data_1hds_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 1hds _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' VAL . . . . . 1.586 ' CB ' ' CG1' ' A' ' 1' ' ' VAL . 58.8 t . . . . . 3 CA--C 1.87 13.271 1 N-CA-C 99.971 -4.085 . . . . 12.9 99.971 . . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . 1.637 ' CA ' ' CB ' ' A' ' 2' ' ' LEU 1.361 3.9 mm? -29.66 84.91 0.0 OUTLIER 'General case' 3 CA--C 2.046 20.032 3 O-C-N 89.0 -21.063 . . . . 12.46 116.345 55.779 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . 1.582 ' CA ' ' CB ' ' A' ' 3' ' ' SER 0.755 4.9 t -110.88 151.44 27.87 Favored 'General case' 4 C--O 1.675 23.458 4 O-C-N 148.308 16.005 . . . . 14.55 117.708 -171.183 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ALA . . . . . 1.275 ' N ' ' CA ' ' A' ' 4' ' ' ALA 0.393 . . -55.48 -17.68 5.67 Favored 'General case' 3 N--CA 1.97 25.544 5 C-N-CA 100.806 -8.357 . . . . 13.6 123.824 -165.501 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' A' ' 8' ' ' SER 0.375 . . -91.3 -31.93 15.91 Favored 'General case' 3 C--O 0.975 -13.358 1 C-N-CA 97.224 -9.791 . . . . 12.07 104.103 -179.001 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASN . . . . . 0.467 ' ND2' ' CB ' ' A' ' 3' ' ' SER 0.632 66.1 m-20 -14.84 -79.41 0.0 OUTLIER 'General case' 1 C--N 1.463 5.519 2 C-N-CA 141.551 7.94 . . . . 11.81 95.093 166.222 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . 1.567 ' CD ' ' CE ' ' A' ' 7' ' ' LYS 0.274 10.7 mmtt -45.06 -57.02 4.14 Favored 'General case' 3 CA--C 1.901 14.449 4 O-C-N 136.637 8.71 . . . . 16.17 97.087 -174.839 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' SER . . . . . 1.341 ' O ' ' C ' ' A' ' 8' ' ' SER 0.615 10.4 m -89.81 40.23 0.99 Allowed 'General case' 4 C--O 1.639 21.602 3 CA-C-O 79.972 -19.109 . . . . 14.73 90.661 -170.299 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . 1.433 ' CA ' ' N ' ' A' ' 9' ' ' ASN 0.576 2.0 m-80 -69.49 -45.38 69.11 Favored 'General case' 3 N--CA 1.816 17.841 4 CA-C-N 170.569 24.258 . . . . 14.81 102.619 80.074 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . 1.52 ' CA ' ' C ' ' A' ' 10' ' ' VAL 0.575 44.5 t -44.69 -65.27 0.17 Allowed 'Isoleucine or valine' 3 C--O 1.424 10.249 3 O-C-N 130.635 4.96 . . . . 16.01 99.416 -175.574 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . 1.524 ' CE ' ' NZ ' ' A' ' 11' ' ' LYS 0.732 0.0 OUTLIER -78.87 -40.07 33.46 Favored 'General case' 4 C--O 0.727 -26.402 0 CA-C-N 123.185 2.721 . . . . 16.53 117.028 -167.076 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . 1.587 ' CA ' ' CB ' ' A' ' 12' ' ' ALA 0.302 . . -44.04 -40.23 4.68 Favored 'General case' 4 C--O 0.799 -22.636 5 CA-C-O 146.075 12.369 . . . . 15.29 130.984 163.67 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . 0.754 ' N ' ' O ' ' A' ' 12' ' ' ALA . . . -45.75 -87.87 0.0 OUTLIER 'General case' 3 C--O 0.957 -14.326 2 CA-C-N 90.608 -12.087 . . . . 15.67 100.316 177.145 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TRP . . . . . 1.647 ' CH2' ' CZ2' ' A' ' 14' ' ' TRP 1.04 1.0 OUTLIER -14.69 -66.4 0.01 OUTLIER 'General case' 3 CA--C 1.282 -9.362 2 C-N-CA 155.976 13.71 . . . . 14.58 102.322 161.307 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -34.15 8.72 0.0 OUTLIER Glycine 2 C--N 1.115 -11.75 4 C-N-CA 163.856 19.789 . . . . 13.56 109.047 154.82 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . 1.593 ' CE ' ' CD ' ' A' ' 16' ' ' LYS 0.424 0.0 OUTLIER -159.44 -28.99 0.07 Allowed 'General case' 1 C--N 1.522 8.096 4 CA-C-N 161.319 22.559 . . . . 13.25 110.054 -149.475 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . 1.456 ' CG2' ' CB ' ' A' ' 17' ' ' VAL 0.671 0.1 OUTLIER -60.69 -98.02 0.0 OUTLIER 'Isoleucine or valine' 3 C--N 1.764 18.598 5 O-C-N 97.921 -15.487 . . . . 13.58 99.063 169.504 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . 1.233 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . 88.56 -127.8 8.79 Favored Glycine 3 C--O 0.818 -25.875 3 O-C-N 104.885 -11.135 . . . . 13.02 103.097 -178.597 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . 1.49 ' C ' ' CA ' ' A' ' 19' ' ' GLY . . . -102.36 9.7 56.1 Favored Glycine 3 CA--C 1.785 16.938 3 C-N-CA 146.486 11.517 . . . . 12.13 110.342 -160.095 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . 1.428 ' CB ' ' CG ' ' A' ' 20' ' ' ASN 0.716 1.1 m120 -93.47 -33.72 13.69 Favored 'General case' 2 C--O 1.079 -7.902 2 C-N-CA 147.46 10.304 . . . . 10.53 105.838 175.149 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . 0.43 ' O ' ' C ' ' A' ' 22' ' ' PRO . . . -58.01 -48.32 97.31 Favored Pre-proline 2 C--O 1.341 5.92 2 O-C-N 140.099 10.875 . . . . 10.91 90.409 -170.35 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . 1.603 ' CB ' ' CG ' ' A' ' 22' ' ' PRO 0.331 0.1 OUTLIER -45.71 -34.4 11.6 Favored 'Trans proline' 3 C--N 1.03 -16.236 3 N-CA-C 125.985 5.34 . . . . 11.21 125.985 -178.399 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.469 . . -89.89 -53.63 4.41 Favored 'General case' 3 N--CA 1.236 -11.134 3 C-N-CA 165.285 17.434 . . . . 12.41 100.835 -158.77 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.922 0.0 OUTLIER -94.29 -72.09 0.63 Allowed 'General case' 2 CA--C 1.281 -9.391 4 CA-C-O 99.233 -9.936 . . . . 15.76 91.067 -162.766 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . 1.416 ' C ' ' CA ' ' A' ' 25' ' ' GLY . . . -21.64 -77.56 0.01 OUTLIER Glycine 3 CA--C 1.873 22.428 4 CA-C-N 155.243 17.292 . . . . 15.15 113.513 -177.116 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . 1.314 ' CB ' ' CA ' ' A' ' 26' ' ' ALA 0.611 . . -59.59 -6.41 1.12 Allowed 'General case' 1 C--O 1.591 19.038 4 CA-C-N 93.81 -11.195 . . . . 15.19 124.474 168.58 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLN . . . . . 0.613 ' OE1' ' CE1' ' A' ' 112' ' ' HIS 0.876 0.0 OUTLIER -90.4 -36.83 14.37 Favored 'General case' 3 CA--C 1.69 6.341 2 CA-C-O 103.83 -7.748 . . . . 14.75 91.853 176.272 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . 0.787 . . -31.22 -47.92 0.12 Allowed 'General case' 4 N--CA 1.118 -17.055 2 C-N-CA 140.881 7.673 . . . . 12.33 112.698 176.126 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . 1.48 ' CD2' ' CG ' ' A' ' 29' ' ' LEU 1.352 0.0 OUTLIER -173.79 -81.5 0.01 OUTLIER 'General case' 3 CA--C 0.79 -28.26 5 C-N-CA 161.817 16.047 . . . . 11.73 84.621 -105.099 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . 1.075 ' NE2' ' CD ' ' A' ' 30' ' ' GLN 0.471 0.0 OUTLIER -18.9 -45.28 0.0 OUTLIER 'General case' 1 C--N 1.455 5.168 4 O-C-N 69.994 -32.941 . . . . 12.26 102.831 -157.347 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . 1.578 ' CD ' ' CG ' ' A' ' 31' ' ' ARG 1.082 2.1 mmt180 156.56 -65.27 0.0 OUTLIER 'General case' 2 C--O 1.64 21.608 2 C-N-CA 167.356 18.263 . . . . 16.13 112.126 -45.28 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . 1.441 ' CE ' ' SD ' ' A' ' 32' ' ' MET 0.753 0.0 OUTLIER -86.88 -10.56 53.08 Favored 'General case' 2 C--N 1.811 20.646 3 O-C-N 111.22 -7.175 . . . . 16.42 102.925 -169.58 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . 1.411 ' N ' ' C ' ' A' ' 32' ' ' MET 1.507 0.0 OUTLIER -49.88 -39.71 40.34 Favored 'General case' 3 C--N 1.689 15.356 2 O-C-N 137.616 9.323 . . . . 16.72 117.837 -177.53 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . 1.421 ' CB ' ' CA ' ' A' ' 34' ' ' LEU 0.744 0.0 OUTLIER -125.52 -11.91 6.75 Favored 'General case' 2 C--O 1.509 14.725 4 CA-C-O 100.478 -9.344 . . . . 16.7 100.105 -159.017 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . 1.546 ' CA ' ' CB ' ' A' ' 35' ' ' SER 0.871 52.6 p -123.83 -12.48 7.56 Favored 'General case' 2 C--O 1.051 -9.377 2 C-N-CA 86.425 -14.11 . . . . 16.06 111.532 172.811 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . 1.642 ' CB ' ' CG ' ' A' ' 36' ' ' PHE . 40.7 m-85 -125.12 42.45 0.75 Allowed Pre-proline 3 C--O 1.463 12.306 3 CA-C-O 135.38 7.276 . . . . 14.77 113.281 173.261 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . 1.338 ' N ' ' CD ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -24.99 -40.29 0.03 OUTLIER 'Trans proline' 2 C--N 1.591 13.338 3 C-N-CA 132.279 8.652 . . . . 13.96 111.347 -173.83 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . 0.668 0.6 OUTLIER -54.67 -28.6 48.54 Favored 'General case' 3 C--O 0.871 -18.859 1 CA-C-O 98.206 -10.426 . . . . 13.1 111.609 -175.737 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . 0.919 ' CG2' ' O ' ' A' ' 36' ' ' PHE 0.756 0.0 OUTLIER -57.2 -42.71 81.81 Favored 'General case' 3 CA--C 1.284 -9.279 1 O-C-N 141.247 11.592 . . . . 12.56 105.252 177.638 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . 1.281 ' CB ' ' CG ' ' A' ' 40' ' ' LYS 0.622 0.0 OUTLIER -54.73 12.08 0.0 OUTLIER 'General case' 2 C--N 1.173 -7.101 4 O-C-N 98.528 -15.107 . . . . 12.76 107.07 -170.969 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . 1.592 ' CA ' ' CB ' ' A' ' 41' ' ' THR 0.557 0.0 OUTLIER -112.75 -16.41 12.77 Favored 'General case' 3 N--CA 1.008 -22.54 4 O-C-N 83.897 -24.252 . . . . 13.34 114.299 -173.645 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TYR . . . . . 1.376 ' C ' ' N ' ' A' ' 43' ' ' PHE 0.387 39.6 m-85 -36.41 -37.2 0.12 Allowed 'General case' 1 C--O 0.771 -24.083 3 O-C-N 97.373 -15.83 . . . . 13.06 104.809 133.146 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . 1.567 ' CA ' ' CB ' ' A' ' 43' ' ' PHE 0.396 0.0 OUTLIER -124.19 62.66 30.29 Favored Pre-proline 2 C--N 1.732 17.198 3 C-N-CA 98.137 -9.425 . . . . 13.09 130.876 -176.885 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . 1.447 ' CB ' ' CA ' ' A' ' 44' ' ' PRO 0.823 50.6 Cg_endo -31.62 -53.93 0.29 Allowed 'Trans proline' 4 C--N 1.779 23.198 4 CA-C-N 85.148 -11.411 . . . . 11.91 128.289 -174.847 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HIS . . . . . 1.533 ' CA ' ' CB ' ' A' ' 45' ' ' HIS 0.546 0.0 OUTLIER -58.27 -21.66 49.58 Favored 'General case' 4 C--O 1.491 13.764 3 C-N-CA 162.98 16.512 . . . . 11.55 124.914 -179.231 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . 0.767 ' CD1' ' NE2' ' A' ' 55' ' ' GLN 0.744 5.8 m-30 -157.48 93.27 1.28 Allowed 'General case' 4 CA--C 1.221 -11.684 2 O-C-N 137.922 9.514 . . . . 12.81 104.406 -123.018 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . 0.536 ' OD2' ' CA ' ' A' ' 49' ' ' SER 0.76 19.1 t70 -24.35 81.66 0.0 OUTLIER 'General case' 4 C--O 1.508 14.678 4 C-N-CA 161.652 15.981 . . . . 13.03 89.054 141.7 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . 1.499 ' CB ' ' CA ' ' A' ' 48' ' ' LEU 0.412 27.5 mt -93.47 39.47 1.06 Allowed 'General case' 3 C--O 1.425 10.337 3 O-C-N 103.72 -11.863 . . . . 11.79 85.463 -162.902 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . 1.163 ' CB ' ' OG ' ' A' ' 49' ' ' SER 0.734 46.5 t 29.79 -92.42 0.01 OUTLIER 'General case' 3 CA--C 1.116 -15.717 4 CA-C-O 138.191 8.615 . . . . 11.82 101.46 -172.339 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HIS . . . . . 1.557 ' CG ' ' CB ' ' A' ' 50' ' ' HIS 0.77 0.9 OUTLIER 70.09 -101.7 0.04 OUTLIER 'General case' 2 CA--C 1.36 -6.364 3 C-N-CA 165.521 17.528 . . . . 14.08 118.255 -55.347 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -101.05 98.04 1.76 Allowed Glycine 2 C--O 1.519 17.936 3 N-CA-C 97.094 -6.403 . . . . 12.23 97.094 169.517 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . 1.266 ' CB ' ' OG ' ' A' ' 52' ' ' SER 1.036 0.9 OUTLIER -116.53 115.66 26.17 Favored 'General case' 1 C--N 1.214 -5.325 4 CA-C-O 89.372 -14.632 . . . . 11.54 131.167 176.193 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . 1.318 ' O ' ' C ' ' A' ' 53' ' ' ALA 1.042 . . -44.51 -0.6 0.0 OUTLIER 'General case' 2 C--O 1.679 23.689 4 O-C-N 162.822 25.076 . . . . 13.38 104.746 -173.436 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . 1.356 ' O ' ' C ' ' A' ' 54' ' ' GLN 0.713 55.2 tt0 -69.54 -57.07 5.68 Favored 'General case' 1 C--O 1.646 21.937 3 CA-C-O 135.564 7.364 . . . . 14.11 95.33 -171.735 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . 1.58 ' CB ' ' CA ' ' A' ' 55' ' ' GLN 0.499 0.0 OUTLIER -60.38 -22.86 63.8 Favored 'General case' 2 CA--C 1.725 7.695 2 CA-C-N 105.073 -5.512 . . . . 12.89 122.079 -160.373 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . 1.527 ' CE ' ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -71.3 -59.97 2.48 Favored 'General case' 2 C--O 1.632 21.192 1 C-N-CA 170.629 19.571 . . . . 13.57 114.53 -173.176 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . 1.561 ' CA ' ' CB ' ' A' ' 57' ' ' ALA 0.962 . . -79.54 -67.79 0.73 Allowed 'General case' 1 C--O 0.902 -17.215 3 N-CA-C 87.184 -8.821 . . . . 13.31 87.184 168.922 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HIS . . . . . 1.546 ' CB ' ' CA ' ' A' ' 58' ' ' HIS 0.873 9.3 t60 -37.52 -58.93 0.82 Allowed 'General case' 2 N--CA 1.618 7.941 1 CA-C-N 128.731 5.241 . . . . 14.32 113.711 -178.954 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . 1.399 ' N ' ' C ' ' A' ' 58' ' ' HIS . . . -68.0 -42.42 85.15 Favored Glycine 4 N--CA 1.084 -24.815 2 N-CA-C 88.944 -9.662 . . . . 14.94 88.944 -154.963 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . 1.507 ' C ' ' CA ' ' A' ' 60' ' ' GLN 0.417 0.0 OUTLIER -31.38 -63.72 0.16 Allowed 'General case' 4 C--O 0.863 -19.266 3 C-N-CA 144.189 8.996 . . . . 14.63 104.685 174.066 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . 1.484 ' CB ' ' CA ' ' A' ' 61' ' ' LYS 0.591 0.0 OUTLIER -69.86 -48.51 58.54 Favored 'General case' 3 C--N 1.073 -11.444 4 CA-C-N 91.155 -11.839 . . . . 14.0 131.822 -179.012 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . 1.555 ' CB ' ' CG1' ' A' ' 62' ' ' VAL 0.431 0.3 OUTLIER -60.06 -71.26 0.11 Allowed 'Isoleucine or valine' 3 C--O 1.404 9.23 3 O-C-N 145.366 14.166 . . . . 14.99 93.153 167.783 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . 1.628 ' CB ' ' CA ' ' A' ' 63' ' ' ALA 0.68 . . -55.29 -27.48 47.04 Favored 'General case' 1 CA--C 1.263 -10.091 4 CA-C-N 152.932 16.242 . . . . 14.75 118.152 -179.292 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . 1.461 ' C ' ' CA ' ' A' ' 64' ' ' ASN 0.419 69.1 m-20 -59.61 -39.92 85.84 Favored 'General case' 3 CA--C 1.811 11.019 3 CA-C-N 136.918 8.963 . . . . 14.25 106.347 175.291 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ALA . . . . . 1.582 ' CA ' ' CB ' ' A' ' 65' ' ' ALA 0.445 . . -75.78 -41.75 52.1 Favored 'General case' 4 CA--C 1.139 -14.829 1 O-C-N 107.799 -9.313 . . . . 13.62 106.239 -177.031 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . 0.724 49.9 mt -19.28 -59.49 0.02 OUTLIER 'General case' 3 N--CA 1.315 -7.2 4 O-C-N 98.468 -15.145 . . . . 14.16 112.073 157.753 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . 1.468 ' C ' ' CA ' ' A' ' 67' ' ' THR 0.827 21.5 p -69.06 -21.32 64.1 Favored 'General case' 3 N--CA 1.099 -18.021 2 O-C-N 106.298 -10.251 . . . . 13.87 120.644 -171.856 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . 0.867 ' N ' ' CA ' ' A' ' 67' ' ' THR 0.348 0.0 OUTLIER -87.27 -49.8 7.02 Favored 'General case' 2 C--N 0.95 -16.761 3 CA-C-O 138.547 8.784 . . . . 15.1 117.418 171.335 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . 1.452 ' CA ' ' N ' ' A' ' 69' ' ' ALA 0.34 . . -65.72 -42.86 90.55 Favored 'General case' 4 N--CA 1.759 14.98 3 CA-C-N 100.512 -7.586 . . . . 15.85 97.889 -177.491 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLN . . . . . 1.374 ' CD ' ' NE2' ' A' ' 70' ' ' GLN 0.766 0.0 OUTLIER -67.35 -45.49 76.19 Favored 'General case' 4 C--O 0.987 -12.753 3 O-C-N 112.233 -6.542 . . . . 15.5 96.03 -174.56 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -101.5 41.1 2.21 Favored Glycine 4 N--CA 1.099 -23.769 2 O-C-N 98.976 -14.828 . . . . 15.25 112.358 -162.692 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . 1.22 ' CE1' ' NE2' ' A' ' 72' ' ' HIS 0.664 16.2 p80 174.46 69.7 0.0 OUTLIER 'General case' 2 C--O 1.536 16.184 1 O-C-N 111.256 -7.026 . . . . 14.9 110.72 158.892 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . 1.583 ' CG ' ' CD2' ' A' ' 73' ' ' LEU 0.483 0.5 OUTLIER -75.48 105.09 6.33 Favored 'General case' 3 N--CA 1.599 7.022 2 N-CA-C 77.447 -12.427 . . . . 15.44 77.447 -177.168 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . 1.334 ' CG ' ' CB ' ' A' ' 74' ' ' ASN 0.391 0.0 OUTLIER 159.86 -33.57 0.0 OUTLIER 'General case' 4 C--O 1.868 33.64 5 C-N-CA 147.98 10.512 . . . . 15.7 93.038 152.013 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . 0.985 ' CA ' ' O ' ' A' ' 74' ' ' ASN 0.301 53.0 t0 -136.99 38.75 2.56 Favored 'General case' 4 C--O 1.523 15.485 3 CA-C-N 143.94 12.154 . . . . 15.81 104.057 -159.783 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . 0.986 ' O ' ' C ' ' A' ' 77' ' ' PRO 0.48 0.0 OUTLIER -47.9 -50.8 51.4 Favored Pre-proline 3 C--O 1.548 16.783 2 CA-C-O 137.112 8.101 . . . . 16.47 113.87 174.534 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PRO . . . . . 1.409 ' C ' ' N ' ' A' ' 78' ' ' GLY 0.638 6.3 Cg_endo -54.91 -65.72 0.11 Allowed 'Trans proline' 3 CA--C 2.118 29.72 4 CA-C-O 93.641 -11.066 . . . . 15.41 93.019 -169.575 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . 1.455 ' C ' ' CA ' ' A' ' 78' ' ' GLY . . . -54.18 -17.08 7.19 Favored Glycine 4 N--CA 1.91 30.244 4 O-C-N 161.562 24.289 . . . . 14.27 111.353 -179.162 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . 1.593 ' CA ' ' CB ' ' A' ' 79' ' ' THR 0.426 0.0 OUTLIER -70.34 -51.78 27.52 Favored 'General case' 3 C--N 0.988 -15.134 2 CA-C-N 131.888 7.844 . . . . 14.61 121.73 178.566 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . 1.499 ' CD2' ' CG ' ' A' ' 80' ' ' LEU 0.507 0.2 OUTLIER -82.18 8.62 10.49 Favored 'General case' 2 C--O 1.499 14.185 1 O-C-N 105.804 -10.56 . . . . 14.03 118.602 178.883 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . 1.628 ' CA ' ' CB ' ' A' ' 81' ' ' SER 0.395 41.4 t -79.39 -63.02 1.51 Allowed 'General case' 3 N--CA 1.288 -8.529 5 CA-C-O 80.95 -18.643 . . . . 13.34 88.152 -149.203 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASN . . . . . 1.386 ' N ' ' CA ' ' A' ' 82' ' ' ASN 0.735 0.2 OUTLIER -41.52 -79.21 0.02 OUTLIER 'General case' 4 N--CA 1.863 20.178 2 O-C-N 151.938 18.274 . . . . 13.41 100.654 -176.208 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . 0.794 ' C ' ' CA ' ' A' ' 84' ' ' SER . 1.8 mp -58.13 -6.03 0.55 Allowed 'General case' 3 C--O 1.419 10.026 1 O-C-N 133.349 6.656 . . . . 11.34 108.714 -177.478 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' SER . . . . . 1.348 ' CA ' ' N ' ' A' ' 84' ' ' SER 0.477 0.1 OUTLIER -72.14 -29.92 64.53 Favored 'General case' 4 N--CA 1.857 19.912 4 CA-C-O 135.737 7.446 . . . . 11.6 117.244 175.272 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASN . . . . . 1.522 ' C ' ' CA ' ' A' ' 85' ' ' ASN 0.598 0.7 OUTLIER -104.5 -74.69 0.64 Allowed 'General case' 4 C--O 1.691 24.318 4 CA-C-O 74.237 -21.839 . . . . 12.64 103.659 -170.571 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . 1.536 ' CD2' ' CG ' ' A' ' 86' ' ' LEU . 39.9 tp -14.56 -59.37 0.01 OUTLIER 'General case' 2 C--O 1.061 -8.828 3 CA-C-N 151.317 15.508 . . . . 12.39 113.826 164.295 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . 1.446 ' N ' ' C ' ' A' ' 86' ' ' LEU 0.721 61.5 m80 -67.32 -54.43 20.72 Favored 'General case' 4 C--N 1.68 14.961 3 O-C-N 134.769 7.543 . . . . 11.33 130.042 -168.641 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . 1.523 ' C ' ' CA ' ' A' ' 88' ' ' ALA 0.257 . . -43.57 -81.72 0.01 OUTLIER 'General case' 4 C--N 1.615 12.116 4 CA-C-N 96.632 -9.349 . . . . 12.36 101.458 -168.908 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HIS . . . . . 1.231 ' NE2' ' CE1' ' A' ' 89' ' ' HIS 0.623 24.5 t-80 146.89 -126.57 0.0 OUTLIER 'General case' 3 N--CA 1.254 -10.27 4 O-C-N 106.814 -9.929 . . . . 16.16 91.885 -25.73 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . 0.504 ' N ' ' ND1' ' A' ' 89' ' ' HIS 0.283 0.0 OUTLIER -49.85 -53.95 22.49 Favored 'General case' 2 C--O 1.483 13.367 4 O-C-N 96.141 -16.599 . . . . 14.79 106.773 173.982 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . 1.588 ' CG ' ' CD2' ' A' ' 91' ' ' LEU 0.636 2.1 mp -62.06 -57.85 10.06 Favored 'General case' 3 N--CA 1.775 15.811 2 C-N-CA 149.5 11.12 . . . . 14.68 103.63 172.35 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . 0.645 ' CA ' ' O ' ' A' ' 88' ' ' ALA 0.523 1.1 ptt180 42.72 63.06 1.55 Allowed 'General case' 2 C--O 1.44 11.119 3 CA-C-O 135.641 7.401 . . . . 13.33 125.139 -174.898 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . 1.603 ' CB ' ' CG1' ' A' ' 93' ' ' VAL 1.027 0.5 OUTLIER -115.91 91.5 1.81 Allowed 'Isoleucine or valine' 2 C--O 1.01 -11.552 3 C-N-CA 168.622 18.769 . . . . 11.88 102.017 -140.11 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASN . . . . . 1.472 ' CA ' ' N ' ' A' ' 94' ' ' ASN 0.768 21.7 t-20 -60.61 130.23 90.16 Favored Pre-proline 2 C--O 0.738 -25.855 1 CA-C-N 103.635 -6.166 . . . . 12.77 101.654 -175.703 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . 0.71 ' N ' ' O ' ' A' ' 94' ' ' ASN 0.654 10.1 Cg_endo -54.74 -41.94 73.19 Favored 'Trans proline' 3 N--CA 1.16 -18.107 3 O-C-N 140.305 10.108 . . . . 14.14 123.441 176.612 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . 0.644 ' C ' ' CA ' ' A' ' 97' ' ' ASN 0.309 28.2 m -52.97 -18.3 1.35 Allowed 'Isoleucine or valine' 2 N--CA 1.199 -13.003 2 CA-C-O 110.107 -4.758 . . . . 16.2 115.414 166.306 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . 1.562 ' N ' ' CA ' ' A' ' 97' ' ' ASN 0.757 34.1 m120 -82.84 -4.25 57.83 Favored 'General case' 1 N--CA 1.687 11.403 2 O-C-N 138.222 9.701 . . . . 15.47 106.145 168.313 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . 0.447 ' CE2' ' OG1' ' A' ' 137' ' ' THR 0.432 25.0 m-85 -86.0 -59.24 2.35 Favored 'General case' 3 CA--C 1.311 -8.231 3 CA-C-N 136.68 8.855 . . . . 13.47 102.828 -179.401 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . 1.419 ' CE ' ' NZ ' ' A' ' 99' ' ' LYS 0.308 0.4 OUTLIER -42.55 -11.5 0.01 OUTLIER 'General case' 2 C--O 1.469 12.648 2 C-N-CA 135.84 5.656 . . . . 12.45 107.26 175.313 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . 1.511 ' CB ' ' CG ' ' A' ' 100' ' ' LEU 1.062 0.0 OUTLIER -86.51 -76.65 0.34 Allowed 'General case' 3 N--CA 1.086 -18.644 4 C-N-CA 146.81 10.044 . . . . 11.09 104.155 -178.759 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . 0.376 6.4 tp -48.07 -28.13 2.69 Favored 'General case' 2 CA--C 1.733 8.005 3 CA-C-N 104.589 -5.732 . . . . 12.24 117.959 -172.336 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.9 m -84.95 -39.19 18.42 Favored 'General case' 2 CA--C 1.187 -12.99 3 C-N-CA 145.931 9.692 . . . . 12.41 107.459 -172.594 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HIS . . . . . 1.483 ' CB ' ' CA ' ' A' ' 103' ' ' HIS 0.409 8.2 t-80 -59.72 -57.96 10.66 Favored 'General case' 3 CA--C 1.68 5.979 3 CA-C-N 155.626 17.466 . . . . 13.56 103.544 158.449 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . 1.568 ' CA ' ' CB ' ' A' ' 104' ' ' SER 0.489 0.2 OUTLIER -57.79 -43.81 85.83 Favored 'General case' 2 C--N 1.132 -8.887 3 CA-C-O 102.685 -8.293 . . . . 12.98 101.197 -177.625 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . 1.554 ' CG ' ' CD1' ' A' ' 105' ' ' LEU 0.34 0.1 OUTLIER -74.6 -29.06 61.16 Favored 'General case' 2 N--CA 1.732 13.626 1 CA-C-O 128.947 4.213 . . . . 12.82 110.392 179.971 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . 1.529 ' CD2' ' CG ' ' A' ' 106' ' ' LEU 0.567 0.0 OUTLIER -71.88 1.69 6.68 Favored 'General case' 4 N--CA 1.83 18.537 2 C-N-CA 106.46 -6.096 . . . . 14.88 101.354 179.34 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . 0.757 1.2 t -89.45 -83.75 0.13 Allowed 'Isoleucine or valine' 3 C--O 0.953 -14.544 4 O-C-N 95.68 -16.888 . . . . 14.04 95.932 -170.486 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . 1.538 ' CA ' ' CB ' ' A' ' 108' ' ' THR 0.8 0.7 OUTLIER 61.97 -96.23 0.06 Allowed 'General case' 2 C--O 0.809 -22.113 5 C-N-CA 167.557 18.343 . . . . 13.9 86.628 84.075 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . 1.09 ' C ' ' CA ' ' A' ' 109' ' ' LEU 0.624 0.1 OUTLIER -13.95 -86.88 0.0 OUTLIER 'General case' 4 CA--C 2.192 25.635 3 CA-C-O 132.102 5.715 . . . . 13.12 104.284 172.87 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . 0.687 ' O ' ' CG ' ' A' ' 114' ' ' PRO 1.118 . . -38.34 -96.5 0.0 OUTLIER 'General case' 4 C--O 1.451 11.671 4 C-N-CA 153.889 12.876 . . . . 11.3 82.401 164.826 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . 0.533 0.9 OUTLIER -30.54 -59.65 0.19 Allowed 'General case' 1 C--N 1.222 -4.975 3 CA-C-N 144.636 12.471 . . . . 9.71 108.249 -179.023 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HIS . . . . . 1.222 ' ND1' ' CG ' ' A' ' 112' ' ' HIS 0.304 3.5 m80 -73.92 -31.15 62.95 Favored 'General case' 1 N--CA 1.29 -8.431 4 CA-C-N 150.388 15.085 . . . . 11.97 122.989 176.957 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' A' ' 109' ' ' LEU 0.4 0.2 OUTLIER -123.86 56.29 10.54 Favored Pre-proline 3 CA--C 1.118 -15.651 1 CA-C-O 137.837 8.446 . . . . 9.59 118.221 176.551 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PRO . . . . . 1.53 ' CD ' ' CG ' ' A' ' 114' ' ' PRO 0.265 0.0 OUTLIER -78.16 23.86 0.57 Allowed 'Trans proline' 3 CA--C 1.104 -21.008 1 O-C-N 102.618 -9.727 . . . . 10.2 109.29 -174.838 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . 1.406 ' OG1' ' CB ' ' A' ' 115' ' ' THR 0.743 1.3 p -97.63 -42.93 7.42 Favored 'General case' 2 C--O 0.97 -13.626 3 O-C-N 93.013 -18.554 . . . . 10.62 109.345 176.291 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASN . . . . . 1.526 ' CA ' ' N ' ' A' ' 116' ' ' ASN 0.449 11.0 m120 -88.13 -17.4 31.06 Favored 'General case' 2 N--CA 1.691 11.601 3 C-N-CA 147.294 10.238 . . . . 11.13 103.474 -174.181 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PHE . . . . . 0.445 ' N ' ' N ' ' A' ' 116' ' ' ASN 0.301 1.1 t80 -103.02 71.26 1.12 Allowed 'General case' 3 C--O 0.922 -16.173 2 CA-C-O 141.047 9.975 . . . . 13.06 132.565 177.137 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . 1.363 ' CB ' ' CG2' ' A' ' 118' ' ' THR 0.371 0.0 OUTLIER -54.88 149.95 21.07 Favored Pre-proline 3 C--O 1.369 7.377 4 N-CA-C 134.192 8.59 . . . . 13.7 134.192 168.445 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PRO . . . . . 1.547 ' CA ' ' CB ' ' A' ' 119' ' ' PRO 0.338 16.4 Cg_exo -63.38 -43.43 18.03 Favored 'Trans proline' 2 N--CA 1.658 11.187 3 CA-C-O 91.178 -12.092 . . . . 14.36 103.272 -179.474 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ALA . . . . . 1.451 ' N ' ' C ' ' A' ' 119' ' ' PRO 0.358 . . -67.72 -49.92 60.11 Favored 'General case' 3 C--N 1.693 15.52 3 CA-C-O 85.591 -16.433 . . . . 15.35 110.304 166.521 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . 1.112 0.8 OUTLIER -42.7 -38.19 0.84 Allowed 'Isoleucine or valine' 2 N--CA 1.265 -9.714 3 CA-C-N 168.607 23.367 . . . . 15.73 110.557 179.99 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HIS . . . . . 1.501 ' CA ' ' C ' ' A' ' 122' ' ' HIS 1.173 0.1 OUTLIER -64.34 -37.53 87.83 Favored 'General case' 4 C--O 1.489 13.677 1 C-N-CA 134.874 5.269 . . . . 15.49 113.536 -176.151 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . 0.791 ' N ' ' CA ' ' A' ' 122' ' ' HIS 0.379 . . -82.05 -42.0 19.85 Favored 'General case' 2 C--N 1.129 -8.995 2 CA-C-O 134.766 6.984 . . . . 13.62 117.756 -178.761 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . 1.405 ' CB ' ' CG ' ' A' ' 124' ' ' ASN 0.738 0.0 OUTLIER -60.07 -56.37 22.5 Favored 'General case' 2 C--O 1.76 27.968 2 O-C-N 110.129 -7.857 . . . . 14.56 106.929 170.367 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . 0.431 38.2 mt -44.52 -47.0 10.11 Favored 'General case' 4 C--O 0.935 -15.474 3 CA-C-N 134.664 7.938 . . . . 13.84 131.168 166.24 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASN . . . . . 1.471 ' C ' ' CA ' ' A' ' 126' ' ' ASN 0.674 3.3 t-20 -51.65 -51.03 59.04 Favored 'General case' 2 C--O 1.495 14.011 2 C-N-CA 136.962 6.105 . . . . 13.5 98.529 -173.895 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . 1.588 ' CD ' ' CE ' ' A' ' 127' ' ' LYS 0.328 30.9 ttmt -75.46 -79.83 0.09 Allowed 'General case' 3 C--O 1.631 21.151 3 CA-C-O 73.96 -21.972 . . . . 12.23 103.12 179.824 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PHE . . . . . 1.579 ' CE1' ' CD1' ' A' ' 128' ' ' PHE 0.254 25.3 t80 -23.24 -63.64 0.04 OUTLIER 'General case' 4 C--N 0.815 -22.643 3 O-C-N 149.146 16.529 . . . . 14.06 107.19 -176.744 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . 0.374 16.6 mt -54.82 -34.69 63.1 Favored 'General case' 4 C--O 1.033 -10.332 3 CA-C-O 106.933 -6.27 . . . . 13.99 109.046 -170.928 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . 0.811 . . -40.63 -60.9 1.03 Allowed 'General case' 3 C--O 0.964 -13.961 3 O-C-N 142.038 12.086 . . . . 14.96 106.532 170.224 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASN . . . . . 1.192 ' CA ' ' N ' ' A' ' 131' ' ' ASN 0.906 2.2 t-20 -71.73 -46.59 58.11 Favored 'General case' 3 N--CA 2.052 29.659 2 CA-C-N 89.016 -12.811 . . . . 16.33 95.02 -179.605 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ASP . . . . . 1.099 ' CG ' ' OD2' ' A' ' 132' ' ' ASP 1.299 5.7 t70 -35.94 -79.57 0.01 OUTLIER 'General case' 4 C--O 1.398 8.885 3 O-C-N 97.936 -15.478 . . . . 14.76 109.438 168.772 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . 0.272 0.1 OUTLIER -46.97 -49.65 20.36 Favored 'General case' 3 C--O 1.071 -8.338 3 CA-C-O 138.638 8.828 . . . . 14.84 107.061 -168.688 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . 0.347 29.1 m -73.06 -59.28 2.78 Favored 'General case' 4 CA--C 1.732 7.947 5 O-C-N 89.708 -20.62 . . . . 13.76 90.123 -169.747 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . 1.491 ' C ' ' CA ' ' A' ' 135' ' ' VAL 0.413 0.8 OUTLIER -46.52 -67.19 0.13 Allowed 'Isoleucine or valine' 3 CA--C 1.774 9.593 1 CA-C-N 142.295 11.407 . . . . 13.41 118.668 -179.898 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . 1.562 ' CD1' ' CG ' ' A' ' 136' ' ' LEU 0.577 0.0 OUTLIER -60.33 9.73 0.02 OUTLIER 'General case' 3 C--O 1.436 10.891 5 CA-C-O 147.371 12.986 . . . . 12.66 135.312 170.868 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' THR . . . . . 1.602 ' CA ' ' CB ' ' A' ' 137' ' ' THR 0.72 0.5 OUTLIER -109.73 -20.82 12.67 Favored 'General case' 3 N--CA 1.116 -17.139 3 O-C-N 106.898 -9.876 . . . . 14.43 111.086 179.21 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' SER . . . . . 1.42 ' CB ' ' OG ' ' A' ' 138' ' ' SER 0.5 0.7 OUTLIER -28.45 -60.63 0.12 Allowed 'General case' 4 C--O 1.425 10.313 3 CA-C-O 84.184 -17.103 . . . . 14.32 90.222 -177.931 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LYS . . . . . 1.57 ' CE ' ' CD ' ' A' ' 139' ' ' LYS 1.22 0.0 OUTLIER -25.94 -76.14 0.02 OUTLIER 'General case' 2 C--O 1.589 18.949 3 CA-C-N 139.568 10.167 . . . . 14.88 108.86 -172.506 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' TYR . . . . . 1.636 ' CG ' ' CB ' ' A' ' 140' ' ' TYR 0.708 1.6 m-85 -21.75 -81.19 0.01 OUTLIER 'General case' 3 N--CA 1.312 -7.368 1 CA-C-O 131.607 5.48 . . . . 17.76 119.171 165.841 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ARG . . . . . 1.47 ' NH2' ' CZ ' ' A' ' 141' ' ' ARG 0.543 3.5 ttt180 . . . . . 2 CA--C 1.945 16.172 2 N-CA-C 128.06 6.319 . . . . 21.0 128.06 171.572 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . 1.468 ' CG ' ' CD1' ' B' ' 77' ' ' LEU 1.085 6.0 mmt . . . . . 2 N--CA 2.104 32.248 2 CA-C-O 86.204 -16.141 . . . . 13.09 88.659 . . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LEU . . . . . 1.506 ' CA ' ' CB ' ' B' ' 2' ' ' LEU 0.686 0.0 OUTLIER -169.5 -140.0 0.03 OUTLIER 'General case' 4 C--N 0.982 -15.383 3 CA-C-N 141.299 10.954 . . . . 13.28 101.689 -174.186 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' THR . . . . . 1.28 ' CG2' ' CB ' ' B' ' 5' ' ' GLU 0.492 0.4 OUTLIER -68.18 164.44 20.46 Favored 'General case' 1 CA--C 1.638 4.327 3 O-C-N 133.347 6.655 . . . . 12.32 100.795 178.727 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ALA . . . . . 1.532 ' CA ' ' N ' ' B' ' 4' ' ' ALA 0.717 . . -85.93 -7.57 58.59 Favored 'General case' 3 C--O 0.817 -21.679 2 O-C-N 108.34 -8.975 . . . . 11.28 103.62 -170.763 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLU . . . . . 1.296 ' CA ' ' N ' ' B' ' 5' ' ' GLU 0.765 0.4 OUTLIER -78.98 -22.53 45.44 Favored 'General case' 2 N--CA 1.925 23.309 4 O-C-N 153.352 19.158 . . . . 11.49 95.988 -177.623 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLU . . . . . 1.489 ' CB ' ' CA ' ' B' ' 6' ' ' GLU 0.366 1.5 mt-10 -113.38 -81.48 0.59 Allowed 'General case' 4 N--CA 1.786 16.329 3 CA-C-O 88.593 -15.003 . . . . 14.36 100.563 -178.164 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LYS . . . . . 1.291 ' CA ' ' C ' ' B' ' 7' ' ' LYS 0.341 0.0 OUTLIER -23.16 -28.3 0.0 OUTLIER 'General case' 3 CA--C 2.009 18.599 3 CA-C-N 146.518 13.326 . . . . 12.04 127.074 161.72 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ALA . . . . . 1.511 ' CB ' ' CA ' ' B' ' 8' ' ' ALA 0.425 . . -49.46 -67.99 0.22 Allowed 'General case' 4 C--O 1.102 -6.67 3 CA-C-O 99.614 -9.755 . . . . 13.7 108.82 166.538 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ALA . . . . . 0.712 ' C ' ' CA ' ' B' ' 10' ' ' VAL 0.304 . . -39.49 -68.79 0.15 Allowed 'General case' 2 C--N 1.465 5.598 2 C-N-CA 169.949 19.299 . . . . 13.24 106.377 155.422 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' VAL . . . . . 1.613 ' CG1' ' CD2' ' B' ' 128' ' ' LEU . 25.6 m -76.13 -24.44 16.37 Favored 'Isoleucine or valine' 2 N--CA 1.832 18.659 2 O-C-N 130.128 4.642 . . . . 13.36 121.106 172.319 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' THR . . . . . 1.604 ' CA ' ' CB ' ' B' ' 11' ' ' THR 0.369 17.3 m -60.25 -36.04 76.87 Favored 'General case' 3 C--O 0.798 -22.667 0 N-CA-C 121.122 3.749 . . . . 15.72 121.122 164.523 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLY . . . . . 1.106 ' N ' ' O ' ' B' ' 11' ' ' THR . . . -82.83 -58.59 2.34 Favored Glycine 3 C--O 1.499 16.659 3 CA-C-O 148.582 15.546 . . . . 15.04 105.913 -172.189 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' PHE . . . . . 1.502 ' C ' ' CA ' ' B' ' 13' ' ' PHE . 0.5 OUTLIER -68.86 -18.36 64.13 Favored 'General case' 3 CA--C 1.793 10.298 3 O-C-N 103.283 -11.716 . . . . 14.99 100.682 178.171 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' TRP . . . . . 0.846 ' NE1' ' OD1' ' B' ' 68' ' ' ASP 0.593 23.3 t-105 -58.89 -74.62 0.06 Allowed 'General case' 2 C--O 0.936 -15.444 2 CA-C-O 147.051 12.834 . . . . 15.96 106.546 -174.314 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLY . . . . . 1.103 ' O ' ' C ' ' B' ' 15' ' ' GLY . . . -10.95 -64.73 0.01 OUTLIER Glycine 4 C--O 1.887 40.93 3 O-C-N 101.404 -13.31 . . . . 16.03 112.333 161.395 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . 1.594 ' CD ' ' CE ' ' B' ' 16' ' ' LYS 0.315 0.1 OUTLIER -54.81 -8.52 0.26 Allowed 'General case' 3 CA--C 1.22 -11.735 3 CA-C-O 146.915 12.769 . . . . 15.65 119.187 173.131 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' VAL . . . . . 1.512 ' C ' ' CA ' ' B' ' 17' ' ' VAL 0.452 56.0 t -45.21 111.48 0.09 OUTLIER 'Isoleucine or valine' 2 C--O 1.628 20.975 3 O-C-N 73.526 -30.734 . . . . 15.82 113.034 153.561 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASP . . . . . 1.458 ' CB ' ' CG ' ' B' ' 18' ' ' ASP 0.371 1.9 t70 -79.4 46.7 0.76 Allowed 'General case' 2 C--O 1.046 -9.657 1 CA-C-O 107.047 -6.215 . . . . 14.97 117.228 -176.297 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' VAL . . . . . 1.539 ' CB ' ' CA ' ' B' ' 19' ' ' VAL 0.347 0.3 OUTLIER 6.2 -59.5 0.0 OUTLIER 'Isoleucine or valine' 2 CA--C 1.345 -6.915 2 CA-C-O 107.569 -5.967 . . . . 14.46 119.934 175.946 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASP . . . . . 1.269 ' CG ' ' OD1' ' B' ' 20' ' ' ASP 0.426 31.7 p-10 -56.3 53.56 0.0 OUTLIER 'General case' 4 C--N 0.917 -18.208 2 CA-C-N 133.961 7.619 . . . . 16.13 124.163 168.991 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' VAL . . . . . 1.595 ' CB ' ' CA ' ' B' ' 21' ' ' VAL 1.15 21.9 t 132.08 -11.79 0.0 OUTLIER 'Isoleucine or valine' 3 CA--C 1.294 -8.877 4 O-C-N 80.593 -26.317 . . . . 15.25 97.147 -168.034 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . 1.509 ' CB ' ' CG2' ' B' ' 22' ' ' VAL 0.528 0.4 OUTLIER -82.7 -34.63 11.85 Favored 'Isoleucine or valine' 1 CA--C 1.93 15.559 4 N-CA-C 78.561 -12.014 . . . . 14.41 78.561 172.706 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . 1.377 ' CA ' ' N ' ' B' ' 23' ' ' GLY . . . -96.75 -17.99 31.35 Favored Glycine 3 N--CA 1.845 25.926 4 C-N-CA 92.695 -14.098 . . . . 14.9 101.135 -175.713 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . 1.518 ' CA ' ' N ' ' B' ' 24' ' ' ALA 1.284 . . -54.14 -40.57 67.54 Favored 'General case' 3 N--CA 1.683 11.205 2 CA-C-O 135.467 7.318 . . . . 14.18 117.046 175.335 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLN . . . . . 1.513 ' N ' ' CA ' ' B' ' 25' ' ' GLN 0.757 0.0 OUTLIER -76.06 -65.18 0.95 Allowed 'General case' 3 N--CA 1.685 11.276 3 CA-C-N 96.266 -9.515 . . . . 14.55 98.846 -179.201 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . 1.535 ' C ' ' CA ' ' B' ' 26' ' ' ALA 0.372 . . -59.51 -42.97 93.45 Favored 'General case' 4 C--N 0.994 -14.879 3 CA-C-O 101.657 -8.782 . . . . 13.58 100.705 -164.472 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' LEU . . . . . 0.753 ' N ' ' CA ' ' B' ' 26' ' ' ALA 0.521 0.0 OUTLIER -73.72 -47.11 41.76 Favored 'General case' 4 C--O 1.489 13.691 1 O-C-N 148.076 15.86 . . . . 13.27 106.759 171.08 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLY . . . . . 0.554 ' CA ' ' O ' ' B' ' 24' ' ' ALA . . . -40.07 -85.31 0.01 OUTLIER Glycine 2 C--N 1.146 -10.022 2 CA-C-O 93.293 -15.17 . . . . 13.98 111.256 175.242 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ARG . . . . . 0.404 ' N ' ' O ' ' B' ' 25' ' ' GLN 0.407 1.3 mpp_? -53.04 -32.03 44.55 Favored 'General case' 3 C--O 0.936 -15.42 3 O-C-N 148.522 14.895 . . . . 16.89 126.209 163.983 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . 0.394 0.7 OUTLIER -41.04 -47.15 3.05 Favored 'General case' 4 N--CA 1.347 -5.609 4 CA-C-O 145.607 12.146 . . . . 16.45 109.973 171.438 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . 1.583 ' CG ' ' CD1' ' B' ' 31' ' ' LEU 0.923 0.2 OUTLIER -44.0 -75.76 0.03 OUTLIER 'General case' 2 C--N 1.585 10.835 2 CA-C-N 98.075 -8.693 . . . . 17.22 108.934 167.711 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' VAL . . . . . 1.355 ' N ' ' CA ' ' B' ' 32' ' ' VAL 0.678 2.3 p -103.94 95.74 4.07 Favored 'Isoleucine or valine' 4 N--CA 1.895 21.777 4 C-N-CA 86.541 -14.063 . . . . 15.6 96.213 -173.005 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' VAL . . . . . 0.669 ' C ' ' CD ' ' B' ' 35' ' ' PRO 0.657 25.0 t 165.29 -56.04 0.0 OUTLIER 'Isoleucine or valine' 4 C--O 1.014 -11.298 5 O-C-N 84.984 -23.573 . . . . 14.66 90.529 -167.403 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' TYR . . . . . 1.696 ' CE2' ' CZ ' ' B' ' 34' ' ' TYR 1.026 0.1 OUTLIER -105.68 55.79 0.14 Allowed Pre-proline 3 N--CA 1.772 15.657 5 CA-C-N 143.988 12.176 . . . . 15.77 96.719 -175.61 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' B' ' 34' ' ' TYR 0.356 52.5 Cg_exo -42.94 -21.0 0.18 Allowed 'Trans proline' 3 C--N 1.118 -11.587 4 C-N-CA 146.968 18.445 . . . . 14.45 120.762 -172.282 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' TRP . . . . . 1.609 ' CD2' ' CG ' ' B' ' 36' ' ' TRP . 31.0 p90 -78.46 -36.55 45.18 Favored 'General case' 2 C--O 0.978 -13.214 2 O-C-N 102.56 -12.588 . . . . 14.07 112.722 -178.85 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' THR . . . . . 1.549 ' N ' ' CA ' ' B' ' 37' ' ' THR 0.279 0.8 OUTLIER -55.7 -21.85 20.49 Favored 'General case' 3 N--CA 1.687 11.388 3 CA-C-O 152.693 15.521 . . . . 14.24 112.901 175.833 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLN . . . . . 1.288 ' C ' ' CA ' ' B' ' 38' ' ' GLN 0.362 0.0 OUTLIER -74.36 13.66 0.55 Allowed 'General case' 3 C--O 0.823 -21.382 3 O-C-N 88.291 -21.506 . . . . 16.95 96.559 -162.405 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ARG . . . . . 1.351 ' CB ' ' CG ' ' B' ' 39' ' ' ARG 0.283 0.0 OUTLIER -105.48 -41.07 5.59 Favored 'General case' 4 C--O 0.958 -14.282 2 CA-C-O 141.748 10.308 . . . . 13.66 119.611 -169.695 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' PHE . . . . . 1.502 ' C ' ' CA ' ' B' ' 40' ' ' PHE 0.53 71.3 m-85 -77.88 -20.95 52.05 Favored 'General case' 3 C--O 1.524 15.547 2 CA-C-N 95.096 -10.047 . . . . 12.37 94.424 178.125 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' PHE . . . . . 1.619 ' CZ ' ' CE1' ' B' ' 41' ' ' PHE . 0.0 OUTLIER -137.18 89.54 2.44 Favored 'General case' 4 C--O 0.743 -25.555 2 C-N-CA 101.914 -7.914 . . . . 11.94 124.973 178.59 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLN . . . . . 1.451 ' CD ' ' NE2' ' B' ' 42' ' ' GLN 0.515 0.0 OUTLIER -95.13 -1.96 50.9 Favored 'General case' 3 C--N 1.854 22.542 3 CA-C-N 89.993 -12.367 . . . . 12.31 104.295 175.407 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' HIS . . . . . 1.519 ' C ' ' CA ' ' B' ' 43' ' ' HIS 0.466 61.4 t60 96.42 -50.02 0.01 OUTLIER 'General case' 4 C--N 1.934 26.001 4 O-C-N 90.405 -20.184 . . . . 14.92 84.122 16.649 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PHE . . . . . 1.227 ' CE1' ' CD2' ' B' ' 41' ' ' PHE 0.286 10.5 m-85 -139.47 -84.5 0.25 Allowed 'General case' 2 C--N 1.479 6.226 2 O-C-N 135.762 8.164 . . . . 12.88 103.861 175.66 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLY . . . . . 1.554 ' N ' ' CA ' ' B' ' 45' ' ' GLY . . . 177.72 -102.74 0.17 Allowed Glycine 4 C--O 1.692 28.751 2 C-N-CA 98.688 -11.244 . . . . 13.97 87.71 177.4 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASN . . . . . 1.426 ' CA ' ' CB ' ' B' ' 46' ' ' ASN 0.449 1.4 m120 -51.75 65.98 0.0 OUTLIER 'General case' 2 C--N 0.923 -17.95 1 N-CA-C 128.134 6.346 . . . . 14.83 128.134 -178.765 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LEU . . . . . 0.873 ' O ' ' NE2' ' B' ' 38' ' ' GLN 0.87 0.2 OUTLIER -110.78 29.37 7.81 Favored 'General case' 3 C--O 1.392 8.564 1 CA-C-O 129.302 4.382 . . . . 16.85 105.408 173.204 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' SER . . . . . . . . . . . . 0.606 8.5 t -108.27 26.95 9.83 Favored 'General case' 3 C--O 1.378 7.834 2 C-N-CA 104.501 -6.88 . . . . 16.47 95.022 -174.459 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' SER . . . . . 1.507 ' C ' ' CA ' ' B' ' 49' ' ' SER 0.439 19.5 t -146.0 157.06 43.87 Favored 'General case' 2 C--O 1.749 27.38 2 CA-C-O 94.309 -12.281 . . . . 16.63 107.907 176.673 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ALA . . . . . 0.44 ' O ' ' C ' ' B' ' 51' ' ' GLY 0.607 . . -88.03 -45.85 9.84 Favored 'General case' 0 C--N 1.3 -1.55 4 CA-C-N 146.05 13.114 . . . . 16.53 91.639 -169.535 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' GLY . . . . . 0.44 ' C ' ' O ' ' B' ' 50' ' ' ALA . . . -47.9 -66.8 1.82 Allowed Glycine 4 C--O 1.405 10.807 5 CA-C-O 158.901 21.279 . . . . 16.45 93.303 -156.971 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ALA . . . . . 1.476 ' CA ' ' N ' ' B' ' 52' ' ' ALA 0.571 . . -34.4 -79.38 0.01 OUTLIER 'General case' 4 N--CA 1.754 14.727 4 CA-C-N 87.938 -14.131 . . . . 15.98 98.352 -170.666 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' VAL . . . . . 1.211 ' C ' ' CA ' ' B' ' 54' ' ' MET . 10.8 p -48.0 -33.9 4.15 Favored 'Isoleucine or valine' 3 C--O 1.428 10.474 4 CA-C-N 93.66 -10.7 . . . . 16.0 101.725 -160.557 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' MET . . . . . 1.482 ' CA ' ' N ' ' B' ' 54' ' ' MET 0.508 0.0 OUTLIER -70.02 -44.39 69.37 Favored 'General case' 3 N--CA 1.715 12.812 3 C-N-CA 94.192 -11.003 . . . . 13.7 130.909 -168.294 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ASN . . . . . 1.337 ' O ' ' NZ ' ' B' ' 60' ' ' LYS 0.602 0.4 OUTLIER -72.73 -43.79 62.52 Favored 'General case' 4 CA--C 2.073 21.081 2 C-N-CA 162.966 16.506 . . . . 13.79 123.136 -175.603 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASN . . . . . 1.329 ' N ' ' C ' ' B' ' 55' ' ' ASN 0.666 0.1 OUTLIER -29.05 49.1 0.0 OUTLIER Pre-proline 2 C--O 0.781 -23.571 3 CA-C-N 81.534 -16.212 . . . . 14.77 104.99 164.769 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' PRO . . . . . 1.5 ' N ' ' CD ' ' B' ' 57' ' ' PRO . 9.6 Cg_endo 12.05 -46.41 0.0 OUTLIER 'Trans proline' 4 C--N 1.625 15.123 4 C-N-CA 142.799 15.666 . . . . 14.77 100.386 173.098 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' LYS . . . . . 