data_1pyi_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 1pyi _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 ' D' D ' 1' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.136 3 O4'-C1'-N19 102.442 -6.698 . . . . 26.53 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ' DC' . . . . . 0.546 ' N4 ' ' O ' ' A' ' 40' ' ' LYS . . . . . . . . 0 O3'--C3' 1.402 -2.2 2 C5'-C4'-C3' 107.112 -5.059 . . . . 32.34 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ' DG' . . . . . 0.532 ' C2 ' ' N2 ' ' E' ' 27' ' ' ' DG' . . . . . . . . 1 O5'--C5' 1.349 -5.711 2 P-O3'-C3' 113.068 -5.526 . . . . 36.77 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.398 -2.526 2 O4'-C1'-N19 113.262 6.828 . . . . 39.15 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.883 3 C5'-C4'-C3' 124.104 6.269 . . . . 44.15 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' ' DA' . . . . . 0.504 ' C2 ' ' C2 ' ' D' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.772 1 P-O3'-C3' 124.531 4.026 . . . . 50.9 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' ' DA' . . . . . 0.504 ' C2 ' ' C2 ' ' D' ' 6' ' ' ' DA' . . . . . . . . 1 O3'--C3' 1.353 -5.98 3 O4'-C1'-N19 101.41 -7.987 . . . . 48.72 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ' DT' . . . . . 0.639 ' N3 ' ' N1 ' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.375 -3.499 4 P-O5'-C5' 103.875 -10.641 . . . . 31.05 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' ' DT' . . . . . 0.578 ' C6 ' " C2'" ' D' ' 8' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.495 -3.324 4 O4'-C4'-C3' 99.284 -6.316 . . . . 21.04 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ' DG' . . . . . 0.61 ' OP2' ' NH1' ' B' ' 38' ' ' ARG . . . . . . . . 1 C5'--C4' 1.543 4.023 3 OP1-P-OP2 110.303 -6.198 . . . . 12.54 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.236 2 P-O3'-C3' 109.255 -8.704 . . . . 21.32 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' ' DC' . . . . . 0.561 ' N3 ' ' N1 ' ' E' ' 17' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.392 -3.025 2 O4'-C1'-N19 103.998 -4.752 . . . . 35.03 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ' DG' . . . . . 0.46 ' N1 ' ' N3 ' ' E' ' 16' ' ' ' DC' . . . . . . . . 1 O3'--C3' 1.534 7.899 4 O4'-C1'-N19 114.835 8.794 . . . . 43.33 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 P--O5' 1.639 4.625 5 O4'-C1'-N19 117.639 12.299 . . . . 46.16 . . . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' ' DT' . . . . . 0.406 ' C4 ' ' N4 ' ' E' ' 16' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.499 -2.925 2 O4'-C1'-N19 101.409 -7.989 . . . . 28.13 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' ' DC' . . . . . 0.46 ' N3 ' ' N1 ' ' D' ' 13' ' ' ' DG' . . . . . . . . 1 O3'--C3' 1.497 5.056 3 O4'-C1'-N19 115.118 9.148 . . . . 37.44 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' ' DG' . . . . . 0.561 ' N1 ' ' N3 ' ' D' ' 12' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.379 -3.805 1 P-O5'-C5' 112.824 -5.048 . . . . 47.11 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' ' DG' . . . . . 0.53 ' C2 ' ' N3 ' ' E' ' 19' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.376 3 O4'-C1'-N19 115.069 9.086 . . . . 49.6 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' ' DC' . . . . . 0.53 ' N3 ' ' C2 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.505 -2.305 0 O4'-C1'-N19 110.797 3.746 . . . . 53.03 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.494 -3.406 2 C5'-C4'-O4' 116.526 4.454 . . . . 56.34 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' ' DA' . . . . . 0.639 ' N1 ' ' N3 ' ' D' ' 8' ' ' ' DT' . . . . . . . . 1 O3'--C3' 1.37 -4.663 2 O4'-C1'-N19 101.283 -8.146 . . . . 54.48 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' ' DT' . . . . . 0.512 " C2'" ' C6 ' ' E' ' 23' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.393 -2.96 2 O4'-C1'-N19 112.59 5.988 . . . . 38.36 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' ' DT' . . . . . 0.512 ' C6 ' " C2'" ' E' ' 22' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.5 -2.755 2 P-O5'-C5' 110.065 -6.772 . . . . 26.58 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' ' DG' . . . . . 0.474 ' C5 ' ' C4 ' ' E' ' 25' ' ' ' DC' . . . . . . . . 2 O5'--C5' 1.366 -4.653 2 O5'-C5'-C4' 102.179 -5.729 . . . . 24.44 . . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' ' DC' . . . . . 0.474 ' C4 ' ' C5 ' ' E' ' 24' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.4 -2.383 2 O5'-C5'-C4' 102.362 -5.599 . . . . 23.25 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' ' DC' . . . . . 0.536 ' C4 ' ' C6 ' ' E' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.507 -2.061 3 P-O3'-C3' 127.808 6.757 . . . . 34.1 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 27' ' ' ' DG' . . . . . 0.536 ' C6 ' ' C4 ' ' E' ' 26' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.377 -3.953 5 O4'-C1'-N19 115.898 10.123 . . . . 43.34 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.394 -2.856 0 N19-C1'-C2' 119.938 3.587 . . . . 48.71 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 114.227 1.195 . . . . 58.46 114.227 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . 0.436 0.0 OUTLIER -94.07 6.17 49.38 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 105.873 -1.899 . . . . 62.99 105.873 170.743 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.13 122.89 48.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 123.733 1.73 . . . . 49.31 108.064 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . 0.283 . . -156.04 120.74 4.64 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 100.417 -3.919 . . . . 32.32 100.417 -179.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' CYS . . . . . 0.483 ' O ' ' N ' ' A' ' 36' ' ' ARG . 1.4 p -57.93 142.43 46.28 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 120.199 3.407 . . . . 30.0 120.199 -174.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 34' ' ' CYS . 24.9 mtpt -37.22 -32.03 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.182 0 N-CA-C 114.028 1.121 . . . . 41.74 114.028 -178.628 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ARG . . . . . 0.483 ' N ' ' O ' ' A' ' 34' ' ' CYS . 7.9 ttt85 -67.34 -77.56 0.07 Allowed 'General case' 0 CA--C 1.503 -0.842 0 CA-C-O 124.729 2.204 . . . . 38.92 108.489 178.585 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' CYS . . . . . 0.483 ' O ' ' N ' ' A' ' 41' ' ' LYS . 86.3 m -34.19 -56.12 0.5 Allowed 'General case' 0 N--CA 1.425 -1.695 0 CA-C-N 109.572 -3.467 . . . . 27.86 114.478 -179.434 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.6 ttm105 -48.68 -50.13 34.62 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.433 1.111 . . . . 31.89 108.527 -179.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.12 -60.85 2.66 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.9 0.857 . . . . 21.66 112.953 -177.452 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . 0.546 ' O ' ' N4 ' ' D' ' 2' ' ' ' DC' 0.251 57.1 mmtt -60.82 -28.15 68.58 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 112.685 -2.052 . . . . 37.66 107.756 178.395 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . 0.483 ' N ' ' O ' ' A' ' 37' ' ' CYS . 24.2 mttt 68.84 54.83 0.46 Allowed 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 112.662 -2.063 . . . . 17.38 109.897 -175.652 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . 0.402 ' CG2' ' CB ' ' A' ' 40' ' ' LYS . 3.2 pt -128.16 167.94 22.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.388 0 CA-C-O 116.313 -1.803 . . . . 22.52 109.851 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.2 pttm -87.08 86.35 7.3 Favored 'General case' 0 N--CA 1.477 0.909 1 N-CA-C 124.111 4.856 . . . . 55.3 124.111 -171.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.7 t -34.03 116.57 0.29 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 120.747 3.61 . . . . 34.06 120.747 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -91.16 68.57 6.04 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 119.746 3.239 . . . . 50.33 119.746 -173.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -19.76 44.16 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.119 3 C-N-CA 135.924 5.69 . . . . 43.39 121.999 -179.484 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -119.59 167.04 12.39 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 116.934 -1.906 . . . . 53.74 110.041 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -121.63 146.98 46.82 Favored Pre-proline 0 C--O 1.233 0.23 0 N-CA-C 109.21 -0.663 . . . . 40.39 109.21 178.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -87.51 22.98 21.52 Favored 'Cis proline' 0 N--CA 1.441 -1.597 0 CA-C-N 119.284 0.78 . . . . 34.41 113.164 4.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -166.81 146.63 5.62 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.263 -0.975 . . . . 33.95 112.787 178.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 15.9 p -82.54 145.73 29.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 105.753 -1.943 . . . . 41.47 105.753 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . 0.803 0.1 OUTLIER -37.15 -56.57 0.91 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 121.131 3.752 . . . . 63.01 121.131 -177.074 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . 0.4 ' NH1' ' CG ' ' A' ' 53' ' ' ARG . 0.0 OUTLIER -59.13 -52.41 65.85 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 116.498 -2.081 . . . . 63.5 113.128 179.663 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' CYS . . . . . . . . . . . . . 1.4 m -42.24 -49.84 4.96 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 124.55 1.14 . . . . 45.7 111.471 -177.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . 0.48 ' O ' ' CA ' ' A' ' 58' ' ' GLU . . . -49.24 -71.89 0.06 Allowed 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 112.139 -2.301 . . . . 44.05 111.038 175.921 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . 0.457 ' O ' ' N ' ' A' ' 58' ' ' GLU . 44.5 mtmt -53.22 -64.01 0.96 Allowed 'General case' 0 CA--C 1.486 -1.516 0 O-C-N 126.312 2.257 . . . . 53.12 107.949 -178.244 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -51.6 -10.74 0.11 Allowed 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 116.124 -1.893 . . . . 46.75 110.474 176.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLU . . . . . 0.48 ' CA ' ' O ' ' A' ' 55' ' ' ALA 0.268 3.8 mt-10 87.19 -10.11 0.59 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 130.172 3.389 . . . . 64.66 119.46 171.088 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . 0.266 3.1 p -75.02 169.74 18.87 Favored Pre-proline 0 C--N 1.307 -1.248 0 N-CA-C 119.662 3.208 . . . . 50.62 119.662 -172.599 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -76.59 126.54 9.02 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.804 3.669 . . . . 46.2 108.748 172.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 3.6 t -94.02 100.94 12.98 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 127.951 2.501 . . . . 37.74 113.164 -178.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.4 p -118.93 127.99 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.97 0 CA-C-N 112.346 -2.207 . . . . 36.89 114.37 -173.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.3 137.0 36.98 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 123.408 1.575 . . . . 31.48 112.697 -178.677 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . 0.435 0.1 OUTLIER -85.81 100.66 12.2 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 114.042 -2.885 . . . . 30.56 106.602 178.479 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -49.52 116.16 5.66 Favored Pre-proline 0 N--CA 1.476 0.866 0 CA-C-N 121.799 2.091 . . . . 30.94 113.618 179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -45.33 -71.46 0.05 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 124.098 3.199 . . . . 26.8 112.975 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -51.14 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.135 0 O-C-N 124.599 1.187 . . . . 17.53 111.175 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 53.8 p -52.15 -19.3 1.88 Allowed 'General case' 0 CA--C 1.479 -1.767 0 N-CA-C 114.293 1.22 . . . . 16.73 114.293 -174.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.61 10.41 67.0 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 124.379 1.049 . . . . 26.63 113.649 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -99.16 168.87 9.78 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 120.418 3.488 . . . . 47.91 120.418 -175.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -71.33 152.08 43.55 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 113.896 -3.121 . . . . 31.33 108.731 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.2 t -149.07 100.37 3.42 Favored Pre-proline 0 C--O 1.221 -0.44 0 C-N-CA 125.424 1.49 . . . . 25.37 109.993 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -59.59 124.38 15.33 Favored 'Trans proline' 0 C--N 1.295 -2.255 0 N-CA-C 107.696 -1.694 . . . . 23.07 107.696 174.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . 0.27 3.0 mtt180 -55.98 -25.96 46.31 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 123.475 1.607 . . . . 31.5 114.982 -176.081 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . 0.647 ' O ' ' N ' ' A' ' 78' ' ' PHE 0.293 11.7 p -71.74 -43.55 65.63 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.873 -1.512 . . . . 32.08 108.953 178.877 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.8 t80 -51.37 -38.76 54.98 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 114.792 -1.094 . . . . 27.61 108.049 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 75.2 t -69.98 -36.73 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 125.678 1.861 . . . . 24.75 108.098 172.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PHE . . . . . 0.647 ' N ' ' O ' ' A' ' 75' ' ' SER . 17.8 t80 -52.64 -56.79 12.95 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.456 -1.298 . . . . 47.96 109.146 -177.606 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . 0.446 ' CD1' ' C ' ' A' ' 79' ' ' PHE . 