PFRMAT TS TARGET T0267 AUTHOR 4204-4258-2837 METHOD The SAM-T04 human predictions for CASP6 use a very similar method to 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 7 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 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) for METHOD finding and aligning more remote 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. METHOD METHOD After the initial automatic run was finished, the results were METHOD examined by hand, and various tweaks were made to the undertaker METHOD cost function to improve the models. Many of the tweaks consisted of METHOD adding specific Hbonds, SSbonds, or distance constraints, to make the METHOD model look better to us. METHOD METHOD Undertaker uses a genetic algorithm with about 28 different operators METHOD to minimize its cost function. The cost function has many components, METHOD including various definitions of burial and compactness, sidechain METHOD rotamer preferences, steric clashes, chain breaks, predicted local METHOD backbone conformation, hydrogen bonding, disulfide bonds, and user METHOD specified constraints. The relative weights of these components were METHOD tweaked for each target, as we have not found a generally applicable METHOD set of weights. METHOD METHOD Because undertaker does not (yet) handle multimers, we sometimes added METHOD "scaffolding" constraints by hand to try to retain structure in METHOD dimerization interfaces. METHOD METHOD For multiple-domain models, we generally broke the sequence into METHOD chunks (often somewhat arbitrary overlapping chunks), and did the full METHOD method for each subchain. The alignments found were all tossed into METHOD the undertaker conformation search. In some cases, we performed METHOD undertaker runs for the subchains, and cut-and-pasted the pieces into METHOD one PDB file (with bad breaks) and let undertaker try to assemble the METHOD pieces. METHOD METHOD This model was created by alignment to the best template (1tiqA) with sidechains METHOD repacked by SCWRL. METHOD METHOD The alignment was created by a 3-track HMM: METHOD T0267-1tiqA-t2k-local-str2+CB_burial_14_7-0.4+0.4-adpstyle5 REMARK 6 REMARK 6 T0267 model 5 Tue Aug 10 12:03:00 2004 MODEL 5 PARENT 1tiq_A ATOM 1 N MET 1 11.311 -19.957 6.187 1.00 0.00 ATOM 2 CA MET 1 12.162 -18.784 5.838 1.00 0.00 ATOM 3 CB MET 1 13.276 -19.196 4.875 1.00 0.00 ATOM 4 CG MET 1 14.323 -20.111 5.491 1.00 0.00 ATOM 5 SD MET 1 15.580 -20.626 4.306 1.00 0.00 ATOM 6 CE MET 1 16.494 -19.101 4.095 1.00 0.00 ATOM 7 O MET 1 10.176 -17.927 4.800 1.00 0.00 ATOM 8 C MET 1 11.326 -17.694 5.169 1.00 0.00 ATOM 9 N VAL 2 11.905 -16.506 5.019 1.00 0.00 ATOM 10 CA VAL 2 11.213 -15.383 4.391 1.00 0.00 ATOM 11 CB VAL 2 11.550 -14.051 5.088 1.00 0.00 ATOM 12 CG1 VAL 2 10.861 -12.891 4.381 1.00 0.00 ATOM 13 CG2 VAL 2 11.084 -14.075 6.534 1.00 0.00 ATOM 14 O VAL 2 12.789 -15.295 2.582 1.00 0.00 ATOM 15 C VAL 2 11.607 -15.248 2.922 1.00 0.00 ATOM 16 N ARG 3 10.619 -15.093 2.050 1.00 0.00 ATOM 17 CA ARG 3 10.889 -14.930 0.628 1.00 0.00 ATOM 18 CB ARG 3 10.811 -16.279 -0.091 1.00 0.00 ATOM 19 CG ARG 3 11.824 -17.301 0.397 1.00 0.00 ATOM 20 CD ARG 3 13.235 -16.926 -0.026 1.00 0.00 ATOM 21 NE ARG 3 14.203 -17.964 0.318 1.00 0.00 ATOM 22 CZ ARG 3 14.828 -18.045 1.488 1.00 0.00 ATOM 23 NH1 ARG 3 15.694 -19.025 1.712 1.00 0.00 ATOM 24 NH2 ARG 3 14.585 -17.146 2.432 1.00 0.00 ATOM 25 O ARG 3 8.729 -13.907 0.461 1.00 0.00 ATOM 26 C ARG 3 9.870 -13.988 0.006 1.00 0.00 ATOM 27 N ILE 4 10.295 -13.267 -1.024 1.00 0.00 ATOM 28 CA ILE 4 9.408 -12.356 -1.726 1.00 0.00 ATOM 29 CB ILE 4 9.857 -10.893 -1.561 1.00 0.00 ATOM 30 CG1 ILE 4 9.797 -10.479 -0.090 1.00 0.00 ATOM 31 CG2 ILE 4 8.953 -9.965 -2.359 1.00 0.00 ATOM 32 CD1 ILE 4 10.459 -9.149 0.198 1.00 0.00 ATOM 33 O ILE 4 10.431 -13.178 -3.732 1.00 0.00 ATOM 34 C ILE 4 9.419 -12.710 -3.202 1.00 0.00 ATOM 35 N ARG 5 8.284 -12.490 -3.858 1.00 0.00 ATOM 36 CA ARG 5 8.140 -12.790 -5.278 1.00 0.00 ATOM 37 CB ARG 5 7.401 -14.116 -5.473 1.00 0.00 ATOM 38 CG ARG 5 8.130 -15.322 -4.900 1.00 0.00 ATOM 39 CD ARG 5 9.375 -15.650 -5.708 1.00 0.00 ATOM 40 NE ARG 5 10.029 -16.867 -5.234 1.00 0.00 ATOM 41 CZ ARG 5 10.931 -16.899 -4.258 1.00 0.00 ATOM 42 NH1 ARG 5 11.474 -18.052 -3.893 1.00 0.00 ATOM 43 NH2 ARG 5 11.287 -15.776 -3.649 1.00 0.00 ATOM 44 O ARG 5 6.359 -11.199 -5.460 1.00 0.00 ATOM 45 C ARG 5 7.353 -11.699 -5.990 1.00 0.00 ATOM 46 N ARG 6 7.793 -11.336 -7.191 1.00 0.00 ATOM 47 CA ARG 6 7.093 -10.320 -7.971 1.00 0.00 ATOM 48 CB ARG 6 7.970 -9.838 -9.129 1.00 0.00 ATOM 49 CG ARG 6 7.362 -8.701 -9.935 1.00 0.00 ATOM 50 CD ARG 6 8.266 -8.295 -11.087 1.00 0.00 ATOM 51 NE ARG 6 9.532 -7.737 -10.617 1.00 0.00 ATOM 52 CZ ARG 6 9.693 -6.475 -10.229 1.00 0.00 ATOM 53 NH1 ARG 6 10.882 -6.055 -9.816 1.00 0.00 ATOM 54 NH2 ARG 6 8.665 -5.638 -10.252 1.00 0.00 ATOM 55 O ARG 6 5.852 -12.063 -9.053 1.00 0.00 ATOM 56 C ARG 6 5.819 -10.955 -8.512 1.00 0.00 ATOM 57 N ALA 7 4.700 -10.253 -8.376 1.00 0.00 ATOM 58 CA ALA 7 3.416 -10.769 -8.839 1.00 0.00 ATOM 59 CB ALA 7 2.275 -9.940 -8.269 1.00 0.00 ATOM 60 O ALA 7 3.646 -9.801 -11.025 1.00 0.00 ATOM 61 C ALA 7 3.252 -10.752 -10.356 1.00 0.00 ATOM 62 N GLY 8 2.664 -11.816 -10.891 1.00 0.00 ATOM 63 CA GLY 8 2.426 -11.914 -12.327 1.00 0.00 ATOM 64 O GLY 8 0.124 -11.959 -11.653 1.00 0.00 ATOM 65 C GLY 8 0.934 -12.010 -12.582 1.00 0.00 ATOM 66 N LEU 9 0.578 -12.163 -13.851 1.00 0.00 ATOM 67 CA LEU 9 -0.814 -12.262 -14.246 1.00 0.00 ATOM 68 CB LEU 9 -0.929 -12.468 -15.757 1.00 0.00 ATOM 69 CG LEU 9 -0.543 -11.275 -16.635 1.00 0.00 ATOM 70 CD1 LEU 9 -0.528 -11.671 -18.103 1.00 0.00 ATOM 71 CD2 LEU 9 -1.534 -10.135 -16.459 1.00 0.00 ATOM 72 O LEU 9 -2.683 -13.345 -13.215 1.00 0.00 ATOM 73 C LEU 9 -1.510 -13.437 -13.559 1.00 0.00 ATOM 74 N GLU 10 -0.787 -14.533 -13.356 1.00 0.00 ATOM 75 CA GLU 10 -1.371 -15.704 -12.715 1.00 0.00 ATOM 76 CB GLU 10 -0.436 -16.907 -12.842 1.00 0.00 ATOM 77 CG GLU 10 -0.286 -17.429 -14.262 1.00 0.00 ATOM 78 CD GLU 10 0.730 -18.550 -14.366 1.00 0.00 ATOM 79 OE1 GLU 10 1.334 -18.902 -13.333 1.00 0.00 ATOM 80 OE2 GLU 10 0.921 -19.077 -15.484 1.00 0.00 ATOM 81 O GLU 10 -2.371 -16.307 -10.619 1.00 0.00 ATOM 82 C GLU 10 -1.646 -15.518 -11.225 1.00 0.00 ATOM 83 N ASP 11 -1.080 -14.469 -10.639 1.00 0.00 ATOM 84 CA ASP 11 -1.276 -14.187 -9.217 1.00 0.00 ATOM 85 CB ASP 11 -0.057 -13.466 -8.640 1.00 0.00 ATOM 86 CG ASP 11 1.201 -14.310 -8.698 1.00 0.00 ATOM 87 OD1 ASP 11 1.146 -15.488 -8.289 1.00 0.00 ATOM 88 OD2 ASP 11 2.243 -13.792 -9.156 1.00 0.00 ATOM 89 O ASP 11 -2.774 -12.938 -7.835 1.00 0.00 ATOM 90 C ASP 11 -2.493 -13.303 -8.971 1.00 0.00 ATOM 91 N LEU 12 -3.209 -12.966 -10.040 1.00 0.00 ATOM 92 CA LEU 12 -4.381 -12.098 -9.951 1.00 0.00 ATOM 93 CB LEU 12 -5.139 -12.085 -11.280 1.00 0.00 ATOM 94 CG LEU 12 -4.460 -11.355 -12.441 1.00 0.00 ATOM 95 CD1 LEU 12 -5.225 -11.580 -13.738 1.00 0.00 ATOM 96 CD2 LEU 12 -4.404 -9.859 -12.176 1.00 0.00 ATOM 97 O LEU 12 -5.794 -11.675 -8.064 1.00 0.00 ATOM 98 C LEU 12 -5.397 -12.497 -8.888 1.00 0.00 ATOM 99 N PRO 13 -5.829 -13.755 -8.912 1.00 0.00 ATOM 100 CA PRO 13 -6.817 -14.224 -7.948 1.00 0.00 ATOM 101 CB PRO 13 -7.079 -15.672 -8.362 1.00 0.00 ATOM 102 CG PRO 13 -6.800 -15.699 -9.828 1.00 0.00 ATOM 103 CD PRO 13 -5.617 -14.797 -10.041 1.00 0.00 ATOM 104 O PRO 13 -7.050 -13.735 -5.609 1.00 0.00 ATOM 105 C PRO 13 -6.319 -14.158 -6.507 1.00 0.00 ATOM 106 N GLY 14 -5.083 -14.588 -6.285 1.00 0.00 ATOM 107 CA GLY 14 -4.503 -14.563 -4.946 1.00 0.00 ATOM 108 O GLY 14 -4.681 -12.790 -3.343 1.00 0.00 ATOM 109 C GLY 14 -4.348 -13.119 -4.479 1.00 0.00 ATOM 110 N VAL 15 -3.844 -12.259 -5.361 1.00 0.00 ATOM 111 CA VAL 15 -3.665 -10.848 -5.022 1.00 0.00 ATOM 112 CB VAL 15 -3.096 -10.049 -6.210 1.00 0.00 ATOM 113 CG1 VAL 15 -3.107 -8.559 -5.903 1.00 0.00 ATOM 114 CG2 VAL 15 -1.664 -10.471 -6.497 1.00 0.00 ATOM 115 O VAL 15 -5.092 -9.484 -3.661 1.00 0.00 ATOM 116 C VAL 15 -5.005 -10.229 -4.632 1.00 0.00 ATOM 117 N ALA 16 -6.050 -10.545 -5.394 1.00 0.00 ATOM 118 CA ALA 16 -7.382 -10.008 -5.125 1.00 0.00 ATOM 119 CB ALA 16 -8.380 -10.528 -6.149 1.00 0.00 ATOM 120 O ALA 16 -8.428 -9.554 -3.013 1.00 0.00 ATOM 121 C ALA 16 -7.899 -10.394 -3.747 1.00 0.00 ATOM 122 N ARG 17 -7.751 -11.663 -3.387 1.00 0.00 ATOM 123 CA ARG 17 -8.233 -12.119 -2.090 1.00 0.00 ATOM 124 CB ARG 17 -8.114 -13.640 -1.980 1.00 0.00 ATOM 125 CG ARG 17 -9.101 -14.405 -2.847 1.00 0.00 ATOM 126 CD ARG 17 -8.878 -15.905 -2.750 1.00 0.00 ATOM 127 NE ARG 17 -9.817 -16.654 -3.581 1.00 0.00 ATOM 128 CZ ARG 17 -9.788 -17.973 -3.738 1.00 0.00 ATOM 129 NH1 ARG 17 -10.683 -18.568 -4.515 1.00 0.00 ATOM 130 NH2 