00 ATOM 363 N ALA 47 -0.577 18.108 -1.660 1.00 0.00 ATOM 364 CA ALA 47 0.869 18.317 -1.634 1.00 0.00 ATOM 365 CB ALA 47 1.190 19.760 -1.271 1.00 0.00 ATOM 366 O ALA 47 2.514 16.721 -0.937 1.00 0.00 ATOM 367 C ALA 47 1.559 17.421 -0.613 1.00 0.00 ATOM 368 N GLU 48 1.078 17.450 0.624 1.00 0.00 ATOM 369 CA GLU 48 1.660 16.624 1.672 1.00 0.00 ATOM 370 CB GLU 48 0.865 16.769 2.971 1.00 0.00 ATOM 371 CG GLU 48 1.066 18.099 3.677 1.00 0.00 ATOM 372 CD GLU 48 2.510 18.338 4.074 1.00 0.00 ATOM 373 OE1 GLU 48 3.094 17.457 4.741 1.00 0.00 ATOM 374 OE2 GLU 48 3.056 19.401 3.716 1.00 0.00 ATOM 375 O GLU 48 2.632 14.453 1.315 1.00 0.00 ATOM 376 C GLU 48 1.632 15.166 1.225 1.00 0.00 ATOM 377 N ILE 49 0.477 14.740 0.726 1.00 0.00 ATOM 378 CA ILE 49 0.285 13.376 0.259 1.00 0.00 ATOM 379 CB ILE 49 -1.153 13.149 -0.244 1.00 0.00 ATOM 380 CG1 ILE 49 -2.151 13.310 0.903 1.00 0.00 ATOM 381 CG2 ILE 49 -1.301 11.750 -0.821 1.00 0.00 ATOM 382 CD1 ILE 49 -1.952 12.319 2.029 1.00 0.00 ATOM 383 O ILE 49 1.793 11.921 -0.916 1.00 0.00 ATOM 384 C ILE 49 1.221 13.014 -0.898 1.00 0.00 ATOM 385 N ARG 50 1.391 13.924 -1.856 1.00 0.00 ATOM 386 CA ARG 50 2.261 13.658 -2.999 1.00 0.00 ATOM 387 CB ARG 50 2.199 14.814 -4.000 1.00 0.00 ATOM 388 CG ARG 50 3.049 14.605 -5.242 1.00 0.00 ATOM 389 CD ARG 50 2.852 15.733 -6.242 1.00 0.00 ATOM 390 NE ARG 50 3.693 15.569 -7.426 1.00 0.00 ATOM 391 CZ ARG 50 3.751 16.441 -8.427 1.00 0.00 ATOM 392 NH1 ARG 50 4.545 16.206 -9.464 1.00 0.00 ATOM 393 NH2 ARG 50 3.015 17.543 -8.392 1.00 0.00 ATOM 394 O ARG 50 4.433 12.640 -3.074 1.00 0.00 ATOM 395 C ARG 50 3.705 13.490 -2.556 1.00 0.00 ATOM 396 N VAL 51 4.120 14.313 -1.601 1.00 0.00 ATOM 397 CA VAL 51 5.469 14.248 -1.063 1.00 0.00 ATOM 398 CB VAL 51 5.703 15.329 0.009 1.00 0.00 ATOM 399 CG1 VAL 51 7.044 15.117 0.695 1.00 0.00 ATOM 400 CG2 VAL 51 5.700 16.713 -0.621 1.00 0.00 ATOM 401 O VAL 51 6.705 12.233 -0.615 1.00 0.00 ATOM 402 C VAL 51 5.667 12.872 -0.436 1.00 0.00 ATOM 403 N ARG 52 4.652 12.420 0.293 1.00 0.00 ATOM 404 CA ARG 52 4.708 11.125 0.960 1.00 0.00 ATOM 405 CB ARG 52 3.376 10.822 1.650 1.00 0.00 ATOM 406 CG ARG 52 3.353 9.499 2.401 1.00 0.00 ATOM 407 CD ARG 52 4.349 9.499 3.548 1.00 0.00 ATOM 408 NE ARG 52 4.297 8.257 4.316 1.00 0.00 ATOM 409 CZ ARG 52 5.202 7.901 5.222 1.00 0.00 ATOM 410 NH1 ARG 52 5.074 6.752 5.871 1.00 0.00 ATOM 411 NH2 ARG 52 6.234 8.694 5.476 1.00 0.00 ATOM 412 O ARG 52 5.959 9.234 0.187 1.00 0.00 ATOM 413 C ARG 52 4.988 9.967 0.005 1.00 0.00 ATOM 414 N HIS 53 4.138 9.794 -1.004 1.00 0.00 ATOM 415 CA HIS 53 4.326 8.701 -1.947 1.00 0.00 ATOM 416 CB HIS 53 3.114 8.579 -2.872 1.00 0.00 ATOM 417 CG HIS 53 2.926 9.754 -3.781 1.00 0.00 ATOM 418 CD2 HIS 53 3.160 10.022 -5.193 1.00 0.00 ATOM 419 ND1 HIS 53 2.419 10.959 -3.346 1.00 0.00 ATOM 420 CE1 HIS 53 2.369 11.814 -4.383 1.00 0.00 ATOM 421 NE2 HIS 53 2.811 11.258 -5.494 1.00 0.00 ATOM 422 O HIS 53 6.174 7.974 -3.304 1.00 0.00 ATOM 423 C HIS 53 5.557 8.926 -2.811 1.00 0.00 ATOM 424 N ILE 54 5.921 10.189 -2.981 1.00 0.00 ATOM 425 CA ILE 54 7.098 10.522 -3.762 1.00 0.00 ATOM 426 CB ILE 54 7.332 12.044 -3.810 1.00 0.00 ATOM 427 CG1 ILE 54 6.221 12.730 -4.606 1.00 0.00 ATOM 428 CG2 ILE 54 8.665 12.358 -4.472 1.00 0.00 ATOM 429 CD1 ILE 54 6.219 14.238 -4.478 1.00 0.00 ATOM 430 O ILE 54 9.049 9.112 -3.731 1.00 0.00 ATOM 431 C ILE 54 8.285 9.839 -3.092 1.00 0.00 ATOM 432 N GLU 55 8.416 10.069 -1.789 1.00 0.00 ATOM 433 CA GLU 55 9.500 9.496 -1.001 1.00 0.00 ATOM 434 CB GLU 55 9.461 10.031 0.432 1.00 0.00 ATOM 435 CG GLU 55 9.854 11.493 0.559 1.00 0.00 ATOM 436 CD GLU 55 9.686 12.021 1.970 1.00 0.00 ATOM 437 OE1 GLU 55 9.193 11.265 2.833 1.00 0.00 ATOM 