data_2rbf_residue 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 2rbf _Structure_validation_residue.Date_analyzed 2016-10-12 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 ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.129 0.49 . . . . 53.539999999999999 111.928 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 t -142.26 164.24 30.68 Favored 'General case' 0 CA--C 1.508 -0.658 0 C-N-CA 120.053 -0.659 . . . . 50.920000000000002 110.021 171.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 91.9 m -90.13 119.6 30.59 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 124.274 0.983 . . . . 48.969999999999999 110.263 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 96.1 mmm -99.65 121.74 41.66 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.878 -0.786 . . . . 59.979999999999997 108.878 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 150.07 44.21 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-O 121.128 0.293 . . . . 48.979999999999997 113.233 173.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.4 p -135.62 124.08 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 107.332 -1.359 . . . . 52.609999999999999 107.332 171.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.7 111.9 10.36 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.495 -0.928 . . . . 51.729999999999997 108.495 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 97.8 mt -128.53 130.08 46.94 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 107.373 -1.343 . . . . 47.810000000000002 107.373 -172.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.4 p30 -80.26 172.95 13.1 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 117.764 -1.574 . . . . 50.990000000000002 109.405 178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -65.13 -42.88 93.46 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.87 -0.605 . . . . 52.479999999999997 112.361 -167.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.2 -42.09 76.63 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 112.727 0.639 . . . . 41.049999999999997 112.727 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -69.37 -41.58 76.34 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 120.54 -0.464 . . . . 43.780000000000001 110.109 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 mtm105 -60.94 -37.31 81.91 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.755 0.65 . . . . 62.369999999999997 112.755 176.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.45 -36.25 71.17 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.894 0.702 . . . . 58.390000000000001 112.894 174.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -59.42 -40.16 85.82 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 119.784 -0.767 . . . . 53.729999999999997 109.984 173.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 82.0 mt -66.54 -44.25 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 111.923 0.342 . . . . 46.280000000000001 111.923 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . . . -63.52 -40.97 98.43 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 121.118 0.485 . . . . 48.960000000000001 109.845 -176.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.2 t -67.73 -47.26 69.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 113.816 -1.538 . . . . 46.799999999999997 111.726 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.81 -40.92 88.24 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 119.566 -0.854 . . . . 44.920000000000002 111.416 178.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.97 -46.35 71.64 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.411 0.684 . . . . 46.57 112.823 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 16.4 m -59.22 -49.63 77.11 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.528 -0.76 . . . . 46.219999999999999 112.431 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . 0.283 18.5 ptt180 -78.52 -4.56 49.2 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 116.068 1.877 . . . . 50.520000000000003 116.068 -176.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 21.7 pt -107.99 5.96 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 113.811 1.041 . . . . 47.299999999999997 113.811 166.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.0 t0 61.35 45.74 8.35 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.57 1.322 . . . . 53.219999999999999 114.57 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -138.19 165.93 25.44 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.18 -1.415 . . . . 52.0 107.18 -179.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 72.0 p -80.62 155.89 73.37 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 120.454 -0.498 . . . . 45.359999999999999 110.637 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -50.39 -38.67 53.46 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 120.819 1.013 . . . . 44.219999999999999 113.876 169.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -59.92 -48.88 79.9 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.121 0.568 . . . . 42.909999999999997 111.406 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 61.7 t90 -57.46 -42.25 82.17 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.213 0.53 . . . . 42.950000000000003 110.429 179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tt -63.52 -45.41 90.77 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.195 -0.457 . . . . 42.840000000000003 111.528 -176.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.56 -48.72 87.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 112.881 0.697 . . . . 47.390000000000001 112.881 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.22 -53.47 55.6 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.803 0.689 . . . . 59.640000000000001 112.022 174.022 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . 0.558 ' NE2' ' O ' ' A' ' 55' ' ' HOH . 10.9 tp-100 -57.03 -43.83 82.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.54 0.57 . . . . 49.840000000000003 112.54 177.094 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.52 -41.91 63.88 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 120.932 0.396 . . . . 43.560000000000002 111.752 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.0 mt -66.42 -48.16 81.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 CA-C-N 115.386 -0.824 . . . . 44.090000000000003 109.003 -177.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -64.1 -39.35 93.86 Favored 'General case' 0 C--O 1.211 -0.951 0 O-C-N 123.315 0.385 . . . . 46.350000000000001 111.828 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.9 m -69.61 -36.62 76.34 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.005 -0.678 . . . . 48.060000000000002 111.082 -179.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -71.63 -38.72 70.73 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.977 -0.556 . . . . 45.909999999999997 110.693 -177.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.25 -39.3 92.42 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.055 0.391 . . . . 42.990000000000002 112.055 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . . . -60.96 -46.6 90.05 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.728 -0.101 . . . . 44.920000000000002 110.728 173.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -56.62 -45.11 81.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.444 0.535 . . . . 54.659999999999997 112.444 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.18 -45.37 81.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.323 0.49 . . . . 50.310000000000002 112.323 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -77.53 -13.87 59.81 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 113.473 0.916 . . . . 60.390000000000001 113.473 -174.