ARG 17 -8.863 -18.694 -3.119 1.00 0.00 ATOM 131 O ARG 17 -7.999 -11.071 0.059 1.00 0.00 ATOM 132 C ARG 17 -7.434 -11.505 -0.948 1.00 0.00 ATOM 133 N VAL 18 -6.117 -11.464 -1.105 1.00 0.00 ATOM 134 CA VAL 18 -5.255 -10.897 -0.072 1.00 0.00 ATOM 135 CB VAL 18 -3.765 -11.079 -0.418 1.00 0.00 ATOM 136 CG1 VAL 18 -2.893 -10.320 0.569 1.00 0.00 ATOM 137 CG2 VAL 18 -3.382 -12.550 -0.368 1.00 0.00 ATOM 138 O VAL 18 -5.559 -8.868 1.185 1.00 0.00 ATOM 139 C VAL 18 -5.536 -9.399 0.074 1.00 0.00 ATOM 140 N LEU 19 -5.759 -8.721 -1.052 1.00 0.00 ATOM 141 CA LEU 19 -6.050 -7.282 -1.034 1.00 0.00 ATOM 142 CB LEU 19 -6.214 -6.751 -2.459 1.00 0.00 ATOM 143 CG LEU 19 -6.539 -5.261 -2.594 1.00 0.00 ATOM 144 CD1 LEU 19 -5.419 -4.412 -2.013 1.00 0.00 ATOM 145 CD2 LEU 19 -6.715 -4.880 -4.056 1.00 0.00 ATOM 146 O LEU 19 -7.392 -6.083 0.569 1.00 0.00 ATOM 147 C LEU 19 -7.342 -6.987 -0.267 1.00 0.00 ATOM 148 N VAL 20 -8.382 -7.764 -0.551 1.00 0.00 ATOM 149 CA VAL 20 -9.673 -7.586 0.104 1.00 0.00 ATOM 150 CB VAL 20 -10.723 -8.569 -0.443 1.00 0.00 ATOM 151 CG1 VAL 20 -11.998 -8.503 0.387 1.00 0.00 ATOM 152 CG2 VAL 20 -11.071 -8.232 -1.884 1.00 0.00 ATOM 153 O VAL 20 -10.062 -6.978 2.395 1.00 0.00 ATOM 154 C VAL 20 -9.599 -7.811 1.616 1.00 0.00 ATOM 155 N ASP 21 -9.013 -8.933 2.024 1.00 0.00 ATOM 156 CA ASP 21 -8.898 -9.274 3.440 1.00 0.00 ATOM 157 CB ASP 21 -8.174 -10.611 3.612 1.00 0.00 ATOM 158 CG ASP 21 -9.026 -11.793 3.198 1.00 0.00 ATOM 159 OD1 ASP 21 -10.246 -11.607 3.007 1.00 0.00 ATOM 160 OD2 ASP 21 -8.474 -12.905 3.065 1.00 0.00 ATOM 161 O ASP 21 -8.596 -7.757 5.275 1.00 0.00 ATOM 162 C ASP 21 -8.122 -8.237 4.245 1.00 0.00 ATOM 163 N THR 22 -6.926 -7.895 3.780 1.00 0.00 ATOM 164 CA THR 22 -6.104 -6.932 4.504 1.00 0.00 ATOM 165 CB THR 22 -4.701 -6.808 3.883 1.00 0.00 ATOM 166 CG2 THR 22 -3.981 -8.147 3.919 1.00 0.00 ATOM 167 OG1 THR 22 -4.814 -6.380 2.521 1.00 0.00 ATOM 168 O THR 22 -6.611 -4.825 5.529 1.00 0.00 ATOM 169 C THR 22 -6.697 -5.527 4.517 1.00 0.00 ATOM 170 N TRP 23 -7.314 -5.115 3.414 1.00 0.00 ATOM 171 CA TRP 23 -7.912 -3.784 3.367 1.00 0.00 ATOM 172 CB TRP 23 -8.350 -3.444 1.941 1.00 0.00 ATOM 173 CG TRP 23 -8.972 -2.087 1.812 1.00 0.00 ATOM 174 CD1 TRP 23 -8.319 -0.902 1.634 1.00 0.00 ATOM 175 CD2 TRP 23 -10.370 -1.777 1.850 1.00 0.00 ATOM 176 CE2 TRP 23 -10.491 -0.381 1.690 1.00 0.00 ATOM 177 CE3 TRP 23 -11.531 -2.539 2.006 1.00 0.00 ATOM 178 NE1 TRP 23 -9.223 0.130 1.559 1.00 0.00 ATOM 179 CZ2 TRP 23 -11.725 0.264 1.679 1.00 0.00 ATOM 180 CZ3 TRP 23 -12.753 -1.895 1.994 1.00 0.00 ATOM 181 CH2 TRP 23 -12.844 -0.508 1.834 1.00 0.00 ATOM 182 O TRP 23 -9.309 -2.752 5.025 1.00 0.00 ATOM 183 C TRP 23 -9.134 -3.714 4.275 1.00 0.00 ATOM 184 N ARG 24 -9.986 -4.732 4.198 1.00 0.00 ATOM 185 CA ARG 24 -11.180 -4.765 5.030 1.00 0.00 ATOM 186 CB ARG 24 -11.946 -6.071 4.818 1.00 0.00 ATOM 187 CG ARG 24 -13.245 -6.164 5.601 1.00 0.00 ATOM 188 CD ARG 24 -13.907 -7.520 5.417 1.00 0.00 ATOM 189 NE ARG 24 -13.110 -8.600 5.997 1.00 0.00 ATOM 190 CZ ARG 24 -13.060 -8.877 7.296 1.00 0.00 ATOM 191 NH1 ARG 24 -12.309 -9.877 7.732 1.00 0.00 ATOM 192 NH2 ARG 24 -13.762 -8.151 8.155 1.00 0.00 ATOM 193 O ARG 24 -11.329 -3.853 7.254 1.00 0.00 ATOM 194 C ARG 24 -10.784 -4.658 6.500 1.00 0.00 ATOM 195 N ALA 25 -9.819 -5.475 6.897 1.00 0.00 ATOM 196 CA ALA 25 -9.364 -5.489 8.276 1.00 0.00 ATOM 197 CB ALA 25 -8.395 -6.640 8.503 1.00 0.00 ATOM 198 O ALA 25 -8.229 -4.083 9.854 1.00 0.00 ATOM 199 C ALA 25 -8.638 -4.213 8.702 1.00 0.00 ATOM 200 N THR 26 -8.489 -3.264 7.783 1.00 0.00 ATOM 201 CA THR 26 -7.803 -2.018 8.101 1.00 0.00 ATOM 202 CB THR 26 -6.746 -1.670 7.036 1.00 0.00 ATOM 203 CG2 THR 26 -6.000 -0.402 7.421 1.00 0.00 ATOM 204 OG1 THR 26 -5.805 -2.745 6.921 1.00 0.00 ATOM 205 O THR 26 -8.473 0.110 8.975 1.00 0.00 ATOM 206 C THR 26 -8.732 -0.799 8.192 1.00 0.00 ATOM 207 N TYR 27 -9.801 -0.781 7.398 1.00 0.00 ATOM 208 CA TYR 27 -10.739 0.341 7.403 1.00 0.00 ATOM 209 CB TYR 27 -10.810 0.985 6.017 1.00 0.00 ATOM 210 CG TYR 27 -9.494 1.555 5.538 1.00 0.00 ATOM 211 CD1 TYR 27 -8.719 0.871 4.612 1.00 0.00 ATOM 212 CD2 TYR 27 -9.034 2.775 6.013 1.00 0.00 ATOM 213 CE1 TYR 27 -7.514 1.384 4.168 1.00 0.00 ATOM 214 CE2 TYR 27 -7.832 3.305 5.580 1.00 0.00 ATOM 215 CZ TYR 27 -7.072 2.598 4.650 1.00 0.00 ATOM 216 OH TYR 27 -5.873 3.110 4.209 1.00 0.00 ATOM 217 O TYR 27 -13.092 0.741 7.682 1.00 0.00 ATOM 218 C TYR 27 -12.164 -0.066 7.782 1.00 0.00 ATOM 219 N ARG 28 -12.323 -1.315 8.211 1.00 0.00 ATOM 220 CA ARG 28 -13.621 -1.883 8.589 1.00 0.00 ATOM 221 CB ARG 28 -13.461 -3.340 9.027 1.00 0.00 ATOM 222 CG ARG 28 -14.767 -4.023 9.401 1.00 0.00 ATOM 223 CD ARG 28 -14.552 -5.494 9.713 1.00 0.00 ATOM 224 NE ARG 28 -15.791 -6.156 10.115 1.00 0.00 ATOM 225 CZ ARG 28 -15.870 -7.429 10.489 1.00 0.00 ATOM 226 NH1 ARG 28 -17.040 -7.945 10.838 1.00 0.00 ATOM 227 NH2 ARG 28 -14.780 -8.183 10.514 1.00 0.00 ATOM 228 O ARG 28 -15.540 -0.995 9.717 1.00 0.00 ATOM 229 C ARG 28 -14.322 -1.174 9.736 1.00 0.00 ATOM 230 N GLY 29 -13.545 -0.783 10.737 1.00 0.00 ATOM 231 CA GLY 29 -14.093 -0.136 11.919 1.00 0.00 ATOM 232 O GLY 29 -15.553 1.710 12.365 1.00 0.00 ATOM 233 C GLY 29 -14.594 1.289 11.713 1.00 0.00 ATOM 234 N VAL 30 -13.959 2.034 10.814 1.00 0.00 ATOM 235 CA VAL 30 -14.346 3.423 10.578 1.00 0.00 ATOM 236 CB VAL 30 -13.113 4.336 10.435 1.00 0.00 ATOM 237 CG1 VAL 30 -12.305 4.344 11.723 1.00 0.00 ATOM 238 CG2 VAL 30 -12.217 3.848 9.307 1.00 0.00 ATOM 239 O VAL 30 -15.249 4.774 8.824 1.00 0.00 ATOM 240 C VAL 30 -15.173 3.651 9.315 1.00 0.00 ATOM 241 N VAL 31 -15.809 2.603 8.800 1.00 0.00 ATOM 242 CA VAL 31 -16.609 2.735 7.587 1.00 0.00 ATOM 243 CB VAL 31 -15.809 2.329 6.335 1.00 0.00 ATOM 244 CG1 VAL 31 -16.690 2.382 5.097 1.00 0.00 ATOM 245 CG2 VAL 31 -14.632 3.270 6.129 1.00 0.00 ATOM 246 O VAL 31 -17.885 0.825 8.252 1.00 0.00 ATOM 247 C VAL 31 -17.860 1.867 7.603 1.00 0.00 ATOM 248 N PRO 32 -18.896 2.290 6.885 1.00 0.00 ATOM 249 CA PRO 32 -20.128 1.504 6.853 1.00 0.00 ATOM 250 CB PRO 32 -21.170 2.473 6.287 1.00 0.00 ATOM 251 CG PRO 32 -20.532 3.816 6.402 1.00 0.00 ATOM 252 CD PRO 32 -19.051 3.587 6.292 1.00 0.00 ATOM 253 O PRO 32 -19.189 0.326 4.987 1.00 0.00 ATOM 254 C PRO 32 -19.939 0.282 5.959 1.00 0.00 ATOM 255 N GLU 33 -20.606 -0.833 6.292 1.00 0.00 ATOM 256 CA GLU 33 -20.497 -2.060 5.496 1.00 0.00 ATOM 257 CB GLU 33 -21.445 -3.133 6.034 1.00 0.00 ATOM 258 CG GLU 33 -21.025 -3.715 7.375 1.00 0.00 ATOM 259 CD GLU 33 -22.034 -4.706 7.922 1.00 0.00 ATOM 260 OE1 GLU 33 -23.094 -4.886 7.287 1.00 0.00 ATOM 261 OE2 GLU 33 -21.765 -5.303 8.986 1.00 0.00 ATOM 262 O GLU 33 -20.291 -2.403 3.128 1.00 0.00 ATOM 263 C GLU 33 -20.856 -1.798 4.039 1.00 0.00 ATOM 264 N ALA 34 -21.809 -0.893 3.833 1.00 0.00 ATOM 265 CA ALA 34 -22.269 -0.535 2.497 1.00 0.00 ATOM 266 CB ALA 34 -23.462 0.404 2.582 1.00 0.00 ATOM 267 O ALA 34 -20.977 -0.105 0.504 1.00 0.00 ATOM 268 C ALA 34 -21.173 0.168 1.699 1.00 0.00 ATOM 269 N PHE 35 -20.476 1.090 2.354 1.00 0.00 ATOM 270 CA PHE 35 -19.388 1.817 1.700 1.00 0.00 ATOM 271 CB PHE 35 -18.914 2.977 2.579 1.00 0.00 ATOM 272 CG PHE 35 -19.831 4.166 2.560 1.00 0.00 ATOM 273 CD1 PHE 35 -20.718 4.391 3.598 1.00 0.00 ATOM 274 CD2 PHE 35 -19.808 5.060 1.504 1.00 0.00 ATOM 275 CE1 PHE 35 -21.562 5.485 3.581 1.00 0.00 ATOM 276 CE2 PHE 35 -20.651 6.154 1.487 1.00 0.00 ATOM 277 CZ PHE 35 -21.526 6.369 2.519 1.00 0.00 ATOM 278 O PHE 35 -17.555 0.940 0.415 1.00 0.00 ATOM 279 C PHE 35 -18.212 0.865 1.455 1.00 0.00 ATOM 280 N LEU 36 -17.950 -0.027 2.407 1.00 0.00 ATOM 281 CA LEU 36 -16.851 -0.981 2.255 1.00 0.00 ATOM 282 CB LEU 36 -16.680 -1.807 3.531 1.00 0.00 ATOM 283 CG LEU 36 -16.160 -1.058 4.759 1.00 0.00 ATOM 284 CD1 LEU 36 -16.208 -1.949 5.992 1.00 0.00 ATOM 285 CD2 LEU 36 -14.721 -0.614 4.549 1.00 0.00 ATOM 286 O LEU 36 -16.205 -2.229 0.308 1.00 0.00 ATOM 287 C LEU 36 -17.104 -1.946 1.100 1.00 0.00 ATOM 288 N GLU 37 -18.330 -2.451 1.002 1.00 0.00 ATOM 289 CA GLU 37 -18.680 -3.383 -0.064 1.00 0.00 ATOM 290 CB GLU 37 -20.143 -3.814 0.059 1.00 0.00 ATOM 291 CG GLU 37 -20.583 -4.824 -0.989 1.00 0.00 ATOM 292 CD GLU 37 -22.026 -5.252 -0.815 1.00 0.00 ATOM 293 OE1 GLU 37 -22.679 -4.769 0.135 1.00 0.00 ATOM 294 OE2 GLU 37 -22.505 -6.071 -1.627 1.00 0.00 ATOM 295 O GLU 37 -17.899 -3.327 -2.339 1.00 0.00 ATOM 296 C GLU 37 -18.483 -2.731 -1.429 1.00 0.00 ATOM 297 N GLY 38 -18.965 -1.499 -1.565 1.00 0.00 ATOM 298 CA GLY 38 -18.846 -0.769 -2.825 1.00 0.00 ATOM 299 O GLY 38 -17.008 -0.721 -4.373 1.00 0.00 ATOM 300 C GLY 38 -17.389 -0.523 -3.218 1.00 0.00 ATOM 301 N LEU 39 -16.574 -0.091 -2.263 1.00 0.00 ATOM 302 CA LEU 39 -15.170 0.177 -2.547 1.00 0.00 ATOM 303 CB LEU 39 -14.485 0.799 -1.329 1.00 0.00 