PFRMAT TS TARGET T0234 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 METHOD This is try9-opt2, our best-scoring model with the undertaker cost function. REMARK 6 REMARK 6 T0234 model 1 Mon Jul 19 21:17:05 2004 MODEL 1 PARENT 1dnl_A 1g79_A 1nrg_A 1axj 1flm_A REMARK 7 REMARK 7 ALLPARENTS 1dnl_A 1g79_A 1nrg_A 1axj 1flm_A 1ci0_A ATOM 1 N MET 1 3.834 -12.628 24.310 1.00 0.00 ATOM 2 CA MET 1 4.247 -11.364 24.911 1.00 0.00 ATOM 3 CB MET 1 4.883 -10.477 23.820 1.00 0.00 ATOM 4 CG MET 1 6.240 -11.153 23.106 1.00 0.00 ATOM 5 SD MET 1 7.683 -10.986 24.007 1.00 0.00 ATOM 6 CE MET 1 7.981 -9.330 23.933 1.00 0.00 ATOM 7 O MET 1 1.867 -11.226 25.063 1.00 0.00 ATOM 8 C MET 1 2.941 -11.141 25.663 1.00 0.00 ATOM 9 N SER 2 3.024 -10.953 26.983 1.00 0.00 ATOM 10 CA SER 2 1.843 -10.760 27.809 1.00 0.00 ATOM 11 CB SER 2 2.006 -11.215 29.260 1.00 0.00 ATOM 12 OG SER 2 2.965 -10.422 29.938 1.00 0.00 ATOM 13 O SER 2 0.400 -8.912 28.321 1.00 0.00 ATOM 14 C SER 2 1.467 -9.280 27.830 1.00 0.00 ATOM 15 N GLN 3 2.403 -8.412 27.445 1.00 0.00 ATOM 16 CA GLN 3 2.135 -6.983 27.386 1.00 0.00 ATOM 17 CB GLN 3 3.296 -6.196 27.997 1.00 0.00 ATOM 18 CG GLN 3 3.560 -6.516 29.460 1.00 0.00 ATOM 19 CD GLN 3 2.393 -6.149 30.356 1.00 0.00 ATOM 20 OE1 GLN 3 1.919 -5.012 30.340 1.00 0.00 ATOM 21 NE2 GLN 3 1.926 -7.113 31.140 1.00 0.00 ATOM 22 O GLN 3 2.533 -6.910 25.045 1.00 0.00 ATOM 23 C GLN 3 1.861 -6.452 25.968 1.00 0.00 ATOM 24 N LEU 4 0.954 -5.475 25.759 1.00 0.00 ATOM 25 CA LEU 4 0.835 -4.783 24.469 1.00 0.00 ATOM 26 CB LEU 4 -0.301 -3.776 24.544 1.00 0.00 ATOM 27 CG LEU 4 -1.678 -4.352 24.227 1.00 0.00 ATOM 28 CD1 LEU 4 -2.770 -3.385 24.671 1.00 0.00 ATOM 29 CD2 LEU 4 -1.805 -4.675 22.750 1.00 0.00 ATOM 30 O LEU 4 2.585 -4.054 22.988 1.00 0.00 ATOM 31 C LEU 4 2.130 -4.038 24.133 1.00 0.00 ATOM 32 N GLU 5 2.758 -3.440 25.137 1.00 0.00 ATOM 33 CA GLU 5 3.982 -2.675 24.947 1.00 0.00 ATOM 34 CB GLU 5 4.434 -2.381 26.594 1.00 0.00 ATOM 35 CG GLU 5 3.307 -2.510 27.615 1.00 0.00 ATOM 36 CD GLU 5 2.765 -1.121 27.929 1.00 0.00 ATOM 37 OE1 GLU 5 1.840 -0.667 27.234 1.00 0.00 ATOM 38 OE2 GLU 5 3.285 -0.488 28.878 1.00 0.00 ATOM 39 O GLU 5 5.933 -3.208 23.654 1.00 0.00 ATOM 40 C GLU 5 5.135 -3.578 24.517 1.00 0.00 ATOM 41 N LYS 6 5.230 -4.773 25.107 1.00 0.00 ATOM 42 CA LYS 6 6.289 -5.716 24.767 1.00 0.00 ATOM 43 CB LYS 6 6.224 -6.931 25.696 1.00 0.00 ATOM 44 CG LYS 6 6.692 -6.649 27.117 1.00 0.00 ATOM 45 CD LYS 6 6.603 -7.895 27.984 1.00 0.00 ATOM 46 CE LYS 6 7.049 -7.607 29.409 1.00 0.00 ATOM 47 NZ LYS 6 6.937 -8.810 30.277 1.00 0.00 ATOM 48 O LYS 6 7.076 -6.303 22.558 1.00 0.00 ATOM 49 C LYS 6 6.109 -6.213 23.320 1.00 0.00 ATOM 50 N ALA 7 4.932 -6.516 22.953 1.00 0.00 ATOM 51 CA ALA 7 4.631 -7.018 21.610 1.00 0.00 ATOM 52 CB ALA 7 3.168 -7.414 21.499 1.00 0.00 ATOM 53 O ALA 7 5.618 -6.215 19.570 1.00 0.00 ATOM 54 C ALA 7 4.941 -5.947 20.563 1.00 0.00 ATOM 55 N GLN 8 4.446 -4.670 20.807 1.00 0.00 ATOM 56 CA GLN 8 4.693 -3.555 19.898 1.00 0.00 ATOM 57 CB GLN 8 3.407 -2.571 20.170 1.00 0.00 ATOM 58 CG GLN 8 2.093 -2.861 19.497 1.00 0.00 ATOM 59 CD GLN 8 1.058 -1.793 19.821 1.00 0.00 ATOM 60 OE1 GLN 8 0.842 -0.861 19.037 1.00 0.00 ATOM 61 NE2 GLN 8 0.422 -1.916 20.988 1.00 0.00 ATOM 62 O GLN 8 6.429 -2.234 18.917 1.00 0.00 ATOM 63 C GLN 8 6.072 -2.901 19.885 1.00 0.00 ATOM 64 N ALA 9 6.817 -3.054 20.961 1.00 0.00 ATOM 65 CA ALA 9 8.141 -2.450 21.057 1.00 0.00 ATOM 66 CB ALA 9 8.801 -2.784 22.386 1.00 0.00 ATOM 67 O ALA 9 9.740 -2.152 19.297 1.00 0.00 ATOM 68 C ALA 9 9.045 -2.950 19.929 1.00 0.00 ATOM 69 N GLU 10 8.870 -4.205 19.527 1.00 0.00 ATOM 70 CA GLU 10 9.675 -4.792 18.457 1.00 0.00 ATOM 71 CB GLU 10 9.500 -6.258 18.399 1.00 0.00 ATOM 72 CG GLU 10 10.214 -6.969 19.528 1.00 0.00 ATOM 73 CD GLU 10 10.071 -8.472 19.614 1.00 0.00 ATOM 74 OE1 GLU 10 9.187 -9.046 18.940 1.00 0.00 ATOM 75 OE2 GLU 10 10.900 -9.060 20.374 1.00 0.00 ATOM 76 O GLU 10 10.057 -3.867 16.270 1.00 0.00 ATOM 77 C GLU 10 9.232 -4.241 17.106 1.00 0.00 ATOM 78 N TYR 11 7.910 -4.180 16.936 1.00 0.00 ATOM 79 CA TYR 11 7.355 -3.665 15.681 1.00 0.00 ATOM 80 CB TYR 11 5.862 -3.658 15.661 1.00 0.00 ATOM 81 CG TYR 11 5.222 -5.027 15.844 1.00 0.00 ATOM 82 CD1 TYR 11 5.908 -6.203 15.499 1.00 0.00 ATOM 83 CD2 TYR 11 3.927 -5.101 16.357 1.00 0.00 ATOM 84 CE1 TYR 11 5.296 -7.448 15.671 1.00 0.00 ATOM 85 CE2 TYR 11 3.315 -6.344 16.524 1.00 0.00 ATOM 86 CZ TYR 11 4.004 -7.503 16.181 1.00 0.00 ATOM 87 OH TYR 11 3.405 -8.726 16.351 1.00 0.00 ATOM 88 O TYR 11 7.919 -1.819 14.232 1.00 0.00 ATOM 89 C TYR 11 7.786 -2.221 15.391 1.00 0.00 ATOM 90 N ALA 12 8.097 -1.452 16.435 1.00 0.00 ATOM 91 CA ALA 12 8.500 -0.069 16.187 1.00 0.00 ATOM 92 CB ALA 12 9.127 0.470 17.631 1.00 0.00 ATOM 93 O ALA 12 10.070 0.976 14.718 1.00 0.00 ATOM 94 C ALA 12 9.820 0.016 15.448 1.00 0.00 ATOM 95 N GLY 13 10.652 -1.004 15.608 1.00 0.00 ATOM 96 CA GLY 13 11.921 -1.045 14.899 1.00 0.00 ATOM 97 O GLY 13 12.167 -0.314 12.577 1.00 0.00 ATOM 98 C GLY 13 11.576 -1.060 13.402 1.00 0.00 ATOM 99 N PHE 14 10.633 -1.903 13.016 1.00 0.00 ATOM 100 CA PHE 14 10.245 -2.013 11.629 1.00 0.00 ATOM 101 CB PHE 14 9.296 -3.198 11.429 1.00 0.00 ATOM 102 CG PHE 14 9.947 -4.538 11.631 1.00 0.00 ATOM 103 CD1 PHE 14 11.325 -4.663 11.613 1.00 0.00 ATOM 104 CD2 PHE 14 9.181 -5.671 11.839 1.00 0.00 ATOM 105 CE1 PHE 14 11.922 -5.894 11.800 1.00 0.00 ATOM 106 CE2 PHE 14 9.777 -6.901 12.025 1.00 0.00 ATOM 107 CZ PHE 14 11.145 -7.017 12.005 1.00 0.00 ATOM 108 O PHE 14 9.742 -0.273 10.062 1.00 0.00 ATOM 109 C PHE 14 9.524 -0.750 11.175 1.00 0.00 ATOM 110 N ILE 15 8.681 -0.205 12.030 1.00 0.00 ATOM 111 CA ILE 15 7.979 1.026 11.693 1.00 0.00 ATOM 112 CB ILE 15 6.902 1.358 12.741 1.00 0.00 ATOM 113 CG1 ILE 15 5.778 0.322 12.646 1.00 0.00 ATOM 114 CG2 ILE 15 6.366 2.778 12.531 1.00 0.00 ATOM 115 CD1 ILE 15 4.709 0.456 13.719 1.00 0.00 ATOM 116 O ILE 15 8.904 2.958 10.586 1.00 0.00 ATOM 117 C ILE 15 8.992 2.166 11.537 1.00 0.00 ATOM 118 N GLN 16 9.997 2.204 12.398 1.00 0.00 ATOM 119 CA GLN 16 11.015 3.254 12.308 1.00 0.00 ATOM 120 CB GLN 16 11.667 3.308 13.803 1.00 0.00 ATOM 121 CG GLN 16 10.750 3.635 14.963 1.00 0.00 ATOM 122 CD GLN 16 11.455 3.501 16.301 1.00 0.00 ATOM 123 OE1 GLN 16 12.569 2.978 16.383 1.00 0.00 ATOM 124 NE2 GLN 16 10.803 3.962 17.360 1.00 0.00 ATOM 125 O GLN 16 12.577 4.079 10.695 1.00 0.00 ATOM 126 C GLN 16 11.909 3.125 11.087 1.00 0.00 ATOM 127 N GLU 17 11.940 1.935 10.476 1.00 0.00 ATOM 128 CA GLU 17 12.767 1.737 9.299 1.00 0.00 ATOM 129 CB GLU 17 12.598 0.310 8.775 1.00 0.00 ATOM 130 CG GLU 17 13.621 -0.102 7.728 1.00 0.00 ATOM 131 CD GLU 17 13.889 -1.595 7.752 1.00 0.00 ATOM 132 OE1 GLU 17 14.011 -2.161 8.861 1.00 0.00 ATOM 133 OE2 GLU 17 13.994 -2.202 6.667 1.00 0.00 ATOM 134 O GLU 17 13.265 3.353 7.608 1.00 0.00 ATOM 135 C GLU 17 12.412 2.650 8.136 1.00 0.00 ATOM 136 N PHE 18 11.012 2.526 7.736 1.00 0.00 ATOM 137 CA PHE 18 10.570 3.295 6.569 1.00 0.00 ATOM 138 CB PHE 18 10.299 2.316 5.466 1.00 0.00 ATOM 139 CG PHE 18 11.575 2.044 4.746 1.00 0.00 ATOM 140 CD1 PHE 18 12.104 2.980 3.865 1.00 0.00 ATOM 141 CD2 PHE 18 12.268 0.855 4.963 1.00 0.00 ATOM 142 CE1 PHE 18 13.301 2.730 3.210 1.00 0.00 ATOM 143 CE2 PHE 18 13.465 0.597 4.312 1.00 0.00 ATOM 144 CZ PHE 18 13.983 1.536 3.434 1.00 0.00 ATOM 145 O PHE 18 8.633 2.477 7.783 1.00 0.00 ATOM 146 C PHE 18 9.263 3.456 7.376 1.00 0.00 ATOM 147 N GLN 19 8.858 4.703 7.603 1.00 0.00 ATOM 148 CA GLN 19 7.643 4.953 8.361 1.00 0.00 ATOM 149 CB GLN 19 8.226 6.369 9.296 1.00 0.00 ATOM 150 CG GLN 19 9.749 6.550 9.335 1.00 0.00 ATOM 151 CD GLN 19 10.158 7.970 9.763 1.00 0.00 ATOM 152 OE1 GLN 19 9.382 8.680 10.419 1.00 0.00 ATOM 153 NE2 GLN 19 11.354 8.432 9.287 1.00 0.00 ATOM 154 O GLN 19 5.282 5.223 8.015 1.00 0.00 ATOM 155 C GLN 19 6.383 5.023 7.498 1.00 0.00 ATOM 156 N SER 20 6.525 4.824 6.194 1.00 0.00 ATOM 157 CA SER 20 5.366 4.885 5.309 1.00 0.00 ATOM 158 CB SER 20 5.812 4.916 3.847 1.00 0.00 ATOM 159 OG SER 20 4.693 4.911 2.974 1.00 0.00 ATOM 160 O SER 20 4.939 2.580 5.810 1.00 0.00 ATOM 161 C SER 20 4.470 3.680 5.512 1.00 0.00 ATOM 162 N ALA 21 3.182 3.870 5.342 1.00 0.00 ATOM 163 CA ALA 21 2.227 2.793 5.504 1.00 0.00 ATOM 164 CB ALA 21 1.918 2.585 6.968 1.00 0.00 ATOM 165 O ALA 