0.0 OUTLIER -70.47 -38.57 74.44 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-O 124.832 2.253 . . . . 35.44 114.046 -173.781 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.293 6.4 tp -59.53 -29.97 68.27 Favored 'General case' 0 N--CA 1.401 -2.879 0 CA-C-N 112.495 -2.139 . . . . 21.99 106.395 177.197 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -73.25 -34.59 65.93 Favored 'General case' 0 CA--C 1.489 -1.373 0 C-N-CA 112.983 -3.487 . . . . 35.44 109.732 179.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 85' ' ' ALA . 0.0 OUTLIER -59.98 -48.75 80.41 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 124.299 2.0 . . . . 38.19 109.231 -177.894 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.16 -31.2 19.12 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.2 1.556 . . . . 52.66 115.2 177.192 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . 0.281 2.2 mt -68.3 -36.35 79.22 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 102.37 -3.196 . . . . 33.91 102.37 174.739 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . 0.635 ' N ' ' O ' ' A' ' 82' ' ' ASP . . . -56.45 -48.54 76.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-O 123.451 1.596 . . . . 35.45 114.904 -170.799 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.69 -53.08 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.095 0 CA-C-N 110.862 -2.881 . . . . 39.45 107.085 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -32.91 34.76 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-N 111.836 -2.438 . . . . 35.1 113.381 -176.573 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.6 mtp -80.94 -30.61 35.23 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 119.005 -1.078 . . . . 50.55 111.064 -177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.91 -66.17 0.58 Allowed 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 102.131 -3.285 . . . . 67.71 102.131 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.304 25.8 t -36.81 -68.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 116.888 2.181 . . . . 34.21 116.888 -178.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . 0.514 ' CD1' ' CD2' ' B' ' 91' ' ' LEU . 13.9 tp -61.34 -16.17 43.34 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 125.264 1.426 . . . . 36.02 113.407 -175.698 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -84.37 -48.13 10.0 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-N 113.647 -1.615 . . . . 59.15 106.979 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLU . . . . . 0.469 ' O ' ' N ' ' A' ' 95' ' ' GLY . 98.7 mt-10 -47.5 -62.46 1.43 Allowed 'General case' 0 C--N 1.351 0.65 0 O-C-N 126.101 2.126 . . . . 51.62 105.716 174.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -58.69 4.18 0.03 OUTLIER 'General case' 0 CA--C 1.484 -1.566 0 N-CA-C 114.607 1.336 . . . . 50.31 114.607 -177.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . 0.469 ' N ' ' O ' ' A' ' 93' ' ' GLU . . . 90.82 39.91 5.72 Favored Glycine 0 N--CA 1.433 -1.559 0 CA-C-O 115.019 -3.101 . . . . 44.28 116.49 -179.553 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . 0.27 0.1 OUTLIER -136.29 175.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 C-N-CA 128.552 2.741 . . . . 47.13 114.158 176.041 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASP . . . . . 0.583 ' CB ' ' CD ' ' A' ' 98' ' ' PRO . 12.7 p-10 -149.07 -104.55 0.0 OUTLIER Pre-proline 0 N--CA 1.518 2.938 0 C-N-CA 129.112 2.965 . . . . 44.83 116.382 -178.672 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PRO . . . . . 0.583 ' CD ' ' CB ' ' A' ' 97' ' ' ASP 0.277 0.1 OUTLIER -76.03 108.01 2.59 Favored 'Trans proline' 0 C--N 1.405 3.513 2 C-N-CA 135.257 10.638 . . . . 42.9 125.417 166.957 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . 0.509 0.0 OUTLIER -87.04 143.82 27.16 Favored 'General case' 0 CA--C 1.565 1.53 1 N-CA-C 125.171 5.248 . . . . 38.57 125.171 -176.906 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -68.02 141.74 56.12 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 117.855 -3.028 . . . . 40.58 106.684 172.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . 0.489 ' CG2' ' NE ' ' B' ' 83' ' ' ARG 0.608 33.5 pt -117.74 -110.07 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 1 N-CA-C 124.502 5.001 . . . . 30.48 124.502 -175.1 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . 0.445 0.0 OUTLIER 175.72 -67.95 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 128.782 2.833 . . . . 39.08 112.943 -178.237 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLY . . . . . 0.405 ' C ' ' ND2' ' A' ' 104' ' ' ASN . . . -72.05 170.91 49.08 Favored Glycine 0 CA--C 1.549 2.196 0 N-CA-C 103.319 -3.912 . . . . 17.22 103.319 168.791 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASN . . . . . 0.503 ' N ' ' ND2' ' A' ' 104' ' ' ASN . 5.2 p30 -161.6 166.92 26.19 Favored 'General case' 0 CA--C 1.516 -0.362 2 O-C-N 114.998 -4.825 . . . . 19.82 115.2 -179.323 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ILE . . . . . 0.532 ' CG1' ' CD ' ' A' ' 106' ' ' PRO 0.369 0.2 OUTLIER -91.44 -61.91 0.2 Allowed Pre-proline 0 CA--C 1.543 0.694 1 N-CA-C 123.028 4.455 . . . . 33.49 123.028 -169.988 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PRO . . . . . 0.532 ' CD ' ' CG1' ' A' ' 105' ' ' ILE . 37.2 Cg_exo -96.31 158.31 1.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.97 0 N-CA-C 115.031 1.127 . . . . 25.77 115.031 178.496 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.93 6.48 0.1 Allowed 'General case' 0 CA--C 1.517 -0.297 0 O-C-N 120.521 -1.362 . . . . 20.34 110.293 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . 0.457 ' N ' ' C ' ' A' ' 106' ' ' PRO 0.444 1.9 p -116.12 7.79 14.29 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 125.312 1.445 . . . . 17.63 112.681 -177.46 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.5 m -91.01 -171.49 3.01 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 122.8 2.546 . . . . 20.22 104.179 172.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -92.77 168.56 11.11 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 106.068 -1.827 . . . . 37.1 106.068 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASP . . . . . 0.5 ' OD2' ' N ' ' A' ' 111' ' ' ASP . 0.5 OUTLIER -95.86 178.87 5.29 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 119.7 3.222 . . . . 43.14 119.7 -176.686 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.29 158.68 76.48 Favored Pre-proline 0 C--N 1.348 0.522 1 CA-C-O 111.165 -4.255 . . . . 29.72 111.437 178.618 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PRO . . . . . 0.444 ' CB ' ' CD1' ' A' ' 116' ' ' LEU . 14.2 Cg_endo -150.73 112.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.405 3.511 1 C-N-CA 130.224 7.283 . . . . 37.04 114.382 163.841 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -26.77 136.84 0.02 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 128.092 2.557 . . . . 53.07 113.66 -174.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . 0.411 2.6 t0 72.69 -76.73 0.06 Allowed 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 115.639 1.718 . . . . 56.25 115.639 -176.691 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . 0.444 ' CD1' ' CB ' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -67.05 -11.55 57.4 Favored 'General case' 0 CA--C 1.542 0.662 2 N-CA-C 133.323 8.268 . . . . 51.72 133.323 -162.794 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . 0.26 1.1 tppt? . . . . . 0 N--CA 1.486 1.367 1 CA-C-N 128.384 5.083 . . . . 51.63 112.952 -176.023 . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . 0.536 92.5 p . . . . . 0 CA--C 1.566 1.579 0 N-CA-C 119.989 3.329 . . . . 44.87 119.989 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.421 1.7 tpp180 -66.61 -31.65 72.47 Favored 'General case' 0 C--O 1.209 -1.034 0 O-C-N 120.166 -1.584 . . . . 52.1 114.591 -176.744 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' THR . . . . . 0.62 ' N ' ' OE1' ' B' ' 46' ' ' GLN 0.329 0.9 OUTLIER -164.37 112.38 1.11 Allowed 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 122.869 1.318 . . . . 28.04 113.863 176.142 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -94.13 141.36 28.64 Favored 'General case' 0 N--CA 1.407 -2.589 0 CA-C-N 111.418 -2.628 . . . . 19.11 110.062 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . 0.3 27.9 p -63.09 171.38 2.3 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 128.037 2.535 . . . . 18.22 117.617 -174.277 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' LYS . . . . . 0.411 ' O ' ' C ' ' B' ' 36' ' ' ARG . 29.2 tttt -52.64 -80.04 0.01 OUTLIER 'General case' 0 CA--C 1.471 -2.081 0 N-CA-C 104.031 -2.581 . . . . 18.44 104.031 178.182 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ARG . . . . . 0.411 ' C ' ' O ' ' B' ' 35' ' ' LYS 0.679 0.0 OUTLIER -35.86 -68.61 0.12 Allowed 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 117.075 2.25 . . . . 16.46 117.075 175.464 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' CYS . . . . . 0.405 ' C ' ' O ' ' B' ' 36' ' ' ARG 0.373 0.0 OUTLIER -53.02 -40.78 64.13 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-N 124.377 3.262 . . . . 17.95 118.255 178.446 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ARG . . . . . 0.61 ' NH1' ' OP2' ' D' ' 10' ' ' ' DG' 0.298 6.9 ttp-105 -61.23 -39.98 92.3 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 124.003 1.859 . . . . 34.61 110.81 -176.564 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 37.4 mt -76.24 -32.57 58.97 Favored 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 114.286 -2.966 . . . . 10.01 110.359 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -70.75 -15.37 62.68 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 124.415 2.055 . . . . 21.64 110.055 179.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 43.4 mttt 60.96 51.75 4.43 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.872 -1.513 . . . . 17.53 111.238 -178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 39.3 pt -145.72 151.67 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 N-CA-C 113.608 0.966 . . . . 10.08 113.608 -172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LYS . . . . . 0.575 ' O ' ' NH2' ' B' ' 53' ' ' ARG . 0.4 OUTLIER -57.31 129.8 43.4 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 119.668 3.21 . . . . 23.4 119.668 -168.618 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' B' ' 46' ' ' GLN 0.296 47.3 t -105.78 108.95 20.74 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 118.12 2.637 . . . . 24.16 118.12 -179.424 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -58.99 8.13 0.02 OUTLIER 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.626 2.454 . . . . 31.59 117.626 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLN . . . . . 0.62 ' OE1' ' N ' ' B' ' 32' ' ' THR . 0.0 OUTLIER 41.45 64.5 1.02 Allowed 'General case' 0 C--N 1.306 -1.287 1 N-CA-C 122.521 4.267 . . . . 53.03 122.521 172.678 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . 0.357 7.0 mm-40 -124.09 148.47 47.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.669 1.729 . . . . 40.53 115.669 177.087 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -97.3 128.09 36.11 Favored Pre-proline 0 N--CA 1.427 -1.619 0 CA-C-N 112.381 -2.19 . . . . 23.87 116.281 -177.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -102.83 20.9 15.6 Favored 'Cis proline' 0 N--CA 1.422 -2.691 0 N-CA-C 118.026 2.279 . . . . 19.15 118.026 5.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 29.9 m -169.47 111.25 0.47 Allowed 'General case' 0 C--N 1.305 -1.355 1 N-CA-C 99.765 -4.161 . . . . 21.45 99.765 -179.809 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 14.7 p -49.62 139.04 13.17 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 114.219 1.192 . . . . 32.26 114.219 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -38.79 -43.45 0.92 Allowed 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 117.055 2.243 . . . . 51.1 117.055 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ARG . . . . . 0.575 ' NH2' ' O ' ' B' ' 43' ' ' LYS . 21.7 ttm-85 -52.19 -60.52 3.11 Favored 'General case' 0 N--CA 1.426 -1.629 0 C-N-CA 116.544 -2.062 . . . . 35.87 109.424 -178.151 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' CYS . . . . . . . . . . . . . 9.4 m -60.12 -28.61 68.01 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 115.299 1.592 . . . . 27.98 115.299 174.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.94 -55.57 16.16 Favored 'General case' 0 CA--C 1.484 -1.56 0 O-C-N 120.596 -1.315 . . . . 31.72 107.808 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -43.55 -66.01 0.43 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 125.87 2.748 . . . . 48.92 107.482 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LEU . . . . . 0.455 ' O ' ' CB ' ' B' ' 58' ' ' GLU 0.362 1.2 tt -66.58 -9.89 39.87 Favored 'General case' 0 C--N 1.272 -2.797 0 O-C-N 118.432 -2.667 . . . . 25.82 114.952 -178.929 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' GLU . . . . . 0.455 ' CB ' ' O ' ' B' ' 57' ' ' LEU 0.25 42.4 mt-10 64.77 35.08 8.95 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 117.319 2.341 . . . . 52.09 117.319 -177.338 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.261 8.0 p -106.05 128.58 26.1 Favored Pre-proline 0 N--CA 1.438 -1.033 0 N-CA-C 101.583 -3.488 . . . . 21.4 101.583 175.733 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' PRO . . . . . . . . . . . . 0.274 31.8 Cg_endo -50.26 142.73 28.1 Favored 'Trans proline' 0 CA--C 1.467 -2.826 0 CA-C-O 114.928 -2.197 . . . . 9.58 107.291 -169.338 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' CYS . . . . . . . . . . . . 0.454 0.0 OUTLIER -109.21 117.94 35.43 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 113.741 -3.184 . . . . 16.31 111.981 179.866 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 m -130.64 160.13 42.08 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.786 0 CA-C-O 123.746 1.736 . . . . 7.56 115.135 -176.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' SER . . . . . 0.41 ' N ' ' O ' ' B' ' 72' ' ' VAL . 