438 OE2 GLU 55 10.048 13.192 2.213 1.00 0.00 ATOM 439 O GLU 55 10.456 7.294 -0.915 1.00 0.00 ATOM 440 C GLU 55 9.426 7.971 -0.917 1.00 0.00 ATOM 441 N ARG 56 8.209 7.440 -0.845 1.00 0.00 ATOM 442 CA ARG 56 7.991 5.997 -0.751 1.00 0.00 ATOM 443 CB ARG 56 6.508 5.691 -0.535 1.00 0.00 ATOM 444 CG ARG 56 5.979 6.111 0.826 1.00 0.00 ATOM 445 CD ARG 56 4.499 5.795 0.967 1.00 0.00 ATOM 446 NE ARG 56 3.679 6.607 0.071 1.00 0.00 ATOM 447 CZ ARG 56 2.354 6.540 0.007 1.00 0.00 ATOM 448 NH1 ARG 56 1.691 7.318 -0.839 1.00 0.00 ATOM 449 NH2 ARG 56 1.693 5.696 0.787 1.00 0.00 ATOM 450 O ARG 56 8.713 4.041 -1.953 1.00 0.00 ATOM 451 C ARG 56 8.426 5.241 -2.006 1.00 0.00 ATOM 452 N PHE 57 8.473 5.941 -3.133 1.00 0.00 ATOM 453 CA PHE 57 8.852 5.311 -4.385 1.00 0.00 ATOM 454 CB PHE 57 8.040 5.892 -5.544 1.00 0.00 ATOM 455 CG PHE 57 6.561 5.667 -5.420 1.00 0.00 ATOM 456 CD1 PHE 57 6.066 4.616 -4.668 1.00 0.00 ATOM 457 CD2 PHE 57 5.663 6.508 -6.056 1.00 0.00 ATOM 458 CE1 PHE 57 4.704 4.410 -4.555 1.00 0.00 ATOM 459 CE2 PHE 57 4.302 6.302 -5.942 1.00 0.00 ATOM 460 CZ PHE 57 3.821 5.259 -5.195 1.00 0.00 ATOM 461 O PHE 57 10.695 5.365 -5.912 1.00 0.00 ATOM 462 C PHE 57 10.319 5.490 -4.746 1.00 0.00 ATOM 463 N LYS 58 11.141 5.781 -3.742 1.00 0.00 ATOM 464 CA LYS 58 12.578 5.952 -3.941 1.00 0.00 ATOM 465 CB LYS 58 13.258 6.350 -2.629 1.00 0.00 ATOM 466 CG LYS 58 14.752 6.594 -2.755 1.00 0.00 ATOM 467 CD LYS 58 15.347 7.062 -1.437 1.00 0.00 ATOM 468 CE LYS 58 16.849 7.278 -1.554 1.00 0.00 ATOM 469 NZ LYS 58 17.448 7.722 -0.265 1.00 0.00 ATOM 470 O LYS 58 14.052 4.608 -5.283 1.00 0.00 ATOM 471 C LYS 58 13.162 4.628 -4.435 1.00 0.00 ATOM 472 N GLU 59 12.651 3.529 -3.889 1.00 0.00 ATOM 473 CA GLU 59 13.099 2.188 -4.255 1.00 0.00 ATOM 474 CB GLU 59 13.541 1.413 -3.013 1.00 0.00 ATOM 475 CG GLU 59 14.729 2.025 -2.289 1.00 0.00 ATOM 476 CD GLU 59 15.155 1.215 -1.080 1.00 0.00 ATOM 477 OE1 GLU 59 14.310 0.987 -0.188 1.00 0.00 ATOM 478 OE2 GLU 59 16.335 0.807 -1.025 1.00 0.00 ATOM 479 O GLU 59 10.797 1.592 -4.503 1.00 0.00 ATOM 480 C GLU 59 11.942 1.458 -4.925 1.00 0.00 ATOM 481 N ASP 61 12.217 0.672 -5.975 1.00 0.00 ATOM 482 CA ASP 61 11.089 -0.027 -6.597 1.00 0.00 ATOM 483 CB ASP 61 11.574 -0.913 -7.746 1.00 0.00 ATOM 484 CG ASP 61 11.985 -0.112 -8.966 1.00 0.00 ATOM 485 OD1 ASP 61 11.713 1.107 -8.995 1.00 0.00 ATOM 486 OD2 ASP 61 12.579 -0.703 -9.891 1.00 0.00 ATOM 487 O ASP 61 11.060 -1.580 -4.757 1.00 0.00 ATOM 488 C ASP 61 10.398 -0.904 -5.545 1.00 0.00 ATOM 489 N LEU 62 9.069 -0.877 -5.526 1.00 0.00 ATOM 490 CA LEU 62 8.302 -1.649 -4.553 1.00 0.00 ATOM 491 CB LEU 62 7.314 -0.744 -3.812 1.00 0.00 ATOM 492 CG LEU 62 7.920 0.418 -3.024 1.00 0.00 ATOM 493 CD1 LEU 62 6.828 1.281 -2.412 1.00 0.00 ATOM 494 CD2 LEU 62 8.803 -0.099 -1.897 1.00 0.00 ATOM 495 O LEU 62 6.933 -2.606 -6.277 1.00 0.00 ATOM 496 C LEU 62 7.495 -2.767 -5.196 1.00 0.00 ATOM 497 N TYR 63 7.446 -3.909 -4.526 1.00 0.00 ATOM 498 CA TYR 63 6.671 -5.040 -5.004 1.00 0.00 ATOM 499 CB TYR 63 7.529 -6.308 -5.024 1.00 0.00 ATOM 500 CG TYR 63 8.687 -6.248 -5.994 1.00 0.00 ATOM 501 CD1 TYR 63 9.936 -5.801 -5.582 1.00 0.00 ATOM 502 CD2 TYR 63 8.529 -6.638 -7.318 1.00 0.00 ATOM 503 CE1 TYR 63 11.001 -5.742 -6.462 1.00 0.00 ATOM 504 CE2 TYR 63 9.581 -6.587 -8.210 1.00 0.00 ATOM 505 CZ TYR 63 10.825 -6.134 -7.771 1.00 0.00 ATOM 506 OH TYR 63 11.884 -6.078 -8.648 1.00 0.00 ATOM 507 O TYR 63 5.722 -5.584 -2.871 1.00 0.00 ATOM 508 C TYR 63 5.527 -5.150 -4.008 1.00 0.00 ATOM 509 N GLY 64 4.341 -4.724 -4.428 1.00 0.00 ATOM 510 CA GLY 64 3.170 -4.733 -3.556 1.00 0.00 ATOM 511 O GLY 64 1.644 -5.700 -5.143 1.00 0.00 ATOM 512 C GLY 64 2.085 -5.709 -3.992 