ATOM 304 CG LEU 39 -14.906 2.226 -0.969 1.00 0.00 ATOM 305 CD1 LEU 39 -14.297 2.649 0.359 1.00 0.00 ATOM 306 CD2 LEU 39 -14.446 3.206 -2.037 1.00 0.00 ATOM 307 O LEU 39 -13.629 -1.114 -3.870 1.00 0.00 ATOM 308 C LEU 39 -14.399 -1.094 -2.909 1.00 0.00 ATOM 309 N SER 40 -14.600 -2.145 -2.120 1.00 0.00 ATOM 310 CA SER 40 -13.939 -3.420 -2.366 1.00 0.00 ATOM 311 CB SER 40 -14.443 -4.482 -1.387 1.00 0.00 ATOM 312 OG SER 40 -14.077 -4.165 -0.056 1.00 0.00 ATOM 313 O SER 40 -13.320 -4.426 -4.466 1.00 0.00 ATOM 314 C SER 40 -14.213 -3.908 -3.788 1.00 0.00 ATOM 315 N TYR 41 -15.450 -3.729 -4.245 1.00 0.00 ATOM 316 CA TYR 41 -15.824 -4.154 -5.588 1.00 0.00 ATOM 317 CB TYR 41 -17.345 -4.125 -5.757 1.00 0.00 ATOM 318 CG TYR 41 -17.822 -4.619 -7.103 1.00 0.00 ATOM 319 CD1 TYR 41 -17.823 -5.976 -7.403 1.00 0.00 ATOM 320 CD2 TYR 41 -18.270 -3.729 -8.070 1.00 0.00 ATOM 321 CE1 TYR 41 -18.257 -6.438 -8.631 1.00 0.00 ATOM 322 CE2 TYR 41 -18.709 -4.173 -9.302 1.00 0.00 ATOM 323 CZ TYR 41 -18.697 -5.539 -9.578 1.00 0.00 ATOM 324 OH TYR 41 -19.132 -5.995 -10.802 1.00 0.00 ATOM 325 O TYR 41 -14.943 -3.734 -7.784 1.00 0.00 ATOM 326 C TYR 41 -15.233 -3.263 -6.684 1.00 0.00 ATOM 327 N GLU 42 -15.035 -1.984 -6.387 1.00 0.00 ATOM 328 CA GLU 42 -14.489 -1.072 -7.388 1.00 0.00 ATOM 329 CB GLU 42 -14.998 0.351 -7.150 1.00 0.00 ATOM 330 CG GLU 42 -16.504 0.503 -7.289 1.00 0.00 ATOM 331 CD GLU 42 -16.994 1.871 -6.857 1.00 0.00 ATOM 332 OE1 GLU 42 -16.162 2.683 -6.402 1.00 0.00 ATOM 333 OE2 GLU 42 -18.211 2.128 -6.971 1.00 0.00 ATOM 334 O GLU 42 -12.340 -0.645 -8.375 1.00 0.00 ATOM 335 C GLU 42 -12.962 -1.008 -7.376 1.00 0.00 ATOM 336 N GLY 43 -10.875 -3.738 -6.014 1.00 0.00 ATOM 337 CA GLY 43 -10.250 -5.043 -6.161 1.00 0.00 ATOM 338 O GLY 43 -10.707 -7.239 -7.008 1.00 0.00 ATOM 339 C GLY 43 -10.943 -6.032 -7.092 1.00 0.00 ATOM 340 N GLN 44 -11.796 -5.534 -7.982 1.00 0.00 ATOM 341 CA GLN 44 -12.452 -6.433 -8.907 1.00 0.00 ATOM 342 CB GLN 44 -13.548 -5.700 -9.681 1.00 0.00 ATOM 343 CG GLN 44 -13.029 -4.637 -10.636 1.00 0.00 ATOM 344 CD GLN 44 -14.139 -3.782 -11.216 1.00 0.00 ATOM 345 OE1 GLN 44 -15.312 -3.960 -10.884 1.00 0.00 ATOM 346 NE2 GLN 44 -13.772 -2.848 -12.084 1.00 0.00 ATOM 347 O GLN 44 -10.315 -6.300 -10.019 1.00 0.00 ATOM 348 C GLN 44 -11.365 -6.935 -9.859 1.00 0.00 ATOM 349 N ALA 45 -11.615 -8.089 -10.460 1.00 0.00 ATOM 350 CA ALA 45 -10.683 -8.735 -11.379 1.00 0.00 ATOM 351 CB ALA 45 -11.376 -9.863 -12.129 1.00 0.00 ATOM 352 O ALA 45 -8.882 -7.838 -12.684 1.00 0.00 ATOM 353 C ALA 45 -10.089 -7.825 -12.446 1.00 0.00 ATOM 354 N GLU 46 -10.946 -7.036 -13.082 1.00 0.00 ATOM 355 CA GLU 46 -10.523 -6.148 -14.149 1.00 0.00 ATOM 356 CB GLU 46 -11.736 -5.483 -14.804 1.00 0.00 ATOM 357 CG GLU 46 -12.596 -6.430 -15.623 1.00 0.00 ATOM 358 CD GLU 46 -13.852 -5.765 -16.153 1.00 0.00 ATOM 359 OE1 GLU 46 -14.082 -4.583 -15.823 1.00 0.00 ATOM 360 OE2 GLU 46 -14.603 -6.426 -16.901 1.00 0.00 ATOM 361 O GLU 46 -8.614 -4.712 -14.350 1.00 0.00 ATOM 362 C GLU 46 -9.604 -5.024 -13.687 1.00 0.00 ATOM 363 N ARG 47 -9.930 -4.414 -12.557 1.00 0.00 ATOM 364 CA ARG 47 -9.119 -3.322 -12.035 1.00 0.00 ATOM 365 CB ARG 47 -9.749 -2.745 -10.766 1.00 0.00 ATOM 366 CG ARG 47 -8.961 -1.604 -10.145 1.00 0.00 ATOM 367 CD ARG 47 -8.886 -0.409 -11.082 1.00 0.00 ATOM 368 NE ARG 47 -8.228 0.736 -10.456 1.00 0.00 ATOM 369 CZ ARG 47 -7.848 1.828 -11.112 1.00 0.00 ATOM 370 NH1 ARG 47 -7.257 2.821 -10.461 1.00 0.00 ATOM 371 NH2 ARG 47 -8.063 1.927 -12.417 1.00 0.00 ATOM 372 O ARG 47 -6.719 -3.264 -12.159 1.00 0.00 ATOM 373 C ARG 47 -7.713 -3.827 -11.697 1.00 0.00 ATOM 374 N TRP 48 -7.628 -4.894 -10.911 1.00 0.00 ATOM 375 CA TRP 48 -6.326 -5.438 -10.529 1.00 0.00 ATOM 376 CB TRP 48 -6.498 -6.598 -9.547 1.00 0.00 ATOM 377 CG TRP 48 -5.202 -7.142 -9.028 1.00 0.00 ATOM 378 CD1 TRP 48 -4.661 -8.368 -9.294 1.00 0.00 ATOM 379 CD2 TRP 48 -4.281 -6.479 -8.153 1.00 0.00 ATOM 380 CE2 TRP 48 -3.206 -7.362 -7.931 1.00 0.00 ATOM 381 CE3 TRP 48 -4.261 -5.224 -7.536 1.00 0.00 ATOM 382 NE1 TRP 48 -3.462 -8.509 -8.639 1.00 0.00 ATOM 383 CZ2 TRP 48 -2.123 -7.030 -7.119 1.00 0.00 ATOM 384 CZ3 TRP 48 -3.186 -4.900 -6.731 1.00 0.00 ATOM 385 CH2 TRP 48 -2.130 -5.797 -6.528 1.00 0.00 ATOM 386 O TRP 48 -4.318 -5.872 -11.775 1.00 0.00 ATOM 387 C TRP 48 -5.545 -5.965 -11.732 1.00 0.00 ATOM 388 N ALA 49 -6.251 -6.502 -12.720 1.00 0.00 ATOM 389 CA ALA 49 -5.589 -7.006 -13.917 1.00 0.00 ATOM 390 CB ALA 49 -6.603 -7.641 -14.855 1.00 0.00 ATOM 391 O ALA 49 -3.770 -5.950 -15.097 1.00 0.00 ATOM 392 C ALA 49 -4.902 -5.830 -14.619 1.00 0.00 ATOM 393 N GLN 50 -5.582 -4.685 -14.657 1.00 0.00 ATOM 394 CA GLN 50 -5.031 -3.484 -15.283 1.00 0.00 ATOM 395 CB GLN 50 -6.062 -2.354 -15.277 1.00 0.00 ATOM 396 CG GLN 50 -7.230 -2.573 -16.224 1.00 0.00 ATOM 397 CD GLN 50 -8.295 -1.502 -16.093 1.00 0.00 ATOM 398 OE1 GLN 50 -8.205 -0.626 -15.233 1.00 0.00 ATOM 399 NE2 GLN 50 -9.309 -1.570 -16.948 1.00 0.00 ATOM 400 O GLN 50 -2.753 -2.737 -15.130 1.00 0.00 ATOM 401 C GLN 50 -3.792 -3.014 -14.529 1.00 0.00 ATOM 402 N ARG 51 -3.906 -2.923 -13.209 1.00 0.00 ATOM 403 CA ARG 51 -2.790 -2.491 -12.371 1.00 0.00 ATOM 404 CB ARG 51 -3.208 -2.456 -10.899 1.00 0.00 ATOM 405 CG ARG 51 -4.174 -1.334 -10.555 1.00 0.00 ATOM 406 CD ARG 51 -4.603 -1.401 -9.098 1.00 0.00 ATOM 407 NE ARG 51 -5.554 -0.346 -8.758 1.00 0.00 ATOM 408 CZ ARG 51 -6.142 -0.224 -7.573 1.00 0.00 ATOM 409 NH1 ARG 51 -6.993 0.769 -7.353 1.00 0.00 ATOM 410 NH2 ARG 51 -5.876 -1.093 -6.608 1.00 0.00 ATOM 411 O ARG 51 -0.456 -2.975 -12.544 1.00 0.00 ATOM 412 C ARG 51 -1.595 -3.427 -12.492 1.00 0.00 ATOM 413 N LEU 52 -1.854 -4.731 -12.537 1.00 0.00 ATOM 414 CA LEU 52 -0.769 -5.696 -12.670 1.00 0.00 ATOM 415 CB LEU 52 -1.309 -7.124 -12.575 1.00 0.00 ATOM 416 CG LEU 52 -0.266 -8.245 -12.585 1.00 0.00 ATOM 417 CD1 LEU 52 0.681 -8.106 -11.403 1.00 0.00 ATOM 418 CD2 LEU 52 -0.940 -9.606 -12.498 1.00 0.00 ATOM 419 O LEU 52 1.141 -5.810 -14.120 1.00 0.00 ATOM 420 C LEU 52 -0.057 -5.548 -14.014 1.00 0.00 ATOM 421 N LYS 53 -0.799 -5.124 -15.032 1.00 0.00 ATOM 422 CA LYS 53 -0.254 -4.939 -16.373 1.00 0.00 ATOM 423 CB LYS 53 -1.353 -5.099 -17.424 1.00 0.00 ATOM 424 CG LYS 53 -1.935 -6.501 -17.506 1.00 0.00 ATOM 425 CD LYS 53 -3.046 -6.578 -18.540 1.00 0.00 ATOM 426 CE LYS 53 -3.622 -7.982 -18.627 1.00 0.00 ATOM 427 NZ LYS 53 -4.693 -8.081 -19.658 1.00 0.00 ATOM 428 O LYS 53 0.953 -3.315 -17.658 1.00 0.00 ATOM 429 C LYS 53 0.372 -3.566 -16.599 1.00 0.00 ATOM 430 N THR 54 0.245 -2.673 -15.621 1.00 0.00 ATOM 431 CA THR 54 0.805 -1.329 -15.741 1.00 0.00 ATOM 432 CB THR 54 0.295 -0.402 -14.622 1.00 0.00 ATOM 433 CG2 THR 54 0.867 0.997 -14.788 1.00 0.00 ATOM 434 OG1 THR 54 -1.135 -0.328 -14.674 1.00 0.00 ATOM 435 O THR 54 2.876 -1.882 -14.666 1.00 0.00 ATOM 436 C THR 54 2.326 -1.391 -15.651 1.00 0.00 ATOM 437 N PRO 55 2.998 -0.883 -16.681 1.00 0.00 ATOM 438 CA PRO 55 4.459 -0.884 -16.727 1.00 0.00 ATOM 439 CB PRO 55 4.788 -0.227 -18.069 1.00 0.00 ATOM 440 CG PRO 55 3.593 -0.499 -18.921 1.00 0.00 ATOM 441 CD PRO 55 2.403 -0.412 -18.007 1.00 0.00 ATOM 442 O PRO 55 6.228 -0.394 -15.188 1.00 0.00 ATOM 443 C PRO 55 5.103 -0.108 -15.582 1.00 0.00 ATOM 444 N THR 56 4.382 0.874 -15.052 1.00 0.00 ATOM 445 CA THR 56 4.912 1.717 -13.989 1.00 0.00 ATOM 446 CB THR 56 4.457 3.180 -14.148 1.00 0.00 ATOM 447 CG2 THR 56 4.944 3.748 -15.473 1.00 0.00 ATOM 448 OG1 THR 56 3.026 3.244 -14.116 1.00 0.00 ATOM 449 O THR 56 4.713 2.066 -11.621 1.00 0.00 ATOM 450 C THR 56 4.499 1.318 -12.577 1.00 0.00 ATOM 451 N TRP 57 3.912 0.130 -12.463 1.00 0.00 ATOM 452 CA TRP 57 3.472 -0.413 -11.185 1.00 0.00 ATOM 453 CB TRP 57 1.947 -0.529 -11.148 1.00 0.00 ATOM 454 CG TRP 57 1.244 0.791 -11.210 1.00 0.00 ATOM 455 CD1 TRP 57 1.805 2.028 -11.067 1.00 0.00 ATOM 456 CD2 TRP 57 -0.155 1.011 -11.436 1.00 0.00 ATOM 457 CE2 TRP 57 -0.369 2.402 -11.413 1.00 0.00 ATOM 458 CE3 TRP 57 -1.247 0.165 -11.653 1.00 0.00 ATOM 459 NE1 TRP 57 0.845 3.003 -11.188 1.00 0.00 ATOM 460 CZ2 TRP 57 -1.629 2.968 -11.601 1.00 0.00 ATOM 461 CZ3 TRP 57 -2.495 0.730 -11.838 1.00 0.00 ATOM 462 CH2 TRP 57 -2.679 2.116 -11.811 1.00 0.00 ATOM 463 O TRP 57 4.359 -2.494 -11.972 1.00 0.00 ATOM 464 C TRP 57 4.083 -1.788 -11.001 1.00 0.00 ATOM 468 N ARG 60 4.284 -2.166 -9.746 1.00 0.00 ATOM 469 CA ARG 60 4.860 -3.456 -9.442 1.00 0.00 ATOM 470 CB ARG 60 6.385 -3.359 -9.368 1.00 0.00 ATOM 471 CG ARG 60 7.043 -2.943 -10.673 1.00 0.00 ATOM 472 CD ARG 60 6.947 -4.045 -11.716 1.00 0.00 ATOM 473 NE ARG 60 7.691 -3.715 -12.930 1.00 0.00 ATOM 474 CZ ARG 60 7.218 -2.957 -13.913 1.00 0.00 ATOM 475 NH1 ARG 60 7.966 -2.710 -14.980 1.00 0.00 ATOM 476 NH2 ARG 60 5.997 -2.445 -13.827 1.00 0.00 ATOM 477 O ARG 60 4.263 -3.190 -7.123 1.00 0.00 ATOM 478 C ARG 60 4.327 -3.945 -8.098 1.00 0.00 ATOM 479 N LEU 61 3.914 -5.208 -8.070 1.00 0.00 ATOM 480 CA LEU 61 3.384 -5.839 -6.863 1.00 0.00 ATOM 481 CB LEU 61 2.000 -6.432 -7.133 1.00 0.00 ATOM 482 CG LEU 61 1.319 -7.128 -5.952 1.00 0.00 ATOM 483 CD1 LEU 61 0.971 -6.124 -4.864 1.00 0.00 ATOM 484 CD2 LEU 61 0.035 -7.811 -6.399 1.00 0.00 ATOM 485 O LEU 61 4.889 -7.639 -7.285 1.00 0.00 ATOM 486 C LEU 61 4.334 -6.946 -6.438 1.00 0.00 ATOM 487 N PHE 62 4.508 -7.112 -5.129 1.00 0.00 ATOM 488 CA PHE 62 5.357 -8.169 -4.586 1.00 0.00 ATOM 489 CB PHE 62 6.676 -7.587 -4.076 1.00 0.00 ATOM 490 CG PHE 62 7.494 -6.915 -5.142 1.00 0.00 ATOM 491 CD1 PHE 62 7.378 -5.555 -5.370 1.00 0.00 ATOM 492 CD2 PHE 62 8.381 -7.644 -5.916 1.00 0.00 ATOM 493 CE1 PHE 62 8.130 -4.937 -6.351 1.00 0.00 ATOM 494 CE2 PHE 62 9.134 -7.025 -6.897 1.00 0.00 ATOM 495 CZ PHE 62 9.010 -5.677 -7.115 1.00 0.00 ATOM 496 O PHE 62 4.088 -8.220 -2.557 1.00 0.00 ATOM 497 C PHE 62 4.664 -8.873 -3.425 1.00 0.00 ATOM 498 N VAL 63 4.712 -10.201 -3.409 1.00 0.00 ATOM 499 CA VAL 63 4.132 -10.949 -2.297 1.00 0.00 ATOM 500 CB VAL 63 3.475 -12.257 -2.778 1.00 0.00 ATOM 501 CG1 VAL 63 2.961 -13.062 -1.594 1.00 0.00 ATOM 502 CG2 VAL 63 2.302 -11.955 -3.698 1.00 0.00 ATOM 503 O VAL 63 6.427 -11.392 -1.759 1.00 0.00 ATOM 504 C VAL 63 5.275 -11.267 -1.338 1.00 0.00 ATOM 505 N ALA 64 4.970 -11.368 -0.049 1.00 0.00 ATOM 506 CA ALA 64 5.989 -11.761 0.909 1.00 0.00 ATOM 507 CB ALA 64 6.195 -10.666 1.944 1.00 0.00 ATOM 508 O ALA 64 4.254 -13.141 1.833 1.00 0.00 ATOM 509 C ALA 64 5.449 -13.036 1.549 1.00 0.00 ATOM 510 N GLU 65 6.326 -14.017 1.725 1.00 0.00 ATOM 511 CA GLU 65 5.946 -15.305 2.298 1.00 0.00 ATOM 512 CB GLU 65 6.152 -16.425 1.277 1.00 0.00 ATOM 513 CG GLU 65 5.257 -16.321 0.052 1.00 0.00 ATOM 514 CD GLU 65 5.453 -17.475 -0.912 1.00 0.00 ATOM 515 OE1 GLU 65 6.318 -18.333 -0.644 1.00 0.00 ATOM 516 OE2 GLU 65 4.740 -17.519 -1.937 1.00 0.00 ATOM 517 O GLU 65 7.908 -15.242 3.673 1.00 0.00 ATOM 518 C GLU 65 6.762 -15.658 3.530 1.00 0.00 ATOM 519 N SER 66 6.162 -16.455 4.404 1.00 0.00 ATOM 520 CA SER 66 6.825 -16.931 5.604 1.00 0.00 ATOM 521 CB SER 66 6.307 -16.183 6.835 1.00 0.00 ATOM 522 OG SER 66 6.911 -16.670 8.020 1.00 0.00 ATOM 523 O SER 66 5.327 -18.790 5.851 1.00 0.00 ATOM 524 C SER 66 6.489 -18.416 5.682 1.00 0.00 ATOM 528 N SER 68 7.503 -19.262 5.524 1.00 0.00 ATOM 529 CA SER 68 7.300 -20.705 5.562 1.00 0.00 ATOM 530 CB SER 68 6.676 -21.123 6.894 1.00 0.00 ATOM 531 OG SER 68 7.516 -20.778 7.982 1.00 0.00 ATOM 532 O SER 68 5.544 -22.055 4.639 1.00 0.00 ATOM 533 C SER 68 6.372 -21.170 4.441 1.00 0.00 ATOM 534 N GLY 69 6.527 -20.559 3.267 1.00 0.00 ATOM 535 CA GLY 69 5.735 -20.886 2.078 1.00 0.00 ATOM 536 O GLY 69 3.502 -20.663 1.236 1.00 0.00 ATOM 537 C GLY 69 4.294 -20.387 2.136 1.00 0.00 ATOM 538 N GLU 70 3.955 -19.652 3.191 1.00 0.00 ATOM 539 CA GLU 70 2.607 -19.114 3.351 1.00 0.00 ATOM 540 CB GLU 70 2.111 -19.328 4.782 1.00 0.00 ATOM 541 CG GLU 70 1.898 -20.787 5.156 1.00 0.00 ATOM 542 CD GLU 70 1.456 -20.961 6.594 1.00 0.00 ATOM 543 OE1 GLU 70 1.341 -19.943 7.308 1.00 0.00 ATOM 544 OE2 GLU 70 1.224 -22.117 7.009 1.00 0.00 ATOM 545 O GLU 70 3.396 -16.861 3.543 1.00 0.00 ATOM 546 C GLU 70 2.557 -17.615 3.059 1.00 0.00 ATOM 547 N VAL 71 1.576 -17.195 2.262 1.00 0.00 ATOM 548 CA VAL 71 1.425 -15.784 1.913 1.00 0.00 ATOM 549 CB VAL 71 0.264 -15.568 0.924 1.00 0.00 ATOM 550 CG1 VAL 71 0.063 -14.086 0.653 1.00 0.00 ATOM 551 CG2 VAL 71 0.554 -16.264 -0.397 1.00 0.00 ATOM 552 O VAL 71 0.156 -15.185 3.870 1.00 0.00 ATOM 553 C VAL 71 1.139 -14.952 3.160 1.00 0.00 ATOM 554 N VAL 72 1.998 -13.969 3.418 1.00 0.00 ATOM 555 CA VAL 72 1.861 -13.126 4.599 1.00 0.00 ATOM 556 CB VAL 72 3.178 -13.049 5.394 1.00 0.00 ATOM 557 CG1 VAL 72 3.601 -14.434 5.860 1.00 0.00 ATOM 558 CG2 VAL 72 4.290 -12.474 4.528 1.00 0.00 ATOM 559 O VAL 72 1.056 -10.968 5.241 1.00 0.00 ATOM 560 C VAL 72 1.471 -11.674 4.328 1.00 0.00 ATOM 561 N GLY 73 1.609 -11.220 3.087 1.00 0.00 ATOM 562 CA GLY 73 1.254 -9.846 2.784 1.00 0.00 ATOM 563 O GLY 73 2.316 -10.209 0.683 1.00 0.00 ATOM 564 C GLY 73 1.776 -9.406 1.436 1.00 0.00 ATOM 565 N PHE 74 1.606 -8.131 1.108 1.00 0.00 ATOM 566 CA PHE 74 2.093 -7.647 -0.175 1.00 0.00 ATOM 567 CB PHE 74 1.062 -7.913 -1.274 1.00 0.00 ATOM 568 CG PHE 74 -0.250 -7.217 -1.055 1.00 0.00 ATOM 569 CD1 PHE 74 -0.485 -5.966 -1.597 1.00 0.00 ATOM 570 CD2 PHE 74 -1.250 -7.812 -0.307 1.00 0.00 ATOM 571 CE1 PHE 74 -1.693 -5.324 -1.397 1.00 0.00 ATOM 572 CE2 PHE 74 -2.459 -7.172 -0.106 1.00 0.00 ATOM 573 CZ PHE 74 -2.682 -5.933 -0.647 1.00 0.00 ATOM 574 O PHE 74 1.983 -5.453 0.794 1.00 0.00 ATOM 575 C PHE 74 2.365 -6.156 -0.144 1.00 0.00 ATOM 576 N ALA 75 3.027 -5.688 -1.195 1.00 0.00 ATOM 577 CA ALA 75 3.337 -4.278 -1.347 1.00 0.00 ATOM 578 CB ALA 75 4.780 -4.006 -0.950 1.00 0.00 ATOM 579 O ALA 75 3.341 -4.759 -3.709 1.00 0.00 ATOM 580 C ALA 75 3.120 -3.929 -2.820 1.00 0.00 ATOM 581 N ALA 76 2.643 -2.715 -3.071 1.00 0.00 ATOM 582 CA ALA 76 2.455 -2.233 -4.435 1.00 0.00 ATOM 583 CB ALA 76 0.975 -2.041 -4.731 1.00 0.00 ATOM 584 O ALA 76 2.951 -0.004 -3.738 1.00 0.00 ATOM 585 C ALA 76 3.189 -0.912 -4.538 1.00 0.00 ATOM 586 N PHE 77 4.088 -0.806 -5.511 1.00 0.00 ATOM 587 CA PHE 77 4.844 0.425 -5.717 1.00 0.00 ATOM 588 CB PHE 77 6.348 0.148 -5.646 1.00 0.00 ATOM 589 CG PHE 77 6.812 -0.329 -4.300 1.00 0.00 ATOM 590 CD1 PHE 77 6.898 -1.683 -4.021 1.00 0.00 ATOM 591 CD2 PHE 77 7.163 0.573 -3.312 1.00 0.00 ATOM 592 CE1 PHE 77 7.326 -2.123 -2.782 1.00 0.00 ATOM 593 CE2 PHE 77 7.592 0.133 -2.074 1.00 0.00 ATOM 594 CZ PHE 77 7.674 -1.207 -1.807 1.00 0.00 ATOM 595 O PHE 77 4.179 0.294 -8.021 1.00 0.00 ATOM 596 C PHE 77 4.526 1.023 -7.089 1.00 0.00 ATOM 597 N GLY 78 4.607 2.350 -7.185 1.00 0.00 ATOM 598 CA GLY 78 4.356 3.084 -8.431 1.00 0.00 ATOM 599 O GLY 78 6.101 4.598 -7.790 1.00 0.00 ATOM 600 C GLY 78 5.487 4.058 -8.710 1.00 0.00 ATOM 601 N PRO 79 5.735 4.299 -9.988 1.00 0.00 ATOM 602 CA PRO 79 6.725 5.281 -10.392 1.00 0.00 ATOM 603 CB PRO 79 7.917 4.438 -10.850 1.00 0.00 ATOM 604 CG PRO 79 7.768 3.149 -10.113 1.00 0.00 ATOM 605 CD PRO 79 6.291 2.878 -10.042 1.00 0.00 ATOM 606 O PRO 79 5.042 5.657 -12.057 1.00 0.00 ATOM 607 C PRO 79 6.065 6.073 -11.511 1.00 0.00 ATOM 608 N ASP 80 6.652 7.217 -11.835 1.00 0.00 ATOM 609 CA ASP 80 6.136 8.074 -12.890 1.00 0.00 ATOM 610 CB ASP 80 6.425 7.465 -14.265 1.00 0.00 ATOM 611 CG ASP 80 6.237 8.460 -15.392 1.00 0.00 ATOM 612 OD1 ASP 80 6.140 9.672 -15.106 1.00 0.00 ATOM 613 OD2 ASP 80 6.185 8.027 -16.563 1.00 0.00 ATOM 614 O ASP 80 4.090 8.681 -11.791 1.00 0.00 ATOM 615 C ASP 80 4.627 8.312 -12.836 1.00 0.00 ATOM 616 N ARG 81 1.932 6.808 -10.097 1.00 0.00 ATOM 617 CA ARG 81 1.776 7.304 -8.723 1.00 0.00 ATOM 618 CB ARG 81 2.826 8.374 -8.417 1.00 0.00 ATOM 619 CG ARG 81 4.244 7.837 -8.305 1.00 0.00 ATOM 620 CD ARG 81 5.242 8.961 -8.076 1.00 0.00 ATOM 621 NE ARG 81 5.026 9.633 -6.797 1.00 0.00 ATOM 622 CZ ARG 81 5.579 9.251 -5.650 1.00 0.00 ATOM 623 NH1 ARG 81 5.325 9.924 -4.535 1.00 0.00 ATOM 624 NH2 ARG 81 6.383 8.198 -5.621 1.00 0.00 ATOM 625 O ARG 81 -0.150 8.566 -9.397 1.00 0.00 ATOM 626 C ARG 81 0.395 7.926 -8.498 1.00 0.00 ATOM 627 N ALA 82 -0.164 7.747 -7.300 1.00 0.00 ATOM 628 CA ALA 82 -1.501 8.273 -6.991 1.00 0.00 ATOM 629 CB ALA 82 -2.002 7.709 -5.670 1.00 0.00 ATOM 630 O ALA 82 -2.613 10.395 -6.735 1.00 0.00 ATOM 631 C ALA 82 -1.544 9.795 -6.868 1.00 0.00 ATOM 632 N SER 83 -0.366 10.404 -6.900 1.00 0.00 ATOM 633 CA SER 83 -0.209 11.855 -6.837 1.00 0.00 ATOM 634 CB SER 83 0.195 12.291 -5.427 1.00 0.00 ATOM 635 OG SER 83 0.358 13.697 -5.354 1.00 0.00 ATOM 636 O SER 83 1.827 11.388 -7.993 1.00 0.00 ATOM 637 C SER 83 0.882 12.162 -7.849 1.00 0.00 ATOM 638 N GLY 84 0.746 13.277 -8.557 1.00 0.00 ATOM 639 CA GLY 84 1.726 13.672 -9.567 1.00 0.00 ATOM 640 O GLY 84 3.205 15.404 -8.822 1.00 0.00 ATOM 641 C GLY 84 2.998 14.196 -8.898 1.00 0.00 ATOM 642 N PHE 85 3.844 13.282 -8.423 1.00 0.00 ATOM 643 CA PHE 85 5.083 13.659 -7.747 1.00 0.00 ATOM 644 CB PHE 85 5.458 12.616 -6.693 1.00 0.00 ATOM 645 CG PHE 85 4.500 12.550 -5.539 1.00 0.00 ATOM 646 CD1 PHE 85 3.522 11.571 -5.486 1.00 0.00 ATOM 647 CD2 PHE 85 4.575 13.467 -4.504 1.00 0.00 ATOM 648 CE1 PHE 85 2.641 11.511 -4.423 1.00 0.00 ATOM 649 CE2 PHE 85 3.694 13.407 -3.442 1.00 0.00 ATOM 650 CZ PHE 85 2.730 12.434 -3.399 1.00 0.00 ATOM 651 O PHE 85 7.333 14.299 -8.281 1.00 0.00 ATOM 652 C PHE 85 6.287 13.788 -8.678 1.00 0.00 ATOM 653 N PRO 86 6.154 13.315 -9.911 1.00 0.00 ATOM 654 CA PRO 86 7.261 13.435 -10.844 1.00 0.00 ATOM 655 CB PRO 86 8.232 14.390 -10.146 1.00 0.00 ATOM 656 CG PRO 86 7.995 14.166 -8.691 1.00 