5.6 t -92.22 -179.42 5.24 Favored 'General case' 0 N--CA 1.411 -2.417 0 C-N-CA 115.325 -2.55 . . . . 19.54 111.09 179.699 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 16.7 tp -137.93 127.88 25.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 C-N-CA 116.519 -2.072 . . . . 27.38 112.004 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.19 105.32 1.69 Allowed Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 127.413 2.285 . . . . 37.29 113.029 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -60.95 -37.28 78.21 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.055 2.504 . . . . 41.18 113.235 -173.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.11 -56.61 9.27 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.793 -1.094 . . . . 41.87 113.604 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 3.8 p -81.41 -33.37 32.26 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.776 1.398 . . . . 41.19 114.776 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.94 -2.35 87.66 Favored Glycine 0 CA--C 1.542 1.773 0 O-C-N 125.542 1.776 . . . . 37.72 112.718 -173.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' LYS . . . . . 0.47 ' CD ' ' N ' ' B' ' 71' ' ' ASP . 0.0 OUTLIER -73.86 153.38 39.91 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 124.951 1.3 . . . . 50.56 114.304 -176.363 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASP . . . . . 0.47 ' N ' ' CD ' ' B' ' 70' ' ' LYS 0.253 93.6 m-20 -72.65 156.87 38.52 Favored 'General case' 0 CA--C 1.478 -1.825 0 CA-C-O 112.398 -3.668 . . . . 22.02 107.184 179.207 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' VAL . . . . . 0.41 ' O ' ' N ' ' B' ' 63' ' ' SER 0.325 0.9 OUTLIER -169.64 142.18 2.02 Favored Pre-proline 0 N--CA 1.487 1.41 0 CA-C-N 122.018 2.19 . . . . 6.24 110.9 -174.72 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' PRO . . . . . 0.436 ' O ' ' CD ' ' B' ' 73' ' ' PRO . 55.8 Cg_endo -70.03 139.62 39.73 Favored 'Trans proline' 0 N--CA 1.409 -3.449 1 C-N-CA 126.394 4.73 . . . . 4.51 113.359 -161.727 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ARG . . . . . 0.588 ' NH2' ' O ' ' B' ' 32' ' ' THR . 0.5 OUTLIER -45.65 -26.99 0.7 Allowed 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 128.035 3.334 . . . . 4.8 108.312 177.445 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . 0.513 42.9 t -151.14 102.3 2.93 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 119.498 3.147 . . . . 18.24 119.498 176.082 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' TYR . . . . . 0.462 ' O ' ' N ' ' B' ' 79' ' ' PHE . 0.8 OUTLIER -40.11 -66.85 0.27 Allowed 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 115.176 1.547 . . . . 17.75 115.176 175.732 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.35 -39.76 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.162 0 C-N-CA 115.304 -2.558 . . . . 13.0 110.613 -177.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -58.74 -27.82 65.28 Favored 'General case' 0 N--CA 1.407 -2.587 1 C-N-CA 110.164 -4.615 . . . . 18.11 110.865 177.418 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PHE . . . . . 0.584 ' CD1' ' CD2' ' B' ' 80' ' ' LEU . 0.2 OUTLIER -80.82 -28.74 36.09 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 126.111 2.863 . . . . 13.62 110.889 -177.031 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . 0.584 ' CD2' ' CD1' ' B' ' 79' ' ' PHE . 6.8 mt -74.22 -57.41 3.97 Favored 'General case' 0 N--CA 1.397 -3.086 0 C-N-CA 112.982 -3.487 . . . . 11.22 107.54 -177.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' B' ' 80' ' ' LEU . 68.0 mt-10 -45.61 -33.03 2.61 Favored 'General case' 0 N--CA 1.427 -1.575 0 CA-C-N 115.175 -0.921 . . . . 27.44 110.273 179.652 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -76.03 -41.72 50.02 Favored 'General case' 0 CA--C 1.49 -1.343 0 C-N-CA 118.423 -1.311 . . . . 24.08 112.039 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ARG . . . . . 0.489 ' NE ' ' CG2' ' A' ' 101' ' ' ILE . 0.0 OUTLIER -58.51 -59.63 5.08 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 113.944 -1.48 . . . . 43.06 111.551 -177.674 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . 0.375 8.0 mt -52.54 -34.55 50.54 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 119.469 -0.892 . . . . 29.21 111.297 -179.592 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.67 -56.85 16.54 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 114.762 -2.775 . . . . 30.84 110.134 -174.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 78.2 t -56.78 -42.91 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 113.546 -1.661 . . . . 28.13 111.412 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' MET . . . . . . . . . . . . . 3.6 mmt -53.38 -48.81 68.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.918 1.342 . . . . 32.69 107.476 174.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.3 mtm -59.44 -51.76 68.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.112 -1.617 . . . . 38.27 113.819 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -53.63 -41.06 66.32 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 117.846 -1.541 . . . . 39.03 111.81 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 35.5 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 C-N-CA 117.023 -1.871 . . . . 22.0 108.068 -178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' LEU . . . . . 0.514 ' CD2' ' CD1' ' A' ' 91' ' ' LEU 0.272 20.7 mt -54.18 -46.52 72.38 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 116.155 -2.218 . . . . 27.67 111.543 -179.503 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' B' ' 95' ' ' GLY 0.411 18.7 mttp -49.46 -60.44 2.84 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.283 -0.865 . . . . 31.82 110.149 176.712 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.84 -7.44 0.05 Allowed 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 119.471 -2.018 . . . . 35.31 116.141 175.135 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' TYR . . . . . 0.468 ' N ' ' O ' ' B' ' 92' ' ' LYS . 6.7 m-85 -109.77 8.21 24.51 Favored 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 118.597 -1.241 . . . . 27.21 108.552 177.395 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLY . . . . . 0.547 ' N ' ' O ' ' B' ' 92' ' ' LYS . . . 99.97 -18.53 55.66 Favored Glycine 0 CA--C 1.545 1.963 0 N-CA-C 122.025 3.57 . . . . 36.32 122.025 176.884 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . 0.452 2.5 p -81.44 -144.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.44 1 N-CA-C 122.791 4.367 . . . . 40.02 122.791 -170.796 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ASP . . . . . 0.497 ' CB ' ' CD ' ' B' ' 98' ' ' PRO . 0.1 OUTLIER -168.97 -139.82 0.0 OUTLIER Pre-proline 0 C--O 1.246 0.875 0 N-CA-C 118.158 2.651 . . . . 51.24 118.158 -177.897 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' PRO . . . . . 0.497 ' CD ' ' CB ' ' B' ' 97' ' ' ASP . 18.0 Cg_exo -85.02 79.27 2.4 Favored 'Trans proline' 1 C--O 1.312 4.195 1 C-N-CA 130.595 7.53 . . . . 60.08 108.681 167.109 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' THR . . . . . . . . . . . . 0.671 8.5 p . . . . . 0 N--CA 1.516 2.866 1 N-CA-C 125.575 5.398 . . . . 63.66 125.575 -172.323 . . . . . . . . 2 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 321' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 322' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' ' DT' . . . . . 0.973 HO5' ' H6 ' ' D' ' 1' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.136 3 O4'-C1'-N19 102.442 -6.698 . . . . 26.53 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ' DC' . . . . . 0.743 H2'' ' C8 ' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.402 -2.2 2 C5'-C4'-C3' 107.112 -5.059 . . . . 32.34 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ' DG' . . . . . 0.743 ' C8 ' H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 1 O5'--C5' 1.349 -5.711 2 P-O3'-C3' 113.068 -5.526 . . . . 36.77 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 4' ' ' ' DG' . . . . . 0.699 H2'' ' C6 ' ' D' ' 5' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.398 -2.526 2 O4'-C1'-N19 113.262 6.828 . . . . 39.15 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ' DC' . . . . . 0.699 ' C6 ' H2'' ' D' ' 4' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.534 2.883 3 C5'-C4'-C3' 124.104 6.269 . . . . 44.15 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' ' DA' . . . . . 0.504 ' C2 ' ' C2 ' ' D' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.772 1 P-O3'-C3' 124.531 4.026 . . . . 50.9 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 7' ' ' ' DA' . . . . . 0.523 H2'' " O5'" ' D' ' 8' ' ' ' DT' . . . . . . . . 1 O3'--C3' 1.353 -5.98 3 O4'-C1'-N19 101.41 -7.987 . . . . 48.72 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ' DT' . . . . . 0.663 " H2'" ' C5 ' ' D' ' 9' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.375 -3.499 4 P-O5'-C5' 103.875 -10.641 . . . . 31.05 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 9' ' ' ' DT' . . . . . 0.663 ' C5 ' " H2'" ' D' ' 8' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.495 -3.324 4 O4'-C4'-C3' 99.284 -6.316 . . . . 21.04 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ' DG' . . . . . 0.594 ' OP2' ' NH1' ' B' ' 38' ' ' ARG . . . . . . . . 1 C5'--C4' 1.543 4.023 3 OP1-P-OP2 110.303 -6.198 . . . . 12.54 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 11' ' ' ' DC' . . . . . 0.511 " O5'" H2'' ' D' ' 10' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.236 2 P-O3'-C3' 109.255 -8.704 . . . . 21.32 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.392 -3.025 2 O4'-C1'-N19 103.998 -4.752 . . . . 35.03 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 O3'--C3' 1.534 7.899 4 O4'-C1'-N19 114.835 8.794 . . . . 43.33 . . . . . . . . . . 2 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ' DA' . . . . . 0.491 ' OP2' " H2'" ' D' ' 14' ' ' ' DA' . . . . . . . . 1 P--O5' 1.639 4.625 5 O4'-C1'-N19 117.639 12.299 . . . . 46.16 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' E' E ' 15' ' ' ' DT' . . . . . 0.532 H2'' " C5'" ' E' ' 16' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.499 -2.925 2 O4'-C1'-N19 101.409 -7.989 . . . . 28.13 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 16' ' ' ' DC' . . . . . 0.771 ' C6 ' " H5'" ' E' ' 16' ' ' ' DC' . . . . . . . . 1 O3'--C3' 1.497 5.056 3 O4'-C1'-N19 115.118 9.148 . . . . 37.44 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' E' E ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.379 -3.805 1 P-O5'-C5' 112.824 -5.048 . . . . 47.11 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 18' ' ' ' DG' . . . . . 0.53 ' C2 ' ' N3 ' ' E' ' 19' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.376 3 O4'-C1'-N19 115.069 9.086 . . . . 49.6 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 19' ' ' ' DC' . . . . . 0.53 ' N3 ' ' C2 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.505 -2.305 0 O4'-C1'-N19 110.797 3.746 . . . . 53.03 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 20' ' ' ' DA' . . . . . 0.574 H2'' " O5'" ' E' ' 21' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.494 -3.406 2 C5'-C4'-O4' 116.526 4.454 . . . . 56.34 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 21' ' ' ' DA' . . . . . 0.934 H2'' H5'' ' E' ' 22' ' ' ' DT' . . . . . . . . 1 O3'--C3' 1.37 -4.663 2 O4'-C1'-N19 101.283 -8.146 . . . . 54.48 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' E' E ' 22' ' ' ' DT' . . . . . 0.934 H5'' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.393 -2.96 2 O4'-C1'-N19 112.59 5.988 . . . . 38.36 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 23' ' ' ' DT' . . . . . 0.787 " H2'" ' C8 ' ' E' ' 24' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.5 -2.755 2 P-O5'-C5' 110.065 -6.772 . . . . 26.58 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 24' ' ' ' DG' . . . . . 0.787 ' C8 ' " H2'" ' E' ' 23' ' ' ' DT' . . . . . . . . 2 O5'--C5' 1.366 -4.653 2 O5'-C5'-C4' 102.179 -5.729 . . . . 24.44 . . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' E' E ' 25' ' ' ' DC' . . . . . 0.872 " H3'" ' HB3' ' A' ' 43' ' ' LYS . . . . . . . . 0 O3'--C3' 1.4 -2.383 2 O5'-C5'-C4' 102.362 -5.599 . . . . 23.25 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 26' ' ' ' DC' . . . . . 0.788 H2'' " C5'" ' E' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.507 -2.061 3 P-O3'-C3' 127.808 6.757 . . . . 34.1 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 27' ' ' ' DG' . . . . . 0.788 " C5'" H2'' ' E' ' 26' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.377 -3.953 5 O4'-C1'-N19 115.898 10.123 . . . . 43.34 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.394 -2.856 0 N19-C1'-C2' 119.938 3.587 . . . . 48.71 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 114.227 1.195 . . . . 58.46 114.227 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.598 HH12 ' HD2' ' B' ' 31' ' ' ARG 0.436 0.0 OUTLIER -94.07 6.17 49.38 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 105.873 -1.899 . . . . 62.99 105.873 170.743 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.13 122.89 48.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 123.733 1.73 . . . . 49.31 108.064 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . 0.283 . . -156.04 120.74 4.64 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 100.417 -3.919 . . . . 32.32 100.417 -179.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' CYS . . . . . 0.483 ' O ' ' N ' ' A' ' 36' ' ' ARG . 1.4 p -57.93 142.43 46.28 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 120.199 3.407 . . . . 30.0 120.199 -174.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 34' ' ' CYS . 24.9 mtpt -37.22 -32.03 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.182 0 N-CA-C 114.028 1.121 . . . . 41.74 114.028 -178.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ARG . . . . . 0.483 ' N ' ' O ' ' A' ' 34' ' ' CYS . 7.9 ttt85 -67.34 -77.56 0.07 Allowed 'General case' 0 CA--C 1.503 -0.842 0 CA-C-O 124.729 2.204 . . . . 38.92 108.489 178.585 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' CYS . . . . . 