data_6irb_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6irb _Structure_validation_residue.Date_analyzed 2018-12-28 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 C--O 1.237 0.432 0 CA-C-O 121.035 0.445 . . . . 114.03 111.154 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -60.51 139.53 86.71 Favored 'Trans proline' 0 C--O 1.24 0.619 0 C-N-CA 121.132 1.221 . . . . 98.14 111.852 175.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.12 139.62 71.45 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 120.732 0.955 . . . . 113.11 111.169 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.46 141.15 20.68 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 120.159 -0.617 . . . . 95.75 110.847 173.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 37.8 t -123.86 132.84 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 106.102 -1.814 . . . . 84.45 106.102 168.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -112.49 121.61 45.31 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.439 -0.948 . . . . 76.84 108.439 -174.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -47.79 146.1 4.12 Favored Pre-proline 0 C--O 1.239 0.517 0 N-CA-C 109.056 -0.72 . . . . 93.86 109.056 168.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.39 144.36 22.85 Favored 'Trans proline' 0 C--N 1.324 -0.726 0 N-CA-C 108.883 -1.237 . . . . 85.96 108.883 168.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 m -88.46 123.03 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.146 -1.798 . . . . 111.02 106.146 178.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . 0.484 ' OG1' ' OG ' ' A' ' 35' ' ' SER . 10.3 p -123.71 152.88 41.6 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.035 -0.728 . . . . 90.86 109.035 -169.778 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 tp -45.77 -41.84 11.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.413 -0.812 . . . . 128.45 110.497 168.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tp10 -61.59 -60.82 3.11 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.464 0.542 . . . . 114.14 112.464 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . 0.484 ' OG ' ' OG1' ' A' ' 32' ' ' THR . 1.9 p -58.28 -41.4 84.28 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.954 -0.467 . . . . 96.8 112.069 -176.243 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.4 mt -63.64 -39.55 94.64 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.059 -0.657 . . . . 93.53 109.823 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -58.72 -34.94 71.9 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.198 0.599 . . . . 113.81 110.971 -178.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -88.85 -3.32 58.78 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.988 1.107 . . . . 148.88 113.988 -174.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -63.5 138.6 58.57 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 117.951 -1.5 . . . . 132.47 107.592 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -71.53 -34.42 70.02 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 117.371 -1.732 . . . . 113.87 111.139 -176.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -52.98 -46.04 61.41 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.225 -0.988 . . . . 95.24 112.649 171.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -71.47 -31.76 67.52 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.113 -0.639 . . . . 99.22 112.196 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -69.02 -31.77 70.81 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 118.98 -1.088 . . . . 96.16 110.375 178.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . . . -57.75 -25.47 60.48 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.813 -0.355 . . . . 101.69 111.143 174.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.7 t -70.53 -48.78 57.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.034 -0.666 . . . . 97.78 109.726 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -50.94 -50.13 39.57 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 116.185 -0.461 . . . . 110.81 113.411 172.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -60.25 -48.94 79.62 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.19 -0.594 . . . . 98.72 110.464 -174.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -48.53 -47.93 38.75 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.977 -0.452 . . . . 102.71 111.366 171.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -61.7 -44.97 95.9 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.227 -0.295 . . . . 95.65 111.406 -175.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 8.3 pt -62.55 -49.09 85.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 119.753 -0.779 . . . . 114.14 110.165 -177.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.1 tptt -52.7 -40.91 63.42 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.964 -0.695 . . . . 112.82 111.538 175.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.53 -28.16 66.83 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.91 -0.316 . . . . 105.26 110.971 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -90.53 -35.69 14.92 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.768 1.227 . . . . 90.64 110.546 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -56.74 -50.94 70.75 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.342 -0.543 . . . . 124.23 109.873 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.9 p -60.71 -29.52 69.39 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 120.553 -0.459 . . . . 107.41 112.235 177.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 tp -71.74 -44.58 63.85 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.816 -0.754 . . . . 93.5 110.833 174.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.42 -26.56 65.27 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.891 -0.323 . . . . 107.4 110.942 173.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . . . -79.51 -21.3 45.46 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.438 -0.315 . . . . 112.32 110.648 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -82.75 -25.89 32.42 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.582 -0.447 . . . . 110.16 110.784 173.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -83.89 -50.69 7.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.004 -0.678 . . . . 92.5 110.569 -177.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -50.89 -50.37 57.43 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.131 0.419 . . . . 94.54 112.131 176.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.1 mtmt -50.45 -53.93 25.92 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.328 -0.549 . . . . 106.68 111.089 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -65.97 -58.49 5.41 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.304 -0.959 . . . . 98.7 110.964 -177.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . . . -37.3 -52.96 1.09 Allowed 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.495 0.924 . . . . 106.59 113.495 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 75.4 p -65.36 -49.43 69.4 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.07 -0.652 . . . . 121.12 111.246 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -65.64 -32.51 74.11 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 111.828 0.307 . . . . 113.22 111.828 -174.756 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 t -68.74 -43.82 82.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 119.978 -0.689 . . . . 107.28 110.005 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -60.16 -32.02 70.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.319 -0.953 . . . . 130.29 111.296 172.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -64.89 -47.65 77.06 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.463 -0.495 . . . . 130.16 111.513 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 10.3 p -57.71 -47.81 81.33 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.003 -0.436 . . . . 119.5 110.622 170.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -55.63 -48.62 74.65 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.4 0.619 . . . . 107.93 110.218 -176.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.3 m-20 -68.55 -44.16 75.09 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 115.857 -0.61 . . . . 103.43 111.369 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.84 98.12 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.586 -0.846 . . . . 100.05 111.055 -175.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.52 -51.64 64.63 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.253 -0.979 . . . . 123.26 111.162 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 2.5 pp -65.7 -43.66 93.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.335 -0.546 . . . . 120.04 111.554 -175.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -59.86 -42.86 94.6 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 118.82 -1.152 . . . . 113.12 110.752 -176.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -75.39 -28.28 59.42 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 117.95 -1.5 . . . . 121.63 111.895 171.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 70.1 mt -60.97 -42.16 97.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.801 -1.16 . . . . 132.87 110.446 178.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 tt -64.09 -37.79 80.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 C-N-CA 120.018 -0.673 . . . . 130.57 110.23 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.3 tttt -60.63 -41.81 95.61 Favored 'General case' 0 C--O 1.238 0.497 0 O-C-N 121.886 -0.509 . . . . 114.27 110.947 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.18 -45.77 94.82 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.48 -0.867 . . . . 119.23 111.276 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . . . -66.2 -40.57 90.46 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 122.328 -0.513 . . . . 129.09 111.108 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.1 t -62.64 -33.02 74.17 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.478 -0.489 . . . . 113.4 111.293 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.0 ttpt -60.72 -45.61 93.59 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.118 0.485 . . . . 127.61 111.902 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -74.03 -44.34 54.72 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.448 -0.501 . . . . 152.27 110.892 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -55.26 -52.03 64.72 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 112.458 0.54 . . . . 159.15 112.458 -175.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.64 -33.21 61.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 119.418 -0.913 . . . . 114.45 110.959 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -57.89 -41.41 82.5 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 122.034 -0.417 . . . . 121.94 111.336 174.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -60.39 -44.46 95.65 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.169 -0.613 . . . . 112.93 111.345 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -54.83 -41.57 70.87 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.317 -0.553 . . . . 130.43 111.506 171.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.76 -33.27 71.46 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.382 -0.527 . . . . 127.29 111.431 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -79.14 -14.77 58.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.584 0.957 . . . . 149.45 113.584 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 1.6 pp -80.96 -52.57 13.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 118.283 -1.367 . . . . 109.12 109.851 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 22.8 pttt -52.68 -43.93 65.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 119.543 -0.863 . . . . 144.82 110.09 174.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -62.69 -31.11 71.95 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.732 -0.787 . . . . 154.19 110.988 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 24.4 p -85.52 -57.96 2.85 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 120.574 -0.45 . . . . 110.85 111.035 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.4 tp -49.11 -45.77 17.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 120.912 -0.315 . . . . 118.56 111.497 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -60.82 -35.9 77.68 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.458 -0.897 . . . . 135.58 110.367 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -69.14 -48.82 61.36 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.937 0.398 . . . . 116.28 110.323 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -56.01 -31.56 63.18 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 114.267 1.21 . . . . 99.32 114.267 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.1 p -76.59 -50.37 14.02 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 118.217 -1.393 . . . . 98.93 112.244 -179.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 105' ' ' THR . 1.5 mmtt -51.77 -51.47 56.12 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.127 -1.029 . . . . 127.36 111.348 172.591 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -39.12 -46.66 1.46 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.16 0.505 . . . . 138.01 110.014 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 60.1 t-105 -61.92 -43.86 97.97 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.326 -0.397 . . . . 109.42 110.909 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' THR . . . . . 0.407 ' N ' ' O ' ' A' ' 102' ' ' LYS . 2.2 m -63.5 -40.46 97.13 Favored 'General case' 0 C--O 1.238 0.451 0 O-C-N 121.973 -0.454 . . . . 114.47 111.484 179.235 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -60.41 -43.81 96.36 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.968 -0.693 . . . . 147.8 110.203 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' MSE . . . . . . . . . . . . . . . -65.13 -46.77 79.62 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 122.889 0.475 . . . . 112.99 109.833 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ILE . . . . . . . . . . . . . 8.9 pt -65.83 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 120.06 -0.656 . . . . 124.24 110.867 -178.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -61.48 -49.86 75.08 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.135 -1.026 . . . . 102.3 110.755 -176.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 25.0 mtp85 -72.83 -33.25 66.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.378 -0.529 . . . . 115.23 111.347 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -58.31 -35.37 71.75 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 118.623 -1.231 . . . . 114.47 109.959 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -68.95 -33.57 73.94 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 122.349 -0.22 . . . . 150.79 110.705 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 116' ' ' TRP . 9.9 tttt -61.77 -60.69 3.28 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.53 -0.544 . . . . 131.01 109.53 174.319 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -27.48 -51.88 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.275 1.43 . . . . 172.72 111.87 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . 0.427 ' CG ' ' N ' ' A' ' 116' ' ' TRP . 5.1 pt-20 -61.98 -52.01 65.74 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.123 -0.631 . . . . 124.75 110.743 173.808 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TRP . . . . . 0.503 ' N ' ' O ' ' A' ' 113' ' ' LYS . 66.6 t90 -63.3 -36.79 84.84 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 121.926 -0.484 . . . . 122.35 110.561 -176.595 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASP . . . . . 0.471 ' N ' ' O ' ' A' ' 113' ' ' LYS . 2.0 m-20 -62.75 -50.86 69.39 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.656 0.741 . . . . 97.96 109.415 179.69 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' MSE . . . . . . . . . . . . . 15.4 ttt -66.32 -50.8 62.39 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.602 0.761 . . . . 155.0 111.172 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.6 mt -50.91 -44.76 60.16 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.993 -0.683 . . . . 108.96 111.101 -177.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -53.83 -39.48 65.61 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.348 0.499 . . . . 100.81 112.348 178.138 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -69.87 -48.2 59.68 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 118.634 -1.227 . . . . 96.56 111.135 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -41.49 -54.71 3.05 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.242 0.46 . . . . 82.36 112.242 171.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 98.8 t -62.85 -51.93 65.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 120.152 -0.619 . . . . 76.31 110.833 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -54.73 -47.08 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.587 -0.445 . . . . 113.8 111.368 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -67.81 -48.29 66.69 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.603 -0.839 . . . . 103.57 110.867 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 33.9 m -51.86 -51.17 58.63 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.256 -0.578 . . . . 91.22 110.514 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -49.18 -61.54 2.02 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.404 0.621 . . . . 115.24 110.724 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -45.01 -51.53 9.83 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.441 0.696 . . . . 88.01 111.956 176.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.6 -52.54 65.12 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.518 -0.473 . . . . 74.41 111.789 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' MSE . . . . . . . . . . . . . 3.9 mtm -49.49 -47.15 48.83 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 122.034 -0.416 . . . . 168.78 110.876 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -63.76 -45.32 90.34 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 118.88 -1.128 . . . . 99.27 109.952 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.11 -48.03 76.97 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.952 -0.467 . . . . 63.8 110.769 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 20.2 tp -56.51 -38.54 71.95 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.665 0.269 . . . . 94.56 111.042 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' MSE . . . . . . . . . . . . . 35.4 ttp -59.8 -54.65 43.75 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.494 0.664 . . . . 107.97 111.122 178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 23.9 mt -57.09 -42.75 81.32 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.282 -1.326 . . . . 71.05 110.82 -173.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.0 m -55.23 -65.2 0.63 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.81 -0.177 . . . . 76.31 111.435 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 8.0 m -51.77 -52.41 22.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 120.836 -0.346 . . . . 73.23 111.102 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -43.87 -52.93 6.46 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.659 -0.651 . . . . 80.57 111.256 173.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.16 95.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.143 -0.481 . . . . 72.15 110.697 177.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.41 -34.86 71.24 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.392 -0.523 . . . . 67.18 111.676 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLN . . . . . 0.593 ' OE1' ' NE2' ' A' ' 220' ' ' HIS . 61.9 mt-30 -70.25 -48.1 58.39 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.658 -0.817 . . . . 72.46 110.915 177.713 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 22.4 mm -46.78 -51.51 4.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.145 0.498 . . . . 72.29 111.671 172.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -68.76 -32.69 72.63 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 117.791 -1.563 . . . . 107.82 110.724 -177.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -63.17 -39.37 94.46 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.163 -0.615 . . . . 116.35 110.37 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 9.8 tp -68.45 -58.37 4.43 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.945 -0.702 . . . . 60.7 111.568 176.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -43.83 -52.16 6.93 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.299 0.481 . . . . 95.52 112.299 174.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.01 -43.9 94.94 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.41 -0.516 . . . . 107.13 110.979 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -60.03 -53.17 60.93 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.832 -0.747 . . . . 113.91 111.505 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.98 -34.74 13.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 111.589 0.218 . . . . 60.12 111.589 -173.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.24 -38.13 63.59 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.84 -0.344 . . . . 62.9 111.121 -177.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 -56.36 -46.77 79.86 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.231 0.538 . . . . 121.69 111.027 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -50.51 -47.47 57.34 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.285 -0.416 . . . . 81.54 111.302 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 4.3 mt -67.37 -43.71 87.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 120.307 -0.557 . . . . 90.79 111.768 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -57.26 -61.08 2.72 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 118.916 -1.114 . . . . 100.79 109.416 173.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -37.43 -61.15 0.62 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.365 0.666 . . . . 108.97 111.901 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 25.4 tp -48.26 -52.84 19.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.189 -0.46 . . . . 90.29 111.961 174.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 39.7 m-20 -46.99 -53.08 13.2 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.802 0.334 . . . . 80.58 110.899 178.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -50.85 -59.6 3.95 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.369 -0.378 . . . . 82.9 111.42 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 31.9 tttm -50.03 -46.72 53.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.39 -0.524 . . . . 95.06 110.797 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -59.43 -46.23 89.34 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 119.96 -0.696 . . . . 71.53 110.143 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -60.14 -44.36 95.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.286 -0.965 . . . . 90.72 110.892 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -61.97 -43.23 99.27 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.453 -0.899 . . . . 115.92 111.677 -173.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' MSE . . . . . 0.514 ' O ' ' N ' ' A' ' 167' ' ' THR . 0.2 OUTLIER -55.97 -43.77 77.88 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 118.758 -1.177 . . . . 149.46 111.929 173.134 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.93 -46.62 78.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.502 -0.879 . . . . 89.78 110.46 -173.359 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -54.3 -55.99 22.9 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.558 -0.457 . . . . 84.19 111.139 164.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -57.1 -36.75 70.99 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 112.142 0.423 . . . . 119.31 112.142 -173.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 163' ' ' MSE . 36.6 p -69.42 -44.64 70.94 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.472 -1.291 . . . . 96.22 109.908 173.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.22 74.38 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.742 0.306 . . . . 103.95 111.364 -177.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -59.48 -39.51 83.96 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.318 -0.553 . . . . 123.06 111.011 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.22 -40.03 92.49 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.009 0.374 . . . . 153.73 112.009 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.7 t -61.68 -39.17 82.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-O 121.041 0.448 . . . . 134.05 110.543 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.66 79.68 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.132 -0.627 . . . . 135.85 110.35 178.213 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -94.37 6.39 48.86 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.002 0.371 . . . . 125.97 112.002 178.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -74.59 156.75 36.45 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 122.007 0.908 . . . . 113.31 111.257 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' THR . . . . . . . . . . . . . 14.5 t -65.66 1.36 1.29 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 114.8 -1.091 . . . . 113.96 113.724 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.85 123.06 17.51 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 118.289 -1.364 . . . . 121.43 108.349 173.656 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . . . -71.21 -44.75 64.77 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.784 0.661 . . . . 133.62 112.784 -176.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.45 140.42 48.1 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.666 -0.646 . . . . 140.08 112.423 -174.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' LYS . . . . . . . . . . . . . 31.9 mttp -56.12 -32.93 64.67 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.2 -0.6 . . . . 126.28 111.343 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -47.17 -49.31 22.88 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.248 0.547 . . . . 162.37 111.165 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.64 -37.8 55.71 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.497 -0.32 . . . . 146.28 111.685 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -58.41 -48.72 79.77 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.399 0.545 . . . . 127.97 111.242 -179.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -64.19 -34.77 78.83 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.199 0.444 . . . . 116.51 112.199 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -31.09 72.16 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.65 -0.82 . . . . 181.3 112.222 179.202 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 190' ' ' LYS . 0.4 OUTLIER -82.35 -42.44 18.71 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.192 -0.603 . . . . 113.39 111.588 -172.051 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 191' ' ' ARG . 4.2 pp -56.75 -43.3 80.6 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 118.747 -1.181 . . . . 108.07 110.313 172.276 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' ARG . . . . . . . . . . . . . 9.9 mtp85 -57.06 -38.09 72.76 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.027 -0.669 . . . . 150.56 110.727 175.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -67.98 -46.0 72.57 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.83 0.347 . . . . 136.74 111.542 171.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' LYS . . . . . 0.462 ' N ' ' O ' ' A' ' 186' ' ' ARG . 68.7 mttt -68.41 -55.89 10.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.77 0.319 . . . . 