1.00 0.00 ATOM 513 N GLU 65 1.637 -6.536 -3.056 1.00 0.00 ATOM 514 CA GLU 65 0.622 -7.520 -3.370 1.00 0.00 ATOM 515 CB GLU 65 1.254 -8.901 -3.552 1.00 0.00 ATOM 516 CG GLU 65 2.237 -8.986 -4.709 1.00 0.00 ATOM 517 CD GLU 65 2.812 -10.377 -4.883 1.00 0.00 ATOM 518 OE1 GLU 65 2.461 -11.270 -4.084 1.00 0.00 ATOM 519 OE2 GLU 65 3.615 -10.575 -5.820 1.00 0.00 ATOM 520 O GLU 65 -0.158 -7.610 -1.107 1.00 0.00 ATOM 521 C GLU 65 -0.441 -7.666 -2.300 1.00 0.00 ATOM 522 N LEU 66 -1.675 -7.843 -2.751 1.00 0.00 ATOM 523 CA LEU 66 -2.795 -8.062 -1.859 1.00 0.00 ATOM 524 CB LEU 66 -4.116 -7.767 -2.574 1.00 0.00 ATOM 525 CG LEU 66 -4.322 -6.328 -3.047 1.00 0.00 ATOM 526 CD1 LEU 66 -5.625 -6.198 -3.822 1.00 0.00 ATOM 527 CD2 LEU 66 -4.376 -5.374 -1.863 1.00 0.00 ATOM 528 O LEU 66 -2.375 -10.375 -2.351 1.00 0.00 ATOM 529 C LEU 66 -2.660 -9.536 -1.487 1.00 0.00 ATOM 530 N LEU 67 -2.839 -9.850 -0.206 1.00 0.00 ATOM 531 CA LEU 67 -2.699 -11.221 0.275 1.00 0.00 ATOM 532 CB LEU 67 -1.799 -11.265 1.512 1.00 0.00 ATOM 533 CG LEU 67 -0.403 -10.659 1.358 1.00 0.00 ATOM 534 CD1 LEU 67 0.339 -10.675 2.685 1.00 0.00 ATOM 535 CD2 LEU 67 0.416 -11.444 0.347 1.00 0.00 ATOM 536 O LEU 67 -4.103 -13.059 0.977 1.00 0.00 ATOM 537 C LEU 67 -4.030 -11.862 0.667 1.00 0.00 ATOM 538 N THR 68 -8.669 -11.185 0.300 1.00 0.00 ATOM 539 CA THR 68 -9.787 -10.486 -0.306 1.00 0.00 ATOM 540 CB THR 68 -11.104 -11.263 -0.125 1.00 0.00 ATOM 541 CG2 THR 68 -11.033 -12.604 -0.840 1.00 0.00 ATOM 542 OG1 THR 68 -11.338 -11.493 1.269 1.00 0.00 ATOM 543 O THR 68 -9.585 -8.986 1.548 1.00 0.00 ATOM 544 C THR 68 -9.907 -9.125 0.370 1.00 0.00 ATOM 545 N ARG 69 -10.363 -8.129 -0.376 1.00 0.00 ATOM 546 CA ARG 69 -10.568 -6.799 0.179 1.00 0.00 ATOM 547 CB ARG 69 -10.677 -5.761 -0.941 1.00 0.00 ATOM 548 CG ARG 69 -9.381 -5.533 -1.701 1.00 0.00 ATOM 549 CD ARG 69 -9.510 -4.371 -2.674 1.00 0.00 ATOM 550 NE ARG 69 -10.352 -4.710 -3.820 1.00 0.00 ATOM 551 CZ ARG 69 -9.926 -5.367 -4.892 1.00 0.00 ATOM 552 NH1 ARG 69 -10.763 -5.630 -5.886 1.00 0.00 ATOM 553 NH2 ARG 69 -8.662 -5.762 -4.969 1.00 0.00 ATOM 554 O ARG 69 -12.832 -7.495 0.648 1.00 0.00 ATOM 555 C ARG 69 -11.863 -6.804 0.993 1.00 0.00 ATOM 556 N VAL 70 -11.873 -6.057 2.090 1.00 0.00 ATOM 557 CA VAL 70 -13.079 -5.942 2.906 1.00 0.00 ATOM 558 CB VAL 70 -12.757 -6.051 4.408 1.00 0.00 ATOM 559 CG1 VAL 70 -14.019 -5.872 5.238 1.00 0.00 ATOM 560 CG2 VAL 70 -12.162 -7.414 4.727 1.00 0.00 ATOM 561 O VAL 70 -12.917 -3.576 2.607 1.00 0.00 ATOM 562 C VAL 70 -13.640 -4.571 2.570 1.00 0.00 ATOM 563 N ILE 71 -14.920 -4.509 2.235 1.00 0.00 ATOM 564 CA ILE 71 -15.501 -3.224 1.898 1.00 0.00 ATOM 565 CB ILE 71 -15.448 -2.959 0.383 1.00 0.00 ATOM 566 CG1 ILE 71 -13.999 -2.960 -0.109 1.00 0.00 ATOM 567 CG2 ILE 71 -16.067 -1.609 0.055 1.00 0.00 ATOM 568 CD1 ILE 71 -13.864 -2.868 -1.613 1.00 0.00 ATOM 569 O ILE 71 -17.729 -4.061 2.113 1.00 0.00 ATOM 570 C ILE 71 -16.952 -3.125 2.313 1.00 0.00 ATOM 571 N VAL 72 -17.308 -1.985 2.902 1.00 0.00 ATOM 572 CA VAL 72 -18.677 -1.750 3.338 1.00 0.00 ATOM 573 CB VAL 72 -19.080 -2.709 4.474 1.00 0.00 ATOM 574 CG1 VAL 72 -18.253 -2.436 5.721 1.00 0.00 ATOM 575 CG2 VAL 72 -20.549 -2.535 4.822 1.00 0.00 ATOM 576 O VAL 72 -17.858 0.303 4.274 1.00 0.00 ATOM 577 C VAL 72 -18.827 -0.316 3.852 1.00 0.00 ATOM 578 N GLY 73 -20.039 0.220 3.781 1.00 0.00 ATOM 579 CA GLY 73 -20.326 1.571 4.277 1.00 0.00 ATOM 580 O GLY 73 -18.654 3.062 5.122 1.00 0.00 ATOM 581 C GLY 73 -19.214 2.609 4.132 1.00 0.00 ATOM 582 N ASN 74 -18.917 3.001 2.900 1.00 0.00 ATOM 583 CA ASN 74 -17.891 4.000 2.624 1.00 0.00 ATOM 584 CB ASN 74 -18.263 5.339 3.263 1.00 0.00 ATOM 585 CG ASN 74 -19.464 5.986 2.602 