0.00 ATOM 657 CD PRO 86 6.522 13.901 -8.544 1.00 0.00 ATOM 658 O PRO 86 7.666 11.076 -10.681 1.00 0.00 ATOM 659 C PRO 86 7.989 12.150 -11.189 1.00 0.00 ATOM 660 N GLY 87 9.000 12.272 -12.043 1.00 0.00 ATOM 661 CA GLY 87 9.769 11.116 -12.489 1.00 0.00 ATOM 662 O GLY 87 11.869 10.041 -12.078 1.00 0.00 ATOM 663 C GLY 87 11.011 10.822 -11.661 1.00 0.00 ATOM 664 N TYR 88 11.118 11.439 -10.492 1.00 0.00 ATOM 665 CA TYR 88 12.277 11.214 -9.646 1.00 0.00 ATOM 666 CB TYR 88 12.999 12.532 -9.363 1.00 0.00 ATOM 667 CG TYR 88 13.526 13.221 -10.602 1.00 0.00 ATOM 668 CD1 TYR 88 12.854 14.304 -11.154 1.00 0.00 ATOM 669 CD2 TYR 88 14.693 12.785 -11.216 1.00 0.00 ATOM 670 CE1 TYR 88 13.329 14.940 -12.287 1.00 0.00 ATOM 671 CE2 TYR 88 15.182 13.408 -12.348 1.00 0.00 ATOM 672 CZ TYR 88 14.488 14.494 -12.882 1.00 0.00 ATOM 673 OH TYR 88 14.963 15.124 -14.008 1.00 0.00 ATOM 674 O TYR 88 12.659 10.578 -7.374 1.00 0.00 ATOM 675 C TYR 88 11.874 10.601 -8.317 1.00 0.00 ATOM 676 N THR 89 10.649 10.095 -8.246 1.00 0.00 ATOM 677 CA THR 89 10.158 9.509 -7.009 1.00 0.00 ATOM 678 CB THR 89 9.120 10.419 -6.325 1.00 0.00 ATOM 679 CG2 THR 89 9.715 11.791 -6.048 1.00 0.00 ATOM 680 OG1 THR 89 7.981 10.572 -7.180 1.00 0.00 ATOM 681 O THR 89 9.125 7.774 -8.308 1.00 0.00 ATOM 682 C THR 89 9.480 8.158 -7.195 1.00 0.00 ATOM 683 N ALA 90 9.324 7.431 -6.092 1.00 0.00 ATOM 684 CA ALA 90 8.643 6.145 -6.114 1.00 0.00 ATOM 685 CB ALA 90 9.640 5.014 -5.904 1.00 0.00 ATOM 686 O ALA 90 7.923 6.727 -3.917 1.00 0.00 ATOM 687 C ALA 90 7.634 6.195 -4.982 1.00 0.00 ATOM 688 N GLU 91 6.442 5.665 -5.220 1.00 0.00 ATOM 689 CA GLU 91 5.408 5.656 -4.199 1.00 0.00 ATOM 690 CB GLU 91 4.098 6.216 -4.758 1.00 0.00 ATOM 691 CG GLU 91 2.954 6.234 -3.756 1.00 0.00 ATOM 692 CD GLU 91 1.682 6.821 -4.336 1.00 0.00 ATOM 693 OE1 GLU 91 1.694 7.208 -5.523 1.00 0.00 ATOM 694 OE2 GLU 91 0.674 6.895 -3.602 1.00 0.00 ATOM 695 O GLU 91 5.105 3.288 -4.451 1.00 0.00 ATOM 696 C GLU 91 5.123 4.248 -3.679 1.00 0.00 ATOM 697 N LEU 92 4.930 4.130 -2.368 1.00 0.00 ATOM 698 CA LEU 92 4.538 2.860 -1.775 1.00 0.00 ATOM 699 CB LEU 92 5.267 2.640 -0.449 1.00 0.00 ATOM 700 CG LEU 92 5.262 1.211 0.099 1.00 0.00 ATOM 701 CD1 LEU 92 6.226 1.079 1.268 1.00 0.00 ATOM 702 CD2 LEU 92 3.873 0.828 0.587 1.00 0.00 ATOM 703 O LEU 92 2.627 3.835 -0.713 1.00 0.00 ATOM 704 C LEU 92 3.045 3.144 -1.640 1.00 0.00 ATOM 705 N TRP 93 2.251 2.650 -2.586 1.00 0.00 ATOM 706 CA TRP 93 0.818 2.900 -2.572 1.00 0.00 ATOM 707 CB TRP 93 0.217 2.650 -3.957 1.00 0.00 ATOM 708 CG TRP 93 -1.264 2.865 -4.016 1.00 0.00 ATOM 709 CD1 TRP 93 -1.914 4.046 -4.228 1.00 0.00 ATOM 710 CD2 TRP 93 -2.283 1.869 -3.861 1.00 0.00 ATOM 711 CE2 TRP 93 -3.525 2.520 -3.992 1.00 0.00 ATOM 712 CE3 TRP 93 -2.267 0.491 -3.625 1.00 0.00 ATOM 713 NE1 TRP 93 -3.273 3.850 -4.215 1.00 0.00 ATOM 714 CZ2 TRP 93 -4.739 1.841 -3.893 1.00 0.00 ATOM 715 CZ3 TRP 93 -3.472 -0.179 -3.529 1.00 0.00 ATOM 716 CH2 TRP 93 -4.692 0.493 -3.663 1.00 0.00 ATOM 717 O TRP 93 -0.845 2.454 -0.901 1.00 0.00 ATOM 718 C TRP 93 0.079 2.007 -1.590 1.00 0.00 ATOM 719 N ALA 94 0.491 0.742 -1.536 1.00 0.00 ATOM 720 CA ALA 94 -0.116 -0.244 -0.653 1.00 0.00 ATOM 721 CB ALA 94 -1.054 -1.149 -1.436 1.00 0.00 ATOM 722 O ALA 94 1.927 -1.486 -0.630 1.00 0.00 ATOM 723 C ALA 94 0.946 -1.110 0.003 1.00 0.00 ATOM 724 N ILE 95 0.756 -1.399 1.285 1.00 0.00 ATOM 725 CA ILE 95 1.669 -2.263 2.018 1.00 0.00 ATOM 726 CB ILE 95 2.859 -1.471 2.592 1.00 0.00 ATOM 727 CG1 ILE 95 3.814 -2.408 3.333 1.00 0.00 ATOM 728 CG2 ILE 95 2.371 -0.410 3.567 1.00 0.00 ATOM 729 CD1 ILE 95 5.146 -1.776 3.675 1.00 0.00 ATOM 730 O ILE 95 0.303 -2.173 4.009 1.00 0.00 ATOM 731 C ILE 95 0.838 -2.870 3.140 1.00 0.00 ATOM 732 N TYR 96 0.703 -4.191 3.084 1.00 0.00 ATOM 733 CA TYR 96 -0.128 -4.906 4.038 1.00 0.00 ATOM 734 CB TYR 96 -1.504 -5.201 3.437 1.00 0.00 ATOM 735 CG TYR 96 -2.280 -3.963 3.047 1.00 0.00 ATOM 736 CD1 TYR 96 -2.168 -3.426 1.771 1.00 0.00 ATOM 737 CD2 TYR 96 -3.121 -3.334 3.958 1.00 0.00 ATOM 738 CE1 TYR 96 -2.875 -2.294 1.406 1.00 0.00 ATOM 739 CE2 TYR 96 -3.833 -2.203 3.611 1.00 0.00 ATOM 740 CZ TYR 96 -3.705 -1.685 2.324 1.00 0.00 ATOM 741 OH TYR 96 -4.408 -0.559 1.963 1.00 0.00 ATOM 742 O TYR 96 0.900 -7.017 3.672 1.00 0.00 ATOM 743 C TYR 96 0.429 -6.236 4.488 1.00 0.00 ATOM 744 N VAL 97 0.348 -6.493 5.788 1.00 0.00 ATOM 745 CA VAL 97 0.777 -7.763 6.341 1.00 0.00 ATOM 746 CB VAL 97 1.949 -7.584 7.322 1.00 0.00 ATOM 747 CG1 VAL 97 2.352 -8.923 7.921 1.00 0.00 ATOM 748 CG2 VAL 97 3.158 -6.996 6.606 1.00 0.00 ATOM 749 O VAL 97 -1.148 -7.563 7.764 1.00 0.00 ATOM 750 C VAL 97 -0.458 -8.304 7.057 1.00 0.00 ATOM 751 N LEU 98 -0.757 -9.582 6.839 1.00 0.00 ATOM 752 CA LEU 98 -1.905 -10.210 7.484 1.00 0.00 ATOM 753 CB LEU 98 -2.003 -11.684 7.087 1.00 0.00 ATOM 754 CG LEU 98 -2.339 -11.970 5.622 1.00 0.00 ATOM 755 CD1 LEU 98 -2.274 -13.463 5.337 1.00 0.00 ATOM 756 CD2 LEU 98 -3.740 -11.483 5.287 1.00 0.00 ATOM 757 O LEU 98 -0.624 -10.306 9.496 1.00 0.00 ATOM 758 C LEU 98 -1.718 -10.097 8.987 1.00 0.00 ATOM 759 N PRO 99 -2.794 -9.789 9.698 1.00 0.00 ATOM 760 CA PRO 99 -2.723 -9.625 11.142 1.00 0.00 ATOM 761 CB PRO 99 -4.179 -9.737 11.599 1.00 0.00 ATOM 762 CG PRO 99 -4.969 -9.163 10.472 1.00 0.00 ATOM 763 CD PRO 99 -4.344 -9.693 9.212 1.00 0.00 ATOM 764 O PRO 99 -1.011 -10.298 12.690 1.00 0.00 ATOM 765 C PRO 99 -1.874 -10.662 11.885 1.00 0.00 ATOM 766 N THR 100 -2.101 -11.944 11.618 1.00 0.00 ATOM 767 CA THR 100 -1.344 -12.996 12.299 1.00 0.00 ATOM 768 CB THR 100 -1.868 -14.397 11.932 1.00 0.00 ATOM 769 CG2 THR 100 -3.331 -14.536 12.320 1.00 0.00 ATOM 770 OG1 THR 100 -1.740 -14.603 10.520 1.00 0.00 ATOM 771 O THR 100 0.940 -13.630 12.695 1.00 0.00 ATOM 772 C THR 100 0.151 -13.012 11.971 1.00 0.00 ATOM 773 N TRP 101 0.550 -12.341 10.890 1.00 0.00 ATOM 774 CA TRP 101 1.970 -12.311 10.520 1.00 0.00 ATOM 775 CB TRP 101 2.134 -12.504 9.011 1.00 0.00 ATOM 776 CG TRP 101 1.653 -13.835 8.520 1.00 0.00 ATOM 777 CD1 TRP 101 0.452 -14.105 7.931 1.00 0.00 ATOM 778 CD2 TRP 101 2.363 -15.078 8.576 1.00 0.00 ATOM 779 CE2 TRP 101 1.529 -16.060 8.003 1.00 0.00 ATOM 780 CE3 TRP 101 3.619 -15.459 9.055 1.00 0.00 ATOM 781 NE1 TRP 101 0.367 -15.440 7.616 1.00 0.00 ATOM 782 CZ2 TRP 101 1.913 -17.395 7.895 1.00 0.00 ATOM 783 CZ3 TRP 101 3.997 -16.783 8.945 1.00 0.00 ATOM 784 CH2 TRP 101 3.149 -17.738 8.372 1.00 0.00 ATOM 785 O TRP 101 3.861 -10.833 10.600 1.00 0.00 ATOM 786 C TRP 101 2.671 -10.996 10.875 1.00 0.00 ATOM 787 N GLN 102 1.941 -10.070 11.490 1.00 0.00 ATOM 788 CA GLN 102 2.510 -8.777 11.874 1.00 0.00 ATOM 789 CB GLN 102 1.404 -7.808 12.296 1.00 0.00 ATOM 790 CG GLN 102 0.470 -7.403 11.168 1.00 0.00 ATOM 791 CD GLN 102 -0.598 -6.426 11.618 1.00 0.00 ATOM 792 OE1 GLN 102 -0.666 -6.063 12.793 1.00 0.00 ATOM 793 NE2 GLN 102 -1.436 -5.994 10.682 1.00 0.00 ATOM 794 O GLN 102 3.481 -9.925 13.752 1.00 0.00 ATOM 795 C GLN 102 3.486 -8.915 13.047 1.00 0.00 ATOM 796 N ARG 103 4.320 -7.895 13.238 1.00 0.00 ATOM 797 CA ARG 103 5.309 -7.854 14.324 1.00 0.00 ATOM 798 CB ARG 103 4.628 -8.068 15.677 1.00 0.00 ATOM 799 CG ARG 103 3.586 -7.016 16.021 1.00 0.00 ATOM 800 CD ARG 103 2.916 -7.315 17.352 1.00 0.00 ATOM 801 NE ARG 103 1.821 -6.392 17.634 1.00 0.00 ATOM 802 CZ ARG 103 1.061 -6.445 18.723 1.00 0.00 ATOM 803 NH1 ARG 103 0.086 -5.562 18.895 1.00 0.00 ATOM 804 NH2 ARG 103 1.278 -7.380 19.639 1.00 0.00 ATOM 805 O ARG 103 6.916 -9.384 15.237 1.00 0.00 ATOM 806 C ARG 103 6.403 -8.914 14.218 1.00 0.00 ATOM 807 N LYS 104 6.762 -9.286 12.992 1.00 0.00 ATOM 808 CA LYS 104 7.803 -10.284 12.764 1.00 0.00 ATOM 809 CB LYS 104 7.193 -11.587 12.244 1.00 0.00 ATOM 810 CG LYS 104 6.278 -12.283 13.237 1.00 0.00 ATOM 811 CD LYS 104 5.701 -13.563 12.654 1.00 0.00 ATOM 812 CE LYS 104 4.643 -14.159 13.568 1.00 0.00 ATOM 813 NZ LYS 104 4.050 -15.399 12.995 1.00 0.00 ATOM 814 O LYS 104 9.603 -10.633 11.222 1.00 0.00 ATOM 815 C LYS 104 8.834 -9.823 11.743 1.00 0.00 ATOM 816 N GLY 105 8.843 -8.527 11.454 1.00 0.00 ATOM 817 CA GLY 105 9.798 -7.995 10.505 1.00 0.00 ATOM 818 O GLY 105 10.186 -7.693 8.175 1.00 0.00 ATOM 819 C GLY 105 9.405 -8.086 9.040 1.00 0.00 ATOM 820 N LEU 106 8.207 -8.586 8.742 1.00 0.00 ATOM 821 CA LEU 106 7.780 -8.708 7.345 1.00 0.00 ATOM 822 CB LEU 106 6.529 -9.584 7.240 1.00 0.00 ATOM 823 CG LEU 106 6.710 -11.066 7.571 1.00 0.00 ATOM 824 CD1 LEU 106 5.368 -11.782 7.580 1.00 0.00 ATOM 825 CD2 LEU 106 7.605 -11.741 6.544 1.00 0.00 ATOM 826 O LEU 106 7.678 -7.166 5.504 1.00 0.00 ATOM 827 C LEU 106 7.440 -7.360 6.699 1.00 0.00 ATOM 828 N GLY 107 6.886 -6.435 7.477 1.00 0.00 ATOM 829 CA GLY 107 6.573 -5.122 6.937 1.00 0.00 ATOM 830 O GLY 107 7.974 -3.809 5.508 1.00 0.00 ATOM 831 C