102.08 111.088 -177.031 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 187' ' ' LEU . 3.1 mtm180 -46.51 -53.43 11.3 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 112.729 0.64 . . . . 114.2 112.729 -178.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.49 -44.25 91.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.735 -0.786 . . . . 137.93 111.545 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 45.7 t-20 -49.66 -49.07 48.8 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.888 -0.725 . . . . 114.51 110.006 171.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -63.82 -35.88 82.06 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 111.933 0.346 . . . . 116.19 111.933 179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 29.0 t -60.51 -43.48 94.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 119.75 -0.78 . . . . 80.69 110.111 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -51.64 -51.53 55.0 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.561 -0.456 . . . . 90.54 110.438 170.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -62.22 -43.26 99.23 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 109.899 -0.408 . . . . 66.51 109.899 -178.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' PHE . . . . . . . . . . . . . 17.0 m-30 -58.32 -39.07 78.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 120.777 0.322 . . . . 99.34 111.37 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' MSE . . . . . . . . . . . . . 3.4 mtp -72.46 -42.46 64.93 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.744 0.646 . . . . 180.95 112.744 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.86 -46.57 87.27 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.362 -0.935 . . . . 143.43 110.428 176.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -48.86 -45.49 41.0 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.0 0.429 . . . . 98.42 111.525 172.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -64.38 -43.08 95.6 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 111.82 0.304 . . . . 68.72 111.82 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -56.23 -47.1 79.11 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.525 0.202 . . . . 97.86 111.138 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -60.79 -50.7 72.39 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.166 -0.613 . . . . 108.29 112.163 -179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ILE . . . . . . . . . . . . . 2.9 tt -64.09 -36.5 77.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 118.874 -1.131 . . . . 65.23 110.581 -178.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' GLY . . . . . . . . . . . . . . . -51.1 -38.23 38.99 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 119.352 -1.404 . . . . 47.88 111.405 171.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' VAL . . . . . . . . . . . . . 17.3 t -84.14 -52.57 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 O-C-N 122.219 -0.577 . . . . 57.65 110.735 -168.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' LYS . . . . . 0.408 ' O ' ' N ' ' A' ' 212' ' ' ALA . 47.4 tttm -54.26 -47.06 72.7 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 119.651 -0.82 . . . . 87.33 111.03 178.114 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -55.7 -40.56 72.55 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 116.652 -0.249 . . . . 70.17 111.605 176.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -68.35 -40.77 86.99 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 118.629 -1.748 . . . . 40.56 110.185 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -45.01 93.29 Favored 'General case' 0 C--O 1.238 0.489 0 O-C-N 122.383 -0.48 . . . . 88.07 110.257 177.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' ALA . . . . . 0.408 ' N ' ' O ' ' A' ' 208' ' ' LYS . . . -59.66 -44.25 93.64 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 120.193 -0.603 . . . . 55.6 110.737 -179.978 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' MSE . . . . . . . . . . . . . 39.5 tpp -62.81 -50.88 69.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 120.304 -0.559 . . . . 93.24 112.054 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -53.52 -53.68 48.04 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 118.66 -1.216 . . . . 105.44 110.012 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' LYS . . . . . . . . . . . . . 1.7 tptt -53.94 -43.5 69.88 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.101 -0.639 . . . . 89.08 110.275 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.29 -59.06 5.05 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.497 -0.481 . . . . 59.04 112.047 172.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -60.1 -29.6 68.7 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 118.688 -1.205 . . . . 70.22 113.31 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 6.8 mt -69.19 -35.01 75.79 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 119.205 -0.998 . . . . 57.91 112.219 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.2 -46.78 82.42 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 118.82 -1.152 . . . . 55.85 110.218 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HIS . . . . . 0.593 ' NE2' ' OE1' ' A' ' 141' ' ' GLN . 29.8 m170 -57.33 -47.53 81.33 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.877 0.37 . . . . 63.07 110.881 178.898 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' SER . . . . . . . . . . . . . 3.1 t -54.02 -54.15 43.11 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.87 0.322 . . . . 85.64 111.87 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -60.14 -44.67 94.76 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.426 -0.91 . . . . 87.44 112.066 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -48.66 -46.13 39.76 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.173 -0.611 . . . . 71.22 111.566 176.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' ILE . . . . . . . . . . . . . 15.3 mt -59.0 -56.65 15.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.714 0.768 . . . . 85.44 110.371 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -49.7 -53.68 23.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.753 -0.658 . . . . 113.71 111.282 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.07 -43.39 95.61 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.46 -0.496 . . . . 115.35 111.484 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -59.23 -44.9 92.32 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.483 -0.887 . . . . 101.78 110.936 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 63.1 m -58.59 -59.79 4.84 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.291 -0.564 . . . . 97.0 111.014 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' THR . . . . . . . . . . . . . 27.2 p -47.2 -43.22 21.29 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.566 -0.709 . . . . 104.56 112.158 175.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.37 -38.25 90.36 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.305 0.483 . . . . 127.01 112.305 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.15 -57.82 6.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 C-N-CA 119.652 -0.819 . . . . 130.31 110.33 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -38.77 -39.56 0.52 Allowed 'General case' 0 C--O 1.239 0.539 0 C-N-CA 125.547 1.539 . . . . 152.45 112.301 -177.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' LYS . . . . . . . . . . . . . 19.6 mtpt -46.75 -59.93 2.73 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.22 0.533 . . . . 138.49 112.063 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.205 0.526 . . . . 130.89 111.949 -175.254 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 . . . . . 0 CA--C 1.55 0.95 0 N-CA-C 116.016 1.858 . . . . 123.41 116.016 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -64.65 143.07 79.84 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 120.388 0.725 . . . . 119.73 111.778 169.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -58.02 149.92 67.85 Favored 'Trans proline' 0 C--O 1.235 0.338 0 CA-C-O 121.685 0.619 . . . . 65.77 111.192 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 56.7 mt -57.99 143.55 42.75 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.554 -0.748 . . . . 76.23 109.316 171.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' VAL . . . . . . . . . . . . . 4.1 t -131.7 131.69 62.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 106.205 -1.776 . . . . 75.65 106.205 170.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -113.76 123.57 50.17 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.879 -1.156 . . . . 68.51 107.879 -172.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -63.82 147.92 95.38 Favored Pre-proline 0 C--O 1.236 0.39 0 N-CA-C 110.039 -0.356 . . . . 164.0 110.039 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -68.06 150.62 77.64 Favored 'Trans proline' 0 C--N 1.33 -0.43 0 N-CA-C 109.531 -0.988 . . . . 71.84 109.531 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 89.8 t -90.52 124.02 42.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 105.741 -1.948 . . . . 59.12 105.741 173.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' THR . . . . . 0.408 ' OG1' ' N ' ' B' ' 35' ' ' SER . 23.6 p -131.55 153.89 49.39 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.105 -0.702 . . . . 76.09 109.105 -172.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 tp -43.75 -52.4 6.6 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.398 -0.819 . . . . 103.37 110.113 163.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.12 -51.23 67.07 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.182 -0.324 . . . . 103.68 111.642 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' SER . . . . . 0.408 ' N ' ' OG1' ' B' ' 32' ' ' THR . 80.0 p -64.16 -37.86 88.98 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.659 0.266 . . . . 78.62 111.123 -178.645 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.36 -45.15 94.46 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.762 -0.375 . . . . 82.47 110.542 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ARG . . . . . . . . . . . . . 4.3 mtm105 -59.09 -33.56 70.96 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.19 0.441 . . . . 127.22 112.19 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.6 -17.51 60.7 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.371 0.508 . . . . 100.47 112.371 -177.511 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' GLU . . . . . 0.67 ' OE2' ' N ' ' B' ' 41' ' ' GLY . 2.2 tm-20 -62.67 134.73 56.76 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.849 -0.426 . . . . 103.18 109.849 -174.21 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -70.59 -37.2 73.89 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.811 -0.631 . . . . 105.15 112.022 -169.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLY . . . . . 0.67 ' N ' ' OE2' ' B' ' 39' ' ' GLU . . . -59.74 -39.68 95.6 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 119.663 -1.256 . . . . 86.4 112.771 173.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -77.49 -31.64 53.76 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 113.011 0.745 . . . . 88.23 113.011 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -61.81 -41.2 97.46 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.986 -1.085 . . . . 131.26 109.748 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . . . -60.34 -18.79 52.33 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 120.804 -0.359 . . . . 91.12 111.844 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 73.6 t -67.33 -55.67 16.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.343 0.592 . . . . 90.9 109.697 173.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -45.58 -52.18 9.33 Favored Glycine 0 C--N 1.337 0.601 0 C-N-CA 121.219 -0.515 . . . . 105.42 113.102 172.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -55.83 -51.19 68.35 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.347 -0.502 . . . . 96.77 110.869 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -42.02 -51.33 4.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.816 0.341 . . . . 107.36 111.757 169.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 81.0 mt-30 -61.21 -39.42 90.16 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.917 -0.313 . . . . 103.63 110.999 -173.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 mt -59.54 -50.16 80.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 120.488 -0.485 . . . . 96.58 110.175 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -52.3 -40.6 62.03 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.403 -0.519 . . . . 116.96 110.822 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -61.04 -31.99 71.62 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 111.968 0.359 . . . . 103.89 111.968 179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mt -91.53 -36.73 13.55 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 112.738 0.644 . . . . 90.9 112.738 179.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -56.16 -50.73 70.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.05 -0.66 . . . . 123.62 109.435 167.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' THR . . . . . . . . . . . . . 1.4 t -60.06 -28.42 67.78 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.084 -0.646 . . . . 104.35 111.729 177.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 31.9 tp -81.02 -48.33 12.37 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.636 -0.826 . . . . 98.53 110.581 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -63.71 -13.14 40.58 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.113 -0.635 . . . . 113.48 111.235 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLU . . . . . 0.459 ' O ' ' NZ ' ' B' ' 62' ' ' LYS . 0.2 OUTLIER -86.17 -23.48 26.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 122.847 0.459 . . . . 113.07 110.733 176.543 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -94.38 -19.39 20.66 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.376 0.67 . . . . 129.03 111.279 174.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 6.9 m170 -72.59 -41.84 65.22 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.761 0.315 . . . . 127.72 110.242 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.69 -46.9 77.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.41 -0.359 . . . . 141.27 111.53 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LYS . . . . . 0.459 ' NZ ' ' O ' ' B' ' 58' ' ' GLU . 6.4 mttp -57.45 -42.52 82.67 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.397 -0.921 . . . . 146.98 111.346 -175.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.14 -42.93 99.56 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 118.64 -1.224 . . . . 165.7 109.581 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ARG . . . . . . . . . . . . . 47.5 mmt-85 -60.87 -42.7 98.4 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.897 0.332 . . . . 144.51 111.897 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 24.1 p -71.26 -44.12 65.89 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 120.509 -0.477 . . . . 122.3 111.189 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 27.3 t -62.52 -47.97 81.58 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.459 -0.496 . . . . 119.34 111.311 -173.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 7.1 m -70.11 -30.11 42.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 C-N-CA 119.81 -0.756 . . . . 106.56 109.914 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.43 -38.44 77.43 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.991 -0.684 . . . . 113.53 111.153 175.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -70.38 -45.19 66.53 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.295 -0.962 . . . . 120.31 111.229 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' THR . . . . . . . . . . . . . 4.5 p -58.49 -48.25 81.4 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.502 -0.479 . . . . 117.27 111.254 175.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -57.38 -42.31 81.91 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.013 -0.675 . . . . 114.22 109.799 -179.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ASN . . . . . 0.4 ' O ' ' N ' ' B' ' 76' ' ' ASP . 14.0 m-20 -63.02 -46.37 87.92 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.881 -0.6 . . . . 126.65 110.315 176.845 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.18 93.33 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.837 0.351 . . . . 107.22 110.679 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.83 97.61 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.883 -0.727 . . . . 109.59 110.643 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.25 -45.16 90.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 C-N-CA 120.238 -0.585 . . . . 111.41 110.423 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' B' ' 72' ' ' ASN . 16.5 t70 -60.87 -38.6 86.16 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.113 -0.635 . . . . 121.6 110.592 -179.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -64.21 -42.02 96.8 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.74 -0.784 . . . . 153.63 110.467 176.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.24 -47.97 72.04 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.805 -0.758 . . . . 120.27 111.054 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 1.9 tt -58.61 -37.86 67.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.603 -0.839 . . . . 121.54 109.288 -175.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -65.11 -49.68 69.04 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.26 0.552 . . . . 137.81 109.888 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.66 -43.98 95.61 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 116.177 -0.465 . . . . 135.21 113.726 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . . . -62.75 -44.97 94.82 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 122.101 -0.646 . . . . 127.75 110.84 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -84.94 -11.38 55.66 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 118.366 -1.334 . . . . 164.51 111.474 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . . . -65.5 -45.63 82.87 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.498 -0.927 . . . . 136.56 108.498 170.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.34 -40.73 91.75 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.562 -0.745 . . . . 157.39 110.593 176.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.63 -51.48 69.73 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.541 -0.464 . . . . 194.71 111.922 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.5 -20.54 9.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 115.74 -2.384 . . . . 152.7 110.59 -178.238 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -67.23 -41.92 84.87 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.242 -0.983 . . . . 135.38 109.838 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ASN . . . . . 0.401 ' OD1' ' C ' ' B' ' 89' ' ' ASN . 0.3 OUTLIER -72.9 -24.8 60.88 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.353 0.661 . . . . 141.66 111.328 177.812 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.69 -45.52 93.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.983 0.421 . . . . 149.55 109.967 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.06 -37.98 89.35 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.464 -0.494 . . . . 134.39 109.889 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -58.32 -45.91 87.17 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.642 -0.423 . . . . 153.14 111.55 -179.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.89 -35.18 53.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 118.689 -1.204 . . . . 125.26 109.566 177.891 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . . . -62.36 -42.62 99.55 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.118 -0.633 . . . . 130.21 110.218 -179.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 33.1 m-20 -56.86 -44.2 81.94 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.796 0.332 . . . . 156.37 110.988 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.88 -47.45 62.52 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.67 -0.412 . . . . 127.9 110.939 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ILE . . . . . . . . . . . . . 3.3 tt -59.22 -45.89 92.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 120.765 0.317 . . . . 144.87 110.681 -172.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . 0.676 ' O ' ' OG1' ' B' ' 101' ' ' THR . 4.6 m-20 -66.29 -41.5 89.68 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.984 -0.686 . . . . 166.79 111.689 179.87 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.51 -44.99 85.26 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.199 -0.6 . . . . 170.7 111.772 176.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -44.57 -33.31 1.72 Allowed 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.989 -0.444 . . . . 134.2 111.654 171.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' THR . . . . . 0.676 ' OG1' ' O ' ' B' ' 98' ' ' ASN . 38.2 p -76.31 -34.03 59.03 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.353 -0.939 . . . . 132.34 111.226 176.045 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -57.21 -41.29 79.16 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 119.138 -1.025 . . . . 108.46 109.77 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -58.27 -46.3 86.27 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.007 0.432 . . . . 120.18 109.988 176.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 51.0 t-105 -66.8 -45.33 78.73 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.373 -0.376 . . . . 157.78 111.056 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' THR . . . . . . . . . . . . . 5.1 p -61.34 -39.35 90.25 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.337 -0.945 . . . . 111.69 109.619 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -61.48 -40.36 94.26 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.271 0.558 . . . . 113.63 109.545 176.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' MSE . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -48.26 78.03 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 123.756 0.822 . . . . 119.86 111.06 -177.708 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' ILE . . . . . . . . . . . . . 13.9 pt -64.82 -39.28 85.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 120.148 -0.621 . . . . 106.31 109.766 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -62.09 -45.86 91.65 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.191 -0.604 . . . . 103.74 110.182 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . . . -67.05 -36.99 83.27 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 111.76 0.281 . . . . 102.31 111.76 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -60.46 -44.64 95.66 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.359 -0.537 . . . . 91.64 111.041 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' ARG . . . . . . . . . . . . . 40.4 mtm180 -67.78 -35.19 78.23 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 111.866 0.321 . . . . 132.5 111.866 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . . . -62.32 -46.13 90.13 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.478 -0.489 . . . . 95.04 110.714 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -63.07 -45.83 90.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 120.224 -0.59 . . . . 100.86 110.928 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -63.08 -45.0 94.18 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 122.07 -0.394 . . . . 97.91 111.77 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -65.8 -46.51 78.39 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 118.595 -1.242 . . . . 116.25 110.58 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.35 -42.03 88.67 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.411 -0.916 . . . . 141.28 110.704 -177.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' MSE . . . . . . . . . . . . . 2.1 tmt? -65.79 -40.64 92.12 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.955 -0.757 . . . . 118.82 108.955 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 13.8 mt -66.96 -32.52 73.83 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 118.008 -1.477 . . . . 92.28 111.228 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -61.52 -25.57 67.37 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.797 0.295 . . . . 151.83 111.797 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -74.61 -52.32 12.09 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.822 0.344 . . . . 99.25 110.962 175.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -38.3 -50.22 1.45 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 113.601 0.963 . . . . 93.99 113.601 176.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 14.3 m -63.75 -47.41 91.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.31 -0.556 . . . . 93.52 110.882 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -54.9 -49.08 72.13 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 121.897 -0.502 . . . . 117.25 111.435 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -60.45 -50.81 72.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 119.328 -0.949 . . . . 86.23 110.232 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' SER . . . . . . . . . . . . . 1.6 t -60.34 -52.29 65.87 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.793 0.33 . . . . 83.1 110.598 -174.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -44.16 -62.6 1.09 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-O 120.971 0.415 . . . . 101.74 111.088 167.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -48.31 -52.87 19.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.951 -0.568 . . . . 82.7 111.337 -177.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ALA . . . . . . . . . . . . . . . -53.12 -50.29 64.77 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.168 0.433 . . . . 74.66 112.168 -177.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' MSE . . . . . . . . . . . . . 1.3 mtm -60.11 -46.5 89.42 Favored 'General case' 0 CA--C 1.501 -0.913 0 C-N-CA 118.082 -1.447 . . . . 137.53 113.72 -173.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . 4.5 tttm -45.88 -54.09 8.74 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 118.389 -1.324 . . . . 79.45 110.172 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -47.33 -59.35 3.25 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.034 0.445 . . . . 81.03 110.497 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' B' ' 137' ' ' VAL . 3.3 tp -42.3 -60.86 1.33 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.775 0.798 . . . . 65.6 112.238 175.042 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' MSE . . . . . . . . . . . . . 2.6 ttp -50.67 -57.76 7.49 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 115.276 -0.875 . . . . 113.09 111.717 179.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 64.9 mt -55.52 -41.61 73.37 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 124.414 1.071 . . . . 64.69 109.897 179.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' THR . . . . . . . . . . . . . 69.5 m -58.58 -60.71 3.39 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.777 -0.369 . . . . 70.87 111.552 172.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' VAL . . . . . 0.458 ' N ' ' O ' ' B' ' 133' ' ' LEU . 64.5 t -51.21 -55.8 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 121.167 0.508 . . . . 80.26 110.924 -179.268 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -46.56 -51.4 15.65 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 112.278 0.473 . . . . 71.09 112.278 174.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.76 89.58 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 121.077 -0.249 . . . . 65.37 111.575 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.77 65.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.399 -0.52 . . . . 59.5 110.866 175.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -61.18 -48.71 80.31 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 122.239 -0.288 . . . . 