1.00 0.00 ATOM 586 ND2 ASN 74 -20.230 6.744 3.379 1.00 0.00 ATOM 587 OD1 ASN 74 -19.700 5.805 1.407 1.00 0.00 ATOM 588 O ASN 74 -15.620 4.496 3.150 1.00 0.00 ATOM 589 C ASN 74 -16.511 3.648 3.148 1.00 0.00 ATOM 590 N VAL 75 -16.315 2.408 3.583 1.00 0.00 ATOM 591 CA VAL 75 -15.002 2.028 4.101 1.00 0.00 ATOM 592 CB VAL 75 -15.032 1.838 5.629 1.00 0.00 ATOM 593 CG1 VAL 75 -13.679 1.359 6.132 1.00 0.00 ATOM 594 CG2 VAL 75 -15.366 3.150 6.323 1.00 0.00 ATOM 595 O VAL 75 -15.143 -0.160 3.120 1.00 0.00 ATOM 596 C VAL 75 -14.420 0.731 3.554 1.00 0.00 ATOM 597 N VAL 76 -13.093 0.639 3.578 1.00 0.00 ATOM 598 CA VAL 76 -12.401 -0.545 3.095 1.00 0.00 ATOM 599 CB VAL 76 -12.052 -0.423 1.600 1.00 0.00 ATOM 600 CG1 VAL 76 -11.073 0.718 1.373 1.00 0.00 ATOM 601 CG2 VAL 76 -11.416 -1.711 1.096 1.00 0.00 ATOM 602 O VAL 76 -10.465 0.182 4.313 1.00 0.00 ATOM 603 C VAL 76 -11.102 -0.769 3.853 1.00 0.00 ATOM 604 N ILE 77 -10.725 -2.037 3.998 1.00 0.00 ATOM 605 CA ILE 77 -9.476 -2.399 4.658 1.00 0.00 ATOM 606 CB ILE 77 -9.709 -2.803 6.126 1.00 0.00 ATOM 607 CG1 ILE 77 -10.312 -1.636 6.910 1.00 0.00 ATOM 608 CG2 ILE 77 -8.396 -3.200 6.785 1.00 0.00 ATOM 609 CD1 ILE 77 -10.739 -2.001 8.315 1.00 0.00 ATOM 610 O ILE 77 -9.661 -4.433 3.399 1.00 0.00 ATOM 611 C ILE 77 -8.909 -3.577 3.870 1.00 0.00 ATOM 612 N ASP 78 -7.590 -3.613 3.713 1.00 0.00 ATOM 613 CA ASP 78 -6.962 -4.698 2.970 1.00 0.00 ATOM 614 CB ASP 78 -6.650 -4.258 1.539 1.00 0.00 ATOM 615 CG ASP 78 -5.603 -3.162 1.482 1.00 0.00 ATOM 616 OD1 ASP 78 -5.921 -2.016 1.864 1.00 0.00 ATOM 617 OD2 ASP 78 -4.464 -3.449 1.055 1.00 0.00 ATOM 618 O ASP 78 -4.950 -4.406 4.242 1.00 0.00 ATOM 619 C ASP 78 -5.649 -5.173 3.585 1.00 0.00 ATOM 620 N HIS 79 -5.346 -6.453 3.365 1.00 0.00 ATOM 621 CA HIS 79 -4.124 -7.084 3.849 1.00 0.00 ATOM 622 CB HIS 79 -4.429 -8.466 4.432 1.00 0.00 ATOM 623 CG HIS 79 -5.329 -8.431 5.629 1.00 0.00 ATOM 624 CD2 HIS 79 -6.746 -8.662 5.869 1.00 0.00 ATOM 625 ND1 HIS 79 -4.874 -8.126 6.893 1.00 0.00 ATOM 626 CE1 HIS 79 -5.907 -8.175 7.753 1.00 0.00 ATOM 627 NE2 HIS 79 -7.032 -8.497 7.146 1.00 0.00 ATOM 628 O HIS 79 -3.608 -7.631 1.572 1.00 0.00 ATOM 629 C HIS 79 -3.195 -7.207 2.654 1.00 0.00 ATOM 630 N GLU 80 -1.933 -6.856 2.852 1.00 0.00 ATOM 631 CA GLU 80 -0.976 -6.903 1.759 1.00 0.00 ATOM 632 CB GLU 80 -1.166 -5.704 0.827 1.00 0.00 ATOM 633 CG GLU 80 -0.890 -4.360 1.483 1.00 0.00 ATOM 634 CD GLU 80 -1.156 -3.194 0.552 1.00 0.00 ATOM 635 OE1 GLU 80 -0.526 -3.137 -0.525 1.00 0.00 ATOM 636 OE2 GLU 80 -1.994 -2.334 0.900 1.00 0.00 ATOM 637 O GLU 80 0.681 -6.839 3.485 1.00 0.00 ATOM 638 C GLU 80 0.450 -6.875 2.279 1.00 0.00 ATOM 639 N THR 81 1.402 -6.913 1.356 1.00 0.00 ATOM 640 CA THR 81 2.805 -6.846 1.711 1.00 0.00 ATOM 641 CB THR 81 3.494 -8.212 1.547 1.00 0.00 ATOM 642 CG2 THR 81 2.798 -9.267 2.392 1.00 0.00 ATOM 643 OG1 THR 81 3.445 -8.614 0.172 1.00 0.00 ATOM 644 O THR 81 3.027 -5.522 -0.297 1.00 0.00 ATOM 645 C THR 81 3.502 -5.840 0.811 1.00 0.00 ATOM 646 N VAL 82 4.613 -5.317 1.318 1.00 0.00 ATOM 647 CA VAL 82 5.436 -4.345 0.622 1.00 0.00 ATOM 648 CB VAL 82 5.321 -2.948 1.260 1.00 0.00 ATOM 649 CG1 VAL 82 6.205 -1.952 0.524 1.00 0.00 ATOM 650 CG2 VAL 82 3.885 -2.453 1.200 1.00 0.00 ATOM 651 O VAL 82 7.491 -4.794 1.790 1.00 0.00 ATOM 652 C VAL 82 6.873 -4.850 0.722 1.00 0.00 ATOM 653 N THR 83 7.390 -5.360 -0.393 1.00 0.00 ATOM 654 CA THR 83 8.748 -5.895 -0.443 1.00 0.00 ATOM 655 CB THR 83 8.795 -7.249 -1.176 1.00 0.00 ATOM 656 CG2 THR 83 10.220 -7.782 -1.220 1.00 0.00 ATOM 657 OG1 THR 83 7.967 -8.196 -0.491 1.00 0.00 ATOM 658 O THR 83 9.306 -4.357 -2.205 1.00 0.00 ATOM 659 C THR 83 9.673 -4.935 -1.174 1.00 0.00 ATOM 660 N