GLY 107 7.875 -4.437 6.560 1.00 0.00 ATOM 832 N ARG 108 8.880 -4.571 7.424 1.00 0.00 ATOM 833 CA ARG 108 10.193 -3.977 7.177 1.00 0.00 ATOM 834 CB ARG 108 11.156 -4.311 8.319 1.00 0.00 ATOM 835 CG ARG 108 10.844 -3.595 9.623 1.00 0.00 ATOM 836 CD ARG 108 11.792 -4.027 10.730 1.00 0.00 ATOM 837 NE ARG 108 11.489 -3.368 11.998 1.00 0.00 ATOM 838 CZ ARG 108 12.119 -3.623 13.142 1.00 0.00 ATOM 839 NH1 ARG 108 11.776 -2.974 14.246 1.00 0.00 ATOM 840 NH2 ARG 108 13.089 -4.525 13.177 1.00 0.00 ATOM 841 O ARG 108 11.314 -3.766 5.071 1.00 0.00 ATOM 842 C ARG 108 10.768 -4.522 5.873 1.00 0.00 ATOM 843 N ALA 109 10.647 -5.834 5.671 1.00 0.00 ATOM 844 CA ALA 109 11.139 -6.474 4.451 1.00 0.00 ATOM 845 CB ALA 109 10.834 -7.965 4.474 1.00 0.00 ATOM 846 O ALA 109 11.143 -5.546 2.236 1.00 0.00 ATOM 847 C ALA 109 10.476 -5.867 3.217 1.00 0.00 ATOM 848 N LEU 110 9.157 -5.720 3.260 1.00 0.00 ATOM 849 CA LEU 110 8.440 -5.149 2.123 1.00 0.00 ATOM 850 CB LEU 110 6.931 -5.177 2.372 1.00 0.00 ATOM 851 CG LEU 110 6.270 -6.556 2.373 1.00 0.00 ATOM 852 CD1 LEU 110 4.815 -6.455 2.809 1.00 0.00 ATOM 853 CD2 LEU 110 6.306 -7.171 0.982 1.00 0.00 ATOM 854 O LEU 110 9.004 -3.303 0.709 1.00 0.00 ATOM 855 C LEU 110 8.834 -3.709 1.863 1.00 0.00 ATOM 856 N PHE 111 8.976 -2.925 2.927 1.00 0.00 ATOM 857 CA PHE 111 9.340 -1.523 2.749 1.00 0.00 ATOM 858 CB PHE 111 9.264 -0.777 4.083 1.00 0.00 ATOM 859 CG PHE 111 9.610 0.682 3.983 1.00 0.00 ATOM 860 CD1 PHE 111 8.696 1.591 3.478 1.00 0.00 ATOM 861 CD2 PHE 111 10.848 1.143 4.391 1.00 0.00 ATOM 862 CE1 PHE 111 9.014 2.933 3.385 1.00 0.00 ATOM 863 CE2 PHE 111 11.167 2.486 4.299 1.00 0.00 ATOM 864 CZ PHE 111 10.256 3.379 3.798 1.00 0.00 ATOM 865 O PHE 111 11.026 -0.558 1.341 1.00 0.00 ATOM 866 C PHE 111 10.763 -1.393 2.211 1.00 0.00 ATOM 867 N HIS 112 11.679 -2.209 2.720 1.00 0.00 ATOM 868 CA HIS 112 13.056 -2.146 2.250 1.00 0.00 ATOM 869 CB HIS 112 13.956 -3.039 3.106 1.00 0.00 ATOM 870 CG HIS 112 14.176 -2.522 4.493 1.00 0.00 ATOM 871 CD2 HIS 112 13.955 -1.254 5.177 1.00 0.00 ATOM 872 ND1 HIS 112 14.711 -3.295 5.501 1.00 0.00 ATOM 873 CE1 HIS 112 14.787 -2.560 6.625 1.00 0.00 ATOM 874 NE2 HIS 112 14.334 -1.335 6.439 1.00 0.00 ATOM 875 O HIS 112 14.096 -2.208 0.090 1.00 0.00 ATOM 876 C HIS 112 13.175 -2.609 0.809 1.00 0.00 ATOM 877 N GLU 113 12.232 -3.444 0.387 1.00 0.00 ATOM 878 CA GLU 113 12.208 -3.913 -0.987 1.00 0.00 ATOM 879 CB GLU 113 11.211 -5.062 -1.143 1.00 0.00 ATOM 880 CG GLU 113 11.166 -5.661 -2.540 1.00 0.00 ATOM 881 CD GLU 113 10.211 -6.833 -2.642 1.00 0.00 ATOM 882 OE1 GLU 113 9.589 -7.184 -1.617 1.00 0.00 ATOM 883 OE2 GLU 113 10.082 -7.401 -3.748 1.00 0.00 ATOM 884 O GLU 113 12.320 -2.509 -2.929 1.00 0.00 ATOM 885 C GLU 113 11.788 -2.718 -1.838 1.00 0.00 ATOM 886 N GLY 114 10.832 -1.934 -1.338 1.00 0.00 ATOM 887 CA GLY 114 10.372 -0.746 -2.068 1.00 0.00 ATOM 888 O GLY 114 11.678 0.915 -3.203 1.00 0.00 ATOM 889 C GLY 114 11.526 0.245 -2.184 1.00 0.00 ATOM 890 N ALA 115 12.328 0.342 -1.126 1.00 0.00 ATOM 891 CA ALA 115 13.476 1.251 -1.131 1.00 0.00 ATOM 892 CB ALA 115 14.115 1.306 0.248 1.00 0.00 ATOM 893 O ALA 115 15.119 1.559 -2.862 1.00 0.00 ATOM 894 C ALA 115 14.512 0.761 -2.135 1.00 0.00 ATOM 895 N ARG 116 14.699 -0.553 -2.177 1.00 0.00 ATOM 896 CA ARG 116 15.663 -1.166 -3.086 1.00 0.00 ATOM 897 CB ARG 116 15.734 -2.676 -2.852 1.00 0.00 ATOM 898 CG ARG 116 16.399 -3.072 -1.545 1.00 0.00 ATOM 899 CD ARG 116 16.369 -4.578 -1.342 1.00 0.00 ATOM 900 NE ARG 116 16.982 -4.972 -0.076 1.00 0.00 ATOM 901 CZ ARG 116 17.021 -6.222 0.378 1.00 0.00 ATOM 902 NH1 ARG 116 17.598 -6.486 1.542 1.00 0.00 ATOM 903 NH2 ARG 116 16.482 -7.202 -0.334 1.00 0.00 ATOM 904 O ARG 116 16.078 -0.615 -5.386 1.00 0.00 ATOM 905 C ARG 116 15.242 -0.909 -4.532 1.00 0.00 ATOM 906 N LEU 117 13.946 -1.018 -4.801 1.00 0.00 ATOM 907 CA LEU 117 13.440 -0.773 -6.144 1.00 0.00 ATOM 908 CB LEU 117 11.946 -1.095 -6.219 1.00 0.00 ATOM 909 CG LEU 117 11.282 -0.912 -7.586 1.00 0.00 ATOM 910 CD1 LEU 117 11.926 -1.817 -8.624 1.00 0.00 ATOM 911 CD2 LEU 117 9.800 -1.252 -7.514 1.00 0.00 ATOM 912 O LEU 117 14.011 1.001 -7.666 1.00 0.00 ATOM 913 C LEU 117 13.641 0.696 -6.530 1.00 0.00 ATOM 914 N LEU 118 13.413 1.599 -5.580 1.00 0.00 ATOM 915 CA LEU 118 13.577 3.024 -5.823 1.00 0.00 ATOM 916 CB LEU 118 13.158 3.831 -4.592 1.00 0.00 ATOM 917 CG LEU 118 13.263 5.352 -4.711 1.00 0.00 ATOM 918 CD1 LEU 118 12.359 5.868 -5.821 1.00 0.00 ATOM 919 CD2 LEU 118 12.848 6.023 -3.412 1.00 0.00 ATOM 920 O LEU 118 15.342 4.065 -7.069 1.00 0.00 ATOM 921 C LEU 118 15.037 3.324 -6.136 1.00 0.00 ATOM 922 N GLN 119 15.940 2.745 -5.354 1.00 0.00 ATOM 923 CA GLN 119 17.366 2.957 -5.572 1.00 0.00 ATOM 924 CB GLN 119 18.184 2.238 -4.499 1.00 0.00 ATOM 925 CG GLN 119 18.083 2.864 -3.118 1.00 0.00 ATOM 926 CD GLN 119 18.797 2.052 -2.056 1.00 0.00 ATOM 927 OE1 GLN 119 19.310 0.968 -2.330 1.00 0.00 ATOM 928 NE2 GLN 119 18.834 2.575 -0.836 1.00 0.00 ATOM 929 O GLN 119 18.487 3.070 -7.692 1.00 0.00 ATOM 930 C GLN 119 17.765 2.414 -6.941 1.00 0.00 ATOM 931 N ALA 120 17.290 1.215 -7.262 1.00 0.00 ATOM 932 CA ALA 120 17.602 0.586 -8.542 1.00 0.00 ATOM 933 CB ALA 120 17.003 -0.811 -8.605 1.00 0.00 ATOM 934 O ALA 120 17.634 1.442 -10.798 1.00 0.00 ATOM 935 C ALA 120 17.039 1.396 -9.717 1.00 0.00 ATOM 936 N GLU 121 15.899 2.041 -9.491 1.00 0.00 ATOM 937 CA GLU 121 15.240 2.851 -10.514 1.00 0.00 ATOM 938 CB GLU 121 13.733 2.914 -10.258 1.00 0.00 ATOM 939 CG GLU 121 13.041 1.562 -10.278 1.00 0.00 ATOM 940 CD GLU 121 13.186 0.854 -11.610 1.00 0.00 ATOM 941 OE1 GLU 121 12.927 1.490 -12.653 1.00 0.00 ATOM 942 OE2 GLU 121 13.558 -0.339 -11.612 1.00 0.00 ATOM 943 O GLU 121 15.291 5.146 -11.225 1.00 0.00 ATOM 944 C GLU 121 15.788 4.271 -10.510 1.00 0.00 ATOM 945 N GLY 122 16.810 4.486 -9.687 1.00 0.00 ATOM 946 CA GLY 122 17.463 5.781 -9.554 1.00 0.00 ATOM 947 O GLY 122 16.606 8.025 -9.710 1.00 0.00 ATOM 948 C GLY 122 16.505 6.917 -9.179 1.00 0.00 ATOM 949 N TYR 123 15.580 6.650 -8.261 1.00 0.00 ATOM 950 CA TYR 123 14.639 7.679 -7.830 1.00 0.00 ATOM 951 CB TYR 123 13.321 7.046 -7.382 1.00 0.00 ATOM 952 CG TYR 123 12.512 6.449 -8.510 1.00 0.00 ATOM 953 CD1 TYR 123 12.604 5.098 -8.815 1.00 0.00 ATOM 954 CD2 TYR 123 11.658 7.241 -9.269 1.00 0.00 ATOM 955 CE1 TYR 123 11.867 4.545 -9.845 1.00 0.00 ATOM 956 CE2 TYR 123 10.914 6.705 -10.303 1.00 0.00 ATOM 957 CZ TYR 123 11.026 5.345 -10.588 1.00 0.00 ATOM 958 OH TYR 123 10.293 4.796 -11.614 1.00 0.00 ATOM 959 O TYR 123 15.802 7.881 -5.739 1.00 0.00 ATOM 960 C TYR 123 15.229 8.465 -6.660 1.00 0.00 ATOM 961 N GLY 124 15.090 9.790 -6.707 1.00 0.00 ATOM 962 CA GLY 124 15.616 10.681 -5.670 1.00 0.00 ATOM 963 O GLY 124 15.533 10.746 -3.278 1.00 0.00 ATOM 964 C GLY 124 14.919 10.542 -4.323 1.00 0.00 ATOM 965 N ARG 125 13.631 10.224 -4.331 1.00 0.00 ATOM 966 CA ARG 125 12.933 10.075 -3.068 1.00 0.00 ATOM 967 CB ARG 125 12.358 11.418 -2.611 1.00 0.00 ATOM 968 CG ARG 125 11.302 11.990 -3.543 1.00 0.00 ATOM 969 CD ARG 125 10.807 13.341 -3.051 1.00 0.00 ATOM 970 NE ARG 125 9.737 13.870 -3.894 1.00 0.00 ATOM 971 CZ ARG 125 9.155 15.051 -3.709 1.00 0.00 ATOM 972 NH1 ARG 125 8.190 15.450 -4.526 1.00 0.00 ATOM 973 NH2 ARG 125 9.540 15.830 -2.706 1.00 0.00 ATOM 974 O ARG 125 11.269 8.781 -4.200 1.00 0.00 ATOM 975 C ARG 125 11.775 9.100 -3.129 1.00 0.00 ATOM 976 N MET 126 11.378 8.620 -1.958 1.00 0.00 ATOM 977 CA MET 126 10.295 7.663 -1.833 1.00 0.00 ATOM 978 CB MET 126 10.807 6.346 -1.244 1.00 0.00 ATOM 979 CG MET 126 9.738 5.278 -1.090 1.00 0.00 ATOM 980 SD MET 126 10.419 3.673 -0.627 1.00 0.00 ATOM 981 CE MET 126 8.920 2.715 -0.422 1.00 0.00 ATOM 982 O MET 126 9.616 8.996 0.040 1.00 0.00 ATOM 983 C MET 126 9.262 8.293 -0.906 1.00 0.00 ATOM 984 N LEU 127 7.985 8.065 -1.192 1.00 0.00 ATOM 985 CA LEU 127 6.925 8.669 -0.390 1.00 0.00 ATOM 986 CB LEU 127 6.496 10.008 -0.993 1.00 0.00 ATOM 987 CG LEU 127 7.567 11.098 -1.058 1.00 0.00 ATOM 988 CD1 LEU 127 7.117 12.243 -1.953 1.00 0.00 ATOM 989 CD2 LEU 127 7.846 11.661 0.328 1.00 0.00 ATOM 990 O LEU 127 5.595 6.775 -0.993 1.00 0.00 ATOM 991 C LEU 127 5.692 7.787 -0.309 1.00 0.00 ATOM 992 N VAL 128 4.745 8.202 0.525 1.00 0.00 ATOM 993 CA VAL 128 3.500 7.474 0.689 1.00 0.00 ATOM 994 CB VAL 128 3.696 6.204 1.538 1.00 0.00 ATOM 995 CG1 VAL 128 4.025 6.571 2.977 1.00 0.00 ATOM 996 CG2 VAL 128 2.430 5.361 1.534 1.00 0.00 ATOM 997 O VAL 128 2.819 9.376 1.988 1.00 0.00 ATOM 998 C VAL 128 2.479 8.359 1.380 1.00 0.00 ATOM 999 N TRP 129 1.222 7.957 1.271 1.00 0.00 ATOM 1000 CA TRP 129 0.155 8.682 1.917 1.00 0.00 ATOM 1001 CB TRP 129 -0.933 9.046 0.904 1.00 0.00 ATOM 1002 CG TRP 129 -0.487 10.033 -0.129 1.00 0.00 ATOM 1003 CD1 TRP 129 0.082 9.754 -1.338 