21 0.552 4.275 4.619 1.00 0.00 ATOM 166 C ALA 21 0.922 3.110 4.775 1.00 0.00 ATOM 167 N ILE 22 0.231 2.074 4.321 1.00 0.00 ATOM 168 CA ILE 22 -1.037 2.285 3.635 1.00 0.00 ATOM 169 CB ILE 22 -1.281 1.180 2.583 1.00 0.00 ATOM 170 CG1 ILE 22 -0.113 1.163 1.594 1.00 0.00 ATOM 171 CG2 ILE 22 -2.603 1.415 1.861 1.00 0.00 ATOM 172 CD1 ILE 22 -0.172 0.049 0.554 1.00 0.00 ATOM 173 O ILE 22 -2.337 1.230 5.391 1.00 0.00 ATOM 174 C ILE 22 -2.168 2.230 4.674 1.00 0.00 ATOM 175 N ILE 23 -2.924 3.316 4.769 1.00 0.00 ATOM 176 CA ILE 23 -4.022 3.348 5.718 1.00 0.00 ATOM 177 CB ILE 23 -4.114 4.707 6.430 1.00 0.00 ATOM 178 CG1 ILE 23 -2.791 5.037 7.124 1.00 0.00 ATOM 179 CG2 ILE 23 -5.216 4.687 7.478 1.00 0.00 ATOM 180 CD1 ILE 23 -2.380 4.019 8.167 1.00 0.00 ATOM 181 O ILE 23 -5.615 3.788 4.007 1.00 0.00 ATOM 182 C ILE 23 -5.307 3.098 4.968 1.00 0.00 ATOM 183 N SER 24 -6.053 2.104 5.408 1.00 0.00 ATOM 184 CA SER 24 -7.321 1.807 4.782 1.00 0.00 ATOM 185 CB SER 24 -7.442 0.307 4.501 1.00 0.00 ATOM 186 OG SER 24 -8.721 -0.012 3.983 1.00 0.00 ATOM 187 O SER 24 -8.338 1.990 6.953 1.00 0.00 ATOM 188 C SER 24 -8.415 2.244 5.739 1.00 0.00 ATOM 189 N THR 25 -9.415 2.929 5.192 1.00 0.00 ATOM 190 CA THR 25 -10.575 3.383 5.955 1.00 0.00 ATOM 191 CB THR 25 -10.576 4.915 6.120 1.00 0.00 ATOM 192 CG2 THR 25 -9.275 5.385 6.754 1.00 0.00 ATOM 193 OG1 THR 25 -10.714 5.534 4.833 1.00 0.00 ATOM 194 O THR 25 -11.628 2.447 3.995 1.00 0.00 ATOM 195 C THR 25 -11.784 2.915 5.135 1.00 0.00 ATOM 196 N ILE 26 -12.982 3.063 5.691 1.00 0.00 ATOM 197 CA ILE 26 -14.206 2.618 5.031 1.00 0.00 ATOM 198 CB ILE 26 -14.813 1.387 5.735 1.00 0.00 ATOM 199 CG1 ILE 26 -13.823 0.218 5.706 1.00 0.00 ATOM 200 CG2 ILE 26 -16.094 0.954 5.043 1.00 0.00 ATOM 201 CD1 ILE 26 -14.251 -0.961 6.553 1.00 0.00 ATOM 202 O ILE 26 -15.567 4.301 6.080 1.00 0.00 ATOM 203 C ILE 26 -15.276 3.710 5.031 1.00 0.00 ATOM 204 N SER 27 -15.878 3.979 3.875 1.00 0.00 ATOM 205 CA SER 27 -16.897 5.021 3.845 1.00 0.00 ATOM 206 CB SER 27 -17.078 5.554 2.422 1.00 0.00 ATOM 207 OG SER 27 -17.654 4.568 1.579 1.00 0.00 ATOM 208 O SER 27 -18.360 3.328 4.683 1.00 0.00 ATOM 209 C SER 27 -18.249 4.493 4.327 1.00 0.00 ATOM 210 N GLU 28 -19.268 5.355 4.344 1.00 0.00 ATOM 211 CA GLU 28 -20.612 4.976 4.817 1.00 0.00 ATOM 212 CB GLU 28 -21.550 6.185 4.791 1.00 0.00 ATOM 213 CG GLU 28 -21.242 7.227 5.853 1.00 0.00 ATOM 214 CD GLU 28 -22.131 8.449 5.741 1.00 0.00 ATOM 215 OE1 GLU 28 -22.930 8.519 4.783 1.00 0.00 ATOM 216 OE2 GLU 28 -22.032 9.339 6.612 1.00 0.00 ATOM 217 O GLU 28 -22.230 3.237 4.501 1.00 0.00 ATOM 218 C GLU 28 -21.290 3.868 4.017 1.00 0.00 ATOM 219 N GLN 29 -20.824 3.593 2.784 1.00 0.00 ATOM 220 CA GLN 29 -21.422 2.546 1.968 1.00 0.00 ATOM 221 CB GLN 29 -21.425 2.972 0.514 1.00 0.00 ATOM 222 CG GLN 29 -22.223 4.272 0.366 1.00 0.00 ATOM 223 CD GLN 29 -22.183 4.703 -1.095 1.00 0.00 ATOM 224 OE1 GLN 29 -21.152 4.616 -1.763 1.00 0.00 ATOM 225 NE2 GLN 29 -23.322 5.139 -1.617 1.00 0.00 ATOM 226 O GLN 29 -20.909 0.320 1.257 1.00 0.00 ATOM 227 C GLN 29 -20.644 1.239 2.034 1.00 0.00 ATOM 228 N GLY 30 -19.708 1.118 2.946 1.00 0.00 ATOM 229 CA GLY 30 -18.929 -0.107 3.096 1.00 0.00 ATOM 230 O GLY 30 -17.194 -1.151 1.826 1.00 0.00 ATOM 231 C GLY 30 -17.806 -0.114 2.077 1.00 0.00 ATOM 232 N ILE 31 -17.573 1.041 1.535 1.00 0.00 ATOM 233 CA ILE 31 -16.516 1.169 0.542 1.00 0.00 ATOM 234 CB ILE 31 -16.784 2.311 -0.467 1.00 0.00 ATOM 235 CG1 ILE 31 -18.104 2.073 -1.201 1.00 0.00 ATOM 236 CG2 ILE 31 -15.639 2.423 -1.467 1.00 0.00 ATOM 237 CD1 ILE 31 -18.418 3.116 -2.261 1.00 0.00 ATOM 238 O ILE 31 -14.952 2.519 1.765 1.00 0.00 ATOM 239 C ILE 31 -15.138 1.490 1.151 1.00 0.00 ATOM 240 N PRO 32 -14.168 0.591 1.004 1.00 0.00 ATOM 241 CA PRO 32 -12.867 0.946 1.594 1.00 0.00 ATOM 242 CB PRO 32 -12.078 -0.369 1.405 1.00 0.00 ATOM 243 CG PRO 32 -12.834 -1.180 0.459 1.00 0.00 ATOM 244 CD PRO 32 -14.131 -0.637 0.211 1.00 0.00 ATOM 245 O PRO 32 -12.028 1.886 -0.457 1.00 0.00 ATOM 246 C PRO 32 -11.974 1.891 0.779 1.00 0.00 ATOM 247 N ASN 33 -11.076 2.773 1.376 1.00 0.00 ATOM 248 CA ASN 33 -10.171 3.676 0.668 1.00 0.00 ATOM 249 CB ASN 33 -10.678 5.121 0.676 1.00 0.00 ATOM 250 CG ASN 33 -12.035 5.266 0.017 1.00 0.00 ATOM 251 ND2 ASN 33 -13.063 5.496 0.827 1.00 0.00 ATOM 252 OD1 ASN 33 -12.158 5.174 -1.204 1.00 0.00 ATOM 253 O ASN 33 -8.687 3.392 2.527 1.00 0.00 ATOM 254 C ASN 33 -8.792 3.605 1.313 1.00 0.00 ATOM 255 N GLY 34 -7.739 3.753 0.506 1.00 0.00 ATOM 256 CA GLY 34 -6.374 3.693 1.030 1.00 0.00 ATOM 257 O GLY 34 -5.630 5.298 -0.618 1.00 0.00 ATOM 258 C GLY 34 -5.447 4.782 0.490 1.00 0.00 ATOM 259 N SER 35 -4.422 5.082 1.277 1.00 0.00 ATOM 260 CA SER 35 -3.417 6.056 0.889 1.00 0.00 ATOM 261 CB SER 35 -3.998 7.471 0.921 1.00 0.00 ATOM 262 OG SER 35 -3.002 8.438 0.641 1.00 0.00 ATOM 263 O SER 35 -2.515 5.550 3.040 1.00 0.00 ATOM 264 C SER 35 -2.293 5.917 1.887 1.00 0.00 ATOM 265 N TYR 36 -1.086 6.237 1.455 1.00 0.00 ATOM 266 CA TYR 36 0.064 6.175 2.336 1.00 0.00 ATOM 267 CB TYR 36 1.385 6.147 1.551 1.00 0.00 ATOM 268 CG TYR 36 1.589 4.829 0.843 1.00 0.00 ATOM 269 CD1 TYR 36 0.972 4.593 -0.383 1.00 0.00 ATOM 270 CD2 TYR 36 2.374 3.817 1.393 1.00 0.00 ATOM 271 CE1 TYR 36 1.126 3.399 -1.057 1.00 0.00 ATOM 272 CE2 TYR 36 2.536 2.611 0.726 1.00 0.00 ATOM 273 CZ TYR 36 1.911 2.415 -0.491 1.00 0.00 ATOM 274 OH TYR 36 2.072 1.215 -1.154 1.00 0.00 ATOM 275 O TYR 36 0.498 8.516 2.561 1.00 0.00 ATOM 276 C TYR 36 0.473 7.418 3.113 1.00 0.00 ATOM 277 N ALA 37 0.788 7.241 4.395 1.00 0.00 ATOM 278 CA ALA 37 1.144 8.367 5.243 1.00 0.00 ATOM 279 CB ALA 37 0.036 8.571 6.266 1.00 0.00 ATOM 280 O ALA 37 2.794 6.943 6.229 1.00 0.00 ATOM 281 C ALA 37 2.404 8.089 6.050 1.00 0.00 ATOM 282 N PRO 38 3.092 9.144 6.501 1.00 0.00 ATOM 283 CA PRO 38 4.300 8.909 7.295 1.00 0.00 ATOM 284 CB PRO 38 4.941 10.294 7.414 1.00 0.00 ATOM 285 CG PRO 38 3.848 11.259 7.137 1.00 0.00 ATOM 286 CD PRO 38 2.834 10.574 6.268 1.00 0.00 ATOM 287 O PRO 38 2.871 9.008 9.220 1.00 0.00 ATOM 288 C PRO 38 3.879 8.518 8.708 1.00 0.00 ATOM 289 N PHE 39 4.630 7.609 9.304 1.00 0.00 ATOM 290 CA PHE 39 4.351 7.201 10.674 1.00 0.00 ATOM 291 CB PHE 39 4.704 5.736 10.920 1.00 0.00 ATOM 292 CG PHE 39 3.670 4.759 10.422 1.00 0.00 ATOM 293 CD1 PHE 39 2.347 5.138 10.157 1.00 0.00 ATOM 294 CD2 PHE 39 4.019 3.413 10.324 1.00 0.00 ATOM 295 CE1 PHE 39 1.366 4.197 9.797 1.00 0.00 ATOM 296 CE2 PHE 39 3.049 2.452 9.990 1.00 0.00 ATOM 297 CZ PHE 39 1.723 2.844 9.719 1.00 0.00 ATOM 298 O PHE 39 6.442 8.347 10.955 1.00 0.00 ATOM 299 C PHE 39 5.288 8.198 11.366 1.00 0.00 ATOM 300 N VAL 40 4.801 8.907 12.379 1.00 0.00 ATOM 301 CA VAL 40 5.642 9.897 13.048 1.00 0.00 ATOM 302 CB VAL 40 4.965 11.366 12.621 1.00 0.00 ATOM 303 CG1 VAL 40 5.838 12.524 13.099 1.00 0.00 ATOM 304 CG2 VAL 40 4.732 11.495 11.119 1.00 0.00 ATOM 305 O VAL 40 6.914 9.993 15.086 1.00 0.00 ATOM 306 C VAL 40 5.949 9.507 14.499 1.00 0.00 ATOM 307 N ILE 41 5.177 8.306 14.955 1.00 0.00 ATOM 308 CA ILE 41 5.464 7.835 16.310 1.00 0.00 ATOM 309 CB ILE 41 4.922 8.806 17.366 1.00 0.00 ATOM 310 CG1 ILE 41 5.712 10.123 17.286 1.00 0.00 ATOM 311 CG2 ILE 41 5.002 8.178 18.767 1.00 0.00 ATOM 312 CD1 ILE 41 5.209 11.213 18.213 1.00 0.00 ATOM 313 O ILE 41 3.621 6.313 16.034 1.00 0.00 ATOM 314 C ILE 41 4.685 6.567 16.617 1.00 0.00 ATOM 315 N ASP 42 5.212 5.751 17.520 1.00 0.00 ATOM 316 CA ASP 42 4.500 4.542 17.901 1.00 0.00 ATOM 317 CB ASP 42 4.761 3.425 16.888 1.00 0.00 ATOM 318 CG ASP 42 6.201 2.954 16.899 1.00 0.00 ATOM 319 OD1 ASP 42 6.603 2.291 17.878 1.00 0.00 ATOM 320 OD2 ASP 42 6.932 3.250 15.928 1.00 0.00 ATOM 321 O ASP 42 6.068 4.339 19.704 1.00 0.00 ATOM 322 C ASP 42 4.954 4.057 19.269 1.00 0.00 ATOM 323 N ASP 43 3.963 3.353 19.945 1.00 0.00 ATOM 324 CA ASP 43 4.250 2.754 21.236 1.00 0.00 ATOM 325 CB ASP 43 4.407 3.836 22.307 1.00 0.00 ATOM 326 CG ASP 43 5.202 3.356 23.507 1.00 0.00 ATOM 327 OD1 ASP 43 5.536 2.154 23.556 1.00 0.00 ATOM 328 OD2 ASP 43 5.487 4.181 24.399 1.00 0.00 ATOM 329 O ASP 43 2.143 1.722 20.691 1.00 0.00 ATOM 330 C ASP 43 3.046 1.850 21.535 1.00 0.00 ATOM 331 N ALA 44 3.016 1.220 22.705 1.00 0.00 ATOM 332 CA ALA 44 1.919 0.303 22.988 1.00 0.00 ATOM 333 CB ALA 44 1.934 -0.242 24.355 1.00 0.00 ATOM 334 O ALA 44 -0.430 0.602 22.594 1.00 0.00 ATOM 335 C ALA 44 0.648 1.150 22.836 1.00 0.00 ATOM 336 N LYS 45 0.805 2.525 22.966 1.00 0.00 ATOM 337 CA LYS 45 -0.357 3.412 22.811 1.00 0.00 ATOM 338 CB LYS 45 -0.127 4.921 22.927 1.00 0.00 ATOM 339 CG LYS 45 0.289 5.383 24.315 1.00 0.00 ATOM 340 CD LYS 45 0.496 6.887 24.357 1.00 0.00 ATOM 341 CE LYS 45 0.936 7.345 25.739 1.00 0.00 ATOM 342 NZ LYS 45 1.175 8.813 25.787 1.00 0.00 ATOM 343 O LYS 45 -2.237 2.934 21.360 1.00 0.00 ATOM 344 C LYS 45 -1.019 3.107 21.477 1.00 0.00 ATOM 345 N ASN 46 -0.046 3.186 20.445 1.00 0.00 ATOM 346 CA ASN 46 -0.517 3.063 19.079 1.00 0.00 ATOM 347 CB ASN 46 -1.932 3.863 18.969 1.00 0.00 ATOM 348 CG ASN 46 -1.789 5.266 19.476 1.00 0.00 ATOM 349 ND2 ASN 46 -2.777 5.692 20.230 1.00 0.00 ATOM 350 OD1 ASN 46 -0.777 5.969 19.207 1.00 0.00 ATOM 351 O ASN 46 1.498 3.990 18.165 1.00 0.00 ATOM 352 C ASN 46 0.346 3.602 17.957 1.00 0.00 ATOM 353 N ILE 47 -0.224 3.629 16.757 1.00 0.00 ATOM 354 CA ILE 47 0.489 4.123 15.585 1.00 0.00 ATOM 355 CB ILE 47 0.387 3.137 14.406 1.00 0.00 ATOM 356 CG1 ILE 47 0.906 1.758 14.815 1.00 0.00 ATOM 357 CG2 ILE 47 1.208 3.629 13.225 1.00 0.00 ATOM 358 CD1 ILE 47 2.358 1.757 15.251 1.00 0.00 ATOM 359 O ILE 47 -1.276 5.620 14.928 1.00 0.00 ATOM 360 C ILE 47 -0.063 5.455 15.105 1.00 0.00 ATOM 361 N TYR 48 0.856 6.378 14.836 1.00 0.00 ATOM 362 CA TYR 48 0.522 7.743 14.456 1.00 0.00 ATOM 363 CB TYR 48 1.312 8.742 15.302 1.00 0.00 ATOM 364 CG TYR 48 0.951 8.727 16.769 1.00 0.00 ATOM 365 CD1 TYR 48 1.671 7.956 17.673 1.00 0.00 ATOM 366 CD2 TYR 48 -0.113 9.484 17.248 1.00 0.00 ATOM 367 CE1 TYR 48 1.349 7.935 19.015 1.00 0.00 ATOM 368 CE2 TYR 48 -0.452 9.475 18.589 1.00 0.00 ATOM 369 CZ TYR 48 0.291 8.691 19.471 1.00 0.00 ATOM 370 OH TYR 48 -0.036 8.671 20.808 1.00 0.00 ATOM 371 O TYR 48 1.861 8.056 12.500 1.00 0.00 ATOM 372 C TYR 48 0.770 8.247 13.034 1.00 0.00 ATOM 373 N ILE 49 -0.295 8.960 12.496 1.00 0.00 ATOM 374 CA ILE 49 -0.172 9.516 11.149 1.00 0.00 ATOM 375 CB ILE 49 -0.786 8.648 10.044 1.00 0.00 ATOM 376 CG1 ILE 49 -2.252 8.235 10.311 1.00 0.00 ATOM 377 CG2 ILE 49 0.035 7.356 9.895 1.00 0.00 ATOM 378 CD1 ILE 49 -2.894 7.618 9.064 1.00 0.00 ATOM 379 O ILE 49 -1.643 11.158 12.136 1.00 0.00 ATOM 380 C ILE 49 -0.844 10.899 11.226 1.00 0.00 ATOM 381 N TYR 50 -0.474 11.795 10.317 1.00 0.00 ATOM 382 CA TYR 50 -1.039 13.136 10.276 1.00 0.00 ATOM 383 CB TYR 50 0.065 14.199 10.479 1.00 0.00 ATOM 384 CG TYR 50 0.731 14.143 11.841 1.00 0.00 ATOM 385 CD1 TYR 50 1.768 13.212 12.053 1.00 0.00 ATOM 386 CD2 TYR 50 0.360 14.939 12.896 1.00 0.00 ATOM 387 CE1 TYR 50 2.373 13.154 13.306 1.00 0.00 ATOM 388 CE2 TYR 50 0.949 14.895 14.143 1.00 0.00 ATOM 389 CZ TYR 50 1.978 13.973 14.330 1.00 0.00 ATOM 390 OH TYR 50 2.568 13.923 15.565 1.00 0.00 ATOM 391 O TYR 50 -1.047 13.286 7.889 1.00 0.00 ATOM 392 C TYR 50 -1.680 13.461 8.947 1.00 0.00 ATOM 393 N VAL 51 -2.955 14.033 8.965 1.00 0.00 ATOM 394 CA VAL 51 -3.645 14.392 7.714 1.00 0.00 ATOM 395 CB VAL 51 -4.330 13.177 7.072 1.00 0.00 ATOM 396 CG1 VAL 51 -3.288 12.129 6.719 1.00 0.00 ATOM 397 CG2 VAL 51 -5.381 12.589 7.999 1.00 0.00 ATOM 398 O VAL 51 -5.152 15.540 9.210 1.00 0.00 ATOM 399 C VAL 51 -4.709 15.428 8.049 1.00 0.00 ATOM 400 N SER 52 -5.138 16.201 7.054 1.00 0.00 ATOM 401 CA SER 52 -6.241 17.137 7.321 1.00 0.00 ATOM 402 CB SER 52 -6.576 17.935 6.021 1.00 0.00 ATOM 403 OG SER 52 -7.580 18.901 6.297 1.00 0.00 ATOM 404 O SER 52 -8.049 15.554 7.341 1.00 0.00 ATOM 405 C SER 52 -7.538 16.549 7.864 1.00 0.00 ATOM 406 N GLY 53 -8.097 17.171 8.909 1.00 0.00 ATOM 407 CA GLY 53 -9.342 16.709 9.499 1.00 0.00 ATOM 408 O GLY 53 -11.649 16.365 8.995 1.00 0.00 ATOM 409 C GLY 53 -10.578 16.855 8.633 1.00 0.00 ATOM 410 N LEU 54 -10.457 17.500 7.477 1.00 0.00 ATOM 411 CA LEU 54 -11.591 17.692 6.579 1.00 0.00 ATOM 412 CB LEU 54 -11.667 19.123 6.110 1.00 0.00 ATOM 413 CG LEU 54 -11.891 20.210 7.173 1.00 0.00 ATOM 414 CD1 LEU 54 -12.093 21.533 6.461 1.00 0.00 ATOM 415 CD2 LEU 54 -13.110 19.892 8.031 1.00 0.00 ATOM 416 O LEU 54 -12.400 16.748 4.534 1.00 0.00 ATOM 417 C LEU 54 -11.505 16.759 5.376 1.00 0.00 ATOM 418 N ALA 55 -10.458 15.994 5.327 1.00 0.00 ATOM 419 CA ALA 55 -10.240 15.064 4.225 1.00 0.00 ATOM 420 CB ALA 55 -8.893 14.366 4.358 1.00 0.00 ATOM 421 O ALA 55 -12.074 13.792 5.121 1.00 0.00 ATOM 422 C ALA 55 -11.296 13.972 4.178 1.00 0.00 ATOM 423 N VAL 56 -11.282 13.110 3.071 1.00 0.00 ATOM 424 CA VAL 56 -12.196 11.991 2.949 1.00 0.00 ATOM 425 CB VAL 56 -12.164 11.306 1.628 1.00 0.00 ATOM 426 CG1 VAL 56 -12.313 12.302 0.472 1.00 0.00 ATOM 427 CG2 VAL 56 -10.857 10.591 1.353 1.00 0.00 ATOM 428 O VAL 56 -12.784 10.312 4.553 1.00 0.00 ATOM 429 C VAL 56 -11.877 10.916 3.991 1.00 0.00 ATOM 430 N HIS 57 -10.599 10.647 4.229 1.00 0.00 ATOM 431 CA HIS 57 -10.276 9.588 5.182 1.00 0.00 ATOM 432 CB HIS 57 -8.761 9.375 5.257 1.00 0.00 ATOM 433 CG HIS 57 -8.183 8.722 4.042 1.00 0.00 ATOM 434 CD2 HIS 57 -7.233 9.106 3.006 1.00 0.00 ATOM 435 ND1 HIS 57 -8.513 7.440 3.657 1.00 0.00 ATOM 436 CE1 HIS 57 -7.837 7.130 2.536 1.00 0.00 ATOM 437 NE2 HIS 57 -7.067 8.125 2.141 1.00 0.00 ATOM 438 O HIS 57 -11.332 9.110 7.282 1.00 0.00 ATOM 439 C HIS 57 -10.816 9.960 6.557 1.00 0.00 ATOM 440 N THR 58 -10.697 11.251 6.913 1.00 0.00 ATOM 441 CA THR 58 -11.176 11.736 8.199 1.00 0.00 ATOM 442 CB THR 58 -10.844 13.236 8.378 1.00 0.00 ATOM 443 CG2 THR 58 -11.341 13.734 9.724 1.00 0.00 ATOM 444 OG1 THR 58 -9.426 13.426 8.294 1.00 0.00 ATOM 445 O THR 58 -13.178 11.012 9.308 1.00 0.00 ATOM 446 C THR 58 -12.684 11.538 8.311 1.00 0.00 ATOM 447 N LYS 59 -13.449 11.946 7.283 1.00 0.00 ATOM 448 CA LYS 59 -14.899 11.798 7.287 1.00 0.00 ATOM 449 CB LYS 59 -15.561 12.474 6.119 1.00 0.00 ATOM 450 CG LYS 59 -15.535 14.011 6.255 1.00 0.00 ATOM 451 CD LYS 59 -16.429 14.609 5.157 1.00 0.00 ATOM 452 CE LYS 59 -16.619 16.115 5.353 1.00 0.00 ATOM 453 NZ LYS 59 -15.370 16.896 5.118 1.00 0.00 ATOM 454 O LYS 59 -16.138 9.945 8.218 1.00 0.00 ATOM 455 C LYS 59 -15.270 10.320 7.421 1.00 0.00 ATOM 456 N ASN 60 -14.648 9.410 6.564 1.00 0.00 ATOM 457 CA ASN 60 -14.970 7.992 6.583 1.00 0.00 ATOM 458 CB ASN 60 -14.211 7.209 5.550 1.00 0.00 ATOM 459 CG ASN 60 -14.776 7.427 4.164 1.00 0.00 ATOM 460 ND2 ASN 60 -13.962 7.195 3.139 1.00 0.00 ATOM 461 OD1 ASN 60 -15.947 7.789 4.017 1.00 0.00 ATOM 462 O ASN 60 -15.493 6.560 8.435 1.00 0.00 ATOM 463 C ASN 60 -14.707 7.377 7.950 1.00 0.00 ATOM 464 N ILE 61 -13.633 7.818 8.561 1.00 0.00 ATOM 465 CA ILE 61 -13.316 7.324 9.893 1.00 0.00 ATOM 466 CB ILE 61 -11.965 7.887 10.372 1.00 0.00 ATOM 467 CG1 ILE 61 -10.817 7.286 9.559 1.00 0.00 ATOM 468 CG2 ILE 61 -11.742 7.558 11.841 1.00 0.00 ATOM 469 CD1 ILE 61 -9.489 7.975 9.780 1.00 0.00 ATOM 470 O ILE 61 -14.749 6.991 11.741 1.00 0.00 ATOM 471 C ILE 61 -14.377 7.775 10.873 1.00 0.00 ATOM 472 N GLU 62 -14.912 9.013 10.707 1.00 0.00 ATOM 473 CA GLU 62 -15.983 9.501 11.582 1.00 0.00 ATOM 474 CB GLU 62 -16.175 11.032 11.320 1.00 0.00 ATOM 475 CG GLU 62 -17.418 11.566 12.020 1.00 0.00 ATOM 476 CD GLU 62 -17.404 13.060 12.262 1.00 0.00 ATOM 477 OE1 GLU 62 -16.502 13.769 11.757 1.00 0.00 ATOM 478 OE2 GLU 62 -18.327 13.531 12.959 1.00 0.00 ATOM 479 O GLU 62 -17.969 8.519 12.511 1.00 0.00 ATOM 480 C GLU 62 -17.252 8.642 11.521 1.00 0.00 ATOM 481 N ALA 63 -17.523 8.043 10.365 1.00 0.00 ATOM 482 CA ALA 63 -18.697 7.173 10.232 1.00 0.00 ATOM 483 CB ALA 63 -19.192 7.166 8.793 1.00 0.00 ATOM 484 O ALA 63 -19.265 4.982 11.067 1.00 0.00 ATOM 485 C ALA 63 -18.376 5.717 10.627 1.00 0.00 ATOM 486 N ASN 64 -17.117 5.310 10.480 1.00 0.00 ATOM 487 CA ASN 64 -16.692 3.943 10.812 1.00 0.00 ATOM 488 CB ASN 64 -16.872 3.019 9.609 1.00 0.00 ATOM 489 CG ASN 64 -16.655 1.558 9.957 1.00 0.00 ATOM 490 ND2 ASN 64 -17.171 0.667 9.118 1.00 0.00 ATOM 491 OD1 ASN 64 -16.033 1.238 10.970 1.00 0.00 ATOM 492 O ASN 64 -14.344 4.129 10.354 1.00 0.00 ATOM 493 C ASN 64 -15.218 4.019 11.206 1.00 0.00 ATOM 494 N PRO 65 -14.926 3.958 12.514 1.00 0.00 ATOM 495 CA PRO 65 -13.560 4.037 13.046 1.00 0.00 ATOM 496 CB PRO 65 -13.672 4.438 14.576 1.00 0.00 ATOM 497 CG PRO 65 -15.143 4.153 14.838 1.00 0.00 ATOM 498 CD PRO 65 -15.936 3.993 13.542 1.00 0.00 ATOM 499 O PRO 65 -11.404 2.966 13.099 1.00 0.00 ATOM 500 C PRO 