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.789 0 N-CA-C 113.466 0.913 . . . . 58.229999999999997 113.466 178.701 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 32.6 p . . . . . 0 N--CA 1.5 2.06 0 N-CA-C 112.979 0.733 . . . . 55.310000000000002 112.979 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 32.8 p -116.9 156.43 27.38 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.723 1.379 . . . . 51.439999999999998 114.723 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtp -115.78 162.9 16.62 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 106.488 -1.671 . . . . 50.640000000000001 106.488 156.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . -120.85 144.98 17.19 Favored Glycine 0 C--O 1.218 -0.868 0 N-CA-C 112.02 -0.432 . . . . 47.109999999999999 112.02 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 11.9 p -129.04 126.4 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 121.443 0.639 . . . . 45.329999999999998 110.199 172.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . 0.487 ' NZ ' ' O6 ' ' C' ' 7' ' ' ' DG' . 27.2 ttmt -84.44 113.23 21.05 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.85 -0.614 . . . . 47.359999999999999 109.672 -178.19 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -119.15 145.61 45.84 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 123.889 0.743 . . . . 48.109999999999999 109.821 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -84.21 171.54 12.69 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.496 -0.927 . . . . 52.780000000000001 108.496 173.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -63.65 -40.3 96.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.425 1.268 . . . . 53.619999999999997 114.425 -173.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.47 -45.16 92.42 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.107 0.48 . . . . 47.399999999999999 111.608 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 20.7 m -67.63 -44.84 77.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.535 -0.913 . . . . 47.729999999999997 108.535 -178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 80.5 mtm-85 -54.19 -39.82 67.0 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 119.004 -0.522 . . . . 51.109999999999999 112.161 171.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -59.41 -50.01 75.59 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 123.268 0.355 . . . . 50.049999999999997 110.857 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -62.08 -41.53 98.27 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.104 0.478 . . . . 50.109999999999999 111.619 -178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 86.9 mt -60.0 -45.96 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 C-N-CA 119.844 -0.742 . . . . 45.899999999999999 111.069 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . . . -65.66 -47.79 74.35 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.337 0.398 . . . . 46.619999999999997 110.864 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.1 p -61.71 -35.78 79.02 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.366 -0.534 . . . . 50.090000000000003 111.691 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.06 -39.02 69.35 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.421 0.526 . . . . 48.539999999999999 112.421 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.82 78.69 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.764 0.826 . . . . 49.969999999999999 112.224 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 40.8 m -69.17 -44.04 73.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.046 -0.525 . . . . 50.560000000000002 109.695 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 41.6 mtt180 -52.11 -41.22 62.29 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.563 0.949 . . . . 58.799999999999997 113.563 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 3.0 pt -97.03 3.93 9.72 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 114.766 1.395 . . . . 50.189999999999998 114.766 -175.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 38.6 t0 66.99 46.32 1.6 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.381 0.61 . . . . 49.119999999999997 109.981 172.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ARG . . . . . . . . . . . . . 5.5 mmt85 -139.83 164.78 29.06 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 114.655 -1.157 . . . . 51.670000000000002 109.347 -179.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.8 p -84.18 158.75 60.75 Favored Pre-proline 0 C--N 1.326 -0.436 0 C-N-CA 120.643 -0.423 . . . . 46.710000000000001 110.857 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -53.73 -41.71 72.07 Favored 'Trans proline' 0 N--CA 1.447 -1.219 0 N-CA-C 113.424 0.509 . . . . 45.979999999999997 113.424 169.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -58.01 -51.64 68.83 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 114.019 1.118 . . . . 47.020000000000003 114.019 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' TRP . . . . . . . . . . . . . 67.6 t90 -51.65 -47.39 63.78 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.186 0.517 . . . . 46.579999999999998 111.248 170.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.13 -49.16 74.68 Favored 'General case' 0 C--O 1.247 0.954 0 N-CA-C 112.82 0.674 . . . . 47.009999999999998 112.82 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.97 -42.6 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 120.52 -0.472 . . . . 45.609999999999999 112.195 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 15.3 mtpt -60.96 -47.54 85.98 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.975 0.731 . . . . 52.640000000000001 112.975 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -60.9 -39.88 90.97 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 112.416 0.524 . . . . 54.759999999999998 112.416 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.44 82.86 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.703 -0.48 . . . . 41.469999999999999 109.703 175.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 65.3 mt -64.04 -51.66 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 116.344 -0.389 . . . . 40.880000000000003 111.934 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -55.15 -42.28 72.89 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.1 0.778 . . . . 47.210000000000001 113.1 174.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 26.0 t -66.38 -43.3 86.31 Favored 'General case' 0 C--O 1.203 -1.39 0 C-N-CA 119.586 -0.846 . . . . 43.25 109.693 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -66.83 -40.86 88.11 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 117.935 0.334 . . . . 47.530000000000001 111.154 -177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.8 -41.12 97.96 Favored 'General case' 0 C--O 1.213 -0.86 0 N-CA-C 113.853 1.057 . . . . 41.909999999999997 113.853 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . . . -57.69 -44.61 85.94 Favored 'General case' 0 C--O 1.207 -1.171 0 O-C-N 123.95 0.781 . . . . 46.189999999999998 110.522 174.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.28 -48.45 78.86 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 112.341 0.497 . . . . 66.640000000000001 112.341 174.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 59.6 mt -65.11 -42.34 94.05 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.185 -0.206 . . . . 50.350000000000001 110.974 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -74.24 -31.87 62.75 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.159 0.8 . . . . 51.649999999999999 113.159 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -83.18 -8.35 59.5 Favored 'General case' 0 C--O 1.21 -1.004 0 N-CA-C 114.646 1.351 . . . . 