1.519 ' CB ' ' CG ' ' B' ' 58' ' ' LYS 0.47 0.0 OUTLIER -70.29 -51.22 31.97 Favored 'General case' 3 N--CA 1.151 -15.42 2 O-C-N 141.028 11.455 . . . . 13.49 121.416 -174.978 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' VAL . . . . . 1.522 ' CB ' ' CG1' ' B' ' 59' ' ' VAL 0.735 0.5 OUTLIER -71.52 -38.66 68.75 Favored 'Isoleucine or valine' 3 C--O 1.703 24.933 5 CA-C-O 88.752 -14.928 . . . . 15.92 92.659 -177.899 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LYS . . . . . 1.391 ' NZ ' ' CE ' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -34.53 -78.91 0.02 OUTLIER 'General case' 1 CA--C 1.693 6.444 3 O-C-N 141.836 11.96 . . . . 18.25 120.839 166.074 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ALA . . . . . 0.45 ' C ' ' CA ' ' B' ' 62' ' ' HIS 0.25 . . -32.51 -42.37 0.07 Allowed 'General case' 3 CA--C 1.256 -10.349 2 C-N-CA 139.62 7.168 . . . . 18.18 113.779 171.843 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' HIS . . . . . 1.487 ' ND1' ' CG ' ' B' ' 62' ' ' HIS . 6.1 t60 -54.81 -67.1 0.3 Allowed 'General case' 3 N--CA 1.738 13.97 2 CA-C-N 106.081 -5.054 . . . . 18.05 99.918 -179.687 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . -68.15 -19.38 72.04 Favored Glycine 2 C--O 0.903 -20.54 5 C-N-CA 140.674 8.749 . . . . 16.74 125.425 -162.691 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LYS . . . . . 1.618 ' CG ' ' CD ' ' B' ' 64' ' ' LYS 0.512 0.0 OUTLIER -76.6 -78.56 0.12 Allowed 'General case' 3 CA--C 1.242 -10.898 4 C-N-CA 164.859 17.264 . . . . 16.8 86.834 -151.68 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ARG . . . . . 1.519 ' CA ' ' N ' ' B' ' 65' ' ' ARG 0.434 0.0 OUTLIER -73.92 -38.27 64.36 Favored 'General case' 3 C--O 1.532 15.955 3 CA-C-O 87.929 -15.32 . . . . 13.34 102.097 163.71 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . 1.531 ' CB ' ' CG1' ' B' ' 66' ' ' VAL 0.642 0.1 OUTLIER -64.01 30.07 0.0 OUTLIER 'Isoleucine or valine' 2 C--O 1.465 12.423 3 CA-C-N 157.52 18.327 . . . . 11.9 105.151 178.584 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . 0.783 ' C ' ' CG2' ' B' ' 71' ' ' THR 0.556 5.4 tp -174.7 -142.08 0.02 OUTLIER 'General case' 2 C--N 1.033 -13.183 4 CA-C-O 68.17 -24.729 . . . . 11.13 110.665 -154.764 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ASP . . . . . 1.641 ' CA ' ' CG2' ' B' ' 71' ' ' THR 0.764 0.5 OUTLIER -37.64 71.95 0.0 OUTLIER 'General case' 2 C--N 1.187 -6.493 3 CA-C-O 92.883 -12.961 . . . . 11.42 115.785 -153.353 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ALA . . . . . 1.423 ' CB ' ' N ' ' B' ' 69' ' ' ALA 0.65 . . 109.32 -38.44 0.01 OUTLIER 'General case' 3 N--CA 1.177 -14.076 4 C-N-CA 169.282 19.033 . . . . 12.4 128.263 -74.364 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' PHE . . . . . 1.642 ' CZ ' ' CE2' ' B' ' 70' ' ' PHE 0.543 0.0 OUTLIER -85.92 -69.29 0.67 Allowed 'General case' 2 N--CA 1.67 10.549 3 CA-C-O 170.3 23.905 . . . . 13.29 110.634 160.068 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' THR . . . . . 1.641 ' CG2' ' CA ' ' B' ' 68' ' ' ASP 0.764 0.4 OUTLIER -78.14 66.44 3.75 Favored 'General case' 3 N--CA 0.847 -30.579 3 O-C-N 77.592 -28.193 . . . . 13.14 107.48 175.94 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLN . . . . . 1.484 ' CA ' ' N ' ' B' ' 72' ' ' GLN 0.557 0.0 OUTLIER 170.82 21.01 0.0 OUTLIER 'General case' 2 N--CA 1.698 11.971 2 C-N-CA 166.943 18.097 . . . . 14.78 100.212 -177.51 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' B' ' 74' ' ' LEU . . . -78.97 -78.26 0.85 Allowed Glycine 4 C--N 0.997 -18.268 4 CA-C-O 100.3 -11.278 . . . . 14.25 107.351 -173.398 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LEU . . . . . 1.505 ' CB ' ' CG ' ' B' ' 74' ' ' LEU 0.483 0.0 OUTLIER -55.09 -155.24 0.0 OUTLIER 'General case' 2 C--O 1.399 8.951 4 O-C-N 160.46 21.918 . . . . 15.22 129.632 163.716 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LYS . . . . . 1.491 ' CG ' ' CD ' ' B' ' 75' ' ' LYS 0.935 0.0 OUTLIER 79.43 -125.34 0.02 OUTLIER 'General case' 3 N--CA 2.07 30.53 3 CA-C-N 152.917 16.235 . . . . 15.38 75.565 -166.708 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' HIS . . . . . 1.471 ' CA ' ' N ' ' B' ' 76' ' ' HIS 1.213 19.7 m80 -39.49 -110.17 0.0 OUTLIER 'General case' 3 N--CA 1.735 13.821 4 O-C-N 140.646 11.216 . . . . 16.87 110.812 172.892 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LEU . . . . . 1.594 ' CA ' ' CB ' ' B' ' 77' ' ' LEU 1.051 0.3 OUTLIER 47.06 23.17 0.26 Allowed 'General case' 3 CA--C 1.289 -9.062 5 CA-C-N 167.8 23.0 . . . . 17.2 130.9 -152.436 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASP . . . . . 1.334 ' OD2' ' CG ' ' B' ' 78' ' ' ASP 1.014 32.2 t70 75.69 167.44 0.27 Allowed 'General case' 4 C--O 0.994 -12.388 4 O-C-N 79.985 -26.697 . . . . 17.59 106.446 2.998 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASP . . . . . 1.244 ' O ' ' C ' ' B' ' 79' ' ' ASP 0.909 7.9 t70 -53.27 102.57 0.06 Allowed 'General case' 3 C--O 1.755 27.685 5 CA-C-O 159.312 18.672 . . . . 17.29 83.323 -173.583 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . 1.518 ' CD2' ' CG ' ' B' ' 80' ' ' LEU 0.769 0.5 OUTLIER -127.58 -146.59 0.33 Allowed 'General case' 3 C--O 1.548 16.805 2 O-C-N 83.151 -24.718 . . . . 15.56 101.202 -0.184 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' LYS . . . . . 1.413 ' N ' ' C ' ' B' ' 80' ' ' LEU 1.137 0.8 OUTLIER 23.04 89.39 0.01 OUTLIER 'General case' 3 C--N 1.71 16.281 4 O-C-N 95.058 -17.276 . . . . 13.54 88.261 16.177 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' GLY . . . . . 0.599 ' O ' ' CB ' ' B' ' 85' ' ' ALA . . . 173.99 -72.61 0.09 OUTLIER Glycine 4 C--O 1.552 19.999 4 CA-C-N 139.617 10.189 . . . . 10.98 94.028 -162.155 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' ALA . . . . . 1.497 ' CB ' ' CA ' ' B' ' 83' ' ' ALA 0.737 . . -74.54 -89.28 0.03 OUTLIER 'General case' 4 C--N 0.937 -17.359 3 C-N-CA 157.612 14.365 . . . . 8.33 91.469 -147.061 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' PHE . . . . . 1.649 ' CB ' ' CG ' ' B' ' 84' ' ' PHE 0.452 0.3 OUTLIER -44.76 -46.31 10.43 Favored 'General case' 0 CA--C 1.426 -3.796 4 C-N-CA 161.014 15.726 . . . . 10.02 100.561 161.332 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . 0.599 ' CB ' ' O ' ' B' ' 82' ' ' GLY 0.369 . . 16.91 -77.86 0.0 OUTLIER 'General case' 3 C--N 1.508 7.5 3 CA-C-N 133.898 7.59 . . . . 11.82 122.426 170.128 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' GLN . . . . . 1.567 ' CB ' ' CG ' ' B' ' 86' ' ' GLN 0.686 58.7 tt0 152.22 -79.24 0.0 OUTLIER 'General case' 2 N--CA 1.32 -6.942 3 C-N-CA 159.153 14.981 . . . . 12.69 109.541 -7.199 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LEU . . . . . 1.53 ' C ' ' CA ' ' B' ' 87' ' ' LEU 0.31 0.0 OUTLIER -79.57 -17.55 53.7 Favored 'General case' 4 CA--C 1.764 9.184 2 CA-C-O 89.302 -14.666 . . . . 14.2 83.304 172.48 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' SER . . . . . 0.783 ' OG ' ' CB ' ' B' ' 143' ' ' LYS 0.477 0.2 OUTLIER -30.21 -55.99 0.19 Allowed 'General case' 4 CA--C 1.258 -10.255 3 CA-C-N 159.898 19.408 . . . . 15.37 104.388 158.583 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 87' ' ' LEU . . . -30.94 -79.97 0.01 OUTLIER Glycine 2 C--N 1.47 8.002 2 C-N-CA 144.729 10.68 . . . . 14.83 98.711 -161.929 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . 0.533 52.9 tp -53.02 -56.81 13.26 Favored 'General case' 3 C--O 1.077 -7.981 3 C-N-CA 146.783 10.033 . . . . 14.1 104.23 -170.859 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' HIS . . . . . 0.581 ' C ' ' OH ' ' B' ' 144' ' ' TYR 0.395 12.6 m80 -57.98 -52.81 63.98 Favored 'General case' 2 C--O 1.429 10.548 2 O-C-N 131.78 5.675 . . . . 13.25 109.345 179.739 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' CYS . . . . . 1.22 ' SG ' ' CB ' ' B' ' 92' ' ' CYS 0.421 0.0 OUTLIER -81.2 -31.34 33.98 Favored 'General case' 0 CA--C 1.62 3.647 1 CA-C-O 89.196 -14.716 . . . . 13.69 103.228 176.358 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ASN . . . . . 1.464 ' CB ' ' CG ' ' B' ' 93' ' ' ASN 0.664 3.0 m-80 -35.64 -87.57 0.0 OUTLIER 'General case' 3 C--N 1.636 13.058 3 O-C-N 147.273 15.358 . . . . 16.59 134.888 161.792 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LYS . . . . . 1.563 ' CD ' ' CG ' ' B' ' 94' ' ' LYS 0.532 0.0 OUTLIER -132.34 4.85 4.04 Favored 'General case' 3 C--N 1.142 -8.414 3 C-N-CA 93.558 -11.257 . . . . 16.81 100.232 -172.213 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LEU . . . . . 1.462 ' CA ' ' CB ' ' B' ' 95' ' ' LEU 1.706 0.9 OUTLIER -68.87 -89.98 0.01 OUTLIER 'General case' 3 N--CA 1.807 17.386 2 N-CA-C 92.373 -6.899 . . . . 17.55 92.373 178.899 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' HIS . . . . . 1.443 ' NE2' ' CE1' ' B' ' 96' ' ' HIS 0.263 9.2 m-70 91.92 75.8 0.0 OUTLIER 'General case' 2 CA--C 1.188 -12.949 3 C-N-CA 159.848 15.259 . . . . 16.03 117.558 169.046 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' VAL . . . . . 1.581 ' CB ' ' CA ' ' B' ' 97' ' ' VAL . 0.2 OUTLIER -75.24 156.63 6.08 Favored 'Isoleucine or valine' 1 C--O 1.494 13.943 2 O-C-N 90.054 -20.404 . . . . 16.15 105.097 -176.526 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ASN . . . . . 1.421 ' CG ' ' ND2' ' B' ' 98' ' ' ASN 0.981 0.1 OUTLIER -86.47 152.21 54.49 Favored Pre-proline 2 C--N 1.48 6.244 2 C-N-CA 134.758 5.223 . . . . 17.13 103.843 174.51 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' PRO . . . . . 1.342 ' CG ' ' CD ' ' B' ' 99' ' ' PRO 0.69 0.0 OUTLIER -69.96 -6.44 18.71 Favored 'Trans proline' 3 C--O 1.44 10.606 0 CA-C-O 126.95 2.813 . . . . 16.66 115.269 -176.605 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLN . . . . . 0.486 ' N ' ' C ' ' B' ' 98' ' ' ASN 0.791 24.9 tp60 -81.49 -60.17 2.36 Favored 'General case' 1 C--N 1.615 12.148 5 CA-C-N 102.065 -6.879 . . . . 16.28 97.301 -168.696 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ASN . . . . . 1.448 ' C ' ' CA ' ' B' ' 101' ' ' ASN . 3.3 m120 -65.86 -16.39 63.79 Favored 'General case' 2 CA--C 1.847 12.389 3 CA-C-O 98.966 -10.064 . . . . 16.51 107.706 -175.589 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' PHE . . . . . 1.61 ' CG ' ' CD1' ' B' ' 102' ' ' PHE 0.593 1.3 m-85 -53.99 -40.73 67.21 Favored 'General case' 3 CA--C 1.221 -11.677 2 O-C-N 138.096 9.622 . . . . 17.03 119.963 170.369 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . 1.589 ' CB ' ' CG ' ' B' ' 103' ' ' ARG 0.547 4.6 mmt180 -78.99 -38.46 36.73 Favored 'General case' 2 N--CA 1.085 -18.707 3 O-C-N 87.788 -21.82 . . . . 16.95 108.567 -177.303 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LEU . . . . . 1.502 ' CA ' ' N ' ' B' ' 104' ' ' LEU 0.779 0.3 OUTLIER -56.79 -69.68 0.15 Allowed 'General case' 3 N--CA 1.739 13.985 3 CA-C-O 104.248 -7.549 . . . . 17.15 113.669 164.7 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LEU . . . . . 1.396 ' C ' ' CA ' ' B' ' 105' ' ' LEU 0.729 1.0 OUTLIER -29.48 -63.39 0.12 Allowed 'General case' 4 CA--C 1.867 13.136 4 C-N-CA 147.62 10.368 . . . . 16.86 99.552 164.95 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' GLY . . . . . 1.478 ' C ' ' CA ' ' B' ' 106' ' ' GLY . . . -49.07 -28.1 7.53 Favored Glycine 3 N--CA 0.999 -30.457 2 N-CA-C 133.709 8.244 . . . . 16.91 133.709 169.356 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ASN . . . . . 1.383 ' CG ' ' ND2' ' B' ' 107' ' ' ASN 0.274 90.1 m-20 -74.21 -43.81 55.7 Favored 'General case' 1 CA--C 1.381 -5.554 3 C-N-CA 160.639 15.576 . . . . 16.02 110.267 155.851 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' VAL . . . . . 1.302 ' CB ' ' CG2' ' B' ' 108' ' ' VAL 0.602 20.3 t -65.12 -50.87 72.0 Favored 'Isoleucine or valine' 1 CA--C 1.711 7.163 1 CA-C-N 130.182 5.901 . . . . 16.97 118.481 161.662 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' LEU . . . . . 1.386 ' CG ' ' CB ' ' B' ' 109' ' ' LEU 0.252 0.0 OUTLIER -51.52 -48.23 63.04 Favored 'General case' 1 N--CA 1.604 7.271 1 CA-C-O 106.741 -6.362 . . . . 17.21 108.441 165.289 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ALA . . . . . 1.492 ' CA ' ' CB ' ' B' ' 110' ' ' ALA 0.476 . . -62.33 -25.43 67.88 Favored 'General case' 4 N--CA 1.874 20.739 4 O-C-N 136.343 8.527 . . . . 15.24 122.417 179.839 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' LEU . . . . . 1.412 ' N ' ' C ' ' B' ' 110' ' ' ALA 0.345 0.2 OUTLIER -65.28 -34.25 77.91 Favored 'General case' 3 C--N 1.736 17.39 2 O-C-N 113.604 -5.685 . . . . 15.04 113.45 165.514 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' VAL . . . . . 0.9 ' CG1' ' OE1' ' B' ' 25' ' ' GLN 1.383 0.1 OUTLIER -52.45 -76.81 0.02 OUTLIER 'Isoleucine or valine' 2 C--O 1.007 -11.699 2 CA-C-O 147.87 13.224 . . . . 14.89 104.818 -174.846 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' VAL . . . . . 1.449 ' CB ' ' CG1' ' B' ' 113' ' ' VAL 0.418 0.0 OUTLIER -67.76 -30.53 48.82 Favored 'Isoleucine or valine' 2 C--O 1.007 -11.708 2 CA-C-N 89.185 -12.734 . . . . 17.21 107.701 -172.68 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ALA . . . . . . . . . . . . 0.922 . . -56.13 -33.14 64.89 Favored 'General case' 3 N--CA 1.145 -15.718 3 CA-C-N 135.172 8.169 . . . . 17.12 114.874 170.722 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ARG . . . . . 1.324 ' CB ' ' CA ' ' B' ' 115' ' ' ARG 0.798 48.3 ttp85 -125.37 -37.41 2.38 Favored 'General case' 2 C--O 1.015 -11.241 4 CA-C-O 85.647 -16.406 . . . . 18.03 99.474 -164.791 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ASN . . . . . 1.558 ' CB ' ' CA ' ' B' ' 116' ' ' ASN 0.658 0.6 OUTLIER -56.8 -58.94 5.93 Favored 'General case' 4 C--N 1.042 -12.763 2 CA-C-N 155.942 17.61 . . . . 16.83 103.066 162.715 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' PHE . . . . . 1.597 ' CG ' ' CD1' ' B' ' 117' ' ' PHE 0.631 98.4 m-85 -66.08 -45.33 81.66 Favored 'General case' 4 C--N 1.125 -9.163 1 C-N-CA 144.994 9.318 . . . . 16.48 116.212 -176.693 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLY . . . . . 1.36 ' CA ' ' C ' ' B' ' 117' ' ' PHE . . . 42.61 -98.48 0.01 OUTLIER Glycine 2 N--CA 0.729 -48.471 3 CA-C-O 87.345 -18.475 . . . . 15.89 131.137 177.682 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLY . . . . . 1.51 ' CA ' ' N ' ' B' ' 119' ' ' GLY . . . -70.5 4.06 10.11 Favored Glycine 4 N--CA 1.675 14.579 4 CA-C-N 134.969 9.385 . . . . 14.74 134.652 176.57 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' GLN . . . . . 0.966 ' OE1' ' O ' ' B' ' 117' ' ' PHE 0.33 0.0 OUTLIER -96.94 -40.77 8.73 Favored 'General case' 2 C--O 1.366 7.231 3 C-N-CA 145.584 9.554 . . . . 14.58 99.164 -179.782 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' PHE . . . . . . . . . . . . 0.709 0.3 OUTLIER -79.98 75.81 6.71 Favored 'General case' 1 CA--C 1.394 -5.02 4 O-C-N 106.576 -10.078 . . . . 16.86 86.471 -171.163 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' THR . . . . . 0.79 ' OG1' ' N ' ' B' ' 125' ' ' VAL 0.63 0.6 OUTLIER 112.39 157.04 0.0 OUTLIER Pre-proline 2 C--O 1.492 13.822 4 C-N-CA 176.402 21.881 . . . . 17.28 96.959 3.804 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' PRO . . . . . 1.534 ' CB ' ' CG ' ' B' ' 123' ' ' PRO 0.419 2.7 Cg_endo -74.81 -29.45 8.57 Favored 'Trans proline' 1 C--O 1.106 -6.1 5 C-N-CA 131.959 8.439 . . . . 15.56 98.391 173.204 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' ASN . . . . . 1.45 ' C ' ' N ' ' B' ' 125' ' ' VAL 0.485 1.0 OUTLIER -75.61 -43.14 49.58 Favored 'General case' 3 N--CA 1.308 -7.542 4 O-C-N 84.137 -24.102 . . . . 15.26 111.659 161.685 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' VAL . . . . . 1.505 ' CB ' ' CG1' ' B' ' 125' ' ' VAL 0.87 4.1 t -66.1 -25.96 37.08 Favored 'Isoleucine or valine' 3 N--CA 1.157 -15.106 4 CA-C-N 146.796 13.453 . . . . 15.7 119.917 159.999 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' GLN . . . . . 1.405 ' C ' ' CA ' ' B' ' 126' ' ' GLN 0.567 0.0 OUTLIER -48.83 -70.72 0.08 Allowed 'General case' 3 C--O 0.949 -14.751 3 C-N-CA 151.27 11.828 . . . . 19.08 83.789 -174.437 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ALA . . . . . 0.591 ' N ' ' CA ' ' B' ' 126' ' ' GLN 0.661 . . -23.39 -68.54 0.03 OUTLIER 'General case' 3 C--N 1.222 -4.963 3 C-N-CA 140.447 7.499 . . . . 14.21 115.471 177.379 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' LEU . . . . . 1.613 ' CD2' ' CG1' ' B' ' 10' ' ' VAL 0.857 0.0 OUTLIER -76.21 -28.52 57.26 Favored 'General case' 2 N--CA 1.205 -12.678 3 CA-C-O 93.388 -12.72 . . . . 13.51 110.309 175.496 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' PHE . . . . . . . . . . . . 0.987 0.6 OUTLIER -74.59 -43.31 56.18 Favored 'General case' 2 C--N 0.941 -17.187 4 CA-C-O 136.631 7.872 . . . . 13.27 104.669 -174.231 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' GLN . . . . . 1.538 ' CB ' ' CG ' ' B' ' 130' ' ' GLN 0.691 0.1 OUTLIER -43.72 -49.05 8.0 Favored 'General case' 1 C--N 1.471 5.867 1 O-C-N 111.613 -6.929 . . . . 11.07 115.17 162.953 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' LYS . . . . . 1.523 ' CG ' ' CD ' ' B' ' 131' ' ' LYS 0.479 6.3 mtmt -57.34 -58.55 7.75 Favored 'General case' 3 C--N 1.133 -8.829 2 O-C-N 132.048 5.843 . . . . 11.32 117.232 -179.585 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . 0.753 0.9 OUTLIER -38.7 -64.23 0.1 OUTLIER 'Isoleucine or valine' 3 C--O 1.497 14.13 2 CA-C-N 102.988 -6.46 . . . . 10.84 103.051 173.005 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' VAL . . . . . 1.441 ' CB ' ' CG2' ' B' ' 133' ' ' VAL 0.645 2.6 p -74.4 -44.24 48.44 Favored 'Isoleucine or valine' 4 C--O 0.799 -22.643 4 CA-C-O 97.961 -10.543 . . . . 12.19 100.378 -173.126 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' ALA . . . . . 1.264 ' N ' ' O ' ' B' ' 133' ' ' VAL 0.416 . . -36.21 -54.08 0.81 Allowed 'General case' 3 C--N 1.032 -13.22 3 O-C-N 132.7 6.25 . . . . 11.33 103.203 173.05 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' GLY . . . . . 0.415 ' O ' ' N ' ' B' ' 139' ' ' ALA . . . -60.99 -59.96 9.22 Favored Glycine 4 C--N 1.541 11.931 2 O-C-N 113.184 -5.947 . . . . 10.91 119.003 179.37 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' VAL . . . . . 1.44 ' CA ' ' C ' ' B' ' 136' ' ' VAL 0.343 2.6 t -76.93 -64.67 0.84 Allowed 'Isoleucine or valine' 2 CA--C 1.814 11.129 2 CA-C-O 92.812 -12.994 . . . . 10.82 94.282 -176.464 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' ALA . . . . . 1.499 ' N ' ' CA ' ' B' ' 137' ' ' ALA . . . -20.85 -41.37 0.0 OUTLIER 'General case' 4 C--O 1.549 16.836 3 CA-C-N 146.112 13.142 . . . . 12.58 118.157 153.347 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ASN . . . . . 1.456 ' CG ' ' ND2' ' B' ' 138' ' ' ASN 0.278 1.0 OUTLIER -81.73 -57.35 3.48 Favored 'General case' 3 C--O 1.583 18.63 1 N-CA-C 127.112 5.967 . . . . 14.85 127.112 162.612 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ALA . . . . . 1.336 ' O ' ' C ' ' B' ' 139' ' ' ALA 0.602 . . -51.23 -25.7 5.99 Favored 'General case' 3 C--O 1.658 22.584 4 O-C-N 108.165 -9.084 . . . . 14.1 126.177 174.95 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' LEU . . . . . 1.556 ' CG ' ' CD1' ' B' ' 140' ' ' LEU . 8.2 mt -70.92 -24.54 62.48 Favored 'General case' 2 N--CA 1.142 -15.836 2 CA-C-O 142.255 10.55 . . . . 14.62 110.08 -161.85 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' ALA . . . . . 1.542 ' CA ' ' N ' ' B' ' 141' ' ' ALA 0.537 . . -109.59 8.13 24.86 Favored 'General case' 3 C--O 1.574 18.163 2 C-N-CA 93.94 -11.104 . . . . 13.92 119.776 -179.671 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' HIS . . . . . 1.474 ' N ' ' C ' ' B' ' 141' ' ' ALA . 46.4 t-80 -75.01 -22.86 58.25 Favored 'General case' 3 N--CA 0.946 -25.656 3 CA-C-O 140.633 9.778 . . . . 10.93 97.927 -174.466 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' LYS . . . . . 1.544 ' CE ' ' CD ' ' B' ' 143' ' ' LYS 1.001 1.4 mmmt -67.08 26.81 0.02 OUTLIER 'General case' 4 C--N 0.989 -15.103 4 O-C-N 93.457 -18.277 . . . . 10.83 86.092 -162.926 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' TYR . . . . . 1.69 ' CD2' ' CG ' ' B' ' 144' ' ' TYR 0.253 2.1 m-85 -139.51 99.67 3.78 Favored 'General case' 4 C--O 1.513 14.971 4 CA-C-O 154.78 16.514 . . . . 11.5 99.891 -170.914 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' HIS . . . . . 1.404 ' NE2' ' CE1' ' B' ' 145' ' ' HIS 1.136 1.6 p80 . . . . . 4 C--N 1.596 11.326 1 CA-C-N 81.944 -16.026 . . . . 14.34 111.91 174.784 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' VAL . . . . . 1.348 ' C ' ' CA ' ' C' ' 1' ' ' VAL 1.098 0.0 OUTLIER . . . . . 3 C--O 0.909 -16.823 1 N-CA-C 96.986 -5.19 . . . . 14.82 96.986 . . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . 0.285 0.0 OUTLIER -126.4 132.18 51.58 Favored 'General case' 3 C--O 0.977 -13.262 4 O-C-N 94.815 -17.428 . . . . 13.9 116.586 -175.443 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' SER . . . . . 1.555 ' C ' ' CA ' ' C' ' 3' ' ' SER 1.008 0.3 OUTLIER -36.1 169.35 0.0 OUTLIER 'General case' 3 N--CA 1.102 -17.851 4 O-C-N 89.125 -20.985 . . . . 13.19 105.204 172.867 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ALA . . . . . 1.42 ' CB ' ' CA ' ' C' ' 4' ' ' ALA 1.28 . . -121.49 25.83 9.15 Favored 'General case' 2 N--CA 1.589 6.513 4 O-C-N 103.194 -12.191 . . . . 14.25 94.69 -166.339 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ALA . . . . . . . . . . . . 0.845 . . -112.02 -20.79 11.84 Favored 'General case' 3 C--O 0.898 -17.403 3 CA-C-O 91.403 -13.665 . . . . 13.62 83.345 171.143 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' ASN . . . . . 1.381 ' C ' ' N ' ' C' ' 7' ' ' LYS 0.864 0.8 OUTLIER -57.46 -74.68 0.05 Allowed 'General case' 3 CA--C 1.203 -12.376 3 O-C-N 139.906 10.754 . . . . 12.75 114.586 176.005 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LYS . . . . . 1.633 ' CB ' ' CG ' ' C' ' 7' ' ' LYS . 0.3 OUTLIER -35.15 -27.92 0.01 OUTLIER 'General case' 4 C--N 1.749 17.974 1 N-CA-C 126.044 5.572 . . . . 15.01 126.044 168.28 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' SER . . . . . 1.261 ' O ' ' C ' ' C' ' 8' ' ' SER 0.718 28.9 t -53.43 -65.29 0.59 Allowed 'General case' 2 C--O 1.723 25.988 3 O-C-N 139.654 10.596 . . . . 17.7 111.433 -178.687 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' ASN . . . . . 1.257 ' CB ' ' CG ' ' C' ' 9' ' ' ASN 0.798 1.1 m-20 -44.47 -74.43 0.04 OUTLIER 'General case' 1 C--O 1.14 -4.7 3 CA-C-N 94.565 -10.289 . . . . 19.09 123.367 175.067 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' VAL . . . . . 1.475 ' CB ' ' CG2' ' C' ' 10' ' ' VAL 0.424 1.5 t -20.71 -47.25 0.01 OUTLIER 'Isoleucine or valine' 3 N--CA 1.177 -14.121 2 CA-C-O 154.943 16.592 . . . . 17.41 109.908 169.251 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' LYS . . . . . 1.49 ' CA ' ' N ' ' C' ' 11' ' ' LYS 0.569 0.0 OUTLIER -73.11 -64.16 1.03 Allowed 'General case' 3 N--CA 1.733 13.706 4 O-C-N 103.017 -12.302 . . . . 14.64 117.96 176.272 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ALA . . . . . 1.304 ' O ' ' C ' ' C' ' 12' ' ' ALA 0.517 . . -74.56 -8.06 55.1 Favored 'General case' 2 C--O 1.66 22.702 4 CA-C-N 143.242 11.837 . . . . 12.55 96.598 178.8 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . 1.116 . . -68.63 -65.9 0.64 Allowed 'General case' 2 N--CA 1.249 -10.522 4 CA-C-N 145.449 12.84 . . . . 12.99 108.496 169.855 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' TRP . . . . . 0.804 ' C ' ' CA ' ' C' ' 15' ' ' GLY 0.741 0.1 OUTLIER -50.34 -40.81 50.16 Favored 'General case' 4 N--CA 1.203 -12.779 3 C-N-CA 139.953 7.301 . . . . 12.72 109.205 178.583 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLY . . . . . 1.546 ' N ' ' CA ' ' C' ' 15' ' ' GLY . . . -77.35 -17.97 78.64 Favored Glycine 2 C--O 0.902 -20.599 3 O-C-N 140.206 10.941 . . . . 15.09 106.931 -178.844 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LYS . . . . . 1.508 ' CG ' ' CD ' ' C' ' 16' ' ' LYS 0.4 0.1 OUTLIER -78.21 -38.47 43.11 Favored 'General case' 2 N--CA 1.834 18.732 0 C-N-CA 112.783 -3.567 . . . . 15.3 107.522 172.761 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' VAL . . . . . 1.585 ' CB ' ' CG1' ' C' ' 17' ' ' VAL 0.609 4.6 t -51.42 -74.76 0.04 OUTLIER 'Isoleucine or valine' 3 N--CA 1.171 -14.383 3 N-CA-C 95.623 -5.695 . . . . 15.32 95.623 -176.519 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GLY . . . . . 1.437 ' CA ' ' N ' ' C' ' 18' ' ' GLY . . . 106.49 -145.87 16.0 Favored Glycine 3 N--CA 1.772 21.088 3 O-C-N 134.016 7.072 . . . . 14.45 108.213 171.944 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' GLY . . . . . 1.49 ' C ' ' CA ' ' C' ' 19' ' ' GLY . . . -78.8 -6.3 88.52 Favored Glycine 3 CA--C 1.786 17.015 3 CA-C-O 140.17 10.872 . . . . 14.42 111.562 172.039 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' ASN . . . . . 1.504 ' CA ' ' N ' ' C' ' 20' ' ' ASN 0.668 0.1 OUTLIER -75.41 -74.59 0.2 Allowed 'General case' 3 CA--C 1.173 -13.556 3 O-C-N 100.005 -13.644 . . . . 15.13 86.732 -178.14 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ALA . . . . . 1.415 ' N ' ' C ' ' C' ' 20' ' ' ASN 0.378 . . -4.26 -43.74 0.0 OUTLIER Pre-proline 3 C--N 1.711 16.308 3 O-C-N 103.096 -12.252 . . . . 14.67 106.796 175.528 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' PRO . . . . . 1.565 ' CD ' ' CG ' ' C' ' 22' ' ' PRO 0.385 0.0 OUTLIER -79.2 -42.19 0.19 Allowed 'Trans proline' 3 N--CA 1.815 20.389 4 O-C-N 103.411 -9.31 . . . . 14.07 111.193 177.844 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' ALA . . . . . 1.618 ' CA ' ' CB ' ' C' ' 23' ' ' ALA 0.767 . . -56.45 -25.12 49.69 Favored 'General case' 1 CA--C 1.671 5.601 3 N-CA-C 131.545 7.609 . . . . 13.97 131.545 167.1 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' TYR . . . . . 1.619 ' CG ' ' CB ' ' C' ' 24' ' ' TYR 0.796 3.4 m-30 -50.57 -76.57 0.02 OUTLIER 'General case' 0 C--N 1.422 3.72 2 O-C-N 146.437 14.835 . . . . 13.21 103.575 163.883 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' GLY . . . . . 1.471 ' N ' ' CA ' ' C' ' 25' ' ' GLY . . . -59.03 -37.89 92.21 Favored Glycine 3 N--CA 1.754 19.888 3 CA-C-O 94.479 -14.512 . . . . 15.15 109.681 173.557 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ALA . . . . . 0.581 ' N ' ' CE ' ' C' ' 56' ' ' LYS 0.584 . . -43.59 -56.89 3.44 Favored 'General case' 2 N--CA 1.253 -10.279 2 CA-C-N 139.835 11.817 . . . . 15.04 111.695 167.936 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' GLN . . . . . 0.769 ' C ' ' CA ' ' C' ' 28' ' ' ALA 0.369 11.9 tt0 -63.59 -22.31 66.83 Favored 'General case' 3 C--O 1.049 -9.479 2 O-C-N 98.191 -15.318 . . . . 15.27 123.522 -178.34 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ALA . . . . . 1.557 ' CA ' ' N ' ' C' ' 28' ' ' ALA 0.324 . . -90.78 -31.02 16.68 Favored 'General case' 4 CA--C 1.186 -13.026 5 O-C-N 140.99 11.431 . . . . 15.0 128.587 173.045 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' LEU . . . . . 1.554 ' CA ' ' CB ' ' C' ' 29' ' ' LEU 0.337 6.7 mp -72.78 -42.79 63.57 Favored 'General case' 1 C--N 1.655 13.883 3 CA-C-N 96.756 -9.293 . . . . 14.51 96.293 179.308 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' GLN . . . . . 1.465 ' CD ' ' CG ' ' C' ' 30' ' ' GLN 0.444 2.4 tt0 -77.79 -31.34 51.79 Favored 'General case' 1 N--CA 1.197 -13.087 1 CA-C-N 132.569 6.986 . . . . 13.54 105.923 -174.814 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' ARG . . . . . 1.308 ' C ' ' CA ' ' C' ' 31' ' ' ARG 0.619 3.0 ttt180 -54.19 -79.54 0.02 OUTLIER 'General case' 2 CA--C 1.994 18.054 2 O-C-N 109.889 -8.007 . . . . 15.71 103.117 170.118 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' MET . . . . . 1.585 ' CB ' ' CA ' ' C' ' 32' ' ' MET 0.343 2.2 ttp -48.91 -16.27 0.12 Allowed 'General case' 3 C--O 1.024 -10.769 4 CA-C-O 94.972 -11.966 . . . . 16.81 123.788 -175.459 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' PHE . . . . . 1.297 ' O ' ' C ' ' C' ' 33' ' ' PHE 0.602 5.5 m-30 -73.06 -40.74 64.82 Favored 'General case' 3 C--O 1.685 23.99 4 CA-C-N 141.986 11.266 . . . . 15.05 99.552 -166.92 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' LEU . . . . . . . . . . . . 0.25 7.3 mp -58.88 -72.27 0.1 Allowed 'General case' 3 C--N 1.668 14.451 3 O-C-N 107.568 -9.458 . . . . 14.54 114.3 -178.294 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' SER . . . . . 1.345 ' CB ' ' OG ' ' C' ' 35' ' ' SER 0.49 0.0 OUTLIER -61.83 -20.79 64.04 Favored 'General case' 1 N--CA 1.277 -9.118 4 CA-C-O 82.969 -17.682 . . . . 16.23 103.71 157.795 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' PHE . . . . . 1.554 ' CA ' ' CB ' ' C' ' 36' ' ' PHE 0.319 0.0 OUTLIER -171.59 62.28 0.34 Allowed Pre-proline 3 CA--C 1.281 -9.39 4 CA-C-N 158.424 18.738 . . . . 15.24 128.297 173.351 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' PRO . . . . . 1.376 ' CD ' ' CG ' ' C' ' 37' ' ' PRO 0.657 19.4 Cg_exo -27.34 -39.17 0.04 OUTLIER 'Trans proline' 3 C--N 1.765 22.473 3 N-CA-C 147.115 13.467 . . . . 14.79 147.115 -172.071 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' THR . . . . . 1.297 ' CB ' ' CG2' ' C' ' 38' ' ' THR 0.371 2.3 t -75.84 -16.16 60.11 Favored 'General case' 3 C--O 1.921 36.42 4 C-N-CA 173.507 20.723 . . . . 15.26 95.656 -174.432 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' THR . . . . . 1.536 ' CA ' ' CB ' ' C' ' 39' ' ' THR 0.299 0.7 OUTLIER -93.58 -10.33 35.07 Favored 'General case' 2 N--CA 1.163 -14.8 3 C-N-CA 138.77 6.828 . . . . 14.4 117.364 165.516 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . 0.494 17.0 mtmt -64.81 -8.09 13.73 Favored 'General case' 3 C--N 1.511 7.618 3 O-C-N 140.996 11.435 . . . . 14.31 120.296 178.197 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' THR . . . . . 1.358 ' CB ' ' CG2' ' C' ' 41' ' ' THR 0.542 15.8 m -80.88 -36.43 31.31 Favored 'General case' 3 CA--C 1.072 -17.433 2 C-N-CA 136.86 6.064 . . . . 12.79 105.203 -167.316 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' TYR . . . . . 0.536 ' CG ' ' CBC' ' C' ' 142' ' ' HEM 0.562 10.5 m-85 -77.4 -12.37 59.95 Favored 'General case' 1 C--O 1.389 8.405 5 N-CA-C 87.229 -8.804 . . . . 15.89 87.229 179.621 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' PHE . . . . . 1.536 ' CA ' ' CB ' ' C' ' 43' ' ' PHE 0.307 8.2 m-85 -132.08 67.22 78.96 Favored Pre-proline 2 N--CA 1.209 -12.525 4 O-C-N 96.87 -16.144 . . . . 15.41 132.557 168.476 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' PRO . . . . . 1.491 ' CG ' ' CB ' ' C' ' 44' ' ' PRO 0.332 42.2 Cg_endo -75.08 -73.86 0.01 OUTLIER 'Trans proline' 3 N--CA 1.858 22.925 4 O-C-N 143.614 11.849 . . . . 14.47 103.952 170.947 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' HIS . . . . . 1.533 ' CA ' ' CB ' ' C' ' 45' ' ' HIS 0.504 0.4 OUTLIER -13.52 -50.16 0.0 OUTLIER 'General case' 4 N--CA 1.811 17.613 4 N-CA-C 143.923 12.194 . . . . 13.52 143.923 -175.376 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' PHE . . . . . 1.469 ' CZ ' ' CE2' ' C' ' 46' ' ' PHE 0.724 2.2 m-85 -97.48 148.21 23.45 Favored 'General case' 3 C--O 1.029 -10.549 5 CA-C-O 161.071 19.51 . . . . 13.94 122.505 177.386 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' ASP . . . . . 1.496 ' CB ' ' CG ' ' C' ' 47' ' ' ASP 0.362 0.0 OUTLIER -96.47 117.31 30.64 Favored 'General case' 3 C--O 1.498 14.144 4 CA-C-N 87.949 -13.296 . . . . 12.96 85.415 179.728 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' LEU . . . . . 0.435 ' CD1' ' CB ' ' C' ' 49' ' ' SER 0.301 0.0 OUTLIER 147.14 124.17 0.0 OUTLIER 'General case' 3 C--N 1.133 -8.833 4 C-N-CA 174.715 21.206 . . . . 11.95 89.151 -110.654 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' SER . . . . . 1.399 ' CB ' ' OG ' ' C' ' 49' ' ' SER 0.385 4.5 t -127.9 -175.52 3.51 Favored 'General case' 3 C--N 1.538 8.804 3 CA-C-O 149.649 14.071 . . . . 10.28 76.738 9.473 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 3.6 m80 -122.7 -95.74 0.47 Allowed 'General case' 3 N--CA 1.669 10.524 4 O-C-N 75.533 -29.479 . . . . 10.49 118.792 12.773 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . -74.06 118.1 5.87 Favored Glycine 3 C--O 0.887 -21.549 5 O-C-N 138.991 10.182 . . . . 11.8 91.169 179.285 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' SER . . . . . 0.877 ' C ' ' CA ' ' C' ' 53' ' ' ALA 0.483 0.0 OUTLIER -120.95 128.4 52.71 Favored 'General case' 1 N--CA 1.578 5.941 3 CA-C-O 97.363 -10.827 . . . . 13.68 119.606 179.956 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ALA . . . . . 1.547 ' N ' ' CA ' ' C' ' 53' ' ' ALA 0.488 . . -62.94 -10.69 14.49 Favored 'General case' 2 N--CA 1.701 12.101 5 N-CA-C 132.63 8.011 . . . . 15.05 132.63 171.974 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' GLN . . . . . 1.604 ' CB ' ' CG ' ' C' ' 54' ' ' GLN 0.255 24.3 mt-30 -76.59 -41.92 44.42 Favored 'General case' 3 C--O 1.453 11.77 2 CA-C-O 97.037 -10.982 . . . . 15.17 111.071 171.565 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' GLN . . . . . 1.544 ' CB ' ' CA ' ' C' ' 55' ' ' GLN 0.678 0.3 OUTLIER -72.9 -47.03 49.29 Favored 'General case' 3 C--O 1.57 17.932 3 CA-C-O 92.383 -13.198 . . . . 14.98 105.027 175.143 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' LYS . . . . . 1.277 ' CE ' ' NZ ' ' C' ' 56' ' ' LYS 1.087 0.0 OUTLIER -65.88 -78.85 0.05 OUTLIER 'General case' 1 C--O 1.394 8.692 4 CA-C-N 152.492 16.042 . . . . 15.73 82.717 171.141 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' ALA . . . . . 0.747 ' CB ' ' O ' ' C' ' 53' ' ' ALA 0.704 . . -21.77 -57.96 0.03 OUTLIER 'General case' 4 C--O 1.578 18.375 3 O-C-N 97.847 -15.533 . . . . 15.46 114.819 -171.569 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' HIS . . . . . 0.569 ' NE2' ' CE2' ' C' ' 43' ' ' PHE 0.693 9.6 t60 -71.65 -38.99 70.64 Favored 'General case' 4 C--O 0.94 -15.213 3 O-C-N 102.501 -12.624 . . . . 15.22 116.991 170.848 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' GLY . . . . . 1.37 ' C ' ' CA ' ' C' ' 59' ' ' GLY . . . -59.68 -33.2 76.47 Favored Glycine 4 CA--C 1.919 25.333 4 CA-C-O 101.191 -10.783 . . . . 14.09 93.701 177.46 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' GLN . . . . . 1.592 ' CB ' ' CG ' ' C' ' 60' ' ' GLN . 0.4 OUTLIER -44.63 -58.28 3.13 Favored 'General case' 3 C--N 0.981 -15.434 1 CA-C-N 129.259 6.529 . . . . 14.83 118.906 179.257 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' LYS . . . . . 1.591 ' CG ' ' CD ' ' C' ' 61' ' ' LYS 0.962 0.2 OUTLIER -63.09 -85.21 0.01 OUTLIER 'General case' 3 C--O 1.452 11.734 3 C-N-CA 159.733 15.213 . . . . 14.28 90.345 175.17 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . 0.467 29.5 t -43.9 -66.8 0.12 Allowed 'Isoleucine or valine' 4 C--N 1.103 -10.117 3 CA-C-N 143.176 11.807 . . . . 14.25 100.434 178.758 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . 0.616 . . -9.88 -102.62 0.0 OUTLIER 'General case' 2 N--CA 1.282 -8.85 4 C-N-CA 160.234 15.414 . . . . 13.85 111.142 136.875 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' ASN . . . . . 1.536 ' CB ' ' CA ' ' C' ' 64' ' ' ASN 0.412 74.0 m-20 -7.78 -58.25 0.0 OUTLIER 'General case' 4 N--CA 1.344 -5.746 3 CA-C-N 141.151 10.887 . . . . 14.41 129.92 163.655 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' ALA . . . . . . . . . . . . 0.314 . . -54.87 -50.17 69.34 Favored 'General case' 3 C--O 1.439 11.038 4 CA-C-O 100.945 -9.121 . . . . 13.82 91.085 176.742 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' LEU . . . . . 1.571 ' CD2' ' CG ' ' C' ' 66' ' ' LEU 0.586 0.0 OUTLIER -79.26 -35.48 41.35 Favored 'General case' 1 CA--C 1.371 -5.927 1 CA-C-N 136.147 8.612 . . . . 16.31 118.06 -167.154 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' THR . . . . . 1.492 ' CB ' ' CG2' ' C' ' 67' ' ' THR 0.395 99.5 m -59.38 -57.63 12.15 Favored 'General case' 4 C--O 1.011 -11.496 2 CA-C-O 99.911 -9.614 . . . . 16.95 98.025 175.342 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' LYS . . . . . 1.596 ' CB ' ' CG ' ' C' ' 68' ' ' LYS 0.54 0.0 OUTLIER -32.01 -78.27 0.02 OUTLIER 'General case' 3 C--O 1.087 -7.45 2 C-N-CA 138.785 6.834 . . . . 18.31 103.911 167.266 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' ALA . . . . . 1.442 ' C ' ' CA ' ' C' ' 69' ' ' ALA 0.746 . . -49.52 -25.85 3.0 Favored 'General case' 2 N--CA 1.144 -15.759 4 C-N-CA 162.391 16.276 . . . . 16.09 102.636 -161.916 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' GLN . . . . . 1.395 ' CA ' ' CB ' ' C' ' 70' ' ' GLN 1.917 6.0 mm100 -146.31 17.21 1.35 Allowed 'General case' 3 C--N 1.121 -9.351 2 N-CA-C 140.746 11.017 . . . . 14.15 140.746 173.627 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' GLY . . . . . 1.523 ' C ' ' CA ' ' C' ' 71' ' ' GLY . . . 73.1 -71.36 1.19 Allowed Glycine 4 CA--C 1.761 15.45 3 C-N-CA 142.492 9.615 . . . . 13.2 92.046 23.819 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' HIS . . . . . 1.547 ' CG ' ' CD2' ' C' ' 72' ' ' HIS 0.833 0.0 OUTLIER -164.57 72.27 0.22 Allowed 'General case' 3 CA--C 1.736 8.113 3 CA-C-O 154.977 16.608 . . . . 14.04 123.834 -172.887 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' LEU . . . . . 0.455 ' C ' ' CA ' ' C' ' 74' ' ' ASN 0.305 0.7 OUTLIER -74.26 68.87 1.52 Allowed 'General case' 2 CA--C 1.677 5.84 2 CA-C-N 86.255 -14.066 . . . . 13.38 96.153 179.729 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' ASN . . . . . 1.372 ' N ' ' CA ' ' C' ' 74' ' ' ASN 0.71 0.0 OUTLIER -161.18 -12.69 0.04 OUTLIER 'General case' 3 N--CA 1.858 19.948 3 O-C-N 110.804 -7.435 . . . . 15.77 98.467 171.702 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' ASP . . . . . 1.585 ' CA ' ' CB ' ' C' ' 75' ' ' ASP 0.725 48.9 t0 170.01 71.95 0.0 OUTLIER 'General case' 3 N--CA 0.934 -26.269 4 O-C-N 105.672 -10.643 . . . . 15.04 128.97 -157.583 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' LEU . . . . . 1.584 ' CG ' ' CD1' ' C' ' 76' ' ' LEU 0.461 0.0 OUTLIER -73.05 -30.84 1.33 Allowed Pre-proline 4 C--O 1.496 14.078 4 CA-C-O 101.904 -8.665 . . . . 16.3 124.378 163.021 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' PRO . . . . . 1.268 ' CG ' ' CB ' ' C' ' 77' ' ' PRO 0.268 15.3 Cg_exo -53.09 -32.71 60.16 Favored 'Trans proline' 3 CA--C 1.168 -17.809 4 C-N-CA 105.247 -9.369 . . . . 16.54 128.914 168.15 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' GLY . . . . . 0.91 ' C ' ' CA ' ' C' ' 79' ' ' THR . . . -84.65 -49.0 4.76 Favored Glycine 2 N--CA 1.659 13.502 4 CA-C-O 93.294 -15.17 . . . . 16.63 90.154 -168.651 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' THR . . . . . 1.507 ' CA ' ' N ' ' C' ' 79' ' ' THR 0.529 0.2 OUTLIER -56.11 -40.47 73.75 Favored 'General case' 2 N--CA 1.692 11.672 2 O-C-N 142.236 11.198 . . . . 16.97 115.18 -177.49 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' LEU . . . . . 1.561 ' CG ' ' CD1' ' C' ' 80' ' ' LEU 0.744 4.6 tp -91.51 30.53 1.3 Allowed 'General case' 4 C--O 1.728 26.271 2 N-CA-C 135.499 9.074 . . . . 15.32 135.499 167.39 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' SER . . . . . 1.513 ' CA ' ' CB ' ' C' ' 81' ' ' SER 0.515 0.8 OUTLIER -81.8 -42.79 19.2 Favored 'General case' 3 N--CA 1.286 -8.665 4 CA-C-O 160.542 19.258 . . . . 13.77 101.98 -156.359 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' ASN . . . . . . . . . . . . 0.637 0.9 OUTLIER -51.59 -47.66 63.47 Favored 'General case' 4 C--N 1.637 13.086 3 O-C-N 95.253 -17.154 . . . . 14.45 112.259 175.394 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' LEU . . . . . 1.575 ' CD2' ' CG ' ' C' ' 83' ' ' LEU 0.775 8.0 tp -53.08 -93.16 0.0 OUTLIER 'General case' 2 C--N 1.572 10.282 3 O-C-N 152.374 18.547 . . . . 14.35 132.693 -174.937 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' SER . . . . . 1.43 ' C ' ' CA ' ' C' ' 84' ' ' SER 0.968 12.0 m 12.64 -16.86 0.0 OUTLIER 'General case' 4 C--N 0.94 -17.232 2 C-N-CA 170.694 19.598 . . . . 15.65 101.459 95.457 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' ASN . . . . . 1.462 ' CB ' ' CG ' ' C' ' 85' ' ' ASN 0.491 9.4 t-20 -93.96 139.38 31.0 Favored 'General case' 2 N--CA 1.173 -14.302 4 CA-C-O 70.779 -23.486 . . . . 16.13 99.667 125.654 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' LEU . . . . . 1.643 ' CG ' ' CD1' ' C' ' 86' ' ' LEU 0.807 0.4 OUTLIER -19.75 -27.22 0.0 OUTLIER 'General case' 2 C--N 1.222 -4.948 4 O-C-N 83.411 -24.555 . . . . 15.46 121.371 -26.507 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' HIS . . . . . 1.063 ' ND1' ' CG ' ' C' ' 87' ' ' HIS . 47.0 m80 -85.44 -49.75 7.85 Favored 'General case' 4 CA--C 1.178 -13.363 3 CA-C-O 81.762 -18.256 . . . . 16.18 89.919 176.376 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' ALA . . . . . 0.529 ' CB ' ' CB ' ' C' ' 139' ' ' LYS 0.368 . . -86.81 -89.35 0.12 Allowed 'General case' 3 C--O 1.605 19.765 3 CA-C-N 151.121 15.419 . . . . 16.41 101.491 -163.388 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' HIS . . . . . 0.793 ' ND1' ' C ' ' C' ' 89' ' ' HIS . 0.0 OUTLIER -75.77 -16.34 60.13 Favored 'General case' 2 C--N 1.097 -10.373 3 CA-C-O 148.421 13.486 . . . . 16.34 123.887 -173.139 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' LYS . . . . . 1.518 ' NZ ' ' CE ' ' C' ' 90' ' ' LYS 0.361 0.5 OUTLIER -105.74 -46.65 4.09 Favored 'General case' 3 N--CA 1.899 21.977 4 O-C-N 98.589 -15.069 . . . . 18.04 99.793 -176.961 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' LEU . . . . . 1.646 ' CB ' ' CG ' ' C' ' 91' ' ' LEU 0.394 47.9 mt -72.47 -49.48 32.93 Favored 'General case' 3 N--CA 1.687 11.405 2 O-C-N 136.772 8.795 . . . . 17.6 107.11 -176.352 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' ARG . . . . . 1.612 ' CD ' ' CG ' ' C' ' 92' ' ' ARG 0.632 0.0 OUTLIER 74.09 44.62 0.25 Allowed 'General case' 4 C--O 1.544 16.602 1 CA-C-O 147.566 13.079 . . . . 17.04 120.291 -167.418 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' VAL . . . . . 1.378 ' CA ' ' CB ' ' C' ' 93' ' ' VAL 0.568 2.9 t -61.77 99.8 0.14 Allowed 'Isoleucine or valine' 3 C--O 1.613 20.205 2 CA-C-N 94.615 -10.266 . . . . 17.8 107.622 166.039 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' ASN . . . . . 1.293 ' CG ' ' OD1' ' C' ' 94' ' ' ASN . 0.2 OUTLIER -49.14 141.21 11.37 Favored Pre-proline 4 C--N 1.045 -12.667 3 O-C-N 106.985 -9.822 . . . . 16.87 96.398 -173.612 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' PRO . . . . . 0.565 ' CG ' ' NH1' ' C' ' 141' ' ' ARG 0.461 1.5 Cg_endo -71.54 -17.57 29.97 Favored 'Trans proline' 4 C--O 1.545 15.853 4 O-C-N 103.004 -9.524 . . . . 15.43 117.439 175.047 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' VAL . . . . . 1.432 ' CG2' ' CB ' ' C' ' 96' ' ' VAL 0.62 4.5 t -32.84 -43.44 0.07 OUTLIER 'Isoleucine or valine' 2 CA--C 1.133 -15.059 3 O-C-N 93.48 -18.263 . . . . 14.97 117.841 172.056 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' ASN . . . . . 1.469 ' C ' ' CA ' ' C' ' 97' ' ' ASN 0.484 5.4 m120 -62.75 -29.89 71.03 Favored 'General case' 3 CA--C 1.765 9.227 3 CA-C-O 134.301 6.762 . . . . 15.51 123.136 -173.879 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' PHE . . . . . 1.383 ' CG ' ' CD1' ' C' ' 98' ' ' PHE 0.645 13.2 m-85 -43.14 -55.54 3.86 Favored 'General case' 4 C--O 0.781 -23.586 5 CA-C-O 150.851 14.643 . . . . 16.47 124.021 174.644 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' LYS . . . . . 1.528 ' CD ' ' CG ' ' C' ' 99' ' ' LYS 0.395 0.0 OUTLIER -67.71 -16.56 64.2 Favored 'General case' 1 C--N 1.991 28.482 2 CA-C-N 87.735 -13.393 . . . . 14.38 104.462 -178.223 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' LEU . . . . . 1.41 ' CA ' ' N ' ' C' ' 100' ' ' LEU 0.697 0.0 OUTLIER -86.97 -56.13 3.52 Favored 'General case' 3 N--CA 1.823 18.183 3 CA-C-O 89.612 -14.518 . . . . 15.1 94.069 -178.99 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' LEU . . . . . 1.554 ' CA ' ' CB ' ' C' ' 101' ' ' LEU 0.774 0.0 OUTLIER -50.43 -44.16 55.24 Favored 'General case' 2 C--O 1.519 15.241 3 O-C-N 145.231 14.082 . . . . 15.34 125.571 -179.433 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' SER . . . . . 1.349 ' C ' ' N ' ' C' ' 103' ' ' HIS 0.733 1.2 m -18.35 -88.76 0.0 OUTLIER 'General case' 3 C--N 1.122 -9.31 3 C-N-CA 150.161 11.384 . . . . 14.35 97.126 158.74 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HIS . . . . . 1.657 ' CB ' ' CG ' ' C' ' 103' ' ' HIS 0.262 1.5 t-80 -51.67 -32.42 29.64 Favored 'General case' 2 C--N 1.784 19.459 2 C-N-CA 97.113 -9.835 . . . . 14.05 126.861 169.304 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' SER . . . . . 1.475 ' C ' ' CA ' ' C' ' 104' ' ' SER 0.634 0.6 OUTLIER -57.78 -55.79 30.3 Favored 'General case' 3 CA--C 1.766 9.277 5 C-N-CA 147.283 10.233 . . . . 