65 -12.600 2.862 12.795 1.00 0.00 ATOM 501 N LEU 66 -13.210 1.719 12.261 1.00 0.00 ATOM 502 CA LEU 66 -12.384 0.528 11.990 1.00 0.00 ATOM 503 CB LEU 66 -13.304 -0.655 11.686 1.00 0.00 ATOM 504 CG LEU 66 -12.620 -1.997 11.427 1.00 0.00 ATOM 505 CD1 LEU 66 -11.909 -2.490 12.679 1.00 0.00 ATOM 506 CD2 LEU 66 -13.638 -3.051 11.016 1.00 0.00 ATOM 507 O LEU 66 -11.896 1.005 9.702 1.00 0.00 ATOM 508 C LEU 66 -11.451 0.714 10.810 1.00 0.00 ATOM 509 N VAL 67 -10.157 0.610 11.046 1.00 0.00 ATOM 510 CA VAL 67 -9.241 0.776 9.944 1.00 0.00 ATOM 511 CB VAL 67 -8.449 2.091 10.063 1.00 0.00 ATOM 512 CG1 VAL 67 -9.391 3.285 10.032 1.00 0.00 ATOM 513 CG2 VAL 67 -7.668 2.127 11.369 1.00 0.00 ATOM 514 O VAL 67 -8.123 -1.167 10.816 1.00 0.00 ATOM 515 C VAL 67 -8.232 -0.362 9.884 1.00 0.00 ATOM 516 N ASN 68 -7.492 -0.405 8.778 1.00 0.00 ATOM 517 CA ASN 68 -6.445 -1.398 8.554 1.00 0.00 ATOM 518 CB ASN 68 -6.900 -2.433 7.525 1.00 0.00 ATOM 519 CG ASN 68 -8.137 -3.192 7.970 1.00 0.00 ATOM 520 ND2 ASN 68 -9.267 -2.904 7.336 1.00 0.00 ATOM 521 OD1 ASN 68 -8.071 -4.028 8.871 1.00 0.00 ATOM 522 O ASN 68 -5.364 0.348 7.298 1.00 0.00 ATOM 523 C ASN 68 -5.225 -0.635 8.041 1.00 0.00 ATOM 524 N VAL 69 -4.044 -1.079 8.439 1.00 0.00 ATOM 525 CA VAL 69 -2.785 -0.479 8.027 1.00 0.00 ATOM 526 CB VAL 69 -2.053 0.173 9.216 1.00 0.00 ATOM 527 CG1 VAL 69 -0.720 0.752 8.765 1.00 0.00 ATOM 528 CG2 VAL 69 -2.891 1.299 9.803 1.00 0.00 ATOM 529 O VAL 69 -1.755 -2.662 8.142 1.00 0.00 ATOM 530 C VAL 69 -1.899 -1.615 7.500 1.00 0.00 ATOM 531 N LEU 70 -1.284 -1.356 6.399 1.00 0.00 ATOM 532 CA LEU 70 -0.418 -2.328 5.769 1.00 0.00 ATOM 533 CB LEU 70 -1.080 -2.982 4.554 1.00 0.00 ATOM 534 CG LEU 70 -0.251 -4.037 3.815 1.00 0.00 ATOM 535 CD1 LEU 70 -0.019 -5.255 4.697 1.00 0.00 ATOM 536 CD2 LEU 70 -0.962 -4.491 2.552 1.00 0.00 ATOM 537 O LEU 70 0.874 -0.634 4.675 1.00 0.00 ATOM 538 C LEU 70 0.879 -1.672 5.349 1.00 0.00 ATOM 539 N PHE 71 1.983 -2.255 5.808 1.00 0.00 ATOM 540 CA PHE 71 3.323 -1.782 5.478 1.00 0.00 ATOM 541 CB PHE 71 4.132 -1.089 6.261 1.00 0.00 ATOM 542 CG PHE 71 5.565 -1.047 5.792 1.00 0.00 ATOM 543 CD1 PHE 71 5.933 -0.308 4.670 1.00 0.00 ATOM 544 CD2 PHE 71 6.561 -1.703 6.509 1.00 0.00 ATOM 545 CE1 PHE 71 7.258 -0.255 4.257 1.00 0.00 ATOM 546 CE2 PHE 71 7.871 -1.656 6.092 1.00 0.00 ATOM 547 CZ PHE 71 8.222 -0.942 4.974 1.00 0.00 ATOM 548 O PHE 71 4.005 -3.922 4.626 1.00 0.00 ATOM 549 C PHE 71 3.772 -2.735 4.381 1.00 0.00 ATOM 550 N VAL 72 3.824 -2.176 3.166 1.00 0.00 ATOM 551 CA VAL 72 4.236 -2.939 2.001 1.00 0.00 ATOM 552 CB VAL 72 3.579 -2.332 0.748 1.00 0.00 ATOM 553 CG1 VAL 72 3.835 -3.209 -0.467 1.00 0.00 ATOM 554 CG2 VAL 72 2.073 -2.209 0.942 1.00 0.00 ATOM 555 O VAL 72 6.245 -2.322 0.845 1.00 0.00 ATOM 556 C VAL 72 5.726 -3.014 1.725 1.00 0.00 ATOM 557 N ASP 73 6.413 -3.852 2.487 1.00 0.00 ATOM 558 CA ASP 73 7.854 -4.021 2.354 1.00 0.00 ATOM 559 CB ASP 73 8.486 -3.867 3.773 1.00 0.00 ATOM 560 CG ASP 73 9.987 -3.688 3.780 1.00 0.00 ATOM 561 OD1 ASP 73 10.555 -3.099 2.829 1.00 0.00 ATOM 562 OD2 ASP 73 10.685 -4.107 4.719 1.00 0.00 ATOM 563 O ASP 73 7.975 -6.386 1.920 1.00 0.00 ATOM 564 C ASP 73 7.808 -5.260 1.456 1.00 0.00 ATOM 565 N ASP 74 7.657 -4.846 0.118 1.00 0.00 ATOM 566 CA ASP 74 7.742 -5.837 -0.914 1.00 0.00 ATOM 567 CB ASP 74 6.728 -5.881 -2.058 1.00 0.00 ATOM 568 CG ASP 74 5.332 -6.231 -1.583 1.00 0.00 ATOM 569 OD1 ASP 74 5.190 -6.664 -0.419 1.00 0.00 ATOM 570 OD2 ASP 74 4.378 -6.076 -2.376 1.00 0.00 ATOM 571 O ASP 74 9.664 -6.746 -1.977 1.00 0.00 ATOM 572 C ASP 74 9.160 -5.754 -1.482 1.00 0.00 ATOM 573 N GLU 75 9.790 -4.582 -1.440 1.00 0.00 ATOM 574 CA GLU 75 11.161 -4.486 -1.935 1.00 0.00 ATOM 575 CB GLU 75 11.541 -3.015 -2.199 1.00 0.00 ATOM 576 CG GLU 75 10.682 -2.294 -3.228 1.00 0.00 ATOM 577 CD GLU 75 10.460 -3.096 -4.535 1.00 0.00 ATOM 578 OE1 GLU 75 11.453 -3.624 -5.105 1.00 0.00 ATOM 579 OE2 GLU 75 9.287 -3.196 -4.993 1.00 0.00 ATOM 580 O GLU 75 13.099 -5.796 -1.348 1.00 0.00 ATOM 581 C GLU 75 12.027 -5.320 -0.982 1.00 0.00 ATOM 582 N ALA 76 11.489 -5.479 0.193 1.00 0.00 ATOM 583 CA ALA 76 12.174 -6.336 1.152 1.00 0.00 ATOM 584 CB ALA 76 11.253 -6.385 2.444 1.00 0.00 ATOM 585 O ALA 76 13.682 -8.252 1.140 1.00 0.00 ATOM 586 C ALA 76 12.588 -7.790 0.779 1.00 0.00 ATOM 587 N LYS 77 11.733 -8.357 -0.068 1.00 0.00 ATOM 588 CA LYS 77 12.040 -9.687 -0.581 1.00 0.00 ATOM 589 CB LYS 77 10.891 -10.219 -1.449 1.00 0.00 ATOM 590 CG LYS 77 9.687 -10.651 -0.638 1.00 0.00 ATOM 591 CD LYS 77 8.528 -11.029 -1.526 1.00 0.00 ATOM 592 CE LYS 77 7.351 -11.595 -0.758 1.00 0.00 ATOM 593 NZ LYS 77 6.261 -11.929 -1.723 1.00 0.00 ATOM 594 O LYS 77 14.135 -10.619 -1.324 1.00 0.00 ATOM 595 C LYS 77 13.335 -9.683 -1.371 1.00 0.00 ATOM 596 N THR 78 13.560 -8.626 -2.137 1.00 0.00 ATOM 597 CA THR 78 14.725 -8.553 -3.001 1.00 0.00 ATOM 598 CB THR 78 14.602 -7.367 -3.983 1.00 0.00 ATOM 599 CG2 THR 78 15.877 -7.335 -4.797 1.00 0.00 ATOM 600 OG1 THR 78 13.418 -7.537 -4.779 1.00 0.00 ATOM 601 O THR 78 17.075 -8.622 -2.720 1.00 0.00 ATOM 602 C THR 78 15.998 -8.512 -2.198 1.00 0.00 ATOM 603 N ASN 79 16.005 -8.553 -0.534 1.00 0.00 ATOM 604 CA ASN 79 17.204 -8.584 0.305 1.00 0.00 ATOM 605 CB ASN 79 18.225 -7.425 0.060 1.00 0.00 ATOM 606 CG ASN 79 19.659 -7.787 0.552 1.00 0.00 ATOM 607 ND2 ASN 79 20.557 -8.087 -0.389 1.00 0.00 ATOM 608 OD1 ASN 79 19.926 -7.810 1.736 1.00 0.00 ATOM 609 O ASN 79 15.812 -7.925 2.149 1.00 0.00 ATOM 610 C ASN 79 16.911 -8.354 1.778 1.00 0.00 ATOM 611 N GLN 80 17.911 -8.688 2.604 1.00 0.00 ATOM 612 CA GLN 80 17.775 -8.488 4.049 1.00 0.00 ATOM 613 CB GLN 80 19.418 -9.093 4.350 1.00 0.00 ATOM 614 CG GLN 80 19.829 -10.399 3.629 1.00 0.00 ATOM 615 CD GLN 80 21.317 -10.487 3.554 1.00 0.00 ATOM 616 OE1 GLN 80 21.955 -9.662 2.907 1.00 0.00 ATOM 617 NE2 GLN 80 21.894 -11.487 4.217 1.00 0.00 ATOM 618 O GLN 80 16.712 -6.645 5.209 1.00 0.00 ATOM 619 C GLN 80 17.605 -7.018 4.430 1.00 0.00 ATOM 620 N ILE 81 18.455 -6.174 3.868 1.00 0.00 ATOM 621 CA ILE 81 18.396 -4.759 4.164 1.00 0.00 ATOM 622 CB ILE 81 19.468 -3.974 3.382 1.00 0.00 ATOM 623 CG1 ILE 81 20.865 -4.326 3.890 1.00 0.00 ATOM 624 CG2 ILE 81 19.256 -2.477 3.547 1.00 0.00 ATOM 625 CD1 ILE 81 21.982 -3.809 3.013 1.00 0.00 ATOM 626 O ILE 81 16.463 -3.398 4.582 1.00 0.00 ATOM 627 C ILE 81 17.056 -4.150 3.796 1.00 0.00 ATOM 628 N PHE 82 16.564 -4.516 2.623 1.00 0.00 ATOM 629 CA PHE 82 15.337 -3.913 2.110 1.00 0.00 ATOM 630 CB PHE 82 15.534 -3.447 0.666 1.00 0.00 ATOM 631 CG PHE 82 16.553 -2.352 0.517 1.00 0.00 ATOM 632 CD1 PHE 82 17.882 -2.654 0.272 1.00 0.00 ATOM 633 CD2 PHE 82 16.185 -1.024 0.626 1.00 0.00 ATOM 634 CE1 PHE 82 18.819 -1.649 0.134 1.00 0.00 ATOM 635 CE2 PHE 82 17.123 -0.017 0.490 1.00 0.00 ATOM 636 CZ PHE 82 18.436 -0.325 0.244 1.00 0.00 ATOM 637 O PHE 82 14.999 -6.277 1.650 1.00 0.00 ATOM 638 C PHE 82 14.920 -5.349 2.463 1.00 0.00 ATOM 639 N ALA 83 14.500 -5.399 3.882 1.00 0.00 ATOM 640 CA ALA 83 14.019 -6.617 4.526 1.00 0.00 ATOM 641 CB ALA 83 13.345 -6.288 5.849 1.00 0.00 ATOM 642 O ALA 83 13.260 -8.561 5.702 1.00 0.00 ATOM 643 C ALA 83 13.204 -7.895 4.665 1.00 0.00 ATOM 644 N ARG 84 12.529 -8.281 3.582 1.00 0.00 ATOM 645 CA ARG 84 11.675 -9.470 3.559 1.00 0.00 ATOM 646 CB ARG 84 12.744 -10.636 2.971 1.00 0.00 ATOM 647 CG ARG 84 12.307 -11.799 2.110 1.00 0.00 ATOM 648 CD ARG 84 13.485 -12.624 1.739 1.00 0.00 ATOM 649 NE ARG 84 13.160 -13.777 0.962 1.00 0.00 ATOM 650 CZ ARG 84 13.901 -14.338 0.048 1.00 0.00 ATOM 651 NH1 ARG 84 15.053 -13.805 -0.347 1.00 0.00 ATOM 652 NH2 ARG 84 13.467 -15.457 -0.557 1.00 0.00 ATOM 653 O ARG 84 10.492 -10.555 5.382 1.00 0.00 ATOM 654 C ARG 84 10.666 -9.519 4.726 1.00 0.00 ATOM 655 N ARG 85 10.096 -8.359 5.047 1.00 0.00 ATOM 656 CA ARG 85 9.126 -8.283 6.129 1.00 0.00 ATOM 657 CB ARG 85 9.771 -7.693 7.385 1.00 0.00 ATOM 658 CG ARG 85 10.236 -6.255 7.228 1.00 0.00 ATOM 659 CD ARG 85 10.887 -5.743 8.503 1.00 0.00 ATOM 660 NE ARG 85 11.383 -4.377 8.353 1.00 0.00 ATOM 661 CZ ARG 85 10.651 -3.287 8.571 1.00 0.00 ATOM 662 NH1 ARG 85 11.186 -2.086 8.411 1.00 0.00 ATOM 663 NH2 ARG 85 9.385 -3.404 8.948 1.00 0.00 ATOM 664 O ARG 85 7.902 -6.680 4.830 1.00 0.00 ATOM 665 C ARG 85 7.916 -7.415 5.814 1.00 0.00 ATOM 666 N ARG 86 6.814 -7.700 