61.229999999999997 114.646 175.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 28.9 t -75.17 157.94 33.8 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.294 0.497 . . . . 59.210000000000001 112.038 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ASP . . . . . 0.647 ' OD2' ' N ' ' B' ' 48' ' ' ASP . 0.6 OUTLIER . . . . . 0 N--CA 1.469 0.491 0 N-CA-C 114.032 1.123 . . . . 62.520000000000003 114.032 -164.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 59.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.517 -1.065 0 O4'-C4'-C3' 102.61 -2.99 . . . . 59.640000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.573 1 P-O3'-C3' 124.875 4.313 . . . . 58.810000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.392 -3.014 0 OP1-P-OP2 123.918 2.879 . . . . 58.399999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ' DG' . . . . . 0.487 ' O6 ' ' NZ ' ' B' ' 9' ' ' LYS . . . . . . . . 0 C4'--C3' 1.549 2.114 2 O4'-C1'-N19 111.906 5.133 . . . . 49.490000000000002 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.395 -1.907 1 O4'-C1'-N19 111.022 4.028 . . . . 50.259999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.409 -1.726 2 P-O3'-C3' 124.972 4.393 . . . . 56.950000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.398 -1.667 1 O4'-C1'-N19 111.867 5.083 . . . . 52.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.391 -3.057 2 O4'-C1'-N19 111.842 5.052 . . . . 52.68 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.403 -2.161 0 O3'-P-O5' 98.12 -3.095 . . . . 52.969999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.592 -1.243 1 O4'-C1'-N19 112.577 5.972 . . . . 48.020000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.406 -1.886 0 C3'-C2'-C1' 105.564 2.046 . . . . 52.280000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.411 ' N3 ' ' N1 ' ' D' ' 7' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.404 -1.251 0 P-O5'-C5' 116.363 -2.836 . . . . 55.590000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' ' DT' . . . . . 0.463 ' N3 ' ' N1 ' ' D' ' 6' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.537 1.908 2 O4'-C1'-N19 104.174 -4.533 . . . . 57.030000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.607 1.402 1 P-O3'-C3' 124.55 4.041 . . . . 56.060000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.469 ' N4 ' ' O6 ' ' D' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.408 -1.974 1 O4'-C1'-N19 112.539 5.924 . . . . 55.340000000000003 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.403 -2.293 0 O3'-P-O5' 96.487 -3.954 . . . . 55.450000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.583 -1.959 0 O4'-C1'-N19 105.149 -3.314 . . . . 53.920000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ' DA' . . . . . 0.413 ' N1 ' ' N3 ' ' D' ' 1' ' ' ' DT' . . . . . . . . 0 P--O5' 1.605 1.242 0 O4'-C1'-N19 110.366 3.208 . . . . 51.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' ' DT' . . . . . 0.413 ' N3 ' ' N1 ' ' C' ' 21' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.194 0 O4'-C4'-C3' 106.821 1.221 . . . . 49.5 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.546 2.761 0 O4'-C1'-C2' 102.846 -2.958 . . . . 51.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.418 -1.372 1 O4'-C1'-N19 111.675 4.843 . . . . 52.960000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' ' DG' . . . . . 0.469 ' O6 ' ' N4 ' ' C' ' 18' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.407 -1.841 1 O4'-C1'-N19 111.43 4.537 . . . . 55.689999999999998 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.535 1.685 0 O4'-C1'-N19 104.929 -3.589 . . . . 57.43 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ' DA' . . . . . 0.463 ' N1 ' ' N3 ' ' C' ' 16' ' ' ' DT' . . . . . . . . 0 P--O5' 1.614 2.12 1 O4'-C1'-N19 103.962 -4.798 . . . . 56.420000000000002 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' ' DA' . . . . . 0.411 ' N1 ' ' N3 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.405 -1.989 1 P-O3'-C3' 124.629 4.107 . . . . 54.960000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.395 -1.961 1 O4'-C1'-N19 112.351 5.689 . . . . 50.530000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.342 1 P-O3'-C3' 125.116 4.513 . . . . 48.689999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.948 0 N19-C1'-C2' 118.216 2.51 . . . . 50.909999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.693 1 O4'-C1'-N19 114.492 8.365 . . . . 56.780000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.432 0 P-O3'-C3' 123.04 2.783 . . . . 53.100000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.41 -1.647 0 O5'-C5'-C4' 111.757 1.112 . . . . 53.590000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.595 -1.002 1 O4'-C1'-N19 113.687 7.359 . . . . 52.780000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.413 -1.349 0 O4'-C4'-C3' 103.579 -2.021 . . . . 54.850000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.1 0 C3'-C2'-C1' 106.688 2.849 . . . . 53.880000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.673 0 O4'-C1'-N19 104.83 -3.713 . . . . 56.729999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.855 0 P-O3'-C3' 123.956 3.547 . . . . 61.530000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.448 2 O4'-C1'-N19 112.698 6.122 . . . . 63.600000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' HOH . . . . . 0.558 ' O ' ' NE2' ' A' ' 35' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.129 0.49 . . . . 53.539999999999999 111.928 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 t -142.26 164.24 30.68 Favored 'General case' 0 CA--C 1.508 -0.658 0 C-N-CA 120.053 -0.659 . . . . 50.920000000000002 110.021 171.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 91.9 m -90.13 119.6 30.59 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 124.274 0.983 . . . . 48.969999999999999 110.263 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 96.1 mmm -99.65 121.74 41.66 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.878 -0.786 . . . . 59.979999999999997 108.878 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 150.07 44.21 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-O 121.128 0.293 . . . . 48.979999999999997 113.233 173.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.4 p -135.62 124.08 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 107.332 -1.359 . . . . 52.609999999999999 107.332 171.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.7 111.9 10.36 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.495 -0.928 . . . . 51.729999999999997 108.495 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 97.8 mt -128.53 130.08 46.94 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 107.373 -1.343 . . . . 47.810000000000002 107.373 -172.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.4 p30 -80.26 172.95 13.1 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 117.764 -1.574 . . . . 50.990000000000002 109.405 178.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -65.13 -42.88 93.46 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.87 -0.605 . . . . 52.479999999999997 112.361 -167.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.2 -42.09 76.63 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 112.727 0.639 . . . . 41.049999999999997 112.727 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -69.37 -41.58 76.34 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 120.54 -0.464 . . . . 43.780000000000001 110.109 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 mtm105 -60.94 -37.31 81.91 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.755 0.65 . . . . 62.369999999999997 112.755 176.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.45 -36.25 71.17 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.894 0.702 . . . . 58.390000000000001 112.894 174.