0.457 ' O ' ' N ' ' A' ' 41' ' ' LYS . 86.3 m -34.19 -56.12 0.5 Allowed 'General case' 0 N--CA 1.425 -1.695 0 CA-C-N 109.572 -3.467 . . . . 27.86 114.478 -179.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 38' ' ' ARG . 2.6 ttm105 -48.68 -50.13 34.62 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.433 1.111 . . . . 31.89 108.527 -179.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -51.12 -60.85 2.66 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.9 0.857 . . . . 21.66 112.953 -177.452 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . 0.633 ' CB ' HG23 ' A' ' 42' ' ' ILE 0.251 57.1 mmtt -60.82 -28.15 68.58 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 112.685 -2.052 . . . . 37.66 107.756 178.395 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 24.2 mttt 68.84 54.83 0.46 Allowed 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 112.662 -2.063 . . . . 17.38 109.897 -175.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . 0.633 HG23 ' CB ' ' A' ' 40' ' ' LYS . 3.2 pt -128.16 167.94 22.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.388 0 CA-C-O 116.313 -1.803 . . . . 22.52 109.851 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . 0.872 ' HB3' " H3'" ' E' ' 25' ' ' ' DC' . 15.2 pttm -87.08 86.35 7.3 Favored 'General case' 0 N--CA 1.477 0.909 1 N-CA-C 124.111 4.856 . . . . 55.3 124.111 -171.129 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.7 t -34.03 116.57 0.29 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 120.747 3.61 . . . . 34.06 120.747 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HB2' ' H ' ' A' ' 52' ' ' LYS . 62.2 m-20 -91.16 68.57 6.04 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 119.746 3.239 . . . . 50.33 119.746 -173.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 33.8 tp60 -19.76 44.16 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.119 3 C-N-CA 135.924 5.69 . . . . 43.39 121.999 -179.484 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -119.59 167.04 12.39 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 116.934 -1.906 . . . . 53.74 110.041 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -121.63 146.98 46.82 Favored Pre-proline 0 C--O 1.233 0.23 0 N-CA-C 109.21 -0.663 . . . . 40.39 109.21 178.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -87.51 22.98 21.52 Favored 'Cis proline' 0 N--CA 1.441 -1.597 0 CA-C-N 119.284 0.78 . . . . 34.41 113.164 4.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -166.81 146.63 5.62 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.263 -0.975 . . . . 33.95 112.787 178.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 15.9 p -82.54 145.73 29.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 105.753 -1.943 . . . . 41.47 105.753 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . 0.402 ' H ' ' HB2' ' A' ' 45' ' ' ASP 0.803 0.1 OUTLIER -37.15 -56.57 0.91 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 121.131 3.752 . . . . 63.01 121.131 -177.074 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . 0.446 ' CG ' HH11 ' A' ' 53' ' ' ARG . 0.0 OUTLIER -59.13 -52.41 65.85 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 116.498 -2.081 . . . . 63.5 113.128 179.663 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' CYS . . . . . 0.523 ' HA ' HG12 ' A' ' 59' ' ' VAL . 1.4 m -42.24 -49.84 4.96 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 124.55 1.14 . . . . 45.7 111.471 -177.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . 0.785 ' O ' ' HA ' ' A' ' 58' ' ' GLU . . . -49.24 -71.89 0.06 Allowed 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 112.139 -2.301 . . . . 44.05 111.038 175.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . 0.457 ' O ' ' N ' ' A' ' 58' ' ' GLU . 44.5 mtmt -53.22 -64.01 0.96 Allowed 'General case' 0 CA--C 1.486 -1.516 0 O-C-N 126.312 2.257 . . . . 53.12 107.949 -178.244 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -51.6 -10.74 0.11 Allowed 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 116.124 -1.893 . . . . 46.75 110.474 176.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLU . . . . . 0.785 ' HA ' ' O ' ' A' ' 55' ' ' ALA 0.268 3.8 mt-10 87.19 -10.11 0.59 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 130.172 3.389 . . . . 64.66 119.46 171.088 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . 0.731 HG22 ' HD2' ' A' ' 60' ' ' PRO 0.266 3.1 p -75.02 169.74 18.87 Favored Pre-proline 0 C--N 1.307 -1.248 0 N-CA-C 119.662 3.208 . . . . 50.62 119.662 -172.599 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PRO . . . . . 0.731 ' HD2' HG22 ' A' ' 59' ' ' VAL . 14.6 Cg_endo -76.59 126.54 9.02 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.804 3.669 . . . . 46.2 108.748 172.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . 0.64 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 3.6 t -94.02 100.94 12.98 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 127.951 2.501 . . . . 37.74 113.164 -178.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . 0.882 HG23 ' HD3' ' A' ' 73' ' ' PRO . 10.4 p -118.93 127.99 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.97 0 CA-C-N 112.346 -2.207 . . . . 36.89 114.37 -173.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.3 137.0 36.98 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 123.408 1.575 . . . . 31.48 112.697 -178.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . 0.542 HD11 ' NH2' ' B' ' 31' ' ' ARG 0.435 0.1 OUTLIER -85.81 100.66 12.2 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 114.042 -2.885 . . . . 30.56 106.602 178.479 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 14.7 t0 -49.52 116.16 5.66 Favored Pre-proline 0 N--CA 1.476 0.866 0 CA-C-N 121.799 2.091 . . . . 30.94 113.618 179.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . 0.515 ' HD2' ' OD1' ' A' ' 65' ' ' ASP . 71.6 Cg_endo -45.33 -71.46 0.05 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 124.098 3.199 . . . . 26.8 112.975 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -51.14 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.135 0 O-C-N 124.599 1.187 . . . . 17.53 111.175 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 53.8 p -52.15 -19.3 1.88 Allowed 'General case' 0 CA--C 1.479 -1.767 0 N-CA-C 114.293 1.22 . . . . 16.73 114.293 -174.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.61 10.41 67.0 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 124.379 1.049 . . . . 26.63 113.649 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -99.16 168.87 9.78 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 120.418 3.488 . . . . 47.91 120.418 -175.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -71.33 152.08 43.55 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 113.896 -3.121 . . . . 31.33 108.731 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.2 t -149.07 100.37 3.42 Favored Pre-proline 0 C--O 1.221 -0.44 0 C-N-CA 125.424 1.49 . . . . 25.37 109.993 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PRO . . . . . 0.882 ' HD3' HG23 ' A' ' 62' ' ' VAL . 20.1 Cg_exo -59.59 124.38 15.33 Favored 'Trans proline' 0 C--N 1.295 -2.255 0 N-CA-C 107.696 -1.694 . . . . 23.07 107.696 174.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 61' ' ' CYS 0.27 3.0 mtt180 -55.98 -25.96 46.31 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 123.475 1.607 . . . . 31.5 114.982 -176.081 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . 0.647 ' O ' ' N ' ' A' ' 78' ' ' PHE 0.293 11.7 p -71.74 -43.55 65.63 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.873 -1.512 . . . . 32.08 108.953 178.877 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 12.8 t80 -51.37 -38.76 54.98 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 114.792 -1.094 . . . . 27.61 108.049 -179.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . 0.665 ' O ' ' HG3' ' A' ' 81' ' ' GLU . 75.2 t -69.98 -36.73 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 125.678 1.861 . . . . 24.75 108.098 172.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PHE . . . . . 0.647 ' N ' ' O ' ' A' ' 75' ' ' SER . 17.8 t80 -52.64 -56.79 12.95 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.456 -1.298 . . . . 47.96 109.146 -177.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . 0.446 ' CD1' ' C ' ' A' ' 79' ' ' PHE . 0.0 OUTLIER -70.47 -38.57 74.44 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-O 124.832 2.253 . . . . 35.44 114.046 -173.781 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 0.673 ' HB2' ' O ' ' A' ' 76' ' ' TYR 0.293 6.4 tp -59.53 -29.97 68.27 Favored 'General case' 0 N--CA 1.401 -2.879 0 CA-C-N 112.495 -2.139 . . . . 21.99 106.395 177.197 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . 0.665 ' HG3' ' O ' ' A' ' 77' ' ' VAL . 34.4 mt-10 -73.25 -34.59 65.93 Favored 'General case' 0 CA--C 1.489 -1.373 0 C-N-CA 112.983 -3.487 . . . . 35.44 109.732 179.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 85' ' ' ALA . 0.0 OUTLIER -59.98 -48.75 80.41 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 124.299 2.0 . . . . 38.19 109.231 -177.894 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ARG . . . . . 0.775 ' HG2' HH11 ' A' ' 83' ' ' ARG . 0.1 OUTLIER -51.16 -31.2 19.12 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.2 1.556 . . . . 52.66 115.2 177.192 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . 0.738 HD23 HD23 ' B' ' 84' ' ' LEU 0.281 2.2 mt -68.3 -36.35 79.22 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 102.37 -3.196 . . . . 33.91 102.37 174.739 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . 0.635 ' N ' ' O ' ' A' ' 82' ' ' ASP . . . -56.45 -48.54 76.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-O 123.451 1.596 . . . . 35.45 114.904 -170.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.69 -53.08 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.095 0 CA-C-N 110.862 -2.881 . . . . 39.45 107.085 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -32.91 34.76 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-N 111.836 -2.438 . . . . 35.1 113.381 -176.573 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' MET . . . . . 0.746 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.6 mtp -80.94 -30.61 35.23 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 119.005 -1.078 . . . . 50.55 111.064 -177.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.91 -66.17 0.58 Allowed 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 102.131 -3.285 . . . . 67.71 102.131 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . 0.719 HG21 ' OG1' ' B' ' 99' ' ' THR 0.304 25.8 t -36.81 -68.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 116.888 2.181 . . . . 34.21 116.888 -178.974 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . 0.786 HD11 HG12 ' B' ' 90' ' ' VAL . 13.9 tp -61.34 -16.17 43.34 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 125.264 1.426 . . . . 36.02 113.407 -175.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . 0.838 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 13.3 tttt -84.37 -48.13 10.0 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-N 113.647 -1.615 . . . . 59.15 106.979 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLU . . . . . 0.477 ' C ' ' H ' ' A' ' 95' ' ' GLY . 98.7 mt-10 -47.5 -62.46 1.43 Allowed 'General case' 0 C--N 1.351 0.65 0 O-C-N 126.101 2.126 . . . . 51.62 105.716 174.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' TYR . . . . . 0.574 ' CD2' ' HB3' ' B' ' 94' ' ' TYR . 2.6 m-85 -58.69 4.18 0.03 OUTLIER 'General case' 0 CA--C 1.484 -1.566 0 N-CA-C 114.607 1.336 . . . . 50.31 114.607 -177.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . 0.477 ' H ' ' C ' ' A' ' 93' ' ' GLU . . . 90.82 39.91 5.72 Favored Glycine 0 N--CA 1.433 -1.559 0 CA-C-O 115.019 -3.101 . . . . 44.28 116.49 -179.553 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . 0.838 ' O ' ' HA ' ' A' ' 92' ' ' LYS 0.27 0.1 OUTLIER -136.29 175.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 C-N-CA 128.552 2.741 . . . . 47.13 114.158 176.041 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASP . . . . . 1.049 ' HB2' ' HD2' ' A' ' 98' ' ' PRO . 12.7 p-10 -149.07 -104.55 0.0 OUTLIER Pre-proline 0 N--CA 1.518 2.938 0 C-N-CA 129.112 2.965 . . . . 44.83 116.382 -178.672 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PRO . . . . . 1.049 ' HD2' ' HB2' ' A' ' 97' ' ' ASP 0.277 0.1 OUTLIER -76.03 108.01 2.59 Favored 'Trans proline' 0 C--N 1.405 3.513 2 C-N-CA 135.257 10.638 . . . . 42.9 125.417 166.957 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . 0.509 0.0 OUTLIER -87.04 143.82 27.16 Favored 'General case' 0 CA--C 1.565 1.53 1 N-CA-C 125.171 5.248 . . . . 38.57 125.171 -176.906 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -68.02 141.74 56.12 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 117.855 -3.028 . . . . 40.58 106.684 172.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . 0.946 HG21 ' HE ' ' B' ' 83' ' ' ARG 0.608 33.5 pt -117.74 -110.07 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 1 N-CA-C 124.502 5.001 . . . . 30.48 124.502 -175.1 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 101' ' ' ILE 0.445 0.0 OUTLIER 175.72 -67.95 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 128.782 2.833 . . . . 39.08 112.943 -178.237 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLY . . . . . 0.405 ' C ' ' ND2' ' A' ' 104' ' ' ASN . . . -72.05 170.91 49.08 Favored Glycine 0 CA--C 1.549 2.196 0 N-CA-C 103.319 -3.912 . . . . 17.22 103.319 168.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASN . . . . . 0.503 ' N ' ' ND2' ' A' ' 104' ' ' ASN . 5.2 p30 -161.6 166.92 26.19 Favored 'General case' 0 CA--C 1.516 -0.362 2 O-C-N 114.998 -4.825 . . . . 19.82 115.2 -179.323 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ILE . . . . . 0.925 ' CG1' ' HD3' ' A' ' 106' ' ' PRO 0.369 0.2 OUTLIER -91.44 -61.91 0.2 Allowed Pre-proline 0 CA--C 1.543 0.694 1 N-CA-C 123.028 4.455 . . . . 33.49 123.028 -169.988 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PRO . . . . . 0.925 ' HD3' ' CG1' ' A' ' 105' ' ' ILE . 37.2 Cg_exo -96.31 158.31 1.