71.85 111.28 -175.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ILE . . . . . . . . . . . . . 25.2 mm -51.04 -43.18 25.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 120.712 -0.395 . . . . 63.0 111.245 171.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -68.82 -36.24 77.96 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 118.224 -1.391 . . . . 75.93 111.033 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.88 -40.51 88.91 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.828 -0.749 . . . . 80.73 110.794 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.4 tp -70.24 -48.35 57.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.065 -0.516 . . . . 72.36 111.208 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -53.95 -45.07 71.2 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.946 0.403 . . . . 106.43 110.816 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -63.52 -48.93 75.52 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 122.294 -0.254 . . . . 94.6 111.578 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -45.08 92.78 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.055 0.455 . . . . 67.46 111.128 -178.385 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -56.89 -42.71 80.38 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.29 -0.964 . . . . 70.07 110.379 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.81 85.56 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.73 -0.388 . . . . 64.1 110.54 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -62.78 -39.34 93.89 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.917 0.389 . . . . 82.11 110.111 174.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.88 -42.71 99.87 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.498 -0.481 . . . . 64.02 110.944 176.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' ILE . . . . . . . . . . . . . 2.8 mt -66.68 -39.49 83.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 120.84 0.352 . . . . 82.23 111.16 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -60.66 -43.32 97.77 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 121.667 -0.646 . . . . 75.98 110.942 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -58.59 -48.23 81.64 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.152 -0.476 . . . . 123.19 111.718 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 44.8 tp -61.76 -44.09 97.57 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.766 -0.374 . . . . 75.97 111.892 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' ASN . . . . . 0.717 ' OD1' ' NZ ' ' B' ' 202' ' ' LYS . 53.8 m-20 -57.2 -43.77 83.03 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.672 -0.411 . . . . 97.27 111.344 -178.343 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.39 89.28 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.174 -0.611 . . . . 99.14 110.607 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -61.04 -44.51 97.29 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.477 -0.329 . . . . 101.16 110.526 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -61.66 -40.71 95.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.343 -0.543 . . . . 80.01 112.065 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.44 73.54 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.578 -0.849 . . . . 76.67 110.982 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -62.12 -38.23 88.13 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.536 -0.866 . . . . 94.35 111.643 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' MSE . . . . . . . . . . . . . 3.9 ttt -55.51 -50.62 69.46 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 106.954 -1.498 . . . . 161.47 106.954 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.45 -43.8 88.97 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.722 0.639 . . . . 91.0 111.018 -175.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' ALA . . . . . . . . . . . . . . . -50.55 -67.51 0.25 Allowed 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.723 0.638 . . . . 75.68 112.723 164.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' ASP . . . . . . . . . . . . . 83.9 m-20 -51.46 -27.21 9.73 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.307 0.854 . . . . 99.76 113.307 -175.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' THR . . . . . . . . . . . . . 32.3 p -74.32 -50.09 20.22 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.094 -0.643 . . . . 100.42 110.852 172.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' ALA . . . . . . . . . . . . . . . -47.03 -59.82 2.86 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.814 0.34 . . . . 90.82 110.342 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -53.72 -42.16 67.8 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.445 -0.502 . . . . 106.46 110.697 173.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -62.17 -34.6 76.74 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.246 -0.581 . . . . 135.25 111.512 -173.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 11.6 t -87.28 -27.63 5.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 120.014 -0.675 . . . . 111.24 110.745 -178.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' GLN . . . . . 0.651 ' O ' ' NZ ' ' B' ' 183' ' ' LYS . 3.8 tt0 -73.29 -30.84 63.69 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.218 -0.301 . . . . 135.84 111.406 178.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' ASN . . . . . 0.43 ' OD1' ' NE2' ' B' ' 172' ' ' GLN . 3.2 m-20 . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 110.173 -0.306 . . . . 136.87 110.173 178.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' THR . . . . . . . . . . . . . 25.9 m . . . . . 0 CA--C 1.531 0.25 0 N-CA-C 109.304 -0.628 . . . . 148.58 109.304 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . . . 56.24 37.22 28.63 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.882 0.849 . . . . 145.86 110.355 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' ASN . . . . . . . . . . . . . 1.2 t30 50.85 30.75 5.39 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.604 1.562 . . . . 177.14 114.253 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -25.29 50.55 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 117.896 -1.522 . . . . 151.16 108.72 159.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' LYS . . . . . 0.651 ' NZ ' ' O ' ' B' ' 172' ' ' GLN . 76.7 mttt -54.07 -51.27 64.63 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.804 0.69 . . . . 122.37 110.663 -174.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.9 -38.81 79.72 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.987 -0.551 . . . . 171.11 111.501 -176.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' ARG . . . . . . . . . . . . . . . -67.89 -42.81 80.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.775 -0.77 . . . . 131.85 112.017 177.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' ARG . . . . . . . . . . . . . 8.6 ttp180 -67.62 -39.67 84.68 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.515 -0.874 . . . . 146.94 110.741 -174.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' LEU . . . . . 0.459 ' O ' ' N ' ' B' ' 191' ' ' ARG . 1.2 mt -57.27 -34.19 68.4 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.676 -1.21 . . . . 124.38 110.791 178.028 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -59.14 -38.62 80.1 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.195 -1.002 . . . . 158.59 110.584 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . . . -62.43 -42.81 99.72 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.013 -0.675 . . . . 117.37 110.481 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' LYS . . . . . 0.433 ' O ' ' N ' ' B' ' 194' ' ' ASN . 73.7 mttt -66.56 -48.62 69.04 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.462 -0.495 . . . . 111.16 110.728 176.171 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' ARG . . . . . 0.459 ' N ' ' O ' ' B' ' 187' ' ' LEU . 0.6 OUTLIER -50.97 -41.7 59.61 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.909 -0.316 . . . . 144.6 110.348 -177.843 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -73.73 -36.04 65.13 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 120.251 -0.58 . . . . 134.59 109.673 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -62.02 -44.07 97.48 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.084 0.469 . . . . 122.8 110.021 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' B' ' 190' ' ' LYS . 38.5 m-20 -63.73 -46.22 86.37 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.048 0.759 . . . . 80.78 113.048 179.988 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -39.23 82.58 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 C-N-CA 118.173 -1.411 . . . . 91.86 109.709 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -60.22 -44.42 95.17 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.928 0.394 . . . . 117.85 110.439 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' ARG . . . . . . . . . . . . . 18.6 ttt85 -67.29 -43.88 80.65 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.667 0.27 . . . . 91.9 111.269 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -61.34 -49.18 78.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 112.415 0.524 . . . . 96.53 112.415 -172.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' MSE . . . . . . . . . . . . . 71.7 mtp -70.73 -31.5 68.37 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 116.388 -2.125 . . . . 189.87 112.375 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -56.8 -39.8 74.77 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 117.831 -1.548 . . . . 87.3 109.732 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -58.32 -42.57 87.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.922 -0.311 . . . . 81.35 110.422 174.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' LYS . . . . . 0.717 ' NZ ' ' OD1' ' B' ' 157' ' ' ASN . 11.9 mmtt -64.18 -42.52 96.64 Favored 'General case' 0 C--O 1.235 0.301 0 O-C-N 122.08 -0.387 . . . . 92.04 111.725 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -59.22 -48.24 82.37 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.2 -0.6 . . . . 86.89 110.726 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.13 -55.67 25.48 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.31 -0.556 . . . . 127.04 110.382 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.64 -38.46 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 C-N-CA 120.099 -0.641 . . . . 67.8 110.488 -174.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' GLY . . . . . . . . . . . . . . . -51.74 -40.95 49.76 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.69 -0.767 . . . . 86.95 113.544 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' VAL . . . . . . . . . . . . . 97.7 t -76.16 -46.79 32.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 O-C-N 122.12 -0.635 . . . . 109.13 110.837 -172.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -59.91 -47.56 85.26 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.524 -0.47 . . . . 82.3 111.472 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -54.4 -49.11 70.68 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.946 0.403 . . . . 79.07 111.452 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' GLY . . . . . . . . . . . . . . . -60.43 -42.53 99.0 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 119.595 -1.288 . . . . 87.82 112.12 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' ARG . . . . . 0.705 ' NH2' ' O ' ' B' ' 301' ' ' HOH . 1.7 mmp_? -66.56 -42.12 87.59 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.721 -0.792 . . . . 119.63 109.935 179.354 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' ALA . . . . . . . . . . . . . . . -60.22 -52.96 63.05 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 120.941 0.4 . . . . 72.62 110.42 -178.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' MSE . . . . . . . . . . . . . 0.9 OUTLIER -52.2 -56.24 15.95 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 113.24 0.83 . . . . 123.07 113.24 174.668 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -52.09 -48.6 64.64 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.376 -0.829 . . . . 96.48 110.91 -178.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -51.54 -51.78 52.48 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.011 0.434 . . . . 74.26 110.198 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' LEU . . . . . . . . . . . . . 49.3 tp -56.39 -51.85 66.82 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.501 0.556 . . . . 74.79 112.501 -178.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 8.1 mttm -60.87 -33.07 72.52 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 118.868 -1.133 . . . . 83.07 112.715 179.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 218' ' ' LEU . . . . . . . . . . . . . 14.7 mt -66.74 -37.7 85.18 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.082 -1.047 . . . . 75.75 111.333 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -61.95 -40.42 95.49 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.089 -0.645 . . . . 60.8 110.255 172.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HIS . . . . . . . . . . . . . 54.5 m170 -60.43 -47.15 87.34 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.769 -0.372 . . . . 65.97 110.546 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.84 -49.93 67.33 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.767 0.317 . . . . 84.74 111.163 176.884 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -60.56 -46.24 90.94 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.925 -0.71 . . . . 78.45 110.699 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -50.89 -47.31 60.67 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.967 0.413 . . . . 83.13 111.255 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' ILE . . . . . . . . . . . . . 51.1 mt -66.44 -50.95 63.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.305 0.574 . . . . 84.34 109.964 -178.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -50.71 -47.47 59.04 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.344 -0.389 . . . . 135.13 111.386 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -63.18 -40.67 98.18 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.919 -0.712 . . . . 106.49 111.412 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 227' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -62.25 -41.43 98.43 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.544 -0.862 . . . . 104.93 110.428 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.3 p -54.02 -56.69 15.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.049 0.452 . . . . 91.26 110.028 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.1 m -48.44 -48.93 37.12 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.612 0.597 . . . . 98.12 112.612 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 230' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.79 -42.34 99.66 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.203 -0.599 . . . . 125.79 112.096 -174.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' B' ' 234' ' ' LEU . 32.6 m -72.73 -58.11 5.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 120.377 -0.529 . . . . 149.99 111.078 178.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 232' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -33.74 -47.45 0.25 Allowed 'General case' 0 C--O 1.239 0.528 0 C-N-CA 125.295 1.438 . . . . 115.49 112.297 -179.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 233' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -49.49 -59.92 3.31 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.36 0.6 . . . . 145.19 112.069 169.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' LEU . . . . . 0.491 ' N ' ' O ' ' B' ' 231' ' ' VAL . 10.1 mp . . . . . 0 C--N 1.327 -0.389 0 CA-C-O 120.883 0.373 . . . . 126.39 111.575 -173.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . 0.705 ' O ' ' NH2' ' B' ' 211' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 C--O 1.237 0.432 0 CA-C-O 121.035 0.445 . . . . 114.03 111.154 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -60.51 139.53 86.71 Favored 'Trans proline' 0 C--O 1.24 0.619 0 C-N-CA 121.132 1.221 . . . . 98.14 111.852 175.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.12 139.62 71.45 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 120.732 0.955 . . . . 113.11 111.169 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.46 141.15 20.68 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 120.159 -0.617 . . . . 95.75 110.847 173.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 37.8 t -123.86 132.84 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 106.102 -1.814 . . . . 84.45 106.102 168.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -112.49 121.61 45.31 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.439 -0.948 . . . . 76.84 108.439 -174.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -47.79 146.1 4.12 Favored Pre-proline 0 C--O 1.239 0.517 0 N-CA-C 109.056 -0.72 . . . . 93.86 109.056 168.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.39 144.36 22.85 Favored 'Trans proline' 0 C--N 1.324 -0.726 0 N-CA-C 108.883 -1.237 . . . . 85.96 108.883 168.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 m -88.46 123.03 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.146 -1.798 . . . . 111.02 106.146 178.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.3 p -123.71 152.88 41.6 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.035 -0.728 . . . . 90.86 109.035 -169.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . 0.662 ' HG ' HH22 ' A' ' 37' ' ' ARG . 2.3 tp -45.77 -41.84 11.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.413 -0.812 . . . . 128.45 110.497 168.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tp10 -61.59 -60.82 3.11 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.464 0.542 . . . . 114.14 112.464 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.9 p -58.28 -41.4 84.28 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.954 -0.467 . . . . 96.8 112.069 -176.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.4 mt -63.64 -39.55 94.64 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.059 -0.657 . . . . 93.53 109.823 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . 0.662 HH22 ' HG ' ' A' ' 33' ' ' LEU . 9.5 ttm-85 -58.72 -34.94 71.9 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.198 0.599 . . . . 113.81 110.971 -178.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -88.85 -3.32 58.78 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.988 1.107 . . . . 148.88 113.988 -174.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . 0.466 ' HG2' ' N ' ' A' ' 40' ' ' LYS . 4.2 tt0 -63.5 138.6 58.57 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 117.951 -1.5 . . . . 132.47 107.592 -179.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . 0.466 ' N ' ' HG2' ' A' ' 39' ' ' GLU . 41.1 mtpt -71.53 -34.42 70.02 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 117.371 -1.732 . . . . 113.87 111.139 -176.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -52.98 -46.04 61.41 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.225 -0.988 . . . . 95.24 112.649 171.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -71.47 -31.76 67.52 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.113 -0.639 . . . . 99.22 112.196 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 87.5 mt-30 -69.02 -31.77 70.81 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 118.98 -1.088 . . . . 96.16 110.375 178.143 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . . . -57.75 -25.47 60.48 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.813 -0.355 . . . . 101.69 111.143 174.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.7 t -70.53 -48.78 57.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.034 -0.666 . . . . 97.78 109.726 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -50.94 -50.13 39.57 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 116.185 -0.461 . . . . 110.81 113.411 172.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 43' ' ' GLN . 6.4 mmtt -60.25 -48.94 79.62 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.19 -0.594 . . . . 98.72 110.464 -174.611 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' A' ' 48' ' ' LYS . 3.4 mmtt -48.53 -47.93 38.75 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.977 -0.452 . . . . 102.71 111.366 171.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -61.7 -44.97 95.9 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.227 -0.295 . . . . 95.65 111.406 -175.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . 0.592 HG13 ' N ' ' A' ' 51' ' ' LYS . 8.3 pt -62.55 -49.09 85.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 119.753 -0.779 . . . . 114.14 110.165 -177.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . 0.619 ' O ' HG23 ' A' ' 55' ' ' THR . 3.1 tptt -52.7 -40.91 63.42 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.964 -0.695 . . . . 112.82 111.538 175.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.53 -28.16 66.83 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.91 -0.316 . . . . 105.26 110.971 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -90.53 -35.69 14.92 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.768 1.227 . . . . 90.64 110.546 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -56.74 -50.94 70.75 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.342 -0.543 . . . . 124.23 109.873 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . 0.619 HG23 ' O ' ' A' ' 51' ' ' LYS . 22.9 p -60.71 -29.52 69.39 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 120.553 -0.459 . . . . 107.41 112.235 177.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 tp -71.74 -44.58 63.85 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.816 -0.754 . . . . 93.5 110.833 174.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.42 -26.56 65.27 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.891 -0.323 . . . . 107.4 110.942 173.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . 0.604 ' O ' ' HG3' ' A' ' 62' ' ' LYS . . . -79.51 -21.3 45.46 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.438 -0.315 . . . . 112.32 110.648 179.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -82.75 -25.89 32.42 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.582 -0.447 . . . . 110.16 110.784 173.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HIS . . . . . 0.459 ' HA ' ' HG2' ' A' ' 63' ' ' GLU . 34.1 m170 -83.89 -50.69 7.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.004 -0.678 . . . . 92.5 110.569 -177.024 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -50.89 -50.37 57.43 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.131 0.419 . . . . 94.54 112.131 176.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . 0.604 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 18.1 mtmt -50.45 -53.93 25.92 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.328 -0.549 . . . . 106.68 111.089 174.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . 0.459 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 17.4 pt-20 -65.97 -58.49 5.41 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.304 -0.959 . . . . 98.7 110.964 -177.414 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . . . -37.3 -52.96 1.09 Allowed 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.495 0.924 . . . . 106.59 113.495 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 75.4 p -65.36 -49.43 69.4 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.07 -0.652 . . . . 121.12 111.246 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . 0.425 ' O ' HG23 ' A' ' 70' ' ' THR . 1.0 OUTLIER -65.64 -32.51 74.11 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 111.828 0.307 . . . . 113.22 111.828 -174.756 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 t -68.74 -43.82 82.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 119.978 -0.689 . . . . 107.28 110.005 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -60.16 -32.02 70.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.319 -0.953 . . . . 130.29 111.296 172.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -64.89 -47.65 77.06 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.463 -0.495 . . . . 130.16 111.513 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 66' ' ' SER . 10.3 p -57.71 -47.81 81.33 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.003 -0.436 . . . . 119.5 110.622 170.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -55.63 -48.62 74.65 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.4 0.619 . . . . 107.93 110.218 -176.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.3 m-20 -68.55 -44.16 75.09 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 115.857 -0.61 . . . . 103.43 111.369 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.84 98.12 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.586 -0.846 . . . . 100.05 111.055 -175.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . 0.605 ' O ' ' HG ' ' A' ' 78' ' ' LEU . . . -63.52 -51.64 64.63 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.253 -0.979 . . . . 123.26 111.162 -178.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.425 ' HA ' HD12 ' A' ' 78' ' ' LEU . 2.5 pp -65.7 -43.66 93.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.335 -0.546 . . . . 120.04 111.554 -175.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . 0.476 ' O ' HG22 ' A' ' 79' ' ' ILE . 1.4 m-20 -59.86 -42.86 94.6 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 118.82 -1.152 . . . . 113.12 110.752 -176.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -75.39 -28.28 59.42 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 117.95 -1.5 . . . . 121.63 111.895 171.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 74' ' ' ALA . 70.1 mt -60.97 -42.16 97.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.801 -1.16 . . . . 132.87 110.446 178.27 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 76' ' ' ASP . 3.1 tt -64.09 -37.79 80.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 C-N-CA 120.018 -0.673 . . . . 130.57 110.23 178.341 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.3 tttt -60.63 -41.81 95.61 Favored 'General case' 0 C--O 1.238 0.497 0 O-C-N 121.886 -0.509 . . . . 114.27 110.947 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.18 -45.77 94.82 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.48 -0.867 . . . . 119.23 111.276 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . . . -66.2 -40.57 90.46 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 122.328 -0.513 . . . . 129.09 111.108 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.1 t -62.64 -33.02 74.17 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.478 -0.489 . . . . 113.4 111.293 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.0 ttpt -60.72 -45.61 93.59 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.118 0.485 . . . . 127.61 111.902 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -74.03 -44.34 54.72 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.448 -0.501 . . . . 152.27 110.892 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -55.26 -52.03 64.72 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 112.458 0.54 . . . . 159.15 112.458 -175.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.64 -33.21 61.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 119.418 -0.913 . . . . 114.45 110.959 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -57.89 -41.41 82.5 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 122.034 -0.417 . . . . 121.94 111.336 174.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -60.39 -44.46 95.65 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.169 -0.613 . . . . 112.93 111.345 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . 0.489 ' O ' HG13 ' A' ' 93' ' ' ILE . 2.5 t70 -54.83 -41.57 70.87 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.317 -0.553 . . . . 130.43 111.506 171.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.76 -33.27 71.46 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.382 -0.527 . . . . 127.29 111.431 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -79.14 -14.77 58.