6.498 1.00 0.00 ATOM 667 CA ARG 86 5.597 -6.890 6.396 1.00 0.00 ATOM 668 CB ARG 86 4.632 -7.501 5.375 1.00 0.00 ATOM 669 CG ARG 86 5.150 -7.489 3.947 1.00 0.00 ATOM 670 CD ARG 86 4.124 -8.061 2.984 1.00 0.00 ATOM 671 NE ARG 86 3.943 -9.498 3.169 1.00 0.00 ATOM 672 CZ ARG 86 2.874 -10.176 2.759 1.00 0.00 ATOM 673 NH1 ARG 86 2.796 -11.482 2.973 1.00 0.00 ATOM 674 NH2 ARG 86 1.889 -9.546 2.136 1.00 0.00 ATOM 675 O ARG 86 5.071 -7.910 8.471 1.00 0.00 ATOM 676 C ARG 86 4.998 -6.898 7.787 1.00 0.00 ATOM 677 N LEU 87 4.362 -5.797 8.169 1.00 0.00 ATOM 678 CA LEU 87 3.643 -5.721 9.440 1.00 0.00 ATOM 679 CB LEU 87 4.376 -4.806 10.420 1.00 0.00 ATOM 680 CG LEU 87 5.661 -5.364 11.013 1.00 0.00 ATOM 681 CD1 LEU 87 6.386 -4.236 11.814 1.00 0.00 ATOM 682 CD2 LEU 87 5.322 -6.538 11.966 1.00 0.00 ATOM 683 O LEU 87 2.304 -4.041 8.357 1.00 0.00 ATOM 684 C LEU 87 2.294 -5.085 9.025 1.00 0.00 ATOM 685 N SER 88 1.242 -5.748 9.411 1.00 0.00 ATOM 686 CA SER 88 -0.114 -5.220 9.154 1.00 0.00 ATOM 687 CB SER 88 -0.846 -6.207 8.244 1.00 0.00 ATOM 688 OG SER 88 -2.147 -5.741 7.929 1.00 0.00 ATOM 689 O SER 88 -0.650 -5.857 11.383 1.00 0.00 ATOM 690 C SER 88 -0.836 -5.044 10.481 1.00 0.00 ATOM 691 N PHE 89 -1.608 -3.981 10.628 1.00 0.00 ATOM 692 CA PHE 89 -2.265 -3.667 11.905 1.00 0.00 ATOM 693 CB PHE 89 -1.898 -2.250 12.260 1.00 0.00 ATOM 694 CG PHE 89 -0.407 -2.056 12.386 1.00 0.00 ATOM 695 CD1 PHE 89 0.252 -2.388 13.562 1.00 0.00 ATOM 696 CD2 PHE 89 0.343 -1.572 11.318 1.00 0.00 ATOM 697 CE1 PHE 89 1.638 -2.239 13.678 1.00 0.00 ATOM 698 CE2 PHE 89 1.722 -1.421 11.423 1.00 0.00 ATOM 699 CZ PHE 89 2.372 -1.756 12.607 1.00 0.00 ATOM 700 O PHE 89 -4.121 -2.958 10.596 1.00 0.00 ATOM 701 C PHE 89 -3.727 -3.447 11.651 1.00 0.00 ATOM 702 N ASP 90 -4.438 -3.895 12.791 1.00 0.00 ATOM 703 CA ASP 90 -5.883 -3.837 12.725 1.00 0.00 ATOM 704 CB ASP 90 -6.513 -5.213 12.876 1.00 0.00 ATOM 705 CG ASP 90 -8.040 -5.153 12.834 1.00 0.00 ATOM 706 OD1 ASP 90 -8.614 -4.068 13.099 1.00 0.00 ATOM 707 OD2 ASP 90 -8.673 -6.194 12.549 1.00 0.00 ATOM 708 O ASP 90 -5.917 -3.403 15.073 1.00 0.00 ATOM 709 C ASP 90 -6.253 -3.014 13.954 1.00 0.00 ATOM 710 N CYS 91 -7.050 -1.966 13.754 1.00 0.00 ATOM 711 CA CYS 91 -7.481 -1.116 14.854 1.00 0.00 ATOM 712 CB CYS 91 -6.327 -0.270 15.390 1.00 0.00 ATOM 713 SG CYS 91 -5.740 0.995 14.265 1.00 0.00 ATOM 714 O CYS 91 -8.802 0.116 13.257 1.00 0.00 ATOM 715 C CYS 91 -8.527 -0.092 14.427 1.00 0.00 ATOM 716 N THR 92 -8.880 0.876 15.433 1.00 0.00 ATOM 717 CA THR 92 -9.682 2.049 15.180 1.00 0.00 ATOM 718 CB THR 92 -10.737 2.238 16.325 1.00 0.00 ATOM 719 CG2 THR 92 -11.708 1.062 16.414 1.00 0.00 ATOM 720 OG1 THR 92 -10.011 2.352 17.553 1.00 0.00 ATOM 721 O THR 92 -7.835 3.487 15.601 1.00 0.00 ATOM 722 C THR 92 -8.920 3.353 15.049 1.00 0.00 ATOM 723 N ALA 93 -9.456 4.333 14.263 1.00 0.00 ATOM 724 CA ALA 93 -8.845 5.641 14.076 1.00 0.00 ATOM 725 CB ALA 93 -8.864 6.088 12.621 1.00 0.00 ATOM 726 O ALA 93 -10.759 6.698 14.990 1.00 0.00 ATOM 727 C ALA 93 -9.522 6.625 14.989 1.00 0.00 ATOM 728 N THR 94 -8.745 7.395 15.741 1.00 0.00 ATOM 729 CA THR 94 -9.294 8.441 16.608 1.00 0.00 ATOM 730 CB THR 94 -9.124 8.095 18.098 1.00 0.00 ATOM 731 CG2 THR 94 -9.708 9.197 18.970 1.00 0.00 ATOM 732 OG1 THR 94 -9.805 6.865 18.386 1.00 0.00 ATOM 733 O THR 94 -7.322 9.746 16.226 1.00 0.00 ATOM 734 C THR 94 -8.545 9.742 16.330 1.00 0.00 ATOM 735 N LEU 95 -9.241 10.841 16.255 1.00 0.00 ATOM 736 CA LEU 95 -8.610 12.134 16.035 1.00 0.00 ATOM 737 CB LEU 95 -9.661 13.230 16.115 1.00 0.00 ATOM 738 CG LEU 95 -9.178 14.617 15.709 1.00 0.00 ATOM 739 CD1 LEU 95 -8.781 14.675 14.244 1.00 0.00 ATOM 740 CD2 LEU 95 -10.243 15.641 16.015 1.00 0.00 ATOM 741 O LEU 95 -7.805 12.256 18.289 1.00 0.00 ATOM 742 C LEU 95 -7.584 12.505 17.104 1.00 0.00 ATOM 743 N ILE 96 -7.006 12.962 17.410 1.00 0.00 ATOM 744 CA ILE 96 -6.182 13.399 18.537 1.00 0.00 ATOM 745 CB ILE 96 -4.654 13.356 18.119 1.00 0.00 ATOM 746 CG1 ILE 96 -3.800 13.603 19.343 1.00 0.00 ATOM 747 CG2 ILE 96 -4.406 14.381 16.966 1.00 0.00 ATOM 748 CD1 ILE 96 -2.367 13.232 19.155 1.00 0.00 ATOM 749 O ILE 96 -7.055 15.607 18.332 1.00 0.00 ATOM 750 C ILE 96 -6.594 14.753 19.078 1.00 0.00 ATOM 751 N GLU 97 -6.388 14.985 20.381 1.00 0.00 ATOM 752 CA GLU 97 -6.767 16.291 20.938 1.00 0.00 ATOM 753 CB GLU 97 -6.537 16.316 22.451 1.00 0.00 ATOM 754 CG GLU 97 -6.956 17.612 23.123 1.00 0.00 ATOM 755 CD GLU 97 -6.764 17.577 24.626 1.00 0.00 ATOM 756 OE1 GLU 97 -6.300 16.541 25.142 1.00 0.00 ATOM 757 OE2 GLU 97 -7.077 18.590 25.287 1.00 0.00 ATOM 758 O GLU 97 -4.778 17.120 19.870 1.00 0.00 ATOM 759 C GLU 97 -5.905 17.370 20.303 1.00 0.00 ATOM 760 N ARG 98 -6.556 18.601 20.086 1.00 0.00 ATOM 761 CA ARG 98 -5.931 19.664 19.325 1.00 0.00 ATOM 762 CB ARG 98 -7.057 20.798 19.273 1.00 0.00 ATOM 763 CG ARG 98 -6.499 22.032 18.555 1.00 0.00 ATOM 764 CD ARG 98 -7.591 23.107 18.578 1.00 0.00 ATOM 765 NE ARG 98 -7.178 24.233 17.749 1.00 0.00 ATOM 766 CZ ARG 98 -7.303 24.304 16.426 1.00 0.00 ATOM 767 NH1 ARG 98 -7.869 23.296 15.774 1.00 0.00 ATOM 768 NH2 ARG 98 -6.857 25.390 15.835 1.00 0.00 ATOM 769 O ARG 98 -3.619 20.256 19.162 1.00 0.00 ATOM 770 C ARG 98 -4.582 20.071 19.898 1.00 0.00 ATOM 771 N GLU 99 -4.512 20.211 21.206 1.00 0.00 ATOM 772 CA GLU 99 -3.263 20.616 21.827 1.00 0.00 ATOM 773 CB GLU 99 -3.441 20.799 23.334 1.00 0.00 ATOM 774 CG GLU 99 -4.282 22.008 23.716 1.00 0.00 ATOM 775 CD GLU 99 -4.516 22.106 25.212 1.00 0.00 ATOM 776 OE1 GLU 99 -4.080 21.191 25.941 1.00 0.00 ATOM 777 OE2 GLU 99 -5.135 23.097 25.653 1.00 0.00 ATOM 778 O GLU 99 -1.010 19.923 21.516 1.00 0.00 ATOM 779 C GLU 99 -2.192 19.592 21.597 1.00 0.00 ATOM 780 N SER 100 -2.590 18.328 21.536 1.00 0.00 ATOM 781 CA SER 100 -1.595 17.293 21.301 1.00 0.00 ATOM 782 CB SER 100 -2.218 15.905 21.457 1.00 0.00 ATOM 783 OG SER 100 -2.623 15.673 22.794 1.00 0.00 ATOM 784 O SER 100 0.171 17.281 19.656 1.00 0.00 ATOM 785 C SER 100 -1.033 17.429 19.875 1.00 0.00 ATOM 786 N GLN 101 -1.911 17.676 18.976 1.00 0.00 ATOM 787 CA GLN 101 -1.547 17.933 17.581 1.00 0.00 ATOM 788 CB GLN 101 -3.085 18.502 17.023 1.00 0.00 ATOM 789 CG GLN 101 -2.870 19.938 16.569 1.00 0.00 ATOM 790 CD GLN 101 -3.517 20.202 15.221 1.00 0.00 ATOM 791 OE1 GLN 101 -4.386 19.450 14.777 1.00 0.00 ATOM 792 NE2 GLN 101 -3.106 21.285 14.572 1.00 0.00 ATOM 793 O GLN 101 0.256 19.203 16.651 1.00 0.00 ATOM 794 C GLN 101 -0.663 19.163 17.471 1.00 0.00 ATOM 795 N LYS 102 -0.970 20.187 18.272 1.00 0.00 ATOM 796 CA LYS 102 -0.193 21.432 18.297 1.00 0.00 ATOM 797 CB LYS 102 -0.765 22.397 19.337 1.00 0.00 ATOM 798 CG LYS 102 -0.041 23.735 19.402 1.00 0.00 ATOM 799 CD LYS 102 -0.703 24.668 20.402 1.00 0.00 ATOM 800 CE LYS 102 0.046 25.987 20.505 1.00 0.00 ATOM 801 NZ LYS 102 -0.574 26.905 21.501 1.00 0.00 ATOM 802 O LYS 102 2.205 21.610 17.966 1.00 0.00 ATOM 803 C LYS 102 1.268 21.158 18.651 1.00 0.00 ATOM 804 N TRP 103 1.468 20.481 19.778 1.00 0.00 ATOM 805 CA TRP 103 2.822 20.199 20.197 1.00 0.00 ATOM 806 CB TRP 103 2.822 19.373 21.484 1.00 0.00 ATOM 807 CG TRP 103 4.195 19.004 21.958 1.00 0.00 ATOM 808 CD1 TRP 103 4.785 17.776 21.884 1.00 0.00 ATOM 809 CD2 TRP 103 5.150 19.872 22.581 1.00 0.00 ATOM 810 CE2 TRP 103 6.298 19.100 22.857 1.00 0.00 ATOM 811 CE3 TRP 103 5.150 21.224 22.933 1.00 0.00 ATOM 812 NE1 TRP 103 6.049 17.823 22.421 1.00 0.00 ATOM 813 CZ2 TRP 103 7.430 19.637 23.466 1.00 0.00 ATOM 814 CZ3 TRP 103 6.275 21.752 23.538 1.00 0.00 ATOM 815 CH2 TRP 103 7.399 20.963 23.799 1.00 0.00 ATOM 816 O TRP 103 4.733 19.758 18.794 1.00 0.00 ATOM 817 C TRP 103 3.585 19.428 19.098 1.00 0.00 ATOM 818 N ASN 104 2.926 18.402 18.721 1.00 0.00 ATOM 819 CA ASN 104 3.587 17.575 17.704 1.00 0.00 ATOM 820 CB ASN 104 2.719 16.396 17.261 1.00 0.00 ATOM 821 CG ASN 104 2.616 15.318 18.324 1.00 0.00 ATOM 822 ND2 ASN 104 1.595 14.476 18.214 1.00 0.00 ATOM 823 OD1 ASN 104 3.446 15.244 19.228 1.00 0.00 ATOM 824 O ASN 104 5.038 18.251 15.858 1.00 0.00 ATOM 825 C ASN 104 3.941 18.388 16.444 1.00 0.00 ATOM 826 N GLN 105 2.996 19.219 16.019 1.00 0.00 ATOM 827 CA GLN 105 3.171 20.015 14.814 1.00 0.00 ATOM 828 CB GLN 105 1.950 20.906 14.580 1.00 0.00 ATOM 829 CG GLN 105 2.029 21.749 13.317 1.00 0.00 ATOM 830 CD GLN 105 0.796 22.606 13.110 