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.97 0 N-CA-C 115.031 1.127 . . . . 25.77 115.031 178.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.93 6.48 0.1 Allowed 'General case' 0 CA--C 1.517 -0.297 0 O-C-N 120.521 -1.362 . . . . 20.34 110.293 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . 0.605 ' H ' ' C ' ' A' ' 106' ' ' PRO 0.444 1.9 p -116.12 7.79 14.29 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 125.312 1.445 . . . . 17.63 112.681 -177.46 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.5 m -91.01 -171.49 3.01 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 122.8 2.546 . . . . 20.22 104.179 172.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -92.77 168.56 11.11 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 106.068 -1.827 . . . . 37.1 106.068 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASP . . . . . 0.54 ' HB3' ' HA ' ' B' ' 60' ' ' PRO . 0.5 OUTLIER -95.86 178.87 5.29 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 119.7 3.222 . . . . 43.14 119.7 -176.686 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.29 158.68 76.48 Favored Pre-proline 0 C--N 1.348 0.522 1 CA-C-O 111.165 -4.255 . . . . 29.72 111.437 178.618 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PRO . . . . . 1.14 ' HB2' HD11 ' A' ' 116' ' ' LEU . 14.2 Cg_endo -150.73 112.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.405 3.511 1 C-N-CA 130.224 7.283 . . . . 37.04 114.382 163.841 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -26.77 136.84 0.02 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 128.092 2.557 . . . . 53.07 113.66 -174.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . 0.411 2.6 t0 72.69 -76.73 0.06 Allowed 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 115.639 1.718 . . . . 56.25 115.639 -176.691 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . 1.14 HD11 ' HB2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -67.05 -11.55 57.4 Favored 'General case' 0 CA--C 1.542 0.662 2 N-CA-C 133.323 8.268 . . . . 51.72 133.323 -162.794 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 117' ' ' LYS 0.26 1.1 tppt? . . . . . 0 N--CA 1.486 1.367 1 CA-C-N 128.384 5.083 . . . . 51.63 112.952 -176.023 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . 0.536 92.5 p . . . . . 0 CA--C 1.566 1.579 0 N-CA-C 119.989 3.329 . . . . 44.87 119.989 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ARG . . . . . 0.598 ' HD2' HH12 ' A' ' 31' ' ' ARG 0.421 1.7 tpp180 -66.61 -31.65 72.47 Favored 'General case' 0 C--O 1.209 -1.034 0 O-C-N 120.166 -1.584 . . . . 52.1 114.591 -176.744 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 32' ' ' THR . . . . . 0.62 ' N ' ' OE1' ' B' ' 46' ' ' GLN 0.329 0.9 OUTLIER -164.37 112.38 1.11 Allowed 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 122.869 1.318 . . . . 28.04 113.863 176.142 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -94.13 141.36 28.64 Favored 'General case' 0 N--CA 1.407 -2.589 0 CA-C-N 111.418 -2.628 . . . . 19.11 110.062 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . 0.3 27.9 p -63.09 171.38 2.3 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 128.037 2.535 . . . . 18.22 117.617 -174.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' LYS . . . . . 0.434 ' HB3' ' H ' ' B' ' 36' ' ' ARG . 29.2 tttt -52.64 -80.04 0.01 OUTLIER 'General case' 0 CA--C 1.471 -2.081 0 N-CA-C 104.031 -2.581 . . . . 18.44 104.031 178.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ARG . . . . . 0.434 ' H ' ' HB3' ' B' ' 35' ' ' LYS 0.679 0.0 OUTLIER -35.86 -68.61 0.12 Allowed 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 117.075 2.25 . . . . 16.46 117.075 175.464 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 37' ' ' CYS . . . . . 0.405 ' C ' ' O ' ' B' ' 36' ' ' ARG 0.373 0.0 OUTLIER -53.02 -40.78 64.13 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-N 124.377 3.262 . . . . 17.95 118.255 178.446 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ARG . . . . . 0.594 ' NH1' ' OP2' ' D' ' 10' ' ' ' DG' 0.298 6.9 ttp-105 -61.23 -39.98 92.3 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 124.003 1.859 . . . . 34.61 110.81 -176.564 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 37.4 mt -76.24 -32.57 58.97 Favored 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 114.286 -2.966 . . . . 10.01 110.359 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . 0.695 ' HB3' HG12 ' B' ' 42' ' ' ILE . 9.7 mptt -70.75 -15.37 62.68 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 124.415 2.055 . . . . 21.64 110.055 179.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LYS . . . . . 0.433 ' C ' HG23 ' B' ' 42' ' ' ILE . 43.4 mttt 60.96 51.75 4.43 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.872 -1.513 . . . . 17.53 111.238 -178.778 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . 0.695 HG12 ' HB3' ' B' ' 40' ' ' LYS . 39.3 pt -145.72 151.67 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 N-CA-C 113.608 0.966 . . . . 10.08 113.608 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LYS . . . . . 0.575 ' O ' ' NH2' ' B' ' 53' ' ' ARG . 0.4 OUTLIER -57.31 129.8 43.4 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 119.668 3.21 . . . . 23.4 119.668 -168.618 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 44' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' B' ' 46' ' ' GLN 0.296 47.3 t -105.78 108.95 20.74 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 118.12 2.637 . . . . 24.16 118.12 -179.424 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -58.99 8.13 0.02 OUTLIER 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.626 2.454 . . . . 31.59 117.626 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLN . . . . . 0.62 ' OE1' ' N ' ' B' ' 32' ' ' THR . 0.0 OUTLIER 41.45 64.5 1.02 Allowed 'General case' 0 C--N 1.306 -1.287 1 N-CA-C 122.521 4.267 . . . . 53.03 122.521 172.678 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . 0.357 7.0 mm-40 -124.09 148.47 47.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.669 1.729 . . . . 40.53 115.669 177.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' PHE . . . . . 0.64 ' CD1' ' HA ' ' B' ' 49' ' ' PRO . 1.3 t80 -97.3 128.09 36.11 Favored Pre-proline 0 N--CA 1.427 -1.619 0 CA-C-N 112.381 -2.19 . . . . 23.87 116.281 -177.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PRO . . . . . 0.64 ' HA ' ' CD1' ' B' ' 48' ' ' PHE . 47.6 Cg_exo -102.83 20.9 15.6 Favored 'Cis proline' 0 N--CA 1.422 -2.691 0 N-CA-C 118.026 2.279 . . . . 19.15 118.026 5.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' B' ' 61' ' ' CYS . 29.9 m -169.47 111.25 0.47 Allowed 'General case' 0 C--N 1.305 -1.355 1 N-CA-C 99.765 -4.161 . . . . 21.45 99.765 -179.809 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 14.7 p -49.62 139.04 13.17 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 114.219 1.192 . . . . 32.26 114.219 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -38.79 -43.45 0.92 Allowed 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 117.055 2.243 . . . . 51.1 117.055 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ARG . . . . . 0.575 ' NH2' ' O ' ' B' ' 43' ' ' LYS . 21.7 ttm-85 -52.19 -60.52 3.11 Favored 'General case' 0 N--CA 1.426 -1.629 0 C-N-CA 116.544 -2.062 . . . . 35.87 109.424 -178.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' CYS . . . . . 0.517 ' CB ' ' HB2' ' B' ' 61' ' ' CYS . 9.4 m -60.12 -28.61 68.01 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 115.299 1.592 . . . . 27.98 115.299 174.246 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.94 -55.57 16.16 Favored 'General case' 0 CA--C 1.484 -1.56 0 O-C-N 120.596 -1.315 . . . . 31.72 107.808 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -43.55 -66.01 0.43 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 125.87 2.748 . . . . 48.92 107.482 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LEU . . . . . 0.673 ' O ' ' HB2' ' B' ' 58' ' ' GLU 0.362 1.2 tt -66.58 -9.89 39.87 Favored 'General case' 0 C--N 1.272 -2.797 0 O-C-N 118.432 -2.667 . . . . 25.82 114.952 -178.929 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 58' ' ' GLU . . . . . 0.673 ' HB2' ' O ' ' B' ' 57' ' ' LEU 0.25 42.4 mt-10 64.77 35.08 8.95 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 117.319 2.341 . . . . 52.09 117.319 -177.338 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.261 8.0 p -106.05 128.58 26.1 Favored Pre-proline 0 N--CA 1.438 -1.033 0 N-CA-C 101.583 -3.488 . . . . 21.4 101.583 175.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' PRO . . . . . 0.54 ' HA ' ' HB3' ' A' ' 111' ' ' ASP 0.274 31.8 Cg_endo -50.26 142.73 28.1 Favored 'Trans proline' 0 CA--C 1.467 -2.826 0 CA-C-O 114.928 -2.197 . . . . 9.58 107.291 -169.338 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 61' ' ' CYS . . . . . 0.78 ' HB3' ' HB3' ' B' ' 50' ' ' SER 0.454 0.0 OUTLIER -109.21 117.94 35.43 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 113.741 -3.184 . . . . 16.31 111.981 179.866 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 m -130.64 160.13 42.08 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.786 0 CA-C-O 123.746 1.736 . . . . 7.56 115.135 -176.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' SER . . . . . 0.437 ' HB2' ' HD2' ' B' ' 74' ' ' ARG . 5.6 t -92.22 -179.42 5.24 Favored 'General case' 0 N--CA 1.411 -2.417 0 C-N-CA 115.325 -2.55 . . . . 19.54 111.09 179.699 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 16.7 tp -137.93 127.88 25.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 C-N-CA 116.519 -2.072 . . . . 27.38 112.004 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.19 105.32 1.69 Allowed Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 127.413 2.285 . . . . 37.29 113.029 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -60.95 -37.28 78.21 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.055 2.504 . . . . 41.18 113.235 -173.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.11 -56.61 9.27 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.793 -1.094 . . . . 41.87 113.604 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 3.8 p -81.41 -33.37 32.26 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.776 1.398 . . . . 41.19 114.776 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.94 -2.35 87.66 Favored Glycine 0 CA--C 1.542 1.773 0 O-C-N 125.542 1.776 . . . . 37.72 112.718 -173.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' LYS . . . . . 0.895 ' HD3' ' N ' ' B' ' 71' ' ' ASP . 0.0 OUTLIER -73.86 153.38 39.91 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 124.951 1.3 . . . . 50.56 114.304 -176.363 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASP . . . . . 0.895 ' N ' ' HD3' ' B' ' 70' ' ' LYS 0.253 93.6 m-20 -72.65 156.87 38.52 Favored 'General case' 0 CA--C 1.478 -1.825 0 CA-C-O 112.398 -3.668 . . . . 22.02 107.184 179.207 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 72' ' ' VAL . . . . . 0.76 HG23 ' O ' ' B' ' 71' ' ' ASP 0.325 0.9 OUTLIER -169.64 142.18 2.02 Favored Pre-proline 0 N--CA 1.487 1.41 0 CA-C-N 122.018 2.19 . . . . 6.24 110.9 -174.72 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' B' B ' 73' ' ' PRO . . . . . 0.567 ' HD2' ' O ' ' B' ' 73' ' ' PRO . 55.8 Cg_endo -70.03 139.62 39.73 Favored 'Trans proline' 0 N--CA 1.409 -3.449 1 C-N-CA 126.394 4.73 . . . . 4.51 113.359 -161.727 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ARG . . . . . 0.911 ' HG3' HH11 ' B' ' 74' ' ' ARG . 0.5 OUTLIER -45.65 -26.99 0.7 Allowed 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 128.035 3.334 . . . . 4.8 108.312 177.445 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . 0.513 42.9 t -151.14 102.3 2.93 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 119.498 3.147 . . . . 18.24 119.498 176.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' TYR . . . . . 0.462 ' O ' ' N ' ' B' ' 79' ' ' PHE . 0.8 OUTLIER -40.11 -66.85 0.27 Allowed 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 115.176 1.547 . . . . 17.75 115.176 175.732 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 77' ' ' VAL . . . . . 0.521 HG23 ' N ' ' B' ' 78' ' ' PHE . 0.1 OUTLIER -59.35 -39.76 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.162 0 C-N-CA 115.304 -2.558 . . . . 13.0 110.613 -177.79 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 78' ' ' PHE . . . . . 0.521 ' N ' HG23 ' B' ' 77' ' ' VAL . 20.1 t80 -58.74 -27.82 65.28 Favored 'General case' 0 N--CA 1.407 -2.587 1 C-N-CA 110.164 -4.615 . . . . 18.11 110.865 177.418 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PHE . . . . . 0.792 ' CD1' HD23 ' B' ' 80' ' ' LEU . 0.2 OUTLIER -80.82 -28.74 36.09 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 126.111 2.863 . . . . 13.62 110.889 -177.031 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . 0.792 HD23 ' CD1' ' B' ' 79' ' ' PHE . 6.8 mt -74.22 -57.41 3.97 Favored 'General case' 0 N--CA 1.397 -3.086 0 C-N-CA 112.982 -3.487 . . . . 11.22 107.54 -177.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' B' ' 80' ' ' LEU . 68.0 mt-10 -45.61 -33.03 2.61 Favored 'General case' 0 N--CA 1.427 -1.575 0 CA-C-N 115.175 -0.921 . . . . 27.44 110.273 179.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -76.03 -41.72 50.02 Favored 'General case' 0 CA--C 1.49 -1.343 0 C-N-CA 118.423 -1.311 . . . . 24.08 112.039 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ARG . . . . . 0.946 ' HE ' HG21 ' A' ' 101' ' ' ILE . 0.0 OUTLIER -58.51 -59.63 5.08 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 113.944 -1.48 . . . . 43.06 111.551 -177.674 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LEU . . . . . 0.738 HD23 HD23 ' A' ' 84' ' ' LEU 0.375 8.0 mt -52.54 -34.55 50.54 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 119.469 -0.892 . . . . 29.21 111.297 -179.592 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.67 -56.85 16.54 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 114.762 -2.775 . . . . 30.84 110.134 -174.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 78.2 t -56.78 -42.91 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 113.546 -1.661 . . . . 28.13 111.412 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' MET . . . . . 