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.584 0.957 . . . . 149.45 113.584 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 90' ' ' ASP . 1.6 pp -80.96 -52.57 13.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 118.283 -1.367 . . . . 109.12 109.851 172.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . 0.449 ' H ' HG13 ' A' ' 93' ' ' ILE . 22.8 pttt -52.68 -43.93 65.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 119.543 -0.863 . . . . 144.82 110.09 174.501 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -62.69 -31.11 71.95 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.732 -0.787 . . . . 154.19 110.988 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 24.4 p -85.52 -57.96 2.85 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 120.574 -0.45 . . . . 110.85 111.035 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ILE . . . . . 0.446 HG22 ' HA ' ' A' ' 94' ' ' LYS . 6.4 tp -49.11 -45.77 17.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 120.912 -0.315 . . . . 118.56 111.497 176.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -60.82 -35.9 77.68 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.458 -0.897 . . . . 135.58 110.367 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -69.14 -48.82 61.36 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.937 0.398 . . . . 116.28 110.323 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -56.01 -31.56 63.18 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 114.267 1.21 . . . . 99.32 114.267 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 97' ' ' ILE . 71.1 p -76.59 -50.37 14.02 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 118.217 -1.393 . . . . 98.93 112.244 -179.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' A' ' 102' ' ' LYS . 1.5 mmtt -51.77 -51.47 56.12 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.127 -1.029 . . . . 127.36 111.348 172.591 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -39.12 -46.66 1.46 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.16 0.505 . . . . 138.01 110.014 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 60.1 t-105 -61.92 -43.86 97.97 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.326 -0.397 . . . . 109.42 110.909 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' THR . . . . . 0.476 ' HA ' HG12 ' A' ' 108' ' ' ILE . 2.2 m -63.5 -40.46 97.13 Favored 'General case' 0 C--O 1.238 0.451 0 O-C-N 121.973 -0.454 . . . . 114.47 111.484 179.235 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -60.41 -43.81 96.36 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.968 -0.693 . . . . 147.8 110.203 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' MSE . . . . . . . . . . . . . . . -65.13 -46.77 79.62 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 122.889 0.475 . . . . 112.99 109.833 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ILE . . . . . 0.546 HG13 ' N ' ' A' ' 109' ' ' ALA . 8.9 pt -65.83 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 120.06 -0.656 . . . . 124.24 110.867 -178.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . 0.546 ' N ' HG13 ' A' ' 108' ' ' ILE . . . -61.48 -49.86 75.08 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.135 -1.026 . . . . 102.3 110.755 -176.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 25.0 mtp85 -72.83 -33.25 66.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.378 -0.529 . . . . 115.23 111.347 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -58.31 -35.37 71.75 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 118.623 -1.231 . . . . 114.47 109.959 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . 0.527 ' O ' ' HG2' ' A' ' 115' ' ' GLU . 3.6 mtm180 -68.95 -33.57 73.94 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 122.349 -0.22 . . . . 150.79 110.705 179.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 116' ' ' TRP . 9.9 tttt -61.77 -60.69 3.28 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.53 -0.544 . . . . 131.01 109.53 174.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -27.48 -51.88 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.275 1.43 . . . . 172.72 111.87 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 112' ' ' ARG . 5.1 pt-20 -61.98 -52.01 65.74 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.123 -0.631 . . . . 124.75 110.743 173.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TRP . . . . . 0.54 ' CE2' ' HD3' ' A' ' 120' ' ' ARG . 66.6 t90 -63.3 -36.79 84.84 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 121.926 -0.484 . . . . 122.35 110.561 -176.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.75 -50.86 69.39 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.656 0.741 . . . . 97.96 109.415 179.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' MSE . . . . . . . . . . . . . 15.4 ttt -66.32 -50.8 62.39 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.602 0.761 . . . . 155.0 111.172 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.6 mt -50.91 -44.76 60.16 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.993 -0.683 . . . . 108.96 111.101 -177.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ARG . . . . . 0.54 ' HD3' ' CE2' ' A' ' 116' ' ' TRP . 0.7 OUTLIER -53.83 -39.48 65.61 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.348 0.499 . . . . 100.81 112.348 178.138 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -69.87 -48.2 59.68 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 118.634 -1.227 . . . . 96.56 111.135 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -41.49 -54.71 3.05 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.242 0.46 . . . . 82.36 112.242 171.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 98.8 t -62.85 -51.93 65.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 120.152 -0.619 . . . . 76.31 110.833 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -54.73 -47.08 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.587 -0.445 . . . . 113.8 111.368 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -67.81 -48.29 66.69 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.603 -0.839 . . . . 103.57 110.867 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 33.9 m -51.86 -51.17 58.63 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.256 -0.578 . . . . 91.22 110.514 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -49.18 -61.54 2.02 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.404 0.621 . . . . 115.24 110.724 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -45.01 -51.53 9.83 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.441 0.696 . . . . 88.01 111.956 176.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.6 -52.54 65.12 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.518 -0.473 . . . . 74.41 111.789 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' MSE . . . . . . . . . . . . . 3.9 mtm -49.49 -47.15 48.83 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 122.034 -0.416 . . . . 168.78 110.876 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -63.76 -45.32 90.34 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 118.88 -1.128 . . . . 99.27 109.952 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.11 -48.03 76.97 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.952 -0.467 . . . . 63.8 110.769 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 20.2 tp -56.51 -38.54 71.95 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.665 0.269 . . . . 94.56 111.042 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' MSE . . . . . 0.514 ' O ' ' HG3' ' A' ' 138' ' ' GLN . 35.4 ttp -59.8 -54.65 43.75 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.494 0.664 . . . . 107.97 111.122 178.718 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 23.9 mt -57.09 -42.75 81.32 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.282 -1.326 . . . . 71.05 110.82 -173.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.0 m -55.23 -65.2 0.63 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.81 -0.177 . . . . 76.31 111.435 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 134' ' ' MSE . 8.0 m -51.77 -52.41 22.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 120.836 -0.346 . . . . 73.23 111.102 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 134' ' ' MSE . 19.2 mt-30 -43.87 -52.93 6.46 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.659 -0.651 . . . . 80.57 111.256 173.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.16 95.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.143 -0.481 . . . . 72.15 110.697 177.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.41 -34.86 71.24 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.392 -0.523 . . . . 67.18 111.676 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLN . . . . . 0.53 ' OE1' ' NE2' ' A' ' 220' ' ' HIS . 61.9 mt-30 -70.25 -48.1 58.39 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.658 -0.817 . . . . 72.46 110.915 177.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 22.4 mm -46.78 -51.51 4.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.145 0.498 . . . . 72.29 111.671 172.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -68.76 -32.69 72.63 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 117.791 -1.563 . . . . 107.82 110.724 -177.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -63.17 -39.37 94.46 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.163 -0.615 . . . . 116.35 110.37 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LEU . . . . . 0.591 ' HB3' ' HE1' ' A' ' 213' ' ' MSE . 9.8 tp -68.45 -58.37 4.43 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.945 -0.702 . . . . 60.7 111.568 176.636 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -43.83 -52.16 6.93 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.299 0.481 . . . . 95.52 112.299 174.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.01 -43.9 94.94 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.41 -0.516 . . . . 107.13 110.979 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -60.03 -53.17 60.93 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.832 -0.747 . . . . 113.91 111.505 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.98 -34.74 13.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 111.589 0.218 . . . . 60.12 111.589 -173.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.24 -38.13 63.59 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.84 -0.344 . . . . 62.9 111.121 -177.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 -56.36 -46.77 79.86 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.231 0.538 . . . . 121.69 111.027 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -50.51 -47.47 57.34 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.285 -0.416 . . . . 81.54 111.302 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 4.3 mt -67.37 -43.71 87.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 120.307 -0.557 . . . . 90.79 111.768 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 157' ' ' ASN . 11.6 tmtt? -57.26 -61.08 2.72 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 118.916 -1.114 . . . . 100.79 109.416 173.247 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -37.43 -61.15 0.62 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.365 0.666 . . . . 108.97 111.901 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 25.4 tp -48.26 -52.84 19.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.189 -0.46 . . . . 90.29 111.961 174.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 154' ' ' LYS . 39.7 m-20 -46.99 -53.08 13.2 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.802 0.334 . . . . 80.58 110.899 178.088 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -50.85 -59.6 3.95 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.369 -0.378 . . . . 82.9 111.42 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 31.9 tttm -50.03 -46.72 53.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.39 -0.524 . . . . 95.06 110.797 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -59.43 -46.23 89.34 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 119.96 -0.696 . . . . 71.53 110.143 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -60.14 -44.36 95.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.286 -0.965 . . . . 90.72 110.892 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -61.97 -43.23 99.27 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.453 -0.899 . . . . 115.92 111.677 -173.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' MSE . . . . . 0.544 ' HE3' ' HE1' ' A' ' 198' ' ' PHE . 0.2 OUTLIER -55.97 -43.77 77.88 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 118.758 -1.177 . . . . 149.46 111.929 173.134 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.93 -46.62 78.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.502 -0.879 . . . . 89.78 110.46 -173.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -54.3 -55.99 22.9 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.558 -0.457 . . . . 84.19 111.139 164.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ASP . . . . . 0.418 ' HB2' ' HA ' ' A' ' 163' ' ' MSE . 41.3 m-20 -57.1 -36.75 70.99 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 112.142 0.423 . . . . 119.31 112.142 -173.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 167' ' ' THR . . . . . 0.431 HG23 ' HG2' ' A' ' 163' ' ' MSE . 36.6 p -69.42 -44.64 70.94 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.472 -1.291 . . . . 96.22 109.908 173.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.22 74.38 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.742 0.306 . . . . 103.95 111.364 -177.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -59.48 -39.51 83.96 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.318 -0.553 . . . . 123.06 111.011 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.22 -40.03 92.49 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.009 0.374 . . . . 153.73 112.009 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.7 t -61.68 -39.17 82.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-O 121.041 0.448 . . . . 134.05 110.543 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.66 79.68 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.132 -0.627 . . . . 135.85 110.35 178.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -94.37 6.39 48.86 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.002 0.371 . . . . 125.97 112.002 178.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -74.59 156.75 36.45 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 122.007 0.908 . . . . 113.31 111.257 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' THR . . . . . . . . . . . . . 14.5 t -65.66 1.36 1.29 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 114.8 -1.091 . . . . 113.96 113.724 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.85 123.06 17.51 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 118.289 -1.364 . . . . 121.43 108.349 173.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . . . -71.21 -44.75 64.77 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.784 0.661 . . . . 133.62 112.784 -176.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.45 140.42 48.1 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.666 -0.646 . . . . 140.08 112.423 -174.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 180' ' ' LYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 183' ' ' LYS . 31.9 mttp -56.12 -32.93 64.67 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.2 -0.6 . . . . 126.28 111.343 -179.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -47.17 -49.31 22.88 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.248 0.547 . . . . 162.37 111.165 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.64 -37.8 55.71 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.497 -0.32 . . . . 146.28 111.685 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' LYS . . . . . 0.64 ' HB2' ' HA ' ' A' ' 180' ' ' LYS . 58.3 mttm -58.41 -48.72 79.77 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.399 0.545 . . . . 127.97 111.242 -179.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -64.19 -34.77 78.83 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.199 0.444 . . . . 116.51 112.199 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -31.09 72.16 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.65 -0.82 . . . . 181.3 112.222 179.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.35 -42.44 18.71 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.192 -0.603 . . . . 113.39 111.588 -172.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 187' ' ' LEU . . . . . 0.457 HD12 ' N ' ' A' ' 188' ' ' ARG . 4.2 pp -56.75 -43.3 80.6 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 118.747 -1.181 . . . . 108.07 110.313 172.276 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 188' ' ' ARG . . . . . 0.457 ' N ' HD12 ' A' ' 187' ' ' LEU . 9.9 mtp85 -57.06 -38.09 72.76 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.027 -0.669 . . . . 150.56 110.727 175.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -67.98 -46.0 72.57 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.83 0.347 . . . . 136.74 111.542 171.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 190' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -68.41 -55.89 10.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.77 0.319 . . . . 102.08 111.088 -177.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -46.51 -53.43 11.3 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 112.729 0.64 . . . . 114.2 112.729 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.49 -44.25 91.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.735 -0.786 . . . . 137.93 111.545 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 45.7 t-20 -49.66 -49.07 48.8 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.888 -0.725 . . . . 114.51 110.006 171.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' ASN . . . . . 0.412 ' OD1' HG21 ' A' ' 167' ' ' THR . 3.7 m120 -63.82 -35.88 82.06 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 111.933 0.346 . . . . 116.19 111.933 179.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 29.0 t -60.51 -43.48 94.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 119.75 -0.78 . . . . 80.69 110.111 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -51.64 -51.53 55.0 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.561 -0.456 . . . . 90.54 110.438 170.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -62.22 -43.26 99.23 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 109.899 -0.408 . . . . 66.51 109.899 -178.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' PHE . . . . . 0.544 ' HE1' ' HE3' ' A' ' 163' ' ' MSE . 17.0 m-30 -58.32 -39.07 78.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 120.777 0.322 . . . . 99.34 111.37 178.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 199' ' ' MSE . . . . . . . . . . . . . 3.4 mtp -72.46 -42.46 64.93 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.744 0.646 . . . . 180.95 112.744 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.86 -46.57 87.27 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.362 -0.935 . . . . 143.43 110.428 176.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -48.86 -45.49 41.0 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.0 0.429 . . . . 98.42 111.525 172.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -64.38 -43.08 95.6 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 111.82 0.304 . . . . 68.72 111.82 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -56.23 -47.1 79.11 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.525 0.202 . . . . 97.86 111.138 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -60.79 -50.7 72.39 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.166 -0.613 . . . . 108.29 112.163 -179.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ILE . . . . . . . . . . . . . 2.9 tt -64.09 -36.5 77.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 118.874 -1.131 . . . . 65.23 110.581 -178.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' GLY . . . . . . . . . . . . . . . -51.1 -38.23 38.99 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 119.352 -1.404 . . . . 47.88 111.405 171.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' VAL . . . . . . . . . . . . . 17.3 t -84.14 -52.57 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 O-C-N 122.219 -0.577 . . . . 57.65 110.735 -168.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 47.4 tttm -54.26 -47.06 72.7 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 119.651 -0.82 . . . . 87.33 111.03 178.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -55.7 -40.56 72.55 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 116.652 -0.249 . . . . 70.17 111.605 176.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -68.35 -40.77 86.99 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 118.629 -1.748 . . . . 40.56 110.185 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 211' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -45.01 93.29 Favored 'General case' 0 C--O 1.238 0.489 0 O-C-N 122.383 -0.48 . . . . 88.07 110.257 177.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -59.66 -44.25 93.64 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 120.193 -0.603 . . . . 55.6 110.737 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 213' ' ' MSE . . . . . 0.591 ' HE1' ' HB3' ' A' ' 145' ' ' LEU . 39.5 tpp -62.81 -50.88 69.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 120.304 -0.559 . . . . 93.24 112.054 -179.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -53.52 -53.68 48.04 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 118.66 -1.216 . . . . 105.44 110.012 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 215' ' ' LYS . . . . . . . . . . . . . 1.7 tptt -53.94 -43.5 69.88 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.101 -0.639 . . . . 89.08 110.275 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 216' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.29 -59.06 5.05 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.497 -0.481 . . . . 59.04 112.047 172.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -60.1 -29.6 68.7 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 118.688 -1.205 . . . . 70.22 113.31 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 6.8 mt -69.19 -35.01 75.79 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 119.205 -0.998 . . . . 57.91 112.219 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.2 -46.78 82.42 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 118.82 -1.152 . . . . 55.85 110.218 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HIS . . . . . 0.53 ' NE2' ' OE1' ' A' ' 141' ' ' GLN . 29.8 m170 -57.33 -47.53 81.33 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.877 0.37 . . . . 63.07 110.881 178.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 221' ' ' SER . . . . . . . . . . . . . 3.1 t -54.02 -54.15 43.11 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.87 0.322 . . . . 85.64 111.87 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -60.14 -44.67 94.76 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.426 -0.91 . . . . 87.44 112.066 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 223' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -48.66 -46.13 39.76 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.173 -0.611 . . . . 71.22 111.566 176.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' ILE . . . . . 0.421 HG12 ' HE3' ' A' ' 134' ' ' MSE . 15.3 mt -59.0 -56.65 15.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.714 0.768 . . . . 85.44 110.371 179.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 225' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -49.7 -53.68 23.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.753 -0.658 . . . . 113.71 111.282 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.07 -43.39 95.61 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.46 -0.496 . . . . 115.35 111.484 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -59.23 -44.9 92.32 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.483 -0.887 . . . . 101.78 110.936 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 63.1 m -58.59 -59.79 4.84 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.291 -0.564 . . . . 97.0 111.014 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 229' ' ' THR . . . . . . . . . . . . . 27.2 p -47.2 -43.22 21.29 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.566 -0.709 . . . . 104.56 112.158 175.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.37 -38.25 90.36 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.305 0.483 . . . . 127.01 112.305 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.15 -57.82 6.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 C-N-CA 119.652 -0.819 . . . . 130.31 110.33 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -38.77 -39.56 0.52 Allowed 'General case' 0 C--O 1.239 0.539 0 C-N-CA 125.547 1.539 . . . . 152.45 112.301 -177.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 233' ' ' LYS . . . . . . . . . . . . . 19.6 mtpt -46.75 -59.93 2.73 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.22 0.533 . . . . 138.49 112.063 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 234' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.205 0.526 . . . . 130.89 111.949 -175.254 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 . . . . . 0 CA--C 1.55 0.95 0 N-CA-C 116.016 1.858 . . . . 123.41 116.016 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -64.65 143.07 79.84 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 120.388 0.725 . . . . 119.73 111.778 169.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -58.02 149.92 67.85 Favored 'Trans proline' 0 C--O 1.235 0.338 0 CA-C-O 121.685 0.619 . . . . 65.77 111.192 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 56.7 mt -57.99 143.55 42.75 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.554 -0.748 . . . . 76.23 109.316 171.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' VAL . . . . . . . . . . . . . 4.1 t -131.7 131.69 62.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 106.205 -1.776 . . . . 75.65 106.205 170.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -113.76 123.57 50.17 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.879 -1.156 . . . . 68.51 107.879 -172.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -63.82 147.92 95.38 Favored Pre-proline 0 C--O 1.236 0.39 0 N-CA-C 110.039 -0.356 . . . . 164.0 110.039 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -68.06 150.62 77.64 Favored 'Trans proline' 0 C--N 1.33 -0.43 0 N-CA-C 109.531 -0.988 . . . . 71.84 109.531 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 89.8 t -90.52 124.02 42.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 105.741 -1.948 . . . . 59.12 105.741 173.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' THR . . . . . 0.425 ' H ' ' HG ' ' B' ' 35' ' ' SER . 23.6 p -131.55 153.89 49.39 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.105 -0.702 . . . . 76.09 109.105 -172.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . 0.438 ' O ' ' HG3' ' B' ' 37' ' ' ARG . 2.5 tp -43.75 -52.4 6.6 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.398 -0.819 . . . . 103.37 110.113 163.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.12 -51.23 67.07 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.182 -0.324 . . . . 103.68 111.642 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' SER . . . . . 0.425 ' HG ' ' H ' ' B' ' 32' ' ' THR . 80.0 p -64.16 -37.86 88.98 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.659 0.266 . . . . 78.62 111.123 -178.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.36 -45.15 94.46 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.762 -0.375 . . . . 82.47 110.542 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' B' ' 33' ' ' LEU . 4.3 mtm105 -59.09 -33.56 70.96 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.19 0.441 . . . . 127.22 112.19 -179.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.6 -17.51 60.7 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.371 0.508 . . . . 100.47 112.371 -177.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' GLU . . . . . 