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -59.42 -40.16 85.82 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 119.784 -0.767 . . . . 53.729999999999997 109.984 173.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 82.0 mt -66.54 -44.25 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 111.923 0.342 . . . . 46.280000000000001 111.923 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . . . -63.52 -40.97 98.43 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 121.118 0.485 . . . . 48.960000000000001 109.845 -176.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.2 t -67.73 -47.26 69.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 113.816 -1.538 . . . . 46.799999999999997 111.726 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.81 -40.92 88.24 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 119.566 -0.854 . . . . 44.920000000000002 111.416 178.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.97 -46.35 71.64 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.411 0.684 . . . . 46.57 112.823 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 16.4 m -59.22 -49.63 77.11 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.528 -0.76 . . . . 46.219999999999999 112.431 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . 0.283 18.5 ptt180 -78.52 -4.56 49.2 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 116.068 1.877 . . . . 50.520000000000003 116.068 -176.058 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 21.7 pt -107.99 5.96 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 113.811 1.041 . . . . 47.299999999999997 113.811 166.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.0 t0 61.35 45.74 8.35 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.57 1.322 . . . . 53.219999999999999 114.57 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -138.19 165.93 25.44 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.18 -1.415 . . . . 52.0 107.18 -179.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 72.0 p -80.62 155.89 73.37 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 120.454 -0.498 . . . . 45.359999999999999 110.637 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -50.39 -38.67 53.46 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 120.819 1.013 . . . . 44.219999999999999 113.876 169.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -59.92 -48.88 79.9 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.121 0.568 . . . . 42.909999999999997 111.406 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 61.7 t90 -57.46 -42.25 82.17 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.213 0.53 . . . . 42.950000000000003 110.429 179.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tt -63.52 -45.41 90.77 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.195 -0.457 . . . . 42.840000000000003 111.528 -176.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.56 -48.72 87.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 112.881 0.697 . . . . 47.390000000000001 112.881 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.22 -53.47 55.6 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.803 0.689 . . . . 59.640000000000001 112.022 174.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 52.5 tp60 -57.03 -43.83 82.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.54 0.57 . . . . 49.840000000000003 112.54 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.52 -41.91 63.88 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 120.932 0.396 . . . . 43.560000000000002 111.752 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.0 mt -66.42 -48.16 81.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 CA-C-N 115.386 -0.824 . . . . 44.090000000000003 109.003 -177.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -64.1 -39.35 93.86 Favored 'General case' 0 C--O 1.211 -0.951 0 O-C-N 123.315 0.385 . . . . 46.350000000000001 111.828 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.9 m -69.61 -36.62 76.34 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.005 -0.678 . . . . 48.060000000000002 111.082 -179.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -71.63 -38.72 70.73 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.977 -0.556 . . . . 45.909999999999997 110.693 -177.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.25 -39.3 92.42 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.055 0.391 . . . . 42.990000000000002 112.055 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . . . -60.96 -46.6 90.05 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.728 -0.101 . . . . 44.920000000000002 110.728 173.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -56.62 -45.11 81.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.444 0.535 . . . . 54.659999999999997 112.444 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.18 -45.37 81.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.323 0.49 . . . . 50.310000000000002 112.323 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -77.53 -13.87 59.81 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 113.473 0.916 . . . . 60.390000000000001 113.473 -174.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.789 0 N-CA-C 113.466 0.913 . . . . 58.229999999999997 113.466 178.701 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 32.6 p . . . . . 0 N--CA 1.5 2.06 0 N-CA-C 112.979 0.733 . . . . 55.310000000000002 112.979 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 32.8 p -116.9 156.43 27.38 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.723 1.379 . . . . 51.439999999999998 114.723 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtp -115.78 162.9 16.62 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 106.488 -1.671 . . . . 50.640000000000001 106.488 156.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . -120.85 144.98 17.19 Favored Glycine 0 C--O 1.218 -0.868 0 N-CA-C 112.02 -0.432 . . . . 47.109999999999999 112.02 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 11.9 p -129.04 126.4 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 121.443 0.639 . . . . 45.329999999999998 110.199 172.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -84.44 113.23 21.05 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.85 -0.614 . . . . 47.359999999999999 109.672 -178.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -119.15 145.61 45.84 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 123.889 0.743 . . . . 48.109999999999999 109.821 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -84.21 171.54 12.69 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.496 -0.927 . . . . 52.780000000000001 108.496 173.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -63.65 -40.3 96.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.425 1.268 . . . . 53.619999999999997 114.425 -173.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.47 -45.16 92.42 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.107 0.48 . . . . 47.399999999999999 111.608 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 20.7 m -67.63 -44.84 77.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.535 -0.913 . . . . 47.729999999999997 108.535 -178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 80.5 mtm-85 -54.19 -39.82 67.0 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 119.004 -0.522 . . . . 51.109999999999999 112.161 171.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -59.41 -50.01 75.59 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 123.268 0.355 . . . . 50.049999999999997 110.857 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -62.08 -41.53 98.27 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.104 0.478 . . . . 50.109999999999999 111.619 -178.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 86.9 mt -60.0 -45.96 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 C-N-CA 119.844 -0.742 . . . . 