1.00 0.00 ATOM 831 OE1 GLN 105 -0.098 22.638 13.954 1.00 0.00 ATOM 832 NE2 GLN 105 0.743 23.300 11.978 1.00 0.00 ATOM 833 O GLN 105 5.097 21.100 13.926 1.00 0.00 ATOM 834 C GLN 105 4.354 20.960 14.897 1.00 0.00 ATOM 835 N VAL 106 4.544 21.634 16.025 1.00 0.00 ATOM 836 CA VAL 106 5.666 22.544 16.205 1.00 0.00 ATOM 837 CB VAL 106 5.489 23.405 17.491 1.00 0.00 ATOM 838 CG1 VAL 106 6.616 24.416 17.597 1.00 0.00 ATOM 839 CG2 VAL 106 4.148 24.125 17.455 1.00 0.00 ATOM 840 O VAL 106 7.989 22.284 15.729 1.00 0.00 ATOM 841 C VAL 106 6.985 21.786 16.220 1.00 0.00 ATOM 842 N VAL 107 6.974 20.566 16.785 1.00 0.00 ATOM 843 CA VAL 107 8.192 19.759 16.818 1.00 0.00 ATOM 844 CB VAL 107 7.927 18.493 17.651 1.00 0.00 ATOM 845 CG1 VAL 107 9.194 17.659 17.772 1.00 0.00 ATOM 846 CG2 VAL 107 7.460 18.862 19.050 1.00 0.00 ATOM 847 O VAL 107 9.998 19.096 15.341 1.00 0.00 ATOM 848 C VAL 107 8.789 19.384 15.453 1.00 0.00 ATOM 849 N ASP 108 7.957 19.430 14.329 1.00 0.00 ATOM 850 CA ASP 108 8.459 19.112 12.996 1.00 0.00 ATOM 851 CB ASP 108 7.305 18.727 12.050 1.00 0.00 ATOM 852 CG ASP 108 6.284 19.837 11.882 1.00 0.00 ATOM 853 OD1 ASP 108 6.670 21.023 11.861 1.00 0.00 ATOM 854 OD2 ASP 108 5.083 19.518 11.749 1.00 0.00 ATOM 855 O ASP 108 9.350 21.346 12.995 1.00 0.00 ATOM 856 C ASP 108 9.382 20.228 12.497 1.00 0.00 ATOM 857 N GLN 109 10.184 19.953 11.466 1.00 0.00 ATOM 858 CA GLN 109 11.046 21.035 10.999 1.00 0.00 ATOM 859 CB GLN 109 12.517 20.514 10.775 1.00 0.00 ATOM 860 CG GLN 109 13.274 20.047 11.986 1.00 0.00 ATOM 861 CD GLN 109 13.148 18.566 12.304 1.00 0.00 ATOM 862 OE1 GLN 109 12.822 17.738 11.444 1.00 0.00 ATOM 863 NE2 GLN 109 13.451 18.219 13.553 1.00 0.00 ATOM 864 O GLN 109 10.309 21.184 8.715 1.00 0.00 ATOM 865 C GLN 109 10.204 20.605 9.798 1.00 0.00 ATOM 866 N PHE 110 9.356 19.490 9.946 1.00 0.00 ATOM 867 CA PHE 110 8.621 18.925 8.827 1.00 0.00 ATOM 868 CB PHE 110 8.220 18.166 10.092 1.00 0.00 ATOM 869 CG PHE 110 7.369 16.956 9.830 1.00 0.00 ATOM 870 CD1 PHE 110 7.933 15.781 9.365 1.00 0.00 ATOM 871 CD2 PHE 110 6.003 16.994 10.049 1.00 0.00 ATOM 872 CE1 PHE 110 7.150 14.670 9.126 1.00 0.00 ATOM 873 CE2 PHE 110 5.218 15.882 9.808 1.00 0.00 ATOM 874 CZ PHE 110 5.787 14.723 9.348 1.00 0.00 ATOM 875 O PHE 110 7.086 18.381 7.070 1.00 0.00 ATOM 876 C PHE 110 7.318 19.098 8.044 1.00 0.00 ATOM 877 N GLN 111 6.411 19.926 8.587 1.00 0.00 ATOM 878 CA GLN 111 5.129 20.136 7.922 1.00 0.00 ATOM 879 CB GLN 111 4.640 21.606 8.542 1.00 0.00 ATOM 880 CG GLN 111 5.116 21.944 9.945 1.00 0.00 ATOM 881 CD GLN 111 5.017 23.411 10.259 1.00 0.00 ATOM 882 OE1 GLN 111 5.382 24.264 9.438 1.00 0.00 ATOM 883 NE2 GLN 111 4.534 23.718 11.446 1.00 0.00 ATOM 884 O GLN 111 4.576 20.217 5.595 1.00 0.00 ATOM 885 C GLN 111 5.312 20.620 6.494 1.00 0.00 ATOM 886 N GLU 112 6.278 21.485 6.310 1.00 0.00 ATOM 887 CA GLU 112 6.474 22.024 4.973 1.00 0.00 ATOM 888 CB GLU 112 7.538 23.122 4.976 1.00 0.00 ATOM 889 CG GLU 112 7.120 24.385 5.707 1.00 0.00 ATOM 890 CD GLU 112 8.241 25.405 5.797 1.00 0.00 ATOM 891 OE1 GLU 112 9.365 25.091 5.351 1.00 0.00 ATOM 892 OE2 GLU 112 7.995 26.515 6.312 1.00 0.00 ATOM 893 O GLU 112 6.428 20.883 2.885 1.00 0.00 ATOM 894 C GLU 112 6.903 20.932 4.018 1.00 0.00 ATOM 895 N ARG 113 7.775 19.993 4.479 1.00 0.00 ATOM 896 CA ARG 113 8.240 18.897 3.634 1.00 0.00 ATOM 897 CB ARG 113 9.195 18.108 4.410 1.00 0.00 ATOM 898 CG ARG 113 9.856 17.044 3.566 1.00 0.00 ATOM 899 CD ARG 113 10.638 16.047 4.418 1.00 0.00 ATOM 900 NE ARG 113 11.224 16.627 5.624 1.00 0.00 ATOM 901 CZ ARG 113 10.958 16.225 6.864 1.00 0.00 ATOM 902 NH1 ARG 113 10.102 15.224 7.144 1.00 0.00 ATOM 903 NH2 ARG 113 11.585 16.859 7.848 1.00 0.00 ATOM 904 O ARG 113 6.771 17.619 2.198 1.00 0.00 ATOM 905 C ARG 113 7.027 18.018 3.358 1.00 0.00 ATOM 906 N PHE 114 6.144 17.668 4.413 1.00 0.00 ATOM 907 CA PHE 114 4.930 16.867 4.207 1.00 0.00 ATOM 908 CB PHE 114 4.094 16.399 5.400 1.00 0.00 ATOM 909 CG PHE 114 3.022 15.409 5.037 1.00 0.00 ATOM 910 CD1 PHE 114 3.347 14.100 4.731 1.00 0.00 ATOM 911 CD2 PHE 114 1.692 15.791 5.003 1.00 0.00 ATOM 912 CE1 PHE 114 2.360 13.190 4.398 1.00 0.00 ATOM 913 CE2 PHE 114 0.708 14.880 4.669 1.00 0.00 ATOM 914 CZ PHE 114 1.036 13.584 4.368 1.00 0.00 ATOM 915 O PHE 114 3.241 16.731 2.511 1.00 0.00 ATOM 916 C PHE 114 3.946 17.467 3.204 1.00 0.00 ATOM 917 N GLY 115 3.932 18.814 3.345 1.00 0.00 ATOM 918 CA GLY 115 2.992 19.440 2.439 1.00 0.00 ATOM 919 O GLY 115 0.979 20.620 1.837 1.00 0.00 ATOM 920 C GLY 115 1.550 19.528 1.957 1.00 0.00 ATOM 921 N GLN 116 0.951 18.376 1.687 1.00 0.00 ATOM 922 CA GLN 116 -0.436 18.347 1.215 1.00 0.00 ATOM 923 CB GLN 116 -0.815 16.887 0.881 1.00 0.00 ATOM 924 CG GLN 116 -0.081 16.277 -0.322 1.00 0.00 ATOM 925 CD GLN 116 1.436 16.468 -0.286 1.00 0.00 ATOM 926 OE1 GLN 116 1.988 17.260 -1.052 1.00 0.00 ATOM 927 NE2 GLN 116 2.105 15.748 0.605 1.00 0.00 ATOM 928 O GLN 116 -2.327 19.624 1.966 1.00 0.00 ATOM 929 C GLN 116 -1.405 18.868 2.272 1.00 0.00 ATOM 930 N ILE 117 -1.152 18.541 3.547 1.00 0.00 ATOM 931 CA ILE 117 -2.008 18.978 4.639 1.00 0.00 ATOM 932 CB ILE 117 -1.580 18.331 5.976 1.00 0.00 ATOM 933 CG1 ILE 117 -1.466 16.813 5.812 1.00 0.00 ATOM 934 CG2 ILE 117 -2.610 18.639 7.055 1.00 0.00 ATOM 935 CD1 ILE 117 -0.922 16.103 7.032 1.00 0.00 ATOM 936 O ILE 117 -2.976 21.134 4.948 1.00 0.00 ATOM 937 C ILE 117 -1.947 20.493 4.828 1.00 0.00 ATOM 938 N ILE 118 -0.769 21.098 4.809 1.00 0.00 ATOM 939 CA ILE 118 -0.645 22.546 5.009 1.00 0.00 ATOM 940 CB ILE 118 0.840 22.941 5.092 1.00 0.00 ATOM 941 CG1 ILE 118 1.511 22.247 6.280 1.00 0.00 ATOM 942 CG2 ILE 118 0.986 24.443 5.268 1.00 0.00 ATOM 943 CD1 ILE 118 0.898 22.601 7.618 1.00 0.00 ATOM 944 O ILE 118 -1.959 24.362 4.138 1.00 0.00 ATOM 945 C ILE 118 -1.272 23.369 3.894 1.00 0.00 ATOM 946 N GLU 119 -1.092 22.931 2.660 1.00 0.00 ATOM 947 CA GLU 119 -1.589 23.729 1.544 1.00 0.00 ATOM 948 CB GLU 119 -0.427 24.226 0.683 1.00 0.00 ATOM 949 CG GLU 119 0.507 25.191 1.395 1.00 0.00 ATOM 950 CD GLU 119 1.667 25.631 0.525 1.00 0.00 ATOM 951 OE1 GLU 119 1.741 25.181 -0.640 1.00 0.00 ATOM 952 OE2 GLU 119 2.502 26.426 1.002 1.00 0.00 ATOM 953 O GLU 119 -3.303 23.644 -0.121 1.00 0.00 ATOM 954 C GLU 119 -2.537 23.004 0.597 1.00 0.00 ATOM 955 N VAL 120 -2.531 21.678 0.625 1.00 0.00 ATOM 956 CA VAL 120 -3.408 20.920 -0.257 1.00 0.00 ATOM 957 CB VAL 120 -2.696 19.732 -0.850 1.00 0.00 ATOM 958 CG1 VAL 120 -3.667 18.834 -1.573 1.00 0.00 ATOM 959 CG2 VAL 120 -1.578 20.204 -1.788 1.00 0.00 ATOM 960 O VAL 120 -5.775 20.645 -0.013 1.00 0.00 ATOM 961 C VAL 120 -4.657 20.401 0.444 1.00 0.00 ATOM 962 N LEU 121 -4.466 19.671 1.544 1.00 0.00 ATOM 963 CA LEU 121 -5.594 19.126 2.293 1.00 0.00 ATOM 964 CB LEU 121 -5.141 17.960 3.171 1.00 0.00 ATOM 965 CG LEU 121 -4.587 16.736 2.438 1.00 0.00 ATOM 966 CD1 LEU 121 -4.082 15.698 3.430 1.00 0.00 ATOM 967 CD2 LEU 121 -5.662 16.088 1.579 1.00 0.00 ATOM 968 O LEU 121 -5.560 21.146 3.584 1.00 0.00 ATOM 969 C LEU 121 -6.218 20.179 3.203 1.00 0.00 ATOM 970 N ARG 122 -7.437 19.910 3.655 1.00 0.00 ATOM 971 CA ARG 122 -8.119 20.831 4.549 1.00 0.00 ATOM 972 CB ARG 122 -9.642 20.597 4.506 1.00 0.00 ATOM 973 CG ARG 122 -10.339 20.916 3.188 1.00 0.00 ATOM 974 CD ARG 122 -11.838 20.995 3.341 1.00 0.00 ATOM 975 NE ARG 122 -12.551 21.021 2.077 1.00 0.00 ATOM 976 CZ ARG 122 -12.627 22.071 1.287 1.00 0.00 ATOM 977 NH1 ARG 122 -12.028 23.194 1.626 1.00 0.00 ATOM 978 NH2 ARG 122 -13.329 21.986 0.164 1.00 0.00 ATOM 979 O ARG 122 -7.978 23.141 5.101 1.00 0.00 ATOM 980 C ARG 122 -7.507 22.003 5.270 1.00 0.00 ATOM 981 N GLY 123 -6.459 21.762 6.173 1.00 0.00 ATOM 982 CA GLY 123 -5.875 22.853 6.910 1.00 0.00 ATOM 983 O GLY 123 -5.321 22.142 9.126 1.00 0.00 ATOM 984 C GLY 123 -5.294 23.057 8.294 1.00 0.00 ATOM 985 N LEU 124 -4.673 24.204 8.517 1.00 0.00 ATOM 986 CA LEU 124 -4.047 24.531 9.796 1.00 0.00 ATOM 987 CB LEU 124 -3.211 25.812 9.662 1.00 0.00 ATOM 988 CG LEU 124 -2.071 25.733 8.638 1.00 0.00 ATOM 989 CD1 LEU 124 -1.409 27.102 8.475 1.00 0.00 ATOM 990 CD2 LEU 124 -1.064 24.658 9.069 1.00 0.00 ATOM 991 O LEU 124 -4.960 23.908 11.911 1.00 0.00 ATOM 992 C LEU 124 -5.138 24.524 10.848 1.00 0.00 ATOM 993 N ALA 125 -6.214 25.283 10.642 1.00 0.00 ATOM 994 CA ALA 125 -7.285 25.332 