0.586 ' OE2' ' N ' ' B' ' 41' ' ' GLY . 2.2 tm-20 -62.67 134.73 56.76 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.849 -0.426 . . . . 103.18 109.849 -174.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -70.59 -37.2 73.89 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.811 -0.631 . . . . 105.15 112.022 -169.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLY . . . . . 0.586 ' N ' ' OE2' ' B' ' 39' ' ' GLU . . . -59.74 -39.68 95.6 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 119.663 -1.256 . . . . 86.4 112.771 173.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -77.49 -31.64 53.76 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 113.011 0.745 . . . . 88.23 113.011 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -61.81 -41.2 97.46 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.986 -1.085 . . . . 131.26 109.748 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . . . -60.34 -18.79 52.33 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 120.804 -0.359 . . . . 91.12 111.844 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 73.6 t -67.33 -55.67 16.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.343 0.592 . . . . 90.9 109.697 173.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -45.58 -52.18 9.33 Favored Glycine 0 C--N 1.337 0.601 0 C-N-CA 121.219 -0.515 . . . . 105.42 113.102 172.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -55.83 -51.19 68.35 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.347 -0.502 . . . . 96.77 110.869 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -42.02 -51.33 4.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.816 0.341 . . . . 107.36 111.757 169.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLN . . . . . 0.443 ' HA ' ' HG3' ' B' ' 52' ' ' GLU . 81.0 mt-30 -61.21 -39.42 90.16 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.917 -0.313 . . . . 103.63 110.999 -173.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 mt -59.54 -50.16 80.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 120.488 -0.485 . . . . 96.58 110.175 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -52.3 -40.6 62.03 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.403 -0.519 . . . . 116.96 110.822 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLU . . . . . 0.47 ' O ' HG22 ' B' ' 55' ' ' THR . 4.9 mt-10 -61.04 -31.99 71.62 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 111.968 0.359 . . . . 103.89 111.968 179.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mt -91.53 -36.73 13.55 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 112.738 0.644 . . . . 90.9 112.738 179.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ASP . . . . . 0.496 ' O ' ' HB2' ' B' ' 58' ' ' GLU . 7.3 m-20 -56.16 -50.73 70.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.05 -0.66 . . . . 123.62 109.435 167.857 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' THR . . . . . 0.47 HG22 ' O ' ' B' ' 52' ' ' GLU . 1.4 t -60.06 -28.42 67.78 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.084 -0.646 . . . . 104.35 111.729 177.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 31.9 tp -81.02 -48.33 12.37 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.636 -0.826 . . . . 98.53 110.581 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -63.71 -13.14 40.58 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.113 -0.635 . . . . 113.48 111.235 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' B' ' 54' ' ' ASP . 0.2 OUTLIER -86.17 -23.48 26.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 122.847 0.459 . . . . 113.07 110.733 176.543 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -94.38 -19.39 20.66 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.376 0.67 . . . . 129.03 111.279 174.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 6.9 m170 -72.59 -41.84 65.22 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.761 0.315 . . . . 127.72 110.242 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ALA . . . . . 0.472 ' O ' HG23 ' B' ' 65' ' ' THR . . . -65.69 -46.9 77.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.41 -0.359 . . . . 141.27 111.53 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -57.45 -42.52 82.67 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.397 -0.921 . . . . 146.98 111.346 -175.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.14 -42.93 99.56 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 118.64 -1.224 . . . . 165.7 109.581 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' B' ' 64' ' ' ARG . 47.5 mmt-85 -60.87 -42.7 98.4 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.897 0.332 . . . . 144.51 111.897 179.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' THR . . . . . 0.472 HG23 ' O ' ' B' ' 61' ' ' ALA . 24.1 p -71.26 -44.12 65.89 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 120.509 -0.477 . . . . 122.3 111.189 178.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' SER . . . . . 0.472 ' O ' HG23 ' B' ' 70' ' ' THR . 27.3 t -62.52 -47.97 81.58 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.459 -0.496 . . . . 119.34 111.311 -173.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 7.1 m -70.11 -30.11 42.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 C-N-CA 119.81 -0.756 . . . . 106.56 109.914 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.43 -38.44 77.43 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.991 -0.684 . . . . 113.53 111.153 175.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -70.38 -45.19 66.53 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.295 -0.962 . . . . 120.31 111.229 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' THR . . . . . 0.472 HG23 ' O ' ' B' ' 66' ' ' SER . 4.5 p -58.49 -48.25 81.4 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.502 -0.479 . . . . 117.27 111.254 175.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -57.38 -42.31 81.91 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.013 -0.675 . . . . 114.22 109.799 -179.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -63.02 -46.37 87.92 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.881 -0.6 . . . . 126.65 110.315 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.18 93.33 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.837 0.351 . . . . 107.22 110.679 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.83 97.61 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.883 -0.727 . . . . 109.59 110.643 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.25 -45.16 90.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 C-N-CA 120.238 -0.585 . . . . 111.41 110.423 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -60.87 -38.6 86.16 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.113 -0.635 . . . . 121.6 110.592 -179.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -64.21 -42.02 96.8 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.74 -0.784 . . . . 153.63 110.467 176.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.24 -47.97 72.04 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.805 -0.758 . . . . 120.27 111.054 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 1.9 tt -58.61 -37.86 67.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.603 -0.839 . . . . 121.54 109.288 -175.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -65.11 -49.68 69.04 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.26 0.552 . . . . 137.81 109.888 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.66 -43.98 95.61 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 116.177 -0.465 . . . . 135.21 113.726 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . . . -62.75 -44.97 94.82 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 122.101 -0.646 . . . . 127.75 110.84 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -84.94 -11.38 55.66 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 118.366 -1.334 . . . . 164.51 111.474 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . . . -65.5 -45.63 82.87 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.498 -0.927 . . . . 136.56 108.498 170.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.34 -40.73 91.75 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.562 -0.745 . . . . 157.39 110.593 176.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.63 -51.48 69.73 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.541 -0.464 . . . . 194.71 111.922 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.5 -20.54 9.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 115.74 -2.384 . . . . 152.7 110.59 -178.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -67.23 -41.92 84.87 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.242 -0.983 . . . . 135.38 109.838 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ASN . . . . . 0.401 ' OD1' ' C ' ' B' ' 89' ' ' ASN . 0.3 OUTLIER -72.9 -24.8 60.88 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.353 0.661 . . . . 141.66 111.328 177.812 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.69 -45.52 93.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.983 0.421 . . . . 149.55 109.967 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.06 -37.98 89.35 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.464 -0.494 . . . . 134.39 109.889 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -58.32 -45.91 87.17 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.642 -0.423 . . . . 153.14 111.55 -179.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.89 -35.18 53.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 118.689 -1.204 . . . . 125.26 109.566 177.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LYS . . . . . 0.417 ' HA ' HG22 ' B' ' 97' ' ' ILE . . . -62.36 -42.62 99.55 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.118 -0.633 . . . . 130.21 110.218 -179.528 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 33.1 m-20 -56.86 -44.2 81.94 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.796 0.332 . . . . 156.37 110.988 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.88 -47.45 62.52 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.67 -0.412 . . . . 127.9 110.939 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ILE . . . . . 0.417 HG22 ' HA ' ' B' ' 94' ' ' LYS . 3.3 tt -59.22 -45.89 92.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 120.765 0.317 . . . . 144.87 110.681 -172.994 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . 0.648 ' O ' ' OG1' ' B' ' 101' ' ' THR . 4.6 m-20 -66.29 -41.5 89.68 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.984 -0.686 . . . . 166.79 111.689 179.87 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.51 -44.99 85.26 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.199 -0.6 . . . . 170.7 111.772 176.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -44.57 -33.31 1.72 Allowed 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.989 -0.444 . . . . 134.2 111.654 171.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' THR . . . . . 0.648 ' OG1' ' O ' ' B' ' 98' ' ' ASN . 38.2 p -76.31 -34.03 59.03 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.353 -0.939 . . . . 132.34 111.226 176.045 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -57.21 -41.29 79.16 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 119.138 -1.025 . . . . 108.46 109.77 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -58.27 -46.3 86.27 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.007 0.432 . . . . 120.18 109.988 176.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 51.0 t-105 -66.8 -45.33 78.73 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.373 -0.376 . . . . 157.78 111.056 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' THR . . . . . 0.433 ' HA ' HG12 ' B' ' 108' ' ' ILE . 5.1 p -61.34 -39.35 90.25 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.337 -0.945 . . . . 111.69 109.619 178.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -61.48 -40.36 94.26 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.271 0.558 . . . . 113.63 109.545 176.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' MSE . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -48.26 78.03 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 123.756 0.822 . . . . 119.86 111.06 -177.708 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' ILE . . . . . 0.466 HG13 ' N ' ' B' ' 109' ' ' ALA . 13.9 pt -64.82 -39.28 85.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 120.148 -0.621 . . . . 106.31 109.766 -178.411 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ALA . . . . . 0.466 ' N ' HG13 ' B' ' 108' ' ' ILE . . . -62.09 -45.86 91.65 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.191 -0.604 . . . . 103.74 110.182 -179.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . . . -67.05 -36.99 83.27 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 111.76 0.281 . . . . 102.31 111.76 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -60.46 -44.64 95.66 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.359 -0.537 . . . . 91.64 111.041 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' ARG . . . . . . . . . . . . . 40.4 mtm180 -67.78 -35.19 78.23 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 111.866 0.321 . . . . 132.5 111.866 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . . . -62.32 -46.13 90.13 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.478 -0.489 . . . . 95.04 110.714 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -63.07 -45.83 90.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 120.224 -0.59 . . . . 100.86 110.928 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -63.08 -45.0 94.18 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 122.07 -0.394 . . . . 97.91 111.77 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -65.8 -46.51 78.39 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 118.595 -1.242 . . . . 116.25 110.58 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.35 -42.03 88.67 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.411 -0.916 . . . . 141.28 110.704 -177.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' MSE . . . . . . . . . . . . . 2.1 tmt? -65.79 -40.64 92.12 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.955 -0.757 . . . . 118.82 108.955 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 13.8 mt -66.96 -32.52 73.83 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 118.008 -1.477 . . . . 92.28 111.228 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -61.52 -25.57 67.37 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.797 0.295 . . . . 151.83 111.797 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -74.61 -52.32 12.09 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.822 0.344 . . . . 99.25 110.962 175.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -38.3 -50.22 1.45 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 113.601 0.963 . . . . 93.99 113.601 176.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 14.3 m -63.75 -47.41 91.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.31 -0.556 . . . . 93.52 110.882 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -54.9 -49.08 72.13 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 121.897 -0.502 . . . . 117.25 111.435 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -60.45 -50.81 72.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 119.328 -0.949 . . . . 86.23 110.232 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' SER . . . . . . . . . . . . . 1.6 t -60.34 -52.29 65.87 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.793 0.33 . . . . 83.1 110.598 -174.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -44.16 -62.6 1.09 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-O 120.971 0.415 . . . . 101.74 111.088 167.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -48.31 -52.87 19.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.951 -0.568 . . . . 82.7 111.337 -177.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ALA . . . . . . . . . . . . . . . -53.12 -50.29 64.77 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.168 0.433 . . . . 74.66 112.168 -177.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' MSE . . . . . 0.451 ' HE3' ' HB3' ' B' ' 130' ' ' MSE . 1.3 mtm -60.11 -46.5 89.42 Favored 'General case' 0 CA--C 1.501 -0.913 0 C-N-CA 118.082 -1.447 . . . . 137.53 113.72 -173.242 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . 4.5 tttm -45.88 -54.09 8.74 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 118.389 -1.324 . . . . 79.45 110.172 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -47.33 -59.35 3.25 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.034 0.445 . . . . 81.03 110.497 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LEU . . . . . 0.428 ' O ' HG23 ' B' ' 137' ' ' VAL . 3.3 tp -42.3 -60.86 1.33 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.775 0.798 . . . . 65.6 112.238 175.042 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 134' ' ' MSE . . . . . 0.712 ' HE1' HG12 ' B' ' 224' ' ' ILE . 2.6 ttp -50.67 -57.76 7.49 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 115.276 -0.875 . . . . 113.09 111.717 179.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 64.9 mt -55.52 -41.61 73.37 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 124.414 1.071 . . . . 64.69 109.897 179.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' THR . . . . . . . . . . . . . 69.5 m -58.58 -60.71 3.39 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.777 -0.369 . . . . 70.87 111.552 172.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 133' ' ' LEU . 64.5 t -51.21 -55.8 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 121.167 0.508 . . . . 80.26 110.924 -179.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' B' ' 134' ' ' MSE . 42.2 mt-30 -46.56 -51.4 15.65 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 112.278 0.473 . . . . 71.09 112.278 174.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.76 89.58 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 121.077 -0.249 . . . . 65.37 111.575 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.77 65.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.399 -0.52 . . . . 59.5 110.866 175.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -61.18 -48.71 80.31 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 122.239 -0.288 . . . . 71.85 111.28 -175.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ILE . . . . . 0.401 HD13 HD23 ' B' ' 216' ' ' LEU . 25.2 mm -51.04 -43.18 25.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 120.712 -0.395 . . . . 63.0 111.245 171.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 143' ' ' LYS . . . . . 0.507 ' HE3' ' OD1' ' B' ' 147' ' ' ASP . 37.0 tptt -68.82 -36.24 77.96 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 118.224 -1.391 . . . . 75.93 111.033 179.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.88 -40.51 88.91 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.828 -0.749 . . . . 80.73 110.794 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.4 tp -70.24 -48.35 57.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.065 -0.516 . . . . 72.36 111.208 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -53.95 -45.07 71.2 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.946 0.403 . . . . 106.43 110.816 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' ASP . . . . . 0.507 ' OD1' ' HE3' ' B' ' 143' ' ' LYS . 59.2 m-20 -63.52 -48.93 75.52 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 122.294 -0.254 . . . . 94.6 111.578 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 148' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -45.08 92.78 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.055 0.455 . . . . 67.46 111.128 -178.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 149' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -56.89 -42.71 80.38 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.29 -0.964 . . . . 70.07 110.379 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.81 85.56 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.73 -0.388 . . . . 64.1 110.54 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -62.78 -39.34 93.89 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.917 0.389 . . . . 82.11 110.111 174.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.88 -42.71 99.87 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.498 -0.481 . . . . 64.02 110.944 176.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' ILE . . . . . . . . . . . . . 2.8 mt -66.68 -39.49 83.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 120.84 0.352 . . . . 82.23 111.16 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -60.66 -43.32 97.77 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 121.667 -0.646 . . . . 75.98 110.942 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -58.59 -48.23 81.64 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.152 -0.476 . . . . 123.19 111.718 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 44.8 tp -61.76 -44.09 97.57 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.766 -0.374 . . . . 75.97 111.892 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' ASN . . . . . 0.717 ' OD1' ' NZ ' ' B' ' 202' ' ' LYS . 53.8 m-20 -57.2 -43.77 83.03 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.672 -0.411 . . . . 97.27 111.344 -178.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.39 89.28 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.174 -0.611 . . . . 99.14 110.607 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -61.04 -44.51 97.29 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.477 -0.329 . . . . 101.16 110.526 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -61.66 -40.71 95.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.343 -0.543 . . . . 80.01 112.065 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.44 73.54 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.578 -0.849 . . . . 76.67 110.982 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -62.12 -38.23 88.13 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.536 -0.866 . . . . 94.35 111.643 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' MSE . . . . . . . . . . . . . 3.9 ttt -55.51 -50.62 69.46 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 106.954 -1.498 . . . . 161.47 106.954 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.45 -43.8 88.97 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.722 0.639 . . . . 91.0 111.018 -175.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 165' ' ' ALA . . . . . . . . . . . . . . . -50.55 -67.51 0.25 Allowed 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.723 0.638 . . . . 75.68 112.723 164.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' B' ' 170' ' ' GLU . 83.9 m-20 -51.46 -27.21 9.73 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.307 0.854 . . . . 99.76 113.307 -175.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 167' ' ' THR . . . . . . . . . . . . . 32.3 p -74.32 -50.09 20.22 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.094 -0.643 . . . . 100.42 110.852 172.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' ALA . . . . . . . . . . . . . . . -47.03 -59.82 2.86 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.814 0.34 . . . . 90.82 110.342 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -53.72 -42.16 67.8 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.445 -0.502 . . . . 106.46 110.697 173.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 170' ' ' GLU . . . . . 0.579 ' HB2' ' O ' ' B' ' 166' ' ' ASP . 16.6 tt0 -62.17 -34.6 76.74 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.246 -0.581 . . . . 135.25 111.512 -173.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 171' ' ' VAL . . . . . 0.637 HG11 ' HG ' ' B' ' 187' ' ' LEU . 11.6 t -87.28 -27.63 5.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 120.014 -0.675 . . . . 111.24 110.745 -178.651 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 172' ' ' GLN . . . . . 0.626 ' O ' ' NZ ' ' B' ' 183' ' ' LYS . 3.8 tt0 -73.29 -30.84 63.69 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.218 -0.301 . . . . 135.84 111.406 178.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 173' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 110.173 -0.306 . . . . 136.87 110.173 178.179 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 179' ' ' THR . . . . . . . . . . . . . 25.9 m . . . . . 0 CA--C 1.531 0.25 0 N-CA-C 109.304 -0.628 . . . . 148.58 109.304 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . . . 56.24 37.22 28.63 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.882 0.849 . . . . 145.86 110.355 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 181' ' ' ASN . . . . . . . . . . . . . 1.2 t30 50.85 30.75 5.39 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.604 1.562 . . . . 177.14 114.253 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -25.29 50.55 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 117.896 -1.522 . . . . 151.16 108.72 159.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 183' ' ' LYS . . . . . 0.626 ' NZ ' ' O ' ' B' ' 172' ' ' GLN . 76.7 mttt -54.07 -51.27 64.63 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.804 0.69 . . . . 122.37 110.663 -174.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 184' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.9 -38.81 79.72 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.987 -0.551 . . . . 171.11 111.501 -176.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 185' ' ' ARG . . . . . . . . . . . . . . . -67.89 -42.81 80.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.775 -0.77 . . . . 131.85 112.017 177.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' ' ' ARG . . . . . 0.46 ' NH2' ' HE3' ' B' ' 190' ' ' LYS . 8.6 ttp180 -67.62 -39.67 84.68 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.515 -0.874 . . . . 146.94 110.741 -174.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 187' ' ' LEU . . . . . 0.637 ' HG ' HG11 ' B' ' 171' ' ' VAL . 1.2 mt -57.27 -34.19 68.4 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.676 -1.21 . . . . 124.38 110.791 178.028 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -59.14 -38.62 80.1 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.195 -1.002 . . . . 158.59 110.584 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . . . -62.43 -42.81 99.72 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.013 -0.675 . . . . 117.37 110.481 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 190' ' ' LYS . . . . . 0.46 ' HE3' ' NH2' ' B' ' 186' ' ' ARG . 73.7 mttt -66.56 -48.62 69.04 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.462 -0.495 . . . . 111.16 110.728 176.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 191' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.97 -41.7 59.61 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.909 -0.316 . . . . 144.6 110.348 -177.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 192' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -73.73 -36.04 65.13 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 120.251 -0.58 . . . . 134.59 109.673 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -62.02 -44.07 97.48 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.084 0.469 . . . . 122.8 110.021 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 194' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 -63.73 -46.22 86.37 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.048 0.759 . . . . 80.78 113.048 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -39.23 82.58 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 C-N-CA 118.173 -1.411 . . . . 91.86 109.709 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -60.22 -44.42 95.17 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.928 0.394 . . . . 117.85 110.439 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 197' ' ' ARG . . . . . . . . . . . . . 18.6 ttt85 -67.29 -43.88 80.65 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.667 0.27 . . . . 91.9 111.269 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 198' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -61.34 -49.18 78.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 112.415 0.524 . . . . 96.53 112.415 -172.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 199' ' ' MSE . . . . . . . . . . . . . 