14.55 99.906 -157.097 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' LEU . . . . . 1.501 ' CG ' ' CD1' ' C' ' 105' ' ' LEU 0.469 4.6 tp -83.62 -38.02 22.13 Favored 'General case' 3 C--O 1.398 8.914 4 CA-C-O 97.814 -10.612 . . . . 15.21 99.673 -173.956 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.25 -21.7 60.57 Favored 'General case' 1 N--CA 1.211 -12.388 2 CA-C-N 131.937 6.699 . . . . 15.05 119.855 175.697 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' VAL . . . . . 0.503 ' CG1' ' O ' ' C' ' 103' ' ' HIS 0.645 0.2 OUTLIER -89.8 -57.46 4.24 Favored 'Isoleucine or valine' 2 N--CA 1.201 -12.913 5 C-N-CA 166.423 17.889 . . . . 15.99 86.724 173.751 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' THR . . . . . 1.565 ' CG2' ' CB ' ' C' ' 108' ' ' THR 1.101 19.8 m -76.36 -68.21 0.61 Allowed 'General case' 4 CA--C 1.847 12.383 5 CA-C-N 165.266 21.848 . . . . 13.92 86.866 -159.355 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' LEU . . . . . 0.606 ' O ' ' CD2' ' C' ' 113' ' ' LEU 0.418 1.3 mm? -36.97 -75.01 0.03 OUTLIER 'General case' 2 C--N 1.063 -11.87 3 C-N-CA 149.091 10.956 . . . . 15.09 109.248 -176.354 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' ALA . . . . . 1.212 ' C ' ' CA ' ' C' ' 110' ' ' ALA 0.856 . . 156.84 -72.32 0.0 OUTLIER 'General case' 2 CA--C 2.079 21.314 5 C-N-CA 176.978 22.111 . . . . 16.87 80.796 -25.29 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' SER . . . . . 1.414 ' C ' ' CA ' ' C' ' 111' ' ' SER . 46.7 t -53.07 -36.33 60.52 Favored 'General case' 4 C--N 0.967 -16.049 2 O-C-N 142.286 12.241 . . . . 15.37 117.202 -176.692 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' HIS . . . . . 0.508 ' N ' ' CA ' ' C' ' 111' ' ' SER 0.394 24.3 m80 -95.61 -46.79 6.49 Favored 'General case' 3 C--O 1.555 17.165 5 CA-C-O 81.396 -18.43 . . . . 14.64 97.385 -173.855 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' LEU . . . . . 1.534 ' CD2' ' CG ' ' C' ' 113' ' ' LEU 0.519 0.1 OUTLIER -126.27 80.6 68.52 Favored Pre-proline 1 C--O 1.37 7.425 4 O-C-N 144.523 13.639 . . . . 14.99 102.536 -166.745 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' PRO . . . . . 1.538 ' N ' ' CA ' ' C' ' 114' ' ' PRO 0.67 71.9 Cg_endo -96.99 16.79 0.66 Allowed 'Trans proline' 4 C--N 1.651 16.461 3 C-N-CA 102.645 -11.103 . . . . 12.85 112.432 -172.346 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' THR . . . . . 1.534 ' CB ' ' CG2' ' C' ' 115' ' ' THR 0.76 0.7 OUTLIER -103.09 -8.51 20.47 Favored 'General case' 4 C--O 1.663 22.867 4 O-C-N 134.993 7.683 . . . . 12.8 91.608 -176.89 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' ASN . . . . . 1.531 ' C ' ' CA ' ' C' ' 116' ' ' ASN 0.466 1.3 t30 -106.55 -61.93 1.46 Allowed 'General case' 3 C--N 1.08 -11.114 3 C-N-CA 159.966 15.307 . . . . 15.35 112.952 -157.139 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' PHE . . . . . 1.607 ' CD2' ' CE2' ' C' ' 117' ' ' PHE 1.029 0.1 OUTLIER -82.38 58.32 4.05 Favored 'General case' 2 C--N 0.99 -15.049 3 CA-C-O 92.953 -12.927 . . . . 16.87 104.515 -178.158 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' THR . . . . . 1.455 ' OG1' ' CB ' ' C' ' 118' ' ' THR 0.561 74.6 p -23.19 141.61 0.04 OUTLIER Pre-proline 3 C--N 0.896 -19.112 3 C-N-CA 162.136 16.174 . . . . 15.72 109.878 143.202 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' PRO . . . . . 1.362 ' C ' ' CA ' ' C' ' 119' ' ' PRO 0.607 77.8 Cg_exo -59.19 -35.06 98.34 Favored 'Trans proline' 3 CA--C 1.933 20.438 1 C-N-CA 112.373 -4.618 . . . . 14.73 113.417 177.927 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' ALA . . . . . . . . . . . . 0.566 . . -81.66 -23.58 36.82 Favored 'General case' 1 N--CA 1.09 -18.465 2 C-N-CA 145.636 9.574 . . . . 12.62 105.562 177.176 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' VAL . . . . . 1.379 ' C ' ' N ' ' C' ' 122' ' ' HIS . 85.3 t -90.95 -53.25 9.18 Favored 'Isoleucine or valine' 2 C--N 1.46 5.409 5 O-C-N 89.644 -20.66 . . . . 12.47 90.002 170.681 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' HIS . . . . . 1.379 ' N ' ' C ' ' C' ' 121' ' ' VAL 0.261 4.3 p80 -53.47 -32.88 52.06 Favored 'General case' 2 C--N 1.739 17.519 2 CA-C-N 134.973 8.079 . . . . 13.25 113.074 -167.937 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' ALA . . . . . . . . . . . . 0.609 . . -47.49 -71.01 0.08 Allowed 'General case' 2 C--O 1.105 -6.507 3 O-C-N 98.706 -14.996 . . . . 12.91 111.961 -170.977 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' ASN . . . . . 1.331 ' CG ' ' ND2' ' C' ' 124' ' ' ASN 0.564 0.0 OUTLIER -47.7 -78.57 0.02 OUTLIER 'General case' 1 C--O 1.332 5.41 2 O-C-N 135.105 7.753 . . . . 12.24 102.591 175.955 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . 0.528 91.0 mt -26.25 -56.69 0.07 Allowed 'General case' 3 C--O 1.359 6.839 4 CA-C-O 99.303 -9.903 . . . . 13.23 107.106 165.646 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' ASN . . . . . 1.504 ' C ' ' CA ' ' C' ' 126' ' ' ASN . 51.0 t-20 -50.32 -55.37 15.81 Favored 'General case' 3 CA--C 1.755 8.851 3 CA-C-N 141.358 10.981 . . . . 13.65 114.715 165.777 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' LYS . . . . . . . . . . . . 0.373 0.8 OUTLIER -41.33 -48.5 3.66 Favored 'General case' 1 C--N 1.124 -9.223 4 CA-C-O 147.319 12.961 . . . . 13.98 116.072 173.983 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' PHE . . . . . 1.594 ' CZ ' ' CE1' ' C' ' 128' ' ' PHE 0.754 4.7 t80 -64.53 -73.38 0.12 Allowed 'General case' 4 C--O 1.477 13.029 4 O-C-N 95.866 -16.771 . . . . 13.37 89.709 -172.081 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' LEU . . . . . 1.495 ' CG ' ' CB ' ' C' ' 129' ' ' LEU 0.475 0.1 OUTLIER -84.82 -63.83 1.26 Allowed 'General case' 3 C--N 1.072 -11.496 4 CA-C-O 100.531 -9.319 . . . . 13.08 93.601 -169.698 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 130' ' ' ALA . . . . . 1.344 ' CA ' ' N ' ' C' ' 130' ' ' ALA 0.447 . . -36.31 -27.19 0.01 OUTLIER 'General case' 4 N--CA 1.905 22.317 3 CA-C-N 152.045 15.839 . . . . 12.75 107.999 168.916 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' ASN . . . . . 1.514 ' CB ' ' CA ' ' C' ' 131' ' ' ASN 0.473 0.3 OUTLIER -95.47 -36.98 11.11 Favored 'General case' 2 N--CA 1.167 -14.58 3 CA-C-N 147.245 13.657 . . . . 14.05 114.532 -173.168 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' ASP . . . . . . . . . . . . 0.613 0.8 OUTLIER -64.08 -36.48 84.15 Favored 'General case' 2 C--O 1.436 10.917 5 O-C-N 107.365 -9.585 . . . . 14.99 99.803 176.386 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' SER . . . . . 1.556 ' CA ' ' CB ' ' C' ' 133' ' ' SER 0.592 59.9 m -74.53 -85.33 0.04 OUTLIER 'General case' 3 N--CA 1.113 -17.278 4 C-N-CA 159.203 15.001 . . . . 13.47 94.393 -160.3 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 134' ' ' THR . . . . . 1.524 ' N ' ' CA ' ' C' ' 134' ' ' THR 0.951 21.7 m -46.98 -58.2 4.21 Favored 'General case' 4 N--CA 1.705 12.297 2 O-C-N 142.529 12.393 . . . . 11.67 104.609 176.428 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 135' ' ' VAL . . . . . 1.487 ' CB ' ' CG2' ' C' ' 135' ' ' VAL 0.382 1.3 m -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 2 C--O 1.65 22.168 4 O-C-N 100.294 -14.004 . . . . 11.95 95.174 -154.921 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 136' ' ' LEU . . . . . 1.605 ' CA ' ' CB ' ' C' ' 136' ' ' LEU 0.331 1.6 mm? -64.5 -22.13 66.88 Favored 'General case' 3 C--O 1.377 7.791 3 O-C-N 100.692 -13.755 . . . . 11.91 102.375 -178.267 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 137' ' ' THR . . . . . 1.524 ' CA ' ' N ' ' C' ' 137' ' ' THR . 1.9 m -103.77 -69.77 0.79 Allowed 'General case' 3 C--O 1.709 25.289 3 CA-C-O 101.932 -8.651 . . . . 11.54 93.292 -176.912 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' C' C ' 138' ' ' SER . . . . . 1.577 ' CA ' ' CB ' ' C' ' 138' ' ' SER 0.415 27.8 m 36.91 -64.6 0.0 OUTLIER 'General case' 3 C--N 1.143 -8.374 4 CA-C-N 166.558 22.436 . . . . 12.62 145.677 173.506 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' C' C ' 139' ' ' LYS . . . . . 1.458 ' CG ' ' CB ' ' C' ' 139' ' ' LYS . 0.1 OUTLIER -31.91 -36.83 0.02 OUTLIER 'General case' 2 N--CA 1.328 -6.553 2 CA-C-O 160.59 19.281 . . . . 13.54 109.338 169.691 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' C' C ' 140' ' ' TYR . . . . . 1.666 ' CG ' ' CB ' ' C' ' 140' ' ' TYR 0.402 0.1 OUTLIER -138.23 138.44 38.51 Favored 'General case' 2 N--CA 1.067 -19.614 5 O-C-N 90.577 -20.077 . . . . 14.62 135.072 141.207 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' C' C ' 141' ' ' ARG . . . . . 1.536 ' NE ' ' CD ' ' C' ' 141' ' ' ARG 0.606 1.4 mpt_? . . . . . 2 C--O 1.839 32.112 4 CA-C-N 96.218 -9.537 . . . . 15.41 104.389 172.901 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' MET . . . . . 1.449 ' CA ' ' N ' ' D' ' 1' ' ' MET 0.599 0.0 OUTLIER . . . . . 2 N--CA 1.798 16.971 2 CA-C-O 159.598 18.809 . . . . 14.31 76.283 . . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' LEU . . . . . 1.618 ' CB ' ' CG ' ' D' ' 2' ' ' LEU 1.143 0.0 OUTLIER 171.29 -33.34 0.0 OUTLIER 'General case' 2 C--N 1.572 10.251 4 CA-C-O 66.637 -25.458 . . . . 13.31 67.344 -166.635 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' THR . . . . . 1.43 ' CA ' ' N ' ' D' ' 3' ' ' THR 0.707 0.2 OUTLIER 63.19 103.88 0.03 OUTLIER 'General case' 3 N--CA 1.811 17.618 3 CA-C-N 166.701 22.5 . . . . 13.17 94.013 -168.128 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' ALA . . . . . 1.25 ' C ' ' CA ' ' D' ' 4' ' ' ALA 0.356 . . -94.45 133.77 37.68 Favored 'General case' 3 N--CA 1.944 24.242 4 C-N-CA 62.292 -23.763 . . . . 11.98 117.062 167.945 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' GLU . . . . . 1.248 ' CD ' ' CG ' ' D' ' 5' ' ' GLU 0.306 28.1 mp0 -118.75 138.78 52.43 Favored 'General case' 3 N--CA 0.596 -43.16 2 C-N-CA 171.604 19.962 . . . . 13.4 104.323 -25.501 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' GLU . . . . . 1.585 ' CB ' ' CA ' ' D' ' 6' ' ' GLU 0.375 1.8 pt-20 99.93 86.03 0.0 OUTLIER 'General case' 1 C--O 1.631 21.177 3 C-N-CA 170.876 19.671 . . . . 15.22 111.875 -108.461 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' LYS . . . . . 1.269 ' O ' ' CA ' ' D' ' 8' ' ' ALA 1.334 0.0 OUTLIER 135.95 105.34 0.0 OUTLIER 'General case' 4 C--O 0.695 -28.082 3 O-C-N 164.7 26.25 . . . . 18.76 109.139 -156.921 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ALA . . . . . 1.269 ' CA ' ' O ' ' D' ' 7' ' ' LYS . . . -176.18 55.66 0.01 OUTLIER 'General case' 4 C--O 2.08 44.775 3 O-C-N 47.19 -47.194 . . . . 16.9 110.543 15.913 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' ALA . . . . . . . . . . . . 0.74 . . -27.17 -81.06 0.01 OUTLIER 'General case' 1 C--N 1.466 5.64 2 CA-C-O 85.575 -16.441 . . . . 15.85 109.997 52.384 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' VAL . . . . . 1.49 ' C ' ' CA ' ' D' ' 10' ' ' VAL 0.726 0.1 OUTLIER -43.72 -24.04 0.17 Allowed 'Isoleucine or valine' 3 C--O 1.046 -9.634 4 CA-C-N 160.482 19.674 . . . . 14.65 137.115 168.888 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' THR . . . . . 1.494 ' C ' ' CA ' ' D' ' 11' ' ' THR 1.562 0.6 OUTLIER -96.11 61.51 2.1 Favored 'General case' 4 N--CA 1.827 18.4 3 CA-C-N 102.523 -6.671 . . . . 13.94 98.949 164.226 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' GLY . . . . . 1.556 ' N ' ' CA ' ' D' ' 12' ' ' GLY . . . 54.34 -86.38 0.01 OUTLIER Glycine 2 N--CA 1.682 15.053 3 O-C-N 64.523 -36.36 . . . . 14.44 97.904 -2.666 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' PHE . . . . . 0.663 ' O ' ' O ' ' D' ' 14' ' ' TRP 0.748 36.8 t80 -52.61 -56.47 15.13 Favored 'General case' 1 N--CA 1.618 7.953 3 CA-C-N 103.182 -6.509 . . . . 15.14 105.848 172.763 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' TRP . . . . . 1.659 ' CE3' ' CZ3' ' D' ' 14' ' ' TRP 1.032 0.0 OUTLIER -6.0 -137.1 0.0 OUTLIER 'General case' 4 N--CA 1.083 -18.801 4 CA-C-N 140.396 10.544 . . . . 15.08 106.217 170.829 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' GLY . . . . . 0.842 ' N ' ' CA ' ' D' ' 14' ' ' TRP . . . -61.61 117.61 12.09 Favored Glycine 3 C--N 0.985 -18.932 3 O-C-N 143.498 12.998 . . . . 14.7 91.084 -174.249 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' LYS . . . . . 1.53 ' CD ' ' CB ' ' D' ' 16' ' ' LYS 0.533 2.3 mtpt 97.29 87.85 0.01 OUTLIER 'General case' 4 C--O 1.454 11.816 4 C-N-CA 159.533 15.133 . . . . 15.74 110.54 -165.247 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' VAL . . . . . 1.531 ' C ' ' CA ' ' D' ' 17' ' ' VAL 0.74 2.3 m -176.02 155.11 0.31 Allowed 'Isoleucine or valine' 3 N--CA 1.199 -12.993 3 C-N-CA 158.054 14.541 . . . . 14.02 100.029 -170.162 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ASP . . . . . 1.542 ' CA ' ' CB ' ' D' ' 18' ' ' ASP 0.583 6.1 t0 -122.83 142.75 50.42 Favored 'General case' 2 C--O 0.756 -24.917 4 CA-C-O 166.984 22.326 . . . . 13.41 130.775 167.612 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' VAL . . . . . 1.296 ' CB ' ' CG2' ' D' ' 19' ' ' VAL 0.784 1.5 t -78.39 -163.62 0.06 OUTLIER 'Isoleucine or valine' 3 C--N 1.507 7.454 2 O-C-N 76.241 -29.037 . . . . 13.3 117.853 176.55 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' ASP . . . . . 1.41 ' C ' ' N ' ' D' ' 21' ' ' VAL 0.804 0.4 OUTLIER 33.02 -64.75 0.0 OUTLIER 'General case' 2 C--N 1.14 -8.513 5 C-N-CA 171.302 19.841 . . . . 13.1 82.922 -156.695 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' VAL . . . . . 1.41 ' N ' ' C ' ' D' ' 20' ' ' ASP 0.281 0.4 OUTLIER -62.01 -41.96 93.05 Favored 'Isoleucine or valine' 3 N--CA 1.077 -19.101 2 CA-C-O 94.17 -12.348 . . . . 12.3 115.747 -167.02 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' VAL . . . . . 1.651 ' CB ' ' CG1' ' D' ' 22' ' ' VAL 0.873 2.4 t -49.26 -64.84 0.26 Allowed 'Isoleucine or valine' 1 N--CA 1.324 -6.751 2 CA-C-O 146.606 12.622 . . . . 12.78 120.516 167.601 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . -45.19 -42.44 8.75 Favored Glycine 3 CA--C 1.309 -12.816 3 O-C-N 89.949 -20.469 . . . . 13.04 111.351 176.642 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.1 -31.09 30.89 Favored 'General case' 1 CA--C 1.289 -9.062 1 CA-C-O 104.124 -7.608 . . . . 12.97 105.222 -172.301 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' GLN . . . . . 1.29 ' CG ' ' CD ' ' D' ' 25' ' ' GLN 0.72 1.0 OUTLIER -36.93 -65.75 0.27 Allowed 'General case' 2 C--O 0.908 -16.909 2 C-N-CA 159.83 15.252 . . . . 12.72 112.673 150.488 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ALA . . . . . 1.398 ' C ' ' CA ' ' D' ' 26' ' ' ALA 0.426 . . -70.48 -64.05 0.97 Allowed 'General case' 2 CA--C 1.897 14.317 3 CA-C-O 99.885 -9.626 . . . . 11.41 97.167 -177.522 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' LEU . . . . . 1.517 ' CD1' ' CG ' ' D' ' 27' ' ' LEU . 0.2 OUTLIER -61.51 -16.47 47.73 Favored 'General case' 1 N--CA 1.333 -6.276 1 O-C-N 140.231 10.957 . . . . 11.92 120.833 -174.759 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' GLY . . . . . 0.672 ' CA ' ' CE ' ' D' ' 54' ' ' MET . . . -93.83 -26.73 14.04 Favored Glycine 2 C--O 1.466 14.656 1 CA-C-O 104.574 -8.903 . . . . 14.0 111.567 178.888 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' ARG . . . . . . . . . . . . 0.412 1.5 mmt180 -75.02 -40.22 60.68 Favored 'General case' 2 C--N 0.953 -16.663 3 C-N-CA 148.218 10.607 . . . . 14.08 111.516 176.555 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' LEU . . . . . 1.337 ' C ' ' CA ' ' D' ' 30' ' ' LEU 0.909 62.1 tp -71.29 -50.35 33.48 Favored 'General case' 2 CA--C 1.941 15.998 4 C-N-CA 140.607 7.563 . . . . 14.99 109.165 177.71 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' LEU . . . . . 1.562 ' CB ' ' CA ' ' D' ' 31' ' ' LEU 0.36 0.1 OUTLIER -65.91 -60.66 2.64 Favored 'General case' 3 CA--C 1.809 10.934 3 CA-C-O 96.147 -11.406 . . . . 14.99 96.019 175.279 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' VAL . . . . . . . . . . . . . 1.5 m -73.19 -37.93 53.49 Favored 'Isoleucine or valine' 4 C--O 1.038 -10.052 2 CA-C-O 89.727 -14.463 . . . . 13.02 100.598 -179.586 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' VAL . . . . . 0.452 ' O ' ' CG2' ' D' ' 33' ' ' VAL 0.575 0.4 OUTLIER -72.15 -48.81 47.4 Favored 'Isoleucine or valine' 4 C--N 1.115 -9.593 1 CA-C-N 145.608 12.913 . . . . 12.84 117.836 -168.973 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' TYR . . . . . 1.514 ' CA ' ' N ' ' D' ' 34' ' ' TYR 0.807 4.4 m-85 -106.95 85.99 2.18 Favored Pre-proline 2 N--CA 1.726 13.329 2 CA-C-O 100.252 -9.451 . . . . 14.86 87.427 -172.5 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' PRO . . . . . 1.387 ' N ' ' CD ' ' D' ' 35' ' ' PRO 0.61 37.6 Cg_endo -48.7 -31.94 20.45 Favored 'Trans proline' 3 C--O 0.976 -12.596 2 CA-C-O 87.639 -13.567 . . . . 14.73 109.445 176.069 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' TRP . . . . . 1.488 ' C ' ' CA ' ' D' ' 36' ' ' TRP . 1.2 p90 -63.1 -27.33 69.32 Favored 'General case' 4 N--CA 1.797 16.91 3 O-C-N 147.89 15.744 . . . . 15.58 86.717 -168.149 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' THR . . . . . 0.515 ' O ' ' CE1' ' D' ' 41' ' ' PHE 0.817 0.3 OUTLIER -39.39 -51.37 2.1 Favored 'General case' 3 C--O 1.534 16.041 2 CA-C-O 140.523 9.725 . . . . 15.52 125.669 -178.408 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' GLN . . . . . 1.501 ' CD ' ' CG ' ' D' ' 38' ' ' GLN . 32.3 tt0 -46.57 -35.92 6.32 Favored 'General case' 1 C--O 0.988 -12.704 3 O-C-N 102.809 -12.432 . . . . 15.27 125.936 176.835 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' ARG . . . . . 1.5 ' CD ' ' NE ' ' D' ' 39' ' ' ARG 0.305 1.5 ttp180 -49.51 -25.81 2.96 Favored 'General case' 2 C--N 1.579 10.577 4 O-C-N 148.756 16.285 . . . . 13.41 123.138 174.346 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' PHE . . . . . 1.546 ' CZ ' ' CE2' ' D' ' 40' ' ' PHE 0.536 1.0 OUTLIER -84.49 -53.23 5.57 Favored 'General case' 2 C--N 0.983 -15.331 3 CA-C-N 98.907 -8.315 . . . . 14.73 120.546 178.895 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' PHE . . . . . 1.632 ' CE2' ' CD2' ' D' ' 41' ' ' PHE 0.931 0.0 OUTLIER -73.22 75.9 1.3 Allowed 'General case' 4 CA--C 1.289 -9.096 2 O-C-N 136.216 8.448 . . . . 13.96 99.93 178.145 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' GLN . . . . . 1.445 ' CG ' ' CA ' ' D' ' 42' ' ' GLN 0.334 3.2 mt-30 -108.94 -7.16 15.46 Favored 'General case' 4 C--N 1.832 21.558 3 O-C-N 93.579 -18.201 . . . . 13.48 127.257 178.469 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' HIS . . . . . 1.562 ' CA ' ' CB ' ' D' ' 43' ' ' HIS 0.464 0.0 OUTLIER -2.1 -67.76 0.0 OUTLIER 'General case' 2 C--N 0.937 -17.329 1 C-N-CA 162.97 16.508 . . . . 15.38 105.713 135.916 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' PHE . . . . . 1.498 ' CB ' ' CA ' ' D' ' 44' ' ' PHE 0.641 18.2 m-30 -48.99 -80.46 0.01 OUTLIER 'General case' 4 N--CA 1.012 -22.337 3 C-N-CA 150.264 11.426 . . . . 17.25 135.595 173.606 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' GLY . . . . . 0.812 ' C ' ' CA ' ' D' ' 46' ' ' ASN . . . 147.23 -120.34 1.24 Allowed Glycine 2 C--O 0.961 -16.966 3 CA-C-N 142.559 11.527 . . . . 15.58 121.378 172.189 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' ASN . . . . . 1.499 ' CA ' ' N ' ' D' ' 46' ' ' ASN 0.731 5.6 t-20 -50.23 90.37 0.0 OUTLIER 'General case' 1 N--CA 1.685 11.296 4 CA-C-O 103.951 -7.69 . . . . 13.92 119.657 176.217 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' LEU . . . . . 1.584 ' CB ' ' CA ' ' D' ' 47' ' ' LEU 0.495 0.0 OUTLIER -127.94 28.61 5.54 Favored 'General case' 3 C--N 1.0 -14.595 3 CA-C-O 138.361 8.696 . . . . 13.24 105.737 -179.516 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' SER . . . . . 1.254 ' CB ' ' OG ' ' D' ' 48' ' ' SER 0.817 0.0 OUTLIER -73.55 34.44 0.08 Allowed 'General case' 2 C--O 1.521 15.391 2 CA-C-N 96.594 -9.366 . . . . 12.24 119.413 -177.069 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' SER . . . . . 0.814 ' O ' ' CG1' ' D' ' 53' ' ' VAL . 9.4 p 136.25 129.47 0.0 OUTLIER 'General case' 1 N--CA 1.661 10.121 1 N-CA-C 96.511 -5.366 . . . . 13.26 96.511 -165.492 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' ALA . . . . . 1.37 ' CA ' ' C ' ' D' ' 50' ' ' ALA 0.342 . . -46.5 -39.27 10.53 Favored 'General case' 3 CA--C 1.908 14.735 3 CA-C-O 90.169 -14.253 . . . . 11.73 92.617 -177.872 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' GLY . . . . . 1.262 ' C ' ' N ' ' D' ' 52' ' ' ALA . . . 150.27 -92.7 0.14 Allowed Glycine 1 C--N 1.075 -13.934 4 CA-C-O 155.404 19.335 . . . . 12.65 77.386 -5.491 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' ALA . . . . . 1.509 ' CA ' ' CB ' ' D' ' 52' ' ' ALA 0.683 . . -123.74 39.64 3.91 Favored 'General case' 4 C--N 1.875 23.418 3 O-C-N 87.781 -20.835 . . . . 12.89 115.223 -167.624 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' VAL . . . . . 1.404 ' CB ' ' CG2' ' D' ' 53' ' ' VAL 0.62 0.8 OUTLIER -98.1 -40.1 9.17 Favored 'Isoleucine or valine' 3 N--CA 0.951 -25.392 2 C-N-CA 156.586 13.954 . . . . 12.16 79.243 -177.315 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' MET . . . . . 1.375 ' CG ' ' SD ' ' D' ' 54' ' ' MET 0.328 24.6 mmt -80.82 -48.62 12.18 Favored 'General case' 3 C--O 1.734 26.597 3 O-C-N 110.568 -7.582 . . . . 14.02 102.197 175.183 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' ASN . . . . . 1.261 ' CG ' ' OD1' ' D' ' 55' ' ' ASN 0.904 0.8 OUTLIER -58.48 -60.78 3.26 Favored 'General case' 3 N--CA 0.938 -26.059 2 CA-C-N 139.133 9.97 . . . . 15.52 113.407 -178.595 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' ASN . . . . . 1.328 ' C ' ' O ' ' D' ' 56' ' ' ASN 1.047 0.1 OUTLIER 19.4 67.3 0.24 Allowed Pre-proline 3 C--O 1.656 22.495 4 C-N-CA 161.201 15.8 . . . . 13.03 112.323 -175.892 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' PRO . . . . . 1.424 ' CB ' ' CA ' ' D' ' 57' ' ' PRO 0.605 7.6 Cg_endo -44.28 -50.29 7.96 Favored 'Trans proline' 4 N--CA 1.16 -18.107 2 CA-C-N 142.711 9.147 . . . . 14.62 111.715 -168.954 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' LYS . . . . . 1.381 ' CE ' ' NZ ' ' D' ' 58' ' ' LYS 0.533 0.0 OUTLIER -24.84 -78.08 0.01 OUTLIER 'General case' 1 C--N 1.174 -7.065 4 C-N-CA 151.924 12.09 . . . . 15.02 98.351 173.317 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' VAL . . . . . 1.604 ' CB ' ' CG2' ' D' ' 59' ' ' VAL 0.622 57.8 t -49.39 -88.6 0.0 OUTLIER 'Isoleucine or valine' 4 CA--C 1.837 11.999 3 CA-C-O 94.483 -12.199 . . . . 14.67 93.554 -176.399 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' LYS . . . . . 1.618 ' CD ' ' CE ' ' D' ' 60' ' ' LYS . 1.3 mttp -15.98 -72.99 0.01 OUTLIER 'General case' 3 C--O 1.46 12.172 1 O-C-N 147.322 15.389 . . . . 14.48 112.86 174.674 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' ALA . . . . . 1.527 ' CA ' ' CB ' ' D' ' 61' ' ' ALA 0.311 . . -22.32 -77.49 0.01 OUTLIER 'General case' 2 N--CA 1.18 -13.946 4 CA-C-O 159.514 18.769 . . . . 13.74 119.81 163.059 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' HIS . . . . . 1.55 ' ND1' ' CG ' ' D' ' 62' ' ' HIS 0.276 3.0 t60 -43.38 -22.61 0.04 OUTLIER 'General case' 2 C--O 1.085 -7.567 2 O-C-N 92.81 -18.681 . . . . 13.41 121.61 168.493 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' GLY . . . . . . . . . . . . . . . -78.49 -50.53 6.07 Favored Glycine 4 C--O 1.563 20.688 5 N-CA-C 92.98 -8.048 . . . . 15.65 92.98 -175.073 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' LYS . . . . . 1.566 ' CG ' ' CD ' ' D' ' 64' ' ' LYS . 0.9 OUTLIER -37.86 -82.61 0.01 OUTLIER 'General case' 4 C--O 0.834 -20.766 2 C-N-CA 140.243 7.417 . . . . 16.11 109.913 177.359 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' ARG . . . . . 1.548 ' C ' ' CA ' ' D' ' 65' ' ' ARG 0.433 0.1 OUTLIER -63.48 -9.62 13.74 Favored 'General case' 3 N--CA 1.27 -9.454 1 CA-C-O 94.603 -12.142 . . . . 17.81 115.078 -178.679 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' VAL . . . . . 1.04 ' N ' ' CA ' ' D' ' 65' ' ' ARG . 1.8 t -85.54 -58.61 3.34 Favored 'Isoleucine or valine' 3 C--N 0.931 -17.611 2 O-C-N 156.589 21.181 . . . . 14.28 108.566 170.484 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' LEU . . . . . 1.485 ' CA ' ' CB ' ' D' ' 67' ' ' LEU 0.683 10.9 mt -62.95 -41.97 99.68 Favored 'General case' 4 CA--C 1.857 12.773 3 CA-C-O 88.837 -14.887 . . . . 13.9 103.07 171.643 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' ASP . . . . . 1.511 ' CB ' ' CG ' ' D' ' 68' ' ' ASP 0.659 0.7 OUTLIER -55.9 -43.61 77.42 Favored 'General case' 3 N--CA 0.922 -26.852 3 O-C-N 136.595 8.684 . . . . 14.74 106.135 175.835 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' ALA . . . . . 1.521 ' C ' ' CA ' ' D' ' 69' ' ' ALA 0.45 . . -61.07 -55.54 31.37 Favored 'General case' 3 C--N 1.021 -13.695 3 O-C-N 96.452 -16.405 . . . . 15.7 116.612 -162.22 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' PHE . . . . . 1.1 ' CA ' ' O ' ' D' ' 70' ' ' PHE 0.284 86.0 t80 -91.55 -47.31 7.48 Favored 'General case' 3 C--O 1.976 39.308 4 CA-C-O 70.167 -23.777 . . . . 17.22 119.19 175.155 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' THR . . . . . 1.45 ' CB ' ' CG2' ' D' ' 71' ' ' THR 0.506 1.2 m 83.53 50.88 0.01 OUTLIER 'General case' 3 C--N 1.0 -14.624 5 CA-C-O 153.439 15.876 . . . . 17.96 135.723 9.981 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' GLN . . . . . 1.006 ' NE2' ' N ' ' D' ' 73' ' ' GLY 0.308 0.0 OUTLIER 133.9 -102.37 0.0 OUTLIER 'General case' 3 C--N 1.175 -6.994 3 CA-C-O 79.82 -19.181 . . . . 14.44 109.659 -115.848 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' GLY . . . . . 1.53 ' CA ' ' C ' ' D' ' 73' ' ' GLY . . . 2.49 -62.21 0.0 OUTLIER Glycine 3 N--CA 1.102 -23.582 4 C-N-CA 158.708 17.337 . . . . 12.94 94.876 178.272 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' LEU . . . . . 0.625 ' O ' ' O ' ' D' ' 75' ' ' LYS 0.666 1.5 mm? -57.66 -41.63 81.91 Favored 'General case' 4 N--CA 1.031 -21.409 4 C-N-CA 164.338 17.055 . . . . 13.05 84.493 -148.138 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' LYS . . . . . 1.585 ' CG ' ' CD ' ' D' ' 75' ' ' LYS 0.727 0.0 OUTLIER -37.38 -112.94 0.0 OUTLIER 'General case' 4 C--O 1.896 35.106 3 C-N-CA 143.531 8.732 . . . . 14.78 99.145 167.571 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' HIS . . . . . 1.583 ' CB ' ' CG ' ' D' ' 76' ' ' HIS 0.615 21.7 p80 -94.39 112.98 24.78 Favored 'General case' 3 N--CA 1.72 13.05 1 CA-C-N 134.553 7.888 . . . . 16.98 111.121 -176.709 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' LEU . . . . . 1.436 ' CB ' ' CG ' ' D' ' 77' ' ' LEU 0.452 4.1 mp -76.17 -36.53 58.66 Favored 'General case' 3 N--CA 1.303 -7.809 4 CA-C-O 146.345 12.498 . . . . 14.54 111.413 178.484 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' ASP . . . . . 1.469 ' CB ' ' CG ' ' D' ' 78' ' ' ASP 0.833 0.0 OUTLIER 143.21 -64.12 0.0 OUTLIER 'General case' 2 CA--C 1.851 12.521 4 O-C-N 71.222 -32.174 . . . . 15.31 89.547 25.857 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' ASP . . . . . 1.408 ' CB ' ' CA ' ' D' ' 79' ' ' ASP 0.704 3.1 t0 -140.57 59.27 1.55 Allowed 'General case' 1 N--CA 1.216 -12.154 2 CA-C-N 93.916 -10.583 . . . . 14.14 118.357 -176.325 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.03 -46.39 16.58 Favored 'General case' 1 C--O 1.05 -9.442 3 CA-C-O 103.804 -7.76 . . . . 16.69 119.224 177.654 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' LYS . . . . . 1.611 ' CB ' ' CA ' ' D' ' 81' ' ' LYS 0.905 0.1 OUTLIER -46.3 -20.36 0.11 Allowed 'General case' 4 C--O 1.039 -10.009 4 O-C-N 152.809 18.818 . . . . 16.98 128.64 178.097 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' GLY . . . . . 0.494 ' O ' ' N ' ' D' ' 85' ' ' ALA . . . -55.53 -93.04 0.01 OUTLIER Glycine 1 C--N 1.48 8.535 4 CA-C-O 159.365 21.536 . . . . 16.24 95.289 -173.227 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' ALA . . . . . 1.365 ' CA ' ' C ' ' D' ' 83' ' ' ALA 0.476 . . -35.79 -62.2 0.43 Allowed 'General case' 2 CA--C 1.9 14.422 4 O-C-N 99.913 -13.698 . . . . 15.35 99.049 -163.19 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' PHE . . . . . 1.604 ' CD1' ' CG ' ' D' ' 84' ' ' PHE 1.403 0.4 OUTLIER -122.02 37.64 4.32 Favored 'General case' 1 C--N 1.453 5.067 5 CA-C-O 147.724 13.154 . . . . 14.38 125.003 173.148 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' ALA . . . . . 1.152 ' CA ' ' N ' ' D' ' 85' ' ' ALA 0.435 . . -60.9 -36.22 78.69 Favored 'General case' 2 N--CA 2.078 30.97 3 CA-C-N 89.462 -12.608 . . . . 14.22 108.021 177.855 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' GLN . . . . . 1.59 ' CB ' ' CA ' ' D' ' 86' ' ' GLN 0.638 5.6 pt20 -31.38 -42.55 0.05 OUTLIER 'General case' 3 C--O 0.987 -12.763 3 C-N-CA 143.674 8.79 . . . . 16.9 115.32 155.542 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' LEU . . . . . 1.448 ' CB ' ' CA ' ' D' ' 87' ' ' LEU 0.535 0.0 OUTLIER -116.13 -17.94 10.72 Favored 'General case' 2 N--CA 1.055 -20.188 1 O-C-N 145.237 14.086 . . . . 13.54 106.792 -173.384 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' SER . . . . . 1.489 ' CA ' ' CB ' ' D' ' 88' ' ' SER 0.447 2.3 t -82.26 57.17 3.49 Favored 'General case' 1 CA--C 1.268 -9.897 2 O-C-N 110.944 -7.347 . . . . 13.39 99.033 162.254 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' GLY . . . . . . . . . . . . . . . -123.43 -65.84 0.21 Allowed Glycine 4 C--N 1.047 -15.488 4 O-C-N 97.55 -15.718 . . . . 13.67 85.81 170.821 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' LEU . . . . . 1.543 ' CB ' ' CG ' ' D' ' 90' ' ' LEU . 0.0 OUTLIER -82.23 -38.29 24.73 Favored 'General case' 4 C--O 0.87 -18.89 4 C-N-CA 158.587 14.755 . . . . 12.73 113.305 -141.791 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' HIS . . . . . . . . . . . . . 22.9 m80 -87.43 -51.0 6.18 Favored 'General case' 2 C--N 1.581 10.631 3 CA-C-O 82.103 -18.094 . . . . 13.1 97.016 -178.021 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' CYS . . . . . 1.41 ' C ' ' CA ' ' D' ' 92' ' ' CYS 0.271 40.6 t -61.61 -82.01 0.02 OUTLIER 'General case' 3 CA--C 1.881 13.699 2 O-C-N 162.017 24.573 . . . . 12.09 107.806 174.634 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' ASN . . . . . 1.518 ' CB ' ' CG ' ' D' ' 93' ' ' ASN 0.64 2.0 m120 -57.77 -45.53 85.84 Favored 'General case' 3 N--CA 1.227 -11.593 2 CA-C-O 94.427 -12.225 . . . . 13.18 113.191 -172.93 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' LYS . . . . . 1.456 ' CD ' ' CE ' ' D' ' 94' ' ' LYS 0.756 0.0 OUTLIER -87.58 -70.05 0.65 Allowed 'General case' 2 N--CA 1.263 -9.795 5 O-C-N 157.505 21.753 . . . . 14.61 133.514 175.746 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' LEU . . . . . 1.313 ' CB ' ' CG ' ' D' ' 95' ' ' LEU 0.718 0.0 OUTLIER -88.7 -6.09 57.69 Favored 'General case' 3 C--N 0.921 -18.025 3 C-N-CA 102.467 -7.693 . . . . 14.95 119.135 168.217 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' HIS . . . . . 1.444 ' C ' ' CA ' ' D' ' 96' ' ' HIS . 0.9 OUTLIER 79.52 90.3 0.05 Allowed 'General case' 4 N--CA 1.801 17.102 5 O-C-N 99.745 -14.347 . . . . 16.47 96.443 168.253 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' VAL . . . . . 0.624 ' N ' ' CA ' ' D' ' 96' ' ' HIS 0.785 20.6 t -106.09 116.26 49.48 Favored 'Isoleucine or valine' 3 C--O 1.06 -8.917 2 CA-C-O 90.578 -14.058 . . . . 16.08 114.195 -170.095 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' D' ' 100' ' ' GLN . 1.5 m120 -37.69 114.18 0.71 Allowed Pre-proline 3 C--N 1.102 -10.155 3 CA-C-N 143.315 11.871 . . . . 17.9 130.947 174.215 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' PRO . . . . . 1.434 ' CG ' ' CB ' ' D' ' 99' ' ' PRO . 71.6 Cg_exo -24.03 -41.14 0.03 OUTLIER 'Trans proline' 2 CA--C 1.316 -10.392 2 CA-C-O 151.09 12.871 . . . . 15.06 120.87 -178.49 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' GLN . . . . . 1.519 ' CB ' ' CG ' ' D' ' 100' ' ' GLN 0.784 0.9 OUTLIER -65.37 -58.03 6.9 Favored 'General case' 3 N--CA 1.564 5.229 3 O-C-N 91.249 -19.657 . . . . 13.87 90.816 -146.806 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' ASN . . . . . 1.529 ' CA ' ' N ' ' D' ' 101' ' ' ASN 1.091 0.1 OUTLIER -51.46 -26.31 7.95 Favored 'General case' 3 N--CA 1.678 10.965 4 O-C-N 138.726 10.016 . . . . 14.56 131.74 178.896 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' PHE . . . . . 1.347 ' CA ' ' N ' ' D' ' 102' ' ' PHE 0.797 12.2 m-30 -70.24 -57.74 4.55 Favored 'General case' 2 N--CA 1.899 22.018 4 CA-C-O 88.824 -14.893 . . . . 15.22 83.92 -175.351 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' ARG . . . . . 1.561 ' CG ' ' CD ' ' D' ' 103' ' ' ARG 1.638 0.1 OUTLIER -80.2 -10.4 59.76 Favored 'General case' 2 C--N 1.092 -10.625 4 CA-C-O 157.969 18.033 . . . . 14.68 131.413 -166.592 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' LEU . . . . . 1.467 ' CB ' ' CG ' ' D' ' 104' ' ' LEU 0.264 0.6 OUTLIER -73.63 -54.77 7.36 Favored 'General case' 1 N--CA 1.317 -7.108 3 O-C-N 100.971 -13.58 . . . . 14.91 103.291 -179.888 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' LEU . . . . . 1.552 ' CG ' ' CD1' ' D' ' 105' ' ' LEU 0.301 6.0 tt -89.2 -21.26 23.36 Favored 'General case' 3 C--O 1.489 13.686 5 O-C-N 98.207 -15.308 . . . . 14.63 91.116 -179.445 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.45 -42.82 39.83 Favored Glycine 2 N--CA 1.336 -7.995 3 CA-C-N 152.099 15.863 . . . . 14.63 115.517 174.49 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' ASN . . . . . 1.525 ' N ' ' CA ' ' D' ' 107' ' ' ASN 0.747 1.0 OUTLIER -65.75 -48.35 72.15 Favored 'General case' 3 N--CA 1.694 11.771 4 CA-C-O 98.171 -10.442 . . . . 14.09 90.817 -173.973 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' VAL . . . . . 1.467 ' O ' ' CA ' ' D' ' 108' ' ' VAL 0.75 2.3 t -45.95 -35.0 2.0 Favored 'Isoleucine or valine' 4 C--O 0.729 -26.337 2 CA-C-N 130.571 6.078 . . . . 13.74 118.324 162.719 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' LEU . . . . . 1.499 ' CD2' ' CG ' ' D' ' 109' ' ' LEU 0.848 0.2 OUTLIER -72.9 -75.5 0.14 Allowed 'General case' 3 N--CA 0.966 -24.645 4 CA-C-O 95.668 -11.634 . . . . 14.26 101.013 -177.881 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' ALA . . . . . 1.537 ' CA ' ' N ' ' D' ' 110' ' ' ALA 0.97 . . -18.36 -52.22 0.01 OUTLIER 'General case' 4 CA--C 2.017 18.928 4 O-C-N 146.555 14.909 . . . . 15.54 90.839 170.159 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' LEU . . . . . 1.267 ' C ' ' CA ' ' D' ' 112' ' ' VAL 0.272 0.0 OUTLIER -88.05 -52.5 5.22 Favored 'General case' 4 N--CA 1.21 -12.449 3 CA-C-O 88.826 -14.892 . . . . 16.18 108.08 -162.586 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' VAL . . . . . 1.525 ' CB ' ' CG1' ' D' ' 112' ' ' VAL 0.687 1.1 m -78.45 -20.55 13.25 Favored 'Isoleucine or valine' 3 C--N 0.844 -21.385 4 O-C-N 143.039 12.712 . . . . 15.41 105.419 -177.267 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' VAL . . . . . . . . . . . . 0.779 0.0 OUTLIER -84.75 -63.92 1.14 Allowed 'Isoleucine or valine' 2 CA--C 1.332 -7.434 3 O-C-N 141.776 11.923 . . . . 14.39 84.823 -178.164 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' ALA . . . . . 0.677 ' N ' ' O ' ' D' ' 110' ' ' ALA . . . -70.09 14.1 0.13 Allowed 'General case' 2 N--CA 1.627 8.423 1 CA-C-O 101.057 -9.068 . . . . 13.13 112.135 -175.857 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' ARG . . . . . 1.461 ' CB ' ' CA ' ' D' ' 115' ' ' ARG 0.867 0.0 OUTLIER -97.68 -55.0 2.94 Favored 'General case' 3 C--N 1.033 -13.186 4 CA-C-O 144.991 11.853 . . . . 14.8 118.64 161.052 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' ASN . . . . . 1.391 ' C ' ' N ' ' D' ' 117' ' ' PHE 1.511 0.0 OUTLIER -12.29 -67.6 0.01 OUTLIER 'General case' 2 C--N 1.611 11.938 3 O-C-N 88.478 -21.389 . . . . 12.17 111.999 151.198 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' PHE . . . . . 1.391 ' N ' ' C ' ' D' ' 116' ' ' ASN 0.665 2.0 m-85 -113.48 5.21 16.59 Favored 'General case' 3 C--N 1.715 16.468 2 CA-C-O 97.187 -10.911 . . . . 12.97 108.116 179.111 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.77 -147.36 25.06 Favored Glycine 3 CA--C 1.194 -19.978 4 CA-C-N 145.67 12.941 . . . . 12.36 114.445 144.73 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' GLY . . . . . 1.525 ' CA ' ' N ' ' D' ' 119' ' ' GLY . . . -73.8 -41.95 40.26 Favored Glycine 2 N--CA 1.72 17.606 4 O-C-N 96.922 -15.458 . . . . 11.6 94.997 -166.096 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' GLN . . . . . 1.608 ' CB ' ' CG ' ' D' ' 120' ' ' GLN 0.305 13.2 mt-30 -41.44 -35.32 0.66 Allowed 'General case' 2 C--O 0.955 -14.396 4 O-C-N 96.833 -15.51 . . . . 12.6 98.705 177.536 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' PHE . . . . . 1.564 ' CA ' ' CB ' ' D' ' 121' ' ' PHE 0.707 0.1 OUTLIER -79.44 50.34 1.1 Allowed 'General case' 1 C--O 1.044 -9.756 2 N-CA-C 138.628 10.233 . . . . 15.11 138.628 176.914 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' THR . . . . . 0.483 ' O ' ' O ' ' D' ' 121' ' ' PHE 0.672 1.3 p -41.26 172.35 0.03 OUTLIER Pre-proline 3 CA--C 1.24 -10.962 2 N-CA-C 130.622 7.267 . . . . 13.44 130.622 -166.429 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' PRO . . . . . 1.642 ' CG ' ' CD ' ' D' ' 123' ' ' PRO 1.042 18.4 Cg_exo -58.28 -42.93 51.29 Favored 'Trans proline' 3 CA--C 1.891 18.342 0 CA-C-O 128.977 3.657 . . . . 12.96 116.245 170.786 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' ASN . . . . . 1.456 ' CG ' ' CB ' ' D' ' 124' ' ' ASN 0.666 0.2 OUTLIER -52.52 -97.84 0.0 OUTLIER 'General case' 4 CA--C 1.827 11.61 4 CA-C-O 98.106 -10.473 . . . . 14.55 97.263 159.553 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' VAL . . . . . 0.476 ' N ' ' OG1' ' D' ' 122' ' ' THR 0.987 0.4 OUTLIER -40.35 -49.01 0.62 Allowed 'Isoleucine or valine' 4 C--O 1.626 20.914 1 O-C-N 134.796 7.56 . . . . 14.36 102.062 -176.074 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' GLN . . . . . 1.123 ' OE1' ' CD ' ' D' ' 126' ' ' GLN . 0.0 OUTLIER -71.62 -51.3 23.92 Favored 'General case' 4 N--CA 1.565 5.325 3 O-C-N 104.057 -11.652 . . . . 15.38 112.173 -173.57 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' ALA . . . . . 1.527 ' CB ' ' CA ' ' D' ' 127' ' ' ALA 0.891 . . -76.09 -70.84 0.42 Allowed 'General case' 2 C--O 1.387 8.337 4 CA-C-O 77.446 -20.312 . . . . 15.57 90.312 -170.734 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' LEU . . . . . 1.476 ' CA ' ' N ' ' D' ' 128' ' ' LEU 1.142 0.1 OUTLIER -26.65 -74.59 0.02 OUTLIER 'General case' 3 N--CA 1.725 13.275 3 CA-C-N 155.776 17.534 . . . . 16.69 96.908 -170.374 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' PHE . . . . . 1.491 ' CA ' ' N ' ' D' ' 129' ' ' PHE . 59.7 m-85 -46.58 -32.82 3.67 Favored 'General case' 3 N--CA 1.759 14.977 5 O-C-N 160.523 23.639 . . . . 15.02 128.259 -171.191 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' GLN . . . . . 1.362 ' CG ' ' CA ' ' D' ' 130' ' ' GLN 0.846 0.3 OUTLIER -55.76 -35.89 66.71 Favored 'General case' 3 CA--C 1.727 7.772 4 O-C-N 101.767 -13.083 . . . . 14.14 95.954 178.238 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' LYS . . . . . 1.538 ' CB ' ' CG ' ' D' ' 131' ' ' LYS 1.061 0.0 OUTLIER -94.8 -7.33 40.68 Favored 'General case' 2 C--O 1.027 -10.608 2 O-C-N 105.863 -10.523 . . . . 12.73 111.538 178.45 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' VAL . . . . . 1.483 ' CA ' ' N ' ' D' ' 132' ' ' VAL 0.593 1.1 m -69.61 -31.16 47.79 Favored 'Isoleucine or valine' 3 N--CA 1.723 13.183 2 C-N-CA 90.627 -12.429 . . . . 13.85 110.629 -179.126 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' VAL . . . . . 0.453 ' N ' ' N ' ' D' ' 132' ' ' VAL 0.643 0.8 OUTLIER -46.29 -44.9 6.04 Favored 'Isoleucine or valine' 1 C--N 1.139 -8.567 4 O-C-N 137.303 9.127 . . . . 14.37 122.478 -177.667 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 134' ' ' ALA . . . . . . . . . . . . 0.282 . . -73.75 -98.58 0.01 OUTLIER 'General case' 3 CA--C 1.686 6.177 3 C-N-CA 149.37 11.068 . . . . 14.0 83.547 -172.106 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' D' D ' 135' ' ' GLY . . . . . . . . . . . . . . . -54.33 -36.21 57.16 Favored Glycine 3 CA--C 1.182 -20.779 5 CA-C-O 91.644 -16.086 . . . . 13.58 102.823 -170.481 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' D' D ' 136' ' ' VAL . . . . . 0.473 ' N ' ' O ' ' D' ' 132' ' ' VAL 0.688 21.6 t -79.07 -35.75 17.79 Favored 'Isoleucine or valine' 3 C--O 1.569 17.89 3 CA-C-N 144.129 13.965 . . . . 12.61 101.332 -175.41 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 137' ' ' ALA . . . . . 0.598 ' CB ' ' CD1' ' D' ' 140' ' ' LEU 0.554 . . -132.81 65.01 1.6 Allowed 'General case' 3 C--O 1.012 -11.435 5 C-N-CA 91.594 -12.042 . . . . 12.4 82.606 -168.543 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 138' ' ' ASN . . . . . 1.423 ' CA ' ' N ' ' D' ' 138' ' ' ASN 0.777 0.8 OUTLIER -120.68 -58.75 1.81 Allowed 'General case' 4 N--CA 1.817 17.923 3 C-N-CA 167.187 18.195 . . . . 12.11 108.251 145.911 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 139' ' ' ALA . . . . . 0.49 ' O ' ' N ' ' D' ' 142' ' ' HIS 0.805 . . -19.43 -60.25 0.02 OUTLIER 'General case' 1 C--N 1.209 -5.531 4 CA-C-N 154.756 17.071 . . . . 10.84 108.446 144.931 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 140' ' ' LEU . . . . . 1.514 ' CG ' ' CD1' ' D' ' 140' ' ' LEU 0.982 0.6 OUTLIER -43.33 -55.68 3.93 Favored 'General case' 2 C--O 1.001 -11.977 3 CA-C-O 100.018 -9.563 . . . . 11.45 102.615 178.749 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 141' ' ' ALA . . . . . 1.443 ' C ' ' N ' ' D' ' 142' ' ' HIS . . . -72.44 -11.84 60.85 Favored 'General case' 4 CA--C 1.857 12.787 2 CA-C-N 132.398 6.908 . . . . 11.21 101.129 -170.132 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' D' D ' 142' ' ' HIS . . . . . 1.49 ' CB ' ' CA ' ' D' ' 142' ' ' HIS 0.999 0.2 OUTLIER -102.3 98.76 8.84 Favored 'General case' 4 C--O 0.905 -17.06 4 C-N-CA 97.473 -9.691 . . . . 12.09 94.222 -172.775 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 143' ' ' LYS . . . . . 1.469 ' CE ' ' CD ' ' D' ' 143' ' ' LYS 0.526 0.0 OUTLIER 174.39 -65.93 0.01 OUTLIER 'General case' 2 C--O 1.626 20.912 5 O-C-N 151.128 17.767 . . . . 14.22 141.109 110.872 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' D' D ' 144' ' ' TYR . . . . . 1.556 ' CZ ' ' CE1' ' D' ' 144' ' ' TYR 1.288 10.8 t80 -7.44 -84.29 0.0 OUTLIER 'General case' 2 C--O 1.532 15.957 3 O-C-N 78.559 -27.588 . . . . 14.55 118.416 -161.434 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' D' D ' 145' ' ' HIS . . . . . 1.457 ' C ' ' CA ' ' D' ' 145' ' ' HIS 1.342 0.0 OUTLIER . . . . . 4 C--O 1.747 27.253 5 O-C-N 145.609 14.318 . . . . 16.63 146.623 -169.036 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HEM . . . . . 1.672 ' CMA' ' C3A' ' A' ' 142' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' HEM . . . . . 1.612 ' C3D' ' CAD' ' B' ' 146' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 142' ' ' HEM . . . . . 1.646 ' CAB' ' C3B' ' C' ' 142' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 146' ' ' HEM . . . . . 1.615 ' CBA' ' CAA' ' D' ' 146' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' VAL . . . . . 1.586 ' CB ' ' CG1' ' A' ' 1' ' ' VAL . 58.8 t . . . . . 3 CA--C 1.87 13.271 1 N-CA-C 99.971 -4.085 . . . . 12.9 99.971 . . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . 1.637 ' CA ' ' CB ' ' A' ' 2' ' ' LEU 1.361 3.9 mm? -29.66 84.91 0.0 OUTLIER 'General case' 3 CA--C 2.046 20.032 3 O-C-N 89.0 -21.063 . . . . 12.46 116.345 55.779 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . 1.582 ' CA ' ' CB ' ' A' ' 3' ' ' SER 0.755 4.9 t -110.88 151.44 27.87 Favored 'General case' 4 C--O 1.675 23.458 4 O-C-N 148.308 16.005 . . . . 14.55 117.708 -171.183 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ALA . . . . . 1.275 ' N ' ' CA ' ' A' ' 4' ' ' ALA 0.393 . . -55.48 -17.68 5.67 Favored 'General case' 3 N--CA 1.97 25.544 5 C-N-CA 100.806 -8.357 . . . . 13.6 123.824 -165.501 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' A' ' 8' ' ' SER 0.375 . . -91.3 -31.93 15.91 Favored 'General case' 3 C--O 0.975 -13.358 1 C-N-CA 97.224 -9.791 . . . . 12.07 104.103 -179.001 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASN . . . . . 0.829 HD22 ' HB3' ' A' ' 3' ' ' SER 0.632 66.1 m-20 -14.84 -79.41 0.0 OUTLIER 'General case' 1 C--N 1.463 5.519 2 C-N-CA 141.551 7.94 . . . . 11.81 95.093 166.222 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 1.567 ' CD ' ' CE ' ' A' ' 7' ' ' LYS 0.274 10.7 mmtt -45.06 -57.02 4.14 Favored 'General case' 3 CA--C 1.901 14.449 4 O-C-N 136.637 8.71 . . . . 