11.646 1.00 0.00 ATOM 995 CB ALA 125 -8.275 26.348 11.448 1.00 0.00 ATOM 996 O ALA 125 -8.466 23.366 12.281 1.00 0.00 ATOM 997 C ALA 125 -7.839 23.928 11.400 1.00 0.00 ATOM 998 N ASP 126 -7.554 23.376 10.243 1.00 0.00 ATOM 999 CA ASP 126 -8.051 22.049 9.898 1.00 0.00 ATOM 1000 CB ASP 126 -8.782 22.075 8.558 1.00 0.00 ATOM 1001 CG ASP 126 -10.004 22.987 8.579 1.00 0.00 ATOM 1002 OD1 ASP 126 -11.013 22.651 9.251 1.00 0.00 ATOM 1003 OD2 ASP 126 -10.049 24.069 7.949 1.00 0.00 ATOM 1004 O ASP 126 -7.096 19.907 9.441 1.00 0.00 ATOM 1005 C ASP 126 -6.912 21.030 9.893 1.00 0.00 ATOM 1006 N PHE 127 -5.776 21.413 10.427 1.00 0.00 ATOM 1007 CA PHE 127 -4.654 20.485 10.474 1.00 0.00 ATOM 1008 CB PHE 127 -3.370 21.238 10.778 1.00 0.00 ATOM 1009 CG PHE 127 -2.158 20.324 10.782 1.00 0.00 ATOM 1010 CD1 PHE 127 -1.769 19.671 9.630 1.00 0.00 ATOM 1011 CD2 PHE 127 -1.483 20.081 11.960 1.00 0.00 ATOM 1012 CE1 PHE 127 -0.720 18.772 9.664 1.00 0.00 ATOM 1013 CE2 PHE 127 -0.437 19.180 11.989 1.00 0.00 ATOM 1014 CZ PHE 127 -0.057 18.529 10.839 1.00 0.00 ATOM 1015 O PHE 127 -5.120 19.882 12.727 1.00 0.00 ATOM 1016 C PHE 127 -4.847 19.472 11.585 1.00 0.00 ATOM 1017 N ARG 128 -4.759 18.307 11.124 1.00 0.00 ATOM 1018 CA ARG 128 -5.197 17.239 12.023 1.00 0.00 ATOM 1019 CB ARG 128 -5.696 17.014 13.556 1.00 0.00 ATOM 1020 CG ARG 128 -7.126 17.401 13.903 1.00 0.00 ATOM 1021 CD ARG 128 -7.260 18.924 14.037 1.00 0.00 ATOM 1022 NE ARG 128 -8.654 19.292 14.278 1.00 0.00 ATOM 1023 CZ ARG 128 -9.566 19.754 13.455 1.00 0.00 ATOM 1024 NH1 ARG 128 -9.351 20.015 12.162 1.00 0.00 ATOM 1025 NH2 ARG 128 -10.800 19.987 13.918 1.00 0.00 ATOM 1026 O ARG 128 -3.599 15.651 11.143 1.00 0.00 ATOM 1027 C ARG 128 -4.483 15.892 11.978 1.00 0.00 ATOM 1028 N ILE 129 -4.789 14.867 12.902 1.00 0.00 ATOM 1029 CA ILE 129 -4.148 13.574 12.944 1.00 0.00 ATOM 1030 CB ILE 129 -2.940 13.595 13.933 1.00 0.00 ATOM 1031 CG1 ILE 129 -2.201 12.249 13.936 1.00 0.00 ATOM 1032 CG2 ILE 129 -3.406 13.953 15.341 1.00 0.00 ATOM 1033 CD1 ILE 129 -0.966 12.240 14.830 1.00 0.00 ATOM 1034 O ILE 129 -6.001 12.800 14.251 1.00 0.00 ATOM 1035 C ILE 129 -5.024 12.500 13.551 1.00 0.00 ATOM 1036 N PHE 130 -4.546 11.264 13.467 1.00 0.00 ATOM 1037 CA PHE 130 -5.260 10.122 13.993 1.00 0.00 ATOM 1038 CB PHE 130 -5.918 9.334 12.859 1.00 0.00 ATOM 1039 CG PHE 130 -6.926 10.122 12.076 1.00 0.00 ATOM 1040 CD1 PHE 130 -6.557 10.797 10.927 1.00 0.00 ATOM 1041 CD2 PHE 130 -8.246 10.191 12.490 1.00 0.00 ATOM 1042 CE1 PHE 130 -7.488 11.522 10.206 1.00 0.00 ATOM 1043 CE2 PHE 130 -9.177 10.915 11.770 1.00 0.00 ATOM 1044 CZ PHE 130 -8.801 11.582 10.630 1.00 0.00 ATOM 1045 O PHE 130 -3.114 9.130 14.468 1.00 0.00 ATOM 1046 C PHE 130 -4.325 9.196 14.739 1.00 0.00 ATOM 1047 N GLN 131 -4.890 8.501 15.714 1.00 0.00 ATOM 1048 CA GLN 131 -4.155 7.522 16.482 1.00 0.00 ATOM 1049 CB GLN 131 -4.699 7.690 17.860 1.00 0.00 ATOM 1050 CG GLN 131 -3.797 8.764 18.531 1.00 0.00 ATOM 1051 CD GLN 131 -4.073 8.922 20.010 1.00 0.00 ATOM 1052 OE1 GLN 131 -5.242 8.973 20.430 1.00 0.00 ATOM 1053 NE2 GLN 131 -3.002 8.997 20.819 1.00 0.00 ATOM 1054 O GLN 131 -6.066 6.218 16.089 1.00 0.00 ATOM 1055 C GLN 131 -4.876 6.229 16.137 1.00 0.00 ATOM 1056 N LEU 132 -4.136 5.227 15.736 1.00 0.00 ATOM 1057 CA LEU 132 -4.748 3.924 15.447 1.00 0.00 ATOM 1058 CB LEU 132 -4.124 3.334 14.181 1.00 0.00 ATOM 1059 CG LEU 132 -4.297 4.152 12.895 1.00 0.00 ATOM 1060 CD1 LEU 132 -3.578 3.483 11.736 1.00 0.00 ATOM 1061 CD2 LEU 132 -5.770 4.278 12.535 1.00 0.00 ATOM 1062 O LEU 132 -3.390 2.659 16.950 1.00 0.00 ATOM 1063 C LEU 132 -4.524 2.971 16.606 1.00 0.00 ATOM 1064 N THR 133 -5.577 2.452 17.211 1.00 0.00 ATOM 1065 CA THR 133 -5.435 1.533 18.325 1.00 0.00 ATOM 1066 CB THR 133 -6.766 1.261 19.059 1.00 0.00 ATOM 1067 CG2 THR 133 -7.438 2.575 19.492 1.00 0.00 ATOM 1068 OG1 THR 133 -7.665 0.571 18.166 1.00 0.00 ATOM 1069 O THR 133 -5.140 -0.320 16.818 1.00 0.00 ATOM 1070 C THR 133 -4.801 0.205 17.888 1.00 0.00 ATOM 1071 N PRO 134 -4.214 -0.487 18.860 1.00 0.00 ATOM 1072 CA PRO 134 -3.561 -1.774 18.640 1.00 0.00 ATOM 1073 CB PRO 134 -2.398 -1.705 19.612 1.00 0.00 ATOM 1074 CG PRO 134 -2.904 -0.846 20.719 1.00 0.00 ATOM 1075 CD PRO 134 -3.612 0.275 19.973 1.00 0.00 ATOM 1076 O PRO 134 -4.452 -3.441 20.120 1.00 0.00 ATOM 1077 C PRO 134 -4.485 -2.938 19.001 1.00 0.00 ATOM 1078 N LYS 135 -5.264 -3.469 17.911 1.00 0.00 ATOM 1079 CA LYS 135 -6.099 -4.623 18.178 1.00 0.00 ATOM 1080 CB LYS 135 -7.418 -4.519 17.413 1.00 0.00 ATOM 1081 CG LYS 135 -8.314 -3.379 17.870 1.00 0.00 ATOM 1082 CD LYS 135 -9.631 -3.373 17.110 1.00 0.00 ATOM 1083 CE LYS 135 -10.526 -2.232 17.566 1.00 0.00 ATOM 1084 NZ LYS 135 -11.762 -2.134 16.742 1.00 0.00 ATOM 1085 O LYS 135 -5.382 -6.906 18.394 1.00 0.00 ATOM 1086 C LYS 135 -5.337 -5.866 17.730 1.00 0.00 ATOM 1087 N GLU 136 -4.597 -5.740 16.632 1.00 0.00 ATOM 1088 CA GLU 136 -3.813 -6.841 16.093 1.00 0.00 ATOM 1089 CB GLU 136 -4.654 -7.602 15.071 1.00 0.00 ATOM 1090 CG GLU 136 -5.996 -8.075 15.613 1.00 0.00 ATOM 1091 CD GLU 136 -6.841 -8.752 14.563 1.00 0.00 ATOM 1092 OE1 GLU 136 -7.200 -8.082 13.565 1.00 0.00 ATOM 1093 OE2 GLU 136 -7.144 -9.952 14.739 1.00 0.00 ATOM 1094 O GLU 136 -2.698 -5.561 14.421 1.00 0.00 ATOM 1095 C GLU 136 -2.578 -6.366 15.347 1.00 0.00 ATOM 1096 N GLY 137 -1.404 -6.858 15.738 1.00 0.00 ATOM 1097 CA GLY 137 -0.178 -6.524 15.009 1.00 0.00 ATOM 1098 O GLY 137 0.509 -8.819 15.175 1.00 0.00 ATOM 1099 C GLY 137 0.305 -7.839 14.426 1.00 0.00 ATOM 1100 N ARG 138 0.515 -7.957 12.959 1.00 0.00 ATOM 1101 CA ARG 138 0.959 -9.186 12.308 1.00 0.00 ATOM 1102 CB ARG 138 -0.106 -9.708 11.352 1.00 0.00 ATOM 1103 CG ARG 138 -1.343 -10.286 11.981 1.00 0.00 ATOM 1104 CD ARG 138 -2.294 -10.744 10.877 1.00 0.00 ATOM 1105 NE ARG 138 -2.935 -9.616 10.202 1.00 0.00 ATOM 1106 CZ ARG 138 -3.355 -9.624 8.938 1.00 0.00 ATOM 1107 NH1 ARG 138 -3.203 -10.703 8.182 1.00 0.00 ATOM 1108 NH2 ARG 138 -3.944 -8.553 8.433 1.00 0.00 ATOM 1109 O ARG 138 2.454 -7.968 10.876 1.00 0.00 ATOM 1110 C ARG 138 2.305 -8.920 11.639 1.00 0.00 ATOM 1111 N PHE 139 3.278 -9.775 11.935 1.00 0.00 ATOM 1112 CA PHE 139 4.612 -9.685 11.353 1.00 0.00 ATOM 1113 CB PHE 139 5.670 -9.770 12.424 1.00 0.00 ATOM 1114 CG PHE 139 7.059 -9.863 11.859 1.00 0.00 ATOM 1115 CD1 PHE 139 7.552 -8.846 11.061 1.00 0.00 ATOM 1116 CD2 PHE 139 7.877 -10.948 12.131 1.00 0.00 ATOM 1117 CE1 PHE 139 8.829 -8.908 10.536 1.00 0.00 ATOM 1118 CE2 PHE 139 9.156 -11.013 11.615 1.00 0.00 ATOM 1119 CZ PHE 139 9.632 -10.001 10.803 1.00 0.00 ATOM 1120 O PHE 139 4.417 -12.013 10.741 1.00 0.00 ATOM 1121 C PHE 139 4.804 -10.879 10.424 1.00 0.00 ATOM 1122 N VAL 140 5.364 -10.612 9.254 1.00 0.00 ATOM 1123 CA VAL 140 5.636 -11.657 8.274 1.00 0.00 ATOM 1124 CB VAL 140 4.705 -11.541 7.050 1.00 0.00 ATOM 1125 CG1 VAL 140 5.032 -12.616 6.031 1.00 0.00 ATOM 1126 CG2 VAL 140 3.251 -11.697 7.473 1.00 0.00 ATOM 1127 O VAL 140 7.552 -10.377 7.579 1.00 0.00 ATOM 1128 C VAL 140 7.090 -11.494 7.830 1.00 0.00 ATOM 1129 N ILE 141 7.823 -12.596 7.766 1.00 0.00 ATOM 1130 CA ILE 141 9.195 -12.545 7.272 1.00 0.00 ATOM 1131 CB ILE 141 10.212 -12.567 8.427 1.00 0.00 ATOM 1132 CG1 ILE 141 11.639 -12.452 7.883 1.00 0.00 ATOM 1133 CG2 ILE 141 10.100 -13.862 9.214 1.00 0.00 ATOM 1134 CD1 ILE 141 12.677 -12.169 8.947 1.00 0.00 ATOM 1135 O ILE 141 8.598 -14.652 6.400 1.00 0.00 ATOM 1136 C ILE 141 9.332 -13.685 6.297 1.00 0.00 ATOM 1137 N GLY 142 9.954 -13.477 5.152 1.00 0.00 ATOM 1138 CA GLY 142 10.141 -14.502 4.160 1.00 0.00 ATOM 1139 O GLY 142 10.989 -15.564 6.116 1.00 0.00 ATOM 1140 C GLY 142 10.622 -15.707 4.947 1.00 0.00 ATOM 1141 N PHE 143 10.479 -17.011 4.473 1.00 0.00 ATOM 1142 CA PHE 143 10.735 -18.282 5.162 1.00 0.00 ATOM 1143 CB PHE 143 12.327 -18.280 4.604 1.00 0.00 ATOM 1144 CG PHE 143 13.117 -17.418 5.559 1.00 0.00 ATOM 1145 CD1 PHE 143 13.337 -17.823 6.871 1.00 0.00 ATOM 1146 CD2 PHE 143 13.639 -16.196 5.138 1.00 0.00 ATOM 1147 CE1 PHE 143 14.059 -17.021 7.749 1.00 0.00 ATOM 1148 CE2 PHE 143 14.363 -15.387 6.008 1.00 0.00 ATOM 1149 CZ PHE 143 14.574 -15.803 7.318 1.00 0.00 ATOM 1150 O PHE 143 10.438 -19.011 7.423 1.00 0.00 ATOM 1151 C PHE 143 10.080 -18.227 6.555 1.00 0.00 ATOM 1152 N GLY 144 9.106 -17.256 6.941 1.00 