45.899999999999999 111.069 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . . . -65.66 -47.79 74.35 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.337 0.398 . . . . 46.619999999999997 110.864 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.1 p -61.71 -35.78 79.02 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.366 -0.534 . . . . 50.090000000000003 111.691 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.06 -39.02 69.35 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.421 0.526 . . . . 48.539999999999999 112.421 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.82 78.69 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.764 0.826 . . . . 49.969999999999999 112.224 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 40.8 m -69.17 -44.04 73.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.046 -0.525 . . . . 50.560000000000002 109.695 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 41.6 mtt180 -52.11 -41.22 62.29 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.563 0.949 . . . . 58.799999999999997 113.563 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 3.0 pt -97.03 3.93 9.72 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 114.766 1.395 . . . . 50.189999999999998 114.766 -175.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 38.6 t0 66.99 46.32 1.6 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.381 0.61 . . . . 49.119999999999997 109.981 172.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ARG . . . . . 0.518 ' HD2' ' CE2' ' B' ' 31' ' ' TRP . 5.5 mmt85 -139.83 164.78 29.06 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 114.655 -1.157 . . . . 51.670000000000002 109.347 -179.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.8 p -84.18 158.75 60.75 Favored Pre-proline 0 C--N 1.326 -0.436 0 C-N-CA 120.643 -0.423 . . . . 46.710000000000001 110.857 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -53.73 -41.71 72.07 Favored 'Trans proline' 0 N--CA 1.447 -1.219 0 N-CA-C 113.424 0.509 . . . . 45.979999999999997 113.424 169.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -58.01 -51.64 68.83 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 114.019 1.118 . . . . 47.020000000000003 114.019 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' TRP . . . . . 0.518 ' CE2' ' HD2' ' B' ' 27' ' ' ARG . 67.6 t90 -51.65 -47.39 63.78 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.186 0.517 . . . . 46.579999999999998 111.248 170.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.13 -49.16 74.68 Favored 'General case' 0 C--O 1.247 0.954 0 N-CA-C 112.82 0.674 . . . . 47.009999999999998 112.82 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.97 -42.6 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 120.52 -0.472 . . . . 45.609999999999999 112.195 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 15.3 mtpt -60.96 -47.54 85.98 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.975 0.731 . . . . 52.640000000000001 112.975 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLN . . . . . 0.444 ' HG3' ' CH2' ' B' ' 31' ' ' TRP . 28.7 mm100 -60.9 -39.88 90.97 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 112.416 0.524 . . . . 54.759999999999998 112.416 175.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.44 82.86 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.703 -0.48 . . . . 41.469999999999999 109.703 175.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 65.3 mt -64.04 -51.66 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 116.344 -0.389 . . . . 40.880000000000003 111.934 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -55.15 -42.28 72.89 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.1 0.778 . . . . 47.210000000000001 113.1 174.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 26.0 t -66.38 -43.3 86.31 Favored 'General case' 0 C--O 1.203 -1.39 0 C-N-CA 119.586 -0.846 . . . . 43.25 109.693 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -66.83 -40.86 88.11 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 117.935 0.334 . . . . 47.530000000000001 111.154 -177.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.8 -41.12 97.96 Favored 'General case' 0 C--O 1.213 -0.86 0 N-CA-C 113.853 1.057 . . . . 41.909999999999997 113.853 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . . . -57.69 -44.61 85.94 Favored 'General case' 0 C--O 1.207 -1.171 0 O-C-N 123.95 0.781 . . . . 46.189999999999998 110.522 174.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.28 -48.45 78.86 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 112.341 0.497 . . . . 66.640000000000001 112.341 174.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 59.6 mt -65.11 -42.34 94.05 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.185 -0.206 . . . . 50.350000000000001 110.974 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -74.24 -31.87 62.75 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.159 0.8 . . . . 51.649999999999999 113.159 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -83.18 -8.35 59.5 Favored 'General case' 0 C--O 1.21 -1.004 0 N-CA-C 114.646 1.351 . . . . 61.229999999999997 114.646 175.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 28.9 t -75.17 157.94 33.8 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.294 0.497 . . . . 59.210000000000001 112.038 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ASP . . . . . 0.647 ' OD2' ' N ' ' B' ' 48' ' ' ASP . 0.6 OUTLIER . . . . . 0 N--CA 1.469 0.491 0 N-CA-C 114.032 1.123 . . . . 62.520000000000003 114.032 -164.831 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 59.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.517 -1.065 0 O4'-C4'-C3' 102.61 -2.99 . . . . 59.640000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.573 1 P-O3'-C3' 124.875 4.313 . . . . 58.810000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.392 -3.014 0 OP1-P-OP2 123.918 2.879 . . . . 58.399999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.549 2.114 2 O4'-C1'-N19 111.906 5.133 . . . . 49.490000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.395 -1.907 1 O4'-C1'-N19 111.022 4.028 . . . . 50.259999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.409 -1.726 2 P-O3'-C3' 124.972 4.393 . . . . 56.950000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.398 -1.667 1 O4'-C1'-N19 111.867 5.083 . . . . 52.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' ' DC' . . . . . 0.433 " H2'" ' C8 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.391 -3.057 2 O4'-C1'-N19 111.842 5.052 . . . . 52.68 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ' DA' . . . . . 0.433 ' C8 ' " H2'" ' C' ' 11' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.403 -2.161 0 O3'-P-O5' 98.12 -3.095 . . . . 52.969999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.592 -1.243 1 O4'-C1'-N19 112.577 5.972 . . . . 48.020000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.406 -1.886 0 C3'-C2'-C1' 105.564 2.046 . . . . 52.280000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 15' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.404 -1.251 0 P-O5'-C5' 116.363 -2.836 . . . . 55.590000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.908 2 O4'-C1'-N19 104.174 -4.533 . . . . 57.030000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.607 1.402 1 P-O3'-C3' 124.55 4.041 . . . . 56.060000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.408 -1.974 1 O4'-C1'-N19 112.539 5.924 . . . . 55.340000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.403 -2.293 0 O3'-P-O5' 96.487 -3.954 . . . . 55.450000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.583 -1.959 0 O4'-C1'-N19 105.149 -3.314 . . . . 53.920000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.605 1.242 0 O4'-C1'-N19 110.366 3.208 . . . . 