16.17 97.087 -174.839 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' SER . . . . . 1.341 ' O ' ' C ' ' A' ' 8' ' ' SER 0.615 10.4 m -89.81 40.23 0.99 Allowed 'General case' 4 C--O 1.639 21.602 3 CA-C-O 79.972 -19.109 . . . . 14.73 90.661 -170.299 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . 1.433 ' CA ' ' N ' ' A' ' 9' ' ' ASN 0.576 2.0 m-80 -69.49 -45.38 69.11 Favored 'General case' 3 N--CA 1.816 17.841 4 CA-C-N 170.569 24.258 . . . . 14.81 102.619 80.074 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . 1.52 ' CA ' ' C ' ' A' ' 10' ' ' VAL 0.575 44.5 t -44.69 -65.27 0.17 Allowed 'Isoleucine or valine' 3 C--O 1.424 10.249 3 O-C-N 130.635 4.96 . . . . 16.01 99.416 -175.574 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . 1.524 ' CE ' ' NZ ' ' A' ' 11' ' ' LYS 0.732 0.0 OUTLIER -78.87 -40.07 33.46 Favored 'General case' 4 C--O 0.727 -26.402 0 CA-C-N 123.185 2.721 . . . . 16.53 117.028 -167.076 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . 1.587 ' CA ' ' CB ' ' A' ' 12' ' ' ALA 0.302 . . -44.04 -40.23 4.68 Favored 'General case' 4 C--O 0.799 -22.636 5 CA-C-O 146.075 12.369 . . . . 15.29 130.984 163.67 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . 1.064 ' HB3' ' O ' ' A' ' 10' ' ' VAL . . . -45.75 -87.87 0.0 OUTLIER 'General case' 3 C--O 0.957 -14.326 2 CA-C-N 90.608 -12.087 . . . . 15.67 100.316 177.145 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TRP . . . . . 1.647 ' CH2' ' CZ2' ' A' ' 14' ' ' TRP 1.04 1.0 OUTLIER -14.69 -66.4 0.01 OUTLIER 'General case' 3 CA--C 1.282 -9.362 2 C-N-CA 155.976 13.71 . . . . 14.58 102.322 161.307 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -34.15 8.72 0.0 OUTLIER Glycine 2 C--N 1.115 -11.75 4 C-N-CA 163.856 19.789 . . . . 13.56 109.047 154.82 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . 1.593 ' CE ' ' CD ' ' A' ' 16' ' ' LYS 0.424 0.0 OUTLIER -159.44 -28.99 0.07 Allowed 'General case' 1 C--N 1.522 8.096 4 CA-C-N 161.319 22.559 . . . . 13.25 110.054 -149.475 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . 1.456 ' CG2' ' CB ' ' A' ' 17' ' ' VAL 0.671 0.1 OUTLIER -60.69 -98.02 0.0 OUTLIER 'Isoleucine or valine' 3 C--N 1.764 18.598 5 O-C-N 97.921 -15.487 . . . . 13.58 99.063 169.504 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . 1.233 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . 88.56 -127.8 8.79 Favored Glycine 3 C--O 0.818 -25.875 3 O-C-N 104.885 -11.135 . . . . 13.02 103.097 -178.597 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . 1.49 ' C ' ' CA ' ' A' ' 19' ' ' GLY . . . -102.36 9.7 56.1 Favored Glycine 3 CA--C 1.785 16.938 3 C-N-CA 146.486 11.517 . . . . 12.13 110.342 -160.095 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . 1.428 ' CB ' ' CG ' ' A' ' 20' ' ' ASN 0.716 1.1 m120 -93.47 -33.72 13.69 Favored 'General case' 2 C--O 1.079 -7.902 2 C-N-CA 147.46 10.304 . . . . 10.53 105.838 175.149 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . 0.528 ' HB3' ' CD ' ' A' ' 22' ' ' PRO . . . -58.01 -48.32 97.31 Favored Pre-proline 2 C--O 1.341 5.92 2 O-C-N 140.099 10.875 . . . . 10.91 90.409 -170.35 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . 1.603 ' CB ' ' CG ' ' A' ' 22' ' ' PRO 0.331 0.1 OUTLIER -45.71 -34.4 11.6 Favored 'Trans proline' 3 C--N 1.03 -16.236 3 N-CA-C 125.985 5.34 . . . . 11.21 125.985 -178.399 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . 0.81 ' HB3' ' O ' ' A' ' 20' ' ' ASN 0.469 . . -89.89 -53.63 4.41 Favored 'General case' 3 N--CA 1.236 -11.134 3 C-N-CA 165.285 17.434 . . . . 12.41 100.835 -158.77 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.922 0.0 OUTLIER -94.29 -72.09 0.63 Allowed 'General case' 2 CA--C 1.281 -9.391 4 CA-C-O 99.233 -9.936 . . . . 15.76 91.067 -162.766 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . 1.416 ' C ' ' CA ' ' A' ' 25' ' ' GLY . . . -21.64 -77.56 0.01 OUTLIER Glycine 3 CA--C 1.873 22.428 4 CA-C-N 155.243 17.292 . . . . 15.15 113.513 -177.116 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . 1.314 ' CB ' ' CA ' ' A' ' 26' ' ' ALA 0.611 . . -59.59 -6.41 1.12 Allowed 'General case' 1 C--O 1.591 19.038 4 CA-C-N 93.81 -11.195 . . . . 15.19 124.474 168.58 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLN . . . . . 1.174 ' NE2' ' OE1' ' A' ' 27' ' ' GLN 0.876 5.2 pp0? -90.4 -36.83 14.37 Favored 'General case' 3 CA--C 1.69 6.341 2 CA-C-O 103.83 -7.748 . . . . 14.75 91.853 176.272 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . 0.787 . . -31.22 -47.92 0.12 Allowed 'General case' 4 N--CA 1.118 -17.055 2 C-N-CA 140.881 7.673 . . . . 12.33 112.698 176.126 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . 1.48 ' CD2' ' CG ' ' A' ' 29' ' ' LEU 1.352 0.0 OUTLIER -173.79 -81.5 0.01 OUTLIER 'General case' 3 CA--C 0.79 -28.26 5 C-N-CA 161.817 16.047 . . . . 11.73 84.621 -105.099 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . 1.075 ' NE2' ' CD ' ' A' ' 30' ' ' GLN 0.471 0.0 OUTLIER -18.9 -45.28 0.0 OUTLIER 'General case' 1 C--N 1.455 5.168 4 O-C-N 69.994 -32.941 . . . . 12.26 102.831 -157.347 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 1.578 ' CD ' ' CG ' ' A' ' 31' ' ' ARG 1.082 2.1 mmt180 156.56 -65.27 0.0 OUTLIER 'General case' 2 C--O 1.64 21.608 2 C-N-CA 167.356 18.263 . . . . 16.13 112.126 -45.28 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . 1.441 ' CE ' ' SD ' ' A' ' 32' ' ' MET 0.753 0.0 OUTLIER -86.88 -10.56 53.08 Favored 'General case' 2 C--N 1.811 20.646 3 O-C-N 111.22 -7.175 . . . . 16.42 102.925 -169.58 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . 1.411 ' N ' ' C ' ' A' ' 32' ' ' MET 1.507 0.0 OUTLIER -49.88 -39.71 40.34 Favored 'General case' 3 C--N 1.689 15.356 2 O-C-N 137.616 9.323 . . . . 16.72 117.837 -177.53 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . 1.421 ' CB ' ' CA ' ' A' ' 34' ' ' LEU 0.744 0.0 OUTLIER -125.52 -11.91 6.75 Favored 'General case' 2 C--O 1.509 14.725 4 CA-C-O 100.478 -9.344 . . . . 16.7 100.105 -159.017 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . 1.546 ' CA ' ' CB ' ' A' ' 35' ' ' SER 0.871 52.6 p -123.83 -12.48 7.56 Favored 'General case' 2 C--O 1.051 -9.377 2 C-N-CA 86.425 -14.11 . . . . 16.06 111.532 172.811 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . 1.642 ' CB ' ' CG ' ' A' ' 36' ' ' PHE . 40.7 m-85 -125.12 42.45 0.75 Allowed Pre-proline 3 C--O 1.463 12.306 3 CA-C-O 135.38 7.276 . . . . 14.77 113.281 173.261 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . 1.338 ' N ' ' CD ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -24.99 -40.29 0.03 OUTLIER 'Trans proline' 2 C--N 1.591 13.338 3 C-N-CA 132.279 8.652 . . . . 13.96 111.347 -173.83 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . 0.668 0.6 OUTLIER -54.67 -28.6 48.54 Favored 'General case' 3 C--O 0.871 -18.859 1 CA-C-O 98.206 -10.426 . . . . 13.1 111.609 -175.737 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . 1.174 HG22 ' O ' ' A' ' 36' ' ' PHE 0.756 0.0 OUTLIER -57.2 -42.71 81.81 Favored 'General case' 3 CA--C 1.284 -9.279 1 O-C-N 141.247 11.592 . . . . 12.56 105.252 177.638 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . 1.281 ' CB ' ' CG ' ' A' ' 40' ' ' LYS 0.622 0.0 OUTLIER -54.73 12.08 0.0 OUTLIER 'General case' 2 C--N 1.173 -7.101 4 O-C-N 98.528 -15.107 . . . . 12.76 107.07 -170.969 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . 1.592 ' CA ' ' CB ' ' A' ' 41' ' ' THR 0.557 0.0 OUTLIER -112.75 -16.41 12.77 Favored 'General case' 3 N--CA 1.008 -22.54 4 O-C-N 83.897 -24.252 . . . . 13.34 114.299 -173.645 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TYR . . . . . 1.376 ' C ' ' N ' ' A' ' 43' ' ' PHE 0.387 39.6 m-85 -36.41 -37.2 0.12 Allowed 'General case' 1 C--O 0.771 -24.083 3 O-C-N 97.373 -15.83 . . . . 13.06 104.809 133.146 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . 1.567 ' CA ' ' CB ' ' A' ' 43' ' ' PHE 0.396 0.0 OUTLIER -124.19 62.66 30.29 Favored Pre-proline 2 C--N 1.732 17.198 3 C-N-CA 98.137 -9.425 . . . . 13.09 130.876 -176.885 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . 1.447 ' CB ' ' CA ' ' A' ' 44' ' ' PRO 0.823 50.6 Cg_endo -31.62 -53.93 0.29 Allowed 'Trans proline' 4 C--N 1.779 23.198 4 CA-C-N 85.148 -11.411 . . . . 11.91 128.289 -174.847 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HIS . . . . . 1.533 ' CA ' ' CB ' ' A' ' 45' ' ' HIS 0.546 0.0 OUTLIER -58.27 -21.66 49.58 Favored 'General case' 4 C--O 1.491 13.764 3 C-N-CA 162.98 16.512 . . . . 11.55 124.914 -179.231 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . 0.856 ' HB2' HD23 ' A' ' 48' ' ' LEU 0.744 5.8 m-30 -157.48 93.27 1.28 Allowed 'General case' 4 CA--C 1.221 -11.684 2 O-C-N 137.922 9.514 . . . . 12.81 104.406 -123.018 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . 0.906 ' OD2' ' HA ' ' A' ' 49' ' ' SER 0.76 19.1 t70 -24.35 81.66 0.0 OUTLIER 'General case' 4 C--O 1.508 14.678 4 C-N-CA 161.652 15.981 . . . . 13.03 89.054 141.7 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . 1.499 ' CB ' ' CA ' ' A' ' 48' ' ' LEU 0.412 27.5 mt -93.47 39.47 1.06 Allowed 'General case' 3 C--O 1.425 10.337 3 O-C-N 103.72 -11.863 . . . . 11.79 85.463 -162.902 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . 1.218 ' CB ' ' HB3' ' A' ' 52' ' ' SER 0.734 46.5 t 29.79 -92.42 0.01 OUTLIER 'General case' 3 CA--C 1.116 -15.717 4 CA-C-O 138.191 8.615 . . . . 11.82 101.46 -172.339 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HIS . . . . . 1.557 ' CG ' ' CB ' ' A' ' 50' ' ' HIS 0.77 0.9 OUTLIER 70.09 -101.7 0.04 OUTLIER 'General case' 2 CA--C 1.36 -6.364 3 C-N-CA 165.521 17.528 . . . . 14.08 118.255 -55.347 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -101.05 98.04 1.76 Allowed Glycine 2 C--O 1.519 17.936 3 N-CA-C 97.094 -6.403 . . . . 12.23 97.094 169.517 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . 1.266 ' CB ' ' OG ' ' A' ' 52' ' ' SER 1.036 0.9 OUTLIER -116.53 115.66 26.17 Favored 'General case' 1 C--N 1.214 -5.325 4 CA-C-O 89.372 -14.632 . . . . 11.54 131.167 176.193 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . 1.318 ' O ' ' C ' ' A' ' 53' ' ' ALA 1.042 . . -44.51 -0.6 0.0 OUTLIER 'General case' 2 C--O 1.679 23.689 4 O-C-N 162.822 25.076 . . . . 13.38 104.746 -173.436 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . 1.356 ' O ' ' C ' ' A' ' 54' ' ' GLN 0.713 55.2 tt0 -69.54 -57.07 5.68 Favored 'General case' 1 C--O 1.646 21.937 3 CA-C-O 135.564 7.364 . . . . 14.11 95.33 -171.735 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . 1.58 ' CB ' ' CA ' ' A' ' 55' ' ' GLN 0.499 0.0 OUTLIER -60.38 -22.86 63.8 Favored 'General case' 2 CA--C 1.725 7.695 2 CA-C-N 105.073 -5.512 . . . . 12.89 122.079 -160.373 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . 1.527 ' CE ' ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -71.3 -59.97 2.48 Favored 'General case' 2 C--O 1.632 21.192 1 C-N-CA 170.629 19.571 . . . . 13.57 114.53 -173.176 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . 1.561 ' CA ' ' CB ' ' A' ' 57' ' ' ALA 0.962 . . -79.54 -67.79 0.73 Allowed 'General case' 1 C--O 0.902 -17.215 3 N-CA-C 87.184 -8.821 . . . . 13.31 87.184 168.922 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HIS . . . . . 1.546 ' CB ' ' CA ' ' A' ' 58' ' ' HIS 0.873 9.3 t60 -37.52 -58.93 0.82 Allowed 'General case' 2 N--CA 1.618 7.941 1 CA-C-N 128.731 5.241 . . . . 14.32 113.711 -178.954 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . 1.399 ' N ' ' C ' ' A' ' 58' ' ' HIS . . . -68.0 -42.42 85.15 Favored Glycine 4 N--CA 1.084 -24.815 2 N-CA-C 88.944 -9.662 . . . . 14.94 88.944 -154.963 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . 1.507 ' C ' ' CA ' ' A' ' 60' ' ' GLN 0.417 0.0 OUTLIER -31.38 -63.72 0.16 Allowed 'General case' 4 C--O 0.863 -19.266 3 C-N-CA 144.189 8.996 . . . . 14.63 104.685 174.066 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . 1.484 ' CB ' ' CA ' ' A' ' 61' ' ' LYS 0.591 0.0 OUTLIER -69.86 -48.51 58.54 Favored 'General case' 3 C--N 1.073 -11.444 4 CA-C-N 91.155 -11.839 . . . . 14.0 131.822 -179.012 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . 1.555 ' CB ' ' CG1' ' A' ' 62' ' ' VAL 0.431 0.3 OUTLIER -60.06 -71.26 0.11 Allowed 'Isoleucine or valine' 3 C--O 1.404 9.23 3 O-C-N 145.366 14.166 . . . . 14.99 93.153 167.783 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . 1.628 ' CB ' ' CA ' ' A' ' 63' ' ' ALA 0.68 . . -55.29 -27.48 47.04 Favored 'General case' 1 CA--C 1.263 -10.091 4 CA-C-N 152.932 16.242 . . . . 14.75 118.152 -179.292 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . 1.461 ' C ' ' CA ' ' A' ' 64' ' ' ASN 0.419 69.1 m-20 -59.61 -39.92 85.84 Favored 'General case' 3 CA--C 1.811 11.019 3 CA-C-N 136.918 8.963 . . . . 14.25 106.347 175.291 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ALA . . . . . 1.582 ' CA ' ' CB ' ' A' ' 65' ' ' ALA 0.445 . . -75.78 -41.75 52.1 Favored 'General case' 4 CA--C 1.139 -14.829 1 O-C-N 107.799 -9.313 . . . . 13.62 106.239 -177.031 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . 0.525 ' HB2' ' HA ' ' A' ' 63' ' ' ALA 0.724 49.9 mt -19.28 -59.49 0.02 OUTLIER 'General case' 3 N--CA 1.315 -7.2 4 O-C-N 98.468 -15.145 . . . . 14.16 112.073 157.753 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . 1.468 ' C ' ' CA ' ' A' ' 67' ' ' THR 0.827 21.5 p -69.06 -21.32 64.1 Favored 'General case' 3 N--CA 1.099 -18.021 2 O-C-N 106.298 -10.251 . . . . 13.87 120.644 -171.856 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . 0.867 ' N ' ' CA ' ' A' ' 67' ' ' THR 0.348 0.0 OUTLIER -87.27 -49.8 7.02 Favored 'General case' 2 C--N 0.95 -16.761 3 CA-C-O 138.547 8.784 . . . . 15.1 117.418 171.335 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . 1.452 ' CA ' ' N ' ' A' ' 69' ' ' ALA 0.34 . . -65.72 -42.86 90.55 Favored 'General case' 4 N--CA 1.759 14.98 3 CA-C-N 100.512 -7.586 . . . . 15.85 97.889 -177.491 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLN . . . . . 1.362 ' CD ' ' CG ' ' A' ' 70' ' ' GLN 0.766 0.0 OUTLIER -67.35 -45.49 76.19 Favored 'General case' 4 C--O 0.987 -12.753 3 O-C-N 112.233 -6.542 . . . . 15.5 96.03 -174.56 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -101.5 41.1 2.21 Favored Glycine 4 N--CA 1.099 -23.769 2 O-C-N 98.976 -14.828 . . . . 15.25 112.358 -162.692 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . 1.22 ' CE1' ' NE2' ' A' ' 72' ' ' HIS 0.664 16.2 p80 174.46 69.7 0.0 OUTLIER 'General case' 2 C--O 1.536 16.184 1 O-C-N 111.256 -7.026 . . . . 14.9 110.72 158.892 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . 1.583 ' CG ' ' CD2' ' A' ' 73' ' ' LEU 0.483 0.5 OUTLIER -75.48 105.09 6.33 Favored 'General case' 3 N--CA 1.599 7.022 2 N-CA-C 77.447 -12.427 . . . . 15.44 77.447 -177.168 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . 1.334 ' CG ' ' CB ' ' A' ' 74' ' ' ASN 0.391 28.9 p-10 159.86 -33.57 0.0 OUTLIER 'General case' 4 C--O 1.868 33.64 5 C-N-CA 147.98 10.512 . . . . 15.7 93.038 152.013 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . 1.09 ' HA ' ' O ' ' A' ' 74' ' ' ASN 0.301 53.0 t0 -136.99 38.75 2.56 Favored 'General case' 4 C--O 1.523 15.485 3 CA-C-N 143.94 12.154 . . . . 15.81 104.057 -159.783 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . 0.986 ' O ' ' C ' ' A' ' 77' ' ' PRO 0.48 0.0 OUTLIER -47.9 -50.8 51.4 Favored Pre-proline 3 C--O 1.548 16.783 2 CA-C-O 137.112 8.101 . . . . 16.47 113.87 174.534 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PRO . . . . . 1.409 ' C ' ' N ' ' A' ' 78' ' ' GLY 0.638 6.3 Cg_endo -54.91 -65.72 0.11 Allowed 'Trans proline' 3 CA--C 2.118 29.72 4 CA-C-O 93.641 -11.066 . . . . 15.41 93.019 -169.575 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . 1.455 ' C ' ' CA ' ' A' ' 78' ' ' GLY . . . -54.18 -17.08 7.19 Favored Glycine 4 N--CA 1.91 30.244 4 O-C-N 161.562 24.289 . . . . 14.27 111.353 -179.162 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . 1.593 ' CA ' ' CB ' ' A' ' 79' ' ' THR 0.426 0.0 OUTLIER -70.34 -51.78 27.52 Favored 'General case' 3 C--N 0.988 -15.134 2 CA-C-N 131.888 7.844 . . . . 14.61 121.73 178.566 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 1.499 ' CD2' ' CG ' ' A' ' 80' ' ' LEU 0.507 0.2 OUTLIER -82.18 8.62 10.49 Favored 'General case' 2 C--O 1.499 14.185 1 O-C-N 105.804 -10.56 . . . . 14.03 118.602 178.883 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . 1.628 ' CA ' ' CB ' ' A' ' 81' ' ' SER 0.395 41.4 t -79.39 -63.02 1.51 Allowed 'General case' 3 N--CA 1.288 -8.529 5 CA-C-O 80.95 -18.643 . . . . 13.34 88.152 -149.203 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASN . . . . . 1.386 ' N ' ' CA ' ' A' ' 82' ' ' ASN 0.735 0.2 OUTLIER -41.52 -79.21 0.02 OUTLIER 'General case' 4 N--CA 1.863 20.178 2 O-C-N 151.938 18.274 . . . . 13.41 100.654 -176.208 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.794 ' C ' ' CA ' ' A' ' 84' ' ' SER . 1.8 mp -58.13 -6.03 0.55 Allowed 'General case' 3 C--O 1.419 10.026 1 O-C-N 133.349 6.656 . . . . 11.34 108.714 -177.478 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' SER . . . . . 1.348 ' CA ' ' N ' ' A' ' 84' ' ' SER 0.477 0.1 OUTLIER -72.14 -29.92 64.53 Favored 'General case' 4 N--CA 1.857 19.912 4 CA-C-O 135.737 7.446 . . . . 11.6 117.244 175.272 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASN . . . . . 1.522 ' C ' ' CA ' ' A' ' 85' ' ' ASN 0.598 27.5 t-20 -104.5 -74.69 0.64 Allowed 'General case' 4 C--O 1.691 24.318 4 CA-C-O 74.237 -21.839 . . . . 12.64 103.659 -170.571 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . 1.536 ' CD2' ' CG ' ' A' ' 86' ' ' LEU . 39.9 tp -14.56 -59.37 0.01 OUTLIER 'General case' 2 C--O 1.061 -8.828 3 CA-C-N 151.317 15.508 . . . . 12.39 113.826 164.295 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . 1.446 ' N ' ' C ' ' A' ' 86' ' ' LEU 0.721 61.5 m80 -67.32 -54.43 20.72 Favored 'General case' 4 C--N 1.68 14.961 3 O-C-N 134.769 7.543 . . . . 11.33 130.042 -168.641 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . 1.523 ' C ' ' CA ' ' A' ' 88' ' ' ALA 0.257 . . -43.57 -81.72 0.01 OUTLIER 'General case' 4 C--N 1.615 12.116 4 CA-C-N 96.632 -9.349 . . . . 12.36 101.458 -168.908 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HIS . . . . . 1.231 ' NE2' ' CE1' ' A' ' 89' ' ' HIS 0.623 24.5 t-80 146.89 -126.57 0.0 OUTLIER 'General case' 3 N--CA 1.254 -10.27 4 O-C-N 106.814 -9.929 . . . . 16.16 91.885 -25.73 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . 0.779 ' HE3' ' OD1' ' A' ' 85' ' ' ASN 0.283 0.0 OUTLIER -49.85 -53.95 22.49 Favored 'General case' 2 C--O 1.483 13.367 4 O-C-N 96.141 -16.599 . . . . 14.79 106.773 173.982 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . 1.588 ' CG ' ' CD2' ' A' ' 91' ' ' LEU 0.636 2.1 mp -62.06 -57.85 10.06 Favored 'General case' 3 N--CA 1.775 15.811 2 C-N-CA 149.5 11.12 . . . . 14.68 103.63 172.35 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . 0.83 ' HA ' ' O ' ' A' ' 88' ' ' ALA 0.523 1.1 ptt180 42.72 63.06 1.55 Allowed 'General case' 2 C--O 1.44 11.119 3 CA-C-O 135.641 7.401 . . . . 13.33 125.139 -174.898 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . 1.603 ' CB ' ' CG1' ' A' ' 93' ' ' VAL 1.027 0.5 OUTLIER -115.91 91.5 1.81 Allowed 'Isoleucine or valine' 2 C--O 1.01 -11.552 3 C-N-CA 168.622 18.769 . . . . 11.88 102.017 -140.11 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASN . . . . . 1.472 ' CA ' ' N ' ' A' ' 94' ' ' ASN 0.768 21.7 t-20 -60.61 130.23 90.16 Favored Pre-proline 2 C--O 0.738 -25.855 1 CA-C-N 103.635 -6.166 . . . . 12.77 101.654 -175.703 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . 0.71 ' N ' ' O ' ' A' ' 94' ' ' ASN 0.654 10.1 Cg_endo -54.74 -41.94 73.19 Favored 'Trans proline' 3 N--CA 1.16 -18.107 3 O-C-N 140.305 10.108 . . . . 14.14 123.441 176.612 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . 0.848 HG11 ' HG2' ' D' ' 100' ' ' GLN 0.309 28.2 m -52.97 -18.3 1.35 Allowed 'Isoleucine or valine' 2 N--CA 1.199 -13.003 2 CA-C-O 110.107 -4.758 . . . . 16.2 115.414 166.306 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . 1.562 ' N ' ' CA ' ' A' ' 97' ' ' ASN 0.757 80.7 m-20 -82.84 -4.25 57.83 Favored 'General case' 1 N--CA 1.687 11.403 2 O-C-N 138.222 9.701 . . . . 15.47 106.145 168.313 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . 0.688 ' CE1' HD12 ' A' ' 136' ' ' LEU 0.432 25.0 m-85 -86.0 -59.24 2.35 Favored 'General case' 3 CA--C 1.311 -8.231 3 CA-C-N 136.68 8.855 . . . . 13.47 102.828 -179.401 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . 1.419 ' CE ' ' NZ ' ' A' ' 99' ' ' LYS 0.308 0.4 OUTLIER -42.55 -11.5 0.01 OUTLIER 'General case' 2 C--O 1.469 12.648 2 C-N-CA 135.84 5.656 . . . . 12.45 107.26 175.313 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . 1.511 ' CB ' ' CG ' ' A' ' 100' ' ' LEU 1.062 0.0 OUTLIER -86.51 -76.65 0.34 Allowed 'General case' 3 N--CA 1.086 -18.644 4 C-N-CA 146.81 10.044 . . . . 11.09 104.155 -178.759 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . 0.551 ' HB2' ' SD ' ' A' ' 32' ' ' MET 0.376 6.4 tp -48.07 -28.13 2.69 Favored 'General case' 2 CA--C 1.733 8.005 3 CA-C-N 104.589 -5.732 . . . . 12.24 117.959 -172.336 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.9 m -84.95 -39.19 18.42 Favored 'General case' 2 CA--C 1.187 -12.99 3 C-N-CA 145.931 9.692 . . . . 12.41 107.459 -172.594 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HIS . . . . . 1.483 ' CB ' ' CA ' ' A' ' 103' ' ' HIS 0.409 8.2 t-80 -59.72 -57.96 10.66 Favored 'General case' 3 CA--C 1.68 5.979 3 CA-C-N 155.626 17.466 . . . . 13.56 103.544 158.449 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . 1.568 ' CA ' ' CB ' ' A' ' 104' ' ' SER 0.489 0.2 OUTLIER -57.79 -43.81 85.83 Favored 'General case' 2 C--N 1.132 -8.887 3 CA-C-O 102.685 -8.293 . . . . 12.98 101.197 -177.625 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . 1.554 ' CG ' ' CD1' ' A' ' 105' ' ' LEU 0.34 0.1 OUTLIER -74.6 -29.06 61.16 Favored 'General case' 2 N--CA 1.732 13.626 1 CA-C-O 128.947 4.213 . . . . 12.82 110.392 179.971 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . 1.529 ' CD2' ' CG ' ' A' ' 106' ' ' LEU 0.567 0.0 OUTLIER -71.88 1.69 6.68 Favored 'General case' 4 N--CA 1.83 18.537 2 C-N-CA 106.46 -6.096 . . . . 14.88 101.354 179.34 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . 0.493 HG23 HD22 ' B' ' 111' ' ' LEU 0.757 1.2 t -89.45 -83.75 0.13 Allowed 'Isoleucine or valine' 3 C--O 0.953 -14.544 4 O-C-N 95.68 -16.888 . . . . 14.04 95.932 -170.486 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . 1.538 ' CA ' ' CB ' ' A' ' 108' ' ' THR 0.8 0.7 OUTLIER 61.97 -96.23 0.06 Allowed 'General case' 2 C--O 0.809 -22.113 5 C-N-CA 167.557 18.343 . . . . 13.9 86.628 84.075 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . 1.09 ' C ' ' CA ' ' A' ' 109' ' ' LEU 0.624 0.1 OUTLIER -13.95 -86.88 0.0 OUTLIER 'General case' 4 CA--C 2.192 25.635 3 CA-C-O 132.102 5.715 . . . . 13.12 104.284 172.87 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . 0.96 ' O ' ' HG3' ' A' ' 114' ' ' PRO 1.118 . . -38.34 -96.5 0.0 OUTLIER 'General case' 4 C--O 1.451 11.671 4 C-N-CA 153.889 12.876 . . . . 11.3 82.401 164.826 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 111' ' ' SER . . . . . 0.635 ' HA ' ' O ' ' B' ' 114' ' ' ALA 0.533 0.9 OUTLIER -30.54 -59.65 0.19 Allowed 'General case' 1 C--N 1.222 -4.975 3 CA-C-N 144.636 12.471 . . . . 9.71 108.249 -179.023 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HIS . . . . . 0.439 ' NE2' ' NE2' ' A' ' 27' ' ' GLN 0.304 2.4 m-70 -73.92 -31.15 62.95 Favored 'General case' 1 N--CA 1.29 -8.431 4 CA-C-N 150.388 15.085 . . . . 11.97 122.989 176.957 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . 0.528 ' O ' ' HB2' ' A' ' 117' ' ' PHE 0.4 0.2 OUTLIER -123.86 56.29 10.54 Favored Pre-proline 3 CA--C 1.118 -15.651 1 CA-C-O 137.837 8.446 . . . . 9.59 118.221 176.551 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PRO . . . . . 1.53 ' CD ' ' CG ' ' A' ' 114' ' ' PRO 0.265 0.0 OUTLIER -78.16 23.86 0.57 Allowed 'Trans proline' 3 CA--C 1.104 -21.008 1 O-C-N 102.618 -9.727 . . . . 10.2 109.29 -174.838 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . 1.406 ' OG1' ' CB ' ' A' ' 115' ' ' THR 0.743 1.3 p -97.63 -42.93 7.42 Favored 'General case' 2 C--O 0.97 -13.626 3 O-C-N 93.013 -18.554 . . . . 10.62 109.345 176.291 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASN . . . . . 1.526 ' CA ' ' N ' ' A' ' 116' ' ' ASN 0.449 11.0 m120 -88.13 -17.4 31.06 Favored 'General case' 2 N--CA 1.691 11.601 3 C-N-CA 147.294 10.238 . . . . 11.13 103.474 -174.181 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PHE . . . . . 0.802 ' HE1' HD12 ' A' ' 109' ' ' LEU 0.301 1.1 t80 -103.02 71.26 1.12 Allowed 'General case' 3 C--O 0.922 -16.173 2 CA-C-O 141.047 9.975 . . . . 13.06 132.565 177.137 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . 1.363 ' CB ' ' CG2' ' A' ' 118' ' ' THR 0.371 0.0 OUTLIER -54.88 149.95 21.07 Favored Pre-proline 3 C--O 1.369 7.377 4 N-CA-C 134.192 8.59 . . . . 13.7 134.192 168.445 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PRO . . . . . 1.547 ' CA ' ' CB ' ' A' ' 119' ' ' PRO 0.338 16.4 Cg_exo -63.38 -43.43 18.03 Favored 'Trans proline' 2 N--CA 1.658 11.187 3 CA-C-O 91.178 -12.092 . . . . 14.36 103.272 -179.474 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ALA . . . . . 1.451 ' N ' ' C ' ' A' ' 119' ' ' PRO 0.358 . . -67.72 -49.92 60.11 Favored 'General case' 3 C--N 1.693 15.52 3 CA-C-O 85.591 -16.433 . . . . 15.35 110.304 166.521 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 121' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 121' ' ' VAL 1.112 0.8 OUTLIER -42.7 -38.19 0.84 Allowed 'Isoleucine or valine' 2 N--CA 1.265 -9.714 3 CA-C-N 168.607 23.367 . . . . 15.73 110.557 179.99 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HIS . . . . . 1.501 ' CA ' ' C ' ' A' ' 122' ' ' HIS 1.173 0.1 OUTLIER -64.34 -37.53 87.83 Favored 'General case' 4 C--O 1.489 13.677 1 C-N-CA 134.874 5.269 . . . . 15.49 113.536 -176.151 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . 0.791 ' N ' ' CA ' ' A' ' 122' ' ' HIS 0.379 . . -82.05 -42.0 19.85 Favored 'General case' 2 C--N 1.129 -8.995 2 CA-C-O 134.766 6.984 . . . . 13.62 117.756 -178.761 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . 1.405 ' CB ' ' CG ' ' A' ' 124' ' ' ASN 0.738 0.0 OUTLIER -60.07 -56.37 22.5 Favored 'General case' 2 C--O 1.76 27.968 2 O-C-N 110.129 -7.857 . . . . 14.56 106.929 170.367 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . 0.924 HD21 ' HB1' ' A' ' 13' ' ' ALA 0.431 38.2 mt -44.52 -47.0 10.11 Favored 'General case' 4 C--O 0.935 -15.474 3 CA-C-N 134.664 7.938 . . . . 13.84 131.168 166.24 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASN . . . . . 1.471 ' C ' ' CA ' ' A' ' 126' ' ' ASN 0.674 5.1 t30 -51.65 -51.03 59.04 Favored 'General case' 2 C--O 1.495 14.011 2 C-N-CA 136.962 6.105 . . . . 13.5 98.529 -173.895 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 1.588 ' CD ' ' CE ' ' A' ' 127' ' ' LYS 0.328 30.9 ttmt -75.46 -79.83 0.09 Allowed 'General case' 3 C--O 1.631 21.151 3 CA-C-O 73.96 -21.972 . . . . 12.23 103.12 179.824 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PHE . . . . . 1.579 ' CE1' ' CD1' ' A' ' 128' ' ' PHE 0.254 25.3 t80 -23.24 -63.64 0.04 OUTLIER 'General case' 4 C--N 0.815 -22.643 3 O-C-N 149.146 16.529 . . . . 14.06 107.19 -176.744 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . 0.374 16.6 mt -54.82 -34.69 63.1 Favored 'General case' 4 C--O 1.033 -10.332 3 CA-C-O 106.933 -6.27 . . . . 13.99 109.046 -170.928 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' A' ' 127' ' ' LYS 0.811 . . -40.63 -60.9 1.03 Allowed 'General case' 3 C--O 0.964 -13.961 3 O-C-N 142.038 12.086 . . . . 14.96 106.532 170.224 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASN . . . . . 1.192 ' CA ' ' N ' ' A' ' 131' ' ' ASN 0.906 2.2 t-20 -71.73 -46.59 58.11 Favored 'General case' 3 N--CA 2.052 29.659 2 CA-C-N 89.016 -12.811 . . . . 16.33 95.02 -179.605 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ASP . . . . . 1.099 ' CG ' ' OD2' ' A' ' 132' ' ' ASP 1.299 5.7 t70 -35.94 -79.57 0.01 OUTLIER 'General case' 4 C--O 1.398 8.885 3 O-C-N 97.936 -15.478 . . . . 14.76 109.438 168.772 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 133' ' ' SER . . . . . 0.647 ' O ' ' HB ' ' A' ' 137' ' ' THR 0.272 0.1 OUTLIER -46.97 -49.65 20.36 Favored 'General case' 3 C--O 1.071 -8.338 3 CA-C-O 138.638 8.828 . . . . 14.84 107.061 -168.688 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . 0.347 29.1 m -73.06 -59.28 2.78 Favored 'General case' 4 CA--C 1.732 7.947 5 O-C-N 89.708 -20.62 . . . . 13.76 90.123 -169.747 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . 1.491 ' C ' ' CA ' ' A' ' 135' ' ' VAL 0.413 0.8 OUTLIER -46.52 -67.19 0.13 Allowed 'Isoleucine or valine' 3 CA--C 1.774 9.593 1 CA-C-N 142.295 11.407 . . . . 13.41 118.668 -179.898 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . 1.562 ' CD1' ' CG ' ' A' ' 136' ' ' LEU 0.577 0.0 OUTLIER -60.33 9.73 0.02 OUTLIER 'General case' 3 C--O 1.436 10.891 5 CA-C-O 147.371 12.986 . . . . 12.66 135.312 170.868 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 137' ' ' THR . . . . . 1.602 ' CA ' ' CB ' ' A' ' 137' ' ' THR 0.72 0.5 OUTLIER -109.73 -20.82 12.67 Favored 'General case' 3 N--CA 1.116 -17.139 3 O-C-N 106.898 -9.876 . . . . 14.43 111.086 179.21 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 138' ' ' SER . . . . . 1.42 ' CB ' ' OG ' ' A' ' 138' ' ' SER 0.5 0.7 OUTLIER -28.45 -60.63 0.12 Allowed 'General case' 4 C--O 1.425 10.313 3 CA-C-O 84.184 -17.103 . . . . 14.32 90.222 -177.931 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LYS . . . . . 1.57 ' CE ' ' CD ' ' A' ' 139' ' ' LYS 1.22 0.0 OUTLIER -25.94 -76.14 0.02 OUTLIER 'General case' 2 C--O 1.589 18.949 3 CA-C-N 139.568 10.167 . . . . 14.88 108.86 -172.506 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 140' ' ' TYR . . . . . 1.636 ' CG ' ' CB ' ' A' ' 140' ' ' TYR 0.708 1.6 m-85 -21.75 -81.19 0.01 OUTLIER 'General case' 3 N--CA 1.312 -7.368 1 CA-C-O 131.607 5.48 . . . . 17.76 119.171 165.841 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ARG . . . . . 1.47 ' NH2' ' CZ ' ' A' ' 141' ' ' ARG 0.543 3.5 ttt180 . . . . . 2 CA--C 1.945 16.172 2 N-CA-C 128.06 6.319 . . . . 21.0 128.06 171.572 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . 1.568 ' HG2' ' CD1' ' B' ' 77' ' ' LEU 1.085 6.0 mmt . . . . . 2 N--CA 2.104 32.248 2 CA-C-O 86.204 -16.141 . . . . 13.09 88.659 . . . . . . . . . 4 2 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LEU . . . . . 1.506 ' CA ' ' CB ' ' B' ' 2' ' ' LEU 0.686 0.0 OUTLIER -169.5 -140.0 0.03 OUTLIER 'General case' 4 C--N 0.982 -15.383 3 CA-C-N 141.299 10.954 . . . . 13.28 101.689 -174.186 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 3' ' ' THR . . . . . 1.56 HG23 ' CB ' ' B' ' 5' ' ' GLU 0.492 0.4 OUTLIER -68.18 164.44 20.46 Favored 'General case' 1 CA--C 1.638 4.327 3 O-C-N 133.347 6.655 . . . . 12.32 100.795 178.727 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ALA . . . . . 1.532 ' CA ' ' N ' ' B' ' 4' ' ' ALA 0.717 . . -85.93 -7.57 58.59 Favored 'General case' 3 C--O 0.817 -21.679 2 O-C-N 108.34 -8.975 . . . . 11.28 103.62 -170.763 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLU . . . . . 1.56 ' CB ' HG23 ' B' ' 3' ' ' THR 0.765 0.4 OUTLIER -78.98 -22.53 45.44 Favored 'General case' 2 N--CA 1.925 23.309 4 O-C-N 153.352 19.158 . . . . 11.49 95.988 -177.623 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLU . . . . . 1.489 ' CB ' ' CA ' ' B' ' 6' ' ' GLU 0.366 1.5 mt-10 -113.38 -81.48 0.59 Allowed 'General case' 4 N--CA 1.786 16.329 3 CA-C-O 88.593 -15.003 . . . . 14.36 100.563 -178.164 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LYS . . . . . 1.291 ' CA ' ' C ' ' B' ' 7' ' ' LYS 0.341 0.0 OUTLIER -23.16 -28.3 0.0 OUTLIER 'General case' 3 CA--C 2.009 18.599 3 CA-C-N 146.518 13.326 . . . . 12.04 127.074 161.72 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ALA . . . . . 1.511 ' CB ' ' CA ' ' B' ' 8' ' ' ALA 0.425 . . -49.46 -67.99 0.22 Allowed 'General case' 4 C--O 1.102 -6.67 3 CA-C-O 99.614 -9.755 . . . . 13.7 108.82 166.538 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ALA . . . . . 0.712 ' C ' ' CA ' ' B' ' 10' ' ' VAL 0.304 . . -39.49 -68.79 0.15 Allowed 'General case' 2 C--N 1.465 5.598 2 C-N-CA 169.949 19.299 . . . . 13.24 106.377 155.422 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 10' ' ' VAL . . . . . 1.603 ' CB ' ' CG1' ' B' ' 10' ' ' VAL . 25.6 m -76.13 -24.44 16.37 Favored 'Isoleucine or valine' 2 N--CA 1.832 18.659 2 O-C-N 130.128 4.642 . . . . 13.36 121.106 172.319 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 11' ' ' THR . . . . . 1.604 ' CA ' ' CB ' ' B' ' 11' ' ' THR 0.369 17.3 m -60.25 -36.04 76.87 Favored 'General case' 3 C--O 0.798 -22.667 0 N-CA-C 121.122 3.749 . . . . 15.72 121.122 164.523 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLY . . . . . 1.106 ' N ' ' O ' ' B' ' 11' ' ' THR . . . -82.83 -58.59 2.34 Favored Glycine 3 C--O 1.499 16.659 3 CA-C-O 148.582 15.546 . . . . 15.04 105.913 -172.189 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 13' ' ' PHE . . . . . 1.502 ' C ' ' CA ' ' B' ' 13' ' ' PHE . 0.5 OUTLIER -68.86 -18.36 64.13 Favored 'General case' 3 CA--C 1.793 10.298 3 O-C-N 103.283 -11.716 . . . . 14.99 100.682 178.171 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 14' ' ' TRP . . . . . 1.02 ' HE1' ' CG ' ' B' ' 68' ' ' ASP 0.593 23.3 t-105 -58.89 -74.62 0.06 Allowed 'General case' 2 C--O 0.936 -15.444 2 CA-C-O 147.051 12.834 . . . . 15.96 106.546 -174.314 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLY . . . . . 1.103 ' O ' ' C ' ' B' ' 15' ' ' GLY . . . -10.95 -64.73 0.01 OUTLIER Glycine 4 C--O 1.887 40.93 3 O-C-N 101.404 -13.31 . . . . 16.03 112.333 161.395 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . 1.594 ' CD ' ' CE ' ' B' ' 16' ' ' LYS 0.315 0.1 OUTLIER -54.81 -8.52 0.26 Allowed 'General case' 3 CA--C 1.22 -11.735 3 CA-C-O 146.915 12.769 . . . . 15.65 119.187 173.131 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 17' ' ' VAL . . . . . 1.512 ' C ' ' CA ' ' B' ' 17' ' ' VAL 0.452 56.0 t -45.21 111.48 0.09 OUTLIER 'Isoleucine or valine' 2 C--O 1.628 20.975 3 O-C-N 73.526 -30.734 . . . . 15.82 113.034 153.561 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASP . . . . . 1.458 ' CB ' ' CG ' ' B' ' 18' ' ' ASP 0.371 1.9 t70 -79.4 46.7 0.76 Allowed 'General case' 2 C--O 1.046 -9.657 1 CA-C-O 107.047 -6.215 . . . . 14.97 117.228 -176.297 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 19' ' ' VAL . . . . . 1.539 ' CB ' ' CA ' ' B' ' 19' ' ' VAL 0.347 0.3 OUTLIER 6.2 -59.5 0.0 OUTLIER 'Isoleucine or valine' 2 CA--C 1.345 -6.915 2 CA-C-O 107.569 -5.967 . . . . 14.46 119.934 175.946 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASP . . . . . 1.269 ' CG ' ' OD1' ' B' ' 20' ' ' ASP 0.426 31.7 p-10 -56.3 53.56 0.0 OUTLIER 'General case' 4 C--N 0.917 -18.208 2 CA-C-N 133.961 7.619 . . . . 16.13 124.163 168.991 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 21' ' ' VAL . . . . . 1.595 ' CB ' ' CA ' ' B' ' 21' ' ' VAL 1.15 21.9 t 132.08 -11.79 0.0 OUTLIER 'Isoleucine or valine' 3 CA--C 1.294 -8.877 4 O-C-N 80.593 -26.317 . . . . 15.25 97.147 -168.034 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . 1.509 ' CB ' ' CG2' ' B' ' 22' ' ' VAL 0.528 0.4 OUTLIER -82.7 -34.63 11.85 Favored 'Isoleucine or valine' 1 CA--C 1.93 15.559 4 N-CA-C 78.561 -12.014 . . . . 14.41 78.561 172.706 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . 1.377 ' CA ' ' N ' ' B' ' 23' ' ' GLY . . . -96.75 -17.99 31.35 Favored Glycine 3 N--CA 1.845 25.926 4 C-N-CA 92.695 -14.098 . . . . 14.9 101.135 -175.713 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . 1.518 ' CA ' ' N ' ' B' ' 24' ' ' ALA 1.284 . . -54.14 -40.57 67.54 Favored 'General case' 3 N--CA 1.683 11.205 2 CA-C-O 135.467 7.318 . . . . 14.18 117.046 175.335 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLN . . . . . 1.513 ' N ' ' CA ' ' B' ' 25' ' ' GLN 0.757 0.0 OUTLIER -76.06 -65.18 0.95 Allowed 'General case' 3 N--CA 1.685 11.276 3 CA-C-N 96.266 -9.515 . . . . 14.55 98.846 -179.201 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . 1.535 ' C ' ' CA ' ' B' ' 26' ' ' ALA 0.372 . . -59.51 -42.97 93.45 Favored 'General case' 4 C--N 0.994 -14.879 3 CA-C-O 101.657 -8.782 . . . . 13.58 100.705 -164.472 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 27' ' ' LEU . . . . . 0.753 ' N ' ' CA ' ' B' ' 26' ' ' ALA 0.521 0.0 OUTLIER -73.72 -47.11 41.76 Favored 'General case' 4 C--O 1.489 13.691 1 O-C-N 148.076 15.86 . . . . 13.27 106.759 171.08 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLY . . . . . 0.559 ' HA3' ' O ' ' B' ' 24' ' ' ALA . . . -40.07 -85.31 0.01 OUTLIER Glycine 2 C--N 1.146 -10.022 2 CA-C-O 93.293 -15.17 . . . . 13.98 111.256 175.242 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ARG . . . . . 0.541 ' NH1' ' HD3' ' A' ' 119' ' ' PRO 0.407 1.3 mpp_? -53.04 -32.03 44.55 Favored 'General case' 3 C--O 0.936 -15.42 3 O-C-N 148.522 14.895 . . . . 16.89 126.209 163.983 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 30' ' ' LEU . . . . . 1.021 HD23 ' HA ' ' B' ' 105' ' ' LEU 0.394 0.7 OUTLIER -41.04 -47.15 3.05 Favored 'General case' 4 N--CA 1.347 -5.609 4 CA-C-O 145.607 12.146 . . . . 16.45 109.973 171.438 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . 1.583 ' CG ' ' CD1' ' B' ' 31' ' ' LEU 0.923 0.2 OUTLIER -44.0 -75.76 0.03 OUTLIER 'General case' 2 C--N 1.585 10.835 2 CA-C-N 98.075 -8.693 . . . . 17.22 108.934 167.711 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 32' ' ' VAL . . . . . 1.355 ' N ' ' CA ' ' B' ' 32' ' ' VAL 0.678 2.3 p -103.94 95.74 4.07 Favored 'Isoleucine or valine' 4 N--CA 1.895 21.777 4 C-N-CA 86.541 -14.063 . . . . 15.6 96.213 -173.005 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 33' ' ' VAL . . . . . 0.9 HG12 ' CE1' ' B' ' 34' ' ' TYR 0.657 25.0 t 165.29 -56.04 0.0 OUTLIER 'Isoleucine or valine' 4 C--O 1.014 -11.298 5 O-C-N 84.984 -23.573 . . . . 14.66 90.529 -167.403 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 34' ' ' TYR . . . . . 1.696 ' CE2' ' CZ ' ' B' ' 34' ' ' TYR 1.026 0.1 OUTLIER -105.68 55.79 0.14 Allowed Pre-proline 3 N--CA 1.772 15.657 5 CA-C-N 143.988 12.176 . . . . 15.77 96.719 -175.61 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 35' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' B' ' 34' ' ' TYR 0.356 52.5 Cg_exo -42.94 -21.0 0.18 Allowed 'Trans proline' 3 C--N 1.118 -11.587 4 C-N-CA 146.968 18.445 . . . . 14.45 120.762 -172.282 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 36' ' ' TRP . . . . . 1.609 ' CD2' ' CG ' ' B' ' 36' ' ' TRP . 31.0 p90 -78.46 -36.55 45.18 Favored 'General case' 2 C--O 0.978 -13.214 2 O-C-N 102.56 -12.588 . . . . 14.07 112.722 -178.85 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 37' ' ' THR . . . . . 1.549 ' N ' ' CA ' ' B' ' 37' ' ' THR 0.279 0.8 OUTLIER -55.7 -21.85 20.49 Favored 'General case' 3 N--CA 1.687 11.388 3 CA-C-O 152.693 15.521 . . . . 14.24 112.901 175.833 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLN . . . . . 1.288 ' C ' ' CA ' ' B' ' 38' ' ' GLN 0.362 0.0 OUTLIER -74.36 13.66 0.55 Allowed 'General case' 3 C--O 0.823 -21.382 3 O-C-N 88.291 -21.506 . . . . 16.95 96.559 -162.405 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ARG . . . . . 1.351 ' CB ' ' CG ' ' B' ' 39' ' ' ARG 0.283 0.0 OUTLIER -105.48 -41.07 5.59 Favored 'General case' 4 C--O 0.958 -14.282 2 CA-C-O 141.748 10.308 . . . . 13.66 119.611 -169.695 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 40' ' ' PHE . . . . . 1.502 ' C ' ' CA ' ' B' ' 40' ' ' PHE 0.53 71.3 m-85 -77.88 -20.95 52.05 Favored 'General case' 3 C--O 1.524 15.547 2 CA-C-N 95.096 -10.047 . . . . 12.37 94.424 178.125 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 41' ' ' PHE . . . . . 1.619 ' CZ ' ' CE1' ' B' ' 41' ' ' PHE . 0.0 OUTLIER -137.18 89.54 2.44 Favored 'General case' 4 C--O 0.743 -25.555 2 C-N-CA 101.914 -7.914 . . . . 11.94 124.973 178.59 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLN . . . . . 1.451 ' CD ' ' NE2' ' B' ' 42' ' ' GLN 0.515 0.0 OUTLIER -95.13 -1.96 50.9 Favored 'General case' 3 C--N 1.854 22.542 3 CA-C-N 89.993 -12.367 . . . . 12.31 104.295 175.407 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 43' ' ' HIS . . . . . 1.519 ' C ' ' CA ' ' B' ' 43' ' ' HIS 0.466 61.4 t60 96.42 -50.02 0.01 OUTLIER 'General case' 4 C--N 1.934 26.001 4 O-C-N 90.405 -20.184 . . . . 14.92 84.122 16.649 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PHE . . . . . 1.227 ' CE1' ' CD2' ' B' ' 41' ' ' PHE 0.286 10.5 m-85 -139.47 -84.5 0.25 Allowed 'General case' 2 C--N 1.479 6.226 2 O-C-N 135.762 8.164 . . . . 12.88 103.861 175.66 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLY . . . . . 1.554 ' N ' ' CA ' ' B' ' 45' ' ' GLY . . . 177.72 -102.74 0.17 Allowed Glycine 4 C--O 1.692 28.751 2 C-N-CA 98.688 -11.244 . . . . 13.97 87.71 177.4 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASN . . . . . 1.426 ' CA ' ' CB ' ' B' ' 46' ' ' ASN 0.449 1.4 m120 -51.75 65.98 0.0 OUTLIER 'General case' 2 C--N 0.923 -17.95 1 N-CA-C 128.134 6.346 . . . . 14.83 128.134 -178.765 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LEU . . . . . 1.102 HD12 HG23 ' B' ' 53' ' ' VAL 0.87 0.2 OUTLIER -110.78 29.37 7.81 Favored 'General case' 3 C--O 1.392 8.564 1 CA-C-O 129.302 4.382 . . . . 16.85 105.408 173.204 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 48' ' ' SER . . . . . . . . . . . . 0.606 8.5 t -108.27 26.95 9.83 Favored 'General case' 3 C--O 1.378 7.834 2 C-N-CA 104.501 -6.88 . . . . 16.47 95.022 -174.459 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' SER . . . . . 1.507 ' C ' ' CA ' ' B' ' 49' ' ' SER 0.439 19.5 t -146.0 157.06 43.87 Favored 'General case' 2 C--O 1.749 27.38 2 CA-C-O 94.309 -12.281 . . . . 16.63 107.907 176.673 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ALA . . . . . 0.466 ' CB ' HG11 ' B' ' 32' ' ' VAL 0.607 . . -88.03 -45.85 9.84 Favored 'General case' 0 C--N 1.3 -1.55 4 CA-C-N 146.05 13.114 . . . . 16.53 91.639 -169.535 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 51' ' ' GLY . . . . . 0.44 ' C ' ' O ' ' B' ' 50' ' ' ALA . . . -47.9 -66.8 1.82 Allowed Glycine 4 C--O 1.405 10.807 5 CA-C-O 158.901 21.279 . . . . 16.45 93.303 -156.971 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ALA . . . . . 1.476 ' CA ' ' N ' ' B' ' 52' ' ' ALA 0.571 . . -34.4 -79.38 0.01 OUTLIER 'General case' 4 N--CA 1.754 14.727 4 CA-C-N 87.938 -14.131 . . . . 15.98 98.352 -170.666 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 53' ' ' VAL . . . . . 1.211 ' C ' ' CA ' ' B' ' 54' ' ' MET . 10.8 p -48.0 -33.9 4.15 Favored 'Isoleucine or valine' 3 C--O 1.428 10.474 4 CA-C-N 93.66 -10.7 . . . . 16.0 101.725 -160.557 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 54' ' ' MET . . . . . 1.482 ' CA ' ' N ' ' B' ' 54' ' ' MET 0.508 0.0 OUTLIER -70.02 -44.39 69.37 Favored 'General case' 3 N--CA 1.715 12.812 3 C-N-CA 94.192 -11.003 . . . . 13.7 130.909 -168.294 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ASN . . . . . 1.337 ' O ' ' NZ ' ' B' ' 60' ' ' LYS 0.602 0.4 OUTLIER -72.73 -43.79 62.52 Favored 'General case' 4 CA--C 2.073 21.081 2 C-N-CA 162.966 16.506 . . . . 13.79 123.136 -175.603 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASN . . . . . 1.329 ' N ' ' C ' ' B' ' 55' ' ' ASN 0.666 0.1 OUTLIER -29.05 49.1 0.0 OUTLIER Pre-proline 2 C--O 0.781 -23.571 3 CA-C-N 81.534 -16.212 . . . . 14.77 104.99 164.769 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 57' ' ' PRO . . . . . 1.5 ' N ' ' CD ' ' B' ' 57' ' ' PRO . 9.6 Cg_endo 12.05 -46.41 0.0 OUTLIER 'Trans proline' 4 C--N 1.625 15.123 4 C-N-CA 142.799 15.666 . . . . 14.77 100.386 173.098 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 58' ' ' LYS . . . . . 1.519 ' CB ' ' CG ' ' B' ' 58' ' ' LYS 0.47 0.0 OUTLIER -70.29 -51.22 31.97 Favored 'General case' 3 N--CA 1.151 -15.42 2 O-C-N 141.028 11.455 . . . . 13.49 121.416 -174.978 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 59' ' ' VAL . . . . . 1.522 ' CB ' ' CG1' ' B' ' 59' ' ' VAL 0.735 0.5 OUTLIER -71.52 -38.66 68.75 Favored 'Isoleucine or valine' 3 C--O 1.703 24.933 5 CA-C-O 88.752 -14.928 . . . . 15.92 92.659 -177.899 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LYS . . . . . 1.391 ' NZ ' ' CE ' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -34.53 -78.91 0.02 OUTLIER 'General case' 1 CA--C 1.693 6.444 3 O-C-N 141.836 11.96 . . . . 18.25 120.839 166.074 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ALA . . . . . 0.45 ' C ' ' CA ' ' B' ' 62' ' ' HIS 0.25 . . -32.51 -42.37 0.07 Allowed 'General case' 3 CA--C 1.256 -10.349 2 C-N-CA 139.62 7.168 . . . . 