0.708 ' HE2' HD22 ' A' ' 84' ' ' LEU . 3.6 mmt -53.38 -48.81 68.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.918 1.342 . . . . 32.69 107.476 174.37 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.3 mtm -59.44 -51.76 68.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.112 -1.617 . . . . 38.27 113.819 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -53.63 -41.06 66.32 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 117.846 -1.541 . . . . 39.03 111.81 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' VAL . . . . . 0.786 HG12 HD11 ' A' ' 91' ' ' LEU . 35.5 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 C-N-CA 117.023 -1.871 . . . . 22.0 108.068 -178.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' LEU . . . . . 0.654 ' HG ' HD13 ' A' ' 91' ' ' LEU 0.272 20.7 mt -54.18 -46.52 72.38 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 116.155 -2.218 . . . . 27.67 111.543 -179.503 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LYS . . . . . 0.468 ' O ' ' N ' ' B' ' 94' ' ' TYR 0.411 18.7 mttp -49.46 -60.44 2.84 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.283 -0.865 . . . . 31.82 110.149 176.712 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.84 -7.44 0.05 Allowed 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 119.471 -2.018 . . . . 35.31 116.141 175.135 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 94' ' ' TYR . . . . . 0.574 ' HB3' ' CD2' ' A' ' 94' ' ' TYR . 6.7 m-85 -109.77 8.21 24.51 Favored 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 118.597 -1.241 . . . . 27.21 108.552 177.395 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 99.97 -18.53 55.66 Favored Glycine 0 CA--C 1.545 1.963 0 N-CA-C 122.025 3.57 . . . . 36.32 122.025 176.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' VAL . . . . . 0.65 ' CG1' ' HB3' ' B' ' 91' ' ' LEU 0.452 2.5 p -81.44 -144.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.44 1 N-CA-C 122.791 4.367 . . . . 40.02 122.791 -170.796 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ASP . . . . . 0.715 ' CG ' ' HD2' ' B' ' 98' ' ' PRO . 0.1 OUTLIER -168.97 -139.82 0.0 OUTLIER Pre-proline 0 C--O 1.246 0.875 0 N-CA-C 118.158 2.651 . . . . 51.24 118.158 -177.897 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 98' ' ' PRO . . . . . 0.715 ' HD2' ' CG ' ' B' ' 97' ' ' ASP . 18.0 Cg_exo -85.02 79.27 2.4 Favored 'Trans proline' 1 C--O 1.312 4.195 1 C-N-CA 130.595 7.53 . . . . 60.08 108.681 167.109 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 99' ' ' THR . . . . . 0.719 ' OG1' HG21 ' A' ' 90' ' ' VAL 0.671 8.5 p . . . . . 0 N--CA 1.516 2.866 1 N-CA-C 125.575 5.398 . . . . 63.66 125.575 -172.323 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 321' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 322' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' ' DT' . . . . . 0.973 HO5' ' H6 ' ' D' ' 1' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.136 3 O4'-C1'-N19 102.442 -6.698 . . . . 26.530000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ' DC' . . . . . 0.743 H2'' ' C8 ' ' D' ' 3' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.402 -2.2 2 C5'-C4'-C3' 107.112 -5.059 . . . . 32.340000000000003 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ' DG' . . . . . 0.743 ' C8 ' H2'' ' D' ' 2' ' ' ' DC' . . . . . . . . 1 O5'--C5' 1.349 -5.711 2 P-O3'-C3' 113.068 -5.526 . . . . 36.770000000000003 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' ' DG' . . . . . 0.699 H2'' ' C6 ' ' D' ' 5' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.398 -2.526 2 O4'-C1'-N19 113.262 6.828 . . . . 39.149999999999999 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ' DC' . . . . . 0.699 ' C6 ' H2'' ' D' ' 4' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.534 2.883 3 C5'-C4'-C3' 124.104 6.269 . . . . 44.149999999999999 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' ' DA' . . . . . 0.504 ' C2 ' ' C2 ' ' D' ' 7' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.772 1 P-O3'-C3' 124.531 4.026 . . . . 50.899999999999999 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' ' DA' . . . . . 0.523 H2'' " O5'" ' D' ' 8' ' ' ' DT' . . . . . . . . 1 O3'--C3' 1.353 -5.98 3 O4'-C1'-N19 101.41 -7.987 . . . . 48.719999999999999 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ' DT' . . . . . 0.663 " H2'" ' C5 ' ' D' ' 9' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.375 -3.499 4 P-O5'-C5' 103.875 -10.641 . . . . 31.050000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' ' DT' . . . . . 0.663 ' C5 ' " H2'" ' D' ' 8' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.495 -3.324 4 O4'-C4'-C3' 99.284 -6.316 . . . . 21.039999999999999 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ' DG' . . . . . 0.594 ' OP2' ' NH1' ' B' ' 38' ' ' ARG . . . . . . . . 1 C5'--C4' 1.543 4.023 3 OP1-P-OP2 110.303 -6.198 . . . . 12.539999999999999 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' ' DC' . . . . . 0.511 " O5'" H2'' ' D' ' 10' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.537 3.236 2 P-O3'-C3' 109.255 -8.704 . . . . 21.32 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.392 -3.025 2 O4'-C1'-N19 103.998 -4.752 . . . . 35.030000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 O3'--C3' 1.534 7.899 4 O4'-C1'-N19 114.835 8.794 . . . . 43.329999999999998 . . . . . . . . . . 2 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ' DA' . . . . . 0.491 ' OP2' " H2'" ' D' ' 14' ' ' ' DA' . . . . . . . . 1 P--O5' 1.639 4.625 5 O4'-C1'-N19 117.639 12.299 . . . . 46.159999999999997 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' ' DT' . . . . . 0.532 H2'' " C5'" ' E' ' 16' ' ' ' DC' . . . . . . . . 0 C4'--C3' 1.499 -2.925 2 O4'-C1'-N19 101.409 -7.989 . . . . 28.129999999999999 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' ' DC' . . . . . 0.771 ' C6 ' " H5'" ' E' ' 16' ' ' ' DC' . . . . . . . . 1 O3'--C3' 1.497 5.056 3 O4'-C1'-N19 115.118 9.148 . . . . 37.439999999999998 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.379 -3.805 1 P-O5'-C5' 112.824 -5.048 . . . . 47.109999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' ' DG' . . . . . 0.53 ' C2 ' ' N3 ' ' E' ' 19' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.376 3 O4'-C1'-N19 115.069 9.086 . . . . 49.600000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' ' DC' . . . . . 0.53 ' N3 ' ' C2 ' ' E' ' 18' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.505 -2.305 0 O4'-C1'-N19 110.797 3.746 . . . . 53.030000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' ' DA' . . . . . 0.574 H2'' " O5'" ' E' ' 21' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.494 -3.406 2 C5'-C4'-O4' 116.526 4.454 . . . . 56.340000000000003 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' ' DA' . . . . . 0.934 H2'' H5'' ' E' ' 22' ' ' ' DT' . . . . . . . . 1 O3'--C3' 1.37 -4.663 2 O4'-C1'-N19 101.283 -8.146 . . . . 54.479999999999997 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' ' DT' . . . . . 0.934 H5'' H2'' ' E' ' 21' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.393 -2.96 2 O4'-C1'-N19 112.59 5.988 . . . . 38.359999999999999 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' ' DT' . . . . . 0.787 " H2'" ' C8 ' ' E' ' 24' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.5 -2.755 2 P-O5'-C5' 110.065 -6.772 . . . . 26.579999999999998 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' ' DG' . . . . . 0.787 ' C8 ' " H2'" ' E' ' 23' ' ' ' DT' . . . . . . . . 2 O5'--C5' 1.366 -4.653 2 O5'-C5'-C4' 102.179 -5.729 . . . . 24.440000000000001 . . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' ' DC' . . . . . 0.872 " H3'" ' HB3' ' A' ' 43' ' ' LYS . . . . . . . . 0 O3'--C3' 1.4 -2.383 2 O5'-C5'-C4' 102.362 -5.599 . . . . 23.25 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' ' DC' . . . . . 0.788 H2'' " C5'" ' E' ' 27' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.507 -2.061 3 P-O3'-C3' 127.808 6.757 . . . . 34.100000000000001 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 27' ' ' ' DG' . . . . . 0.788 " C5'" H2'' ' E' ' 26' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.377 -3.953 5 O4'-C1'-N19 115.898 10.123 . . . . 43.340000000000003 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.394 -2.856 0 N19-C1'-C2' 119.938 3.587 . . . . 48.710000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 114.227 1.195 . . . . 58.460000000000001 114.227 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.598 HH12 ' HD2' ' B' ' 31' ' ' ARG 0.436 0.0 OUTLIER -94.07 6.17 49.38 Favored 'General case' 0 C--N 1.354 0.79 0 N-CA-C 105.873 -1.899 . . . . 62.990000000000002 105.873 170.743 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.13 122.89 48.88 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 123.733 1.73 . . . . 49.310000000000002 108.064 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . 0.283 . . -156.04 120.74 4.64 Favored 'General case' 0 C--N 1.286 -2.165 0 N-CA-C 100.417 -3.919 . . . . 32.32 100.417 -179.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.483 ' O ' ' N ' ' A' ' 36' ' ' ARG . 1.4 p -57.93 142.43 46.28 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 120.199 3.407 . . . . 30.0 120.199 -174.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 34' ' ' CYS . 24.9 mtpt -37.22 -32.03 0.04 OUTLIER 'General case' 0 CA--C 1.494 -1.182 0 N-CA-C 114.028 1.121 . . . . 41.740000000000002 114.028 -178.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.483 ' N ' ' O ' ' A' ' 34' ' ' CYS . 7.9 ttt85 -67.34 -77.56 0.07 Allowed 'General case' 0 CA--C 1.503 -0.842 0 CA-C-O 124.729 2.204 . . . . 38.920000000000002 108.489 178.585 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.457 ' O ' ' N ' ' A' ' 41' ' ' LYS . 86.3 m -34.19 -56.12 0.5 Allowed 'General case' 0 N--CA 1.425 -1.695 0 CA-C-N 109.572 -3.467 . . . . 27.859999999999999 114.478 -179.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 38' ' ' ARG . 2.6 ttm105 -48.68 -50.13 34.62 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.433 1.111 . . . . 31.890000000000001 108.527 -179.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -51.12 -60.85 2.66 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-O 121.9 0.857 . . . . 21.66 112.953 -177.452 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.633 ' CB ' HG23 ' A' ' 42' ' ' ILE 0.251 57.1 mmtt -60.82 -28.15 68.58 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-N 112.685 -2.052 . . . . 37.659999999999997 107.756 178.395 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 40' ' ' LYS . 24.2 mttt 68.84 54.83 0.46 Allowed 'General case' 0 N--CA 1.423 -1.787 0 CA-C-N 112.662 -2.063 . . . . 17.379999999999999 109.897 -175.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.633 HG23 ' CB ' ' A' ' 40' ' ' LYS . 3.2 pt -128.16 167.94 22.29 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.388 0 CA-C-O 116.313 -1.803 . . . . 22.52 109.851 -176.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.872 ' HB3' " H3'" ' E' ' 25' ' ' ' DC' . 15.2 pttm -87.08 86.35 7.3 Favored 'General case' 0 N--CA 1.477 0.909 1 N-CA-C 124.111 4.856 . . . . 55.299999999999997 124.111 -171.129 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.7 t -34.03 116.57 0.29 Allowed 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 120.747 3.61 . . . . 34.060000000000002 120.747 176.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.402 ' HB2' ' H ' ' A' ' 52' ' ' LYS . 62.2 m-20 -91.16 68.57 6.04 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 119.746 3.239 . . . . 50.329999999999998 119.746 -173.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.566 ' O ' ' HG3' ' A' ' 46' ' ' GLN . 4.7 tp-100 -19.76 44.16 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.119 3 C-N-CA 135.924 5.69 . . . . 43.390000000000001 121.999 -179.484 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -119.59 167.04 12.39 Favored 'General case' 0 N--CA 1.421 -1.876 0 C-N-CA 116.934 -1.906 . . . . 53.740000000000002 110.041 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -121.63 146.98 46.82 Favored Pre-proline 0 C--O 1.233 0.23 0 N-CA-C 109.21 -0.663 . . . . 40.390000000000001 109.21 178.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -87.51 22.98 21.52 Favored 'Cis proline' 0 N--CA 1.441 -1.597 0 CA-C-N 119.284 0.78 . . . . 34.409999999999997 113.164 4.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.8 t -166.81 146.63 5.62 Favored 'General case' 0 C--N 1.312 -1.054 0 C-N-CA 119.263 -0.975 . . . . 33.950000000000003 112.787 178.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 15.9 p -82.54 145.73 29.59 Favored 'General case' 0 CA--C 1.497 -1.074 0 N-CA-C 105.753 -1.943 . . . . 41.469999999999999 105.753 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.402 ' H ' ' HB2' ' A' ' 45' ' ' ASP 0.803 0.1 OUTLIER -37.15 -56.57 0.91 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 121.131 3.752 . . . . 63.009999999999998 121.131 -177.074 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.446 ' CG ' HH11 ' A' ' 53' ' ' ARG . 0.0 OUTLIER -59.13 -52.41 65.85 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 116.498 -2.081 . . . . 63.5 113.128 179.663 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' CYS . . . . . 0.523 ' HA ' HG12 ' A' ' 59' ' ' VAL . 1.4 m -42.24 -49.84 4.96 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 124.55 1.14 . . . . 45.700000000000003 111.471 -177.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.785 ' O ' ' HA ' ' A' ' 58' ' ' GLU . . . -49.24 -71.89 0.06 Allowed 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 112.139 -2.301 . . . . 44.049999999999997 111.038 175.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.457 ' O ' ' N ' ' A' ' 58' ' ' GLU . 44.5 mtmt -53.22 -64.01 0.96 Allowed 'General case' 0 CA--C 1.486 -1.516 0 O-C-N 126.312 2.257 . . . . 53.119999999999997 107.949 -178.244 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -51.6 -10.74 0.11 Allowed 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 116.124 -1.893 . . . . 46.75 110.474 176.