1.00 0.00 ATOM 1004 CD2 TRP 129 -0.571 11.462 -0.045 1.00 0.00 ATOM 1005 CE2 TRP 129 -0.034 11.983 -1.239 1.00 0.00 ATOM 1006 CE3 TRP 129 -1.047 12.351 0.923 1.00 0.00 ATOM 1007 NE1 TRP 129 0.359 10.919 -2.013 1.00 0.00 ATOM 1008 CZ2 TRP 129 0.040 13.351 -1.492 1.00 0.00 ATOM 1009 CZ3 TRP 129 -0.972 13.708 0.668 1.00 0.00 ATOM 1010 CH2 TRP 129 -0.435 14.198 -0.527 1.00 0.00 ATOM 1011 O TRP 129 -0.515 6.542 2.730 1.00 0.00 ATOM 1012 C TRP 129 -0.384 7.745 2.983 1.00 0.00 ATOM 1013 N VAL 130 -0.665 8.268 4.176 1.00 0.00 ATOM 1014 CA VAL 130 -1.210 7.439 5.255 1.00 0.00 ATOM 1015 CB VAL 130 -0.103 6.959 6.212 1.00 0.00 ATOM 1016 CG1 VAL 130 -0.693 6.110 7.327 1.00 0.00 ATOM 1017 CG2 VAL 130 0.924 6.124 5.464 1.00 0.00 ATOM 1018 O VAL 130 -2.005 9.285 6.573 1.00 0.00 ATOM 1019 C VAL 130 -2.236 8.170 6.111 1.00 0.00 ATOM 1020 N LEU 131 -3.388 7.532 6.293 1.00 0.00 ATOM 1021 CA LEU 131 -4.479 8.090 7.094 1.00 0.00 ATOM 1022 CB LEU 131 -5.604 7.065 7.256 1.00 0.00 ATOM 1023 CG LEU 131 -6.856 7.544 7.992 1.00 0.00 ATOM 1024 CD1 LEU 131 -7.553 8.644 7.206 1.00 0.00 ATOM 1025 CD2 LEU 131 -7.840 6.398 8.179 1.00 0.00 ATOM 1026 O LEU 131 -3.360 7.649 9.175 1.00 0.00 ATOM 1027 C LEU 131 -3.957 8.472 8.478 1.00 0.00 ATOM 1028 N LYS 132 -4.183 9.719 8.875 1.00 0.00 ATOM 1029 CA LYS 132 -3.698 10.204 10.165 1.00 0.00 ATOM 1030 CB LYS 132 -4.233 11.609 10.445 1.00 0.00 ATOM 1031 CG LYS 132 -3.773 12.196 11.769 1.00 0.00 ATOM 1032 CD LYS 132 -4.281 13.617 11.950 1.00 0.00 ATOM 1033 CE LYS 132 -3.794 14.216 13.259 1.00 0.00 ATOM 1034 NZ LYS 132 -4.305 15.600 13.461 1.00 0.00 ATOM 1035 O LYS 132 -3.387 9.301 12.360 1.00 0.00 ATOM 1036 C LYS 132 -4.106 9.341 11.366 1.00 0.00 ATOM 1037 N GLU 133 -5.241 8.646 11.267 1.00 0.00 ATOM 1038 CA GLU 133 -5.721 7.792 12.358 1.00 0.00 ATOM 1039 CB GLU 133 -7.201 7.455 12.164 1.00 0.00 ATOM 1040 CG GLU 133 -8.130 8.651 12.277 1.00 0.00 ATOM 1041 CD GLU 133 -9.584 8.283 12.057 1.00 0.00 ATOM 1042 OE1 GLU 133 -9.870 7.083 11.865 1.00 0.00 ATOM 1043 OE2 GLU 133 -10.437 9.196 12.077 1.00 0.00 ATOM 1044 O GLU 133 -5.058 5.763 13.463 1.00 0.00 ATOM 1045 C GLU 133 -4.966 6.462 12.455 1.00 0.00 ATOM 1046 N ASN 134 -4.236 6.103 11.407 1.00 0.00 ATOM 1047 CA ASN 134 -3.494 4.849 11.416 1.00 0.00 ATOM 1048 CB ASN 134 -3.192 4.395 9.986 1.00 0.00 ATOM 1049 CG ASN 134 -2.570 3.013 9.932 1.00 0.00 ATOM 1050 ND2 ASN 134 -1.896 2.712 8.830 1.00 0.00 ATOM 1051 OD1 ASN 134 -2.697 2.228 10.871 1.00 0.00 ATOM 1052 O ASN 134 -1.095 5.100 11.567 1.00 0.00 ATOM 1053 C ASN 134 -2.170 5.040 12.166 1.00 0.00 ATOM 1054 N PRO 135 -2.268 5.137 13.491 1.00 0.00 ATOM 1055 CA PRO 135 -1.102 5.340 14.343 1.00 0.00 ATOM 1056 CB PRO 135 -1.683 5.386 15.758 1.00 0.00 ATOM 1057 CG PRO 135 -3.076 5.889 15.573 1.00 0.00 ATOM 1058 CD PRO 135 -3.581 5.261 14.305 1.00 0.00 ATOM 1059 O PRO 135 1.129 4.514 14.299 1.00 0.00 ATOM 1060 C PRO 135 -0.065 4.236 14.238 1.00 0.00 ATOM 1061 N LYS 136 -0.511 2.992 14.094 1.00 0.00 ATOM 1062 CA LYS 136 0.421 1.874 13.975 1.00 0.00 ATOM 1063 CB LYS 136 -0.340 0.551 13.858 1.00 0.00 ATOM 1064 CG LYS 136 -1.045 0.127 15.136 1.00 0.00 ATOM 1065 CD LYS 136 -1.781 -1.190 14.950 1.00 0.00 ATOM 1066 CE LYS 136 -2.508 -1.602 16.219 1.00 0.00 ATOM 1067 NZ LYS 136 -3.263 -2.873 16.041 1.00 0.00 ATOM 1068 O LYS 136 2.517 1.903 12.796 1.00 0.00 ATOM 1069 C LYS 136 1.291 2.045 12.735 1.00 0.00 ATOM 1070 N GLY 137 0.674 2.360 11.602 1.00 0.00 ATOM 1071 CA GLY 137 1.455 2.520 10.372 1.00 0.00 ATOM 1072 O GLY 137 3.504 3.676 9.905 1.00 0.00 ATOM 1073 C GLY 137 2.382 3.733 10.414 1.00 0.00 ATOM 1074 N ARG 138 1.913 4.827 11.005 1.00 0.00 ATOM 1075 CA ARG 138 2.724 6.038 11.105 1.00 0.00 ATOM 1076 CB ARG 138 1.935 7.155 11.790 1.00 0.00 ATOM 1077 CG ARG 138 2.681 8.477 11.878 1.00 0.00 ATOM 1078 CD ARG 138 1.880 9.513 12.648 1.00 0.00 ATOM 1079 NE ARG 138 1.720 9.147 14.055 1.00 0.00 ATOM 1080 CZ ARG 138 2.666 9.291 14.977 1.00 0.00 ATOM 1081 NH1 ARG 138 2.430 8.931 16.231 1.00 0.00 ATOM 1082 NH2 ARG 138 3.845 9.798 14.643 1.00 0.00 ATOM 1083 O ARG 138 5.091 6.122 11.519 1.00 0.00 ATOM 1084 C ARG 138 3.982 5.757 11.922 1.00 0.00 ATOM 1085 N GLY 139 3.809 5.078 13.050 1.00 0.00 ATOM 1086 CA GLY 139 4.928 4.735 13.923 1.00 0.00 ATOM 1087 O GLY 139 7.134 3.984 13.356 1.00 0.00 ATOM 1088 C GLY 139 5.925 3.833 13.196 1.00 0.00 ATOM 1089 N PHE 140 5.408 2.891 12.413 1.00 0.00 ATOM 1090 CA PHE 140 6.246 1.979 11.636 1.00 0.00 ATOM 1091 CB PHE 140 5.382 0.969 10.880 1.00 0.00 ATOM 1092 CG PHE 140 4.701 -0.032 11.769 1.00 0.00 ATOM 1093 CD1 PHE 140 5.084 -0.181 13.090 1.00 0.00 ATOM 1094 CD2 PHE 140 3.675 -0.826 11.284 1.00 0.00 ATOM 1095 CE1 PHE 140 4.459 -1.102 13.908 1.00 0.00 ATOM 1096 CE2 PHE 140 3.049 -1.746 12.101 1.00 0.00 ATOM 1097 CZ PHE 140 3.436 -1.886 13.409 1.00 0.00 ATOM 1098 O PHE 140 8.299 2.662 10.582 1.00 0.00 ATOM 1099 C PHE 140 7.071 2.784 10.629 1.00 0.00 ATOM 1100 N TYR 141 6.402 3.621 9.842 1.00 0.00 ATOM 1101 CA TYR 141 7.100 4.433 8.842 1.00 0.00 ATOM 1102 CB TYR 141 6.115 5.351 8.115 1.00 0.00 ATOM 1103 CG TYR 141 5.234 4.635 7.116 1.00 0.00 ATOM 1104 CD1 TYR 141 3.900 4.379 7.400 1.00 0.00 ATOM 1105 CD2 TYR 141 5.742 4.219 5.891 1.00 0.00 ATOM 1106 CE1 TYR 141 3.088 3.726 6.493 1.00 0.00 ATOM 1107 CE2 TYR 141 4.945 3.566 4.971 1.00 0.00 ATOM 1108 CZ TYR 141 3.608 3.321 5.281 1.00 0.00 ATOM 1109 OH TYR 141 2.801 2.670 4.376 1.00 0.00 ATOM 1110 O TYR 141 9.281 5.449 8.901 1.00 0.00 ATOM 1111 C TYR 141 8.186 5.327 9.456 1.00 0.00 ATOM 1112 N GLU 142 7.884 5.964 10.584 1.00 0.00 ATOM 1113 CA GLU 142 8.867 6.831 11.239 1.00 0.00 ATOM 1114 CB GLU 142 8.257 7.493 12.476 1.00 0.00 ATOM 1115 CG GLU 142 7.211 8.552 12.163 1.00 0.00 ATOM 1116 CD GLU 142 6.542 9.096 13.409 1.00 0.00 ATOM 1117 OE1 GLU 142 6.844 8.594 14.513 1.00 0.00 ATOM 1118 OE2 GLU 142 5.717 10.025 13.283 1.00 0.00 ATOM 1119 O GLU 142 11.222 6.491 11.594 1.00 0.00 ATOM 1120 C GLU 142 10.083 6.021 11.673 1.00 0.00 ATOM 1121 N HIS 143 9.843 4.799 12.131 1.00 0.00 ATOM 1122 CA HIS 143 10.937 3.931 12.548 1.00 0.00 ATOM 1123 CB HIS 143 10.392 2.637 13.157 1.00 0.00 ATOM 1124 CG HIS 143 11.455 1.703 13.642 1.00 0.00 ATOM 1125 CD2 HIS 143 11.970 0.408 13.222 1.00 0.00 ATOM 1126 ND1 HIS 143 12.237 1.974 14.745 1.00 0.00 ATOM 1127 CE1 HIS 143 13.096 0.955 14.932 1.00 0.00 ATOM 1128 NE2 HIS 143 12.942 0.013 14.023 1.00 0.00 ATOM 1129 O HIS 143 13.002 3.501 11.390 1.00 0.00 ATOM 1130 C HIS 143 11.776 3.609 11.310 1.00 0.00 ATOM 1131 N LEU 144 11.118 3.475 10.161 1.00 0.00 ATOM 1132 CA LEU 144 11.827 3.171 8.926 1.00 0.00 ATOM 1133 CB LEU 144 10.865 2.600 7.883 1.00 0.00 ATOM 1134 CG LEU 144 10.190 1.273 8.238 1.00 0.00 ATOM 1135 CD1 LEU 144 9.173 0.887 7.174 1.00 0.00 ATOM 1136 CD2 LEU 144 11.218 0.157 8.341 1.00 0.00 ATOM 1137 O LEU 144 13.042 4.297 7.185 1.00 0.00 ATOM 1138 C LEU 144 12.501 4.394 8.285 1.00 0.00 ATOM 1139 N GLY 145 12.461 5.538 8.959 1.00 0.00 ATOM 1140 CA GLY 145 13.121 6.721 8.433 1.00 0.00 ATOM 1141 O GLY 145 12.835 8.725 7.160 1.00 0.00 ATOM 1142 C GLY 145 12.296 7.732 7.660 1.00 0.00 ATOM 1143 N GLY 146 10.996 7.494 7.552 1.00 0.00 ATOM 1144 CA GLY 146 10.121 8.420 6.839 1.00 0.00 ATOM 1145 O GLY 146 9.595 9.388 8.966 1.00 0.00 ATOM 1146 C GLY 146 9.698 9.568 7.755 1.00 0.00 ATOM 1147 N VAL 147 9.471 10.741 7.169 1.00 0.00 ATOM 1148 CA VAL 147 9.061 11.922 7.922 1.00 0.00 ATOM 1149 CB VAL 147 10.202 12.950 8.026 1.00 0.00 ATOM 1150 CG1 VAL 147 11.381 12.364 8.787 1.00 0.00 ATOM 1151 CG2 VAL 147 10.680 13.358 6.640 1.00 0.00 ATOM 1152 O VAL 147 7.738 12.594 6.026 1.00 0.00 ATOM 1153 C VAL 147 7.875 12.609 7.250 1.00 0.00 ATOM 1154 N LEU 148 7.007 13.212 8.049 1.00 0.00 ATOM 1155 CA LEU 148 5.845 13.890 7.499 1.00 0.00 ATOM 1156 CB LEU 148 4.822 14.178 8.601 1.00 0.00 ATOM 1157 CG LEU 148 3.512 14.831 8.155 1.00 0.00 ATOM 1158 CD1 LEU 148 2.722 13.893 7.257 1.00 0.00 ATOM 1159 CD2 LEU 148 2.647 15.177 9.359 1.00 0.00 ATOM 1160 O LEU 148 6.828 16.082 7.528 1.00 0.00 ATOM 1161 C LEU 148 6.259 15.210 6.863 1.00 0.00 ATOM 1162 N LEU 149 5.969 15.353 5.573 1.00 0.00 ATOM 1163 CA LEU 149 6.309 16.569 4.838 1.00 0.00 ATOM 1164 CB LEU 149 6.979 16.219 3.507 1.00 0.00 ATOM 1165 CG LEU 149 8.276 15.411 3.593 1.00 0.00 ATOM 1166 CD1 LEU 149 8.786 15.065 2.203 1.00 0.00 ATOM 1167 CD2 LEU 149 9.357 16.204 4.312 1.00 0.00 ATOM 1168 O LEU 149 5.153 18.561 4.176 1.00 0.00 ATOM 1169 C LEU 149 5.061 17.390 4.543 1.00 0.00 ATOM 1170 N GLY 150 3.895 16.768 4.695 1.00 0.00 ATOM 1171 CA GLY 150 2.656 17.473 4.440 1.00 0.00 ATOM 1172 O GLY 150 1.538 15.623 5.484 1.00 0.00 ATOM 1173 C GLY 150 1.434 16.718 4.933 1.00 0.00 ATOM 1174 N GLU 151 0.267 17.312 4.732 1.00 0.00 ATOM 1175 