ARG 84 10.884 -4.787 -0.651 1.00 0.00 ATOM 661 CA ARG 84 11.855 -3.891 -1.249 1.00 0.00 ATOM 662 CB ARG 84 11.570 -2.444 -0.843 1.00 0.00 ATOM 663 CG ARG 84 11.711 -2.178 0.648 1.00 0.00 ATOM 664 CD ARG 84 11.417 -0.725 0.980 1.00 0.00 ATOM 665 NE ARG 84 11.476 -0.468 2.417 1.00 0.00 ATOM 666 CZ ARG 84 12.594 -0.205 3.083 1.00 0.00 ATOM 667 NH1 ARG 84 12.551 0.015 4.391 1.00 0.00 ATOM 668 NH2 ARG 84 13.753 -0.164 2.442 1.00 0.00 ATOM 669 O ARG 84 13.432 -5.131 0.092 1.00 0.00 ATOM 670 C ARG 84 13.257 -4.269 -0.779 1.00 0.00 ATOM 671 N ASN 85 14.253 -3.621 -1.370 1.00 0.00 ATOM 672 CA ASN 85 15.637 -3.880 -1.005 1.00 0.00 ATOM 673 CB ASN 85 16.342 -4.674 -2.106 1.00 0.00 ATOM 674 CG ASN 85 15.744 -6.054 -2.305 1.00 0.00 ATOM 675 ND2 ASN 85 15.084 -6.252 -3.440 1.00 0.00 ATOM 676 OD1 ASN 85 15.874 -6.927 -1.447 1.00 0.00 ATOM 677 O ASN 85 15.970 -1.506 -1.215 1.00 0.00 ATOM 678 C ASN 85 16.407 -2.582 -0.793 1.00 0.00 ATOM 679 N PHE 86 17.552 -2.692 -0.127 1.00 0.00 ATOM 680 CA PHE 86 18.401 -1.541 0.159 1.00 0.00 ATOM 681 CB PHE 86 17.661 -0.536 1.042 1.00 0.00 ATOM 682 CG PHE 86 17.238 -1.092 2.372 1.00 0.00 ATOM 683 CD1 PHE 86 18.069 -0.996 3.474 1.00 0.00 ATOM 684 CD2 PHE 86 16.010 -1.714 2.520 1.00 0.00 ATOM 685 CE1 PHE 86 17.680 -1.508 4.697 1.00 0.00 ATOM 686 CE2 PHE 86 15.621 -2.226 3.743 1.00 0.00 ATOM 687 CZ PHE 86 16.452 -2.126 4.829 1.00 0.00 ATOM 688 O PHE 86 19.574 -2.856 1.789 1.00 0.00 ATOM 689 C PHE 86 19.656 -2.024 0.884 1.00 0.00 ATOM 690 N PRO 87 20.810 -1.503 0.479 1.00 0.00 ATOM 691 CA PRO 87 22.086 -1.881 1.085 1.00 0.00 ATOM 692 CB PRO 87 22.005 -1.310 2.503 1.00 0.00 ATOM 693 CG PRO 87 21.041 -0.176 2.395 1.00 0.00 ATOM 694 CD PRO 87 19.995 -0.611 1.406 1.00 0.00 ATOM 695 O PRO 87 22.816 -3.953 2.051 1.00 0.00 ATOM 696 C PRO 87 22.259 -3.396 1.105 1.00 0.00 ATOM 697 N GLU 88 21.780 -4.057 0.056 1.00 0.00 ATOM 698 CA GLU 88 21.886 -5.502 -0.017 1.00 0.00 ATOM 699 CB GLU 88 23.355 -5.933 0.001 1.00 0.00 ATOM 700 CG GLU 88 24.147 -5.491 -1.219 1.00 0.00 ATOM 701 CD GLU 88 25.603 -5.905 -1.151 1.00 0.00 ATOM 702 OE1 GLU 88 25.991 -6.549 -0.153 1.00 0.00 ATOM 703 OE2 GLU 88 26.356 -5.587 -2.094 1.00 0.00 ATOM 704 O GLU 88 21.832 -6.570 2.124 1.00 0.00 ATOM 705 C GLU 88 21.189 -6.164 1.156 1.00 0.00 ATOM 706 N GLY 89 19.867 -6.271 1.067 1.00 0.00 ATOM 707 CA GLY 89 19.067 -6.873 2.124 1.00 0.00 ATOM 708 O GLY 89 17.080 -5.663 1.556 1.00 0.00 ATOM 709 C GLY 89 17.598 -6.763 1.723 1.00 0.00 ATOM 710 N LYS 90 16.934 -7.905 1.577 1.00 0.00 ATOM 711 CA LYS 90 15.530 -7.935 1.182 1.00 0.00 ATOM 712 CB LYS 90 15.205 -9.242 0.458 1.00 0.00 ATOM 713 CG LYS 90 13.770 -9.336 -0.037 1.00 0.00 ATOM 714 CD LYS 90 13.528 -10.639 -0.783 1.00 0.00 ATOM 715 CE LYS 90 12.090 -10.741 -1.263 1.00 0.00 ATOM 716 NZ LYS 90 11.850 -11.992 -2.036 1.00 0.00 ATOM 717 O LYS 90 14.749 -8.561 3.372 1.00 0.00 ATOM 718 C LYS 90 14.603 -7.825 2.393 1.00 0.00 ATOM 719 N GLY 91 13.638 -6.916 2.322 1.00 0.00 ATOM 720 CA GLY 91 12.715 -6.728 3.434 1.00 0.00 ATOM 721 O GLY 91 10.881 -6.215 1.961 1.00 0.00 ATOM 722 C GLY 91 11.248 -6.736 3.018 1.00 0.00 ATOM 723 N GLU 92 10.416 -7.337 3.863 1.00 0.00 ATOM 724 CA GLU 92 8.985 -7.405 3.616 1.00 0.00 ATOM 725 CB GLU 92 8.551 -8.851 3.379 1.00 0.00 ATOM 726 CG GLU 92 7.068 -9.015 3.086 1.00 0.00 ATOM 727 CD GLU 92 6.688 -10.452 2.788 1.00 0.00 ATOM 728 OE1 GLU 92 7.565 -11.334 2.898 1.00 0.00 ATOM 729 OE2 GLU 92 5.513 -10.696 2.443 1.00 0.00 ATOM 730 O GLU 92 8.330 -7.320 5.939 1.00 0.00 ATOM 731 C GLU 92 8.181 -6.864 4.798 1.00 0.00 ATOM 732 N VAL 93 7.344 -5.874 4.530 1.00 0.00 ATOM 733 CA VAL 93 6.484 -5.328 5.568 1.00 0.00 ATOM 734 CB VAL 93 