18.18 113.779 171.843 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 62' ' ' HIS . . . . . 1.484 ' N ' ' CA ' ' B' ' 62' ' ' HIS . 63.5 t-80 -54.81 -67.1 0.3 Allowed 'General case' 3 N--CA 1.738 13.97 2 CA-C-N 106.081 -5.054 . . . . 18.05 99.918 -179.687 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . 1.045 ' HA2' HG13 ' B' ' 66' ' ' VAL . . . -68.15 -19.38 72.04 Favored Glycine 2 C--O 0.903 -20.54 5 C-N-CA 140.674 8.749 . . . . 16.74 125.425 -162.691 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LYS . . . . . 1.618 ' CG ' ' CD ' ' B' ' 64' ' ' LYS 0.512 0.0 OUTLIER -76.6 -78.56 0.12 Allowed 'General case' 3 CA--C 1.242 -10.898 4 C-N-CA 164.859 17.264 . . . . 16.8 86.834 -151.68 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ARG . . . . . 1.519 ' CA ' ' N ' ' B' ' 65' ' ' ARG 0.434 0.0 OUTLIER -73.92 -38.27 64.36 Favored 'General case' 3 C--O 1.532 15.955 3 CA-C-O 87.929 -15.32 . . . . 13.34 102.097 163.71 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . 1.531 ' CB ' ' CG1' ' B' ' 66' ' ' VAL 0.642 0.1 OUTLIER -64.01 30.07 0.0 OUTLIER 'Isoleucine or valine' 2 C--O 1.465 12.423 3 CA-C-N 157.52 18.327 . . . . 11.9 105.151 178.584 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . 0.931 HD21 HG12 ' B' ' 22' ' ' VAL 0.556 5.4 tp -174.7 -142.08 0.02 OUTLIER 'General case' 2 C--N 1.033 -13.183 4 CA-C-O 68.17 -24.729 . . . . 11.13 110.665 -154.764 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ASP . . . . . 1.578 ' CA ' ' CG2' ' B' ' 71' ' ' THR 0.764 0.5 OUTLIER -37.64 71.95 0.0 OUTLIER 'General case' 2 C--N 1.187 -6.493 3 CA-C-O 92.883 -12.961 . . . . 11.42 115.785 -153.353 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ALA . . . . . 1.423 ' CB ' ' N ' ' B' ' 69' ' ' ALA 0.65 . . 109.32 -38.44 0.01 OUTLIER 'General case' 3 N--CA 1.177 -14.076 4 C-N-CA 169.282 19.033 . . . . 12.4 128.263 -74.364 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 70' ' ' PHE . . . . . 1.642 ' CZ ' ' CE2' ' B' ' 70' ' ' PHE 0.543 0.0 OUTLIER -85.92 -69.29 0.67 Allowed 'General case' 2 N--CA 1.67 10.549 3 CA-C-O 170.3 23.905 . . . . 13.29 110.634 160.068 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 71' ' ' THR . . . . . 1.578 ' CG2' ' CA ' ' B' ' 68' ' ' ASP 0.764 0.4 OUTLIER -78.14 66.44 3.75 Favored 'General case' 3 N--CA 0.847 -30.579 3 O-C-N 77.592 -28.193 . . . . 13.14 107.48 175.94 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLN . . . . . 1.484 ' CA ' ' N ' ' B' ' 72' ' ' GLN 0.557 0.0 OUTLIER 170.82 21.01 0.0 OUTLIER 'General case' 2 N--CA 1.698 11.971 2 C-N-CA 166.943 18.097 . . . . 14.78 100.212 -177.51 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' B' ' 74' ' ' LEU . . . -78.97 -78.26 0.85 Allowed Glycine 4 C--N 0.997 -18.268 4 CA-C-O 100.3 -11.278 . . . . 14.25 107.351 -173.398 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LEU . . . . . 1.505 ' CB ' ' CG ' ' B' ' 74' ' ' LEU 0.483 0.0 OUTLIER -55.09 -155.24 0.0 OUTLIER 'General case' 2 C--O 1.399 8.951 4 O-C-N 160.46 21.918 . . . . 15.22 129.632 163.716 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LYS . . . . . 1.491 ' CG ' ' CD ' ' B' ' 75' ' ' LYS 0.935 0.0 OUTLIER 79.43 -125.34 0.02 OUTLIER 'General case' 3 N--CA 2.07 30.53 3 CA-C-N 152.917 16.235 . . . . 15.38 75.565 -166.708 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 76' ' ' HIS . . . . . 1.471 ' CA ' ' N ' ' B' ' 76' ' ' HIS 1.213 19.7 m80 -39.49 -110.17 0.0 OUTLIER 'General case' 3 N--CA 1.735 13.821 4 O-C-N 140.646 11.216 . . . . 16.87 110.812 172.892 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LEU . . . . . 1.594 ' CA ' ' CB ' ' B' ' 77' ' ' LEU 1.051 0.3 OUTLIER 47.06 23.17 0.26 Allowed 'General case' 3 CA--C 1.289 -9.062 5 CA-C-N 167.8 23.0 . . . . 17.2 130.9 -152.436 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASP . . . . . 1.334 ' OD2' ' CG ' ' B' ' 78' ' ' ASP 1.014 32.2 t70 75.69 167.44 0.27 Allowed 'General case' 4 C--O 0.994 -12.388 4 O-C-N 79.985 -26.697 . . . . 17.59 106.446 2.998 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASP . . . . . 1.244 ' O ' ' C ' ' B' ' 79' ' ' ASP 0.909 7.9 t70 -53.27 102.57 0.06 Allowed 'General case' 3 C--O 1.755 27.685 5 CA-C-O 159.312 18.672 . . . . 17.29 83.323 -173.583 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . 1.518 ' CD2' ' CG ' ' B' ' 80' ' ' LEU 0.769 0.5 OUTLIER -127.58 -146.59 0.33 Allowed 'General case' 3 C--O 1.548 16.805 2 O-C-N 83.151 -24.718 . . . . 15.56 101.202 -0.184 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 81' ' ' LYS . . . . . 1.413 ' N ' ' C ' ' B' ' 80' ' ' LEU 1.137 0.8 OUTLIER 23.04 89.39 0.01 OUTLIER 'General case' 3 C--N 1.71 16.281 4 O-C-N 95.058 -17.276 . . . . 13.54 88.261 16.177 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 82' ' ' GLY . . . . . 0.955 ' HA2' HD22 ' B' ' 80' ' ' LEU . . . 173.99 -72.61 0.09 OUTLIER Glycine 4 C--O 1.552 19.999 4 CA-C-N 139.617 10.189 . . . . 10.98 94.028 -162.155 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 83' ' ' ALA . . . . . 1.497 ' CB ' ' CA ' ' B' ' 83' ' ' ALA 0.737 . . -74.54 -89.28 0.03 OUTLIER 'General case' 4 C--N 0.937 -17.359 3 C-N-CA 157.612 14.365 . . . . 8.33 91.469 -147.061 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 84' ' ' PHE . . . . . 1.649 ' CB ' ' CG ' ' B' ' 84' ' ' PHE 0.452 0.3 OUTLIER -44.76 -46.31 10.43 Favored 'General case' 0 CA--C 1.426 -3.796 4 C-N-CA 161.014 15.726 . . . . 10.02 100.561 161.332 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . 0.626 ' HB2' ' O ' ' B' ' 82' ' ' GLY 0.369 . . 16.91 -77.86 0.0 OUTLIER 'General case' 3 C--N 1.508 7.5 3 CA-C-N 133.898 7.59 . . . . 11.82 122.426 170.128 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 86' ' ' GLN . . . . . 1.567 ' CB ' ' CG ' ' B' ' 86' ' ' GLN 0.686 58.7 tt0 152.22 -79.24 0.0 OUTLIER 'General case' 2 N--CA 1.32 -6.942 3 C-N-CA 159.153 14.981 . . . . 12.69 109.541 -7.199 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LEU . . . . . 1.53 ' C ' ' CA ' ' B' ' 87' ' ' LEU 0.31 0.0 OUTLIER -79.57 -17.55 53.7 Favored 'General case' 4 CA--C 1.764 9.184 2 CA-C-O 89.302 -14.666 . . . . 14.2 83.304 172.48 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 88' ' ' SER . . . . . 1.035 ' OG ' ' HB3' ' B' ' 143' ' ' LYS 0.477 0.2 OUTLIER -30.21 -55.99 0.19 Allowed 'General case' 4 CA--C 1.258 -10.255 3 CA-C-N 159.898 19.408 . . . . 15.37 104.388 158.583 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 87' ' ' LEU . . . -30.94 -79.97 0.01 OUTLIER Glycine 2 C--N 1.47 8.002 2 C-N-CA 144.729 10.68 . . . . 14.83 98.711 -161.929 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . 0.533 52.9 tp -53.02 -56.81 13.26 Favored 'General case' 3 C--O 1.077 -7.981 3 C-N-CA 146.783 10.033 . . . . 14.1 104.23 -170.859 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' HIS . . . . . 0.784 ' HA ' HD23 ' B' ' 95' ' ' LEU 0.395 12.6 m80 -57.98 -52.81 63.98 Favored 'General case' 2 C--O 1.429 10.548 2 O-C-N 131.78 5.675 . . . . 13.25 109.345 179.739 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 92' ' ' CYS . . . . . 1.22 ' SG ' ' CB ' ' B' ' 92' ' ' CYS 0.421 0.0 OUTLIER -81.2 -31.34 33.98 Favored 'General case' 0 CA--C 1.62 3.647 1 CA-C-O 89.196 -14.716 . . . . 13.69 103.228 176.358 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ASN . . . . . 1.464 ' CB ' ' CG ' ' B' ' 93' ' ' ASN 0.664 3.0 m-80 -35.64 -87.57 0.0 OUTLIER 'General case' 3 C--N 1.636 13.058 3 O-C-N 147.273 15.358 . . . . 16.59 134.888 161.792 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LYS . . . . . 1.563 ' CD ' ' CG ' ' B' ' 94' ' ' LYS 0.532 0.0 OUTLIER -132.34 4.85 4.04 Favored 'General case' 3 C--N 1.142 -8.414 3 C-N-CA 93.558 -11.257 . . . . 16.81 100.232 -172.213 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LEU . . . . . 1.462 ' CA ' ' CB ' ' B' ' 95' ' ' LEU 1.706 0.9 OUTLIER -68.87 -89.98 0.01 OUTLIER 'General case' 3 N--CA 1.807 17.386 2 N-CA-C 92.373 -6.899 . . . . 17.55 92.373 178.899 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 96' ' ' HIS . . . . . 1.443 ' NE2' ' CE1' ' B' ' 96' ' ' HIS 0.263 9.2 m-70 91.92 75.8 0.0 OUTLIER 'General case' 2 CA--C 1.188 -12.949 3 C-N-CA 159.848 15.259 . . . . 16.03 117.558 169.046 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 97' ' ' VAL . . . . . 1.581 ' CB ' ' CA ' ' B' ' 97' ' ' VAL . 0.2 OUTLIER -75.24 156.63 6.08 Favored 'Isoleucine or valine' 1 C--O 1.494 13.943 2 O-C-N 90.054 -20.404 . . . . 16.15 105.097 -176.526 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ASN . . . . . 1.421 ' CG ' ' ND2' ' B' ' 98' ' ' ASN 0.981 0.1 OUTLIER -86.47 152.21 54.49 Favored Pre-proline 2 C--N 1.48 6.244 2 C-N-CA 134.758 5.223 . . . . 17.13 103.843 174.51 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 99' ' ' PRO . . . . . 1.342 ' CG ' ' CD ' ' B' ' 99' ' ' PRO 0.69 0.0 OUTLIER -69.96 -6.44 18.71 Favored 'Trans proline' 3 C--O 1.44 10.606 0 CA-C-O 126.95 2.813 . . . . 16.66 115.269 -176.605 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLN . . . . . 0.995 ' H ' ' HB3' ' B' ' 98' ' ' ASN 0.791 24.9 tp60 -81.49 -60.17 2.36 Favored 'General case' 1 C--N 1.615 12.148 5 CA-C-N 102.065 -6.879 . . . . 16.28 97.301 -168.696 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ASN . . . . . 1.448 ' C ' ' CA ' ' B' ' 101' ' ' ASN . 59.5 m-20 -65.86 -16.39 63.79 Favored 'General case' 2 CA--C 1.847 12.389 3 CA-C-O 98.966 -10.064 . . . . 16.51 107.706 -175.589 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 102' ' ' PHE . . . . . 1.61 ' CG ' ' CD1' ' B' ' 102' ' ' PHE 0.593 1.3 m-85 -53.99 -40.73 67.21 Favored 'General case' 3 CA--C 1.221 -11.677 2 O-C-N 138.096 9.622 . . . . 17.03 119.963 170.369 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . 1.589 ' CB ' ' CG ' ' B' ' 103' ' ' ARG 0.547 4.6 mmt180 -78.99 -38.46 36.73 Favored 'General case' 2 N--CA 1.085 -18.707 3 O-C-N 87.788 -21.82 . . . . 16.95 108.567 -177.303 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LEU . . . . . 1.502 ' CA ' ' N ' ' B' ' 104' ' ' LEU 0.779 0.3 OUTLIER -56.79 -69.68 0.15 Allowed 'General case' 3 N--CA 1.739 13.985 3 CA-C-O 104.248 -7.549 . . . . 17.15 113.669 164.7 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LEU . . . . . 1.396 ' C ' ' CA ' ' B' ' 105' ' ' LEU 0.729 1.0 OUTLIER -29.48 -63.39 0.12 Allowed 'General case' 4 CA--C 1.867 13.136 4 C-N-CA 147.62 10.368 . . . . 16.86 99.552 164.95 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 106' ' ' GLY . . . . . 1.478 ' C ' ' CA ' ' B' ' 106' ' ' GLY . . . -49.07 -28.1 7.53 Favored Glycine 3 N--CA 0.999 -30.457 2 N-CA-C 133.709 8.244 . . . . 16.91 133.709 169.356 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ASN . . . . . 1.383 ' CG ' ' ND2' ' B' ' 107' ' ' ASN 0.274 90.1 m-20 -74.21 -43.81 55.7 Favored 'General case' 1 CA--C 1.381 -5.554 3 C-N-CA 160.639 15.576 . . . . 16.02 110.267 155.851 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 108' ' ' VAL . . . . . 1.302 ' CB ' ' CG2' ' B' ' 108' ' ' VAL 0.602 20.3 t -65.12 -50.87 72.0 Favored 'Isoleucine or valine' 1 CA--C 1.711 7.163 1 CA-C-N 130.182 5.901 . . . . 16.97 118.481 161.662 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 109' ' ' LEU . . . . . 1.386 ' CG ' ' CB ' ' B' ' 109' ' ' LEU 0.252 0.0 OUTLIER -51.52 -48.23 63.04 Favored 'General case' 1 N--CA 1.604 7.271 1 CA-C-O 106.741 -6.362 . . . . 17.21 108.441 165.289 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ALA . . . . . 1.492 ' CA ' ' CB ' ' B' ' 110' ' ' ALA 0.476 . . -62.33 -25.43 67.88 Favored 'General case' 4 N--CA 1.874 20.739 4 O-C-N 136.343 8.527 . . . . 15.24 122.417 179.839 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 111' ' ' LEU . . . . . 1.412 ' N ' ' C ' ' B' ' 110' ' ' ALA 0.345 0.2 OUTLIER -65.28 -34.25 77.91 Favored 'General case' 3 C--N 1.736 17.39 2 O-C-N 113.604 -5.685 . . . . 15.04 113.45 165.514 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 112' ' ' VAL . . . . . 0.9 ' CG1' ' OE1' ' B' ' 25' ' ' GLN 1.383 0.1 OUTLIER -52.45 -76.81 0.02 OUTLIER 'Isoleucine or valine' 2 C--O 1.007 -11.699 2 CA-C-O 147.87 13.224 . . . . 14.89 104.818 -174.846 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 113' ' ' VAL . . . . . 1.449 ' CB ' ' CG1' ' B' ' 113' ' ' VAL 0.418 0.0 OUTLIER -67.76 -30.53 48.82 Favored 'Isoleucine or valine' 2 C--O 1.007 -11.708 2 CA-C-N 89.185 -12.734 . . . . 17.21 107.701 -172.68 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ALA . . . . . 0.635 ' O ' ' HA ' ' A' ' 111' ' ' SER 0.922 . . -56.13 -33.14 64.89 Favored 'General case' 3 N--CA 1.145 -15.718 3 CA-C-N 135.172 8.169 . . . . 17.12 114.874 170.722 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ARG . . . . . 1.324 ' CB ' ' CA ' ' B' ' 115' ' ' ARG 0.798 48.3 ttp85 -125.37 -37.41 2.38 Favored 'General case' 2 C--O 1.015 -11.241 4 CA-C-O 85.647 -16.406 . . . . 18.03 99.474 -164.791 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ASN . . . . . 1.558 ' CB ' ' CA ' ' B' ' 116' ' ' ASN 0.658 0.9 OUTLIER -56.8 -58.94 5.93 Favored 'General case' 4 C--N 1.042 -12.763 2 CA-C-N 155.942 17.61 . . . . 16.83 103.066 162.715 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 117' ' ' PHE . . . . . 1.597 ' CG ' ' CD1' ' B' ' 117' ' ' PHE 0.631 98.4 m-85 -66.08 -45.33 81.66 Favored 'General case' 4 C--N 1.125 -9.163 1 C-N-CA 144.994 9.318 . . . . 16.48 116.212 -176.693 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLY . . . . . 1.36 ' CA ' ' C ' ' B' ' 117' ' ' PHE . . . 42.61 -98.48 0.01 OUTLIER Glycine 2 N--CA 0.729 -48.471 3 CA-C-O 87.345 -18.475 . . . . 15.89 131.137 177.682 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLY . . . . . 1.51 ' CA ' ' N ' ' B' ' 119' ' ' GLY . . . -70.5 4.06 10.11 Favored Glycine 4 N--CA 1.675 14.579 4 CA-C-N 134.969 9.385 . . . . 14.74 134.652 176.57 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 120' ' ' GLN . . . . . 1.116 ' NE2' ' O ' ' B' ' 117' ' ' PHE 0.33 0.2 OUTLIER -96.94 -40.77 8.73 Favored 'General case' 2 C--O 1.366 7.231 3 C-N-CA 145.584 9.554 . . . . 14.58 99.164 -179.782 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 121' ' ' PHE . . . . . 0.697 ' CE2' ' HA ' ' B' ' 126' ' ' GLN 0.709 0.3 OUTLIER -79.98 75.81 6.71 Favored 'General case' 1 CA--C 1.394 -5.02 4 O-C-N 106.576 -10.078 . . . . 16.86 86.471 -171.163 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 122' ' ' THR . . . . . 0.79 ' OG1' ' N ' ' B' ' 125' ' ' VAL 0.63 0.6 OUTLIER 112.39 157.04 0.0 OUTLIER Pre-proline 2 C--O 1.492 13.822 4 C-N-CA 176.402 21.881 . . . . 17.28 96.959 3.804 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 123' ' ' PRO . . . . . 1.534 ' CB ' ' CG ' ' B' ' 123' ' ' PRO 0.419 2.7 Cg_endo -74.81 -29.45 8.57 Favored 'Trans proline' 1 C--O 1.106 -6.1 5 C-N-CA 131.959 8.439 . . . . 15.56 98.391 173.204 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 124' ' ' ASN . . . . . 1.45 ' C ' ' N ' ' B' ' 125' ' ' VAL 0.485 1.0 OUTLIER -75.61 -43.14 49.58 Favored 'General case' 3 N--CA 1.308 -7.542 4 O-C-N 84.137 -24.102 . . . . 15.26 111.659 161.685 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 125' ' ' VAL . . . . . 1.505 ' CB ' ' CG1' ' B' ' 125' ' ' VAL 0.87 4.1 t -66.1 -25.96 37.08 Favored 'Isoleucine or valine' 3 N--CA 1.157 -15.106 4 CA-C-N 146.796 13.453 . . . . 15.7 119.917 159.999 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 126' ' ' GLN . . . . . 1.405 ' C ' ' CA ' ' B' ' 126' ' ' GLN 0.567 0.0 OUTLIER -48.83 -70.72 0.08 Allowed 'General case' 3 C--O 0.949 -14.751 3 C-N-CA 151.27 11.828 . . . . 19.08 83.789 -174.437 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ALA . . . . . 0.643 ' HA ' ' HB3' ' A' ' 35' ' ' SER 0.661 . . -23.39 -68.54 0.03 OUTLIER 'General case' 3 C--N 1.222 -4.963 3 C-N-CA 140.447 7.499 . . . . 14.21 115.471 177.379 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 128' ' ' LEU . . . . . 1.588 ' CD2' HG11 ' B' ' 10' ' ' VAL 0.857 0.0 OUTLIER -76.21 -28.52 57.26 Favored 'General case' 2 N--CA 1.205 -12.678 3 CA-C-O 93.388 -12.72 . . . . 13.51 110.309 175.496 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 129' ' ' PHE . . . . . 0.53 ' CE2' HG12 ' B' ' 10' ' ' VAL 0.987 0.6 OUTLIER -74.59 -43.31 56.18 Favored 'General case' 2 C--N 0.941 -17.187 4 CA-C-O 136.631 7.872 . . . . 13.27 104.669 -174.231 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 130' ' ' GLN . . . . . 1.538 ' CB ' ' CG ' ' B' ' 130' ' ' GLN 0.691 0.1 OUTLIER -43.72 -49.05 8.0 Favored 'General case' 1 C--N 1.471 5.867 1 O-C-N 111.613 -6.929 . . . . 11.07 115.17 162.953 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 131' ' ' LYS . . . . . 1.523 ' CG ' ' CD ' ' B' ' 131' ' ' LYS 0.479 6.3 mtmt -57.34 -58.55 7.75 Favored 'General case' 3 C--N 1.133 -8.829 2 O-C-N 132.048 5.843 . . . . 11.32 117.232 -179.585 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . 0.753 0.9 OUTLIER -38.7 -64.23 0.1 OUTLIER 'Isoleucine or valine' 3 C--O 1.497 14.13 2 CA-C-N 102.988 -6.46 . . . . 10.84 103.051 173.005 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 133' ' ' VAL . . . . . 1.441 ' CB ' ' CG2' ' B' ' 133' ' ' VAL 0.645 2.6 p -74.4 -44.24 48.44 Favored 'Isoleucine or valine' 4 C--O 0.799 -22.643 4 CA-C-O 97.961 -10.543 . . . . 12.19 100.378 -173.126 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 134' ' ' ALA . . . . . 1.264 ' N ' ' O ' ' B' ' 133' ' ' VAL 0.416 . . -36.21 -54.08 0.81 Allowed 'General case' 3 C--N 1.032 -13.22 3 O-C-N 132.7 6.25 . . . . 11.33 103.203 173.05 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -60.99 -59.96 9.22 Favored Glycine 4 C--N 1.541 11.931 2 O-C-N 113.184 -5.947 . . . . 10.91 119.003 179.37 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' B' B ' 136' ' ' VAL . . . . . 1.44 ' CA ' ' C ' ' B' ' 136' ' ' VAL 0.343 2.6 t -76.93 -64.67 0.84 Allowed 'Isoleucine or valine' 2 CA--C 1.814 11.129 2 CA-C-O 92.812 -12.994 . . . . 10.82 94.282 -176.464 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 137' ' ' ALA . . . . . 1.499 ' N ' ' CA ' ' B' ' 137' ' ' ALA . . . -20.85 -41.37 0.0 OUTLIER 'General case' 4 C--O 1.549 16.836 3 CA-C-N 146.112 13.142 . . . . 12.58 118.157 153.347 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ASN . . . . . 1.306 ' CG ' ' OD1' ' B' ' 138' ' ' ASN 0.278 0.4 OUTLIER -81.73 -57.35 3.48 Favored 'General case' 3 C--O 1.583 18.63 1 N-CA-C 127.112 5.967 . . . . 14.85 127.112 162.612 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ALA . . . . . 1.336 ' O ' ' C ' ' B' ' 139' ' ' ALA 0.602 . . -51.23 -25.7 5.99 Favored 'General case' 3 C--O 1.658 22.584 4 O-C-N 108.165 -9.084 . . . . 14.1 126.177 174.95 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 140' ' ' LEU . . . . . 1.556 ' CG ' ' CD1' ' B' ' 140' ' ' LEU . 8.2 mt -70.92 -24.54 62.48 Favored 'General case' 2 N--CA 1.142 -15.836 2 CA-C-O 142.255 10.55 . . . . 14.62 110.08 -161.85 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 141' ' ' ALA . . . . . 1.542 ' CA ' ' N ' ' B' ' 141' ' ' ALA 0.537 . . -109.59 8.13 24.86 Favored 'General case' 3 C--O 1.574 18.163 2 C-N-CA 93.94 -11.104 . . . . 13.92 119.776 -179.671 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 142' ' ' HIS . . . . . 1.474 ' N ' ' C ' ' B' ' 141' ' ' ALA . 46.4 t-80 -75.01 -22.86 58.25 Favored 'General case' 3 N--CA 0.946 -25.656 3 CA-C-O 140.633 9.778 . . . . 10.93 97.927 -174.466 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' B' B ' 143' ' ' LYS . . . . . 1.544 ' CE ' ' CD ' ' B' ' 143' ' ' LYS 1.001 1.4 mmmt -67.08 26.81 0.02 OUTLIER 'General case' 4 C--N 0.989 -15.103 4 O-C-N 93.457 -18.277 . . . . 10.83 86.092 -162.926 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 144' ' ' TYR . . . . . 1.69 ' CD2' ' CG ' ' B' ' 144' ' ' TYR 0.253 2.1 m-85 -139.51 99.67 3.78 Favored 'General case' 4 C--O 1.513 14.971 4 CA-C-O 154.78 16.514 . . . . 11.5 99.891 -170.914 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' B' B ' 145' ' ' HIS . . . . . 1.564 ' ND1' ' CG ' ' B' ' 145' ' ' HIS 1.136 2.3 p-80 . . . . . 4 C--N 1.596 11.326 1 CA-C-N 81.944 -16.026 . . . . 14.34 111.91 174.784 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' C' C ' 1' ' ' VAL . . . . . 1.348 ' C ' ' CA ' ' C' ' 1' ' ' VAL 1.098 0.0 OUTLIER . . . . . 3 C--O 0.909 -16.823 1 N-CA-C 96.986 -5.19 . . . . 14.82 96.986 . . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 2' ' ' LEU . . . . . 0.4 HD12 ' HG3' ' C' ' 7' ' ' LYS 0.285 0.0 OUTLIER -126.4 132.18 51.58 Favored 'General case' 3 C--O 0.977 -13.262 4 O-C-N 94.815 -17.428 . . . . 13.9 116.586 -175.443 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 3' ' ' SER . . . . . 1.555 ' C ' ' CA ' ' C' ' 3' ' ' SER 1.008 0.3 OUTLIER -36.1 169.35 0.0 OUTLIER 'General case' 3 N--CA 1.102 -17.851 4 O-C-N 89.125 -20.985 . . . . 13.19 105.204 172.867 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ALA . . . . . 1.42 ' CB ' ' CA ' ' C' ' 4' ' ' ALA 1.28 . . -121.49 25.83 9.15 Favored 'General case' 2 N--CA 1.589 6.513 4 O-C-N 103.194 -12.191 . . . . 14.25 94.69 -166.339 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ALA . . . . . 0.519 ' H ' ' HB2' ' C' ' 3' ' ' SER 0.845 . . -112.02 -20.79 11.84 Favored 'General case' 3 C--O 0.898 -17.403 3 CA-C-O 91.403 -13.665 . . . . 13.62 83.345 171.143 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 6' ' ' ASN . . . . . 1.381 ' C ' ' N ' ' C' ' 7' ' ' LYS 0.864 0.8 OUTLIER -57.46 -74.68 0.05 Allowed 'General case' 3 CA--C 1.203 -12.376 3 O-C-N 139.906 10.754 . . . . 12.75 114.586 176.005 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LYS . . . . . 1.633 ' CB ' ' CG ' ' C' ' 7' ' ' LYS . 0.3 OUTLIER -35.15 -27.92 0.01 OUTLIER 'General case' 4 C--N 1.749 17.974 1 N-CA-C 126.044 5.572 . . . . 15.01 126.044 168.28 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' C' C ' 8' ' ' SER . . . . . 1.261 ' O ' ' C ' ' C' ' 8' ' ' SER 0.718 28.9 t -53.43 -65.29 0.59 Allowed 'General case' 2 C--O 1.723 25.988 3 O-C-N 139.654 10.596 . . . . 17.7 111.433 -178.687 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 9' ' ' ASN . . . . . 1.257 ' CB ' ' CG ' ' C' ' 9' ' ' ASN 0.798 1.1 m-20 -44.47 -74.43 0.04 OUTLIER 'General case' 1 C--O 1.14 -4.7 3 CA-C-N 94.565 -10.289 . . . . 19.09 123.367 175.067 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 10' ' ' VAL . . . . . 1.475 ' CB ' ' CG2' ' C' ' 10' ' ' VAL 0.424 1.5 t -20.71 -47.25 0.01 OUTLIER 'Isoleucine or valine' 3 N--CA 1.177 -14.121 2 CA-C-O 154.943 16.592 . . . . 17.41 109.908 169.251 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 11' ' ' LYS . . . . . 1.49 ' CA ' ' N ' ' C' ' 11' ' ' LYS 0.569 0.0 OUTLIER -73.11 -64.16 1.03 Allowed 'General case' 3 N--CA 1.733 13.706 4 O-C-N 103.017 -12.302 . . . . 14.64 117.96 176.272 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ALA . . . . . 1.304 ' O ' ' C ' ' C' ' 12' ' ' ALA 0.517 . . -74.56 -8.06 55.1 Favored 'General case' 2 C--O 1.66 22.702 4 CA-C-N 143.242 11.837 . . . . 12.55 96.598 178.8 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ALA . . . . . 0.404 ' HB2' HG11 ' C' ' 121' ' ' VAL 1.116 . . -68.63 -65.9 0.64 Allowed 'General case' 2 N--CA 1.249 -10.522 4 CA-C-N 145.449 12.84 . . . . 12.99 108.496 169.855 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 14' ' ' TRP . . . . . 0.804 ' C ' ' CA ' ' C' ' 15' ' ' GLY 0.741 0.1 OUTLIER -50.34 -40.81 50.16 Favored 'General case' 4 N--CA 1.203 -12.779 3 C-N-CA 139.953 7.301 . . . . 12.72 109.205 178.583 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLY . . . . . 1.546 ' N ' ' CA ' ' C' ' 15' ' ' GLY . . . -77.35 -17.97 78.64 Favored Glycine 2 C--O 0.902 -20.599 3 O-C-N 140.206 10.941 . . . . 15.09 106.931 -178.844 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LYS . . . . . 1.508 ' CG ' ' CD ' ' C' ' 16' ' ' LYS 0.4 0.1 OUTLIER -78.21 -38.47 43.11 Favored 'General case' 2 N--CA 1.834 18.732 0 C-N-CA 112.783 -3.567 . . . . 15.3 107.522 172.761 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' C' C ' 17' ' ' VAL . . . . . 1.585 ' CB ' ' CG1' ' C' ' 17' ' ' VAL 0.609 4.6 t -51.42 -74.76 0.04 OUTLIER 'Isoleucine or valine' 3 N--CA 1.171 -14.383 3 N-CA-C 95.623 -5.695 . . . . 15.32 95.623 -176.519 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GLY . . . . . 1.437 ' CA ' ' N ' ' C' ' 18' ' ' GLY . . . 106.49 -145.87 16.0 Favored Glycine 3 N--CA 1.772 21.088 3 O-C-N 134.016 7.072 . . . . 14.45 108.213 171.944 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 19' ' ' GLY . . . . . 1.49 ' C ' ' CA ' ' C' ' 19' ' ' GLY . . . -78.8 -6.3 88.52 Favored Glycine 3 CA--C 1.786 17.015 3 CA-C-O 140.17 10.872 . . . . 14.42 111.562 172.039 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 20' ' ' ASN . . . . . 1.504 ' CA ' ' N ' ' C' ' 20' ' ' ASN 0.668 0.1 OUTLIER -75.41 -74.59 0.2 Allowed 'General case' 3 CA--C 1.173 -13.556 3 O-C-N 100.005 -13.644 . . . . 15.13 86.732 -178.14 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ALA . . . . . 1.415 ' N ' ' C ' ' C' ' 20' ' ' ASN 0.378 . . -4.26 -43.74 0.0 OUTLIER Pre-proline 3 C--N 1.711 16.308 3 O-C-N 103.096 -12.252 . . . . 14.67 106.796 175.528 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 22' ' ' PRO . . . . . 1.565 ' CD ' ' CG ' ' C' ' 22' ' ' PRO 0.385 0.0 OUTLIER -79.2 -42.19 0.19 Allowed 'Trans proline' 3 N--CA 1.815 20.389 4 O-C-N 103.411 -9.31 . . . . 14.07 111.193 177.844 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 23' ' ' ALA . . . . . 1.618 ' CA ' ' CB ' ' C' ' 23' ' ' ALA 0.767 . . -56.45 -25.12 49.69 Favored 'General case' 1 CA--C 1.671 5.601 3 N-CA-C 131.545 7.609 . . . . 13.97 131.545 167.1 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 24' ' ' TYR . . . . . 1.619 ' CG ' ' CB ' ' C' ' 24' ' ' TYR 0.796 3.4 m-30 -50.57 -76.57 0.02 OUTLIER 'General case' 0 C--N 1.422 3.72 2 O-C-N 146.437 14.835 . . . . 13.21 103.575 163.883 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 25' ' ' GLY . . . . . 1.471 ' N ' ' CA ' ' C' ' 25' ' ' GLY . . . -59.03 -37.89 92.21 Favored Glycine 3 N--CA 1.754 19.888 3 CA-C-O 94.479 -14.512 . . . . 15.15 109.681 173.557 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ALA . . . . . 1.136 ' H ' ' HE2' ' C' ' 56' ' ' LYS 0.584 . . -43.59 -56.89 3.44 Favored 'General case' 2 N--CA 1.253 -10.279 2 CA-C-N 139.835 11.817 . . . . 15.04 111.695 167.936 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 27' ' ' GLN . . . . . 0.769 ' C ' ' CA ' ' C' ' 28' ' ' ALA 0.369 11.9 tt0 -63.59 -22.31 66.83 Favored 'General case' 3 C--O 1.049 -9.479 2 O-C-N 98.191 -15.318 . . . . 15.27 123.522 -178.34 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ALA . . . . . 1.557 ' CA ' ' N ' ' C' ' 28' ' ' ALA 0.324 . . -90.78 -31.02 16.68 Favored 'General case' 4 CA--C 1.186 -13.026 5 O-C-N 140.99 11.431 . . . . 15.0 128.587 173.045 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 29' ' ' LEU . . . . . 1.554 ' CA ' ' CB ' ' C' ' 29' ' ' LEU 0.337 6.7 mp -72.78 -42.79 63.57 Favored 'General case' 1 C--N 1.655 13.883 3 CA-C-N 96.756 -9.293 . . . . 14.51 96.293 179.308 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 30' ' ' GLN . . . . . 1.465 ' CD ' ' CG ' ' C' ' 30' ' ' GLN 0.444 2.4 tt0 -77.79 -31.34 51.79 Favored 'General case' 1 N--CA 1.197 -13.087 1 CA-C-N 132.569 6.986 . . . . 13.54 105.923 -174.814 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 31' ' ' ARG . . . . . 1.308 ' C ' ' CA ' ' C' ' 31' ' ' ARG 0.619 3.0 ttt180 -54.19 -79.54 0.02 OUTLIER 'General case' 2 CA--C 1.994 18.054 2 O-C-N 109.889 -8.007 . . . . 15.71 103.117 170.118 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 32' ' ' MET . . . . . 1.585 ' CB ' ' CA ' ' C' ' 32' ' ' MET 0.343 2.2 ttp -48.91 -16.27 0.12 Allowed 'General case' 3 C--O 1.024 -10.769 4 CA-C-O 94.972 -11.966 . . . . 16.81 123.788 -175.459 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 33' ' ' PHE . . . . . 1.297 ' O ' ' C ' ' C' ' 33' ' ' PHE 0.602 5.5 m-30 -73.06 -40.74 64.82 Favored 'General case' 3 C--O 1.685 23.99 4 CA-C-N 141.986 11.266 . . . . 15.05 99.552 -166.92 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 34' ' ' LEU . . . . . 0.67 ' HB2' ' O ' ' C' ' 31' ' ' ARG 0.25 7.3 mp -58.88 -72.27 0.1 Allowed 'General case' 3 C--N 1.668 14.451 3 O-C-N 107.568 -9.458 . . . . 14.54 114.3 -178.294 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 35' ' ' SER . . . . . 1.345 ' CB ' ' OG ' ' C' ' 35' ' ' SER 0.49 0.0 OUTLIER -61.83 -20.79 64.04 Favored 'General case' 1 N--CA 1.277 -9.118 4 CA-C-O 82.969 -17.682 . . . . 16.23 103.71 157.795 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 36' ' ' PHE . . . . . 1.554 ' CA ' ' CB ' ' C' ' 36' ' ' PHE 0.319 0.0 OUTLIER -171.59 62.28 0.34 Allowed Pre-proline 3 CA--C 1.281 -9.39 4 CA-C-N 158.424 18.738 . . . . 15.24 128.297 173.351 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 37' ' ' PRO . . . . . 1.376 ' CD ' ' CG ' ' C' ' 37' ' ' PRO 0.657 19.4 Cg_exo -27.34 -39.17 0.04 OUTLIER 'Trans proline' 3 C--N 1.765 22.473 3 N-CA-C 147.115 13.467 . . . . 14.79 147.115 -172.071 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 38' ' ' THR . . . . . 1.297 ' CB ' ' CG2' ' C' ' 38' ' ' THR 0.371 2.3 t -75.84 -16.16 60.11 Favored 'General case' 3 C--O 1.921 36.42 4 C-N-CA 173.507 20.723 . . . . 15.26 95.656 -174.432 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 39' ' ' THR . . . . . 1.536 ' CA ' ' CB ' ' C' ' 39' ' ' THR 0.299 0.7 OUTLIER -93.58 -10.33 35.07 Favored 'General case' 2 N--CA 1.163 -14.8 3 C-N-CA 138.77 6.828 . . . . 14.4 117.364 165.516 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LYS . . . . . 0.625 ' HD3' HD11 ' C' ' 48' ' ' LEU 0.494 17.0 mtmt -64.81 -8.09 13.73 Favored 'General case' 3 C--N 1.511 7.618 3 O-C-N 140.996 11.435 . . . . 14.31 120.296 178.197 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 41' ' ' THR . . . . . 1.358 ' CB ' ' CG2' ' C' ' 41' ' ' THR 0.542 15.8 m -80.88 -36.43 31.31 Favored 'General case' 3 CA--C 1.072 -17.433 2 C-N-CA 136.86 6.064 . . . . 12.79 105.203 -167.316 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 42' ' ' TYR . . . . . 0.746 ' CD1' HBC1 ' C' ' 142' ' ' HEM 0.562 10.5 m-85 -77.4 -12.37 59.95 Favored 'General case' 1 C--O 1.389 8.405 5 N-CA-C 87.229 -8.804 . . . . 15.89 87.229 179.621 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 43' ' ' PHE . . . . . 1.536 ' CA ' ' CB ' ' C' ' 43' ' ' PHE 0.307 8.2 m-85 -132.08 67.22 78.96 Favored Pre-proline 2 N--CA 1.209 -12.525 4 O-C-N 96.87 -16.144 . . . . 15.41 132.557 168.476 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 44' ' ' PRO . . . . . 1.491 ' CG ' ' CB ' ' C' ' 44' ' ' PRO 0.332 42.2 Cg_endo -75.08 -73.86 0.01 OUTLIER 'Trans proline' 3 N--CA 1.858 22.925 4 O-C-N 143.614 11.849 . . . . 14.47 103.952 170.947 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 45' ' ' HIS . . . . . 1.533 ' CA ' ' CB ' ' C' ' 45' ' ' HIS 0.504 0.1 OUTLIER -13.52 -50.16 0.0 OUTLIER 'General case' 4 N--CA 1.811 17.613 4 N-CA-C 143.923 12.194 . . . . 13.52 143.923 -175.376 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 46' ' ' PHE . . . . . 1.469 ' CZ ' ' CE2' ' C' ' 46' ' ' PHE 0.724 2.2 m-85 -97.48 148.21 23.45 Favored 'General case' 3 C--O 1.029 -10.549 5 CA-C-O 161.071 19.51 . . . . 13.94 122.505 177.386 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 47' ' ' ASP . . . . . 1.496 ' CB ' ' CG ' ' C' ' 47' ' ' ASP 0.362 0.0 OUTLIER -96.47 117.31 30.64 Favored 'General case' 3 C--O 1.498 14.144 4 CA-C-N 87.949 -13.296 . . . . 12.96 85.415 179.728 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 48' ' ' LEU . . . . . 0.969 ' HA ' ' NE2' ' C' ' 55' ' ' GLN 0.301 0.0 OUTLIER 147.14 124.17 0.0 OUTLIER 'General case' 3 C--N 1.133 -8.833 4 C-N-CA 174.715 21.206 . . . . 11.95 89.151 -110.654 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 49' ' ' SER . . . . . 1.399 ' CB ' ' OG ' ' C' ' 49' ' ' SER 0.385 4.5 t -127.9 -175.52 3.51 Favored 'General case' 3 C--N 1.538 8.804 3 CA-C-O 149.649 14.071 . . . . 10.28 76.738 9.473 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 3.6 m80 -122.7 -95.74 0.47 Allowed 'General case' 3 N--CA 1.669 10.524 4 O-C-N 75.533 -29.479 . . . . 10.49 118.792 12.773 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . -74.06 118.1 5.87 Favored Glycine 3 C--O 0.887 -21.549 5 O-C-N 138.991 10.182 . . . . 11.8 91.169 179.285 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' C' C ' 52' ' ' SER . . . . . 0.877 ' C ' ' CA ' ' C' ' 53' ' ' ALA 0.483 0.0 OUTLIER -120.95 128.4 52.71 Favored 'General case' 1 N--CA 1.578 5.941 3 CA-C-O 97.363 -10.827 . . . . 13.68 119.606 179.956 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ALA . . . . . 1.547 ' N ' ' CA ' ' C' ' 53' ' ' ALA 0.488 . . -62.94 -10.69 14.49 Favored 'General case' 2 N--CA 1.701 12.101 5 N-CA-C 132.63 8.011 . . . . 15.05 132.63 171.974 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 54' ' ' GLN . . . . . 1.604 ' CB ' ' CG ' ' C' ' 54' ' ' GLN 0.255 24.3 mt-30 -76.59 -41.92 44.42 Favored 'General case' 3 C--O 1.453 11.77 2 CA-C-O 97.037 -10.982 . . . . 15.17 111.071 171.565 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 55' ' ' GLN . . . . . 1.544 ' CB ' ' CA ' ' C' ' 55' ' ' GLN 0.678 2.4 mt-30 -72.9 -47.03 49.29 Favored 'General case' 3 C--O 1.57 17.932 3 CA-C-O 92.383 -13.198 . . . . 14.98 105.027 175.143 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 56' ' ' LYS . . . . . 1.277 ' CE ' ' NZ ' ' C' ' 56' ' ' LYS 1.087 0.0 OUTLIER -65.88 -78.85 0.05 OUTLIER 'General case' 1 C--O 1.394 8.692 4 CA-C-N 152.492 16.042 . . . . 15.73 82.717 171.141 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 57' ' ' ALA . . . . . 0.96 ' HB3' ' O ' ' C' ' 53' ' ' ALA 0.704 . . -21.77 -57.96 0.03 OUTLIER 'General case' 4 C--O 1.578 18.375 3 O-C-N 97.847 -15.533 . . . . 15.46 114.819 -171.569 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 58' ' ' HIS . . . . . 0.569 ' NE2' ' CE2' ' C' ' 43' ' ' PHE 0.693 9.6 t60 -71.65 -38.99 70.64 Favored 'General case' 4 C--O 0.94 -15.213 3 O-C-N 102.501 -12.624 . . . . 15.22 116.991 170.848 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 59' ' ' GLY . . . . . 1.37 ' C ' ' CA ' ' C' ' 59' ' ' GLY . . . -59.68 -33.2 76.47 Favored Glycine 4 CA--C 1.919 25.333 4 CA-C-O 101.191 -10.783 . . . . 14.09 93.701 177.46 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 60' ' ' GLN . . . . . 1.592 ' CB ' ' CG ' ' C' ' 60' ' ' GLN . 0.0 OUTLIER -44.63 -58.28 3.13 Favored 'General case' 3 C--N 0.981 -15.434 1 CA-C-N 129.259 6.529 . . . . 14.83 118.906 179.257 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' C' C ' 61' ' ' LYS . . . . . 1.591 ' CG ' ' CD ' ' C' ' 61' ' ' LYS 0.962 0.2 OUTLIER -63.09 -85.21 0.01 OUTLIER 'General case' 3 C--O 1.452 11.734 3 C-N-CA 159.733 15.213 . . . . 14.28 90.345 175.17 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . 0.467 29.5 t -43.9 -66.8 0.12 Allowed 'Isoleucine or valine' 4 C--N 1.103 -10.117 3 CA-C-N 143.176 11.807 . . . . 14.25 100.434 178.758 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . 0.616 . . -9.88 -102.62 0.0 OUTLIER 'General case' 2 N--CA 1.282 -8.85 4 C-N-CA 160.234 15.414 . . . . 13.85 111.142 136.875 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' C' C ' 64' ' ' ASN . . . . . 1.536 ' CB ' ' CA ' ' C' ' 64' ' ' ASN 0.412 74.0 m-20 -7.78 -58.25 0.0 OUTLIER 'General case' 4 N--CA 1.344 -5.746 3 CA-C-N 141.151 10.887 . . . . 14.41 129.92 163.655 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 65' ' ' ALA . . . . . 0.521 ' O ' ' HB2' ' C' ' 68' ' ' LYS 0.314 . . -54.87 -50.17 69.34 Favored 'General case' 3 C--O 1.439 11.038 4 CA-C-O 100.945 -9.121 . . . . 13.82 91.085 176.742 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 66' ' ' LEU . . . . . 1.571 ' CD2' ' CG ' ' C' ' 66' ' ' LEU 0.586 0.0 OUTLIER -79.26 -35.48 41.35 Favored 'General case' 1 CA--C 1.371 -5.927 1 CA-C-N 136.147 8.612 . . . . 16.31 118.06 -167.154 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 67' ' ' THR . . . . . 1.492 ' CB ' ' CG2' ' C' ' 67' ' ' THR 0.395 99.5 m -59.38 -57.63 12.15 Favored 'General case' 4 C--O 1.011 -11.496 2 CA-C-O 99.911 -9.614 . . . . 16.95 98.025 175.342 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 68' ' ' LYS . . . . . 1.596 ' CB ' ' CG ' ' C' ' 68' ' ' LYS 0.54 0.0 OUTLIER -32.01 -78.27 0.02 OUTLIER 'General case' 3 C--O 1.087 -7.45 2 C-N-CA 138.785 6.834 . . . . 18.31 103.911 167.266 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 69' ' ' ALA . . . . . 1.442 ' C ' ' CA ' ' C' ' 69' ' ' ALA 0.746 . . -49.52 -25.85 3.0 Favored 'General case' 2 N--CA 1.144 -15.759 4 C-N-CA 162.391 16.276 . . . . 16.09 102.636 -161.916 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 70' ' ' GLN . . . . . 1.395 ' CA ' ' CB ' ' C' ' 70' ' ' GLN 1.917 0.0 OUTLIER -146.31 17.21 1.35 Allowed 'General case' 3 C--N 1.121 -9.351 2 N-CA-C 140.746 11.017 . . . . 14.15 140.746 173.627 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 71' ' ' GLY . . . . . 1.523 ' C ' ' CA ' ' C' ' 71' ' ' GLY . . . 73.1 -71.36 1.19 Allowed Glycine 4 CA--C 1.761 15.45 3 C-N-CA 142.492 9.615 . . . . 13.2 92.046 23.819 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 72' ' ' HIS . . . . . 1.213 ' ND1' ' CG ' ' C' ' 72' ' ' HIS 0.833 0.0 OUTLIER -164.57 72.27 0.22 Allowed 'General case' 3 CA--C 1.736 8.113 3 CA-C-O 154.977 16.608 . . . . 14.04 123.834 -172.887 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 73' ' ' LEU . . . . . 1.085 ' HB2' ' HG2' ' C' ' 7' ' ' LYS 0.305 0.7 OUTLIER -74.26 68.87 1.52 Allowed 'General case' 2 CA--C 1.677 5.84 2 CA-C-N 86.255 -14.066 . . . . 13.38 96.153 179.729 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 74' ' ' ASN . . . . . 1.372 ' N ' ' CA ' ' C' ' 74' ' ' ASN 0.71 0.0 OUTLIER -161.18 -12.69 0.04 OUTLIER 'General case' 3 N--CA 1.858 19.948 3 O-C-N 110.804 -7.435 . . . . 15.77 98.467 171.702 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 75' ' ' ASP . . . . . 1.585 ' CA ' ' CB ' ' C' ' 75' ' ' ASP 0.725 48.9 t0 170.01 71.95 0.0 OUTLIER 'General case' 3 N--CA 0.934 -26.269 4 O-C-N 105.672 -10.643 . . . . 15.04 128.97 -157.583 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 76' ' ' LEU . . . . . 1.584 ' CG ' ' CD1' ' C' ' 76' ' ' LEU 0.461 0.0 OUTLIER -73.05 -30.84 1.33 Allowed Pre-proline 4 C--O 1.496 14.078 4 CA-C-O 101.904 -8.665 . . . . 16.3 124.378 163.021 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 77' ' ' PRO . . . . . 1.268 ' CG ' ' CB ' ' C' ' 77' ' ' PRO 0.268 15.3 Cg_exo -53.09 -32.71 60.16 Favored 'Trans proline' 3 CA--C 1.168 -17.809 4 C-N-CA 105.247 -9.369 . . . . 16.54 128.914 168.15 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 78' ' ' GLY . . . . . 0.91 ' C ' ' CA ' ' C' ' 79' ' ' THR . . . -84.65 -49.0 4.76 Favored Glycine 2 N--CA 1.659 13.502 4 CA-C-O 93.294 -15.17 . . . . 16.63 90.154 -168.651 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 79' ' ' THR . . . . . 1.507 ' CA ' ' N ' ' C' ' 79' ' ' THR 0.529 0.2 OUTLIER -56.11 -40.47 73.75 Favored 'General case' 2 N--CA 1.692 11.672 2 O-C-N 142.236 11.198 . . . . 16.97 115.18 -177.49 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 80' ' ' LEU . . . . . 1.561 ' CG ' ' CD1' ' C' ' 80' ' ' LEU 0.744 4.6 tp -91.51 30.53 1.3 Allowed 'General case' 4 C--O 1.728 26.271 2 N-CA-C 135.499 9.074 . . . . 15.32 135.499 167.39 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 81' ' ' SER . . . . . 1.513 ' CA ' ' CB ' ' C' ' 81' ' ' SER 0.515 0.8 OUTLIER -81.8 -42.79 19.2 Favored 'General case' 3 N--CA 1.286 -8.665 4 CA-C-O 160.542 19.258 . . . . 13.77 101.98 -156.359 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 82' ' ' ASN . . . . . . . . . . . . 0.637 0.9 OUTLIER -51.59 -47.66 63.47 Favored 'General case' 4 C--N 1.637 13.086 3 O-C-N 95.253 -17.154 . . . . 14.45 112.259 175.394 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 83' ' ' LEU . . . . . 1.575 ' CD2' ' CG ' ' C' ' 83' ' ' LEU 0.775 8.0 tp -53.08 -93.16 0.0 OUTLIER 'General case' 2 C--N 1.572 10.282 3 O-C-N 152.374 18.547 . . . . 14.35 132.693 -174.937 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 84' ' ' SER . . . . . 1.43 ' C ' ' CA ' ' C' ' 84' ' ' SER 0.968 12.0 m 12.64 -16.86 0.0 OUTLIER 'General case' 4 C--N 0.94 -17.232 2 C-N-CA 170.694 19.598 . . . . 15.65 101.459 95.457 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 85' ' ' ASN . . . . . 1.462 ' CB ' ' CG ' ' C' ' 85' ' ' ASN 0.491 9.4 t-20 -93.96 139.38 31.0 Favored 'General case' 2 N--CA 1.173 -14.302 4 CA-C-O 70.779 -23.486 . . . . 16.13 99.667 125.654 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 86' ' ' LEU . . . . . 1.643 ' CG ' ' CD1' ' C' ' 86' ' ' LEU 0.807 0.4 OUTLIER -19.75 -27.22 0.0 OUTLIER 'General case' 2 C--N 1.222 -4.948 4 O-C-N 83.411 -24.555 . . . . 15.46 121.371 -26.507 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 87' ' ' HIS . . . . . 1.161 ' HA ' HD12 ' C' ' 91' ' ' LEU . 47.0 m80 -85.44 -49.75 7.85 Favored 'General case' 4 CA--C 1.178 -13.363 3 CA-C-O 81.762 -18.256 . . . . 16.18 89.919 176.376 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 88' ' ' ALA . . . . . 0.818 ' CB ' ' HB2' ' C' ' 139' ' ' LYS 0.368 . . -86.81 -89.35 0.12 Allowed 'General case' 3 C--O 1.605 19.765 3 CA-C-N 151.121 15.419 . . . . 16.41 101.491 -163.388 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 89' ' ' HIS . . . . . 1.192 ' HB2' ' NZ ' ' C' ' 139' ' ' LYS . 0.0 OUTLIER -75.77 -16.34 60.13 Favored 'General case' 2 C--N 1.097 -10.373 3 CA-C-O 148.421 13.486 . . . . 16.34 123.887 -173.139 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' C' C ' 90' ' ' LYS . . . . . 1.518 ' NZ ' ' CE ' ' C' ' 90' ' ' LYS 0.361 0.5 OUTLIER -105.74 -46.65 4.09 Favored 'General case' 3 N--CA 1.899 21.977 4 O-C-N 98.589 -15.069 . . . . 18.04 99.793 -176.961 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 91' ' ' LEU . . . . . 1.646 ' CB ' ' CG ' ' C' ' 91' ' ' LEU 0.394 47.9 mt -72.47 -49.48 32.93 Favored 'General case' 3 N--CA 1.687 11.405 2 O-C-N 136.772 8.795 . . . . 17.6 107.11 -176.352 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 92' ' ' ARG . . . . . 1.612 ' CD ' ' CG ' ' C' ' 92' ' ' ARG 0.632 0.0 OUTLIER 74.09 44.62 0.25 Allowed 'General case' 4 C--O 1.544 16.602 1 CA-C-O 147.566 13.079 . . . . 17.04 120.291 -167.418 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 93' ' ' VAL . . . . . 1.378 ' CA ' ' CB ' ' C' ' 93' ' ' VAL 0.568 2.9 t -61.77 99.8 0.14 Allowed 'Isoleucine or valine' 3 C--O 1.613 20.205 2 CA-C-N 94.615 -10.266 . . . . 17.8 107.622 166.039 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 94' ' ' ASN . . . . . 1.293 ' CG ' ' OD1' ' C' ' 94' ' ' ASN . 0.2 OUTLIER -49.14 141.21 11.37 Favored Pre-proline 4 C--N 1.045 -12.667 3 O-C-N 106.985 -9.822 . . . . 16.87 96.398 -173.612 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' C' C ' 95' ' ' PRO . . . . . 0.979 ' HG3' ' CZ ' ' C' ' 141' ' ' ARG 0.461 1.5 Cg_endo -71.54 -17.57 29.97 Favored 'Trans proline' 4 C--O 1.545 15.853 4 O-C-N 103.004 -9.524 . . . . 15.43 117.439 175.047 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 96' ' ' VAL . . . . . 1.432 ' CG2' ' CB ' ' C' ' 96' ' ' VAL 0.62 4.5 t -32.84 -43.44 0.07 OUTLIER 'Isoleucine or valine' 2 CA--C 1.133 -15.059 3 O-C-N 93.48 -18.263 . . . . 14.97 117.841 172.056 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 97' ' ' ASN . . . . . 1.469 ' C ' ' CA ' ' C' ' 97' ' ' ASN 0.484 5.4 m120 -62.75 -29.89 71.03 Favored 'General case' 3 CA--C 1.765 9.227 3 CA-C-O 134.301 6.762 . . . . 15.51 123.136 -173.879 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 98' ' ' PHE . . . . . 1.383 ' CG ' ' CD1' ' C' ' 98' ' ' PHE 0.645 13.2 m-85 -43.14 -55.54 3.86 Favored 'General case' 4 C--O 0.781 -23.586 5 CA-C-O 150.851 14.643 . . . . 16.47 124.021 174.644 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 99' ' ' LYS . . . . . 1.528 ' CD ' ' CG ' ' C' ' 99' ' ' LYS 0.395 0.0 OUTLIER -67.71 -16.56 64.2 Favored 'General case' 1 C--N 1.991 28.482 2 CA-C-N 87.735 -13.393 . . . . 14.38 104.462 -178.223 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 100' ' ' LEU . . . . . 1.41 ' CA ' ' N ' ' C' ' 100' ' ' LEU 0.697 0.0 OUTLIER -86.97 -56.13 3.52 Favored 'General case' 3 N--CA 1.823 18.183 3 CA-C-O 89.612 -14.518 . . . . 15.1 94.069 -178.99 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 101' ' ' LEU . . . . . 1.554 ' CA ' ' CB ' ' C' ' 101' ' ' LEU 0.774 0.0 OUTLIER -50.43 -44.16 55.24 Favored 'General case' 2 C--O 1.519 15.241 3 O-C-N 145.231 14.082 . . . . 15.34 125.571 -179.433 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 102' ' ' SER . . . . . 1.349 ' C ' ' N ' ' C' ' 103' ' ' HIS 0.733 1.2 m -18.35 -88.76 0.0 OUTLIER 'General case' 3 C--N 1.122 -9.31 3 C-N-CA 150.161 11.384 . . . . 14.35 97.126 158.74 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HIS . . . . . 