71.7 mtp -70.73 -31.5 68.37 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 116.388 -2.125 . . . . 189.87 112.375 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 200' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -56.8 -39.8 74.77 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 117.831 -1.548 . . . . 87.3 109.732 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -58.32 -42.57 87.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.922 -0.311 . . . . 81.35 110.422 174.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' LYS . . . . . 0.717 ' NZ ' ' OD1' ' B' ' 157' ' ' ASN . 11.9 mmtt -64.18 -42.52 96.64 Favored 'General case' 0 C--O 1.235 0.301 0 O-C-N 122.08 -0.387 . . . . 92.04 111.725 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 203' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -59.22 -48.24 82.37 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.2 -0.6 . . . . 86.89 110.726 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.13 -55.67 25.48 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.31 -0.556 . . . . 127.04 110.382 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 205' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.64 -38.46 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 C-N-CA 120.099 -0.641 . . . . 67.8 110.488 -174.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 206' ' ' GLY . . . . . . . . . . . . . . . -51.74 -40.95 49.76 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.69 -0.767 . . . . 86.95 113.544 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 207' ' ' VAL . . . . . . . . . . . . . 97.7 t -76.16 -46.79 32.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 O-C-N 122.12 -0.635 . . . . 109.13 110.837 -172.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -59.91 -47.56 85.26 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.524 -0.47 . . . . 82.3 111.472 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 209' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -54.4 -49.11 70.68 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.946 0.403 . . . . 79.07 111.452 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 210' ' ' GLY . . . . . . . . . . . . . . . -60.43 -42.53 99.0 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 119.595 -1.288 . . . . 87.82 112.12 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 211' ' ' ARG . . . . . 0.705 ' NH2' ' O ' ' B' ' 301' ' ' HOH . 1.7 mmp_? -66.56 -42.12 87.59 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.721 -0.792 . . . . 119.63 109.935 179.354 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 212' ' ' ALA . . . . . . . . . . . . . . . -60.22 -52.96 63.05 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 120.941 0.4 . . . . 72.62 110.42 -178.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 213' ' ' MSE . . . . . . . . . . . . . 0.9 OUTLIER -52.2 -56.24 15.95 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 113.24 0.83 . . . . 123.07 113.24 174.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 214' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' B' ' 218' ' ' LEU . 3.6 tt0 -52.09 -48.6 64.64 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.376 -0.829 . . . . 96.48 110.91 -178.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 215' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -51.54 -51.78 52.48 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.011 0.434 . . . . 74.26 110.198 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 216' ' ' LEU . . . . . 0.401 HD23 HD13 ' B' ' 142' ' ' ILE . 49.3 tp -56.39 -51.85 66.82 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.501 0.556 . . . . 74.79 112.501 -178.551 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 8.1 mttm -60.87 -33.07 72.52 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 118.868 -1.133 . . . . 83.07 112.715 179.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 218' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 214' ' ' GLU . 14.7 mt -66.74 -37.7 85.18 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.082 -1.047 . . . . 75.75 111.333 176.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -61.95 -40.42 95.49 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.089 -0.645 . . . . 60.8 110.255 172.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HIS . . . . . . . . . . . . . 54.5 m170 -60.43 -47.15 87.34 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.769 -0.372 . . . . 65.97 110.546 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 221' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.84 -49.93 67.33 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.767 0.317 . . . . 84.74 111.163 176.884 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 222' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -60.56 -46.24 90.94 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.925 -0.71 . . . . 78.45 110.699 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -50.89 -47.31 60.67 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.967 0.413 . . . . 83.13 111.255 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 224' ' ' ILE . . . . . 0.712 HG12 ' HE1' ' B' ' 134' ' ' MSE . 51.1 mt -66.44 -50.95 63.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.305 0.574 . . . . 84.34 109.964 -178.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -50.71 -47.47 59.04 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.344 -0.389 . . . . 135.13 111.386 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -63.18 -40.67 98.18 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.919 -0.712 . . . . 106.49 111.412 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 227' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -62.25 -41.43 98.43 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.544 -0.862 . . . . 104.93 110.428 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.3 p -54.02 -56.69 15.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.049 0.452 . . . . 91.26 110.028 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.1 m -48.44 -48.93 37.12 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.612 0.597 . . . . 98.12 112.612 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 230' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.79 -42.34 99.66 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.203 -0.599 . . . . 125.79 112.096 -174.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 231' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' B' ' 234' ' ' LEU . 32.6 m -72.73 -58.11 5.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 120.377 -0.529 . . . . 149.99 111.078 178.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 232' ' ' GLN . . . . . 0.412 ' N ' HG23 ' B' ' 231' ' ' VAL . 1.0 OUTLIER -33.74 -47.45 0.25 Allowed 'General case' 0 C--O 1.239 0.528 0 C-N-CA 125.295 1.438 . . . . 115.49 112.297 -179.328 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 233' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -49.49 -59.92 3.31 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.36 0.6 . . . . 145.19 112.069 169.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 234' ' ' LEU . . . . . 0.491 ' N ' ' O ' ' B' ' 231' ' ' VAL . 10.1 mp . . . . . 0 C--N 1.327 -0.389 0 CA-C-O 120.883 0.373 . . . . 126.39 111.575 -173.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . 0.705 ' O ' ' NH2' ' B' ' 211' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 . . . . . 0 C--O 1.237 0.432 0 CA-C-O 121.035 0.445 . . . . 114.03 111.154 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -60.51 139.53 86.71 Favored 'Trans proline' 0 C--O 1.24 0.619 0 C-N-CA 121.132 1.221 . . . . 98.14 111.852 175.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -54.12 139.62 71.45 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 120.732 0.955 . . . . 113.11 111.169 179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.46 141.15 20.68 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 120.159 -0.617 . . . . 95.75 110.847 173.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 37.8 t -123.86 132.84 70.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.43 0 N-CA-C 106.102 -1.814 . . . . 84.45 106.102 168.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -112.49 121.61 45.31 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.439 -0.948 . . . . 76.84 108.439 -174.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -47.79 146.1 4.12 Favored Pre-proline 0 C--O 1.239 0.517 0 N-CA-C 109.056 -0.72 . . . . 93.86 109.056 168.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -77.39 144.36 22.85 Favored 'Trans proline' 0 C--N 1.324 -0.726 0 N-CA-C 108.883 -1.237 . . . . 85.96 108.883 168.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.6 m -88.46 123.03 40.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 106.146 -1.798 . . . . 111.02 106.146 178.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.3 p -123.71 152.88 41.6 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.035 -0.728 . . . . 90.86 109.035 -169.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.662 ' HG ' HH22 ' A' ' 37' ' ' ARG . 2.3 tp -45.77 -41.84 11.34 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.413 -0.812 . . . . 128.45 110.497 168.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.6 tp10 -61.59 -60.82 3.11 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.464 0.542 . . . . 114.14 112.464 177.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.9 p -58.28 -41.4 84.28 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.954 -0.467 . . . . 96.8 112.069 -176.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 51.4 mt -63.64 -39.55 94.64 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.059 -0.657 . . . . 93.53 109.823 178.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.662 HH22 ' HG ' ' A' ' 33' ' ' LEU . 9.5 ttm-85 -58.72 -34.94 71.9 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.198 0.599 . . . . 113.81 110.971 -178.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -88.85 -3.32 58.78 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.988 1.107 . . . . 148.88 113.988 -174.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.466 ' HG2' ' N ' ' A' ' 40' ' ' LYS . 4.2 tt0 -63.5 138.6 58.57 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 117.951 -1.5 . . . . 132.47 107.592 -179.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.466 ' N ' ' HG2' ' A' ' 39' ' ' GLU . 41.1 mtpt -71.53 -34.42 70.02 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 117.371 -1.732 . . . . 113.87 111.139 -176.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -52.98 -46.04 61.41 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.225 -0.988 . . . . 95.24 112.649 171.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 61.4 t80 -71.47 -31.76 67.52 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.113 -0.639 . . . . 99.22 112.196 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 47' ' ' LYS . 87.5 mt-30 -69.02 -31.77 70.81 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 118.98 -1.088 . . . . 96.16 110.375 178.143 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . . . -57.75 -25.47 60.48 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.813 -0.355 . . . . 101.69 111.143 174.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 46.7 t -70.53 -48.78 57.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.034 -0.666 . . . . 97.78 109.726 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -50.94 -50.13 39.57 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 116.185 -0.461 . . . . 110.81 113.411 172.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 43' ' ' GLN . 6.4 mmtt -60.25 -48.94 79.62 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.19 -0.594 . . . . 98.72 110.464 -174.611 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' A' ' 48' ' ' LYS . 3.4 mmtt -48.53 -47.93 38.75 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 121.977 -0.452 . . . . 102.71 111.366 171.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -61.7 -44.97 95.9 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.227 -0.295 . . . . 95.65 111.406 -175.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.592 HG13 ' N ' ' A' ' 51' ' ' LYS . 8.3 pt -62.55 -49.09 85.22 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 119.753 -0.779 . . . . 114.14 110.165 -177.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.619 ' O ' HG23 ' A' ' 55' ' ' THR . 3.1 tptt -52.7 -40.91 63.42 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.964 -0.695 . . . . 112.82 111.538 175.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -59.53 -28.16 66.83 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 120.91 -0.316 . . . . 105.26 110.971 178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 15.2 tp -90.53 -35.69 14.92 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.768 1.227 . . . . 90.64 110.546 -179.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -56.74 -50.94 70.75 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.342 -0.543 . . . . 124.23 109.873 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . 0.619 HG23 ' O ' ' A' ' 51' ' ' LYS . 22.9 p -60.71 -29.52 69.39 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 120.553 -0.459 . . . . 107.41 112.235 177.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 56.4 tp -71.74 -44.58 63.85 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.816 -0.754 . . . . 93.5 110.833 174.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -59.42 -26.56 65.27 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.891 -0.323 . . . . 107.4 110.942 173.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.604 ' O ' ' HG3' ' A' ' 62' ' ' LYS . . . -79.51 -21.3 45.46 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 119.438 -0.315 . . . . 112.32 110.648 179.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -82.75 -25.89 32.42 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.582 -0.447 . . . . 110.16 110.784 173.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.459 ' HA ' ' HG2' ' A' ' 63' ' ' GLU . 34.1 m170 -83.89 -50.69 7.82 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.004 -0.678 . . . . 92.5 110.569 -177.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -50.89 -50.37 57.43 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 112.131 0.419 . . . . 94.54 112.131 176.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.604 ' HG3' ' O ' ' A' ' 58' ' ' GLU . 18.1 mtmt -50.45 -53.93 25.92 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.328 -0.549 . . . . 106.68 111.089 174.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.459 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 17.4 pt-20 -65.97 -58.49 5.41 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 119.304 -0.959 . . . . 98.7 110.964 -177.414 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . . . -37.3 -52.96 1.09 Allowed 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.495 0.924 . . . . 106.59 113.495 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 75.4 p -65.36 -49.43 69.4 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.07 -0.652 . . . . 121.12 111.246 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . 0.425 ' O ' HG23 ' A' ' 70' ' ' THR . 1.0 OUTLIER -65.64 -32.51 74.11 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 111.828 0.307 . . . . 113.22 111.828 -174.756 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 2.4 t -68.74 -43.82 82.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.406 0 C-N-CA 119.978 -0.689 . . . . 107.28 110.005 177.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -60.16 -32.02 70.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.319 -0.953 . . . . 130.29 111.296 172.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -64.89 -47.65 77.06 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.463 -0.495 . . . . 130.16 111.513 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 66' ' ' SER . 10.3 p -57.71 -47.81 81.33 Favored 'General case' 0 C--O 1.238 0.493 0 O-C-N 122.003 -0.436 . . . . 119.5 110.622 170.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -55.63 -48.62 74.65 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.4 0.619 . . . . 107.93 110.218 -176.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.3 m-20 -68.55 -44.16 75.09 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 115.857 -0.61 . . . . 103.43 111.369 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.57 -43.84 98.12 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.586 -0.846 . . . . 100.05 111.055 -175.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.605 ' O ' ' HG ' ' A' ' 78' ' ' LEU . . . -63.52 -51.64 64.63 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.253 -0.979 . . . . 123.26 111.162 -178.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.425 ' HA ' HD12 ' A' ' 78' ' ' LEU . 2.5 pp -65.7 -43.66 93.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 C-N-CA 120.335 -0.546 . . . . 120.04 111.554 -175.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.476 ' O ' HG22 ' A' ' 79' ' ' ILE . 1.4 m-20 -59.86 -42.86 94.6 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 118.82 -1.152 . . . . 113.12 110.752 -176.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 7.1 mtmt -75.39 -28.28 59.42 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 117.95 -1.5 . . . . 121.63 111.895 171.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 74' ' ' ALA . 70.1 mt -60.97 -42.16 97.8 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.801 -1.16 . . . . 132.87 110.446 178.27 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.476 HG22 ' O ' ' A' ' 76' ' ' ASP . 3.1 tt -64.09 -37.79 80.76 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 C-N-CA 120.018 -0.673 . . . . 130.57 110.23 178.341 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 32.3 tttt -60.63 -41.81 95.61 Favored 'General case' 0 C--O 1.238 0.497 0 O-C-N 121.886 -0.509 . . . . 114.27 110.947 179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.18 -45.77 94.82 Favored Glycine 0 C--N 1.335 0.52 0 C-N-CA 120.48 -0.867 . . . . 119.23 111.276 -179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . . . -66.2 -40.57 90.46 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 122.328 -0.513 . . . . 129.09 111.108 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.1 t -62.64 -33.02 74.17 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.478 -0.489 . . . . 113.4 111.293 179.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.0 ttpt -60.72 -45.61 93.59 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.118 0.485 . . . . 127.61 111.902 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -74.03 -44.34 54.72 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.448 -0.501 . . . . 152.27 110.892 178.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -55.26 -52.03 64.72 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 112.458 0.54 . . . . 159.15 112.458 -175.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 3.4 mt -66.64 -33.21 61.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 C-N-CA 119.418 -0.913 . . . . 114.45 110.959 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.2 ttp180 -57.89 -41.41 82.5 Favored 'General case' 0 C--O 1.237 0.415 0 O-C-N 122.034 -0.417 . . . . 121.94 111.336 174.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -60.39 -44.46 95.65 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.169 -0.613 . . . . 112.93 111.345 179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.489 ' O ' HG13 ' A' ' 93' ' ' ILE . 2.5 t70 -54.83 -41.57 70.87 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.317 -0.553 . . . . 130.43 111.506 171.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -59.76 -33.27 71.46 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 120.382 -0.527 . . . . 127.29 111.431 178.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 17.2 m-20 -79.14 -14.77 58.9 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.584 0.957 . . . . 149.45 113.584 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 90' ' ' ASP . 1.6 pp -80.96 -52.57 13.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 118.283 -1.367 . . . . 109.12 109.851 172.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.449 ' H ' HG13 ' A' ' 93' ' ' ILE . 22.8 pttt -52.68 -43.93 65.9 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 119.543 -0.863 . . . . 144.82 110.09 174.501 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -62.69 -31.11 71.95 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.732 -0.787 . . . . 154.19 110.988 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 24.4 p -85.52 -57.96 2.85 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 120.574 -0.45 . . . . 110.85 111.035 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.446 HG22 ' HA ' ' A' ' 94' ' ' LYS . 6.4 tp -49.11 -45.77 17.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 120.912 -0.315 . . . . 118.56 111.497 176.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -60.82 -35.9 77.68 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.458 -0.897 . . . . 135.58 110.367 179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 82.5 m-20 -69.14 -48.82 61.36 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.937 0.398 . . . . 116.28 110.323 172.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -56.01 -31.56 63.18 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 114.267 1.21 . . . . 99.32 114.267 175.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 97' ' ' ILE . 71.1 p -76.59 -50.37 14.02 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 118.217 -1.393 . . . . 98.93 112.244 -179.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.424 ' HD3' ' HA ' ' A' ' 102' ' ' LYS . 1.5 mmtt -51.77 -51.47 56.12 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 119.127 -1.029 . . . . 127.36 111.348 172.591 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -39.12 -46.66 1.46 Allowed 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.16 0.505 . . . . 138.01 110.014 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TRP . . . . . . . . . . . . . 60.1 t-105 -61.92 -43.86 97.97 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.326 -0.397 . . . . 109.42 110.909 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' THR . . . . . 0.476 ' HA ' HG12 ' A' ' 108' ' ' ILE . 2.2 m -63.5 -40.46 97.13 Favored 'General case' 0 C--O 1.238 0.451 0 O-C-N 121.973 -0.454 . . . . 114.47 111.484 179.235 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -60.41 -43.81 96.36 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.968 -0.693 . . . . 147.8 110.203 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' MSE . . . . . . . . . . . . . . . -65.13 -46.77 79.62 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 122.889 0.475 . . . . 112.99 109.833 -176.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.546 HG13 ' N ' ' A' ' 109' ' ' ALA . 8.9 pt -65.83 -37.15 79.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 C-N-CA 120.06 -0.656 . . . . 124.24 110.867 -178.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.546 ' N ' HG13 ' A' ' 108' ' ' ILE . . . -61.48 -49.86 75.08 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 119.135 -1.026 . . . . 102.3 110.755 -176.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 25.0 mtp85 -72.83 -33.25 66.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 120.378 -0.529 . . . . 115.23 111.347 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -58.31 -35.37 71.75 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 118.623 -1.231 . . . . 114.47 109.959 170.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.527 ' O ' ' HG2' ' A' ' 115' ' ' GLU . 3.6 mtm180 -68.95 -33.57 73.94 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 122.349 -0.22 . . . . 150.79 110.705 179.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 116' ' ' TRP . 9.9 tttt -61.77 -60.69 3.28 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.53 -0.544 . . . . 131.01 109.53 174.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -27.48 -51.88 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.275 1.43 . . . . 172.72 111.87 174.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 112' ' ' ARG . 5.1 pt-20 -61.98 -52.01 65.74 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.123 -0.631 . . . . 124.75 110.743 173.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.54 ' CE2' ' HD3' ' A' ' 120' ' ' ARG . 66.6 t90 -63.3 -36.79 84.84 Favored 'General case' 0 CA--C 1.513 -0.469 0 O-C-N 121.926 -0.484 . . . . 122.35 110.561 -176.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.75 -50.86 69.39 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-O 121.656 0.741 . . . . 97.96 109.415 179.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' MSE . . . . . . . . . . . . . 15.4 ttt -66.32 -50.8 62.39 Favored 'General case' 0 N--CA 1.437 -1.119 0 C-N-CA 123.602 0.761 . . . . 155.0 111.172 -177.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 11.6 mt -50.91 -44.76 60.16 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.993 -0.683 . . . . 108.96 111.101 -177.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.54 ' HD3' ' CE2' ' A' ' 116' ' ' TRP . 0.7 OUTLIER -53.83 -39.48 65.61 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 112.348 0.499 . . . . 100.81 112.348 178.138 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -69.87 -48.2 59.68 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 118.634 -1.227 . . . . 96.56 111.135 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -41.49 -54.71 3.05 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 112.242 0.46 . . . . 82.36 112.242 171.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 98.8 t -62.85 -51.93 65.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 C-N-CA 120.152 -0.619 . . . . 76.31 110.833 -178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -54.73 -47.08 74.24 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.587 -0.445 . . . . 113.8 111.368 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -67.81 -48.29 66.69 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.603 -0.839 . . . . 103.57 110.867 179.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 33.9 m -51.86 -51.17 58.63 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.256 -0.578 . . . . 91.22 110.514 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -49.18 -61.54 2.02 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.404 0.621 . . . . 115.24 110.724 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -45.01 -51.53 9.83 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.441 0.696 . . . . 88.01 111.956 176.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.6 -52.54 65.12 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.518 -0.473 . . . . 74.41 111.789 -177.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' MSE . . . . . . . . . . . . . 3.9 mtm -49.49 -47.15 48.83 Favored 'General case' 0 CA--C 1.505 -0.769 0 O-C-N 122.034 -0.416 . . . . 168.78 110.876 176.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -63.76 -45.32 90.34 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 118.88 -1.128 . . . . 99.27 109.952 -177.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -56.11 -48.03 76.97 Favored 'General case' 0 C--O 1.238 0.448 0 O-C-N 121.952 -0.467 . . . . 63.8 110.769 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 20.2 tp -56.51 -38.54 71.95 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 120.665 0.269 . . . . 94.56 111.042 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' MSE . . . . . 0.514 ' O ' ' HG3' ' A' ' 138' ' ' GLN . 35.4 ttp -59.8 -54.65 43.75 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.494 0.664 . . . . 107.97 111.122 178.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 23.9 mt -57.09 -42.75 81.32 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 114.282 -1.326 . . . . 71.05 110.82 -173.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.0 m -55.23 -65.2 0.63 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.81 -0.177 . . . . 76.31 111.435 175.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.405 HG22 ' O ' ' A' ' 134' ' ' MSE . 8.0 m -51.77 -52.41 22.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 C-N-CA 120.836 -0.346 . . . . 73.23 111.102 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 134' ' ' MSE . 