51.07 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.194 0 O4'-C4'-C3' 106.821 1.221 . . . . 49.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.546 2.761 0 O4'-C1'-C2' 102.846 -2.958 . . . . 51.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.418 -1.372 1 O4'-C1'-N19 111.675 4.843 . . . . 52.960000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.407 -1.841 1 O4'-C1'-N19 111.43 4.537 . . . . 55.689999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.535 1.685 0 O4'-C1'-N19 104.929 -3.589 . . . . 57.43 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.12 1 O4'-C1'-N19 103.962 -4.798 . . . . 56.420000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.405 -1.989 1 P-O3'-C3' 124.629 4.107 . . . . 54.960000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.395 -1.961 1 O4'-C1'-N19 112.351 5.689 . . . . 50.530000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.342 1 P-O3'-C3' 125.116 4.513 . . . . 48.689999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.948 0 N19-C1'-C2' 118.216 2.51 . . . . 50.909999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 11' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.693 1 O4'-C1'-N19 114.492 8.365 . . . . 56.780000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.432 0 P-O3'-C3' 123.04 2.783 . . . . 53.100000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.41 -1.647 0 O5'-C5'-C4' 111.757 1.112 . . . . 53.590000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.595 -1.002 1 O4'-C1'-N19 113.687 7.359 . . . . 52.780000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.413 -1.349 0 O4'-C4'-C3' 103.579 -2.021 . . . . 54.850000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 16' ' ' ' DC' . . . . . 0.448 " H2'" ' C8 ' ' D' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.404 -2.1 0 C3'-C2'-C1' 106.688 2.849 . . . . 53.880000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ' DG' . . . . . 0.448 ' C8 ' " H2'" ' D' ' 16' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.413 -1.673 0 O4'-C1'-N19 104.83 -3.713 . . . . 56.729999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.855 0 P-O3'-C3' 123.956 3.547 . . . . 61.530000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.448 2 O4'-C1'-N19 112.698 6.122 . . . . 63.600000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 121.129 0.49 . . . . 53.539999999999999 111.928 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 t -142.26 164.24 30.68 Favored 'General case' 0 CA--C 1.508 -0.658 0 C-N-CA 120.053 -0.659 . . . . 50.920000000000002 110.021 171.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 91.9 m -90.13 119.6 30.59 Favored 'General case' 0 N--CA 1.436 -1.138 0 O-C-N 124.274 0.983 . . . . 48.969999999999999 110.263 177.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 96.1 mmm -99.65 121.74 41.66 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 108.878 -0.786 . . . . 59.979999999999997 108.878 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -72.7 150.07 44.21 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-O 121.128 0.293 . . . . 48.979999999999997 113.233 173.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 4.4 p -135.62 124.08 38.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 107.332 -1.359 . . . . 52.609999999999999 107.332 171.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp -74.7 111.9 10.36 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.495 -0.928 . . . . 51.729999999999997 108.495 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 97.8 mt -128.53 130.08 46.94 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 107.373 -1.343 . . . . 47.810000000000002 107.373 -172.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 25.4 p30 -80.26 172.95 13.1 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 117.764 -1.574 . . . . 50.990000000000002 109.405 178.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -65.13 -42.88 93.46 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-N 115.87 -0.605 . . . . 52.479999999999997 112.361 -167.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.2 -42.09 76.63 Favored 'General case' 0 C--O 1.239 0.511 0 N-CA-C 112.727 0.639 . . . . 41.049999999999997 112.727 174.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 90.9 m -69.37 -41.58 76.34 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 120.54 -0.464 . . . . 43.780000000000001 110.109 -177.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 mtm105 -60.94 -37.31 81.91 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 112.755 0.65 . . . . 62.369999999999997 112.755 176.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -71.45 -36.25 71.17 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.894 0.702 . . . . 58.390000000000001 112.894 174.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -59.42 -40.16 85.82 Favored 'General case' 0 C--N 1.316 -0.884 0 C-N-CA 119.784 -0.767 . . . . 53.729999999999997 109.984 173.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 82.0 mt -66.54 -44.25 90.26 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 111.923 0.342 . . . . 46.280000000000001 111.923 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . . . -63.52 -40.97 98.43 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-O 121.118 0.485 . . . . 48.960000000000001 109.845 -176.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 28.2 t -67.73 -47.26 69.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 113.816 -1.538 . . . . 46.799999999999997 111.726 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.81 -40.92 88.24 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 119.566 -0.854 . . . . 44.920000000000002 111.416 178.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -53.97 -46.35 71.64 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.411 0.684 . . . . 46.57 112.823 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 16.4 m -59.22 -49.63 77.11 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 115.528 -0.76 . . . . 46.219999999999999 112.431 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . 0.283 18.5 ptt180 -78.52 -4.56 49.2 Favored 'General case' 0 N--CA 1.438 -1.026 0 N-CA-C 116.068 1.877 . . . . 50.520000000000003 116.068 -176.058 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 21.7 pt -107.99 5.96 9.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 N-CA-C 113.811 1.041 . . . . 47.299999999999997 113.811 166.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.0 t0 61.35 45.74 8.35 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 114.57 1.322 . . . . 53.219999999999999 114.57 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 86.4 mmt-85 -138.19 165.93 25.44 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 107.18 -1.415 . . . . 52.0 107.18 -179.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 72.0 p -80.62 155.89 73.37 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 120.454 -0.498 . . . . 45.359999999999999 110.637 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -50.39 -38.67 53.46 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 120.819 1.013 . . . . 44.219999999999999 113.876 169.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -59.92 -48.88 79.9 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 123.121 0.568 . . . . 42.909999999999997 111.406 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 61.7 t90 -57.46 -42.25 82.17 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-O 121.213 0.53 . . . . 42.950000000000003 110.429 179.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.8 tt -63.52 -45.41 90.77 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 116.195 -0.457 . . . . 42.840000000000003 111.528 -176.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 96.6 mt -61.56 -48.72 87.