6.579 -3.792 5.629 1.00 0.00 ATOM 735 CG1 VAL 93 5.635 -3.242 6.687 1.00 0.00 ATOM 736 CG2 VAL 93 7.997 -3.360 5.976 1.00 0.00 ATOM 737 O VAL 93 4.632 -5.612 4.061 1.00 0.00 ATOM 738 C VAL 93 5.057 -5.753 5.210 1.00 0.00 ATOM 739 N ASP 94 4.326 -6.281 6.188 1.00 0.00 ATOM 740 CA ASP 94 2.958 -6.730 5.953 1.00 0.00 ATOM 741 CB ASP 94 2.822 -8.220 6.268 1.00 0.00 ATOM 742 CG ASP 94 1.441 -8.758 5.954 1.00 0.00 ATOM 743 OD1 ASP 94 0.569 -7.960 5.548 1.00 0.00 ATOM 744 OD2 ASP 94 1.227 -9.979 6.114 1.00 0.00 ATOM 745 O ASP 94 1.714 -6.348 7.976 1.00 0.00 ATOM 746 C ASP 94 1.983 -5.962 6.835 1.00 0.00 ATOM 747 N VAL 95 1.443 -4.853 6.315 1.00 0.00 ATOM 748 CA VAL 95 0.502 -4.080 7.121 1.00 0.00 ATOM 749 CB VAL 95 0.756 -2.566 6.989 1.00 0.00 ATOM 750 CG1 VAL 95 2.154 -2.217 7.477 1.00 0.00 ATOM 751 CG2 VAL 95 0.630 -2.129 5.538 1.00 0.00 ATOM 752 O VAL 95 -1.254 -5.173 5.892 1.00 0.00 ATOM 753 C VAL 95 -0.951 -4.314 6.721 1.00 0.00 ATOM 754 N ALA 96 -1.842 -3.566 7.354 1.00 0.00 ATOM 755 CA ALA 96 -3.256 -3.606 7.035 1.00 0.00 ATOM 756 CB ALA 96 -4.034 -4.279 8.156 1.00 0.00 ATOM 757 O ALA 96 -3.466 -1.348 7.800 1.00 0.00 ATOM 758 C ALA 96 -3.646 -2.144 6.883 1.00 0.00 ATOM 759 N CYS 97 -4.144 -1.794 5.703 1.00 0.00 ATOM 760 CA CYS 97 -4.542 -0.424 5.410 1.00 0.00 ATOM 761 CB CYS 97 -4.136 -0.041 3.986 1.00 0.00 ATOM 762 SG CYS 97 -4.620 1.630 3.493 1.00 0.00 ATOM 763 O CYS 97 -6.821 -1.152 5.295 1.00 0.00 ATOM 764 C CYS 97 -6.042 -0.229 5.527 1.00 0.00 ATOM 765 N ILE 98 -6.432 0.985 5.890 1.00 0.00 ATOM 766 CA ILE 98 -7.834 1.334 6.008 1.00 0.00 ATOM 767 CB ILE 98 -8.202 1.709 7.456 1.00 0.00 ATOM 768 CG1 ILE 98 -7.948 0.528 8.394 1.00 0.00 ATOM 769 CG2 ILE 98 -9.670 2.094 7.550 1.00 0.00 ATOM 770 CD1 ILE 98 -8.065 0.878 9.862 1.00 0.00 ATOM 771 O ILE 98 -7.405 3.530 5.110 1.00 0.00 ATOM 772 C ILE 98 -8.132 2.534 5.101 1.00 0.00 ATOM 773 N TYR 99 -9.194 2.421 4.310 1.00 0.00 ATOM 774 CA TYR 99 -9.610 3.474 3.391 1.00 0.00 ATOM 775 CB TYR 99 -9.657 2.944 1.957 1.00 0.00 ATOM 776 CG TYR 99 -8.307 2.548 1.404 1.00 0.00 ATOM 777 CD1 TYR 99 -7.836 1.248 1.539 1.00 0.00 ATOM 778 CD2 TYR 99 -7.506 3.476 0.750 1.00 0.00 ATOM 779 CE1 TYR 99 -6.603 0.877 1.038 1.00 0.00 ATOM 780 CE2 TYR 99 -6.270 3.123 0.243 1.00 0.00 ATOM 781 CZ TYR 99 -5.822 1.812 0.392 1.00 0.00 ATOM 782 OH TYR 99 -4.593 1.445 -0.107 1.00 0.00 ATOM 783 O TYR 99 -11.910 3.195 3.971 1.00 0.00 ATOM 784 C TYR 99 -10.993 3.983 3.765 1.00 0.00 ATOM 785 N GLU 100 -11.127 5.303 3.836 1.00 0.00 ATOM 786 CA GLU 100 -12.392 5.968 4.127 1.00 0.00 ATOM 787 CB GLU 100 -12.268 6.824 5.389 1.00 0.00 ATOM 788 CG GLU 100 -13.560 7.509 5.804 1.00 0.00 ATOM 789 CD GLU 100 -13.400 8.347 7.057 1.00 0.00 ATOM 790 OE1 GLU 100 -12.263 8.451 7.560 1.00 0.00 ATOM 791 OE2 GLU 100 -14.413 8.899 7.535 1.00 0.00 ATOM 792 O GLU 100 -11.896 7.705 2.537 1.00 0.00 ATOM 793 C GLU 100 -12.684 6.840 2.891 1.00 0.00 ATOM 794 N VAL 101 -13.815 6.609 2.232 1.00 0.00 ATOM 795 CA VAL 101 -14.144 7.362 1.025 1.00 0.00 ATOM 796 CB VAL 101 -14.748 6.452 -0.060 1.00 0.00 ATOM 797 CG1 VAL 101 -13.721 5.433 -0.534 1.00 0.00 ATOM 798 CG2 VAL 101 -15.954 5.702 0.483 1.00 0.00 ATOM 799 O VAL 101 -15.934 8.420 2.225 1.00 0.00 ATOM 800 C VAL 101 -15.159 8.479 1.266 1.00 0.00 ATOM 801 N GLU 102 -18.205 11.208 -0.581 1.00 0.00 ATOM 802 CA GLU 102 -19.336 11.006 -1.468 1.00 0.00 ATOM 803 CB GLU 102 -20.303 12.188 -1.383 1.00 0.00 ATOM 804 CG GLU 102 -21.073 12.268 -0.076 1.00 0.00 ATOM 805 CD GLU 102 -21.950 13.502 0.011 1.00 0.00 ATOM 806 OE1 GLU 102 -21.901 14.332 -0.922 1.00 0.00 ATOM 807 OE2 GLU 102 -22.685 13.639 1.011 1.00 0.00 ATOM 808 O GLU 102 -19.686 10.131 -3.662 1.00 0.00 ATOM 809 C GLU 102 -18.998 10.856 -2.940 1.00 0.00 ATOM 810 N ASN 103 -17.944 11.538 -3.386 1.00 0.00 ATOM 811 CA ASN 103 -17.526 11.488 -4.784 1.00 0.00 ATOM 812 CB ASN 103 -16.751 12.753 -5.158 1.00 0.00 ATOM 813 CG ASN 103 -15.415 12.850 -4.447 1.00 0.00 ATOM 814 ND2 ASN 103 -14.627 13.856 -4.806 1.00 0.00 ATOM 815 OD1 ASN 103 -15.099 12.029 -3.586 1.00 0.00 ATOM 816 O ASN 103 -15.856 10.317 -6.058 1.00 0.00 ATOM 817 C ASN 103 -16.619 10.295 -5.092 1.00 0.00 ATOM 818 N GLY 104 -16.705 9.261 -4.260 1.00 0.00 ATOM 819 CA GLY 104 -15.908 8.062 -4.469 1.00 0.00 ATOM 820 O GLY 104 -13.675 7.223 -4.493 1.00 0.00 ATOM 821 C GLY 104 -14.415 8.173 -4.225 1.00 0.00 ATOM 822 N ARG 105 -13.957 9.313 -3.719 1.00 0.00 ATOM 823 CA ARG 105 -12.529 9.492 -3.458 1.00 0.00 ATOM 824 CB ARG 105 -12.119 10.947 -3.687 1.00 0.00 ATOM 825 CG ARG 105 -12.284 11.420 -5.124 1.00 0.00 ATOM 826 CD ARG 105 -11.756 12.833 -5.304 1.00 0.00 ATOM 827 NE ARG 105 -11.994 13.340 -6.654 1.00 0.00 ATOM 828 CZ ARG 105 -11.680 14.565 -7.058 1.00 0.00 ATOM 829 NH1 ARG 105 -11.934 14.938 -8.305 1.00 0.00 ATOM 830 NH2 ARG 105 -11.111 15.417 -6.216 1.00 0.00 ATOM 831 O ARG 105 -12.987 9.151 -1.119 1.00 0.00 ATOM 832 C ARG 105 -12.149 9.129 -2.021 1.00 0.00 ATOM 833 N ILE 106 -10.880 8.791 -1.814 1.00 0.00 ATOM 834 CA ILE 106 -10.406 8.441 -0.485 1.00 0.00 ATOM 835 CB ILE 106 -9.137 7.569 -0.550 1.00 0.00 ATOM 836 CG1 ILE 106 -9.409 6.291 -1.345 1.00 0.00 ATOM 837 CG2 ILE 106 -8.686 7.181 0.849 1.00 0.00 ATOM 838 CD1 ILE 106 -10.494 5.420 -0.749 1.00 0.00 ATOM 839 O ILE 106 -9.278 10.537 -0.200 1.00 0.00 ATOM 840 C ILE 106 -10.086 9.732 0.262 1.00 0.00 ATOM 841 N ALA 107 -10.724 9.927 1.413 1.00 0.00 ATOM 842 CA ALA 107 -10.477 11.116 2.218 1.00 0.00 ATOM 843 CB ALA 107 -11.784 11.656 2.779 1.00 0.00 ATOM 844 O ALA 107 -9.068 11.680 4.076 1.00 0.00 ATOM 845 C ALA 107 -9.550 10.788 3.381 1.00 0.00 ATOM 846 N LYS 108 -9.290 9.503 3.588 1.00 0.00 ATOM 847 CA LYS 108 -8.417 9.094 4.686 1.00 0.00 ATOM 848 CB LYS 108 -9.184 9.101 6.010 1.00 0.00 ATOM 849 CG LYS 108 -8.321 8.813 7.229 1.00 0.00 ATOM 850 CD LYS 108 -9.123 8.930 8.513 1.00 0.00 ATOM 851 CE LYS 108 -8.245 8.710 9.734 1.00 0.00 ATOM 852 NZ LYS 108 -9.019 8.816 11.002 1.00 0.00 ATOM 853 O LYS 108 -8.567 6.754 4.165 1.00 0.00 ATOM 854 C LYS 108 -7.846 7.691 4.512 1.00 0.00 ATOM 855 N ALA 109 -6.542 7.558 4.730 1.00 0.00 ATOM 856 CA ALA 109 -5.887 6.257 4.650 1.00 0.00 ATOM 857 CB ALA 109 -4.956 6.205 3.449 1.00 0.00 ATOM 858 O ALA 109 -4.631 7.087 6.519 1.00 0.00 ATOM 859 C ALA 109 -5.108 6.104 5.944 1.00 0.00 ATOM 860 N TRP 110 -5.009 4.873 6.421 1.00 0.00 ATOM 861 CA TRP 110 -4.277 4.579 7.640 1.00 0.00 ATOM 862 CB TRP 110 -5.225 4.551 8.841 1.00 0.00 ATOM 863 CG TRP 110 -4.530 4.331 10.149 1.00 0.00 ATOM 864 CD1 TRP 110 -3.243 4.666 10.461 1.00 0.00 ATOM 865 CD2 TRP 110 -5.084 3.726 11.324 1.00 0.00 ATOM 866 CE2 TRP 110 -4.075 3.728 12.309 1.00 0.00 ATOM 867 CE3 TRP 110 -6.333 3.184 11.641 1.00 0.00 ATOM 868 NE1 TRP 110 -2.960 4.307 11.757 1.00 0.00 ATOM 869 CZ2 TRP 110 -4.278 3.209 13.586 1.00 0.00 ATOM 870 CZ3 TRP 110 -6.529 2.670 12.910 1.00 0.00 ATOM 871 CH2 TRP 110 -5.510 2.684 13.868 1.00 0.00 ATOM 872 O TRP 110 -4.295 2.243 7.112 1.00 0.00 ATOM 873 C TRP 110 -3.626 3.221 7.460 1.00 0.00 ATOM 874 N PHE 111 -2.319 3.172 7.678 1.00 0.00 ATOM 875 CA PHE 111 -1.564 1.941 7.533 1.00 0.00 ATOM 876 CB PHE 111 -0.324 2.171 6.666 1.00 0.00 ATOM 877 CG PHE 111 -0.638 2.490 5.232 1.00 0.00 ATOM 878 CD1 PHE 111 -0.819 3.801 4.823 1.00 0.00 ATOM 879 CD2 PHE 111 -0.754 1.481 4.293 1.00 0.00 ATOM 880 CE1 PHE 111 -1.108 4.095 3.503 1.00 0.00 ATOM 