19.2 mt-30 -43.87 -52.93 6.46 Favored 'General case' 0 C--O 1.238 0.463 0 O-C-N 121.659 -0.651 . . . . 80.57 111.256 173.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -60.4 -42.16 95.36 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.143 -0.481 . . . . 72.15 110.697 177.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -58.41 -34.86 71.24 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.392 -0.523 . . . . 67.18 111.676 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.53 ' OE1' ' NE2' ' A' ' 220' ' ' HIS . 61.9 mt-30 -70.25 -48.1 58.39 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 119.658 -0.817 . . . . 72.46 110.915 177.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 22.4 mm -46.78 -51.51 4.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 CA-C-O 121.145 0.498 . . . . 72.29 111.671 172.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -68.76 -32.69 72.63 Favored 'General case' 0 CA--C 1.517 -0.307 0 C-N-CA 117.791 -1.563 . . . . 107.82 110.724 -177.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -63.17 -39.37 94.46 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.163 -0.615 . . . . 116.35 110.37 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.591 ' HB3' ' HE1' ' A' ' 213' ' ' MSE . 9.8 tp -68.45 -58.37 4.43 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.945 -0.702 . . . . 60.7 111.568 176.636 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -43.83 -52.16 6.93 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 112.299 0.481 . . . . 95.52 112.299 174.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -60.01 -43.9 94.94 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.41 -0.516 . . . . 107.13 110.979 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 4.6 ttt-85 -60.03 -53.17 60.93 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.832 -0.747 . . . . 113.91 111.505 173.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -48.98 -34.74 13.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 111.589 0.218 . . . . 60.12 111.589 -173.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -74.24 -38.13 63.59 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.84 -0.344 . . . . 62.9 111.121 -177.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 -56.36 -46.77 79.86 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 121.231 0.538 . . . . 121.69 111.027 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ASP . . . . . . . . . . . . . 84.9 m-20 -50.51 -47.47 57.34 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-N 116.285 -0.416 . . . . 81.54 111.302 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 4.3 mt -67.37 -43.71 87.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 C-N-CA 120.307 -0.557 . . . . 90.79 111.768 -177.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 157' ' ' ASN . 11.6 tmtt? -57.26 -61.08 2.72 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 118.916 -1.114 . . . . 100.79 109.416 173.247 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -37.43 -61.15 0.62 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 123.365 0.666 . . . . 108.97 111.901 173.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LEU . . . . . . . . . . . . . 25.4 tp -48.26 -52.84 19.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.189 -0.46 . . . . 90.29 111.961 174.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 154' ' ' LYS . 39.7 m-20 -46.99 -53.08 13.2 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.802 0.334 . . . . 80.58 110.899 178.088 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ALA . . . . . . . . . . . . . . . -50.85 -59.6 3.95 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-N 116.369 -0.378 . . . . 82.9 111.42 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 31.9 tttm -50.03 -46.72 53.24 Favored 'General case' 0 C--O 1.239 0.544 0 C-N-CA 120.39 -0.524 . . . . 95.06 110.797 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -59.43 -46.23 89.34 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 119.96 -0.696 . . . . 71.53 110.143 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -60.14 -44.36 95.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.286 -0.965 . . . . 90.72 110.892 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 14.7 tptt -61.97 -43.23 99.27 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 119.453 -0.899 . . . . 115.92 111.677 -173.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' MSE . . . . . 0.544 ' HE3' ' HE1' ' A' ' 198' ' ' PHE . 0.2 OUTLIER -55.97 -43.77 77.88 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 118.758 -1.177 . . . . 149.46 111.929 173.134 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -55.93 -46.62 78.42 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.502 -0.879 . . . . 89.78 110.46 -173.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ALA . . . . . . . . . . . . . . . -54.3 -55.99 22.9 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.558 -0.457 . . . . 84.19 111.139 164.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ASP . . . . . 0.418 ' HB2' ' HA ' ' A' ' 163' ' ' MSE . 41.3 m-20 -57.1 -36.75 70.99 Favored 'General case' 0 C--O 1.238 0.478 0 N-CA-C 112.142 0.423 . . . . 119.31 112.142 -173.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' THR . . . . . 0.431 HG23 ' HG2' ' A' ' 163' ' ' MSE . 36.6 p -69.42 -44.64 70.94 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.472 -1.291 . . . . 96.22 109.908 173.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.22 74.38 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.742 0.306 . . . . 103.95 111.364 -177.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' LYS . . . . . . . . . . . . . 10.2 tttm -59.48 -39.51 83.96 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.318 -0.553 . . . . 123.06 111.011 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -61.22 -40.03 92.49 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 112.009 0.374 . . . . 153.73 112.009 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.7 t -61.68 -39.17 82.27 Favored 'Isoleucine or valine' 0 C--O 1.24 0.562 0 CA-C-O 121.041 0.448 . . . . 134.05 110.543 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.84 -36.66 79.68 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.132 -0.627 . . . . 135.85 110.35 178.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -94.37 6.39 48.86 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 112.002 0.371 . . . . 125.97 112.002 178.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' ASP . . . . . . . . . . . . . 32.2 t0 -74.59 156.75 36.45 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 122.007 0.908 . . . . 113.31 111.257 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' THR . . . . . . . . . . . . . 14.5 t -65.66 1.36 1.29 Allowed 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 114.8 -1.091 . . . . 113.96 113.724 178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.85 123.06 17.51 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 118.289 -1.364 . . . . 121.43 108.349 173.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . . . -71.21 -44.75 64.77 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 112.784 0.661 . . . . 133.62 112.784 -176.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -113.45 140.42 48.1 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.666 -0.646 . . . . 140.08 112.423 -174.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' LYS . . . . . 0.64 ' HA ' ' HB2' ' A' ' 183' ' ' LYS . 31.9 mttp -56.12 -32.93 64.67 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.2 -0.6 . . . . 126.28 111.343 -179.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -47.17 -49.31 22.88 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.248 0.547 . . . . 162.37 111.165 175.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -76.64 -37.8 55.71 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.497 -0.32 . . . . 146.28 111.685 174.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' LYS . . . . . 0.64 ' HB2' ' HA ' ' A' ' 180' ' ' LYS . 58.3 mttm -58.41 -48.72 79.77 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.399 0.545 . . . . 127.97 111.242 -179.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -64.19 -34.77 78.83 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 112.199 0.444 . . . . 116.51 112.199 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -31.09 72.16 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.65 -0.82 . . . . 181.3 112.222 179.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -82.35 -42.44 18.71 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 120.192 -0.603 . . . . 113.39 111.588 -172.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' LEU . . . . . 0.457 HD12 ' N ' ' A' ' 188' ' ' ARG . 4.2 pp -56.75 -43.3 80.6 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 118.747 -1.181 . . . . 108.07 110.313 172.276 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' ARG . . . . . 0.457 ' N ' HD12 ' A' ' 187' ' ' LEU . 9.9 mtp85 -57.06 -38.09 72.76 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.027 -0.669 . . . . 150.56 110.727 175.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -67.98 -46.0 72.57 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.83 0.347 . . . . 136.74 111.542 171.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -68.41 -55.89 10.35 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.77 0.319 . . . . 102.08 111.088 -177.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -46.51 -53.43 11.3 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 112.729 0.64 . . . . 114.2 112.729 -178.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -64.49 -44.25 91.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.735 -0.786 . . . . 137.93 111.545 -179.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' ASN . . . . . . . . . . . . . 45.7 t-20 -49.66 -49.07 48.8 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.888 -0.725 . . . . 114.51 110.006 171.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' ASN . . . . . 0.412 ' OD1' HG21 ' A' ' 167' ' ' THR . 3.7 m120 -63.82 -35.88 82.06 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 111.933 0.346 . . . . 116.19 111.933 179.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' VAL . . . . . . . . . . . . . 29.0 t -60.51 -43.48 94.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 C-N-CA 119.75 -0.78 . . . . 80.69 110.111 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' LYS . . . . . . . . . . . . . 16.1 mttm -51.64 -51.53 55.0 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.561 -0.456 . . . . 90.54 110.438 170.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' ARG . . . . . . . . . . . . . 21.5 ttt85 -62.22 -43.26 99.23 Favored 'General case' 0 C--O 1.239 0.536 0 N-CA-C 109.899 -0.408 . . . . 66.51 109.899 -178.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' PHE . . . . . 0.544 ' HE1' ' HE3' ' A' ' 163' ' ' MSE . 17.0 m-30 -58.32 -39.07 78.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 CA-C-O 120.777 0.322 . . . . 99.34 111.37 178.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' MSE . . . . . . . . . . . . . 3.4 mtp -72.46 -42.46 64.93 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.744 0.646 . . . . 180.95 112.744 179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.86 -46.57 87.27 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.362 -0.935 . . . . 143.43 110.428 176.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' GLU . . . . . . . . . . . . . 72.6 mt-10 -48.86 -45.49 41.0 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.0 0.429 . . . . 98.42 111.525 172.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -64.38 -43.08 95.6 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 111.82 0.304 . . . . 68.72 111.82 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -56.23 -47.1 79.11 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 120.525 0.202 . . . . 97.86 111.138 176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -60.79 -50.7 72.39 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.166 -0.613 . . . . 108.29 112.163 -179.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ILE . . . . . . . . . . . . . 2.9 tt -64.09 -36.5 77.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 118.874 -1.131 . . . . 65.23 110.581 -178.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' GLY . . . . . . . . . . . . . . . -51.1 -38.23 38.99 Favored Glycine 0 C--N 1.333 0.362 0 C-N-CA 119.352 -1.404 . . . . 47.88 111.405 171.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' VAL . . . . . . . . . . . . . 17.3 t -84.14 -52.57 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.39 0 O-C-N 122.219 -0.577 . . . . 57.65 110.735 -168.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 47.4 tttm -54.26 -47.06 72.7 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 119.651 -0.82 . . . . 87.33 111.03 178.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -55.7 -40.56 72.55 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 116.652 -0.249 . . . . 70.17 111.605 176.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' GLY . . . . . . . . . . . . . . . -68.35 -40.77 86.99 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 118.629 -1.748 . . . . 40.56 110.185 177.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -63.32 -45.01 93.29 Favored 'General case' 0 C--O 1.238 0.489 0 O-C-N 122.383 -0.48 . . . . 88.07 110.257 177.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' ALA . . . . . . . . . . . . . . . -59.66 -44.25 93.64 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 120.193 -0.603 . . . . 55.6 110.737 -179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' MSE . . . . . 0.591 ' HE1' ' HB3' ' A' ' 145' ' ' LEU . 39.5 tpp -62.81 -50.88 69.25 Favored 'General case' 0 N--CA 1.439 -1.0 0 C-N-CA 120.304 -0.559 . . . . 93.24 112.054 -179.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -53.52 -53.68 48.04 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 118.66 -1.216 . . . . 105.44 110.012 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' LYS . . . . . . . . . . . . . 1.7 tptt -53.94 -43.5 69.88 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.101 -0.639 . . . . 89.08 110.275 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' LEU . . . . . . . . . . . . . 3.1 tp -53.29 -59.06 5.05 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.497 -0.481 . . . . 59.04 112.047 172.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' LYS . . . . . . . . . . . . . 57.4 mttm -60.1 -29.6 68.7 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 118.688 -1.205 . . . . 70.22 113.31 -177.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' LEU . . . . . . . . . . . . . 6.8 mt -69.19 -35.01 75.79 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 119.205 -0.998 . . . . 57.91 112.219 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.2 -46.78 82.42 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 118.82 -1.152 . . . . 55.85 110.218 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HIS . . . . . 0.53 ' NE2' ' OE1' ' A' ' 141' ' ' GLN . 29.8 m170 -57.33 -47.53 81.33 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.877 0.37 . . . . 63.07 110.881 178.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' SER . . . . . . . . . . . . . 3.1 t -54.02 -54.15 43.11 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 111.87 0.322 . . . . 85.64 111.87 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -60.14 -44.67 94.76 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 119.426 -0.91 . . . . 87.44 112.066 -179.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -48.66 -46.13 39.76 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.173 -0.611 . . . . 71.22 111.566 176.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' ILE . . . . . 0.421 HG12 ' HE3' ' A' ' 134' ' ' MSE . 15.3 mt -59.0 -56.65 15.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.714 0.768 . . . . 85.44 110.371 179.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -49.7 -53.68 23.16 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.753 -0.658 . . . . 113.71 111.282 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -64.07 -43.39 95.61 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.46 -0.496 . . . . 115.35 111.484 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -59.23 -44.9 92.32 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.483 -0.887 . . . . 101.78 110.936 178.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' SER . . . . . . . . . . . . . 63.1 m -58.59 -59.79 4.84 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.291 -0.564 . . . . 97.0 111.014 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' THR . . . . . . . . . . . . . 27.2 p -47.2 -43.22 21.29 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 121.566 -0.709 . . . . 104.56 112.158 175.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -64.37 -38.25 90.36 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.305 0.483 . . . . 127.01 112.305 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.15 -57.82 6.7 Favored 'Isoleucine or valine' 0 C--O 1.238 0.47 0 C-N-CA 119.652 -0.819 . . . . 130.31 110.33 176.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -38.77 -39.56 0.52 Allowed 'General case' 0 C--O 1.239 0.539 0 C-N-CA 125.547 1.539 . . . . 152.45 112.301 -177.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' LYS . . . . . . . . . . . . . 19.6 mtpt -46.75 -59.93 2.73 Favored 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.22 0.533 . . . . 138.49 112.063 170.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 121.205 0.526 . . . . 130.89 111.949 -175.254 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 . . . . . 0 CA--C 1.55 0.95 0 N-CA-C 116.016 1.858 . . . . 123.41 116.016 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -64.65 143.07 79.84 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 120.388 0.725 . . . . 119.73 111.778 169.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_exo -58.02 149.92 67.85 Favored 'Trans proline' 0 C--O 1.235 0.338 0 CA-C-O 121.685 0.619 . . . . 65.77 111.192 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' LEU . . . . . . . . . . . . . 56.7 mt -57.99 143.55 42.75 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.554 -0.748 . . . . 76.23 109.316 171.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' VAL . . . . . . . . . . . . . 4.1 t -131.7 131.69 62.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 106.205 -1.776 . . . . 75.65 106.205 170.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -113.76 123.57 50.17 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 107.879 -1.156 . . . . 68.51 107.879 -172.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -63.82 147.92 95.38 Favored Pre-proline 0 C--O 1.236 0.39 0 N-CA-C 110.039 -0.356 . . . . 164.0 110.039 171.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_exo -68.06 150.62 77.64 Favored 'Trans proline' 0 C--N 1.33 -0.43 0 N-CA-C 109.531 -0.988 . . . . 71.84 109.531 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 89.8 t -90.52 124.02 42.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 105.741 -1.948 . . . . 59.12 105.741 173.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' THR . . . . . 0.425 ' H ' ' HG ' ' B' ' 35' ' ' SER . 23.6 p -131.55 153.89 49.39 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.105 -0.702 . . . . 76.09 109.105 -172.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.438 ' O ' ' HG3' ' B' ' 37' ' ' ARG . 2.5 tp -43.75 -52.4 6.6 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.398 -0.819 . . . . 103.37 110.113 163.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -55.12 -51.23 67.07 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.182 -0.324 . . . . 103.68 111.642 178.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' SER . . . . . 0.425 ' HG ' ' H ' ' B' ' 32' ' ' THR . 80.0 p -64.16 -37.86 88.98 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-O 120.659 0.266 . . . . 78.62 111.123 -178.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.36 -45.15 94.46 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.762 -0.375 . . . . 82.47 110.542 -178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' B' ' 33' ' ' LEU . 4.3 mtm105 -59.09 -33.56 70.96 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.19 0.441 . . . . 127.22 112.19 -179.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -74.6 -17.51 60.7 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.371 0.508 . . . . 100.47 112.371 -177.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.586 ' OE2' ' N ' ' B' ' 41' ' ' GLY . 2.2 tm-20 -62.67 134.73 56.76 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 109.849 -0.426 . . . . 103.18 109.849 -174.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 63.2 mttt -70.59 -37.2 73.89 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.811 -0.631 . . . . 105.15 112.022 -169.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLY . . . . . 0.586 ' N ' ' OE2' ' B' ' 39' ' ' GLU . . . -59.74 -39.68 95.6 Favored Glycine 0 C--N 1.334 0.431 0 C-N-CA 119.663 -1.256 . . . . 86.4 112.771 173.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 52.3 t80 -77.49 -31.64 53.76 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 113.011 0.745 . . . . 88.23 113.011 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -61.81 -41.2 97.46 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.986 -1.085 . . . . 131.26 109.748 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLU . . . . . . . . . . . . . . . -60.34 -18.79 52.33 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 120.804 -0.359 . . . . 91.12 111.844 177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 73.6 t -67.33 -55.67 16.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-O 121.343 0.592 . . . . 90.9 109.697 173.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . -45.58 -52.18 9.33 Favored Glycine 0 C--N 1.337 0.601 0 C-N-CA 121.219 -0.515 . . . . 105.42 113.102 172.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 20.3 mttt -55.83 -51.19 68.35 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.347 -0.502 . . . . 96.77 110.869 -178.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -42.02 -51.33 4.52 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.816 0.341 . . . . 107.36 111.757 169.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLN . . . . . 0.443 ' HA ' ' HG3' ' B' ' 52' ' ' GLU . 81.0 mt-30 -61.21 -39.42 90.16 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.917 -0.313 . . . . 103.63 110.999 -173.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ILE . . . . . . . . . . . . . 26.3 mt -59.54 -50.16 80.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 120.488 -0.485 . . . . 96.58 110.175 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -52.3 -40.6 62.03 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.403 -0.519 . . . . 116.96 110.822 175.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLU . . . . . 0.47 ' O ' HG22 ' B' ' 55' ' ' THR . 4.9 mt-10 -61.04 -31.99 71.62 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 111.968 0.359 . . . . 103.89 111.968 179.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 3.0 mt -91.53 -36.73 13.55 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 112.738 0.644 . . . . 90.9 112.738 179.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.496 ' O ' ' HB2' ' B' ' 58' ' ' GLU . 7.3 m-20 -56.16 -50.73 70.34 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 120.05 -0.66 . . . . 123.62 109.435 167.857 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' THR . . . . . 0.47 HG22 ' O ' ' B' ' 52' ' ' GLU . 1.4 t -60.06 -28.42 67.78 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 120.084 -0.646 . . . . 104.35 111.729 177.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 31.9 tp -81.02 -48.33 12.37 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.636 -0.826 . . . . 98.53 110.581 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 22.3 mtt180 -63.71 -13.14 40.58 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.113 -0.635 . . . . 113.48 111.235 176.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' B' ' 54' ' ' ASP . 0.2 OUTLIER -86.17 -23.48 26.51 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 122.847 0.459 . . . . 113.07 110.733 176.543 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -94.38 -19.39 20.66 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 123.376 0.67 . . . . 129.03 111.279 174.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 6.9 m170 -72.59 -41.84 65.22 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 120.761 0.315 . . . . 127.72 110.242 178.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ALA . . . . . 0.472 ' O ' HG23 ' B' ' 65' ' ' THR . . . -65.69 -46.9 77.29 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.41 -0.359 . . . . 141.27 111.53 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LYS . . . . . . . . . . . . . 6.4 mttp -57.45 -42.52 82.67 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.397 -0.921 . . . . 146.98 111.346 -175.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -63.14 -42.93 99.56 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 118.64 -1.224 . . . . 165.7 109.581 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ARG . . . . . 0.426 ' HD3' ' HA ' ' B' ' 64' ' ' ARG . 47.5 mmt-85 -60.87 -42.7 98.4 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 111.897 0.332 . . . . 144.51 111.897 179.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' THR . . . . . 0.472 HG23 ' O ' ' B' ' 61' ' ' ALA . 24.1 p -71.26 -44.12 65.89 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 120.509 -0.477 . . . . 122.3 111.189 178.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' SER . . . . . 0.472 ' O ' HG23 ' B' ' 70' ' ' THR . 27.3 t -62.52 -47.97 81.58 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.459 -0.496 . . . . 119.34 111.311 -173.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 7.1 m -70.11 -30.11 42.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 C-N-CA 119.81 -0.756 . . . . 106.56 109.914 178.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.43 -38.44 77.43 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 119.991 -0.684 . . . . 113.53 111.153 175.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 9.9 mtpt -70.38 -45.19 66.53 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.295 -0.962 . . . . 120.31 111.229 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' THR . . . . . 0.472 HG23 ' O ' ' B' ' 66' ' ' SER . 4.5 p -58.49 -48.25 81.4 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.502 -0.479 . . . . 117.27 111.254 175.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -57.38 -42.31 81.91 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.013 -0.675 . . . . 114.22 109.799 -179.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -63.02 -46.37 87.92 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.881 -0.6 . . . . 126.65 110.315 176.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.89 -45.18 93.33 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 120.837 0.351 . . . . 107.22 110.679 -176.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.03 -43.83 97.61 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.883 -0.727 . . . . 109.59 110.643 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mm -66.25 -45.16 90.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 C-N-CA 120.238 -0.585 . . . . 111.41 110.423 177.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -60.87 -38.6 86.16 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 120.113 -0.635 . . . . 121.6 110.592 -179.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -64.21 -42.02 96.8 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.74 -0.784 . . . . 153.63 110.467 176.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.24 -47.97 72.04 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.805 -0.758 . . . . 120.27 111.054 177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . 1.9 tt -58.61 -37.86 67.76 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 119.603 -0.839 . . . . 121.54 109.288 -175.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LYS . . . . . . . . . . . . . 79.0 mttt -65.11 -49.68 69.04 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.26 0.552 . . . . 137.81 109.888 177.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.66 -43.98 95.61 Favored Glycine 0 C--N 1.339 0.695 0 CA-C-N 116.177 -0.465 . . . . 