1.657 ' CB ' ' CG ' ' C' ' 103' ' ' HIS 0.262 1.5 t-80 -51.67 -32.42 29.64 Favored 'General case' 2 C--N 1.784 19.459 2 C-N-CA 97.113 -9.835 . . . . 14.05 126.861 169.304 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 104' ' ' SER . . . . . 1.475 ' C ' ' CA ' ' C' ' 104' ' ' SER 0.634 0.6 OUTLIER -57.78 -55.79 30.3 Favored 'General case' 3 CA--C 1.766 9.277 5 C-N-CA 147.283 10.233 . . . . 14.55 99.906 -157.097 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 105' ' ' LEU . . . . . 1.501 ' CG ' ' CD1' ' C' ' 105' ' ' LEU 0.469 4.6 tp -83.62 -38.02 22.13 Favored 'General case' 3 C--O 1.398 8.914 4 CA-C-O 97.814 -10.612 . . . . 15.21 99.673 -173.956 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 106' ' ' LEU . . . . . 0.454 HD23 HD21 ' D' ' 111' ' ' LEU . 0.6 OUTLIER -73.25 -21.7 60.57 Favored 'General case' 1 N--CA 1.211 -12.388 2 CA-C-N 131.937 6.699 . . . . 15.05 119.855 175.697 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' C' C ' 107' ' ' VAL . . . . . 0.827 HG12 ' O ' ' C' ' 103' ' ' HIS 0.645 0.2 OUTLIER -89.8 -57.46 4.24 Favored 'Isoleucine or valine' 2 N--CA 1.201 -12.913 5 C-N-CA 166.423 17.889 . . . . 15.99 86.724 173.751 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 108' ' ' THR . . . . . 1.565 ' CG2' ' CB ' ' C' ' 108' ' ' THR 1.101 19.8 m -76.36 -68.21 0.61 Allowed 'General case' 4 CA--C 1.847 12.383 5 CA-C-N 165.266 21.848 . . . . 13.92 86.866 -159.355 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 109' ' ' LEU . . . . . 0.641 ' O ' HD22 ' C' ' 113' ' ' LEU 0.418 1.3 mm? -36.97 -75.01 0.03 OUTLIER 'General case' 2 C--N 1.063 -11.87 3 C-N-CA 149.091 10.956 . . . . 15.09 109.248 -176.354 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 110' ' ' ALA . . . . . 1.212 ' C ' ' CA ' ' C' ' 110' ' ' ALA 0.856 . . 156.84 -72.32 0.0 OUTLIER 'General case' 2 CA--C 2.079 21.314 5 C-N-CA 176.978 22.111 . . . . 16.87 80.796 -25.29 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 111' ' ' SER . . . . . 1.414 ' C ' ' CA ' ' C' ' 111' ' ' SER . 46.7 t -53.07 -36.33 60.52 Favored 'General case' 4 C--N 0.967 -16.049 2 O-C-N 142.286 12.241 . . . . 15.37 117.202 -176.692 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 112' ' ' HIS . . . . . 0.508 ' N ' ' CA ' ' C' ' 111' ' ' SER 0.394 24.3 m80 -95.61 -46.79 6.49 Favored 'General case' 3 C--O 1.555 17.165 5 CA-C-O 81.396 -18.43 . . . . 14.64 97.385 -173.855 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 113' ' ' LEU . . . . . 1.534 ' CD2' ' CG ' ' C' ' 113' ' ' LEU 0.519 0.1 OUTLIER -126.27 80.6 68.52 Favored Pre-proline 1 C--O 1.37 7.425 4 O-C-N 144.523 13.639 . . . . 14.99 102.536 -166.745 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 114' ' ' PRO . . . . . 1.538 ' N ' ' CA ' ' C' ' 114' ' ' PRO 0.67 71.9 Cg_endo -96.99 16.79 0.66 Allowed 'Trans proline' 4 C--N 1.651 16.461 3 C-N-CA 102.645 -11.103 . . . . 12.85 112.432 -172.346 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 115' ' ' THR . . . . . 1.534 ' CB ' ' CG2' ' C' ' 115' ' ' THR 0.76 0.7 OUTLIER -103.09 -8.51 20.47 Favored 'General case' 4 C--O 1.663 22.867 4 O-C-N 134.993 7.683 . . . . 12.8 91.608 -176.89 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 116' ' ' ASN . . . . . 1.531 ' C ' ' CA ' ' C' ' 116' ' ' ASN 0.466 1.3 t30 -106.55 -61.93 1.46 Allowed 'General case' 3 C--N 1.08 -11.114 3 C-N-CA 159.966 15.307 . . . . 15.35 112.952 -157.139 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 117' ' ' PHE . . . . . 1.607 ' CD2' ' CE2' ' C' ' 117' ' ' PHE 1.029 0.1 OUTLIER -82.38 58.32 4.05 Favored 'General case' 2 C--N 0.99 -15.049 3 CA-C-O 92.953 -12.927 . . . . 16.87 104.515 -178.158 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 118' ' ' THR . . . . . 1.455 ' OG1' ' CB ' ' C' ' 118' ' ' THR 0.561 74.6 p -23.19 141.61 0.04 OUTLIER Pre-proline 3 C--N 0.896 -19.112 3 C-N-CA 162.136 16.174 . . . . 15.72 109.878 143.202 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 119' ' ' PRO . . . . . 1.362 ' C ' ' CA ' ' C' ' 119' ' ' PRO 0.607 77.8 Cg_exo -59.19 -35.06 98.34 Favored 'Trans proline' 3 CA--C 1.933 20.438 1 C-N-CA 112.373 -4.618 . . . . 14.73 113.417 177.927 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 120' ' ' ALA . . . . . . . . . . . . 0.566 . . -81.66 -23.58 36.82 Favored 'General case' 1 N--CA 1.09 -18.465 2 C-N-CA 145.636 9.574 . . . . 12.62 105.562 177.176 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' C' C ' 121' ' ' VAL . . . . . 1.379 ' C ' ' N ' ' C' ' 122' ' ' HIS . 85.3 t -90.95 -53.25 9.18 Favored 'Isoleucine or valine' 2 C--N 1.46 5.409 5 O-C-N 89.644 -20.66 . . . . 12.47 90.002 170.681 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 122' ' ' HIS . . . . . 1.379 ' N ' ' C ' ' C' ' 121' ' ' VAL 0.261 4.3 p80 -53.47 -32.88 52.06 Favored 'General case' 2 C--N 1.739 17.519 2 CA-C-N 134.973 8.079 . . . . 13.25 113.074 -167.937 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 123' ' ' ALA . . . . . 0.493 ' HB3' HD22 ' C' ' 124' ' ' ASN 0.609 . . -47.49 -71.01 0.08 Allowed 'General case' 2 C--O 1.105 -6.507 3 O-C-N 98.706 -14.996 . . . . 12.91 111.961 -170.977 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 124' ' ' ASN . . . . . 1.331 ' CG ' ' ND2' ' C' ' 124' ' ' ASN 0.564 0.0 OUTLIER -47.7 -78.57 0.02 OUTLIER 'General case' 1 C--O 1.332 5.41 2 O-C-N 135.105 7.753 . . . . 12.24 102.591 175.955 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . 0.528 91.0 mt -26.25 -56.69 0.07 Allowed 'General case' 3 C--O 1.359 6.839 4 CA-C-O 99.303 -9.903 . . . . 13.23 107.106 165.646 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' C' C ' 126' ' ' ASN . . . . . 1.504 ' C ' ' CA ' ' C' ' 126' ' ' ASN . 51.0 t-20 -50.32 -55.37 15.81 Favored 'General case' 3 CA--C 1.755 8.851 3 CA-C-N 141.358 10.981 . . . . 13.65 114.715 165.777 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 127' ' ' LYS . . . . . . . . . . . . 0.373 0.8 OUTLIER -41.33 -48.5 3.66 Favored 'General case' 1 C--N 1.124 -9.223 4 CA-C-O 147.319 12.961 . . . . 13.98 116.072 173.983 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 128' ' ' PHE . . . . . 1.594 ' CZ ' ' CE1' ' C' ' 128' ' ' PHE 0.754 4.7 t80 -64.53 -73.38 0.12 Allowed 'General case' 4 C--O 1.477 13.029 4 O-C-N 95.866 -16.771 . . . . 13.37 89.709 -172.081 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 129' ' ' LEU . . . . . 1.495 ' CG ' ' CB ' ' C' ' 129' ' ' LEU 0.475 0.1 OUTLIER -84.82 -63.83 1.26 Allowed 'General case' 3 C--N 1.072 -11.496 4 CA-C-O 100.531 -9.319 . . . . 13.08 93.601 -169.698 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 130' ' ' ALA . . . . . 1.344 ' CA ' ' N ' ' C' ' 130' ' ' ALA 0.447 . . -36.31 -27.19 0.01 OUTLIER 'General case' 4 N--CA 1.905 22.317 3 CA-C-N 152.045 15.839 . . . . 12.75 107.999 168.916 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 131' ' ' ASN . . . . . 1.514 ' CB ' ' CA ' ' C' ' 131' ' ' ASN 0.473 0.3 OUTLIER -95.47 -36.98 11.11 Favored 'General case' 2 N--CA 1.167 -14.58 3 CA-C-N 147.245 13.657 . . . . 14.05 114.532 -173.168 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 132' ' ' ASP . . . . . 0.658 ' O ' HD23 ' C' ' 136' ' ' LEU 0.613 0.8 OUTLIER -64.08 -36.48 84.15 Favored 'General case' 2 C--O 1.436 10.917 5 O-C-N 107.365 -9.585 . . . . 14.99 99.803 176.386 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 133' ' ' SER . . . . . 1.556 ' CA ' ' CB ' ' C' ' 133' ' ' SER 0.592 59.9 m -74.53 -85.33 0.04 OUTLIER 'General case' 3 N--CA 1.113 -17.278 4 C-N-CA 159.203 15.001 . . . . 13.47 94.393 -160.3 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 134' ' ' THR . . . . . 1.524 ' N ' ' CA ' ' C' ' 134' ' ' THR 0.951 21.7 m -46.98 -58.2 4.21 Favored 'General case' 4 N--CA 1.705 12.297 2 O-C-N 142.529 12.393 . . . . 11.67 104.609 176.428 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 135' ' ' VAL . . . . . 1.487 ' CB ' ' CG2' ' C' ' 135' ' ' VAL 0.382 1.3 m -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 2 C--O 1.65 22.168 4 O-C-N 100.294 -14.004 . . . . 11.95 95.174 -154.921 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 136' ' ' LEU . . . . . 1.605 ' CA ' ' CB ' ' C' ' 136' ' ' LEU 0.331 1.6 mm? -64.5 -22.13 66.88 Favored 'General case' 3 C--O 1.377 7.791 3 O-C-N 100.692 -13.755 . . . . 11.91 102.375 -178.267 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 137' ' ' THR . . . . . 1.524 ' CA ' ' N ' ' C' ' 137' ' ' THR . 1.9 m -103.77 -69.77 0.79 Allowed 'General case' 3 C--O 1.709 25.289 3 CA-C-O 101.932 -8.651 . . . . 11.54 93.292 -176.912 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' C' C ' 138' ' ' SER . . . . . 1.577 ' CA ' ' CB ' ' C' ' 138' ' ' SER 0.415 27.8 m 36.91 -64.6 0.0 OUTLIER 'General case' 3 C--N 1.143 -8.374 4 CA-C-N 166.558 22.436 . . . . 12.62 145.677 173.506 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' C' C ' 139' ' ' LYS . . . . . 1.458 ' CG ' ' CB ' ' C' ' 139' ' ' LYS . 0.1 OUTLIER -31.91 -36.83 0.02 OUTLIER 'General case' 2 N--CA 1.328 -6.553 2 CA-C-O 160.59 19.281 . . . . 13.54 109.338 169.691 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' C' C ' 140' ' ' TYR . . . . . 1.666 ' CG ' ' CB ' ' C' ' 140' ' ' TYR 0.402 0.1 OUTLIER -138.23 138.44 38.51 Favored 'General case' 2 N--CA 1.067 -19.614 5 O-C-N 90.577 -20.077 . . . . 14.62 135.072 141.207 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' C' C ' 141' ' ' ARG . . . . . 1.536 ' NE ' ' CD ' ' C' ' 141' ' ' ARG 0.606 1.4 mpt_? . . . . . 2 C--O 1.839 32.112 4 CA-C-N 96.218 -9.537 . . . . 15.41 104.389 172.901 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' D' D ' 1' ' ' MET . . . . . 1.449 ' CA ' ' N ' ' D' ' 1' ' ' MET 0.599 0.0 OUTLIER . . . . . 2 N--CA 1.798 16.971 2 CA-C-O 159.598 18.809 . . . . 14.31 76.283 . . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 2' ' ' LEU . . . . . 1.618 ' CB ' ' CG ' ' D' ' 2' ' ' LEU 1.143 0.0 OUTLIER 171.29 -33.34 0.0 OUTLIER 'General case' 2 C--N 1.572 10.251 4 CA-C-O 66.637 -25.458 . . . . 13.31 67.344 -166.635 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 3' ' ' THR . . . . . 1.43 ' CA ' ' N ' ' D' ' 3' ' ' THR 0.707 0.2 OUTLIER 63.19 103.88 0.03 OUTLIER 'General case' 3 N--CA 1.811 17.618 3 CA-C-N 166.701 22.5 . . . . 13.17 94.013 -168.128 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 4' ' ' ALA . . . . . 1.25 ' C ' ' CA ' ' D' ' 4' ' ' ALA 0.356 . . -94.45 133.77 37.68 Favored 'General case' 3 N--CA 1.944 24.242 4 C-N-CA 62.292 -23.763 . . . . 11.98 117.062 167.945 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 5' ' ' GLU . . . . . 1.248 ' CD ' ' CG ' ' D' ' 5' ' ' GLU 0.306 28.1 mp0 -118.75 138.78 52.43 Favored 'General case' 3 N--CA 0.596 -43.16 2 C-N-CA 171.604 19.962 . . . . 13.4 104.323 -25.501 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 6' ' ' GLU . . . . . 1.585 ' CB ' ' CA ' ' D' ' 6' ' ' GLU 0.375 1.8 pt-20 99.93 86.03 0.0 OUTLIER 'General case' 1 C--O 1.631 21.177 3 C-N-CA 170.876 19.671 . . . . 15.22 111.875 -108.461 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 7' ' ' LYS . . . . . 1.269 ' O ' ' CA ' ' D' ' 8' ' ' ALA 1.334 0.0 OUTLIER 135.95 105.34 0.0 OUTLIER 'General case' 4 C--O 0.695 -28.082 3 O-C-N 164.7 26.25 . . . . 18.76 109.139 -156.921 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ALA . . . . . 1.269 ' CA ' ' O ' ' D' ' 7' ' ' LYS . . . -176.18 55.66 0.01 OUTLIER 'General case' 4 C--O 2.08 44.775 3 O-C-N 47.19 -47.194 . . . . 16.9 110.543 15.913 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 9' ' ' ALA . . . . . 1.026 ' HB3' ' HB3' ' D' ' 5' ' ' GLU 0.74 . . -27.17 -81.06 0.01 OUTLIER 'General case' 1 C--N 1.466 5.64 2 CA-C-O 85.575 -16.441 . . . . 15.85 109.997 52.384 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 10' ' ' VAL . . . . . 1.49 ' C ' ' CA ' ' D' ' 10' ' ' VAL 0.726 0.1 OUTLIER -43.72 -24.04 0.17 Allowed 'Isoleucine or valine' 3 C--O 1.046 -9.634 4 CA-C-N 160.482 19.674 . . . . 14.65 137.115 168.888 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 11' ' ' THR . . . . . 1.494 ' C ' ' CA ' ' D' ' 11' ' ' THR 1.562 0.6 OUTLIER -96.11 61.51 2.1 Favored 'General case' 4 N--CA 1.827 18.4 3 CA-C-N 102.523 -6.671 . . . . 13.94 98.949 164.226 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 12' ' ' GLY . . . . . 1.556 ' N ' ' CA ' ' D' ' 12' ' ' GLY . . . 54.34 -86.38 0.01 OUTLIER Glycine 2 N--CA 1.682 15.053 3 O-C-N 64.523 -36.36 . . . . 14.44 97.904 -2.666 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 13' ' ' PHE . . . . . 0.663 ' O ' ' O ' ' D' ' 14' ' ' TRP 0.748 36.8 t80 -52.61 -56.47 15.13 Favored 'General case' 1 N--CA 1.618 7.953 3 CA-C-N 103.182 -6.509 . . . . 15.14 105.848 172.763 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 14' ' ' TRP . . . . . 1.659 ' CE3' ' CZ3' ' D' ' 14' ' ' TRP 1.032 0.0 OUTLIER -6.0 -137.1 0.0 OUTLIER 'General case' 4 N--CA 1.083 -18.801 4 CA-C-N 140.396 10.544 . . . . 15.08 106.217 170.829 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 15' ' ' GLY . . . . . 0.842 ' N ' ' CA ' ' D' ' 14' ' ' TRP . . . -61.61 117.61 12.09 Favored Glycine 3 C--N 0.985 -18.932 3 O-C-N 143.498 12.998 . . . . 14.7 91.084 -174.249 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 16' ' ' LYS . . . . . 1.53 ' CD ' ' CB ' ' D' ' 16' ' ' LYS 0.533 2.3 mtpt 97.29 87.85 0.01 OUTLIER 'General case' 4 C--O 1.454 11.816 4 C-N-CA 159.533 15.133 . . . . 15.74 110.54 -165.247 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 17' ' ' VAL . . . . . 1.531 ' C ' ' CA ' ' D' ' 17' ' ' VAL 0.74 2.3 m -176.02 155.11 0.31 Allowed 'Isoleucine or valine' 3 N--CA 1.199 -12.993 3 C-N-CA 158.054 14.541 . . . . 14.02 100.029 -170.162 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ASP . . . . . 1.542 ' CA ' ' CB ' ' D' ' 18' ' ' ASP 0.583 6.1 t0 -122.83 142.75 50.42 Favored 'General case' 2 C--O 0.756 -24.917 4 CA-C-O 166.984 22.326 . . . . 13.41 130.775 167.612 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 19' ' ' VAL . . . . . 1.296 ' CB ' ' CG2' ' D' ' 19' ' ' VAL 0.784 1.5 t -78.39 -163.62 0.06 OUTLIER 'Isoleucine or valine' 3 C--N 1.507 7.454 2 O-C-N 76.241 -29.037 . . . . 13.3 117.853 176.55 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 20' ' ' ASP . . . . . 1.41 ' C ' ' N ' ' D' ' 21' ' ' VAL 0.804 0.4 OUTLIER 33.02 -64.75 0.0 OUTLIER 'General case' 2 C--N 1.14 -8.513 5 C-N-CA 171.302 19.841 . . . . 13.1 82.922 -156.695 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 21' ' ' VAL . . . . . 1.41 ' N ' ' C ' ' D' ' 20' ' ' ASP 0.281 0.4 OUTLIER -62.01 -41.96 93.05 Favored 'Isoleucine or valine' 3 N--CA 1.077 -19.101 2 CA-C-O 94.17 -12.348 . . . . 12.3 115.747 -167.02 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 22' ' ' VAL . . . . . 1.651 ' CB ' ' CG1' ' D' ' 22' ' ' VAL 0.873 2.4 t -49.26 -64.84 0.26 Allowed 'Isoleucine or valine' 1 N--CA 1.324 -6.751 2 CA-C-O 146.606 12.622 . . . . 12.78 120.516 167.601 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 23' ' ' GLY . . . . . 0.691 ' N ' HD12 ' D' ' 67' ' ' LEU . . . -45.19 -42.44 8.75 Favored Glycine 3 CA--C 1.309 -12.816 3 O-C-N 89.949 -20.469 . . . . 13.04 111.351 176.642 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.1 -31.09 30.89 Favored 'General case' 1 CA--C 1.289 -9.062 1 CA-C-O 104.124 -7.608 . . . . 12.97 105.222 -172.301 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 25' ' ' GLN . . . . . 1.29 ' CG ' ' CD ' ' D' ' 25' ' ' GLN 0.72 2.9 tt0 -36.93 -65.75 0.27 Allowed 'General case' 2 C--O 0.908 -16.909 2 C-N-CA 159.83 15.252 . . . . 12.72 112.673 150.488 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ALA . . . . . 1.398 ' C ' ' CA ' ' D' ' 26' ' ' ALA 0.426 . . -70.48 -64.05 0.97 Allowed 'General case' 2 CA--C 1.897 14.317 3 CA-C-O 99.885 -9.626 . . . . 11.41 97.167 -177.522 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 27' ' ' LEU . . . . . 1.517 ' CD1' ' CG ' ' D' ' 27' ' ' LEU . 0.2 OUTLIER -61.51 -16.47 47.73 Favored 'General case' 1 N--CA 1.333 -6.276 1 O-C-N 140.231 10.957 . . . . 11.92 120.833 -174.759 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' D' D ' 28' ' ' GLY . . . . . 0.918 ' C ' ' HE3' ' D' ' 54' ' ' MET . . . -93.83 -26.73 14.04 Favored Glycine 2 C--O 1.466 14.656 1 CA-C-O 104.574 -8.903 . . . . 14.0 111.567 178.888 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 29' ' ' ARG . . . . . 0.489 ' HG3' HG11 ' D' ' 112' ' ' VAL 0.412 1.5 mmt180 -75.02 -40.22 60.68 Favored 'General case' 2 C--N 0.953 -16.663 3 C-N-CA 148.218 10.607 . . . . 14.08 111.516 176.555 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 30' ' ' LEU . . . . . 1.337 ' C ' ' CA ' ' D' ' 30' ' ' LEU 0.909 62.1 tp -71.29 -50.35 33.48 Favored 'General case' 2 CA--C 1.941 15.998 4 C-N-CA 140.607 7.563 . . . . 14.99 109.165 177.71 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 31' ' ' LEU . . . . . 1.562 ' CB ' ' CA ' ' D' ' 31' ' ' LEU 0.36 0.1 OUTLIER -65.91 -60.66 2.64 Favored 'General case' 3 CA--C 1.809 10.934 3 CA-C-O 96.147 -11.406 . . . . 14.99 96.019 175.279 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 32' ' ' VAL . . . . . 0.653 HG11 ' HA ' ' D' ' 50' ' ' ALA . 1.5 m -73.19 -37.93 53.49 Favored 'Isoleucine or valine' 4 C--O 1.038 -10.052 2 CA-C-O 89.727 -14.463 . . . . 13.02 100.598 -179.586 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 33' ' ' VAL . . . . . 0.612 HG22 ' O ' ' D' ' 33' ' ' VAL 0.575 0.4 OUTLIER -72.15 -48.81 47.4 Favored 'Isoleucine or valine' 4 C--N 1.115 -9.593 1 CA-C-N 145.608 12.913 . . . . 12.84 117.836 -168.973 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 34' ' ' TYR . . . . . 1.514 ' CA ' ' N ' ' D' ' 34' ' ' TYR 0.807 4.4 m-85 -106.95 85.99 2.18 Favored Pre-proline 2 N--CA 1.726 13.329 2 CA-C-O 100.252 -9.451 . . . . 14.86 87.427 -172.5 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 35' ' ' PRO . . . . . 1.387 ' N ' ' CD ' ' D' ' 35' ' ' PRO 0.61 37.6 Cg_endo -48.7 -31.94 20.45 Favored 'Trans proline' 3 C--O 0.976 -12.596 2 CA-C-O 87.639 -13.567 . . . . 14.73 109.445 176.069 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 36' ' ' TRP . . . . . 1.488 ' C ' ' CA ' ' D' ' 36' ' ' TRP . 1.2 p90 -63.1 -27.33 69.32 Favored 'General case' 4 N--CA 1.797 16.91 3 O-C-N 147.89 15.744 . . . . 15.58 86.717 -168.149 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 37' ' ' THR . . . . . 0.768 ' HB ' ' O ' ' D' ' 34' ' ' TYR 0.817 0.3 OUTLIER -39.39 -51.37 2.1 Favored 'General case' 3 C--O 1.534 16.041 2 CA-C-O 140.523 9.725 . . . . 15.52 125.669 -178.408 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 38' ' ' GLN . . . . . 1.501 ' CD ' ' CG ' ' D' ' 38' ' ' GLN . 32.3 tt0 -46.57 -35.92 6.32 Favored 'General case' 1 C--O 0.988 -12.704 3 O-C-N 102.809 -12.432 . . . . 15.27 125.936 176.835 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 39' ' ' ARG . . . . . 1.5 ' CD ' ' NE ' ' D' ' 39' ' ' ARG 0.305 1.5 ttp180 -49.51 -25.81 2.96 Favored 'General case' 2 C--N 1.579 10.577 4 O-C-N 148.756 16.285 . . . . 13.41 123.138 174.346 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 40' ' ' PHE . . . . . 1.546 ' CZ ' ' CE2' ' D' ' 40' ' ' PHE 0.536 1.0 OUTLIER -84.49 -53.23 5.57 Favored 'General case' 2 C--N 0.983 -15.331 3 CA-C-N 98.907 -8.315 . . . . 14.73 120.546 178.895 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 41' ' ' PHE . . . . . 1.632 ' CE2' ' CD2' ' D' ' 41' ' ' PHE 0.931 0.0 OUTLIER -73.22 75.9 1.3 Allowed 'General case' 4 CA--C 1.289 -9.096 2 O-C-N 136.216 8.448 . . . . 13.96 99.93 178.145 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 42' ' ' GLN . . . . . 1.445 ' CG ' ' CA ' ' D' ' 42' ' ' GLN 0.334 3.2 mt-30 -108.94 -7.16 15.46 Favored 'General case' 4 C--N 1.832 21.558 3 O-C-N 93.579 -18.201 . . . . 13.48 127.257 178.469 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 43' ' ' HIS . . . . . 1.562 ' CA ' ' CB ' ' D' ' 43' ' ' HIS 0.464 0.0 OUTLIER -2.1 -67.76 0.0 OUTLIER 'General case' 2 C--N 0.937 -17.329 1 C-N-CA 162.97 16.508 . . . . 15.38 105.713 135.916 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 44' ' ' PHE . . . . . 1.498 ' CB ' ' CA ' ' D' ' 44' ' ' PHE 0.641 18.2 m-30 -48.99 -80.46 0.01 OUTLIER 'General case' 4 N--CA 1.012 -22.337 3 C-N-CA 150.264 11.426 . . . . 17.25 135.595 173.606 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 45' ' ' GLY . . . . . 0.812 ' C ' ' CA ' ' D' ' 46' ' ' ASN . . . 147.23 -120.34 1.24 Allowed Glycine 2 C--O 0.961 -16.966 3 CA-C-N 142.559 11.527 . . . . 15.58 121.378 172.189 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 46' ' ' ASN . . . . . 1.499 ' CA ' ' N ' ' D' ' 46' ' ' ASN 0.731 5.6 t-20 -50.23 90.37 0.0 OUTLIER 'General case' 1 N--CA 1.685 11.296 4 CA-C-O 103.951 -7.69 . . . . 13.92 119.657 176.217 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 47' ' ' LEU . . . . . 1.584 ' CB ' ' CA ' ' D' ' 47' ' ' LEU 0.495 0.0 OUTLIER -127.94 28.61 5.54 Favored 'General case' 3 C--N 1.0 -14.595 3 CA-C-O 138.361 8.696 . . . . 13.24 105.737 -179.516 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 48' ' ' SER . . . . . 1.254 ' CB ' ' OG ' ' D' ' 48' ' ' SER 0.817 0.0 OUTLIER -73.55 34.44 0.08 Allowed 'General case' 2 C--O 1.521 15.391 2 CA-C-N 96.594 -9.366 . . . . 12.24 119.413 -177.069 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 49' ' ' SER . . . . . 0.814 ' O ' ' CG1' ' D' ' 53' ' ' VAL . 9.4 p 136.25 129.47 0.0 OUTLIER 'General case' 1 N--CA 1.661 10.121 1 N-CA-C 96.511 -5.366 . . . . 13.26 96.511 -165.492 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 50' ' ' ALA . . . . . 1.37 ' CA ' ' C ' ' D' ' 50' ' ' ALA 0.342 . . -46.5 -39.27 10.53 Favored 'General case' 3 CA--C 1.908 14.735 3 CA-C-O 90.169 -14.253 . . . . 11.73 92.617 -177.872 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 51' ' ' GLY . . . . . 1.262 ' C ' ' N ' ' D' ' 52' ' ' ALA . . . 150.27 -92.7 0.14 Allowed Glycine 1 C--N 1.075 -13.934 4 CA-C-O 155.404 19.335 . . . . 12.65 77.386 -5.491 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 52' ' ' ALA . . . . . 1.509 ' CA ' ' CB ' ' D' ' 52' ' ' ALA 0.683 . . -123.74 39.64 3.91 Favored 'General case' 4 C--N 1.875 23.418 3 O-C-N 87.781 -20.835 . . . . 12.89 115.223 -167.624 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 53' ' ' VAL . . . . . 1.404 ' CB ' ' CG2' ' D' ' 53' ' ' VAL 0.62 0.8 OUTLIER -98.1 -40.1 9.17 Favored 'Isoleucine or valine' 3 N--CA 0.951 -25.392 2 C-N-CA 156.586 13.954 . . . . 12.16 79.243 -177.315 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 54' ' ' MET . . . . . 1.375 ' CG ' ' SD ' ' D' ' 54' ' ' MET 0.328 24.6 mmt -80.82 -48.62 12.18 Favored 'General case' 3 C--O 1.734 26.597 3 O-C-N 110.568 -7.582 . . . . 14.02 102.197 175.183 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 55' ' ' ASN . . . . . 1.411 ' ND2' ' CG ' ' D' ' 55' ' ' ASN 0.904 39.6 t-20 -58.48 -60.78 3.26 Favored 'General case' 3 N--CA 0.938 -26.059 2 CA-C-N 139.133 9.97 . . . . 15.52 113.407 -178.595 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 56' ' ' ASN . . . . . 1.328 ' C ' ' O ' ' D' ' 56' ' ' ASN 1.047 1.5 t-20 19.4 67.3 0.24 Allowed Pre-proline 3 C--O 1.656 22.495 4 C-N-CA 161.201 15.8 . . . . 13.03 112.323 -175.892 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 57' ' ' PRO . . . . . 1.424 ' CB ' ' CA ' ' D' ' 57' ' ' PRO 0.605 7.6 Cg_endo -44.28 -50.29 7.96 Favored 'Trans proline' 4 N--CA 1.16 -18.107 2 CA-C-N 142.711 9.147 . . . . 14.62 111.715 -168.954 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 58' ' ' LYS . . . . . 1.381 ' CE ' ' NZ ' ' D' ' 58' ' ' LYS 0.533 0.0 OUTLIER -24.84 -78.08 0.01 OUTLIER 'General case' 1 C--N 1.174 -7.065 4 C-N-CA 151.924 12.09 . . . . 15.02 98.351 173.317 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 59' ' ' VAL . . . . . 1.604 ' CB ' ' CG2' ' D' ' 59' ' ' VAL 0.622 57.8 t -49.39 -88.6 0.0 OUTLIER 'Isoleucine or valine' 4 CA--C 1.837 11.999 3 CA-C-O 94.483 -12.199 . . . . 14.67 93.554 -176.399 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 60' ' ' LYS . . . . . 1.618 ' CD ' ' CE ' ' D' ' 60' ' ' LYS . 1.3 mttp -15.98 -72.99 0.01 OUTLIER 'General case' 3 C--O 1.46 12.172 1 O-C-N 147.322 15.389 . . . . 14.48 112.86 174.674 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 61' ' ' ALA . . . . . 1.527 ' CA ' ' CB ' ' D' ' 61' ' ' ALA 0.311 . . -22.32 -77.49 0.01 OUTLIER 'General case' 2 N--CA 1.18 -13.946 4 CA-C-O 159.514 18.769 . . . . 13.74 119.81 163.059 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 62' ' ' HIS . . . . . 1.54 ' NE2' ' CE1' ' D' ' 62' ' ' HIS 0.276 2.1 t-80 -43.38 -22.61 0.04 OUTLIER 'General case' 2 C--O 1.085 -7.567 2 O-C-N 92.81 -18.681 . . . . 13.41 121.61 168.493 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 63' ' ' GLY . . . . . 0.651 ' O ' ' HB ' ' D' ' 66' ' ' VAL . . . -78.49 -50.53 6.07 Favored Glycine 4 C--O 1.563 20.688 5 N-CA-C 92.98 -8.048 . . . . 15.65 92.98 -175.073 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 64' ' ' LYS . . . . . 1.566 ' CG ' ' CD ' ' D' ' 64' ' ' LYS . 0.9 OUTLIER -37.86 -82.61 0.01 OUTLIER 'General case' 4 C--O 0.834 -20.766 2 C-N-CA 140.243 7.417 . . . . 16.11 109.913 177.359 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' D' D ' 65' ' ' ARG . . . . . 1.548 ' C ' ' CA ' ' D' ' 65' ' ' ARG 0.433 0.1 OUTLIER -63.48 -9.62 13.74 Favored 'General case' 3 N--CA 1.27 -9.454 1 CA-C-O 94.603 -12.142 . . . . 17.81 115.078 -178.679 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 66' ' ' VAL . . . . . 1.04 ' N ' ' CA ' ' D' ' 65' ' ' ARG . 1.8 t -85.54 -58.61 3.34 Favored 'Isoleucine or valine' 3 C--N 0.931 -17.611 2 O-C-N 156.589 21.181 . . . . 14.28 108.566 170.484 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 67' ' ' LEU . . . . . 1.485 ' CA ' ' CB ' ' D' ' 67' ' ' LEU 0.683 10.9 mt -62.95 -41.97 99.68 Favored 'General case' 4 CA--C 1.857 12.773 3 CA-C-O 88.837 -14.887 . . . . 13.9 103.07 171.643 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 68' ' ' ASP . . . . . 1.511 ' CB ' ' CG ' ' D' ' 68' ' ' ASP 0.659 0.7 OUTLIER -55.9 -43.61 77.42 Favored 'General case' 3 N--CA 0.922 -26.852 3 O-C-N 136.595 8.684 . . . . 14.74 106.135 175.835 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 69' ' ' ALA . . . . . 1.521 ' C ' ' CA ' ' D' ' 69' ' ' ALA 0.45 . . -61.07 -55.54 31.37 Favored 'General case' 3 C--N 1.021 -13.695 3 O-C-N 96.452 -16.405 . . . . 15.7 116.612 -162.22 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 70' ' ' PHE . . . . . 1.318 ' HA ' ' O ' ' D' ' 70' ' ' PHE 0.284 86.0 t80 -91.55 -47.31 7.48 Favored 'General case' 3 C--O 1.976 39.308 4 CA-C-O 70.167 -23.777 . . . . 17.22 119.19 175.155 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 71' ' ' THR . . . . . 1.45 ' CB ' ' CG2' ' D' ' 71' ' ' THR 0.506 1.2 m 83.53 50.88 0.01 OUTLIER 'General case' 3 C--N 1.0 -14.624 5 CA-C-O 153.439 15.876 . . . . 17.96 135.723 9.981 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 72' ' ' GLN . . . . . 0.868 ' OE1' ' N ' ' D' ' 73' ' ' GLY 0.308 0.0 OUTLIER 133.9 -102.37 0.0 OUTLIER 'General case' 3 C--N 1.175 -6.994 3 CA-C-O 79.82 -19.181 . . . . 14.44 109.659 -115.848 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 73' ' ' GLY . . . . . 1.53 ' CA ' ' C ' ' D' ' 73' ' ' GLY . . . 2.49 -62.21 0.0 OUTLIER Glycine 3 N--CA 1.102 -23.582 4 C-N-CA 158.708 17.337 . . . . 12.94 94.876 178.272 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 74' ' ' LEU . . . . . 0.988 ' O ' HD11 ' D' ' 77' ' ' LEU 0.666 1.5 mm? -57.66 -41.63 81.91 Favored 'General case' 4 N--CA 1.031 -21.409 4 C-N-CA 164.338 17.055 . . . . 13.05 84.493 -148.138 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 75' ' ' LYS . . . . . 1.585 ' CG ' ' CD ' ' D' ' 75' ' ' LYS 0.727 0.0 OUTLIER -37.38 -112.94 0.0 OUTLIER 'General case' 4 C--O 1.896 35.106 3 C-N-CA 143.531 8.732 . . . . 14.78 99.145 167.571 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 76' ' ' HIS . . . . . 1.583 ' CB ' ' CG ' ' D' ' 76' ' ' HIS 0.615 3.0 p-80 -94.39 112.98 24.78 Favored 'General case' 3 N--CA 1.72 13.05 1 CA-C-N 134.553 7.888 . . . . 16.98 111.121 -176.709 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 77' ' ' LEU . . . . . 1.436 ' CB ' ' CG ' ' D' ' 77' ' ' LEU 0.452 4.1 mp -76.17 -36.53 58.66 Favored 'General case' 3 N--CA 1.303 -7.809 4 CA-C-O 146.345 12.498 . . . . 14.54 111.413 178.484 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 78' ' ' ASP . . . . . 1.469 ' CB ' ' CG ' ' D' ' 78' ' ' ASP 0.833 0.0 OUTLIER 143.21 -64.12 0.0 OUTLIER 'General case' 2 CA--C 1.851 12.521 4 O-C-N 71.222 -32.174 . . . . 15.31 89.547 25.857 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 79' ' ' ASP . . . . . 1.408 ' CB ' ' CA ' ' D' ' 79' ' ' ASP 0.704 3.1 t0 -140.57 59.27 1.55 Allowed 'General case' 1 N--CA 1.216 -12.154 2 CA-C-N 93.916 -10.583 . . . . 14.14 118.357 -176.325 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.03 -46.39 16.58 Favored 'General case' 1 C--O 1.05 -9.442 3 CA-C-O 103.804 -7.76 . . . . 16.69 119.224 177.654 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 81' ' ' LYS . . . . . 1.611 ' CB ' ' CA ' ' D' ' 81' ' ' LYS 0.905 0.1 OUTLIER -46.3 -20.36 0.11 Allowed 'General case' 4 C--O 1.039 -10.009 4 O-C-N 152.809 18.818 . . . . 16.98 128.64 178.097 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 82' ' ' GLY . . . . . 0.522 ' H ' ' HD3' ' D' ' 81' ' ' LYS . . . -55.53 -93.04 0.01 OUTLIER Glycine 1 C--N 1.48 8.535 4 CA-C-O 159.365 21.536 . . . . 16.24 95.289 -173.227 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 83' ' ' ALA . . . . . 1.365 ' CA ' ' C ' ' D' ' 83' ' ' ALA 0.476 . . -35.79 -62.2 0.43 Allowed 'General case' 2 CA--C 1.9 14.422 4 O-C-N 99.913 -13.698 . . . . 15.35 99.049 -163.19 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 84' ' ' PHE . . . . . 1.604 ' CD1' ' CG ' ' D' ' 84' ' ' PHE 1.403 0.4 OUTLIER -122.02 37.64 4.32 Favored 'General case' 1 C--N 1.453 5.067 5 CA-C-O 147.724 13.154 . . . . 14.38 125.003 173.148 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 85' ' ' ALA . . . . . 1.152 ' CA ' ' N ' ' D' ' 85' ' ' ALA 0.435 . . -60.9 -36.22 78.69 Favored 'General case' 2 N--CA 2.078 30.97 3 CA-C-N 89.462 -12.608 . . . . 14.22 108.021 177.855 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 86' ' ' GLN . . . . . 1.59 ' CB ' ' CA ' ' D' ' 86' ' ' GLN 0.638 5.6 pt20 -31.38 -42.55 0.05 OUTLIER 'General case' 3 C--O 0.987 -12.763 3 C-N-CA 143.674 8.79 . . . . 16.9 115.32 155.542 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 87' ' ' LEU . . . . . 1.448 ' CB ' ' CA ' ' D' ' 87' ' ' LEU 0.535 0.0 OUTLIER -116.13 -17.94 10.72 Favored 'General case' 2 N--CA 1.055 -20.188 1 O-C-N 145.237 14.086 . . . . 13.54 106.792 -173.384 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 88' ' ' SER . . . . . 1.489 ' CA ' ' CB ' ' D' ' 88' ' ' SER 0.447 2.3 t -82.26 57.17 3.49 Favored 'General case' 1 CA--C 1.268 -9.897 2 O-C-N 110.944 -7.347 . . . . 13.39 99.033 162.254 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 89' ' ' GLY . . . . . . . . . . . . . . . -123.43 -65.84 0.21 Allowed Glycine 4 C--N 1.047 -15.488 4 O-C-N 97.55 -15.718 . . . . 13.67 85.81 170.821 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 90' ' ' LEU . . . . . 1.543 ' CB ' ' CG ' ' D' ' 90' ' ' LEU . 0.0 OUTLIER -82.23 -38.29 24.73 Favored 'General case' 4 C--O 0.87 -18.89 4 C-N-CA 158.587 14.755 . . . . 12.73 113.305 -141.791 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' D' D ' 91' ' ' HIS . . . . . 0.682 ' HA ' ' HG ' ' D' ' 95' ' ' LEU . 22.9 m80 -87.43 -51.0 6.18 Favored 'General case' 2 C--N 1.581 10.631 3 CA-C-O 82.103 -18.094 . . . . 13.1 97.016 -178.021 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 92' ' ' CYS . . . . . 1.41 ' C ' ' CA ' ' D' ' 92' ' ' CYS 0.271 40.6 t -61.61 -82.01 0.02 OUTLIER 'General case' 3 CA--C 1.881 13.699 2 O-C-N 162.017 24.573 . . . . 12.09 107.806 174.634 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 93' ' ' ASN . . . . . 1.518 ' CB ' ' CG ' ' D' ' 93' ' ' ASN 0.64 2.0 m120 -57.77 -45.53 85.84 Favored 'General case' 3 N--CA 1.227 -11.593 2 CA-C-O 94.427 -12.225 . . . . 13.18 113.191 -172.93 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 94' ' ' LYS . . . . . 1.456 ' CD ' ' CE ' ' D' ' 94' ' ' LYS 0.756 0.0 OUTLIER -87.58 -70.05 0.65 Allowed 'General case' 2 N--CA 1.263 -9.795 5 O-C-N 157.505 21.753 . . . . 14.61 133.514 175.746 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 95' ' ' LEU . . . . . 1.313 ' CB ' ' CG ' ' D' ' 95' ' ' LEU 0.718 0.0 OUTLIER -88.7 -6.09 57.69 Favored 'General case' 3 C--N 0.921 -18.025 3 C-N-CA 102.467 -7.693 . . . . 14.95 119.135 168.217 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 96' ' ' HIS . . . . . 1.444 ' C ' ' CA ' ' D' ' 96' ' ' HIS . 0.9 OUTLIER 79.52 90.3 0.05 Allowed 'General case' 4 N--CA 1.801 17.102 5 O-C-N 99.745 -14.347 . . . . 16.47 96.443 168.253 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' D' D ' 97' ' ' VAL . . . . . 0.83 ' CG2' HD12 ' D' ' 95' ' ' LEU 0.785 20.6 t -106.09 116.26 49.48 Favored 'Isoleucine or valine' 3 C--O 1.06 -8.917 2 CA-C-O 90.578 -14.058 . . . . 16.08 114.195 -170.095 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 98' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' D' ' 100' ' ' GLN . 1.5 m120 -37.69 114.18 0.71 Allowed Pre-proline 3 C--N 1.102 -10.155 3 CA-C-N 143.315 11.871 . . . . 17.9 130.947 174.215 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 99' ' ' PRO . . . . . 1.434 ' CG ' ' CB ' ' D' ' 99' ' ' PRO . 71.6 Cg_exo -24.03 -41.14 0.03 OUTLIER 'Trans proline' 2 CA--C 1.316 -10.392 2 CA-C-O 151.09 12.871 . . . . 15.06 120.87 -178.49 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 100' ' ' GLN . . . . . 1.519 ' CB ' ' CG ' ' D' ' 100' ' ' GLN 0.784 0.9 OUTLIER -65.37 -58.03 6.9 Favored 'General case' 3 N--CA 1.564 5.229 3 O-C-N 91.249 -19.657 . . . . 13.87 90.816 -146.806 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 101' ' ' ASN . . . . . 1.529 ' CA ' ' N ' ' D' ' 101' ' ' ASN 1.091 0.1 OUTLIER -51.46 -26.31 7.95 Favored 'General case' 3 N--CA 1.678 10.965 4 O-C-N 138.726 10.016 . . . . 14.56 131.74 178.896 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 102' ' ' PHE . . . . . 1.347 ' CA ' ' N ' ' D' ' 102' ' ' PHE 0.797 12.2 m-30 -70.24 -57.74 4.55 Favored 'General case' 2 N--CA 1.899 22.018 4 CA-C-O 88.824 -14.893 . . . . 15.22 83.92 -175.351 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 103' ' ' ARG . . . . . 1.561 ' CG ' ' CD ' ' D' ' 103' ' ' ARG 1.638 0.1 OUTLIER -80.2 -10.4 59.76 Favored 'General case' 2 C--N 1.092 -10.625 4 CA-C-O 157.969 18.033 . . . . 14.68 131.413 -166.592 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 104' ' ' LEU . . . . . 1.467 ' CB ' ' CG ' ' D' ' 104' ' ' LEU 0.264 0.6 OUTLIER -73.63 -54.77 7.36 Favored 'General case' 1 N--CA 1.317 -7.108 3 O-C-N 100.971 -13.58 . . . . 14.91 103.291 -179.888 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 105' ' ' LEU . . . . . 1.552 ' CG ' ' CD1' ' D' ' 105' ' ' LEU 0.301 6.0 tt -89.2 -21.26 23.36 Favored 'General case' 3 C--O 1.489 13.686 5 O-C-N 98.207 -15.308 . . . . 14.63 91.116 -179.445 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 106' ' ' GLY . . . . . 0.496 ' HA3' ' CG1' ' D' ' 133' ' ' VAL . . . -73.45 -42.82 39.83 Favored Glycine 2 N--CA 1.336 -7.995 3 CA-C-N 152.099 15.863 . . . . 14.63 115.517 174.49 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 107' ' ' ASN . . . . . 1.525 ' N ' ' CA ' ' D' ' 107' ' ' ASN 0.747 1.0 OUTLIER -65.75 -48.35 72.15 Favored 'General case' 3 N--CA 1.694 11.771 4 CA-C-O 98.171 -10.442 . . . . 14.09 90.817 -173.973 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 108' ' ' VAL . . . . . 1.467 ' O ' ' CA ' ' D' ' 108' ' ' VAL 0.75 2.3 t -45.95 -35.0 2.0 Favored 'Isoleucine or valine' 4 C--O 0.729 -26.337 2 CA-C-N 130.571 6.078 . . . . 13.74 118.324 162.719 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 109' ' ' LEU . . . . . 1.499 ' CD2' ' CG ' ' D' ' 109' ' ' LEU 0.848 0.2 OUTLIER -72.9 -75.5 0.14 Allowed 'General case' 3 N--CA 0.966 -24.645 4 CA-C-O 95.668 -11.634 . . . . 14.26 101.013 -177.881 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 110' ' ' ALA . . . . . 1.537 ' CA ' ' N ' ' D' ' 110' ' ' ALA 0.97 . . -18.36 -52.22 0.01 OUTLIER 'General case' 4 CA--C 2.017 18.928 4 O-C-N 146.555 14.909 . . . . 15.54 90.839 170.159 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 111' ' ' LEU . . . . . 1.267 ' C ' ' CA ' ' D' ' 112' ' ' VAL 0.272 0.0 OUTLIER -88.05 -52.5 5.22 Favored 'General case' 4 N--CA 1.21 -12.449 3 CA-C-O 88.826 -14.892 . . . . 16.18 108.08 -162.586 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 112' ' ' VAL . . . . . 1.525 ' CB ' ' CG1' ' D' ' 112' ' ' VAL 0.687 1.1 m -78.45 -20.55 13.25 Favored 'Isoleucine or valine' 3 C--N 0.844 -21.385 4 O-C-N 143.039 12.712 . . . . 15.41 105.419 -177.267 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 113' ' ' VAL . . . . . 0.425 ' CG2' HD13 ' D' ' 109' ' ' LEU 0.779 0.0 OUTLIER -84.75 -63.92 1.14 Allowed 'Isoleucine or valine' 2 CA--C 1.332 -7.434 3 O-C-N 141.776 11.923 . . . . 14.39 84.823 -178.164 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 114' ' ' ALA . . . . . 0.677 ' N ' ' O ' ' D' ' 110' ' ' ALA . . . -70.09 14.1 0.13 Allowed 'General case' 2 N--CA 1.627 8.423 1 CA-C-O 101.057 -9.068 . . . . 13.13 112.135 -175.857 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 115' ' ' ARG . . . . . 1.461 ' CB ' ' CA ' ' D' ' 115' ' ' ARG 0.867 0.0 OUTLIER -97.68 -55.0 2.94 Favored 'General case' 3 C--N 1.033 -13.186 4 CA-C-O 144.991 11.853 . . . . 14.8 118.64 161.052 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 116' ' ' ASN . . . . . 1.391 ' C ' ' N ' ' D' ' 117' ' ' PHE 1.511 0.0 OUTLIER -12.29 -67.6 0.01 OUTLIER 'General case' 2 C--N 1.611 11.938 3 O-C-N 88.478 -21.389 . . . . 12.17 111.999 151.198 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 117' ' ' PHE . . . . . 1.391 ' N ' ' C ' ' D' ' 116' ' ' ASN 0.665 2.0 m-85 -113.48 5.21 16.59 Favored 'General case' 3 C--N 1.715 16.468 2 CA-C-O 97.187 -10.911 . . . . 12.97 108.116 179.111 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.77 -147.36 25.06 Favored Glycine 3 CA--C 1.194 -19.978 4 CA-C-N 145.67 12.941 . . . . 12.36 114.445 144.73 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 119' ' ' GLY . . . . . 1.525 ' CA ' ' N ' ' D' ' 119' ' ' GLY . . . -73.8 -41.95 40.26 Favored Glycine 2 N--CA 1.72 17.606 4 O-C-N 96.922 -15.458 . . . . 11.6 94.997 -166.096 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 120' ' ' GLN . . . . . 1.608 ' CB ' ' CG ' ' D' ' 120' ' ' GLN 0.305 13.2 mt-30 -41.44 -35.32 0.66 Allowed 'General case' 2 C--O 0.955 -14.396 4 O-C-N 96.833 -15.51 . . . . 12.6 98.705 177.536 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 121' ' ' PHE . . . . . 1.564 ' CA ' ' CB ' ' D' ' 121' ' ' PHE 0.707 0.1 OUTLIER -79.44 50.34 1.1 Allowed 'General case' 1 C--O 1.044 -9.756 2 N-CA-C 138.628 10.233 . . . . 15.11 138.628 176.914 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 122' ' ' THR . . . . . 0.63 ' H ' HG12 ' D' ' 125' ' ' VAL 0.672 1.3 p -41.26 172.35 0.03 OUTLIER Pre-proline 3 CA--C 1.24 -10.962 2 N-CA-C 130.622 7.267 . . . . 13.44 130.622 -166.429 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 123' ' ' PRO . . . . . 1.642 ' CG ' ' CD ' ' D' ' 123' ' ' PRO 1.042 18.4 Cg_exo -58.28 -42.93 51.29 Favored 'Trans proline' 3 CA--C 1.891 18.342 0 CA-C-O 128.977 3.657 . . . . 12.96 116.245 170.786 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 124' ' ' ASN . . . . . 1.456 ' CG ' ' CB ' ' D' ' 124' ' ' ASN 0.666 0.2 OUTLIER -52.52 -97.84 0.0 OUTLIER 'General case' 4 CA--C 1.827 11.61 4 CA-C-O 98.106 -10.473 . . . . 14.55 97.263 159.553 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 125' ' ' VAL . . . . . 0.63 HG12 ' H ' ' D' ' 122' ' ' THR 0.987 0.4 OUTLIER -40.35 -49.01 0.62 Allowed 'Isoleucine or valine' 4 C--O 1.626 20.914 1 O-C-N 134.796 7.56 . . . . 14.36 102.062 -176.074 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 126' ' ' GLN . . . . . 1.252 ' CD ' ' NE2' ' D' ' 126' ' ' GLN . 0.0 OUTLIER -71.62 -51.3 23.92 Favored 'General case' 4 N--CA 1.565 5.325 3 O-C-N 104.057 -11.652 . . . . 15.38 112.173 -173.57 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' D' D ' 127' ' ' ALA . . . . . 1.527 ' CB ' ' CA ' ' D' ' 127' ' ' ALA 0.891 . . -76.09 -70.84 0.42 Allowed 'General case' 2 C--O 1.387 8.337 4 CA-C-O 77.446 -20.312 . . . . 15.57 90.312 -170.734 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 128' ' ' LEU . . . . . 1.476 ' CA ' ' N ' ' D' ' 128' ' ' LEU 1.142 0.1 OUTLIER -26.65 -74.59 0.02 OUTLIER 'General case' 3 N--CA 1.725 13.275 3 CA-C-N 155.776 17.534 . . . . 16.69 96.908 -170.374 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 129' ' ' PHE . . . . . 1.491 ' CA ' ' N ' ' D' ' 129' ' ' PHE . 59.7 m-85 -46.58 -32.82 3.67 Favored 'General case' 3 N--CA 1.759 14.977 5 O-C-N 160.523 23.639 . . . . 15.02 128.259 -171.191 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 130' ' ' GLN . . . . . 1.362 ' CG ' ' CA ' ' D' ' 130' ' ' GLN 0.846 4.0 tp60 -55.76 -35.89 66.71 Favored 'General case' 3 CA--C 1.727 7.772 4 O-C-N 101.767 -13.083 . . . . 14.14 95.954 178.238 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 131' ' ' LYS . . . . . 1.538 ' CB ' ' CG ' ' D' ' 131' ' ' LYS 1.061 0.0 OUTLIER -94.8 -7.33 40.68 Favored 'General case' 2 C--O 1.027 -10.608 2 O-C-N 105.863 -10.523 . . . . 12.73 111.538 178.45 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 132' ' ' VAL . . . . . 1.483 ' CA ' ' N ' ' D' ' 132' ' ' VAL 0.593 1.1 m -69.61 -31.16 47.79 Favored 'Isoleucine or valine' 3 N--CA 1.723 13.183 2 C-N-CA 90.627 -12.429 . . . . 13.85 110.629 -179.126 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 133' ' ' VAL . . . . . 0.496 ' CG1' ' HA3' ' D' ' 106' ' ' GLY 0.643 0.8 OUTLIER -46.29 -44.9 6.04 Favored 'Isoleucine or valine' 1 C--N 1.139 -8.567 4 O-C-N 137.303 9.127 . . . . 14.37 122.478 -177.667 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 134' ' ' ALA . . . . . . . . . . . . 0.282 . . -73.75 -98.58 0.01 OUTLIER 'General case' 3 CA--C 1.686 6.177 3 C-N-CA 149.37 11.068 . . . . 14.0 83.547 -172.106 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' D' D ' 135' ' ' GLY . . . . . . . . . . . . . . . -54.33 -36.21 57.16 Favored Glycine 3 CA--C 1.182 -20.779 5 CA-C-O 91.644 -16.086 . . . . 13.58 102.823 -170.481 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' D' D ' 136' ' ' VAL . . . . . 0.712 HG13 ' CE1' ' D' ' 84' ' ' PHE 0.688 21.6 t -79.07 -35.75 17.79 Favored 'Isoleucine or valine' 3 C--O 1.569 17.89 3 CA-C-N 144.129 13.965 . . . . 12.61 101.332 -175.41 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 137' ' ' ALA . . . . . 0.968 ' HB1' HD13 ' D' ' 140' ' ' LEU 0.554 . . -132.81 65.01 1.6 Allowed 'General case' 3 C--O 1.012 -11.435 5 C-N-CA 91.594 -12.042 . . . . 12.4 82.606 -168.543 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 138' ' ' ASN . . . . . 1.423 ' CA ' ' N ' ' D' ' 138' ' ' ASN 0.777 0.8 OUTLIER -120.68 -58.75 1.81 Allowed 'General case' 4 N--CA 1.817 17.923 3 C-N-CA 167.187 18.195 . . . . 12.11 108.251 145.911 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 139' ' ' ALA . . . . . 0.49 ' O ' ' N ' ' D' ' 142' ' ' HIS 0.805 . . -19.43 -60.25 0.02 OUTLIER 'General case' 1 C--N 1.209 -5.531 4 CA-C-N 154.756 17.071 . . . . 10.84 108.446 144.931 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 140' ' ' LEU . . . . . 1.514 ' CG ' ' CD1' ' D' ' 140' ' ' LEU 0.982 0.6 OUTLIER -43.33 -55.68 3.93 Favored 'General case' 2 C--O 1.001 -11.977 3 CA-C-O 100.018 -9.563 . . . . 11.45 102.615 178.749 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 141' ' ' ALA . . . . . 1.443 ' C ' ' N ' ' D' ' 142' ' ' HIS . . . -72.44 -11.84 60.85 Favored 'General case' 4 CA--C 1.857 12.787 2 CA-C-N 132.398 6.908 . . . . 11.21 101.129 -170.132 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' D' D ' 142' ' ' HIS . . . . . 1.49 ' CB ' ' CA ' ' D' ' 142' ' ' HIS 0.999 0.2 OUTLIER -102.3 98.76 8.84 Favored 'General case' 4 C--O 0.905 -17.06 4 C-N-CA 97.473 -9.691 . . . . 12.09 94.222 -172.775 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 143' ' ' LYS . . . . . 1.469 ' CE ' ' CD ' ' D' ' 143' ' ' LYS 0.526 0.0 OUTLIER 174.39 -65.93 0.01 OUTLIER 'General case' 2 C--O 1.626 20.912 5 O-C-N 151.128 17.767 . . . . 14.22 141.109 110.872 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' D' D ' 144' ' ' TYR . . . . . 1.556 ' CZ ' ' CE1' ' D' ' 144' ' ' TYR 1.288 10.8 t80 -7.44 -84.29 0.0 OUTLIER 'General case' 2 C--O 1.532 15.957 3 O-C-N 78.559 -27.588 . . . . 14.55 118.416 -161.434 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' D' D ' 145' ' ' HIS . . . . . 