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 112.881 0.697 . . . . 47.390000000000001 112.881 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -55.22 -53.47 55.6 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.803 0.689 . . . . 59.640000000000001 112.022 174.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.558 ' NE2' ' O ' ' A' ' 55' ' ' HOH . 10.9 tp-100 -57.03 -43.83 82.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.54 0.57 . . . . 49.840000000000003 112.54 177.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -52.52 -41.91 63.88 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 120.932 0.396 . . . . 43.560000000000002 111.752 173.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.0 mt -66.42 -48.16 81.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 CA-C-N 115.386 -0.824 . . . . 44.090000000000003 109.003 -177.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -64.1 -39.35 93.86 Favored 'General case' 0 C--O 1.211 -0.951 0 O-C-N 123.315 0.385 . . . . 46.350000000000001 111.828 -178.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.9 m -69.61 -36.62 76.34 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 120.005 -0.678 . . . . 48.060000000000002 111.082 -179.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -71.63 -38.72 70.73 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.977 -0.556 . . . . 45.909999999999997 110.693 -177.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 73.4 mt -62.25 -39.3 92.42 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.055 0.391 . . . . 42.990000000000002 112.055 172.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . . . -60.96 -46.6 90.05 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 110.728 -0.101 . . . . 44.920000000000002 110.728 173.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -56.62 -45.11 81.7 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.444 0.535 . . . . 54.659999999999997 112.444 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.4 mt -66.18 -45.37 81.1 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.323 0.49 . . . . 50.310000000000002 112.323 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 85.3 mt-10 -77.53 -13.87 59.81 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 113.473 0.916 . . . . 60.390000000000001 113.473 -174.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.789 0 N-CA-C 113.466 0.913 . . . . 58.229999999999997 113.466 178.701 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' THR . . . . . . . . . . . . . 32.6 p . . . . . 0 N--CA 1.5 2.06 0 N-CA-C 112.979 0.733 . . . . 55.310000000000002 112.979 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' THR . . . . . . . . . . . . . 32.8 p -116.9 156.43 27.38 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.723 1.379 . . . . 51.439999999999998 114.723 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' MET . . . . . . . . . . . . . 79.2 mtp -115.78 162.9 16.62 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 106.488 -1.671 . . . . 50.640000000000001 106.488 156.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLY . . . . . . . . . . . . . . . -120.85 144.98 17.19 Favored Glycine 0 C--O 1.218 -0.868 0 N-CA-C 112.02 -0.432 . . . . 47.109999999999999 112.02 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' VAL . . . . . . . . . . . . . 11.9 p -129.04 126.4 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 CA-C-O 121.443 0.639 . . . . 45.329999999999998 110.199 172.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -84.44 113.23 21.05 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.85 -0.614 . . . . 47.359999999999999 109.672 -178.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . 75.8 mt -119.15 145.61 45.84 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 123.889 0.743 . . . . 48.109999999999999 109.821 -177.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -84.21 171.54 12.69 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 108.496 -0.927 . . . . 52.780000000000001 108.496 173.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -63.65 -40.3 96.49 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 114.425 1.268 . . . . 53.619999999999997 114.425 -173.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.47 -45.16 92.42 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.107 0.48 . . . . 47.399999999999999 111.608 178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' THR . . . . . . . . . . . . . 20.7 m -67.63 -44.84 77.04 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 108.535 -0.913 . . . . 47.729999999999997 108.535 -178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ARG . . . . . . . . . . . . . 80.5 mtm-85 -54.19 -39.82 67.0 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 119.004 -0.522 . . . . 51.109999999999999 112.161 171.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -59.41 -50.01 75.59 Favored 'General case' 0 N--CA 1.47 0.569 0 O-C-N 123.268 0.355 . . . . 50.049999999999997 110.857 176.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -62.08 -41.53 98.27 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.104 0.478 . . . . 50.109999999999999 111.619 -178.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 86.9 mt -60.0 -45.96 94.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 C-N-CA 119.844 -0.742 . . . . 45.899999999999999 111.069 179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . . . -65.66 -47.79 74.35 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 123.337 0.398 . . . . 46.619999999999997 110.864 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 10.1 p -61.71 -35.78 79.02 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 120.366 -0.534 . . . . 50.090000000000003 111.691 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.06 -39.02 69.35 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.421 0.526 . . . . 48.539999999999999 112.421 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.72 -34.82 78.69 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.764 0.826 . . . . 49.969999999999999 112.224 179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 40.8 m -69.17 -44.04 73.04 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.046 -0.525 . . . . 50.560000000000002 109.695 179.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 41.6 mtt180 -52.11 -41.22 62.29 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.563 0.949 . . . . 58.799999999999997 113.563 175.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 3.0 pt -97.03 3.93 9.72 Favored 'Isoleucine or valine' 0 C--O 1.24 0.571 0 N-CA-C 114.766 1.395 . . . . 50.189999999999998 114.766 -175.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 38.6 t0 66.99 46.32 1.6 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.381 0.61 . . . . 49.119999999999997 109.981 172.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ARG . . . . . 0.518 ' HD2' ' CE2' ' B' ' 31' ' ' TRP . 5.5 mmt85 -139.83 164.78 29.06 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 114.655 -1.157 . . . . 51.670000000000002 109.347 -179.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 40.8 p -84.18 158.75 60.75 Favored Pre-proline 0 C--N 1.326 -0.436 0 C-N-CA 120.643 -0.423 . . . . 46.710000000000001 110.857 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -53.73 -41.71 72.07 Favored 'Trans proline' 0 N--CA 1.447 -1.219 0 N-CA-C 113.424 0.509 . . . . 45.979999999999997 113.424 169.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -58.01 -51.64 68.83 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 114.019 1.118 . . . . 47.020000000000003 114.019 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' TRP . . . . . 0.518 ' CE2' ' HD2' ' B' ' 27' ' ' ARG . 67.6 t90 -51.65 -47.39 63.78 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.186 0.517 . . . . 