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.785 ' HA ' ' O ' ' A' ' 55' ' ' ALA 0.268 3.8 mt-10 87.19 -10.11 0.59 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 130.172 3.389 . . . . 64.659999999999997 119.46 171.088 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.731 HG22 ' HD2' ' A' ' 60' ' ' PRO 0.266 3.1 p -75.02 169.74 18.87 Favored Pre-proline 0 C--N 1.307 -1.248 0 N-CA-C 119.662 3.208 . . . . 50.619999999999997 119.662 -172.599 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.731 ' HD2' HG22 ' A' ' 59' ' ' VAL . 14.6 Cg_endo -76.59 126.54 9.02 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 124.804 3.669 . . . . 46.200000000000003 108.748 172.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.64 ' O ' ' HG3' ' A' ' 74' ' ' ARG . 3.6 t -94.02 100.94 12.98 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 127.951 2.501 . . . . 37.740000000000002 113.164 -178.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.882 HG23 ' HD3' ' A' ' 73' ' ' PRO . 10.4 p -118.93 127.99 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.97 0 CA-C-N 112.346 -2.207 . . . . 36.890000000000001 114.37 -173.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.3 137.0 36.98 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 123.408 1.575 . . . . 31.48 112.697 -178.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.542 HD11 ' NH2' ' B' ' 31' ' ' ARG 0.435 0.1 OUTLIER -85.81 100.66 12.2 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 114.042 -2.885 . . . . 30.559999999999999 106.602 178.479 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.515 ' OD1' ' HD2' ' A' ' 66' ' ' PRO . 14.7 t0 -49.52 116.16 5.66 Favored Pre-proline 0 N--CA 1.476 0.866 0 CA-C-N 121.799 2.091 . . . . 30.940000000000001 113.618 179.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.515 ' HD2' ' OD1' ' A' ' 65' ' ' ASP . 71.6 Cg_endo -45.33 -71.46 0.05 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 124.098 3.199 . . . . 26.800000000000001 112.975 -179.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -51.14 -83.25 0.01 OUTLIER 'General case' 0 C--N 1.362 1.135 0 O-C-N 124.599 1.187 . . . . 17.530000000000001 111.175 -179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 53.8 p -52.15 -19.3 1.88 Allowed 'General case' 0 CA--C 1.479 -1.767 0 N-CA-C 114.293 1.22 . . . . 16.73 114.293 -174.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.61 10.41 67.0 Favored Glycine 0 CA--C 1.532 1.102 0 O-C-N 124.379 1.049 . . . . 26.629999999999999 113.649 -175.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.6 mttt -99.16 168.87 9.78 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 120.418 3.488 . . . . 47.909999999999997 120.418 -175.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -71.33 152.08 43.55 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 113.896 -3.121 . . . . 31.329999999999998 108.731 177.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.2 t -149.07 100.37 3.42 Favored Pre-proline 0 C--O 1.221 -0.44 0 C-N-CA 125.424 1.49 . . . . 25.370000000000001 109.993 176.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.882 ' HD3' HG23 ' A' ' 62' ' ' VAL . 20.1 Cg_exo -59.59 124.38 15.33 Favored 'Trans proline' 0 C--N 1.295 -2.255 0 N-CA-C 107.696 -1.694 . . . . 23.07 107.696 174.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.64 ' HG3' ' O ' ' A' ' 61' ' ' CYS 0.27 3.0 mtt180 -55.98 -25.96 46.31 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 123.475 1.607 . . . . 31.5 114.982 -176.081 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . 0.647 ' O ' ' N ' ' A' ' 78' ' ' PHE 0.293 11.7 p -71.74 -43.55 65.63 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 113.873 -1.512 . . . . 32.079999999999998 108.953 178.877 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 80' ' ' LEU . 12.8 t80 -51.37 -38.76 54.98 Favored 'General case' 0 CA--C 1.486 -1.495 0 CA-C-N 114.792 -1.094 . . . . 27.609999999999999 108.049 -179.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.665 ' O ' ' HG3' ' A' ' 81' ' ' GLU . 75.2 t -69.98 -36.73 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 O-C-N 125.678 1.861 . . . . 24.75 108.098 172.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.647 ' N ' ' O ' ' A' ' 75' ' ' SER . 17.8 t80 -52.64 -56.79 12.95 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 118.456 -1.298 . . . . 47.960000000000001 109.146 -177.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.446 ' CD1' ' C ' ' A' ' 79' ' ' PHE . 0.0 OUTLIER -70.47 -38.57 74.44 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-O 124.832 2.253 . . . . 35.439999999999998 114.046 -173.781 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.673 ' HB2' ' O ' ' A' ' 76' ' ' TYR 0.293 6.4 tp -59.53 -29.97 68.27 Favored 'General case' 0 N--CA 1.401 -2.879 0 CA-C-N 112.495 -2.139 . . . . 21.989999999999998 106.395 177.197 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.665 ' HG3' ' O ' ' A' ' 77' ' ' VAL . 34.4 mt-10 -73.25 -34.59 65.93 Favored 'General case' 0 CA--C 1.489 -1.373 0 C-N-CA 112.983 -3.487 . . . . 35.439999999999998 109.732 179.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.635 ' O ' ' N ' ' A' ' 85' ' ' ALA . 0.0 OUTLIER -59.98 -48.75 80.41 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 124.299 2.0 . . . . 38.189999999999998 109.231 -177.894 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.775 ' HG2' HH11 ' A' ' 83' ' ' ARG . 0.1 OUTLIER -51.16 -31.2 19.12 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.2 1.556 . . . . 52.659999999999997 115.2 177.192 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.738 HD23 HD23 ' B' ' 84' ' ' LEU 0.281 2.2 mt -68.3 -36.35 79.22 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 102.37 -3.196 . . . . 33.909999999999997 102.37 174.739 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.635 ' N ' ' O ' ' A' ' 82' ' ' ASP . . . -56.45 -48.54 76.84 Favored 'General case' 0 N--CA 1.433 -1.313 0 CA-C-O 123.451 1.596 . . . . 35.450000000000003 114.904 -170.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.3 t -59.69 -53.08 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.095 0 CA-C-N 110.862 -2.881 . . . . 39.450000000000003 107.085 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.91 -32.91 34.76 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-N 111.836 -2.438 . . . . 35.100000000000001 113.381 -176.573 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' MET . . . . . 0.746 ' O ' ' HB2' ' A' ' 92' ' ' LYS . 2.6 mtp -80.94 -30.61 35.23 Favored 'General case' 0 N--CA 1.434 -1.254 0 C-N-CA 119.005 -1.078 . . . . 50.549999999999997 111.064 -177.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 20.7 ttt180 -65.91 -66.17 0.58 Allowed 'General case' 0 CA--C 1.5 -0.948 0 N-CA-C 102.131 -3.285 . . . . 67.709999999999994 102.131 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.719 HG21 ' OG1' ' B' ' 99' ' ' THR 0.304 25.8 t -36.81 -68.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 116.888 2.181 . . . . 34.210000000000001 116.888 -178.974 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.786 HD11 HG12 ' B' ' 90' ' ' VAL . 13.9 tp -61.34 -16.17 43.34 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 125.264 1.426 . . . . 36.020000000000003 113.407 -175.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.838 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 13.3 tttt -84.37 -48.13 10.0 Favored 'General case' 0 C--O 1.242 0.686 0 CA-C-N 113.647 -1.615 . . . . 59.149999999999999 106.979 179.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLU . . . . . 0.477 ' C ' ' H ' ' A' ' 95' ' ' GLY . 98.7 mt-10 -47.5 -62.46 1.43 Allowed 'General case' 0 C--N 1.351 0.65 0 O-C-N 126.101 2.126 . . . . 51.619999999999997 105.716 174.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.574 ' CD2' ' HB3' ' B' ' 94' ' ' TYR . 2.6 m-85 -58.69 4.18 0.03 OUTLIER 'General case' 0 CA--C 1.484 -1.566 0 N-CA-C 114.607 1.336 . . . . 50.310000000000002 114.607 -177.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.477 ' H ' ' C ' ' A' ' 93' ' ' GLU . . . 90.82 39.91 5.72 Favored Glycine 0 N--CA 1.433 -1.559 0 CA-C-O 115.019 -3.101 . . . . 44.280000000000001 116.49 -179.553 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.838 ' O ' ' HA ' ' A' ' 92' ' ' LYS 0.27 0.1 OUTLIER -136.29 175.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 C-N-CA 128.552 2.741 . . . . 47.130000000000003 114.158 176.041 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASP . . . . . 1.049 ' HB2' ' HD2' ' A' ' 98' ' ' PRO . 12.7 p-10 -149.07 -104.55 0.0 OUTLIER Pre-proline 0 N--CA 1.518 2.938 0 C-N-CA 129.112 2.965 . . . . 44.829999999999998 116.382 -178.672 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PRO . . . . . 1.049 ' HD2' ' HB2' ' A' ' 97' ' ' ASP 0.277 0.1 OUTLIER -76.03 108.01 2.59 Favored 'Trans proline' 0 C--N 1.405 3.513 2 C-N-CA 135.257 10.638 . . . . 42.899999999999999 125.417 166.957 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . 0.509 0.0 OUTLIER -87.04 143.82 27.16 Favored 'General case' 0 CA--C 1.565 1.53 1 N-CA-C 125.171 5.248 . . . . 38.57 125.171 -176.906 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -68.02 141.74 56.12 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 117.855 -3.028 . . . . 40.579999999999998 106.684 172.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.946 HG21 ' HE ' ' B' ' 83' ' ' ARG 0.608 33.5 pt -117.74 -110.07 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 1 N-CA-C 124.502 5.001 . . . . 30.48 124.502 -175.1 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.528 ' HB2' ' O ' ' A' ' 101' ' ' ILE 0.445 0.0 OUTLIER 175.72 -67.95 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 128.782 2.833 . . . . 39.079999999999998 112.943 -178.237 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.405 ' C ' ' ND2' ' A' ' 104' ' ' ASN . . . -72.05 170.91 49.08 Favored Glycine 0 CA--C 1.549 2.196 0 N-CA-C 103.319 -3.912 . . . . 17.219999999999999 103.319 168.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASN . . . . . 0.503 ' N ' ' ND2' ' A' ' 104' ' ' ASN . 5.2 p30 -161.6 166.92 26.19 Favored 'General case' 0 CA--C 1.516 -0.362 2 O-C-N 114.998 -4.825 . . . . 19.82 115.2 -179.323 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ILE . . . . . 0.925 ' CG1' ' HD3' ' A' ' 106' ' ' PRO 0.369 0.2 OUTLIER -91.44 -61.91 0.2 Allowed Pre-proline 0 CA--C 1.543 0.694 1 N-CA-C 123.028 4.455 . . . . 33.490000000000002 123.028 -169.988 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PRO . . . . . 0.925 ' HD3' ' CG1' ' A' ' 105' ' ' ILE . 37.2 Cg_exo -96.31 158.31 1.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.97 0 N-CA-C 115.031 1.127 . . . . 25.77 115.031 178.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.93 6.48 0.1 Allowed 'General case' 0 CA--C 1.517 -0.297 0 O-C-N 120.521 -1.362 . . . . 20.34 110.293 177.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . 0.605 ' H ' ' C ' ' A' ' 106' ' ' PRO 0.444 1.9 p -116.12 7.79 14.29 Favored 'General case' 0 C--O 1.214 -0.806 0 C-N-CA 125.312 1.445 . . . . 17.629999999999999 112.681 -177.46 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 5.5 m -91.01 -171.49 3.01 Favored 'General case' 0 C--N 1.347 0.494 0 CA-C-N 122.8 2.546 . . . . 20.219999999999999 104.179 172.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -92.77 168.56 11.11 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 106.068 -1.827 . . . . 37.100000000000001 106.068 177.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASP . . . . . 0.54 ' HB3' ' HA ' ' B' ' 60' ' ' PRO . 0.5 OUTLIER -95.86 178.87 5.29 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 119.7 3.222 . . . . 43.140000000000001 119.7 -176.686 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.29 158.68 76.48 Favored Pre-proline 0 C--N 1.348 0.522 1 CA-C-O 111.165 -4.255 . . . . 29.719999999999999 111.437 178.618 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PRO . . . . . 1.14 ' HB2' HD11 ' A' ' 116' ' ' LEU . 14.2 Cg_endo -150.73 112.75 0.0 OUTLIER 'Trans proline' 0 C--N 1.405 3.511 1 C-N-CA 130.224 7.283 . . . . 37.039999999999999 114.382 163.841 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -26.77 136.84 0.02 OUTLIER 'General case' 0 C--N 1.381 1.954 0 C-N-CA 128.092 2.557 . . . . 53.07 113.66 -174.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . 0.411 2.6 t0 72.69 -76.73 0.06 Allowed 'General case' 0 CA--C 1.569 1.698 0 N-CA-C 115.639 1.718 . . . . 56.25 115.639 -176.691 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.14 HD11 ' HB2' ' A' ' 113' ' ' PRO . 0.6 OUTLIER -67.05 -11.55 57.4 Favored 'General case' 0 CA--C 1.542 0.662 2 N-CA-C 133.323 8.268 . . . . 51.719999999999999 133.323 -162.794 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 117' ' ' LYS 0.26 1.1 tppt? . . . . . 0 N--CA 1.486 1.367 1 CA-C-N 128.384 5.083 . . . . 51.630000000000003 112.952 -176.023 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . 0.536 92.5 p . . . . . 0 CA--C 1.566 1.579 0 N-CA-C 119.989 3.329 . . . . 44.869999999999997 119.989 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ARG . . . . . 0.598 ' HD2' HH12 ' A' ' 31' ' ' ARG 0.421 1.7 tpp180 -66.61 -31.65 72.47 Favored 'General case' 0 C--O 1.209 -1.034 0 O-C-N 120.166 -1.584 . . . . 52.100000000000001 114.591 -176.744 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' THR . . . . . 0.62 ' N ' ' OE1' ' B' ' 46' ' ' GLN 0.329 0.9 OUTLIER -164.37 112.38 1.11 Allowed 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 122.869 1.318 . . . . 28.039999999999999 113.863 176.142 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -94.13 141.36 28.64 Favored 'General case' 0 N--CA 1.407 -2.589 0 CA-C-N 111.418 -2.628 . . . . 19.109999999999999 110.062 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' CYS . . . . . . . . . . . . 0.3 27.9 p -63.09 171.38 2.3 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 128.037 2.535 . . . . 18.219999999999999 117.617 -174.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' LYS . . . . . 0.434 ' HB3' ' H ' ' B' ' 36' ' ' ARG . 29.2 tttt -52.64 -80.04 0.01 OUTLIER 'General case' 0 CA--C 1.471 -2.081 0 N-CA-C 104.031 -2.581 . . . . 18.440000000000001 104.031 178.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ARG . . . . . 