1.457 ' C ' ' CA ' ' D' ' 145' ' ' HIS 1.342 0.0 OUTLIER . . . . . 4 C--O 1.747 27.253 5 O-C-N 145.609 14.318 . . . . 16.63 146.623 -169.036 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HEM . . . . . 1.672 ' CMA' ' C3A' ' A' ' 142' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' HEM . . . . . 1.612 ' C3D' ' CAD' ' B' ' 146' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 142' ' ' HEM . . . . . 1.646 ' CAB' ' C3B' ' C' ' 142' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 146' ' ' HEM . . . . . 1.615 ' CBA' ' CAA' ' D' ' 146' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' VAL . . . . . 1.586 ' CB ' ' CG1' ' A' ' 1' ' ' VAL . 58.8 t . . . . . 3 CA--C 1.87 13.271 1 N-CA-C 99.971 -4.085 . . . . 12.9 99.971 . . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . 1.637 ' CA ' ' CB ' ' A' ' 2' ' ' LEU 1.361 3.9 mm? -29.66 84.91 0.0 OUTLIER 'General case' 3 CA--C 2.046 20.032 3 O-C-N 89.0 -21.063 . . . . 12.46 116.345 55.779 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . 1.582 ' CA ' ' CB ' ' A' ' 3' ' ' SER 0.755 4.9 t -110.88 151.44 27.87 Favored 'General case' 4 C--O 1.675 23.458 4 O-C-N 148.308 16.005 . . . . 14.55 117.708 -171.183 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ALA . . . . . 1.275 ' N ' ' CA ' ' A' ' 4' ' ' ALA 0.393 . . -55.48 -17.68 5.67 Favored 'General case' 3 N--CA 1.97 25.544 5 C-N-CA 100.806 -8.357 . . . . 13.6 123.824 -165.501 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' A' ' 8' ' ' SER 0.375 . . -91.3 -31.93 15.91 Favored 'General case' 3 C--O 0.975 -13.358 1 C-N-CA 97.224 -9.791 . . . . 12.07 104.103 -179.001 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.829 HD22 ' HB3' ' A' ' 3' ' ' SER 0.632 66.1 m-20 -14.84 -79.41 0.0 OUTLIER 'General case' 1 C--N 1.463 5.519 2 C-N-CA 141.551 7.94 . . . . 11.81 95.093 166.222 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 1.567 ' CD ' ' CE ' ' A' ' 7' ' ' LYS 0.274 10.7 mmtt -45.06 -57.02 4.14 Favored 'General case' 3 CA--C 1.901 14.449 4 O-C-N 136.637 8.71 . . . . 16.17 97.087 -174.839 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' SER . . . . . 1.341 ' O ' ' C ' ' A' ' 8' ' ' SER 0.615 10.4 m -89.81 40.23 0.99 Allowed 'General case' 4 C--O 1.639 21.602 3 CA-C-O 79.972 -19.109 . . . . 14.73 90.661 -170.299 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . 1.433 ' CA ' ' N ' ' A' ' 9' ' ' ASN 0.576 2.0 m-80 -69.49 -45.38 69.11 Favored 'General case' 3 N--CA 1.816 17.841 4 CA-C-N 170.569 24.258 . . . . 14.81 102.619 80.074 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . 1.52 ' CA ' ' C ' ' A' ' 10' ' ' VAL 0.575 44.5 t -44.69 -65.27 0.17 Allowed 'Isoleucine or valine' 3 C--O 1.424 10.249 3 O-C-N 130.635 4.96 . . . . 16.01 99.416 -175.574 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . 1.524 ' CE ' ' NZ ' ' A' ' 11' ' ' LYS 0.732 0.0 OUTLIER -78.87 -40.07 33.46 Favored 'General case' 4 C--O 0.727 -26.402 0 CA-C-N 123.185 2.721 . . . . 16.53 117.028 -167.076 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . 1.587 ' CA ' ' CB ' ' A' ' 12' ' ' ALA 0.302 . . -44.04 -40.23 4.68 Favored 'General case' 4 C--O 0.799 -22.636 5 CA-C-O 146.075 12.369 . . . . 15.29 130.984 163.67 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . 1.064 ' HB3' ' O ' ' A' ' 10' ' ' VAL . . . -45.75 -87.87 0.0 OUTLIER 'General case' 3 C--O 0.957 -14.326 2 CA-C-N 90.608 -12.087 . . . . 15.67 100.316 177.145 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TRP . . . . . 1.647 ' CH2' ' CZ2' ' A' ' 14' ' ' TRP 1.04 1.0 OUTLIER -14.69 -66.4 0.01 OUTLIER 'General case' 3 CA--C 1.282 -9.362 2 C-N-CA 155.976 13.71 . . . . 14.58 102.322 161.307 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -34.15 8.72 0.0 OUTLIER Glycine 2 C--N 1.115 -11.75 4 C-N-CA 163.856 19.789 . . . . 13.56 109.047 154.82 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . 1.593 ' CE ' ' CD ' ' A' ' 16' ' ' LYS 0.424 0.0 OUTLIER -159.44 -28.99 0.07 Allowed 'General case' 1 C--N 1.522 8.096 4 CA-C-N 161.319 22.559 . . . . 13.25 110.054 -149.475 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . 1.456 ' CG2' ' CB ' ' A' ' 17' ' ' VAL 0.671 0.1 OUTLIER -60.69 -98.02 0.0 OUTLIER 'Isoleucine or valine' 3 C--N 1.764 18.598 5 O-C-N 97.921 -15.487 . . . . 13.58 99.063 169.504 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . 1.233 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . 88.56 -127.8 8.79 Favored Glycine 3 C--O 0.818 -25.875 3 O-C-N 104.885 -11.135 . . . . 13.02 103.097 -178.597 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . 1.49 ' C ' ' CA ' ' A' ' 19' ' ' GLY . . . -102.36 9.7 56.1 Favored Glycine 3 CA--C 1.785 16.938 3 C-N-CA 146.486 11.517 . . . . 12.13 110.342 -160.095 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . 1.428 ' CB ' ' CG ' ' A' ' 20' ' ' ASN 0.716 1.1 m120 -93.47 -33.72 13.69 Favored 'General case' 2 C--O 1.079 -7.902 2 C-N-CA 147.46 10.304 . . . . 10.53 105.838 175.149 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.528 ' HB3' ' CD ' ' A' ' 22' ' ' PRO . . . -58.01 -48.32 97.31 Favored Pre-proline 2 C--O 1.341 5.92 2 O-C-N 140.099 10.875 . . . . 10.91 90.409 -170.35 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . 1.603 ' CB ' ' CG ' ' A' ' 22' ' ' PRO 0.331 0.1 OUTLIER -45.71 -34.4 11.6 Favored 'Trans proline' 3 C--N 1.03 -16.236 3 N-CA-C 125.985 5.34 . . . . 11.21 125.985 -178.399 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.81 ' HB3' ' O ' ' A' ' 20' ' ' ASN 0.469 . . -89.89 -53.63 4.41 Favored 'General case' 3 N--CA 1.236 -11.134 3 C-N-CA 165.285 17.434 . . . . 12.41 100.835 -158.77 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . 0.922 0.0 OUTLIER -94.29 -72.09 0.63 Allowed 'General case' 2 CA--C 1.281 -9.391 4 CA-C-O 99.233 -9.936 . . . . 15.76 91.067 -162.766 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . 1.416 ' C ' ' CA ' ' A' ' 25' ' ' GLY . . . -21.64 -77.56 0.01 OUTLIER Glycine 3 CA--C 1.873 22.428 4 CA-C-N 155.243 17.292 . . . . 15.15 113.513 -177.116 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . 1.314 ' CB ' ' CA ' ' A' ' 26' ' ' ALA 0.611 . . -59.59 -6.41 1.12 Allowed 'General case' 1 C--O 1.591 19.038 4 CA-C-N 93.81 -11.195 . . . . 15.19 124.474 168.58 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.62 ' O ' ' HB3' ' A' ' 30' ' ' GLN 0.876 0.0 OUTLIER -90.4 -36.83 14.37 Favored 'General case' 3 CA--C 1.69 6.341 2 CA-C-O 103.83 -7.748 . . . . 14.75 91.853 176.272 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . 0.787 . . -31.22 -47.92 0.12 Allowed 'General case' 4 N--CA 1.118 -17.055 2 C-N-CA 140.881 7.673 . . . . 12.33 112.698 176.126 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . 1.48 ' CD2' ' CG ' ' A' ' 29' ' ' LEU 1.352 0.0 OUTLIER -173.79 -81.5 0.01 OUTLIER 'General case' 3 CA--C 0.79 -28.26 5 C-N-CA 161.817 16.047 . . . . 11.73 84.621 -105.099 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . 1.075 ' NE2' ' CD ' ' A' ' 30' ' ' GLN 0.471 0.0 OUTLIER -18.9 -45.28 0.0 OUTLIER 'General case' 1 C--N 1.455 5.168 4 O-C-N 69.994 -32.941 . . . . 12.26 102.831 -157.347 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 1.578 ' CD ' ' CG ' ' A' ' 31' ' ' ARG 1.082 2.1 mmt180 156.56 -65.27 0.0 OUTLIER 'General case' 2 C--O 1.64 21.608 2 C-N-CA 167.356 18.263 . . . . 16.13 112.126 -45.28 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . 1.441 ' CE ' ' SD ' ' A' ' 32' ' ' MET 0.753 0.0 OUTLIER -86.88 -10.56 53.08 Favored 'General case' 2 C--N 1.811 20.646 3 O-C-N 111.22 -7.175 . . . . 16.42 102.925 -169.58 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . 1.411 ' N ' ' C ' ' A' ' 32' ' ' MET 1.507 0.0 OUTLIER -49.88 -39.71 40.34 Favored 'General case' 3 C--N 1.689 15.356 2 O-C-N 137.616 9.323 . . . . 16.72 117.837 -177.53 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . 1.421 ' CB ' ' CA ' ' A' ' 34' ' ' LEU 0.744 0.0 OUTLIER -125.52 -11.91 6.75 Favored 'General case' 2 C--O 1.509 14.725 4 CA-C-O 100.478 -9.344 . . . . 16.7 100.105 -159.017 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . 1.546 ' CA ' ' CB ' ' A' ' 35' ' ' SER 0.871 52.6 p -123.83 -12.48 7.56 Favored 'General case' 2 C--O 1.051 -9.377 2 C-N-CA 86.425 -14.11 . . . . 16.06 111.532 172.811 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . 1.642 ' CB ' ' CG ' ' A' ' 36' ' ' PHE . 40.7 m-85 -125.12 42.45 0.75 Allowed Pre-proline 3 C--O 1.463 12.306 3 CA-C-O 135.38 7.276 . . . . 14.77 113.281 173.261 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . 1.338 ' N ' ' CD ' ' A' ' 37' ' ' PRO . 0.0 OUTLIER -24.99 -40.29 0.03 OUTLIER 'Trans proline' 2 C--N 1.591 13.338 3 C-N-CA 132.279 8.652 . . . . 13.96 111.347 -173.83 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . 0.668 0.6 OUTLIER -54.67 -28.6 48.54 Favored 'General case' 3 C--O 0.871 -18.859 1 CA-C-O 98.206 -10.426 . . . . 13.1 111.609 -175.737 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . 1.174 HG22 ' O ' ' A' ' 36' ' ' PHE 0.756 0.0 OUTLIER -57.2 -42.71 81.81 Favored 'General case' 3 CA--C 1.284 -9.279 1 O-C-N 141.247 11.592 . . . . 12.56 105.252 177.638 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . 1.281 ' CB ' ' CG ' ' A' ' 40' ' ' LYS 0.622 0.0 OUTLIER -54.73 12.08 0.0 OUTLIER 'General case' 2 C--N 1.173 -7.101 4 O-C-N 98.528 -15.107 . . . . 12.76 107.07 -170.969 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . 1.592 ' CA ' ' CB ' ' A' ' 41' ' ' THR 0.557 0.0 OUTLIER -112.75 -16.41 12.77 Favored 'General case' 3 N--CA 1.008 -22.54 4 O-C-N 83.897 -24.252 . . . . 13.34 114.299 -173.645 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TYR . . . . . 1.376 ' C ' ' N ' ' A' ' 43' ' ' PHE 0.387 39.6 m-85 -36.41 -37.2 0.12 Allowed 'General case' 1 C--O 0.771 -24.083 3 O-C-N 97.373 -15.83 . . . . 13.06 104.809 133.146 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . 1.567 ' CA ' ' CB ' ' A' ' 43' ' ' PHE 0.396 0.0 OUTLIER -124.19 62.66 30.29 Favored Pre-proline 2 C--N 1.732 17.198 3 C-N-CA 98.137 -9.425 . . . . 13.09 130.876 -176.885 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . 1.447 ' CB ' ' CA ' ' A' ' 44' ' ' PRO 0.823 50.6 Cg_endo -31.62 -53.93 0.29 Allowed 'Trans proline' 4 C--N 1.779 23.198 4 CA-C-N 85.148 -11.411 . . . . 11.91 128.289 -174.847 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HIS . . . . . 1.533 ' CA ' ' CB ' ' A' ' 45' ' ' HIS 0.546 0.0 OUTLIER -58.27 -21.66 49.58 Favored 'General case' 4 C--O 1.491 13.764 3 C-N-CA 162.98 16.512 . . . . 11.55 124.914 -179.231 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.856 ' HB2' HD23 ' A' ' 48' ' ' LEU 0.744 5.8 m-30 -157.48 93.27 1.28 Allowed 'General case' 4 CA--C 1.221 -11.684 2 O-C-N 137.922 9.514 . . . . 12.81 104.406 -123.018 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.906 ' OD2' ' HA ' ' A' ' 49' ' ' SER 0.76 19.1 t70 -24.35 81.66 0.0 OUTLIER 'General case' 4 C--O 1.508 14.678 4 C-N-CA 161.652 15.981 . . . . 13.03 89.054 141.7 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.499 ' CB ' ' CA ' ' A' ' 48' ' ' LEU 0.412 27.5 mt -93.47 39.47 1.06 Allowed 'General case' 3 C--O 1.425 10.337 3 O-C-N 103.72 -11.863 . . . . 11.79 85.463 -162.902 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . 1.218 ' CB ' ' HB3' ' A' ' 52' ' ' SER 0.734 46.5 t 29.79 -92.42 0.01 OUTLIER 'General case' 3 CA--C 1.116 -15.717 4 CA-C-O 138.191 8.615 . . . . 11.82 101.46 -172.339 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HIS . . . . . 1.557 ' CG ' ' CB ' ' A' ' 50' ' ' HIS 0.77 0.9 OUTLIER 70.09 -101.7 0.04 OUTLIER 'General case' 2 CA--C 1.36 -6.364 3 C-N-CA 165.521 17.528 . . . . 14.08 118.255 -55.347 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -101.05 98.04 1.76 Allowed Glycine 2 C--O 1.519 17.936 3 N-CA-C 97.094 -6.403 . . . . 12.23 97.094 169.517 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . 1.266 ' CB ' ' OG ' ' A' ' 52' ' ' SER 1.036 0.9 OUTLIER -116.53 115.66 26.17 Favored 'General case' 1 C--N 1.214 -5.325 4 CA-C-O 89.372 -14.632 . . . . 11.54 131.167 176.193 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . 1.318 ' O ' ' C ' ' A' ' 53' ' ' ALA 1.042 . . -44.51 -0.6 0.0 OUTLIER 'General case' 2 C--O 1.679 23.689 4 O-C-N 162.822 25.076 . . . . 13.38 104.746 -173.436 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . 1.356 ' O ' ' C ' ' A' ' 54' ' ' GLN 0.713 55.2 tt0 -69.54 -57.07 5.68 Favored 'General case' 1 C--O 1.646 21.937 3 CA-C-O 135.564 7.364 . . . . 14.11 95.33 -171.735 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . 1.58 ' CB ' ' CA ' ' A' ' 55' ' ' GLN 0.499 0.0 OUTLIER -60.38 -22.86 63.8 Favored 'General case' 2 CA--C 1.725 7.695 2 CA-C-N 105.073 -5.512 . . . . 12.89 122.079 -160.373 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . 1.527 ' CE ' ' NZ ' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -71.3 -59.97 2.48 Favored 'General case' 2 C--O 1.632 21.192 1 C-N-CA 170.629 19.571 . . . . 13.57 114.53 -173.176 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . 1.561 ' CA ' ' CB ' ' A' ' 57' ' ' ALA 0.962 . . -79.54 -67.79 0.73 Allowed 'General case' 1 C--O 0.902 -17.215 3 N-CA-C 87.184 -8.821 . . . . 13.31 87.184 168.922 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HIS . . . . . 1.546 ' CB ' ' CA ' ' A' ' 58' ' ' HIS 0.873 9.3 t60 -37.52 -58.93 0.82 Allowed 'General case' 2 N--CA 1.618 7.941 1 CA-C-N 128.731 5.241 . . . . 14.32 113.711 -178.954 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . 1.399 ' N ' ' C ' ' A' ' 58' ' ' HIS . . . -68.0 -42.42 85.15 Favored Glycine 4 N--CA 1.084 -24.815 2 N-CA-C 88.944 -9.662 . . . . 14.94 88.944 -154.963 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . 1.507 ' C ' ' CA ' ' A' ' 60' ' ' GLN 0.417 0.0 OUTLIER -31.38 -63.72 0.16 Allowed 'General case' 4 C--O 0.863 -19.266 3 C-N-CA 144.189 8.996 . . . . 14.63 104.685 174.066 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . 1.484 ' CB ' ' CA ' ' A' ' 61' ' ' LYS 0.591 0.0 OUTLIER -69.86 -48.51 58.54 Favored 'General case' 3 C--N 1.073 -11.444 4 CA-C-N 91.155 -11.839 . . . . 14.0 131.822 -179.012 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . 1.555 ' CB ' ' CG1' ' A' ' 62' ' ' VAL 0.431 0.3 OUTLIER -60.06 -71.26 0.11 Allowed 'Isoleucine or valine' 3 C--O 1.404 9.23 3 O-C-N 145.366 14.166 . . . . 14.99 93.153 167.783 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . 1.628 ' CB ' ' CA ' ' A' ' 63' ' ' ALA 0.68 . . -55.29 -27.48 47.04 Favored 'General case' 1 CA--C 1.263 -10.091 4 CA-C-N 152.932 16.242 . . . . 14.75 118.152 -179.292 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . 1.461 ' C ' ' CA ' ' A' ' 64' ' ' ASN 0.419 69.1 m-20 -59.61 -39.92 85.84 Favored 'General case' 3 CA--C 1.811 11.019 3 CA-C-N 136.918 8.963 . . . . 14.25 106.347 175.291 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ALA . . . . . 1.582 ' CA ' ' CB ' ' A' ' 65' ' ' ALA 0.445 . . -75.78 -41.75 52.1 Favored 'General case' 4 CA--C 1.139 -14.829 1 O-C-N 107.799 -9.313 . . . . 13.62 106.239 -177.031 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.525 ' HB2' ' HA ' ' A' ' 63' ' ' ALA 0.724 49.9 mt -19.28 -59.49 0.02 OUTLIER 'General case' 3 N--CA 1.315 -7.2 4 O-C-N 98.468 -15.145 . . . . 14.16 112.073 157.753 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . 1.468 ' C ' ' CA ' ' A' ' 67' ' ' THR 0.827 21.5 p -69.06 -21.32 64.1 Favored 'General case' 3 N--CA 1.099 -18.021 2 O-C-N 106.298 -10.251 . . . . 13.87 120.644 -171.856 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.867 ' N ' ' CA ' ' A' ' 67' ' ' THR 0.348 0.0 OUTLIER -87.27 -49.8 7.02 Favored 'General case' 2 C--N 0.95 -16.761 3 CA-C-O 138.547 8.784 . . . . 15.1 117.418 171.335 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . 1.452 ' CA ' ' N ' ' A' ' 69' ' ' ALA 0.34 . . -65.72 -42.86 90.55 Favored 'General case' 4 N--CA 1.759 14.98 3 CA-C-N 100.512 -7.586 . . . . 15.85 97.889 -177.491 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLN . . . . . 1.374 ' CD ' ' NE2' ' A' ' 70' ' ' GLN 0.766 0.0 OUTLIER -67.35 -45.49 76.19 Favored 'General case' 4 C--O 0.987 -12.753 3 O-C-N 112.233 -6.542 . . . . 15.5 96.03 -174.56 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -101.5 41.1 2.21 Favored Glycine 4 N--CA 1.099 -23.769 2 O-C-N 98.976 -14.828 . . . . 15.25 112.358 -162.692 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . 1.22 ' CE1' ' NE2' ' A' ' 72' ' ' HIS 0.664 16.2 p80 174.46 69.7 0.0 OUTLIER 'General case' 2 C--O 1.536 16.184 1 O-C-N 111.256 -7.026 . . . . 14.9 110.72 158.892 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . 1.583 ' CG ' ' CD2' ' A' ' 73' ' ' LEU 0.483 0.5 OUTLIER -75.48 105.09 6.33 Favored 'General case' 3 N--CA 1.599 7.022 2 N-CA-C 77.447 -12.427 . . . . 15.44 77.447 -177.168 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . 1.334 ' CG ' ' CB ' ' A' ' 74' ' ' ASN 0.391 0.0 OUTLIER 159.86 -33.57 0.0 OUTLIER 'General case' 4 C--O 1.868 33.64 5 C-N-CA 147.98 10.512 . . . . 15.7 93.038 152.013 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . 1.09 ' HA ' ' O ' ' A' ' 74' ' ' ASN 0.301 53.0 t0 -136.99 38.75 2.56 Favored 'General case' 4 C--O 1.523 15.485 3 CA-C-N 143.94 12.154 . . . . 15.81 104.057 -159.783 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.986 ' O ' ' C ' ' A' ' 77' ' ' PRO 0.48 0.0 OUTLIER -47.9 -50.8 51.4 Favored Pre-proline 3 C--O 1.548 16.783 2 CA-C-O 137.112 8.101 . . . . 16.47 113.87 174.534 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PRO . . . . . 1.409 ' C ' ' N ' ' A' ' 78' ' ' GLY 0.638 6.3 Cg_endo -54.91 -65.72 0.11 Allowed 'Trans proline' 3 CA--C 2.118 29.72 4 CA-C-O 93.641 -11.066 . . . . 15.41 93.019 -169.575 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . 1.455 ' C ' ' CA ' ' A' ' 78' ' ' GLY . . . -54.18 -17.08 7.19 Favored Glycine 4 N--CA 1.91 30.244 4 O-C-N 161.562 24.289 . . . . 14.27 111.353 -179.162 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . 1.593 ' CA ' ' CB ' ' A' ' 79' ' ' THR 0.426 0.0 OUTLIER -70.34 -51.78 27.52 Favored 'General case' 3 C--N 0.988 -15.134 2 CA-C-N 131.888 7.844 . . . . 14.61 121.73 178.566 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.499 ' CD2' ' CG ' ' A' ' 80' ' ' LEU 0.507 0.2 OUTLIER -82.18 8.62 10.49 Favored 'General case' 2 C--O 1.499 14.185 1 O-C-N 105.804 -10.56 . . . . 14.03 118.602 178.883 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . 1.628 ' CA ' ' CB ' ' A' ' 81' ' ' SER 0.395 41.4 t -79.39 -63.02 1.51 Allowed 'General case' 3 N--CA 1.288 -8.529 5 CA-C-O 80.95 -18.643 . . . . 13.34 88.152 -149.203 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASN . . . . . 1.386 ' N ' ' CA ' ' A' ' 82' ' ' ASN 0.735 0.2 OUTLIER -41.52 -79.21 0.02 OUTLIER 'General case' 4 N--CA 1.863 20.178 2 O-C-N 151.938 18.274 . . . . 13.41 100.654 -176.208 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.794 ' C ' ' CA ' ' A' ' 84' ' ' SER . 1.8 mp -58.13 -6.03 0.55 Allowed 'General case' 3 C--O 1.419 10.026 1 O-C-N 133.349 6.656 . . . . 11.34 108.714 -177.478 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' SER . . . . . 1.348 ' CA ' ' N ' ' A' ' 84' ' ' SER 0.477 0.1 OUTLIER -72.14 -29.92 64.53 Favored 'General case' 4 N--CA 1.857 19.912 4 CA-C-O 135.737 7.446 . . . . 11.6 117.244 175.272 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASN . . . . . 1.522 ' C ' ' CA ' ' A' ' 85' ' ' ASN 0.598 0.7 OUTLIER -104.5 -74.69 0.64 Allowed 'General case' 4 C--O 1.691 24.318 4 CA-C-O 74.237 -21.839 . . . . 12.64 103.659 -170.571 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . 1.536 ' CD2' ' CG ' ' A' ' 86' ' ' LEU . 39.9 tp -14.56 -59.37 0.01 OUTLIER 'General case' 2 C--O 1.061 -8.828 3 CA-C-N 151.317 15.508 . . . . 12.39 113.826 164.295 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . 1.446 ' N ' ' C ' ' A' ' 86' ' ' LEU 0.721 61.5 m80 -67.32 -54.43 20.72 Favored 'General case' 4 C--N 1.68 14.961 3 O-C-N 134.769 7.543 . . . . 11.33 130.042 -168.641 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . 1.523 ' C ' ' CA ' ' A' ' 88' ' ' ALA 0.257 . . -43.57 -81.72 0.01 OUTLIER 'General case' 4 C--N 1.615 12.116 4 CA-C-N 96.632 -9.349 . . . . 12.36 101.458 -168.908 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HIS . . . . . 1.231 ' NE2' ' CE1' ' A' ' 89' ' ' HIS 0.623 24.5 t-80 146.89 -126.57 0.0 OUTLIER 'General case' 3 N--CA 1.254 -10.27 4 O-C-N 106.814 -9.929 . . . . 16.16 91.885 -25.73 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . 1.006 ' HE3' HD21 ' A' ' 85' ' ' ASN 0.283 0.0 OUTLIER -49.85 -53.95 22.49 Favored 'General case' 2 C--O 1.483 13.367 4 O-C-N 96.141 -16.599 . . . . 14.79 106.773 173.982 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . 1.588 ' CG ' ' CD2' ' A' ' 91' ' ' LEU 0.636 2.1 mp -62.06 -57.85 10.06 Favored 'General case' 3 N--CA 1.775 15.811 2 C-N-CA 149.5 11.12 . . . . 14.68 103.63 172.35 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . 0.83 ' HA ' ' O ' ' A' ' 88' ' ' ALA 0.523 1.1 ptt180 42.72 63.06 1.55 Allowed 'General case' 2 C--O 1.44 11.119 3 CA-C-O 135.641 7.401 . . . . 13.33 125.139 -174.898 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . 1.603 ' CB ' ' CG1' ' A' ' 93' ' ' VAL 1.027 0.5 OUTLIER -115.91 91.5 1.81 Allowed 'Isoleucine or valine' 2 C--O 1.01 -11.552 3 C-N-CA 168.622 18.769 . . . . 11.88 102.017 -140.11 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASN . . . . . 1.472 ' CA ' ' N ' ' A' ' 94' ' ' ASN 0.768 21.7 t-20 -60.61 130.23 90.16 Favored Pre-proline 2 C--O 0.738 -25.855 1 CA-C-N 103.635 -6.166 . . . . 12.77 101.654 -175.703 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.71 ' N ' ' O ' ' A' ' 94' ' ' ASN 0.654 10.1 Cg_endo -54.74 -41.94 73.19 Favored 'Trans proline' 3 N--CA 1.16 -18.107 3 O-C-N 140.305 10.108 . . . . 14.14 123.441 176.612 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.848 HG11 ' HG2' ' D' ' 100' ' ' GLN 0.309 28.2 m -52.97 -18.3 1.35 Allowed 'Isoleucine or valine' 2 N--CA 1.199 -13.003 2 CA-C-O 110.107 -4.758 . . . . 16.2 115.414 166.306 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . 1.562 ' N ' ' CA ' ' A' ' 97' ' ' ASN 0.757 34.1 m120 -82.84 -4.25 57.83 Favored 'General case' 1 N--CA 1.687 11.403 2 O-C-N 138.222 9.701 . . . . 15.47 106.145 168.313 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.688 ' CE1' HD12 ' A' ' 136' ' ' LEU 0.432 25.0 m-85 -86.0 -59.24 2.35 Favored 'General case' 3 CA--C 1.311 -8.231 3 CA-C-N 136.68 8.855 . . . . 13.47 102.828 -179.401 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . 1.419 ' CE ' ' NZ ' ' A' ' 99' ' ' LYS 0.308 0.4 OUTLIER -42.55 -11.5 0.01 OUTLIER 'General case' 2 C--O 1.469 12.648 2 C-N-CA 135.84 5.656 . . . . 12.45 107.26 175.313 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.511 ' CB ' ' CG ' ' A' ' 100' ' ' LEU 1.062 0.0 OUTLIER -86.51 -76.65 0.34 Allowed 'General case' 3 N--CA 1.086 -18.644 4 C-N-CA 146.81 10.044 . . . . 11.09 104.155 -178.759 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.551 ' HB2' ' SD ' ' A' ' 32' ' ' MET 0.376 6.4 tp -48.07 -28.13 2.69 Favored 'General case' 2 CA--C 1.733 8.005 3 CA-C-N 104.589 -5.732 . . . . 12.24 117.959 -172.336 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 49.9 m -84.95 -39.19 18.42 Favored 'General case' 2 CA--C 1.187 -12.99 3 C-N-CA 145.931 9.692 . . . . 12.41 107.459 -172.594 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HIS . . . . . 1.483 ' CB ' ' CA ' ' A' ' 103' ' ' HIS 0.409 8.2 t-80 -59.72 -57.96 10.66 Favored 'General case' 3 CA--C 1.68 5.979 3 CA-C-N 155.626 17.466 . . . . 13.56 103.544 158.449 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . 1.568 ' CA ' ' CB ' ' A' ' 104' ' ' SER 0.489 0.2 OUTLIER -57.79 -43.81 85.83 Favored 'General case' 2 C--N 1.132 -8.887 3 CA-C-O 102.685 -8.293 . . . . 12.98 101.197 -177.625 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . 1.554 ' CG ' ' CD1' ' A' ' 105' ' ' LEU 0.34 0.1 OUTLIER -74.6 -29.06 61.16 Favored 'General case' 2 N--CA 1.732 13.626 1 CA-C-O 128.947 4.213 . . . . 12.82 110.392 179.971 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . 1.529 ' CD2' ' CG ' ' A' ' 106' ' ' LEU 0.567 0.0 OUTLIER -71.88 1.69 6.68 Favored 'General case' 4 N--CA 1.83 18.537 2 C-N-CA 106.46 -6.096 . . . . 14.88 101.354 179.34 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . 0.493 HG23 HD22 ' B' ' 111' ' ' LEU 0.757 1.2 t -89.45 -83.75 0.13 Allowed 'Isoleucine or valine' 3 C--O 0.953 -14.544 4 O-C-N 95.68 -16.888 . . . . 14.04 95.932 -170.486 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . 1.538 ' CA ' ' CB ' ' A' ' 108' ' ' THR 0.8 0.7 OUTLIER 61.97 -96.23 0.06 Allowed 'General case' 2 C--O 0.809 -22.113 5 C-N-CA 167.557 18.343 . . . . 13.9 86.628 84.075 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . 1.09 ' C ' ' CA ' ' A' ' 109' ' ' LEU 0.624 0.1 OUTLIER -13.95 -86.88 0.0 OUTLIER 'General case' 4 CA--C 2.192 25.635 3 CA-C-O 132.102 5.715 . . . . 13.12 104.284 172.87 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . 0.96 ' O ' ' HG3' ' A' ' 114' ' ' PRO 1.118 . . -38.34 -96.5 0.0 OUTLIER 'General case' 4 C--O 1.451 11.671 4 C-N-CA 153.889 12.876 . . . . 11.3 82.401 164.826 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' SER . . . . . 0.635 ' HA ' ' O ' ' B' ' 114' ' ' ALA 0.533 0.9 OUTLIER -30.54 -59.65 0.19 Allowed 'General case' 1 C--N 1.222 -4.975 3 CA-C-N 144.636 12.471 . . . . 9.71 108.249 -179.023 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HIS . . . . . 1.222 ' ND1' ' CG ' ' A' ' 112' ' ' HIS 0.304 3.5 m80 -73.92 -31.15 62.95 Favored 'General case' 1 N--CA 1.29 -8.431 4 CA-C-N 150.388 15.085 . . . . 11.97 122.989 176.957 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.528 ' O ' ' HB2' ' A' ' 117' ' ' PHE 0.4 0.2 OUTLIER -123.86 56.29 10.54 Favored Pre-proline 3 CA--C 1.118 -15.651 1 CA-C-O 137.837 8.446 . . . . 9.59 118.221 176.551 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PRO . . . . . 1.53 ' CD ' ' CG ' ' A' ' 114' ' ' PRO 0.265 0.0 OUTLIER -78.16 23.86 0.57 Allowed 'Trans proline' 3 CA--C 1.104 -21.008 1 O-C-N 102.618 -9.727 . . . . 10.2 109.29 -174.838 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . 1.406 ' OG1' ' CB ' ' A' ' 115' ' ' THR 0.743 1.3 p -97.63 -42.93 7.42 Favored 'General case' 2 C--O 0.97 -13.626 3 O-C-N 93.013 -18.554 . . . . 10.62 109.345 176.291 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASN . . . . . 1.526 ' CA ' ' N ' ' A' ' 116' ' ' ASN 0.449 11.0 m120 -88.13 -17.4 31.06 Favored 'General case' 2 N--CA 1.691 11.601 3 C-N-CA 147.294 10.238 . . . . 11.13 103.474 -174.181 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.802 ' HE1' HD12 ' A' ' 109' ' ' LEU 0.301 1.1 t80 -103.02 71.26 1.12 Allowed 'General case' 3 C--O 0.922 -16.173 2 CA-C-O 141.047 9.975 . . . . 13.06 132.565 177.137 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . 1.363 ' CB ' ' CG2' ' A' ' 118' ' ' THR 0.371 0.0 OUTLIER -54.88 149.95 21.07 Favored Pre-proline 3 C--O 1.369 7.377 4 N-CA-C 134.192 8.59 . . . . 13.7 134.192 168.445 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PRO . . . . . 1.547 ' CA ' ' CB ' ' A' ' 119' ' ' PRO 0.338 16.4 Cg_exo -63.38 -43.43 18.03 Favored 'Trans proline' 2 N--CA 1.658 11.187 3 CA-C-O 91.178 -12.092 . . . . 14.36 103.272 -179.474 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ALA . . . . . 1.451 ' N ' ' C ' ' A' ' 119' ' ' PRO 0.358 . . -67.72 -49.92 60.11 Favored 'General case' 3 C--N 1.693 15.52 3 CA-C-O 85.591 -16.433 . . . . 15.35 110.304 166.521 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 121' ' ' VAL 1.112 0.8 OUTLIER -42.7 -38.19 0.84 Allowed 'Isoleucine or valine' 2 N--CA 1.265 -9.714 3 CA-C-N 168.607 23.367 . . . . 15.73 110.557 179.99 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HIS . . . . . 1.501 ' CA ' ' C ' ' A' ' 122' ' ' HIS 1.173 0.1 OUTLIER -64.34 -37.53 87.83 Favored 'General case' 4 C--O 1.489 13.677 1 C-N-CA 134.874 5.269 . . . . 15.49 113.536 -176.151 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.791 ' N ' ' CA ' ' A' ' 122' ' ' HIS 0.379 . . -82.05 -42.0 19.85 Favored 'General case' 2 C--N 1.129 -8.995 2 CA-C-O 134.766 6.984 . . . . 13.62 117.756 -178.761 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . 1.405 ' CB ' ' CG ' ' A' ' 124' ' ' ASN 0.738 0.0 OUTLIER -60.07 -56.37 22.5 Favored 'General case' 2 C--O 1.76 27.968 2 O-C-N 110.129 -7.857 . . . . 14.56 106.929 170.367 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.924 HD21 ' HB1' ' A' ' 13' ' ' ALA 0.431 38.2 mt -44.52 -47.0 10.11 Favored 'General case' 4 C--O 0.935 -15.474 3 CA-C-N 134.664 7.938 . . . . 13.84 131.168 166.24 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASN . . . . . 1.471 ' C ' ' CA ' ' A' ' 126' ' ' ASN 0.674 3.3 t-20 -51.65 -51.03 59.04 Favored 'General case' 2 C--O 1.495 14.011 2 C-N-CA 136.962 6.105 . . . . 13.5 98.529 -173.895 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 1.588 ' CD ' ' CE ' ' A' ' 127' ' ' LYS 0.328 30.9 ttmt -75.46 -79.83 0.09 Allowed 'General case' 3 C--O 1.631 21.151 3 CA-C-O 73.96 -21.972 . . . . 12.23 103.12 179.824 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PHE . . . . . 1.579 ' CE1' ' CD1' ' A' ' 128' ' ' PHE 0.254 25.3 t80 -23.24 -63.64 0.04 OUTLIER 'General case' 4 C--N 0.815 -22.643 3 O-C-N 149.146 16.529 . . . . 14.06 107.19 -176.744 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . 0.374 16.6 mt -54.82 -34.69 63.1 Favored 'General case' 4 C--O 1.033 -10.332 3 CA-C-O 106.933 -6.27 . . . . 13.99 109.046 -170.928 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' A' ' 127' ' ' LYS 0.811 . . -40.63 -60.9 1.03 Allowed 'General case' 3 C--O 0.964 -13.961 3 O-C-N 142.038 12.086 . . . . 14.96 106.532 170.224 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASN . . . . . 1.192 ' CA ' ' N ' ' A' ' 131' ' ' ASN 0.906 2.2 t-20 -71.73 -46.59 58.11 Favored 'General case' 3 N--CA 2.052 29.659 2 CA-C-N 89.016 -12.811 . . . . 16.33 95.02 -179.605 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ASP . . . . . 1.099 ' CG ' ' OD2' ' A' ' 132' ' ' ASP 1.299 5.7 t70 -35.94 -79.57 0.01 OUTLIER 'General case' 4 C--O 1.398 8.885 3 O-C-N 97.936 -15.478 . . . . 14.76 109.438 168.772 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' SER . . . . . 0.647 ' O ' ' HB ' ' A' ' 137' ' ' THR 0.272 0.1 OUTLIER -46.97 -49.65 20.36 Favored 'General case' 3 C--O 1.071 -8.338 3 CA-C-O 138.638 8.828 . . . . 14.84 107.061 -168.688 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . 0.347 29.1 m -73.06 -59.28 2.78 Favored 'General case' 4 CA--C 1.732 7.947 5 O-C-N 89.708 -20.62 . . . . 13.76 90.123 -169.747 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . 1.491 ' C ' ' CA ' ' A' ' 135' ' ' VAL 0.413 0.8 OUTLIER -46.52 -67.19 0.13 Allowed 'Isoleucine or valine' 3 CA--C 1.774 9.593 1 CA-C-N 142.295 11.407 . . . . 13.41 118.668 -179.898 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . 1.562 ' CD1' ' CG ' ' A' ' 136' ' ' LEU 0.577 0.0 OUTLIER -60.33 9.73 0.02 OUTLIER 'General case' 3 C--O 1.436 10.891 5 CA-C-O 147.371 12.986 . . . . 12.66 135.312 170.868 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' THR . . . . . 1.602 ' CA ' ' CB ' ' A' ' 137' ' ' THR 0.72 0.5 OUTLIER -109.73 -20.82 12.67 Favored 'General case' 3 N--CA 1.116 -17.139 3 O-C-N 106.898 -9.876 . . . . 14.43 111.086 179.21 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' SER . . . . . 1.42 ' CB ' ' OG ' ' A' ' 138' ' ' SER 0.5 0.7 OUTLIER -28.45 -60.63 0.12 Allowed 'General case' 4 C--O 1.425 10.313 3 CA-C-O 84.184 -17.103 . . . . 14.32 90.222 -177.931 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LYS . . . . . 1.57 ' CE ' ' CD ' ' A' ' 139' ' ' LYS 1.22 0.0 OUTLIER -25.94 -76.14 0.02 OUTLIER 'General case' 2 C--O 1.589 18.949 3 CA-C-N 139.568 10.167 . . . . 14.88 108.86 -172.506 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' TYR . . . . . 1.636 ' CG ' ' CB ' ' A' ' 140' ' ' TYR 0.708 1.6 m-85 -21.75 -81.19 0.01 OUTLIER 'General case' 3 N--CA 1.312 -7.368 1 CA-C-O 131.607 5.48 . . . . 17.76 119.171 165.841 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ARG . . . . . 1.47 ' NH2' ' CZ ' ' A' ' 141' ' ' ARG 0.543 3.5 ttt180 . . . . . 2 CA--C 1.945 16.172 2 N-CA-C 128.06 6.319 . . . . 21.0 128.06 171.572 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . 1.568 ' HG2' ' CD1' ' B' ' 77' ' ' LEU 1.085 6.0 mmt . . . . . 2 N--CA 2.104 32.248 2 CA-C-O 86.204 -16.141 . . . . 13.09 88.659 . . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LEU . . . . . 1.506 ' CA ' ' CB ' ' B' ' 2' ' ' LEU 0.686 0.0 OUTLIER -169.5 -140.0 0.03 OUTLIER 'General case' 4 C--N 0.982 -15.383 3 CA-C-N 141.299 10.954 . . . . 13.28 101.689 -174.186 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' THR . . . . . 1.56 HG23 ' CB ' ' B' ' 5' ' ' GLU 0.492 0.4 OUTLIER -68.18 164.44 20.46 Favored 'General case' 1 CA--C 1.638 4.327 3 O-C-N 133.347 6.655 . . . . 12.32 100.795 178.727 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ALA . . . . . 1.532 ' CA ' ' N ' ' B' ' 4' ' ' ALA 0.717 . . -85.93 -7.57 58.59 Favored 'General case' 3 C--O 0.817 -21.679 2 O-C-N 108.34 -8.975 . . . . 11.28 103.62 -170.763 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLU . . . . . 1.56 ' CB ' HG23 ' B' ' 3' ' ' THR 0.765 0.4 OUTLIER -78.98 -22.53 45.44 Favored 'General case' 2 N--CA 1.925 23.309 4 O-C-N 153.352 19.158 . . . . 11.49 95.988 -177.623 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLU . . . . . 1.489 ' CB ' ' CA ' ' B' ' 6' ' ' GLU 0.366 1.5 mt-10 -113.38 -81.48 0.59 Allowed 'General case' 4 N--CA 1.786 16.329 3 CA-C-O 88.593 -15.003 . . . . 14.36 100.563 -178.164 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LYS . . . . . 1.291 ' CA ' ' C ' ' B' ' 7' ' ' LYS 0.341 0.0 OUTLIER -23.16 -28.3 0.0 OUTLIER 'General case' 3 CA--C 2.009 18.599 3 CA-C-N 146.518 13.326 . . . . 12.04 127.074 161.72 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ALA . . . . . 1.511 ' CB ' ' CA ' ' B' ' 8' ' ' ALA 0.425 . . -49.46 -67.99 0.22 Allowed 'General case' 4 C--O 1.102 -6.67 3 CA-C-O 99.614 -9.755 . . . . 13.7 108.82 166.538 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ALA . . . . . 0.712 ' C ' ' CA ' ' B' ' 10' ' ' VAL 0.304 . . -39.49 -68.79 0.15 Allowed 'General case' 2 C--N 1.465 5.598 2 C-N-CA 169.949 19.299 . . . . 13.24 106.377 155.422 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' VAL . . . . . 1.603 ' CB ' ' CG1' ' B' ' 10' ' ' VAL . 25.6 m -76.13 -24.44 16.37 Favored 'Isoleucine or valine' 2 N--CA 1.832 18.659 2 O-C-N 130.128 4.642 . . . . 13.36 121.106 172.319 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' THR . . . . . 1.604 ' CA ' ' CB ' ' B' ' 11' ' ' THR 0.369 17.3 m -60.25 -36.04 76.87 Favored 'General case' 3 C--O 0.798 -22.667 0 N-CA-C 121.122 3.749 . . . . 15.72 121.122 164.523 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLY . . . . . 1.106 ' N ' ' O ' ' B' ' 11' ' ' THR . . . -82.83 -58.59 2.34 Favored Glycine 3 C--O 1.499 16.659 3 CA-C-O 148.582 15.546 . . . . 15.04 105.913 -172.189 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' PHE . . . . . 1.502 ' C ' ' CA ' ' B' ' 13' ' ' PHE . 0.5 OUTLIER -68.86 -18.36 64.13 Favored 'General case' 3 CA--C 1.793 10.298 3 O-C-N 103.283 -11.716 . . . . 14.99 100.682 178.171 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' TRP . . . . . 1.02 ' HE1' ' CG ' ' B' ' 68' ' ' ASP 0.593 23.3 t-105 -58.89 -74.62 0.06 Allowed 'General case' 2 C--O 0.936 -15.444 2 CA-C-O 147.051 12.834 . . . . 15.96 106.546 -174.314 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLY . . . . . 1.103 ' O ' ' C ' ' B' ' 15' ' ' GLY . . . -10.95 -64.73 0.01 OUTLIER Glycine 4 C--O 1.887 40.93 3 O-C-N 101.404 -13.31 . . . . 16.03 112.333 161.395 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . 1.594 ' CD ' ' CE ' ' B' ' 16' ' ' LYS 0.315 0.1 OUTLIER -54.81 -8.52 0.26 Allowed 'General case' 3 CA--C 1.22 -11.735 3 CA-C-O 146.915 12.769 . . . . 15.65 119.187 173.131 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' VAL . . . . . 1.512 ' C ' ' CA ' ' B' ' 17' ' ' VAL 0.452 56.0 t -45.21 111.48 0.09 OUTLIER 'Isoleucine or valine' 2 C--O 1.628 20.975 3 O-C-N 73.526 -30.734 . . . . 15.82 113.034 153.561 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASP . . . . . 1.458 ' CB ' ' CG ' ' B' ' 18' ' ' ASP 0.371 1.9 t70 -79.4 46.7 0.76 Allowed 'General case' 2 C--O 1.046 -9.657 1 CA-C-O 107.047 -6.215 . . . . 14.97 117.228 -176.297 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' VAL . . . . . 1.539 ' CB ' ' CA ' ' B' ' 19' ' ' VAL 0.347 0.3 OUTLIER 6.2 -59.5 0.0 OUTLIER 'Isoleucine or valine' 2 CA--C 1.345 -6.915 2 CA-C-O 107.569 -5.967 . . . . 14.46 119.934 175.946 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASP . . . . . 1.269 ' CG ' ' OD1' ' B' ' 20' ' ' ASP 0.426 31.7 p-10 -56.3 53.56 0.0 OUTLIER 'General case' 4 C--N 0.917 -18.208 2 CA-C-N 133.961 7.619 . . . . 16.13 124.163 168.991 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' VAL . . . . . 1.595 ' CB ' ' CA ' ' B' ' 21' ' ' VAL 1.15 21.9 t 132.08 -11.79 0.0 OUTLIER 'Isoleucine or valine' 3 CA--C 1.294 -8.877 4 O-C-N 80.593 -26.317 . . . . 15.25 97.147 -168.034 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . 1.509 ' CB ' ' CG2' ' B' ' 22' ' ' VAL 0.528 0.4 OUTLIER -82.7 -34.63 11.85 Favored 'Isoleucine or valine' 1 CA--C 1.93 15.559 4 N-CA-C 78.561 -12.014 . . . . 14.41 78.561 172.706 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . 1.377 ' CA ' ' N ' ' B' ' 23' ' ' GLY . . . -96.75 -17.99 31.35 Favored Glycine 3 N--CA 1.845 25.926 4 C-N-CA 92.695 -14.098 . . . . 14.9 101.135 -175.713 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . 1.518 ' CA ' ' N ' ' B' ' 24' ' ' ALA 1.284 . . -54.14 -40.57 67.54 Favored 'General case' 3 N--CA 1.683 11.205 2 CA-C-O 135.467 7.318 . . . . 14.18 117.046 175.335 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLN . . . . . 1.513 ' N ' ' CA ' ' B' ' 25' ' ' GLN 0.757 0.0 OUTLIER -76.06 -65.18 0.95 Allowed 'General case' 3 N--CA 1.685 11.276 3 CA-C-N 96.266 -9.515 . . . . 14.55 98.846 -179.201 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . 1.535 ' C ' ' CA ' ' B' ' 26' ' ' ALA 0.372 . . -59.51 -42.97 93.45 Favored 'General case' 4 C--N 0.994 -14.879 3 CA-C-O 101.657 -8.782 . . . . 13.58 100.705 -164.472 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.753 ' N ' ' CA ' ' B' ' 26' ' ' ALA 0.521 0.0 OUTLIER -73.72 -47.11 41.76 Favored 'General case' 4 C--O 1.489 13.691 1 O-C-N 148.076 15.86 . . . . 13.27 106.759 171.08 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLY . . . . . 0.559 ' HA3' ' O ' ' B' ' 24' ' ' ALA . . . -40.07 -85.31 0.01 OUTLIER Glycine 2 C--N 1.146 -10.022 2 CA-C-O 93.293 -15.17 . . . . 13.98 111.256 175.242 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.541 ' NH1' ' HD3' ' A' ' 119' ' ' PRO 0.407 1.3 mpp_? -53.04 -32.03 44.55 Favored 'General case' 3 C--O 0.936 -15.42 3 O-C-N 148.522 14.895 . . . . 16.89 126.209 163.983 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' LEU . . . . . 1.021 HD23 ' HA ' ' B' ' 105' ' ' LEU 0.394 0.7 OUTLIER -41.04 -47.15 3.05 Favored 'General case' 4 N--CA 1.347 -5.609 4 CA-C-O 145.607 12.146 . . . . 16.45 109.973 171.438 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . 1.583 ' CG ' ' CD1' ' B' ' 31' ' ' LEU 0.923 0.2 OUTLIER -44.0 -75.76 0.03 OUTLIER 'General case' 2 C--N 1.585 10.835 2 CA-C-N 98.075 -8.693 . . . . 17.22 108.934 167.711 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' VAL . . . . . 1.355 ' N ' ' CA ' ' B' ' 32' ' ' VAL 0.678 2.3 p -103.94 95.74 4.07 Favored 'Isoleucine or valine' 4 N--CA 1.895 21.777 4 C-N-CA 86.541 -14.063 . . . . 15.6 96.213 -173.005 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.9 HG12 ' CE1' ' B' ' 34' ' ' TYR 0.657 25.0 t 165.29 -56.04 0.0 OUTLIER 'Isoleucine or valine' 4 C--O 1.014 -11.298 5 O-C-N 84.984 -23.573 . . . . 14.66 90.529 -167.403 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' TYR . . . . . 1.696 ' CE2' ' CZ ' ' B' ' 34' ' ' TYR 1.026 0.1 OUTLIER -105.68 55.79 0.14 Allowed Pre-proline 3 N--CA 1.772 15.657 5 CA-C-N 143.988 12.176 . . . . 15.77 96.719 -175.61 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' PRO . . . . . 0.775 ' CD ' ' N ' ' B' ' 34' ' ' TYR 0.356 52.5 Cg_exo -42.94 -21.0 0.18 Allowed 'Trans proline' 3 C--N 1.118 -11.587 4 C-N-CA 146.968 18.445 . . . . 14.45 120.762 -172.282 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' TRP . . . . . 1.609 ' CD2' ' CG ' ' B' ' 36' ' ' TRP . 31.0 p90 -78.46 -36.55 45.18 Favored 'General case' 2 C--O 0.978 -13.214 2 O-C-N 102.56 -12.588 . . . . 14.07 112.722 -178.85 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' THR . . . . . 1.549 ' N ' ' CA ' ' B' ' 37' ' ' THR 0.279 0.8 OUTLIER -55.7 -21.85 20.49 Favored 'General case' 3 N--CA 1.687 11.388 3 CA-C-O 152.693 15.521 . . . . 14.24 112.901 175.833 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLN . . . . . 1.288 ' C ' ' CA ' ' B' ' 38' ' ' GLN 0.362 0.0 OUTLIER -74.36 13.66 0.55 Allowed 'General case' 3 C--O 0.823 -21.382 3 O-C-N 88.291 -21.506 . . . . 16.95 96.559 -162.405 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ARG . . . . . 1.351 ' CB ' ' CG ' ' B' ' 39' ' ' ARG 0.283 0.0 OUTLIER -105.48 -41.07 5.59 Favored 'General case' 4 C--O 0.958 -14.282 2 CA-C-O 141.748 10.308 . . . . 13.66 119.611 -169.695 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' PHE . . . . . 1.502 ' C ' ' CA ' ' B' ' 40' ' ' PHE 0.53 71.3 m-85 -77.88 -20.95 52.05 Favored 'General case' 3 C--O 1.524 15.547 2 CA-C-N 95.096 -10.047 . . . . 12.37 94.424 178.125 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' PHE . . . . . 1.619 ' CZ ' ' CE1' ' B' ' 41' ' ' PHE . 0.0 OUTLIER -137.18 89.54 2.44 Favored 'General case' 4 C--O 0.743 -25.555 2 C-N-CA 101.914 -7.914 . . . . 11.94 124.973 178.59 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLN . . . . . 1.451 ' CD ' ' NE2' ' B' ' 42' ' ' GLN 0.515 0.0 OUTLIER -95.13 -1.96 50.9 Favored 'General case' 3 C--N 1.854 22.542 3 CA-C-N 89.993 -12.367 . . . . 12.31 104.295 175.407 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' HIS . . . . . 1.519 ' C ' ' CA ' ' B' ' 43' ' ' HIS 0.466 61.4 t60 96.42 -50.02 0.01 OUTLIER 'General case' 4 C--N 1.934 26.001 4 O-C-N 90.405 -20.184 . . . . 14.92 84.122 16.649 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PHE . . . . . 1.227 ' CE1' ' CD2' ' B' ' 41' ' ' PHE 0.286 10.5 m-85 -139.47 -84.5 0.25 Allowed 'General case' 2 C--N 1.479 6.226 2 O-C-N 135.762 8.164 . . . . 12.88 103.861 175.66 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLY . . . . . 1.554 ' N ' ' CA ' ' B' ' 45' ' ' GLY . . . 177.72 -102.74 0.17 Allowed Glycine 4 C--O 1.692 28.751 2 C-N-CA 98.688 -11.244 . . . . 13.97 87.71 177.4 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASN . . . . . 1.426 ' CA ' ' CB ' ' B' ' 46' ' ' ASN 0.449 1.4 m120 -51.75 65.98 0.0 OUTLIER 'General case' 2 C--N 0.923 -17.95 1 N-CA-C 128.134 6.346 . . . . 14.83 128.134 -178.765 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LEU . . . . . 1.102 HD12 HG23 ' B' ' 53' ' ' VAL 0.87 0.2 OUTLIER -110.78 29.37 7.81 Favored 'General case' 3 C--O 1.392 8.564 1 CA-C-O 129.302 4.382 . . . . 16.85 105.408 173.204 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' SER . . . . . . . . . . . . 0.606 8.5 t -108.27 26.95 9.83 Favored 'General case' 3 C--O 1.378 7.834 2 C-N-CA 104.501 -6.88 . . . . 16.47 95.022 -174.459 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' SER . . . . . 1.507 ' C ' ' CA ' ' B' ' 49' ' ' SER 0.439 19.5 t -146.0 157.06 43.87 Favored 'General case' 2 C--O 1.749 27.38 2 CA-C-O 94.309 -12.281 . . . . 16.63 107.907 176.673 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.466 ' CB ' HG11 ' B' ' 32' ' ' VAL 0.607 . . -88.03 -45.85 9.84 Favored 'General case' 0 C--N 1.3 -1.55 4 CA-C-N 146.05 13.114 . . . . 16.53 91.639 -169.535 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' GLY . . . . . 0.44 ' C ' ' O ' ' B' ' 50' ' ' ALA . . . -47.9 -66.8 1.82 Allowed Glycine 4 C--O 1.405 10.807 5 CA-C-O 158.901 21.279 . . . . 16.45 93.303 -156.971 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ALA . . . . . 1.476 ' CA ' ' N ' ' B' ' 52' ' ' ALA 0.571 . . -34.4 -79.38 0.01 OUTLIER 'General case' 4 N--CA 1.754 14.727 4 CA-C-N 87.938 -14.131 . . . . 15.98 98.352 -170.666 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' VAL . . . . . 1.211 ' C ' ' CA ' ' B' ' 54' ' ' MET . 10.8 p -48.0 -33.9 4.15 Favored 'Isoleucine or valine' 3 C--O 1.428 10.474 4 CA-C-N 93.66 -10.7 . . . . 16.0 101.725 -160.557 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' MET . . . . . 1.482 ' CA ' ' N ' ' B' ' 54' ' ' MET 0.508 0.0 OUTLIER -70.02 -44.39 69.37 Favored 'General case' 3 N--CA 1.715 12.812 3 C-N-CA 94.192 -11.003 . . . . 13.7 130.909 -168.294 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ASN . . . . . 