881 CE2 PHE 111 -1.044 1.775 2.972 1.00 0.00 ATOM 882 CZ PHE 111 -1.220 3.075 2.578 1.00 0.00 ATOM 883 O PHE 111 -0.373 2.169 9.594 1.00 0.00 ATOM 884 C PHE 111 -1.143 1.486 8.916 1.00 0.00 ATOM 885 N LYS 112 -1.653 0.332 9.334 1.00 0.00 ATOM 886 CA LYS 112 -1.336 -0.202 10.651 1.00 0.00 ATOM 887 CB LYS 112 -2.597 -0.743 11.329 1.00 0.00 ATOM 888 CG LYS 112 -2.369 -1.270 12.735 1.00 0.00 ATOM 889 CD LYS 112 -3.660 -1.787 13.348 1.00 0.00 ATOM 890 CE LYS 112 -3.436 -2.293 14.763 1.00 0.00 ATOM 891 NZ LYS 112 -4.696 -2.795 15.378 1.00 0.00 ATOM 892 O LYS 112 -0.632 -2.426 10.040 1.00 0.00 ATOM 893 C LYS 112 -0.327 -1.341 10.542 1.00 0.00 ATOM 894 N ILE 113 0.889 -1.068 10.999 1.00 0.00 ATOM 895 CA ILE 113 1.970 -2.042 10.987 1.00 0.00 ATOM 896 CB ILE 113 2.665 -2.096 9.614 1.00 0.00 ATOM 897 CG1 ILE 113 3.627 -3.285 9.550 1.00 0.00 ATOM 898 CG2 ILE 113 3.458 -0.822 9.366 1.00 0.00 ATOM 899 CD1 ILE 113 4.093 -3.619 8.149 1.00 0.00 ATOM 900 O ILE 113 3.185 -0.451 12.292 1.00 0.00 ATOM 901 C ILE 113 2.984 -1.636 12.042 1.00 0.00 ATOM 902 N GLY 114 3.601 -2.629 12.674 1.00 0.00 ATOM 903 CA GLY 114 4.594 -2.366 13.701 1.00 0.00 ATOM 904 O GLY 114 6.033 -3.731 12.364 1.00 0.00 ATOM 905 C GLY 114 5.857 -3.162 13.445 1.00 0.00 ATOM 906 N GLU 115 6.733 -3.216 14.444 1.00 0.00 ATOM 907 CA GLU 115 7.999 -3.938 14.322 1.00 0.00 ATOM 908 CB GLU 115 8.823 -3.792 15.604 1.00 0.00 ATOM 909 CG GLU 115 9.395 -2.401 15.820 1.00 0.00 ATOM 910 CD GLU 115 10.125 -2.269 17.142 1.00 0.00 ATOM 911 OE1 GLU 115 10.124 -3.246 17.922 1.00 0.00 ATOM 912 OE2 GLU 115 10.698 -1.190 17.399 1.00 0.00 ATOM 913 O GLU 115 8.715 -6.076 13.510 1.00 0.00 ATOM 914 C GLU 115 7.835 -5.435 14.076 1.00 0.00 ATOM 915 N PRO 116 6.710 -5.992 14.502 1.00 0.00 ATOM 916 CA PRO 116 6.463 -7.406 14.302 1.00 0.00 ATOM 917 CB PRO 116 5.403 -7.749 15.351 1.00 0.00 ATOM 918 CG PRO 116 4.636 -6.482 15.535 1.00 0.00 ATOM 919 CD PRO 116 5.634 -5.367 15.395 1.00 0.00 ATOM 920 O PRO 116 5.823 -8.817 12.476 1.00 0.00 ATOM 921 C PRO 116 5.959 -7.671 12.891 1.00 0.00 ATOM 922 N ARG 117 5.683 -6.604 12.152 1.00 0.00 ATOM 923 CA ARG 117 5.182 -6.749 10.796 1.00 0.00 ATOM 924 CB ARG 117 4.023 -5.781 10.547 1.00 0.00 ATOM 925 CG ARG 117 2.816 -6.016 11.439 1.00 0.00 ATOM 926 CD ARG 117 2.085 -7.291 11.054 1.00 0.00 ATOM 927 NE ARG 117 0.836 -7.451 11.796 1.00 0.00 ATOM 928 CZ ARG 117 0.014 -8.488 11.660 1.00 0.00 ATOM 929 NH1 ARG 117 -1.100 -8.547 12.377 1.00 0.00 ATOM 930 NH2 ARG 117 0.309 -9.461 10.809 1.00 0.00 ATOM 931 O ARG 117 5.953 -6.346 8.573 1.00 0.00 ATOM 932 C ARG 117 6.247 -6.463 9.757 1.00 0.00 ATOM 933 N ILE 118 7.487 -6.354 10.221 1.00 0.00 ATOM 934 CA ILE 118 8.636 -6.103 9.356 1.00 0.00 ATOM 935 CB ILE 118 9.455 -4.893 9.842 1.00 0.00 ATOM 936 CG1 ILE 118 8.593 -3.629 9.838 1.00 0.00 ATOM 937 CG2 ILE 118 10.653 -4.662 8.934 1.00 0.00 ATOM 938 CD1 ILE 118 9.251 -2.439 10.499 1.00 0.00 ATOM 939 O ILE 118 9.964 -7.765 10.469 1.00 0.00 ATOM 940 C ILE 118 9.487 -7.371 9.406 1.00 0.00 ATOM 941 N VAL 119 9.655 -8.022 8.258 1.00 0.00 ATOM 942 CA VAL 119 10.433 -9.251 8.181 1.00 0.00 ATOM 943 CB VAL 119 9.600 -10.410 7.601 1.00 0.00 ATOM 944 CG1 VAL 119 10.440 -11.674 7.507 1.00 0.00 ATOM 945 CG2 VAL 119 8.398 -10.696 8.489 1.00 0.00 ATOM 946 O VAL 119 11.524 -8.963 6.062 1.00 0.00 ATOM 947 C VAL 119 11.653 -9.046 7.282 1.00 0.00 ATOM 948 N SER 120 12.835 -8.961 7.893 1.00 0.00 ATOM 949 CA SER 120 14.079 -8.739 7.156 1.00 0.00 ATOM 950 CB SER 120 15.116 -8.055 8.049 1.00 0.00 ATOM 951 OG SER 120 14.669 -6.776 8.462 1.00 0.00 ATOM 952 O SER 120 14.423 -11.113 7.170 1.00 0.00 ATOM 953 C SER 120 14.701 -10.034 6.651 1.00 0.00 TER END