0.434 ' H ' ' HB3' ' B' ' 35' ' ' LYS 0.679 0.0 OUTLIER -35.86 -68.61 0.12 Allowed 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 117.075 2.25 . . . . 16.460000000000001 117.075 175.464 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' CYS . . . . . 0.405 ' C ' ' O ' ' B' ' 36' ' ' ARG 0.373 0.0 OUTLIER -53.02 -40.78 64.13 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-N 124.377 3.262 . . . . 17.949999999999999 118.255 178.446 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ARG . . . . . 0.594 ' NH1' ' OP2' ' D' ' 10' ' ' ' DG' 0.298 6.9 ttp-105 -61.23 -39.98 92.3 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 124.003 1.859 . . . . 34.609999999999999 110.81 -176.564 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 37.4 mt -76.24 -32.57 58.97 Favored 'General case' 0 N--CA 1.425 -1.695 0 C-N-CA 114.286 -2.966 . . . . 10.01 110.359 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . 0.695 ' HB3' HG12 ' B' ' 42' ' ' ILE . 9.7 mptt -70.75 -15.37 62.68 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 124.415 2.055 . . . . 21.640000000000001 110.055 179.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LYS . . . . . 0.433 ' C ' HG23 ' B' ' 42' ' ' ILE . 43.4 mttt 60.96 51.75 4.43 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 113.872 -1.513 . . . . 17.530000000000001 111.238 -178.778 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.695 HG12 ' HB3' ' B' ' 40' ' ' LYS . 39.3 pt -145.72 151.67 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.854 0 N-CA-C 113.608 0.966 . . . . 10.08 113.608 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.575 ' O ' ' NH2' ' B' ' 53' ' ' ARG . 0.4 OUTLIER -57.31 129.8 43.4 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 119.668 3.21 . . . . 23.399999999999999 119.668 -168.618 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' CYS . . . . . 0.48 ' O ' ' N ' ' B' ' 46' ' ' GLN 0.296 47.3 t -105.78 108.95 20.74 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 118.12 2.637 . . . . 24.16 118.12 -179.424 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -58.99 8.13 0.02 OUTLIER 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.626 2.454 . . . . 31.59 117.626 -177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLN . . . . . 0.62 ' OE1' ' N ' ' B' ' 32' ' ' THR . 0.0 OUTLIER 41.45 64.5 1.02 Allowed 'General case' 0 C--N 1.306 -1.287 1 N-CA-C 122.521 4.267 . . . . 53.030000000000001 122.521 172.678 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLU . . . . . . . . . . . . 0.357 7.0 mm-40 -124.09 148.47 47.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.669 1.729 . . . . 40.530000000000001 115.669 177.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' PHE . . . . . 0.64 ' CD1' ' HA ' ' B' ' 49' ' ' PRO . 1.3 t80 -97.3 128.09 36.11 Favored Pre-proline 0 N--CA 1.427 -1.619 0 CA-C-N 112.381 -2.19 . . . . 23.870000000000001 116.281 -177.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PRO . . . . . 0.64 ' HA ' ' CD1' ' B' ' 48' ' ' PHE . 47.6 Cg_exo -102.83 20.9 15.6 Favored 'Cis proline' 0 N--CA 1.422 -2.691 0 N-CA-C 118.026 2.279 . . . . 19.149999999999999 118.026 5.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . 0.78 ' HB3' ' HB3' ' B' ' 61' ' ' CYS . 29.9 m -169.47 111.25 0.47 Allowed 'General case' 0 C--N 1.305 -1.355 1 N-CA-C 99.765 -4.161 . . . . 21.449999999999999 99.765 -179.809 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' CYS . . . . . . . . . . . . . 14.7 p -49.62 139.04 13.17 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 114.219 1.192 . . . . 32.259999999999998 114.219 -175.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 20.5 tttt -38.79 -43.45 0.92 Allowed 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 117.055 2.243 . . . . 51.100000000000001 117.055 -179.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ARG . . . . . 0.575 ' NH2' ' O ' ' B' ' 43' ' ' LYS . 21.7 ttm-85 -52.19 -60.52 3.11 Favored 'General case' 0 N--CA 1.426 -1.629 0 C-N-CA 116.544 -2.062 . . . . 35.869999999999997 109.424 -178.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' CYS . . . . . 0.517 ' CB ' ' HB2' ' B' ' 61' ' ' CYS . 9.4 m -60.12 -28.61 68.01 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 115.299 1.592 . . . . 27.98 115.299 174.246 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.94 -55.57 16.16 Favored 'General case' 0 CA--C 1.484 -1.56 0 O-C-N 120.596 -1.315 . . . . 31.719999999999999 107.808 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 10.6 mtpt -43.55 -66.01 0.43 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 125.87 2.748 . . . . 48.920000000000002 107.482 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.673 ' O ' ' HB2' ' B' ' 58' ' ' GLU 0.362 1.2 tt -66.58 -9.89 39.87 Favored 'General case' 0 C--N 1.272 -2.797 0 O-C-N 118.432 -2.667 . . . . 25.82 114.952 -178.929 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' GLU . . . . . 0.673 ' HB2' ' O ' ' B' ' 57' ' ' LEU 0.25 42.4 mt-10 64.77 35.08 8.95 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 117.319 2.341 . . . . 52.090000000000003 117.319 -177.338 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . 0.261 8.0 p -106.05 128.58 26.1 Favored Pre-proline 0 N--CA 1.438 -1.033 0 N-CA-C 101.583 -3.488 . . . . 21.399999999999999 101.583 175.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' PRO . . . . . 0.54 ' HA ' ' HB3' ' A' ' 111' ' ' ASP 0.274 31.8 Cg_endo -50.26 142.73 28.1 Favored 'Trans proline' 0 CA--C 1.467 -2.826 0 CA-C-O 114.928 -2.197 . . . . 9.5800000000000001 107.291 -169.338 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' CYS . . . . . 0.78 ' HB3' ' HB3' ' B' ' 50' ' ' SER 0.454 0.0 OUTLIER -109.21 117.94 35.43 Favored 'General case' 0 C--N 1.318 -0.764 0 C-N-CA 113.741 -3.184 . . . . 16.309999999999999 111.981 179.866 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 11.0 m -130.64 160.13 42.08 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.786 0 CA-C-O 123.746 1.736 . . . . 7.5599999999999996 115.135 -176.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' SER . . . . . 0.437 ' HB2' ' HD2' ' B' ' 74' ' ' ARG . 5.6 t -92.22 -179.42 5.24 Favored 'General case' 0 N--CA 1.411 -2.417 0 C-N-CA 115.325 -2.55 . . . . 19.539999999999999 111.09 179.699 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 16.7 tp -137.93 127.88 25.62 Favored 'General case' 0 CA--C 1.5 -0.965 0 C-N-CA 116.519 -2.072 . . . . 27.379999999999999 112.004 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.19 105.32 1.69 Allowed Pre-proline 0 C--O 1.236 0.359 0 C-N-CA 127.413 2.285 . . . . 37.289999999999999 113.029 -177.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -60.95 -37.28 78.21 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.055 2.504 . . . . 41.18 113.235 -173.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.11 -56.61 9.27 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.793 -1.094 . . . . 41.869999999999997 113.604 177.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' THR . . . . . . . . . . . . . 3.8 p -81.41 -33.37 32.26 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.776 1.398 . . . . 41.189999999999998 114.776 -177.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.94 -2.35 87.66 Favored Glycine 0 CA--C 1.542 1.773 0 O-C-N 125.542 1.776 . . . . 37.719999999999999 112.718 -173.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.895 ' HD3' ' N ' ' B' ' 71' ' ' ASP . 0.0 OUTLIER -73.86 153.38 39.91 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 124.951 1.3 . . . . 50.560000000000002 114.304 -176.363 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASP . . . . . 0.895 ' N ' ' HD3' ' B' ' 70' ' ' LYS 0.253 93.6 m-20 -72.65 156.87 38.52 Favored 'General case' 0 CA--C 1.478 -1.825 0 CA-C-O 112.398 -3.668 . . . . 22.02 107.184 179.207 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' VAL . . . . . 0.76 HG23 ' O ' ' B' ' 71' ' ' ASP 0.325 0.9 OUTLIER -169.64 142.18 2.02 Favored Pre-proline 0 N--CA 1.487 1.41 0 CA-C-N 122.018 2.19 . . . . 6.2400000000000002 110.9 -174.72 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' PRO . . . . . 0.567 ' HD2' ' O ' ' B' ' 73' ' ' PRO . 55.8 Cg_endo -70.03 139.62 39.73 Favored 'Trans proline' 0 N--CA 1.409 -3.449 1 C-N-CA 126.394 4.73 . . . . 4.5099999999999998 113.359 -161.727 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ARG . . . . . 0.911 HH11 ' HG3' ' B' ' 74' ' ' ARG . 0.5 OUTLIER -45.65 -26.99 0.7 Allowed 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 128.035 3.334 . . . . 4.7999999999999998 108.312 177.445 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . 0.513 42.9 t -151.14 102.3 2.93 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 119.498 3.147 . . . . 18.239999999999998 119.498 176.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.462 ' O ' ' N ' ' B' ' 79' ' ' PHE . 0.8 OUTLIER -40.11 -66.85 0.27 Allowed 'General case' 0 N--CA 1.438 -1.056 0 N-CA-C 115.176 1.547 . . . . 17.75 115.176 175.732 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.521 HG23 ' N ' ' B' ' 78' ' ' PHE . 0.1 OUTLIER -59.35 -39.76 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.469 -2.162 0 C-N-CA 115.304 -2.558 . . . . 13.0 110.613 -177.79 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.521 ' N ' HG23 ' B' ' 77' ' ' VAL . 20.1 t80 -58.74 -27.82 65.28 Favored 'General case' 0 N--CA 1.407 -2.587 1 C-N-CA 110.164 -4.615 . . . . 18.109999999999999 110.865 177.418 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.792 ' CD1' HD23 ' B' ' 80' ' ' LEU . 0.2 OUTLIER -80.82 -28.74 36.09 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 126.111 2.863 . . . . 13.619999999999999 110.889 -177.031 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.792 HD23 ' CD1' ' B' ' 79' ' ' PHE . 6.8 mt -74.22 -57.41 3.97 Favored 'General case' 0 N--CA 1.397 -3.086 0 C-N-CA 112.982 -3.487 . . . . 11.220000000000001 107.54 -177.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLU . . . . . 0.42 ' C ' ' O ' ' B' ' 80' ' ' LEU . 68.0 mt-10 -45.61 -33.03 2.61 Favored 'General case' 0 N--CA 1.427 -1.575 0 CA-C-N 115.175 -0.921 . . . . 27.440000000000001 110.273 179.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -76.03 -41.72 50.02 Favored 'General case' 0 CA--C 1.49 -1.343 0 C-N-CA 118.423 -1.311 . . . . 24.079999999999998 112.039 178.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ARG . . . . . 0.946 ' HE ' HG21 ' A' ' 101' ' ' ILE . 0.0 OUTLIER -58.51 -59.63 5.08 Favored 'General case' 0 N--CA 1.42 -1.943 0 CA-C-N 113.944 -1.48 . . . . 43.060000000000002 111.551 -177.674 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.738 HD23 HD23 ' A' ' 84' ' ' LEU 0.375 8.0 mt -52.54 -34.55 50.54 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 119.469 -0.892 . . . . 29.210000000000001 111.297 -179.592 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -57.67 -56.85 16.54 Favored 'General case' 0 N--CA 1.439 -0.994 0 C-N-CA 114.762 -2.775 . . . . 30.84 110.134 -174.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 78.2 t -56.78 -42.91 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 113.546 -1.661 . . . . 28.129999999999999 111.412 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' MET . . . . . 0.708 ' HE2' HD22 ' A' ' 84' ' ' LEU . 3.6 mmt -53.38 -48.81 68.29 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 122.918 1.342 . . . . 32.689999999999998 107.476 174.37 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.3 mtm -59.44 -51.76 68.49 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.112 -1.617 . . . . 38.270000000000003 113.819 -178.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtm180 -53.63 -41.06 66.32 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 117.846 -1.541 . . . . 39.030000000000001 111.81 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.786 HG12 HD11 ' A' ' 91' ' ' LEU . 35.5 t -65.99 -46.58 87.79 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 C-N-CA 117.023 -1.871 . . . . 22.0 108.068 -178.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' LEU . . . . . 0.654 ' HG ' HD13 ' A' ' 91' ' ' LEU 0.272 20.7 mt -54.18 -46.52 72.38 Favored 'General case' 0 N--CA 1.435 -1.218 0 C-N-CA 116.155 -2.218 . . . . 27.670000000000002 111.543 -179.503 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.468 ' O ' ' N ' ' B' ' 94' ' ' TYR 0.411 18.7 mttp -49.46 -60.44 2.84 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-O 118.283 -0.865 . . . . 31.82 110.149 176.712 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.84 -7.44 0.05 Allowed 'General case' 0 CA--C 1.505 -0.779 0 O-C-N 119.471 -2.018 . . . . 35.310000000000002 116.141 175.135 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' TYR . . . . . 0.574 ' HB3' ' CD2' ' A' ' 94' ' ' TYR . 6.7 m-85 -109.77 8.21 24.51 Favored 'General case' 0 CA--C 1.502 -0.887 0 C-N-CA 118.597 -1.241 . . . . 27.210000000000001 108.552 177.395 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 99.97 -18.53 55.66 Favored Glycine 0 CA--C 1.545 1.963 0 N-CA-C 122.025 3.57 . . . . 36.32 122.025 176.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' VAL . . . . . 0.65 ' CG1' ' HB3' ' B' ' 91' ' ' LEU 0.452 2.5 p -81.44 -144.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.221 -0.44 1 N-CA-C 122.791 4.367 . . . . 40.020000000000003 122.791 -170.796 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ASP . . . . . 0.715 ' CG ' ' HD2' ' B' ' 98' ' ' PRO . 0.1 OUTLIER -168.97 -139.82 0.0 OUTLIER Pre-proline 0 C--O 1.246 0.875 0 N-CA-C 118.158 2.651 . . . . 51.240000000000002 118.158 -177.897 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.715 ' HD2' ' CG ' ' B' ' 97' ' ' ASP . 18.0 Cg_exo -85.02 79.27 2.4 Favored 'Trans proline' 1 C--O 1.312 4.195 1 C-N-CA 130.595 7.53 . . . . 60.079999999999998 108.681 167.109 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' THR . . . . . 0.719 ' OG1' HG21 ' A' ' 90' ' ' VAL 0.671 8.5 p . . . . . 0 N--CA 1.516 2.866 1 N-CA-C 125.575 5.398 . . . . 63.659999999999997 125.575 -172.323 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 321' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 322' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_