0.00 ATOM 1153 CA GLY 144 8.381 -17.409 8.183 1.00 0.00 ATOM 1154 O GLY 144 7.811 -15.081 8.266 1.00 0.00 ATOM 1155 C GLY 144 7.445 -16.246 8.469 1.00 0.00 ATOM 1156 N ALA 145 6.276 -16.554 9.018 1.00 0.00 ATOM 1157 CA ALA 145 5.291 -15.536 9.343 1.00 0.00 ATOM 1158 CB ALA 145 4.249 -15.448 8.226 1.00 0.00 ATOM 1159 O ALA 145 4.783 -16.945 11.226 1.00 0.00 ATOM 1160 C ALA 145 4.842 -15.805 10.779 1.00 0.00 ATOM 1161 N ALA 146 4.680 -14.698 11.516 1.00 0.00 ATOM 1162 CA ALA 146 4.185 -14.767 12.892 1.00 0.00 ATOM 1163 CB ALA 146 5.327 -14.746 13.897 1.00 0.00 ATOM 1164 O ALA 146 3.712 -12.404 13.105 1.00 0.00 ATOM 1165 C ALA 146 3.283 -13.570 13.151 1.00 0.00 ATOM 1166 N TYR 147 2.089 -13.866 13.625 1.00 0.00 ATOM 1167 CA TYR 147 1.128 -12.840 13.928 1.00 0.00 ATOM 1168 CB TYR 147 -0.234 -13.193 13.349 1.00 0.00 ATOM 1169 CG TYR 147 -0.231 -13.340 11.851 1.00 0.00 ATOM 1170 CD1 TYR 147 0.805 -12.817 11.072 1.00 0.00 ATOM 1171 CD2 TYR 147 -1.354 -13.820 11.197 1.00 0.00 ATOM 1172 CE1 TYR 147 0.721 -12.809 9.705 1.00 0.00 ATOM 1173 CE2 TYR 147 -1.414 -13.869 9.832 1.00 0.00 ATOM 1174 CZ TYR 147 -0.357 -13.401 9.097 1.00 0.00 ATOM 1175 OH TYR 147 -0.430 -13.419 7.752 1.00 0.00 ATOM 1176 O TYR 147 0.752 -13.692 16.136 1.00 0.00 ATOM 1177 C TYR 147 1.008 -12.706 15.445 1.00 0.00 ATOM 1178 N HIS 148 1.258 -11.377 15.900 1.00 0.00 ATOM 1179 CA HIS 148 1.098 -11.122 17.334 1.00 0.00 ATOM 1180 CB HIS 148 2.252 -10.281 17.918 1.00 0.00 ATOM 1181 CG HIS 148 3.539 -11.012 18.138 1.00 0.00 ATOM 1182 CD2 HIS 148 3.921 -12.273 17.836 1.00 0.00 ATOM 1183 ND1 HIS 148 4.636 -10.405 18.713 1.00 0.00 ATOM 1184 CE1 HIS 148 5.639 -11.262 18.752 1.00 0.00 ATOM 1185 NE2 HIS 148 5.231 -12.403 18.226 1.00 0.00 ATOM 1186 O HIS 148 -0.331 -9.210 17.105 1.00 0.00 ATOM 1187 C HIS 148 -0.232 -10.384 17.463 1.00 0.00 ATOM 1188 N ILE 149 -1.167 -11.015 18.108 1.00 0.00 ATOM 1189 CA ILE 149 -2.493 -10.428 18.273 1.00 0.00 ATOM 1190 CB ILE 149 -3.540 -11.465 17.830 1.00 0.00 ATOM 1191 CG1 ILE 149 -3.296 -11.884 16.378 1.00 0.00 ATOM 1192 CG2 ILE 149 -4.942 -10.887 17.932 1.00 0.00 ATOM 1193 CD1 ILE 149 -4.154 -13.045 15.927 1.00 0.00 ATOM 1194 O ILE 149 -2.835 -10.929 20.586 1.00 0.00 ATOM 1195 C ILE 149 -2.810 -10.064 19.721 1.00 0.00 ATOM 1196 N SER 150 -3.024 -8.760 19.947 1.00 0.00 ATOM 1197 CA SER 150 -3.400 -8.271 21.286 1.00 0.00 ATOM 1198 CB SER 150 -3.235 -6.727 21.340 1.00 0.00 ATOM 1199 OG SER 150 -4.252 -6.101 20.582 1.00 0.00 ATOM 1200 O SER 150 -5.614 -9.032 20.906 1.00 0.00 ATOM 1201 C SER 150 -4.703 -8.903 21.723 1.00 0.00 ATOM 1202 N GLY 151 -4.680 -9.539 22.892 1.00 0.00 ATOM 1203 CA GLY 151 -5.849 -10.213 23.463 1.00 0.00 ATOM 1204 O GLY 151 -4.364 -10.247 25.355 1.00 0.00 ATOM 1205 C GLY 151 -5.498 -9.985 24.918 1.00 0.00 ATOM 1206 N ASP 152 -6.619 -9.628 25.679 1.00 0.00 ATOM 1207 CA ASP 152 -6.619 -9.285 27.125 1.00 0.00 ATOM 1208 CB ASP 152 -6.748 -10.648 27.809 1.00 0.00 ATOM 1209 CG ASP 152 -7.054 -10.527 29.290 1.00 0.00 ATOM 1210 OD1 ASP 152 -7.491 -9.440 29.720 1.00 0.00 ATOM 1211 OD2 ASP 152 -6.856 -11.522 30.020 1.00 0.00 ATOM 1212 O ASP 152 -4.601 -9.272 28.406 1.00 0.00 ATOM 1213 C ASP 152 -5.350 -8.637 27.661 1.00 0.00 ATOM 1214 N ARG 153 -5.030 -7.449 27.159 1.00 0.00 ATOM 1215 CA ARG 153 -3.843 -6.740 27.618 1.00 0.00 ATOM 1216 CB ARG 153 -4.354 -5.557 28.544 1.00 0.00 ATOM 1217 CG ARG 153 -3.294 -4.721 29.248 1.00 0.00 ATOM 1218 CD ARG 153 -2.477 -3.939 28.238 1.00 0.00 ATOM 1219 NE ARG 153 -3.189 -2.782 27.722 1.00 0.00 ATOM 1220 CZ ARG 153 -3.473 -1.704 28.454 1.00 0.00 ATOM 1221 NH1 ARG 153 -3.096 -1.652 29.726 1.00 0.00 ATOM 1222 NH2 ARG 153 -4.113 -0.673 27.911 1.00 0.00 ATOM 1223 O ARG 153 -1.650 -7.520 28.228 1.00 0.00 ATOM 1224 C ARG 153 -2.584 -7.585 27.425 1.00 0.00 ATOM 1225 N LEU 154 -2.596 -8.451 26.420 1.00 0.00 ATOM 1226 CA LEU 154 -1.429 -9.296 26.157 1.00 0.00 ATOM 1227 CB LEU 154 -1.516 -10.604 26.937 1.00 0.00 ATOM 1228 CG LEU 154 -2.632 -11.617 26.679 1.00 0.00 ATOM 1229 CD1 LEU 154 -2.446 -12.298 25.320 1.00 0.00 ATOM 1230 CD2 LEU 154 -2.597 -12.661 27.787 1.00 0.00 ATOM 1231 O LEU 154 -2.156 -9.145 23.897 1.00 0.00 ATOM 1232 C LEU 154 -1.378 -9.677 24.683 1.00 0.00 ATOM 1233 N ASP 155 -0.283 -10.320 24.283 1.00 0.00 ATOM 1234 CA ASP 155 -0.093 -10.743 22.895 1.00 0.00 ATOM 1235 CB ASP 155 1.314 -10.354 22.485 1.00 0.00 ATOM 1236 CG ASP 155 1.685 -10.883 21.106 1.00 0.00 ATOM 1237 OD1 ASP 155 0.897 -11.622 20.477 1.00 0.00 ATOM 1238 OD2 ASP 155 2.809 -10.565 20.666 1.00 0.00 ATOM 1239 O ASP 155 0.604 -12.974 23.401 1.00 0.00 ATOM 1240 C ASP 155 -0.135 -12.256 22.734 1.00 0.00 ATOM 1241 N THR 156 -1.078 -12.740 21.804 1.00 0.00 ATOM 1242 CA THR 156 -1.193 -14.133 21.417 1.00 0.00 ATOM 1243 CB THR 156 -2.662 -14.536 21.186 1.00 0.00 ATOM 1244 CG2 THR 156 -2.752 -15.989 20.753 1.00 0.00 ATOM 1245 OG1 THR 156 -3.403 -14.363 22.399 1.00 0.00 ATOM 1246 O THR 156 -0.718 -13.597 19.124 1.00 0.00 ATOM 1247 C THR 156 -0.387 -14.246 20.122 1.00 0.00 ATOM 1248 N LEU 157 0.546 -15.197 20.092 1.00 0.00 ATOM 1249 CA LEU 157 1.397 -15.438 18.926 1.00 0.00 ATOM 1250 CB LEU 157 2.871 -15.650 19.331 1.00 0.00 ATOM 1251 CG LEU 157 3.786 -16.094 18.175 1.00 0.00 ATOM 1252 CD1 LEU 157 3.846 -15.118 17.018 1.00 0.00 ATOM 1253 CD2 LEU 157 5.174 -16.407 18.782 1.00 0.00 ATOM 1254 O LEU 157 0.863 -17.802 18.755 1.00 0.00 ATOM 1255 C LEU 157 1.060 -16.736 18.158 1.00 0.00 ATOM 1256 N VAL 158 0.890 -16.649 16.848 1.00 0.00 ATOM 1257 CA VAL 158 0.629 -17.788 15.993 1.00 0.00 ATOM 1258 CB VAL 158 -0.759 -17.734 15.333 1.00 0.00 ATOM 1259 CG1 VAL 158 -1.032 -19.010 14.547 1.00 0.00 ATOM 1260 CG2 VAL 158 -1.864 -17.489 16.351 1.00 0.00 ATOM 1261 O VAL 158 1.754 -16.899 14.047 1.00 0.00 ATOM 1262 C VAL 158 1.676 -17.810 14.876 1.00 0.00 ATOM 1263 N PRO 159 2.480 -18.864 14.848 1.00 0.00 ATOM 1264 CA PRO 159 3.459 -19.078 13.797 1.00 0.00 ATOM 1265 CB PRO 159 4.310 -20.220 14.328 1.00 0.00 ATOM 1266 CG PRO 159 4.168 -20.132 15.818 1.00 0.00 ATOM 1267 CD PRO 159 2.711 -19.736 16.000 1.00 0.00 ATOM 1268 O PRO 159 2.032 -20.367 12.390 1.00 0.00 ATOM 1269 C PRO 159 2.748 -19.370 12.489 1.00 0.00 ATOM 1270 N ILE 160 3.098 -18.623 11.439 1.00 0.00 ATOM 1271 CA ILE 160 2.494 -18.811 10.131 1.00 0.00 ATOM 1272 CB ILE 160 1.750 -17.535 9.705 1.00 0.00 ATOM 1273 CG1 ILE 160 0.610 -17.215 10.696 1.00 0.00 ATOM 1274 CG2 ILE 160 1.148 -17.582 8.267 1.00 0.00 ATOM 1275 CD1 ILE 160 -0.489 -18.293 10.738 1.00 0.00 ATOM 1276 O ILE 160 4.653 -18.421 9.206 1.00 0.00 ATOM 1277 C ILE 160 3.544 -18.914 9.020 1.00 0.00 ATOM 1278 N THR 161 3.175 -19.601 7.948 1.00 0.00 ATOM 1279 CA THR 161 4.088 -19.737 6.818 1.00 0.00 ATOM 1280 CB THR 161 3.845 -21.063 6.054 1.00 0.00 ATOM 1281 CG2 THR 161 3.904 -22.245 7.020 1.00 0.00 ATOM 1282 OG1 THR 161 2.557 -21.027 5.424 1.00 0.00 ATOM 1283 O THR 161 2.873 -18.234 5.360 1.00 0.00 ATOM 1284 C THR 161 3.935 -18.529 5.921 1.00 0.00 ATOM 1285 N GLY 162 5.076 -17.772 5.684 1.00 0.00 ATOM 1286 CA GLY 162 5.075 -16.637 4.809 1.00 0.00 ATOM 1287 O GLY 162 5.188 -18.269 3.078 1.00 0.00 ATOM 1288 C GLY 162 5.194 -17.073 3.360 1.00 0.00 ATOM 1289 N ASP 163 5.271 -16.132 2.403 1.00 0.00 ATOM 1290 CA ASP 163 5.383 -16.476 0.994 1.00 0.00 ATOM 1291 CB ASP 163 5.323 -15.213 0.128 1.00 0.00 ATOM 1292 CG ASP 163 3.942 -14.580 0.035 1.00 0.00 ATOM 1293 OD1 ASP 163 2.992 -15.210 0.435 1.00 0.00 ATOM 1294 OD2 ASP 163 3.864 -13.417 -0.282 1.00 0.00 ATOM 1295 O ASP 163 6.692 -18.132 -0.137 1.00 0.00 ATOM 1296 C ASP 163 6.670 -17.241 0.716 1.00 0.00 ATOM 1297 N LYS 164 7.683 -17.042 1.536 1.00 0.00 ATOM 1298 CA LYS 164 8.967 -17.711 1.371 1.00 0.00 ATOM 1299 CB LYS 164 10.114 -16.721 1.573 1.00 0.00 ATOM 1300 CG LYS 164 10.112 -15.578 0.590 1.00 0.00 ATOM 1301 CD LYS 164 10.372 -16.098 -0.806 1.00 0.00 ATOM 1302 CE LYS 164 10.396 -14.987 -1.826 1.00 0.00 ATOM 1303 NZ LYS 164 10.643 -15.580 -3.157 1.00 0.00 ATOM 1304 O LYS 164 10.191 -19.557 2.295 1.00 0.00 ATOM 1305 C LYS 164 9.083 -19.031 2.138 1.00 0.00 ATOM 1306 N GLY 165 7.998 -19.452 2.776 1.00 0.00 ATOM 1307 CA GLY 165 8.016 -20.697 3.515 1.00 0.00 ATOM 1308 O GLY 165 8.548 -21.639 5.641 1.00 0.00 ATOM 1309 C GLY 165 8.384 -20.606 4.984 1.00 0.00 TER END