CA GLU 151 -0.982 16.701 5.155 1.00 0.00 ATOM 1176 CB GLU 151 -1.161 16.840 6.667 1.00 0.00 ATOM 1177 CG GLU 151 -2.407 16.160 7.211 1.00 0.00 ATOM 1178 CD GLU 151 -2.544 16.308 8.714 1.00 0.00 ATOM 1179 OE1 GLU 151 -1.672 16.958 9.328 1.00 0.00 ATOM 1180 OE2 GLU 151 -3.523 15.775 9.275 1.00 0.00 ATOM 1181 O GLU 151 -2.098 18.646 4.330 1.00 0.00 ATOM 1182 C GLU 151 -2.105 17.419 4.431 1.00 0.00 ATOM 1183 N ARG 152 -3.065 16.656 3.919 1.00 0.00 ATOM 1184 CA ARG 152 -4.192 17.245 3.214 1.00 0.00 ATOM 1185 CB ARG 152 -3.937 17.244 1.706 1.00 0.00 ATOM 1186 CG ARG 152 -2.789 18.139 1.269 1.00 0.00 ATOM 1187 CD ARG 152 -2.643 18.152 -0.245 1.00 0.00 ATOM 1188 NE ARG 152 -1.573 19.044 -0.684 1.00 0.00 ATOM 1189 CZ ARG 152 -1.272 19.280 -1.957 1.00 0.00 ATOM 1190 NH1 ARG 152 -0.282 20.107 -2.262 1.00 0.00 ATOM 1191 NH2 ARG 152 -1.963 18.689 -2.921 1.00 0.00 ATOM 1192 O ARG 152 -5.351 15.262 3.889 1.00 0.00 ATOM 1193 C ARG 152 -5.438 16.432 3.512 1.00 0.00 ATOM 1194 N GLU 153 -6.599 17.057 3.367 1.00 0.00 ATOM 1195 CA GLU 153 -7.848 16.364 3.640 1.00 0.00 ATOM 1196 CB GLU 153 -8.963 17.368 3.941 1.00 0.00 ATOM 1197 CG GLU 153 -8.740 18.182 5.205 1.00 0.00 ATOM 1198 CD GLU 153 -9.885 19.133 5.494 1.00 0.00 ATOM 1199 OE1 GLU 153 -10.828 19.194 4.677 1.00 0.00 ATOM 1200 OE2 GLU 153 -9.837 19.819 6.538 1.00 0.00 ATOM 1201 O GLU 153 -7.951 15.826 1.303 1.00 0.00 ATOM 1202 C GLU 153 -8.286 15.519 2.449 1.00 0.00 ATOM 1203 N ILE 154 -9.016 14.441 2.731 1.00 0.00 ATOM 1204 CA ILE 154 -9.553 13.565 1.693 1.00 0.00 ATOM 1205 CB ILE 154 -8.594 12.400 1.388 1.00 0.00 ATOM 1206 CG1 ILE 154 -9.034 11.664 0.120 1.00 0.00 ATOM 1207 CG2 ILE 154 -8.576 11.407 2.540 1.00 0.00 ATOM 1208 CD1 ILE 154 -7.975 10.752 -0.456 1.00 0.00 ATOM 1209 O ILE 154 -11.104 12.963 3.409 1.00 0.00 ATOM 1210 C ILE 154 -10.877 13.013 2.203 1.00 0.00 ATOM 1211 N GLU 155 -11.751 12.610 1.285 1.00 0.00 ATOM 1212 CA GLU 155 -13.055 12.074 1.659 1.00 0.00 ATOM 1213 CB GLU 155 -14.093 12.389 0.581 1.00 0.00 ATOM 1214 CG GLU 155 -15.488 11.874 0.895 1.00 0.00 ATOM 1215 CD GLU 155 -16.486 12.189 -0.202 1.00 0.00 ATOM 1216 OE1 GLU 155 -16.085 12.809 -1.210 1.00 0.00 ATOM 1217 OE2 GLU 155 -17.669 11.817 -0.054 1.00 0.00 ATOM 1218 O GLU 155 -12.702 9.810 0.940 1.00 0.00 ATOM 1219 C GLU 155 -13.061 10.559 1.849 1.00 0.00 ATOM 1220 N LEU 156 -13.456 10.125 3.042 1.00 0.00 ATOM 1221 CA LEU 156 -13.568 8.706 3.359 1.00 0.00 ATOM 1222 CB LEU 156 -12.777 8.376 4.626 1.00 0.00 ATOM 1223 CG LEU 156 -12.834 6.923 5.101 1.00 0.00 ATOM 1224 CD1 LEU 156 -12.236 5.991 4.058 1.00 0.00 ATOM 1225 CD2 LEU 156 -12.056 6.749 6.396 1.00 0.00 ATOM 1226 O LEU 156 -15.647 8.938 4.546 1.00 0.00 ATOM 1227 C LEU 156 -15.065 8.475 3.560 1.00 0.00 ATOM 1228 N GLY 157 -15.689 7.779 2.619 1.00 0.00 ATOM 1229 CA GLY 157 -17.116 7.539 2.718 1.00 0.00 ATOM 1230 O GLY 157 -17.977 9.186 1.222 1.00 0.00 ATOM 1231 C GLY 157 -17.863 8.817 2.389 1.00 0.00 ATOM 1232 N GLY 158 -18.364 9.498 3.417 1.00 0.00 ATOM 1233 CA GLY 158 -19.100 10.743 3.230 1.00 0.00 ATOM 1234 O GLY 158 -19.172 12.871 4.337 1.00 0.00 ATOM 1235 C GLY 158 -18.556 11.822 4.163 1.00 0.00 ATOM 1236 N ALA 159 -17.395 11.560 4.755 1.00 0.00 ATOM 1237 CA ALA 159 -16.779 12.500 5.693 1.00 0.00 ATOM 1238 CB ALA 159 -16.891 11.978 7.118 1.00 0.00 ATOM 1239 O ALA 159 -14.619 11.812 4.909 1.00 0.00 ATOM 1240 C ALA 159 -15.296 12.714 5.390 1.00 0.00 ATOM 1241 N LYS 160 -14.786 13.908 5.673 1.00 0.00 ATOM 1242 CA LYS 160 -13.381 14.177 5.413 1.00 0.00 ATOM 1243 CB LYS 160 -13.133 15.684 5.323 1.00 0.00 ATOM 1244 CG LYS 160 -13.775 16.347 4.114 1.00 0.00 ATOM 1245 CD LYS 160 -13.472 17.836 4.076 1.00 0.00 ATOM 1246 CE LYS 160 -14.101 18.496 2.860 1.00 0.00 ATOM 1247 NZ LYS 160 -13.825 19.959 2.816 1.00 0.00 ATOM 1248 O LYS 160 -12.820 13.596 7.688 1.00 0.00 ATOM 1249 C LYS 160 -12.466 13.633 6.503 1.00 0.00 ATOM 1250 N LEU 161 -11.290 13.186 6.073 1.00 0.00 ATOM 1251 CA LEU 161 -10.271 12.667 6.968 1.00 0.00 ATOM 1252 CB LEU 161 -10.185 11.143 6.857 1.00 0.00 ATOM 1253 CG LEU 161 -11.454 10.366 7.217 1.00 0.00 ATOM 1254 CD1 LEU 161 -11.296 8.893 6.874 1.00 0.00 ATOM 1255 CD2 LEU 161 -11.748 10.479 8.705 1.00 0.00 ATOM 1256 O LEU 161 -8.901 14.004 5.543 1.00 0.00 ATOM 1257 C LEU 161 -8.955 13.299 6.548 1.00 0.00 ATOM 1258 N TRP 162 -7.897 13.062 7.314 1.00 0.00 ATOM 1259 CA TRP 162 -6.600 13.643 6.985 1.00 0.00 ATOM 1260 CB TRP 162 -5.994 14.330 8.210 1.00 0.00 ATOM 1261 CG TRP 162 -6.726 15.570 8.625 1.00 0.00 ATOM 1262 CD1 TRP 162 -7.759 15.652 9.512 1.00 0.00 ATOM 1263 CD2 TRP 162 -6.476 16.907 8.171 1.00 0.00 ATOM 1264 CE2 TRP 162 -7.400 17.747 8.824 1.00 0.00 ATOM 1265 CE3 TRP 162 -5.566 17.474 7.276 1.00 0.00 ATOM 1266 NE1 TRP 162 -8.172 16.957 9.639 1.00 0.00 ATOM 1267 CZ2 TRP 162 -7.437 19.124 8.611 1.00 0.00 ATOM 1268 CZ3 TRP 162 -5.606 18.840 7.068 1.00 0.00 ATOM 1269 CH2 TRP 162 -6.533 19.651 7.730 1.00 0.00 ATOM 1270 O TRP 162 -5.462 11.527 7.110 1.00 0.00 ATOM 1271 C TRP 162 -5.607 12.589 6.507 1.00 0.00 ATOM 1272 N GLU 163 -4.946 12.896 5.402 1.00 0.00 ATOM 1273 CA GLU 163 -3.951 12.019 4.801 1.00 0.00 ATOM 1274 CB GLU 163 -4.197 11.882 3.297 1.00 0.00 ATOM 1275 CG GLU 163 -5.460 11.113 2.943 1.00 0.00 ATOM 1276 CD GLU 163 -5.401 9.663 3.382 1.00 0.00 ATOM 1277 OE1 GLU 163 -4.406 8.982 3.055 1.00 0.00 ATOM 1278 OE2 GLU 163 -6.351 9.207 4.053 1.00 0.00 ATOM 1279 O GLU 163 -2.379 13.810 4.700 1.00 0.00 ATOM 1280 C GLU 163 -2.589 12.660 5.062 1.00 0.00 ATOM 1281 N VAL 164 -1.670 11.934 5.690 1.00 0.00 ATOM 1282 CA VAL 164 -0.347 12.489 5.949 1.00 0.00 ATOM 1283 CB VAL 164 0.220 11.992 7.292 1.00 0.00 ATOM 1284 CG1 VAL 164 1.629 12.524 7.503 1.00 0.00 ATOM 1285 CG2 VAL 164 -0.651 12.464 8.445 1.00 0.00 ATOM 1286 O VAL 164 0.616 10.894 4.425 1.00 0.00 ATOM 1287 C VAL 164 0.600 12.063 4.831 1.00 0.00 ATOM 1288 N ALA 165 1.371 13.012 4.315 1.00 0.00 ATOM 1289 CA ALA 165 2.332 12.711 3.263 1.00 0.00 ATOM 1290 CB ALA 165 2.404 13.858 2.266 1.00 0.00 ATOM 1291 O ALA 165 4.157 13.431 4.640 1.00 0.00 ATOM 1292 C ALA 165 3.666 12.521 3.975 1.00 0.00 ATOM 1293 N TYR 166 4.242 11.333 3.839 1.00 0.00 ATOM 1294 CA TYR 166 5.503 11.021 4.487 1.00 0.00 ATOM 1295 CB TYR 166 5.329 9.861 5.469 1.00 0.00 ATOM 1296 CG TYR 166 4.417 10.176 6.633 1.00 0.00 ATOM 1297 CD1 TYR 166 3.057 9.903 6.564 1.00 0.00 ATOM 1298 CD2 TYR 166 4.919 10.744 7.796 1.00 0.00 ATOM 1299 CE1 TYR 166 2.215 10.188 7.623 1.00 0.00 ATOM 1300 CE2 TYR 166 4.094 11.034 8.866 1.00 0.00 ATOM 1301 CZ TYR 166 2.732 10.751 8.770 1.00 0.00 ATOM 1302 OH TYR 166 1.896 11.035 9.826 1.00 0.00 ATOM 1303 O TYR 166 6.185 9.967 2.445 1.00 0.00 ATOM 1304 C TYR 166 6.521 10.630 3.425 1.00 0.00 ATOM 1305 N GLY 167 7.765 11.046 3.614 1.00 0.00 ATOM 1306 CA GLY 167 8.769 10.763 2.613 1.00 0.00 ATOM 1307 O GLY 167 10.425 10.929 4.332 1.00 0.00 ATOM 1308 C GLY 167 10.174 10.654 3.162 1.00 0.00 ATOM 1309 N PHE 168 11.086 10.257 2.283 1.00 0.00 ATOM 1310 CA PHE 168 12.485 10.123 2.628 1.00 0.00 ATOM 1311 CB PHE 168 12.764 8.732 3.202 1.00 0.00 ATOM 1312 CG PHE 168 14.201 8.510 3.580 1.00 0.00 ATOM 1313 CD1 PHE 168 14.689 8.956 4.795 1.00 0.00 ATOM 1314 CD2 PHE 168 15.065 7.855 2.718 1.00 0.00 ATOM 1315 CE1 PHE 168 16.012 8.750 5.142 1.00 0.00 ATOM 1316 CE2 PHE 168 16.386 7.651 3.066 1.00 0.00 ATOM 1317 CZ PHE 168 16.861 8.095 4.271 1.00 0.00 ATOM 1318 O PHE 168 12.946 9.829 0.288 1.00 0.00 ATOM 1319 C PHE 168 13.297 10.329 1.362 1.00 0.00 ATOM 1320 N ASP 169 14.380 11.085 1.493 1.00 0.00 ATOM 1321 CA ASP 169 15.255 11.354 0.370 1.00 0.00 ATOM 1322 CB ASP 169 15.968 12.695 0.554 1.00 0.00 ATOM 1323 CG ASP 169 15.030 13.877 0.409 1.00 0.00 ATOM 1324 OD1 ASP 169 13.906 13.686 -0.101 1.00 0.00 ATOM 1325 OD2 ASP 169 15.418 14.996 0.807 1.00 0.00 ATOM 1326 O ASP 169 16.838 9.819 1.297 1.00 0.00 ATOM 1327 C ASP 169 16.286 10.242 0.285 1.00 0.00 ATOM 1328 N LEU 170 16.528 9.757 -0.924 1.00 0.00 ATOM 1329 CA LEU 170 17.483 8.677 -1.134 1.00 0.00 ATOM 1330 CB LEU 170 16.907 7.629 -2.088 1.00 0.00 ATOM 1331 CG LEU 170 15.633 6.918 -1.623 1.00 0.00 ATOM 1332 CD1 LEU 170 15.106 5.994 -2.710 1.00 0.00 ATOM 1333 CD2 LEU 170 15.906 6.084 -0.380 1.00 0.00 ATOM 1334 O LEU 170 19.285 10.258 -1.348 1.00 0.00 ATOM 1335 C LEU 170 18.786 9.203 -1.740 1.00 0.00 ATOM 1336 N GLY 171 19.326 8.463 -2.703 1.00 0.00 ATOM 1337 CA GLY 171 20.569 8.834 -3.365 1.00 0.00 ATOM 1338 O GLY 171 19.465 10.105 -5.073 1.00 0.00 ATOM 1339 C GLY 171 20.392 10.050 -4.269 1.00 0.00 ATOM 1340 N GLY 172 21.287 11.023 -4.137 1.00 0.00 ATOM 1341 CA GLY 172 21.215 12.228 -4.958 1.00 0.00 ATOM 1342 O GLY 172 22.481 13.238 -6.731 1.00 0.00 ATOM 1343 C GLY 172 22.442 12.375 -5.856 1.00 0.00 TER END