46.579999999999998 111.248 170.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . . . . . . . . . 7.1 tt -56.13 -49.16 74.68 Favored 'General case' 0 C--O 1.247 0.954 0 N-CA-C 112.82 0.674 . . . . 47.009999999999998 112.82 179.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.97 -42.6 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 120.52 -0.472 . . . . 45.609999999999999 112.195 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 15.3 mtpt -60.96 -47.54 85.98 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.975 0.731 . . . . 52.640000000000001 112.975 178.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.444 ' HG3' ' CH2' ' B' ' 31' ' ' TRP . 28.7 mm100 -60.9 -39.88 90.97 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 112.416 0.524 . . . . 54.759999999999998 112.416 175.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.02 -44.44 82.86 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 109.703 -0.48 . . . . 41.469999999999999 109.703 175.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 65.3 mt -64.04 -51.66 66.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 116.344 -0.389 . . . . 40.880000000000003 111.934 179.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -55.15 -42.28 72.89 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.1 0.778 . . . . 47.210000000000001 113.1 174.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 26.0 t -66.38 -43.3 86.31 Favored 'General case' 0 C--O 1.203 -1.39 0 C-N-CA 119.586 -0.846 . . . . 43.25 109.693 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -66.83 -40.86 88.11 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 117.935 0.334 . . . . 47.530000000000001 111.154 -177.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 86.6 mt -63.8 -41.12 97.96 Favored 'General case' 0 C--O 1.213 -0.86 0 N-CA-C 113.853 1.057 . . . . 41.909999999999997 113.853 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . . . -57.69 -44.61 85.94 Favored 'General case' 0 C--O 1.207 -1.171 0 O-C-N 123.95 0.781 . . . . 46.189999999999998 110.522 174.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -57.28 -48.45 78.86 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 112.341 0.497 . . . . 66.640000000000001 112.341 174.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 59.6 mt -65.11 -42.34 94.05 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 121.185 -0.206 . . . . 50.350000000000001 110.974 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 74.0 mt-10 -74.24 -31.87 62.75 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.159 0.8 . . . . 51.649999999999999 113.159 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -83.18 -8.35 59.5 Favored 'General case' 0 C--O 1.21 -1.004 0 N-CA-C 114.646 1.351 . . . . 61.229999999999997 114.646 175.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' SER . . . . . . . . . . . . . 28.9 t -75.17 157.94 33.8 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.294 0.497 . . . . 59.210000000000001 112.038 178.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ASP . . . . . 0.647 ' OD2' ' N ' ' B' ' 48' ' ' ASP . 0.6 OUTLIER . . . . . 0 N--CA 1.469 0.491 0 N-CA-C 114.032 1.123 . . . . 62.520000000000003 114.032 -164.831 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 59.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.517 -1.065 0 O4'-C4'-C3' 102.61 -2.99 . . . . 59.640000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.573 1 P-O3'-C3' 124.875 4.313 . . . . 58.810000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.392 -3.014 0 OP1-P-OP2 123.918 2.879 . . . . 58.399999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.549 2.114 2 O4'-C1'-N19 111.906 5.133 . . . . 49.490000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.395 -1.907 1 O4'-C1'-N19 111.022 4.028 . . . . 50.259999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.409 -1.726 2 P-O3'-C3' 124.972 4.393 . . . . 56.950000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.398 -1.667 1 O4'-C1'-N19 111.867 5.083 . . . . 52.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' ' DC' . . . . . 0.433 " H2'" ' C8 ' ' C' ' 12' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.391 -3.057 2 O4'-C1'-N19 111.842 5.052 . . . . 52.68 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ' DA' . . . . . 0.433 ' C8 ' " H2'" ' C' ' 11' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.403 -2.161 0 O3'-P-O5' 98.12 -3.095 . . . . 52.969999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.592 -1.243 1 O4'-C1'-N19 112.577 5.972 . . . . 48.020000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.406 -1.886 0 C3'-C2'-C1' 105.564 2.046 . . . . 52.280000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.404 -1.251 0 P-O5'-C5' 116.363 -2.836 . . . . 55.590000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.908 2 O4'-C1'-N19 104.174 -4.533 . . . . 57.030000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.607 1.402 1 P-O3'-C3' 124.55 4.041 . . . . 56.060000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.408 -1.974 1 O4'-C1'-N19 112.539 5.924 . . . . 55.340000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.403 -2.293 0 O3'-P-O5' 96.487 -3.954 . . . . 55.450000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.583 -1.959 0 O4'-C1'-N19 105.149 -3.314 . . . . 53.920000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.605 1.242 0 O4'-C1'-N19 110.366 3.208 . . . . 51.07 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.194 0 O4'-C4'-C3' 106.821 1.221 . . . . 49.5 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.546 2.761 0 O4'-C1'-C2' 102.846 -2.958 . . . . 51.32 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.418 -1.372 1 O4'-C1'-N19 111.675 4.843 . . . . 52.960000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.407 -1.841 1 O4'-C1'-N19 111.43 4.537 . . . . 55.689999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.535 1.685 0 O4'-C1'-N19 104.929 -3.589 . . . . 57.43 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.614 2.12 1 O4'-C1'-N19 103.962 -4.798 . . . . 56.420000000000002 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.405 -1.989 1 P-O3'-C3' 124.629 4.107 . . . . 54.960000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.395 -1.961 1 O4'-C1'-N19 112.351 5.689 . . . . 50.530000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.342 1 P-O3'-C3' 125.116 4.513 . . . . 48.689999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.948 0 N19-C1'-C2' 118.216 2.51 . . . . 50.909999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.693 1 O4'-C1'-N19 114.492 8.365 . . . . 56.780000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.522 1.432 0 P-O3'-C3' 123.04 2.783 . . . . 53.100000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.41 -1.647 0 O5'-C5'-C4' 111.757 1.112 . . . . 53.590000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.595 -1.002 1 O4'-C1'-N19 113.687 7.359 . . . . 52.780000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.413 -1.349 0 O4'-C4'-C3' 103.579 -2.021 . . . . 54.850000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' ' DC' . . . . . 0.448 " H2'" ' C8 ' ' D' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.404 -2.1 0 C3'-C2'-C1' 106.688 2.849 . . . . 53.880000000000003 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ' DG' . . . . . 0.448 ' C8 ' " H2'" ' D' ' 16' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.413 -1.673 0 O4'-C1'-N19 104.83 -3.713 . . . . 56.729999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.537 1.855 0 P-O3'-C3' 123.956 3.547 . . . . 61.530000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.617 2.448 2 O4'-C1'-N19 112.698 6.122 . . . . 63.600000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' HOH . . . . . 0.558 ' O ' ' NE2' ' A' ' 35' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_