135.21 113.726 -177.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LYS . . . . . . . . . . . . . . . -62.75 -44.97 94.82 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 122.101 -0.646 . . . . 127.75 110.84 -177.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 3.6 m -84.94 -11.38 55.66 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 118.366 -1.334 . . . . 164.51 111.474 -176.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LYS . . . . . . . . . . . . . . . -65.5 -45.63 82.87 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 108.498 -0.927 . . . . 136.56 108.498 170.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -60.34 -40.73 91.75 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.562 -0.745 . . . . 157.39 110.593 176.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.63 -51.48 69.73 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.541 -0.464 . . . . 194.71 111.922 -177.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.5 -20.54 9.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 115.74 -2.384 . . . . 152.7 110.59 -178.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -67.23 -41.92 84.87 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 119.242 -0.983 . . . . 135.38 109.838 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ASN . . . . . 0.401 ' OD1' ' C ' ' B' ' 89' ' ' ASN . 0.3 OUTLIER -72.9 -24.8 60.88 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.353 0.661 . . . . 141.66 111.328 177.812 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.69 -45.52 93.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.983 0.421 . . . . 149.55 109.967 174.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.06 -37.98 89.35 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.464 -0.494 . . . . 134.39 109.889 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -58.32 -45.91 87.17 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.642 -0.423 . . . . 153.14 111.55 -179.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.89 -35.18 53.66 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 118.689 -1.204 . . . . 125.26 109.566 177.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LYS . . . . . 0.417 ' HA ' HG22 ' B' ' 97' ' ' ILE . . . -62.36 -42.62 99.55 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.118 -0.633 . . . . 130.21 110.218 -179.528 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ASN . . . . . . . . . . . . . 33.1 m-20 -56.86 -44.2 81.94 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.796 0.332 . . . . 156.37 110.988 177.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.88 -47.45 62.52 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 120.67 -0.412 . . . . 127.9 110.939 -177.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ILE . . . . . 0.417 HG22 ' HA ' ' B' ' 94' ' ' LYS . 3.3 tt -59.22 -45.89 92.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-O 120.765 0.317 . . . . 144.87 110.681 -172.994 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . 0.648 ' O ' ' OG1' ' B' ' 101' ' ' THR . 4.6 m-20 -66.29 -41.5 89.68 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 119.984 -0.686 . . . . 166.79 111.689 179.87 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -65.51 -44.99 85.26 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.199 -0.6 . . . . 170.7 111.772 176.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -44.57 -33.31 1.72 Allowed 'General case' 0 C--O 1.234 0.274 0 O-C-N 121.989 -0.444 . . . . 134.2 111.654 171.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' THR . . . . . 0.648 ' OG1' ' O ' ' B' ' 98' ' ' ASN . 38.2 p -76.31 -34.03 59.03 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 119.353 -0.939 . . . . 132.34 111.226 176.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -57.21 -41.29 79.16 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 119.138 -1.025 . . . . 108.46 109.77 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -58.27 -46.3 86.27 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.007 0.432 . . . . 120.18 109.988 176.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 51.0 t-105 -66.8 -45.33 78.73 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.373 -0.376 . . . . 157.78 111.056 179.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' THR . . . . . 0.433 ' HA ' HG12 ' B' ' 108' ' ' ILE . 5.1 p -61.34 -39.35 90.25 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.337 -0.945 . . . . 111.69 109.619 178.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -61.48 -40.36 94.26 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.271 0.558 . . . . 113.63 109.545 176.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' MSE . . . . . . . . . . . . . 0.2 OUTLIER -63.61 -48.26 78.03 Favored 'General case' 0 N--CA 1.443 -0.785 0 C-N-CA 123.756 0.822 . . . . 119.86 111.06 -177.708 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' ILE . . . . . 0.466 HG13 ' N ' ' B' ' 109' ' ' ALA . 13.9 pt -64.82 -39.28 85.12 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 C-N-CA 120.148 -0.621 . . . . 106.31 109.766 -178.411 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.466 ' N ' HG13 ' B' ' 108' ' ' ILE . . . -62.09 -45.86 91.65 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.191 -0.604 . . . . 103.74 110.182 -179.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . . . -67.05 -36.99 83.27 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 111.76 0.281 . . . . 102.31 111.76 179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -60.46 -44.64 95.66 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.359 -0.537 . . . . 91.64 111.041 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' ARG . . . . . . . . . . . . . 40.4 mtm180 -67.78 -35.19 78.23 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 111.866 0.321 . . . . 132.5 111.866 176.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . . . -62.32 -46.13 90.13 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.478 -0.489 . . . . 95.04 110.714 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -63.07 -45.83 90.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 120.224 -0.59 . . . . 100.86 110.928 177.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -63.08 -45.0 94.18 Favored 'General case' 0 C--O 1.236 0.388 0 O-C-N 122.07 -0.394 . . . . 97.91 111.77 178.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' TRP . . . . . . . . . . . . . 16.9 t-105 -65.8 -46.51 78.39 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 118.595 -1.242 . . . . 116.25 110.58 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.35 -42.03 88.67 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 119.411 -0.916 . . . . 141.28 110.704 -177.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' MSE . . . . . . . . . . . . . 2.1 tmt? -65.79 -40.64 92.12 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 108.955 -0.757 . . . . 118.82 108.955 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 13.8 mt -66.96 -32.52 73.83 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 118.008 -1.477 . . . . 92.28 111.228 177.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ARG . . . . . . . . . . . . . 1.9 ttt85 -61.52 -25.57 67.37 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.797 0.295 . . . . 151.83 111.797 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' GLN . . . . . . . . . . . . . 3.2 tp60 -74.61 -52.32 12.09 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 120.822 0.344 . . . . 99.25 110.962 175.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -38.3 -50.22 1.45 Allowed 'General case' 0 C--O 1.236 0.357 0 N-CA-C 113.601 0.963 . . . . 93.99 113.601 176.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 14.3 m -63.75 -47.41 91.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.31 -0.556 . . . . 93.52 110.882 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLN . . . . . . . . . . . . . 48.7 tp60 -54.9 -49.08 72.13 Favored 'General case' 0 C--O 1.235 0.333 0 O-C-N 121.897 -0.502 . . . . 117.25 111.435 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 82.2 m-20 -60.45 -50.81 72.08 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 119.328 -0.949 . . . . 86.23 110.232 178.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' SER . . . . . . . . . . . . . 1.6 t -60.34 -52.29 65.87 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.793 0.33 . . . . 83.1 110.598 -174.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 18.7 tt0 -44.16 -62.6 1.09 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-O 120.971 0.415 . . . . 101.74 111.088 167.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -48.31 -52.87 19.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 115.951 -0.568 . . . . 82.7 111.337 -177.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ALA . . . . . . . . . . . . . . . -53.12 -50.29 64.77 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.168 0.433 . . . . 74.66 112.168 -177.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' MSE . . . . . 0.451 ' HE3' ' HB3' ' B' ' 130' ' ' MSE . 1.3 mtm -60.11 -46.5 89.42 Favored 'General case' 0 CA--C 1.501 -0.913 0 C-N-CA 118.082 -1.447 . . . . 137.53 113.72 -173.242 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . 4.5 tttm -45.88 -54.09 8.74 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 118.389 -1.324 . . . . 79.45 110.172 172.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -47.33 -59.35 3.25 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.034 0.445 . . . . 81.03 110.497 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.428 ' O ' HG23 ' B' ' 137' ' ' VAL . 3.3 tp -42.3 -60.86 1.33 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.775 0.798 . . . . 65.6 112.238 175.042 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' MSE . . . . . 0.712 ' HE1' HG12 ' B' ' 224' ' ' ILE . 2.6 ttp -50.67 -57.76 7.49 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-N 115.276 -0.875 . . . . 113.09 111.717 179.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 64.9 mt -55.52 -41.61 73.37 Favored 'General case' 0 CA--C 1.514 -0.407 0 O-C-N 124.414 1.071 . . . . 64.69 109.897 179.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' THR . . . . . . . . . . . . . 69.5 m -58.58 -60.71 3.39 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 120.777 -0.369 . . . . 70.87 111.552 172.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 133' ' ' LEU . 64.5 t -51.21 -55.8 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 CA-C-O 121.167 0.508 . . . . 80.26 110.924 -179.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' B' ' 134' ' ' MSE . 42.2 mt-30 -46.56 -51.4 15.65 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 112.278 0.473 . . . . 71.09 112.278 174.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.76 89.58 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 121.077 -0.249 . . . . 65.37 111.575 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ALA . . . . . . . . . . . . . . . -52.14 -47.77 65.23 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.399 -0.52 . . . . 59.5 110.866 175.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -61.18 -48.71 80.31 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 122.239 -0.288 . . . . 71.85 111.28 -175.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ILE . . . . . 0.401 HD13 HD23 ' B' ' 216' ' ' LEU . 25.2 mm -51.04 -43.18 25.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 C-N-CA 120.712 -0.395 . . . . 63.0 111.245 171.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' LYS . . . . . 0.507 ' HE3' ' OD1' ' B' ' 147' ' ' ASP . 37.0 tptt -68.82 -36.24 77.96 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 118.224 -1.391 . . . . 75.93 111.033 179.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -59.88 -40.51 88.91 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.828 -0.749 . . . . 80.73 110.794 177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' LEU . . . . . . . . . . . . . 12.4 tp -70.24 -48.35 57.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.065 -0.516 . . . . 72.36 111.208 -179.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -53.95 -45.07 71.2 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.946 0.403 . . . . 106.43 110.816 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' ASP . . . . . 0.507 ' OD1' ' HE3' ' B' ' 143' ' ' LYS . 59.2 m-20 -63.52 -48.93 75.52 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 122.294 -0.254 . . . . 94.6 111.578 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.52 -45.08 92.78 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.055 0.455 . . . . 67.46 111.128 -178.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -56.89 -42.71 80.38 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 119.29 -0.964 . . . . 70.07 110.379 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.81 85.56 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.73 -0.388 . . . . 64.1 110.54 -179.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' ARG . . . . . . . . . . . . . 6.6 mtm180 -62.78 -39.34 93.89 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.917 0.389 . . . . 82.11 110.111 174.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -62.88 -42.71 99.87 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 120.498 -0.481 . . . . 64.02 110.944 176.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' ILE . . . . . . . . . . . . . 2.8 mt -66.68 -39.49 83.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 120.84 0.352 . . . . 82.23 111.16 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -60.66 -43.32 97.77 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 121.667 -0.646 . . . . 75.98 110.942 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -58.59 -48.23 81.64 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.152 -0.476 . . . . 123.19 111.718 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' LEU . . . . . . . . . . . . . 44.8 tp -61.76 -44.09 97.57 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.766 -0.374 . . . . 75.97 111.892 179.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' ASN . . . . . 0.717 ' OD1' ' NZ ' ' B' ' 202' ' ' LYS . 53.8 m-20 -57.2 -43.77 83.03 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.672 -0.411 . . . . 97.27 111.344 -178.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -62.11 -46.39 89.28 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.174 -0.611 . . . . 99.14 110.607 175.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -61.04 -44.51 97.29 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 116.477 -0.329 . . . . 101.16 110.526 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -61.66 -40.71 95.89 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.343 -0.543 . . . . 80.01 112.065 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' ALA . . . . . . . . . . . . . . . -68.15 -45.44 73.54 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 119.578 -0.849 . . . . 76.67 110.982 -178.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -62.12 -38.23 88.13 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.536 -0.866 . . . . 94.35 111.643 -179.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' MSE . . . . . . . . . . . . . 3.9 ttt -55.51 -50.62 69.46 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 106.954 -1.498 . . . . 161.47 106.954 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.45 -43.8 88.97 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.722 0.639 . . . . 91.0 111.018 -175.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' ALA . . . . . . . . . . . . . . . -50.55 -67.51 0.25 Allowed 'General case' 0 C--O 1.237 0.445 0 N-CA-C 112.723 0.638 . . . . 75.68 112.723 164.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' B' ' 170' ' ' GLU . 83.9 m-20 -51.46 -27.21 9.73 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 113.307 0.854 . . . . 99.76 113.307 -175.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' THR . . . . . . . . . . . . . 32.3 p -74.32 -50.09 20.22 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.094 -0.643 . . . . 100.42 110.852 172.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' ALA . . . . . . . . . . . . . . . -47.03 -59.82 2.86 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 120.814 0.34 . . . . 90.82 110.342 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' LYS . . . . . . . . . . . . . 18.8 tttp -53.72 -42.16 67.8 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.445 -0.502 . . . . 106.46 110.697 173.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' GLU . . . . . 0.579 ' HB2' ' O ' ' B' ' 166' ' ' ASP . 16.6 tt0 -62.17 -34.6 76.74 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.246 -0.581 . . . . 135.25 111.512 -173.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' VAL . . . . . 0.637 HG11 ' HG ' ' B' ' 187' ' ' LEU . 11.6 t -87.28 -27.63 5.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 C-N-CA 120.014 -0.675 . . . . 111.24 110.745 -178.651 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' GLN . . . . . 0.626 ' O ' ' NZ ' ' B' ' 183' ' ' LYS . 3.8 tt0 -73.29 -30.84 63.69 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.218 -0.301 . . . . 135.84 111.406 178.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 . . . . . 0 C--N 1.329 -0.291 0 N-CA-C 110.173 -0.306 . . . . 136.87 110.173 178.179 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' THR . . . . . . . . . . . . . 25.9 m . . . . . 0 CA--C 1.531 0.25 0 N-CA-C 109.304 -0.628 . . . . 148.58 109.304 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . . . 56.24 37.22 28.63 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.882 0.849 . . . . 145.86 110.355 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' ASN . . . . . . . . . . . . . 1.2 t30 50.85 30.75 5.39 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.604 1.562 . . . . 177.14 114.253 172.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.43 -25.29 50.55 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 117.896 -1.522 . . . . 151.16 108.72 159.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' LYS . . . . . 0.626 ' NZ ' ' O ' ' B' ' 172' ' ' GLN . 76.7 mttt -54.07 -51.27 64.63 Favored 'General case' 0 C--O 1.237 0.428 0 O-C-N 123.804 0.69 . . . . 122.37 110.663 -174.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -58.9 -38.81 79.72 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.987 -0.551 . . . . 171.11 111.501 -176.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' ARG . . . . . . . . . . . . . . . -67.89 -42.81 80.62 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.775 -0.77 . . . . 131.85 112.017 177.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' ARG . . . . . 0.46 ' NH2' ' HE3' ' B' ' 190' ' ' LYS . 8.6 ttp180 -67.62 -39.67 84.68 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 119.515 -0.874 . . . . 146.94 110.741 -174.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' LEU . . . . . 0.637 ' HG ' HG11 ' B' ' 171' ' ' VAL . 1.2 mt -57.27 -34.19 68.4 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.676 -1.21 . . . . 124.38 110.791 178.028 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' ARG . . . . . . . . . . . . . 4.2 mtp85 -59.14 -38.62 80.1 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.195 -1.002 . . . . 158.59 110.584 174.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' GLU . . . . . . . . . . . . . . . -62.43 -42.81 99.72 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.013 -0.675 . . . . 117.37 110.481 174.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' LYS . . . . . 0.46 ' HE3' ' NH2' ' B' ' 186' ' ' ARG . 73.7 mttt -66.56 -48.62 69.04 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.462 -0.495 . . . . 111.16 110.728 176.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.97 -41.7 59.61 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.909 -0.316 . . . . 144.6 110.348 -177.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -73.73 -36.04 65.13 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 120.251 -0.58 . . . . 134.59 109.673 -179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -62.02 -44.07 97.48 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.084 0.469 . . . . 122.8 110.021 174.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' ASN . . . . . . . . . . . . . 38.5 m-20 -63.73 -46.22 86.37 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.048 0.759 . . . . 80.78 113.048 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' VAL . . . . . . . . . . . . . 60.8 t -61.75 -39.23 82.58 Favored 'Isoleucine or valine' 0 C--O 1.239 0.524 0 C-N-CA 118.173 -1.411 . . . . 91.86 109.709 -177.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -60.22 -44.42 95.17 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.928 0.394 . . . . 117.85 110.439 177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' ARG . . . . . . . . . . . . . 18.6 ttt85 -67.29 -43.88 80.65 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.667 0.27 . . . . 91.9 111.269 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' PHE . . . . . . . . . . . . . 11.4 m-30 -61.34 -49.18 78.02 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 112.415 0.524 . . . . 96.53 112.415 -172.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' MSE . . . . . . . . . . . . . 71.7 mtp -70.73 -31.5 68.37 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 116.388 -2.125 . . . . 189.87 112.375 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -56.8 -39.8 74.77 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 117.831 -1.548 . . . . 87.3 109.732 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -58.32 -42.57 87.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.922 -0.311 . . . . 81.35 110.422 174.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' LYS . . . . . 0.717 ' NZ ' ' OD1' ' B' ' 157' ' ' ASN . 11.9 mmtt -64.18 -42.52 96.64 Favored 'General case' 0 C--O 1.235 0.301 0 O-C-N 122.08 -0.387 . . . . 92.04 111.725 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -59.22 -48.24 82.37 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.2 -0.6 . . . . 86.89 110.726 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.13 -55.67 25.48 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 120.31 -0.556 . . . . 127.04 110.382 176.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.64 -38.46 81.6 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 C-N-CA 120.099 -0.641 . . . . 67.8 110.488 -174.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' GLY . . . . . . . . . . . . . . . -51.74 -40.95 49.76 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.69 -0.767 . . . . 86.95 113.544 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' VAL . . . . . . . . . . . . . 97.7 t -76.16 -46.79 32.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 O-C-N 122.12 -0.635 . . . . 109.13 110.837 -172.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' LYS . . . . . . . . . . . . . 3.6 mmpt? -59.91 -47.56 85.26 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.524 -0.47 . . . . 82.3 111.472 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -54.4 -49.11 70.68 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 120.946 0.403 . . . . 79.07 111.452 176.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' GLY . . . . . . . . . . . . . . . -60.43 -42.53 99.0 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 119.595 -1.288 . . . . 87.82 112.12 178.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' ARG . . . . . 0.705 ' NH2' ' O ' ' B' ' 301' ' ' HOH . 1.7 mmp_? -66.56 -42.12 87.59 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 119.721 -0.792 . . . . 119.63 109.935 179.354 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' ALA . . . . . . . . . . . . . . . -60.22 -52.96 63.05 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 120.941 0.4 . . . . 72.62 110.42 -178.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' MSE . . . . . . . . . . . . . 0.9 OUTLIER -52.2 -56.24 15.95 Favored 'General case' 0 N--CA 1.441 -0.901 0 N-CA-C 113.24 0.83 . . . . 123.07 113.24 174.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' B' ' 218' ' ' LEU . 3.6 tt0 -52.09 -48.6 64.64 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.376 -0.829 . . . . 96.48 110.91 -178.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -51.54 -51.78 52.48 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.011 0.434 . . . . 74.26 110.198 177.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' LEU . . . . . 0.401 HD23 HD13 ' B' ' 142' ' ' ILE . 49.3 tp -56.39 -51.85 66.82 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.501 0.556 . . . . 74.79 112.501 -178.551 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' LYS . . . . . . . . . . . . . 8.1 mttm -60.87 -33.07 72.52 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 118.868 -1.133 . . . . 83.07 112.715 179.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 218' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 214' ' ' GLU . 14.7 mt -66.74 -37.7 85.18 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.082 -1.047 . . . . 75.75 111.333 176.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -61.95 -40.42 95.49 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 120.089 -0.645 . . . . 60.8 110.255 172.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HIS . . . . . . . . . . . . . 54.5 m170 -60.43 -47.15 87.34 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 120.769 -0.372 . . . . 65.97 110.546 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.84 -49.93 67.33 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.767 0.317 . . . . 84.74 111.163 176.884 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' LYS . . . . . . . . . . . . . 11.2 tttm -60.56 -46.24 90.94 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.925 -0.71 . . . . 78.45 110.699 177.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' GLN . . . . . . . . . . . . . 32.6 mt-30 -50.89 -47.31 60.67 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.967 0.413 . . . . 83.13 111.255 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' ILE . . . . . 0.712 HG12 ' HE1' ' B' ' 134' ' ' MSE . 51.1 mt -66.44 -50.95 63.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 121.305 0.574 . . . . 84.34 109.964 -178.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -50.71 -47.47 59.04 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.344 -0.389 . . . . 135.13 111.386 176.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -63.18 -40.67 98.18 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 119.919 -0.712 . . . . 106.49 111.412 177.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 227' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -62.25 -41.43 98.43 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.544 -0.862 . . . . 104.93 110.428 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' SER . . . . . . . . . . . . . 1.3 p -54.02 -56.69 15.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 121.049 0.452 . . . . 91.26 110.028 176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 2.1 m -48.44 -48.93 37.12 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.612 0.597 . . . . 98.12 112.612 176.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 230' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -62.79 -42.34 99.66 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.203 -0.599 . . . . 125.79 112.096 -174.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' VAL . . . . . 0.491 ' O ' ' N ' ' B' ' 234' ' ' LEU . 32.6 m -72.73 -58.11 5.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 120.377 -0.529 . . . . 149.99 111.078 178.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 232' ' ' GLN . . . . . 0.412 ' N ' HG23 ' B' ' 231' ' ' VAL . 1.0 OUTLIER -33.74 -47.45 0.25 Allowed 'General case' 0 C--O 1.239 0.528 0 C-N-CA 125.295 1.438 . . . . 115.49 112.297 -179.328 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 233' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -49.49 -59.92 3.31 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.36 0.6 . . . . 145.19 112.069 169.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' LEU . . . . . 0.491 ' N ' ' O ' ' B' ' 231' ' ' VAL . 10.1 mp . . . . . 0 C--N 1.327 -0.389 0 CA-C-O 120.883 0.373 . . . . 126.39 111.575 -173.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . 0.705 ' O ' ' NH2' ' B' ' 211' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_