1.337 ' O ' ' NZ ' ' B' ' 60' ' ' LYS 0.602 0.4 OUTLIER -72.73 -43.79 62.52 Favored 'General case' 4 CA--C 2.073 21.081 2 C-N-CA 162.966 16.506 . . . . 13.79 123.136 -175.603 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASN . . . . . 1.329 ' N ' ' C ' ' B' ' 55' ' ' ASN 0.666 0.1 OUTLIER -29.05 49.1 0.0 OUTLIER Pre-proline 2 C--O 0.781 -23.571 3 CA-C-N 81.534 -16.212 . . . . 14.77 104.99 164.769 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' PRO . . . . . 1.5 ' N ' ' CD ' ' B' ' 57' ' ' PRO . 9.6 Cg_endo 12.05 -46.41 0.0 OUTLIER 'Trans proline' 4 C--N 1.625 15.123 4 C-N-CA 142.799 15.666 . . . . 14.77 100.386 173.098 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' LYS . . . . . 1.519 ' CB ' ' CG ' ' B' ' 58' ' ' LYS 0.47 0.0 OUTLIER -70.29 -51.22 31.97 Favored 'General case' 3 N--CA 1.151 -15.42 2 O-C-N 141.028 11.455 . . . . 13.49 121.416 -174.978 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' VAL . . . . . 1.522 ' CB ' ' CG1' ' B' ' 59' ' ' VAL 0.735 0.5 OUTLIER -71.52 -38.66 68.75 Favored 'Isoleucine or valine' 3 C--O 1.703 24.933 5 CA-C-O 88.752 -14.928 . . . . 15.92 92.659 -177.899 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LYS . . . . . 1.391 ' NZ ' ' CE ' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -34.53 -78.91 0.02 OUTLIER 'General case' 1 CA--C 1.693 6.444 3 O-C-N 141.836 11.96 . . . . 18.25 120.839 166.074 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ALA . . . . . 0.45 ' C ' ' CA ' ' B' ' 62' ' ' HIS 0.25 . . -32.51 -42.37 0.07 Allowed 'General case' 3 CA--C 1.256 -10.349 2 C-N-CA 139.62 7.168 . . . . 18.18 113.779 171.843 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' HIS . . . . . 1.487 ' ND1' ' CG ' ' B' ' 62' ' ' HIS . 6.1 t60 -54.81 -67.1 0.3 Allowed 'General case' 3 N--CA 1.738 13.97 2 CA-C-N 106.081 -5.054 . . . . 18.05 99.918 -179.687 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . 1.045 ' HA2' HG13 ' B' ' 66' ' ' VAL . . . -68.15 -19.38 72.04 Favored Glycine 2 C--O 0.903 -20.54 5 C-N-CA 140.674 8.749 . . . . 16.74 125.425 -162.691 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LYS . . . . . 1.618 ' CG ' ' CD ' ' B' ' 64' ' ' LYS 0.512 0.0 OUTLIER -76.6 -78.56 0.12 Allowed 'General case' 3 CA--C 1.242 -10.898 4 C-N-CA 164.859 17.264 . . . . 16.8 86.834 -151.68 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ARG . . . . . 1.519 ' CA ' ' N ' ' B' ' 65' ' ' ARG 0.434 0.0 OUTLIER -73.92 -38.27 64.36 Favored 'General case' 3 C--O 1.532 15.955 3 CA-C-O 87.929 -15.32 . . . . 13.34 102.097 163.71 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . 1.531 ' CB ' ' CG1' ' B' ' 66' ' ' VAL 0.642 0.1 OUTLIER -64.01 30.07 0.0 OUTLIER 'Isoleucine or valine' 2 C--O 1.465 12.423 3 CA-C-N 157.52 18.327 . . . . 11.9 105.151 178.584 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.931 HD21 HG12 ' B' ' 22' ' ' VAL 0.556 5.4 tp -174.7 -142.08 0.02 OUTLIER 'General case' 2 C--N 1.033 -13.183 4 CA-C-O 68.17 -24.729 . . . . 11.13 110.665 -154.764 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ASP . . . . . 1.578 ' CA ' ' CG2' ' B' ' 71' ' ' THR 0.764 0.5 OUTLIER -37.64 71.95 0.0 OUTLIER 'General case' 2 C--N 1.187 -6.493 3 CA-C-O 92.883 -12.961 . . . . 11.42 115.785 -153.353 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ALA . . . . . 1.423 ' CB ' ' N ' ' B' ' 69' ' ' ALA 0.65 . . 109.32 -38.44 0.01 OUTLIER 'General case' 3 N--CA 1.177 -14.076 4 C-N-CA 169.282 19.033 . . . . 12.4 128.263 -74.364 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' PHE . . . . . 1.642 ' CZ ' ' CE2' ' B' ' 70' ' ' PHE 0.543 0.0 OUTLIER -85.92 -69.29 0.67 Allowed 'General case' 2 N--CA 1.67 10.549 3 CA-C-O 170.3 23.905 . . . . 13.29 110.634 160.068 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' THR . . . . . 1.578 ' CG2' ' CA ' ' B' ' 68' ' ' ASP 0.764 0.4 OUTLIER -78.14 66.44 3.75 Favored 'General case' 3 N--CA 0.847 -30.579 3 O-C-N 77.592 -28.193 . . . . 13.14 107.48 175.94 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLN . . . . . 1.484 ' CA ' ' N ' ' B' ' 72' ' ' GLN 0.557 0.0 OUTLIER 170.82 21.01 0.0 OUTLIER 'General case' 2 N--CA 1.698 11.971 2 C-N-CA 166.943 18.097 . . . . 14.78 100.212 -177.51 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLY . . . . . 0.421 ' C ' ' O ' ' B' ' 74' ' ' LEU . . . -78.97 -78.26 0.85 Allowed Glycine 4 C--N 0.997 -18.268 4 CA-C-O 100.3 -11.278 . . . . 14.25 107.351 -173.398 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LEU . . . . . 1.505 ' CB ' ' CG ' ' B' ' 74' ' ' LEU 0.483 0.0 OUTLIER -55.09 -155.24 0.0 OUTLIER 'General case' 2 C--O 1.399 8.951 4 O-C-N 160.46 21.918 . . . . 15.22 129.632 163.716 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LYS . . . . . 1.491 ' CG ' ' CD ' ' B' ' 75' ' ' LYS 0.935 0.0 OUTLIER 79.43 -125.34 0.02 OUTLIER 'General case' 3 N--CA 2.07 30.53 3 CA-C-N 152.917 16.235 . . . . 15.38 75.565 -166.708 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' HIS . . . . . 1.471 ' CA ' ' N ' ' B' ' 76' ' ' HIS 1.213 19.7 m80 -39.49 -110.17 0.0 OUTLIER 'General case' 3 N--CA 1.735 13.821 4 O-C-N 140.646 11.216 . . . . 16.87 110.812 172.892 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LEU . . . . . 1.594 ' CA ' ' CB ' ' B' ' 77' ' ' LEU 1.051 0.3 OUTLIER 47.06 23.17 0.26 Allowed 'General case' 3 CA--C 1.289 -9.062 5 CA-C-N 167.8 23.0 . . . . 17.2 130.9 -152.436 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASP . . . . . 1.334 ' OD2' ' CG ' ' B' ' 78' ' ' ASP 1.014 32.2 t70 75.69 167.44 0.27 Allowed 'General case' 4 C--O 0.994 -12.388 4 O-C-N 79.985 -26.697 . . . . 17.59 106.446 2.998 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASP . . . . . 1.244 ' O ' ' C ' ' B' ' 79' ' ' ASP 0.909 7.9 t70 -53.27 102.57 0.06 Allowed 'General case' 3 C--O 1.755 27.685 5 CA-C-O 159.312 18.672 . . . . 17.29 83.323 -173.583 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . 1.518 ' CD2' ' CG ' ' B' ' 80' ' ' LEU 0.769 0.5 OUTLIER -127.58 -146.59 0.33 Allowed 'General case' 3 C--O 1.548 16.805 2 O-C-N 83.151 -24.718 . . . . 15.56 101.202 -0.184 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' LYS . . . . . 1.413 ' N ' ' C ' ' B' ' 80' ' ' LEU 1.137 0.8 OUTLIER 23.04 89.39 0.01 OUTLIER 'General case' 3 C--N 1.71 16.281 4 O-C-N 95.058 -17.276 . . . . 13.54 88.261 16.177 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' GLY . . . . . 0.955 ' HA2' HD22 ' B' ' 80' ' ' LEU . . . 173.99 -72.61 0.09 OUTLIER Glycine 4 C--O 1.552 19.999 4 CA-C-N 139.617 10.189 . . . . 10.98 94.028 -162.155 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' ALA . . . . . 1.497 ' CB ' ' CA ' ' B' ' 83' ' ' ALA 0.737 . . -74.54 -89.28 0.03 OUTLIER 'General case' 4 C--N 0.937 -17.359 3 C-N-CA 157.612 14.365 . . . . 8.33 91.469 -147.061 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' PHE . . . . . 1.649 ' CB ' ' CG ' ' B' ' 84' ' ' PHE 0.452 0.3 OUTLIER -44.76 -46.31 10.43 Favored 'General case' 0 CA--C 1.426 -3.796 4 C-N-CA 161.014 15.726 . . . . 10.02 100.561 161.332 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . 0.626 ' HB2' ' O ' ' B' ' 82' ' ' GLY 0.369 . . 16.91 -77.86 0.0 OUTLIER 'General case' 3 C--N 1.508 7.5 3 CA-C-N 133.898 7.59 . . . . 11.82 122.426 170.128 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' GLN . . . . . 1.567 ' CB ' ' CG ' ' B' ' 86' ' ' GLN 0.686 58.7 tt0 152.22 -79.24 0.0 OUTLIER 'General case' 2 N--CA 1.32 -6.942 3 C-N-CA 159.153 14.981 . . . . 12.69 109.541 -7.199 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LEU . . . . . 1.53 ' C ' ' CA ' ' B' ' 87' ' ' LEU 0.31 0.0 OUTLIER -79.57 -17.55 53.7 Favored 'General case' 4 CA--C 1.764 9.184 2 CA-C-O 89.302 -14.666 . . . . 14.2 83.304 172.48 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' SER . . . . . 1.035 ' OG ' ' HB3' ' B' ' 143' ' ' LYS 0.477 0.2 OUTLIER -30.21 -55.99 0.19 Allowed 'General case' 4 CA--C 1.258 -10.255 3 CA-C-N 159.898 19.408 . . . . 15.37 104.388 158.583 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.466 ' N ' ' O ' ' B' ' 87' ' ' LEU . . . -30.94 -79.97 0.01 OUTLIER Glycine 2 C--N 1.47 8.002 2 C-N-CA 144.729 10.68 . . . . 14.83 98.711 -161.929 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . 0.533 52.9 tp -53.02 -56.81 13.26 Favored 'General case' 3 C--O 1.077 -7.981 3 C-N-CA 146.783 10.033 . . . . 14.1 104.23 -170.859 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' HIS . . . . . 0.784 ' HA ' HD23 ' B' ' 95' ' ' LEU 0.395 12.6 m80 -57.98 -52.81 63.98 Favored 'General case' 2 C--O 1.429 10.548 2 O-C-N 131.78 5.675 . . . . 13.25 109.345 179.739 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' CYS . . . . . 1.22 ' SG ' ' CB ' ' B' ' 92' ' ' CYS 0.421 0.0 OUTLIER -81.2 -31.34 33.98 Favored 'General case' 0 CA--C 1.62 3.647 1 CA-C-O 89.196 -14.716 . . . . 13.69 103.228 176.358 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ASN . . . . . 1.464 ' CB ' ' CG ' ' B' ' 93' ' ' ASN 0.664 3.0 m-80 -35.64 -87.57 0.0 OUTLIER 'General case' 3 C--N 1.636 13.058 3 O-C-N 147.273 15.358 . . . . 16.59 134.888 161.792 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LYS . . . . . 1.563 ' CD ' ' CG ' ' B' ' 94' ' ' LYS 0.532 0.0 OUTLIER -132.34 4.85 4.04 Favored 'General case' 3 C--N 1.142 -8.414 3 C-N-CA 93.558 -11.257 . . . . 16.81 100.232 -172.213 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LEU . . . . . 1.462 ' CA ' ' CB ' ' B' ' 95' ' ' LEU 1.706 0.9 OUTLIER -68.87 -89.98 0.01 OUTLIER 'General case' 3 N--CA 1.807 17.386 2 N-CA-C 92.373 -6.899 . . . . 17.55 92.373 178.899 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' HIS . . . . . 1.443 ' NE2' ' CE1' ' B' ' 96' ' ' HIS 0.263 9.2 m-70 91.92 75.8 0.0 OUTLIER 'General case' 2 CA--C 1.188 -12.949 3 C-N-CA 159.848 15.259 . . . . 16.03 117.558 169.046 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' VAL . . . . . 1.581 ' CB ' ' CA ' ' B' ' 97' ' ' VAL . 0.2 OUTLIER -75.24 156.63 6.08 Favored 'Isoleucine or valine' 1 C--O 1.494 13.943 2 O-C-N 90.054 -20.404 . . . . 16.15 105.097 -176.526 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ASN . . . . . 1.421 ' CG ' ' ND2' ' B' ' 98' ' ' ASN 0.981 0.1 OUTLIER -86.47 152.21 54.49 Favored Pre-proline 2 C--N 1.48 6.244 2 C-N-CA 134.758 5.223 . . . . 17.13 103.843 174.51 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' PRO . . . . . 1.342 ' CG ' ' CD ' ' B' ' 99' ' ' PRO 0.69 0.0 OUTLIER -69.96 -6.44 18.71 Favored 'Trans proline' 3 C--O 1.44 10.606 0 CA-C-O 126.95 2.813 . . . . 16.66 115.269 -176.605 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLN . . . . . 0.995 ' H ' ' HB3' ' B' ' 98' ' ' ASN 0.791 24.9 tp60 -81.49 -60.17 2.36 Favored 'General case' 1 C--N 1.615 12.148 5 CA-C-N 102.065 -6.879 . . . . 16.28 97.301 -168.696 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ASN . . . . . 1.448 ' C ' ' CA ' ' B' ' 101' ' ' ASN . 3.3 m120 -65.86 -16.39 63.79 Favored 'General case' 2 CA--C 1.847 12.389 3 CA-C-O 98.966 -10.064 . . . . 16.51 107.706 -175.589 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' PHE . . . . . 1.61 ' CG ' ' CD1' ' B' ' 102' ' ' PHE 0.593 1.3 m-85 -53.99 -40.73 67.21 Favored 'General case' 3 CA--C 1.221 -11.677 2 O-C-N 138.096 9.622 . . . . 17.03 119.963 170.369 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . 1.589 ' CB ' ' CG ' ' B' ' 103' ' ' ARG 0.547 4.6 mmt180 -78.99 -38.46 36.73 Favored 'General case' 2 N--CA 1.085 -18.707 3 O-C-N 87.788 -21.82 . . . . 16.95 108.567 -177.303 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LEU . . . . . 1.502 ' CA ' ' N ' ' B' ' 104' ' ' LEU 0.779 0.3 OUTLIER -56.79 -69.68 0.15 Allowed 'General case' 3 N--CA 1.739 13.985 3 CA-C-O 104.248 -7.549 . . . . 17.15 113.669 164.7 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LEU . . . . . 1.396 ' C ' ' CA ' ' B' ' 105' ' ' LEU 0.729 1.0 OUTLIER -29.48 -63.39 0.12 Allowed 'General case' 4 CA--C 1.867 13.136 4 C-N-CA 147.62 10.368 . . . . 16.86 99.552 164.95 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' GLY . . . . . 1.478 ' C ' ' CA ' ' B' ' 106' ' ' GLY . . . -49.07 -28.1 7.53 Favored Glycine 3 N--CA 0.999 -30.457 2 N-CA-C 133.709 8.244 . . . . 16.91 133.709 169.356 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ASN . . . . . 1.383 ' CG ' ' ND2' ' B' ' 107' ' ' ASN 0.274 90.1 m-20 -74.21 -43.81 55.7 Favored 'General case' 1 CA--C 1.381 -5.554 3 C-N-CA 160.639 15.576 . . . . 16.02 110.267 155.851 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' VAL . . . . . 1.302 ' CB ' ' CG2' ' B' ' 108' ' ' VAL 0.602 20.3 t -65.12 -50.87 72.0 Favored 'Isoleucine or valine' 1 CA--C 1.711 7.163 1 CA-C-N 130.182 5.901 . . . . 16.97 118.481 161.662 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' LEU . . . . . 1.386 ' CG ' ' CB ' ' B' ' 109' ' ' LEU 0.252 0.0 OUTLIER -51.52 -48.23 63.04 Favored 'General case' 1 N--CA 1.604 7.271 1 CA-C-O 106.741 -6.362 . . . . 17.21 108.441 165.289 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ALA . . . . . 1.492 ' CA ' ' CB ' ' B' ' 110' ' ' ALA 0.476 . . -62.33 -25.43 67.88 Favored 'General case' 4 N--CA 1.874 20.739 4 O-C-N 136.343 8.527 . . . . 15.24 122.417 179.839 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' LEU . . . . . 1.412 ' N ' ' C ' ' B' ' 110' ' ' ALA 0.345 0.2 OUTLIER -65.28 -34.25 77.91 Favored 'General case' 3 C--N 1.736 17.39 2 O-C-N 113.604 -5.685 . . . . 15.04 113.45 165.514 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.9 ' CG1' ' OE1' ' B' ' 25' ' ' GLN 1.383 0.1 OUTLIER -52.45 -76.81 0.02 OUTLIER 'Isoleucine or valine' 2 C--O 1.007 -11.699 2 CA-C-O 147.87 13.224 . . . . 14.89 104.818 -174.846 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' VAL . . . . . 1.449 ' CB ' ' CG1' ' B' ' 113' ' ' VAL 0.418 0.0 OUTLIER -67.76 -30.53 48.82 Favored 'Isoleucine or valine' 2 C--O 1.007 -11.708 2 CA-C-N 89.185 -12.734 . . . . 17.21 107.701 -172.68 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ALA . . . . . 0.635 ' O ' ' HA ' ' A' ' 111' ' ' SER 0.922 . . -56.13 -33.14 64.89 Favored 'General case' 3 N--CA 1.145 -15.718 3 CA-C-N 135.172 8.169 . . . . 17.12 114.874 170.722 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ARG . . . . . 1.324 ' CB ' ' CA ' ' B' ' 115' ' ' ARG 0.798 48.3 ttp85 -125.37 -37.41 2.38 Favored 'General case' 2 C--O 1.015 -11.241 4 CA-C-O 85.647 -16.406 . . . . 18.03 99.474 -164.791 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ASN . . . . . 1.558 ' CB ' ' CA ' ' B' ' 116' ' ' ASN 0.658 0.6 OUTLIER -56.8 -58.94 5.93 Favored 'General case' 4 C--N 1.042 -12.763 2 CA-C-N 155.942 17.61 . . . . 16.83 103.066 162.715 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' PHE . . . . . 1.597 ' CG ' ' CD1' ' B' ' 117' ' ' PHE 0.631 98.4 m-85 -66.08 -45.33 81.66 Favored 'General case' 4 C--N 1.125 -9.163 1 C-N-CA 144.994 9.318 . . . . 16.48 116.212 -176.693 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLY . . . . . 1.36 ' CA ' ' C ' ' B' ' 117' ' ' PHE . . . 42.61 -98.48 0.01 OUTLIER Glycine 2 N--CA 0.729 -48.471 3 CA-C-O 87.345 -18.475 . . . . 15.89 131.137 177.682 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLY . . . . . 1.51 ' CA ' ' N ' ' B' ' 119' ' ' GLY . . . -70.5 4.06 10.11 Favored Glycine 4 N--CA 1.675 14.579 4 CA-C-N 134.969 9.385 . . . . 14.74 134.652 176.57 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' GLN . . . . . 0.966 ' OE1' ' O ' ' B' ' 117' ' ' PHE 0.33 0.0 OUTLIER -96.94 -40.77 8.73 Favored 'General case' 2 C--O 1.366 7.231 3 C-N-CA 145.584 9.554 . . . . 14.58 99.164 -179.782 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' PHE . . . . . 0.697 ' CE2' ' HA ' ' B' ' 126' ' ' GLN 0.709 0.3 OUTLIER -79.98 75.81 6.71 Favored 'General case' 1 CA--C 1.394 -5.02 4 O-C-N 106.576 -10.078 . . . . 16.86 86.471 -171.163 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' THR . . . . . 0.79 ' OG1' ' N ' ' B' ' 125' ' ' VAL 0.63 0.6 OUTLIER 112.39 157.04 0.0 OUTLIER Pre-proline 2 C--O 1.492 13.822 4 C-N-CA 176.402 21.881 . . . . 17.28 96.959 3.804 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' PRO . . . . . 1.534 ' CB ' ' CG ' ' B' ' 123' ' ' PRO 0.419 2.7 Cg_endo -74.81 -29.45 8.57 Favored 'Trans proline' 1 C--O 1.106 -6.1 5 C-N-CA 131.959 8.439 . . . . 15.56 98.391 173.204 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' ASN . . . . . 1.45 ' C ' ' N ' ' B' ' 125' ' ' VAL 0.485 1.0 OUTLIER -75.61 -43.14 49.58 Favored 'General case' 3 N--CA 1.308 -7.542 4 O-C-N 84.137 -24.102 . . . . 15.26 111.659 161.685 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' VAL . . . . . 1.505 ' CB ' ' CG1' ' B' ' 125' ' ' VAL 0.87 4.1 t -66.1 -25.96 37.08 Favored 'Isoleucine or valine' 3 N--CA 1.157 -15.106 4 CA-C-N 146.796 13.453 . . . . 15.7 119.917 159.999 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' GLN . . . . . 1.405 ' C ' ' CA ' ' B' ' 126' ' ' GLN 0.567 0.0 OUTLIER -48.83 -70.72 0.08 Allowed 'General case' 3 C--O 0.949 -14.751 3 C-N-CA 151.27 11.828 . . . . 19.08 83.789 -174.437 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ALA . . . . . 0.643 ' HA ' ' HB3' ' A' ' 35' ' ' SER 0.661 . . -23.39 -68.54 0.03 OUTLIER 'General case' 3 C--N 1.222 -4.963 3 C-N-CA 140.447 7.499 . . . . 14.21 115.471 177.379 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' LEU . . . . . 1.588 ' CD2' HG11 ' B' ' 10' ' ' VAL 0.857 0.0 OUTLIER -76.21 -28.52 57.26 Favored 'General case' 2 N--CA 1.205 -12.678 3 CA-C-O 93.388 -12.72 . . . . 13.51 110.309 175.496 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' PHE . . . . . 0.53 ' CE2' HG12 ' B' ' 10' ' ' VAL 0.987 0.6 OUTLIER -74.59 -43.31 56.18 Favored 'General case' 2 C--N 0.941 -17.187 4 CA-C-O 136.631 7.872 . . . . 13.27 104.669 -174.231 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' GLN . . . . . 1.538 ' CB ' ' CG ' ' B' ' 130' ' ' GLN 0.691 0.1 OUTLIER -43.72 -49.05 8.0 Favored 'General case' 1 C--N 1.471 5.867 1 O-C-N 111.613 -6.929 . . . . 11.07 115.17 162.953 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' LYS . . . . . 1.523 ' CG ' ' CD ' ' B' ' 131' ' ' LYS 0.479 6.3 mtmt -57.34 -58.55 7.75 Favored 'General case' 3 C--N 1.133 -8.829 2 O-C-N 132.048 5.843 . . . . 11.32 117.232 -179.585 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' VAL . . . . . . . . . . . . 0.753 0.9 OUTLIER -38.7 -64.23 0.1 OUTLIER 'Isoleucine or valine' 3 C--O 1.497 14.13 2 CA-C-N 102.988 -6.46 . . . . 10.84 103.051 173.005 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' VAL . . . . . 1.441 ' CB ' ' CG2' ' B' ' 133' ' ' VAL 0.645 2.6 p -74.4 -44.24 48.44 Favored 'Isoleucine or valine' 4 C--O 0.799 -22.643 4 CA-C-O 97.961 -10.543 . . . . 12.19 100.378 -173.126 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' ALA . . . . . 1.264 ' N ' ' O ' ' B' ' 133' ' ' VAL 0.416 . . -36.21 -54.08 0.81 Allowed 'General case' 3 C--N 1.032 -13.22 3 O-C-N 132.7 6.25 . . . . 11.33 103.203 173.05 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' GLY . . . . . . . . . . . . . . . -60.99 -59.96 9.22 Favored Glycine 4 C--N 1.541 11.931 2 O-C-N 113.184 -5.947 . . . . 10.91 119.003 179.37 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' VAL . . . . . 1.44 ' CA ' ' C ' ' B' ' 136' ' ' VAL 0.343 2.6 t -76.93 -64.67 0.84 Allowed 'Isoleucine or valine' 2 CA--C 1.814 11.129 2 CA-C-O 92.812 -12.994 . . . . 10.82 94.282 -176.464 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' ALA . . . . . 1.499 ' N ' ' CA ' ' B' ' 137' ' ' ALA . . . -20.85 -41.37 0.0 OUTLIER 'General case' 4 C--O 1.549 16.836 3 CA-C-N 146.112 13.142 . . . . 12.58 118.157 153.347 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ASN . . . . . 1.456 ' CG ' ' ND2' ' B' ' 138' ' ' ASN 0.278 1.0 OUTLIER -81.73 -57.35 3.48 Favored 'General case' 3 C--O 1.583 18.63 1 N-CA-C 127.112 5.967 . . . . 14.85 127.112 162.612 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ALA . . . . . 1.336 ' O ' ' C ' ' B' ' 139' ' ' ALA 0.602 . . -51.23 -25.7 5.99 Favored 'General case' 3 C--O 1.658 22.584 4 O-C-N 108.165 -9.084 . . . . 14.1 126.177 174.95 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' LEU . . . . . 1.556 ' CG ' ' CD1' ' B' ' 140' ' ' LEU . 8.2 mt -70.92 -24.54 62.48 Favored 'General case' 2 N--CA 1.142 -15.836 2 CA-C-O 142.255 10.55 . . . . 14.62 110.08 -161.85 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' ALA . . . . . 1.542 ' CA ' ' N ' ' B' ' 141' ' ' ALA 0.537 . . -109.59 8.13 24.86 Favored 'General case' 3 C--O 1.574 18.163 2 C-N-CA 93.94 -11.104 . . . . 13.92 119.776 -179.671 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' HIS . . . . . 1.474 ' N ' ' C ' ' B' ' 141' ' ' ALA . 46.4 t-80 -75.01 -22.86 58.25 Favored 'General case' 3 N--CA 0.946 -25.656 3 CA-C-O 140.633 9.778 . . . . 10.93 97.927 -174.466 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' LYS . . . . . 1.544 ' CE ' ' CD ' ' B' ' 143' ' ' LYS 1.001 1.4 mmmt -67.08 26.81 0.02 OUTLIER 'General case' 4 C--N 0.989 -15.103 4 O-C-N 93.457 -18.277 . . . . 10.83 86.092 -162.926 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' TYR . . . . . 1.69 ' CD2' ' CG ' ' B' ' 144' ' ' TYR 0.253 2.1 m-85 -139.51 99.67 3.78 Favored 'General case' 4 C--O 1.513 14.971 4 CA-C-O 154.78 16.514 . . . . 11.5 99.891 -170.914 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' HIS . . . . . 1.404 ' NE2' ' CE1' ' B' ' 145' ' ' HIS 1.136 1.6 p80 . . . . . 4 C--N 1.596 11.326 1 CA-C-N 81.944 -16.026 . . . . 14.34 111.91 174.784 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' VAL . . . . . 1.348 ' C ' ' CA ' ' C' ' 1' ' ' VAL 1.098 0.0 OUTLIER . . . . . 3 C--O 0.909 -16.823 1 N-CA-C 96.986 -5.19 . . . . 14.82 96.986 . . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.4 HD12 ' HG3' ' C' ' 7' ' ' LYS 0.285 0.0 OUTLIER -126.4 132.18 51.58 Favored 'General case' 3 C--O 0.977 -13.262 4 O-C-N 94.815 -17.428 . . . . 13.9 116.586 -175.443 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' SER . . . . . 1.555 ' C ' ' CA ' ' C' ' 3' ' ' SER 1.008 0.3 OUTLIER -36.1 169.35 0.0 OUTLIER 'General case' 3 N--CA 1.102 -17.851 4 O-C-N 89.125 -20.985 . . . . 13.19 105.204 172.867 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ALA . . . . . 1.42 ' CB ' ' CA ' ' C' ' 4' ' ' ALA 1.28 . . -121.49 25.83 9.15 Favored 'General case' 2 N--CA 1.589 6.513 4 O-C-N 103.194 -12.191 . . . . 14.25 94.69 -166.339 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ALA . . . . . 0.519 ' H ' ' HB2' ' C' ' 3' ' ' SER 0.845 . . -112.02 -20.79 11.84 Favored 'General case' 3 C--O 0.898 -17.403 3 CA-C-O 91.403 -13.665 . . . . 13.62 83.345 171.143 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' ASN . . . . . 1.381 ' C ' ' N ' ' C' ' 7' ' ' LYS 0.864 0.8 OUTLIER -57.46 -74.68 0.05 Allowed 'General case' 3 CA--C 1.203 -12.376 3 O-C-N 139.906 10.754 . . . . 12.75 114.586 176.005 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LYS . . . . . 1.633 ' CB ' ' CG ' ' C' ' 7' ' ' LYS . 0.3 OUTLIER -35.15 -27.92 0.01 OUTLIER 'General case' 4 C--N 1.749 17.974 1 N-CA-C 126.044 5.572 . . . . 15.01 126.044 168.28 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' SER . . . . . 1.261 ' O ' ' C ' ' C' ' 8' ' ' SER 0.718 28.9 t -53.43 -65.29 0.59 Allowed 'General case' 2 C--O 1.723 25.988 3 O-C-N 139.654 10.596 . . . . 17.7 111.433 -178.687 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' ASN . . . . . 1.257 ' CB ' ' CG ' ' C' ' 9' ' ' ASN 0.798 1.1 m-20 -44.47 -74.43 0.04 OUTLIER 'General case' 1 C--O 1.14 -4.7 3 CA-C-N 94.565 -10.289 . . . . 19.09 123.367 175.067 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' VAL . . . . . 1.475 ' CB ' ' CG2' ' C' ' 10' ' ' VAL 0.424 1.5 t -20.71 -47.25 0.01 OUTLIER 'Isoleucine or valine' 3 N--CA 1.177 -14.121 2 CA-C-O 154.943 16.592 . . . . 17.41 109.908 169.251 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' LYS . . . . . 1.49 ' CA ' ' N ' ' C' ' 11' ' ' LYS 0.569 0.0 OUTLIER -73.11 -64.16 1.03 Allowed 'General case' 3 N--CA 1.733 13.706 4 O-C-N 103.017 -12.302 . . . . 14.64 117.96 176.272 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ALA . . . . . 1.304 ' O ' ' C ' ' C' ' 12' ' ' ALA 0.517 . . -74.56 -8.06 55.1 Favored 'General case' 2 C--O 1.66 22.702 4 CA-C-N 143.242 11.837 . . . . 12.55 96.598 178.8 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ALA . . . . . 0.404 ' HB2' HG11 ' C' ' 121' ' ' VAL 1.116 . . -68.63 -65.9 0.64 Allowed 'General case' 2 N--CA 1.249 -10.522 4 CA-C-N 145.449 12.84 . . . . 12.99 108.496 169.855 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' TRP . . . . . 0.86 ' HB2' HE22 ' C' ' 70' ' ' GLN 0.741 0.1 OUTLIER -50.34 -40.81 50.16 Favored 'General case' 4 N--CA 1.203 -12.779 3 C-N-CA 139.953 7.301 . . . . 12.72 109.205 178.583 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLY . . . . . 1.546 ' N ' ' CA ' ' C' ' 15' ' ' GLY . . . -77.35 -17.97 78.64 Favored Glycine 2 C--O 0.902 -20.599 3 O-C-N 140.206 10.941 . . . . 15.09 106.931 -178.844 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LYS . . . . . 1.508 ' CG ' ' CD ' ' C' ' 16' ' ' LYS 0.4 0.1 OUTLIER -78.21 -38.47 43.11 Favored 'General case' 2 N--CA 1.834 18.732 0 C-N-CA 112.783 -3.567 . . . . 15.3 107.522 172.761 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' VAL . . . . . 1.585 ' CB ' ' CG1' ' C' ' 17' ' ' VAL 0.609 4.6 t -51.42 -74.76 0.04 OUTLIER 'Isoleucine or valine' 3 N--CA 1.171 -14.383 3 N-CA-C 95.623 -5.695 . . . . 15.32 95.623 -176.519 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GLY . . . . . 1.437 ' CA ' ' N ' ' C' ' 18' ' ' GLY . . . 106.49 -145.87 16.0 Favored Glycine 3 N--CA 1.772 21.088 3 O-C-N 134.016 7.072 . . . . 14.45 108.213 171.944 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' GLY . . . . . 1.49 ' C ' ' CA ' ' C' ' 19' ' ' GLY . . . -78.8 -6.3 88.52 Favored Glycine 3 CA--C 1.786 17.015 3 CA-C-O 140.17 10.872 . . . . 14.42 111.562 172.039 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' ASN . . . . . 1.504 ' CA ' ' N ' ' C' ' 20' ' ' ASN 0.668 0.1 OUTLIER -75.41 -74.59 0.2 Allowed 'General case' 3 CA--C 1.173 -13.556 3 O-C-N 100.005 -13.644 . . . . 15.13 86.732 -178.14 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ALA . . . . . 1.415 ' N ' ' C ' ' C' ' 20' ' ' ASN 0.378 . . -4.26 -43.74 0.0 OUTLIER Pre-proline 3 C--N 1.711 16.308 3 O-C-N 103.096 -12.252 . . . . 14.67 106.796 175.528 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' PRO . . . . . 1.565 ' CD ' ' CG ' ' C' ' 22' ' ' PRO 0.385 0.0 OUTLIER -79.2 -42.19 0.19 Allowed 'Trans proline' 3 N--CA 1.815 20.389 4 O-C-N 103.411 -9.31 . . . . 14.07 111.193 177.844 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' ALA . . . . . 1.618 ' CA ' ' CB ' ' C' ' 23' ' ' ALA 0.767 . . -56.45 -25.12 49.69 Favored 'General case' 1 CA--C 1.671 5.601 3 N-CA-C 131.545 7.609 . . . . 13.97 131.545 167.1 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' TYR . . . . . 1.619 ' CG ' ' CB ' ' C' ' 24' ' ' TYR 0.796 3.4 m-30 -50.57 -76.57 0.02 OUTLIER 'General case' 0 C--N 1.422 3.72 2 O-C-N 146.437 14.835 . . . . 13.21 103.575 163.883 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' GLY . . . . . 1.471 ' N ' ' CA ' ' C' ' 25' ' ' GLY . . . -59.03 -37.89 92.21 Favored Glycine 3 N--CA 1.754 19.888 3 CA-C-O 94.479 -14.512 . . . . 15.15 109.681 173.557 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ALA . . . . . 1.136 ' H ' ' HE2' ' C' ' 56' ' ' LYS 0.584 . . -43.59 -56.89 3.44 Favored 'General case' 2 N--CA 1.253 -10.279 2 CA-C-N 139.835 11.817 . . . . 15.04 111.695 167.936 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' GLN . . . . . 0.769 ' C ' ' CA ' ' C' ' 28' ' ' ALA 0.369 11.9 tt0 -63.59 -22.31 66.83 Favored 'General case' 3 C--O 1.049 -9.479 2 O-C-N 98.191 -15.318 . . . . 15.27 123.522 -178.34 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ALA . . . . . 1.557 ' CA ' ' N ' ' C' ' 28' ' ' ALA 0.324 . . -90.78 -31.02 16.68 Favored 'General case' 4 CA--C 1.186 -13.026 5 O-C-N 140.99 11.431 . . . . 15.0 128.587 173.045 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' LEU . . . . . 1.554 ' CA ' ' CB ' ' C' ' 29' ' ' LEU 0.337 6.7 mp -72.78 -42.79 63.57 Favored 'General case' 1 C--N 1.655 13.883 3 CA-C-N 96.756 -9.293 . . . . 14.51 96.293 179.308 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' GLN . . . . . 1.465 ' CD ' ' CG ' ' C' ' 30' ' ' GLN 0.444 2.4 tt0 -77.79 -31.34 51.79 Favored 'General case' 1 N--CA 1.197 -13.087 1 CA-C-N 132.569 6.986 . . . . 13.54 105.923 -174.814 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' ARG . . . . . 1.308 ' C ' ' CA ' ' C' ' 31' ' ' ARG 0.619 3.0 ttt180 -54.19 -79.54 0.02 OUTLIER 'General case' 2 CA--C 1.994 18.054 2 O-C-N 109.889 -8.007 . . . . 15.71 103.117 170.118 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' MET . . . . . 1.585 ' CB ' ' CA ' ' C' ' 32' ' ' MET 0.343 2.2 ttp -48.91 -16.27 0.12 Allowed 'General case' 3 C--O 1.024 -10.769 4 CA-C-O 94.972 -11.966 . . . . 16.81 123.788 -175.459 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' PHE . . . . . 1.297 ' O ' ' C ' ' C' ' 33' ' ' PHE 0.602 5.5 m-30 -73.06 -40.74 64.82 Favored 'General case' 3 C--O 1.685 23.99 4 CA-C-N 141.986 11.266 . . . . 15.05 99.552 -166.92 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' LEU . . . . . 0.67 ' HB2' ' O ' ' C' ' 31' ' ' ARG 0.25 7.3 mp -58.88 -72.27 0.1 Allowed 'General case' 3 C--N 1.668 14.451 3 O-C-N 107.568 -9.458 . . . . 14.54 114.3 -178.294 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' SER . . . . . 1.345 ' CB ' ' OG ' ' C' ' 35' ' ' SER 0.49 0.0 OUTLIER -61.83 -20.79 64.04 Favored 'General case' 1 N--CA 1.277 -9.118 4 CA-C-O 82.969 -17.682 . . . . 16.23 103.71 157.795 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' PHE . . . . . 1.554 ' CA ' ' CB ' ' C' ' 36' ' ' PHE 0.319 0.0 OUTLIER -171.59 62.28 0.34 Allowed Pre-proline 3 CA--C 1.281 -9.39 4 CA-C-N 158.424 18.738 . . . . 15.24 128.297 173.351 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' PRO . . . . . 1.376 ' CD ' ' CG ' ' C' ' 37' ' ' PRO 0.657 19.4 Cg_exo -27.34 -39.17 0.04 OUTLIER 'Trans proline' 3 C--N 1.765 22.473 3 N-CA-C 147.115 13.467 . . . . 14.79 147.115 -172.071 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' THR . . . . . 1.297 ' CB ' ' CG2' ' C' ' 38' ' ' THR 0.371 2.3 t -75.84 -16.16 60.11 Favored 'General case' 3 C--O 1.921 36.42 4 C-N-CA 173.507 20.723 . . . . 15.26 95.656 -174.432 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' THR . . . . . 1.536 ' CA ' ' CB ' ' C' ' 39' ' ' THR 0.299 0.7 OUTLIER -93.58 -10.33 35.07 Favored 'General case' 2 N--CA 1.163 -14.8 3 C-N-CA 138.77 6.828 . . . . 14.4 117.364 165.516 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LYS . . . . . 0.625 ' HD3' HD11 ' C' ' 48' ' ' LEU 0.494 17.0 mtmt -64.81 -8.09 13.73 Favored 'General case' 3 C--N 1.511 7.618 3 O-C-N 140.996 11.435 . . . . 14.31 120.296 178.197 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' THR . . . . . 1.358 ' CB ' ' CG2' ' C' ' 41' ' ' THR 0.542 15.8 m -80.88 -36.43 31.31 Favored 'General case' 3 CA--C 1.072 -17.433 2 C-N-CA 136.86 6.064 . . . . 12.79 105.203 -167.316 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' TYR . . . . . 0.746 ' CD1' HBC1 ' C' ' 142' ' ' HEM 0.562 10.5 m-85 -77.4 -12.37 59.95 Favored 'General case' 1 C--O 1.389 8.405 5 N-CA-C 87.229 -8.804 . . . . 15.89 87.229 179.621 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' PHE . . . . . 1.536 ' CA ' ' CB ' ' C' ' 43' ' ' PHE 0.307 8.2 m-85 -132.08 67.22 78.96 Favored Pre-proline 2 N--CA 1.209 -12.525 4 O-C-N 96.87 -16.144 . . . . 15.41 132.557 168.476 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' PRO . . . . . 1.491 ' CG ' ' CB ' ' C' ' 44' ' ' PRO 0.332 42.2 Cg_endo -75.08 -73.86 0.01 OUTLIER 'Trans proline' 3 N--CA 1.858 22.925 4 O-C-N 143.614 11.849 . . . . 14.47 103.952 170.947 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' HIS . . . . . 1.533 ' CA ' ' CB ' ' C' ' 45' ' ' HIS 0.504 0.4 OUTLIER -13.52 -50.16 0.0 OUTLIER 'General case' 4 N--CA 1.811 17.613 4 N-CA-C 143.923 12.194 . . . . 13.52 143.923 -175.376 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' PHE . . . . . 1.469 ' CZ ' ' CE2' ' C' ' 46' ' ' PHE 0.724 2.2 m-85 -97.48 148.21 23.45 Favored 'General case' 3 C--O 1.029 -10.549 5 CA-C-O 161.071 19.51 . . . . 13.94 122.505 177.386 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' ASP . . . . . 1.496 ' CB ' ' CG ' ' C' ' 47' ' ' ASP 0.362 0.0 OUTLIER -96.47 117.31 30.64 Favored 'General case' 3 C--O 1.498 14.144 4 CA-C-N 87.949 -13.296 . . . . 12.96 85.415 179.728 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' LEU . . . . . 0.945 HD12 ' HB2' ' C' ' 49' ' ' SER 0.301 0.0 OUTLIER 147.14 124.17 0.0 OUTLIER 'General case' 3 C--N 1.133 -8.833 4 C-N-CA 174.715 21.206 . . . . 11.95 89.151 -110.654 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' SER . . . . . 1.399 ' CB ' ' OG ' ' C' ' 49' ' ' SER 0.385 4.5 t -127.9 -175.52 3.51 Favored 'General case' 3 C--N 1.538 8.804 3 CA-C-O 149.649 14.071 . . . . 10.28 76.738 9.473 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' HIS . . . . . . . . . . . . . 3.6 m80 -122.7 -95.74 0.47 Allowed 'General case' 3 N--CA 1.669 10.524 4 O-C-N 75.533 -29.479 . . . . 10.49 118.792 12.773 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' GLY . . . . . . . . . . . . . . . -74.06 118.1 5.87 Favored Glycine 3 C--O 0.887 -21.549 5 O-C-N 138.991 10.182 . . . . 11.8 91.169 179.285 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' SER . . . . . 1.164 ' HB3' HE21 ' C' ' 55' ' ' GLN 0.483 0.0 OUTLIER -120.95 128.4 52.71 Favored 'General case' 1 N--CA 1.578 5.941 3 CA-C-O 97.363 -10.827 . . . . 13.68 119.606 179.956 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ALA . . . . . 1.547 ' N ' ' CA ' ' C' ' 53' ' ' ALA 0.488 . . -62.94 -10.69 14.49 Favored 'General case' 2 N--CA 1.701 12.101 5 N-CA-C 132.63 8.011 . . . . 15.05 132.63 171.974 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' GLN . . . . . 1.604 ' CB ' ' CG ' ' C' ' 54' ' ' GLN 0.255 24.3 mt-30 -76.59 -41.92 44.42 Favored 'General case' 3 C--O 1.453 11.77 2 CA-C-O 97.037 -10.982 . . . . 15.17 111.071 171.565 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' GLN . . . . . 1.544 ' CB ' ' CA ' ' C' ' 55' ' ' GLN 0.678 0.3 OUTLIER -72.9 -47.03 49.29 Favored 'General case' 3 C--O 1.57 17.932 3 CA-C-O 92.383 -13.198 . . . . 14.98 105.027 175.143 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' LYS . . . . . 1.277 ' CE ' ' NZ ' ' C' ' 56' ' ' LYS 1.087 0.0 OUTLIER -65.88 -78.85 0.05 OUTLIER 'General case' 1 C--O 1.394 8.692 4 CA-C-N 152.492 16.042 . . . . 15.73 82.717 171.141 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' ALA . . . . . 0.96 ' HB3' ' O ' ' C' ' 53' ' ' ALA 0.704 . . -21.77 -57.96 0.03 OUTLIER 'General case' 4 C--O 1.578 18.375 3 O-C-N 97.847 -15.533 . . . . 15.46 114.819 -171.569 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' HIS . . . . . 0.569 ' NE2' ' CE2' ' C' ' 43' ' ' PHE 0.693 9.6 t60 -71.65 -38.99 70.64 Favored 'General case' 4 C--O 0.94 -15.213 3 O-C-N 102.501 -12.624 . . . . 15.22 116.991 170.848 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' GLY . . . . . 1.37 ' C ' ' CA ' ' C' ' 59' ' ' GLY . . . -59.68 -33.2 76.47 Favored Glycine 4 CA--C 1.919 25.333 4 CA-C-O 101.191 -10.783 . . . . 14.09 93.701 177.46 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' GLN . . . . . 1.592 ' CB ' ' CG ' ' C' ' 60' ' ' GLN . 0.4 OUTLIER -44.63 -58.28 3.13 Favored 'General case' 3 C--N 0.981 -15.434 1 CA-C-N 129.259 6.529 . . . . 14.83 118.906 179.257 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' LYS . . . . . 1.591 ' CG ' ' CD ' ' C' ' 61' ' ' LYS 0.962 0.2 OUTLIER -63.09 -85.21 0.01 OUTLIER 'General case' 3 C--O 1.452 11.734 3 C-N-CA 159.733 15.213 . . . . 14.28 90.345 175.17 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . 0.467 29.5 t -43.9 -66.8 0.12 Allowed 'Isoleucine or valine' 4 C--N 1.103 -10.117 3 CA-C-N 143.176 11.807 . . . . 14.25 100.434 178.758 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' ALA . . . . . . . . . . . . 0.616 . . -9.88 -102.62 0.0 OUTLIER 'General case' 2 N--CA 1.282 -8.85 4 C-N-CA 160.234 15.414 . . . . 13.85 111.142 136.875 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' ASN . . . . . 1.536 ' CB ' ' CA ' ' C' ' 64' ' ' ASN 0.412 74.0 m-20 -7.78 -58.25 0.0 OUTLIER 'General case' 4 N--CA 1.344 -5.746 3 CA-C-N 141.151 10.887 . . . . 14.41 129.92 163.655 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' ALA . . . . . 0.521 ' O ' ' HB2' ' C' ' 68' ' ' LYS 0.314 . . -54.87 -50.17 69.34 Favored 'General case' 3 C--O 1.439 11.038 4 CA-C-O 100.945 -9.121 . . . . 13.82 91.085 176.742 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' LEU . . . . . 1.571 ' CD2' ' CG ' ' C' ' 66' ' ' LEU 0.586 0.0 OUTLIER -79.26 -35.48 41.35 Favored 'General case' 1 CA--C 1.371 -5.927 1 CA-C-N 136.147 8.612 . . . . 16.31 118.06 -167.154 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' THR . . . . . 1.492 ' CB ' ' CG2' ' C' ' 67' ' ' THR 0.395 99.5 m -59.38 -57.63 12.15 Favored 'General case' 4 C--O 1.011 -11.496 2 CA-C-O 99.911 -9.614 . . . . 16.95 98.025 175.342 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' LYS . . . . . 1.596 ' CB ' ' CG ' ' C' ' 68' ' ' LYS 0.54 0.0 OUTLIER -32.01 -78.27 0.02 OUTLIER 'General case' 3 C--O 1.087 -7.45 2 C-N-CA 138.785 6.834 . . . . 18.31 103.911 167.266 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' ALA . . . . . 1.442 ' C ' ' CA ' ' C' ' 69' ' ' ALA 0.746 . . -49.52 -25.85 3.0 Favored 'General case' 2 N--CA 1.144 -15.759 4 C-N-CA 162.391 16.276 . . . . 16.09 102.636 -161.916 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' GLN . . . . . 1.395 ' CA ' ' CB ' ' C' ' 70' ' ' GLN 1.917 6.0 mm100 -146.31 17.21 1.35 Allowed 'General case' 3 C--N 1.121 -9.351 2 N-CA-C 140.746 11.017 . . . . 14.15 140.746 173.627 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' GLY . . . . . 1.523 ' C ' ' CA ' ' C' ' 71' ' ' GLY . . . 73.1 -71.36 1.19 Allowed Glycine 4 CA--C 1.761 15.45 3 C-N-CA 142.492 9.615 . . . . 13.2 92.046 23.819 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' HIS . . . . . 1.547 ' CG ' ' CD2' ' C' ' 72' ' ' HIS 0.833 0.0 OUTLIER -164.57 72.27 0.22 Allowed 'General case' 3 CA--C 1.736 8.113 3 CA-C-O 154.977 16.608 . . . . 14.04 123.834 -172.887 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' LEU . . . . . 1.085 ' HB2' ' HG2' ' C' ' 7' ' ' LYS 0.305 0.7 OUTLIER -74.26 68.87 1.52 Allowed 'General case' 2 CA--C 1.677 5.84 2 CA-C-N 86.255 -14.066 . . . . 13.38 96.153 179.729 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' ASN . . . . . 1.372 ' N ' ' CA ' ' C' ' 74' ' ' ASN 0.71 0.0 OUTLIER -161.18 -12.69 0.04 OUTLIER 'General case' 3 N--CA 1.858 19.948 3 O-C-N 110.804 -7.435 . . . . 15.77 98.467 171.702 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' ASP . . . . . 1.585 ' CA ' ' CB ' ' C' ' 75' ' ' ASP 0.725 48.9 t0 170.01 71.95 0.0 OUTLIER 'General case' 3 N--CA 0.934 -26.269 4 O-C-N 105.672 -10.643 . . . . 15.04 128.97 -157.583 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' LEU . . . . . 1.584 ' CG ' ' CD1' ' C' ' 76' ' ' LEU 0.461 0.0 OUTLIER -73.05 -30.84 1.33 Allowed Pre-proline 4 C--O 1.496 14.078 4 CA-C-O 101.904 -8.665 . . . . 16.3 124.378 163.021 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' PRO . . . . . 1.268 ' CG ' ' CB ' ' C' ' 77' ' ' PRO 0.268 15.3 Cg_exo -53.09 -32.71 60.16 Favored 'Trans proline' 3 CA--C 1.168 -17.809 4 C-N-CA 105.247 -9.369 . . . . 16.54 128.914 168.15 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' GLY . . . . . 0.91 ' C ' ' CA ' ' C' ' 79' ' ' THR . . . -84.65 -49.0 4.76 Favored Glycine 2 N--CA 1.659 13.502 4 CA-C-O 93.294 -15.17 . . . . 16.63 90.154 -168.651 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' THR . . . . . 1.507 ' CA ' ' N ' ' C' ' 79' ' ' THR 0.529 0.2 OUTLIER -56.11 -40.47 73.75 Favored 'General case' 2 N--CA 1.692 11.672 2 O-C-N 142.236 11.198 . . . . 16.97 115.18 -177.49 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' LEU . . . . . 1.561 ' CG ' ' CD1' ' C' ' 80' ' ' LEU 0.744 4.6 tp -91.51 30.53 1.3 Allowed 'General case' 4 C--O 1.728 26.271 2 N-CA-C 135.499 9.074 . . . . 15.32 135.499 167.39 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' SER . . . . . 1.513 ' CA ' ' CB ' ' C' ' 81' ' ' SER 0.515 0.8 OUTLIER -81.8 -42.79 19.2 Favored 'General case' 3 N--CA 1.286 -8.665 4 CA-C-O 160.542 19.258 . . . . 13.77 101.98 -156.359 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' ASN . . . . . . . . . . . . 0.637 0.9 OUTLIER -51.59 -47.66 63.47 Favored 'General case' 4 C--N 1.637 13.086 3 O-C-N 95.253 -17.154 . . . . 14.45 112.259 175.394 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' LEU . . . . . 1.575 ' CD2' ' CG ' ' C' ' 83' ' ' LEU 0.775 8.0 tp -53.08 -93.16 0.0 OUTLIER 'General case' 2 C--N 1.572 10.282 3 O-C-N 152.374 18.547 . . . . 14.35 132.693 -174.937 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' SER . . . . . 1.43 ' C ' ' CA ' ' C' ' 84' ' ' SER 0.968 12.0 m 12.64 -16.86 0.0 OUTLIER 'General case' 4 C--N 0.94 -17.232 2 C-N-CA 170.694 19.598 . . . . 15.65 101.459 95.457 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' ASN . . . . . 1.462 ' CB ' ' CG ' ' C' ' 85' ' ' ASN 0.491 9.4 t-20 -93.96 139.38 31.0 Favored 'General case' 2 N--CA 1.173 -14.302 4 CA-C-O 70.779 -23.486 . . . . 16.13 99.667 125.654 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' LEU . . . . . 1.643 ' CG ' ' CD1' ' C' ' 86' ' ' LEU 0.807 0.4 OUTLIER -19.75 -27.22 0.0 OUTLIER 'General case' 2 C--N 1.222 -4.948 4 O-C-N 83.411 -24.555 . . . . 15.46 121.371 -26.507 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' HIS . . . . . 1.161 ' HA ' HD12 ' C' ' 91' ' ' LEU . 47.0 m80 -85.44 -49.75 7.85 Favored 'General case' 4 CA--C 1.178 -13.363 3 CA-C-O 81.762 -18.256 . . . . 16.18 89.919 176.376 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' ALA . . . . . 0.818 ' CB ' ' HB2' ' C' ' 139' ' ' LYS 0.368 . . -86.81 -89.35 0.12 Allowed 'General case' 3 C--O 1.605 19.765 3 CA-C-N 151.121 15.419 . . . . 16.41 101.491 -163.388 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' HIS . . . . . 1.192 ' HB2' ' NZ ' ' C' ' 139' ' ' LYS . 0.0 OUTLIER -75.77 -16.34 60.13 Favored 'General case' 2 C--N 1.097 -10.373 3 CA-C-O 148.421 13.486 . . . . 16.34 123.887 -173.139 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' LYS . . . . . 1.518 ' NZ ' ' CE ' ' C' ' 90' ' ' LYS 0.361 0.5 OUTLIER -105.74 -46.65 4.09 Favored 'General case' 3 N--CA 1.899 21.977 4 O-C-N 98.589 -15.069 . . . . 18.04 99.793 -176.961 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' LEU . . . . . 1.646 ' CB ' ' CG ' ' C' ' 91' ' ' LEU 0.394 47.9 mt -72.47 -49.48 32.93 Favored 'General case' 3 N--CA 1.687 11.405 2 O-C-N 136.772 8.795 . . . . 17.6 107.11 -176.352 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' ARG . . . . . 1.612 ' CD ' ' CG ' ' C' ' 92' ' ' ARG 0.632 0.0 OUTLIER 74.09 44.62 0.25 Allowed 'General case' 4 C--O 1.544 16.602 1 CA-C-O 147.566 13.079 . . . . 17.04 120.291 -167.418 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' VAL . . . . . 1.378 ' CA ' ' CB ' ' C' ' 93' ' ' VAL 0.568 2.9 t -61.77 99.8 0.14 Allowed 'Isoleucine or valine' 3 C--O 1.613 20.205 2 CA-C-N 94.615 -10.266 . . . . 17.8 107.622 166.039 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' ASN . . . . . 1.293 ' CG ' ' OD1' ' C' ' 94' ' ' ASN . 0.2 OUTLIER -49.14 141.21 11.37 Favored Pre-proline 4 C--N 1.045 -12.667 3 O-C-N 106.985 -9.822 . . . . 16.87 96.398 -173.612 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' PRO . . . . . 0.979 ' HG3' ' CZ ' ' C' ' 141' ' ' ARG 0.461 1.5 Cg_endo -71.54 -17.57 29.97 Favored 'Trans proline' 4 C--O 1.545 15.853 4 O-C-N 103.004 -9.524 . . . . 15.43 117.439 175.047 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' VAL . . . . . 1.432 ' CG2' ' CB ' ' C' ' 96' ' ' VAL 0.62 4.5 t -32.84 -43.44 0.07 OUTLIER 'Isoleucine or valine' 2 CA--C 1.133 -15.059 3 O-C-N 93.48 -18.263 . . . . 14.97 117.841 172.056 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' ASN . . . . . 1.469 ' C ' ' CA ' ' C' ' 97' ' ' ASN 0.484 5.4 m120 -62.75 -29.89 71.03 Favored 'General case' 3 CA--C 1.765 9.227 3 CA-C-O 134.301 6.762 . . . . 15.51 123.136 -173.879 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' PHE . . . . . 1.383 ' CG ' ' CD1' ' C' ' 98' ' ' PHE 0.645 13.2 m-85 -43.14 -55.54 3.86 Favored 'General case' 4 C--O 0.781 -23.586 5 CA-C-O 150.851 14.643 . . . . 16.47 124.021 174.644 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' LYS . . . . . 1.528 ' CD ' ' CG ' ' C' ' 99' ' ' LYS 0.395 0.0 OUTLIER -67.71 -16.56 64.2 Favored 'General case' 1 C--N 1.991 28.482 2 CA-C-N 87.735 -13.393 . . . . 14.38 104.462 -178.223 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' LEU . . . . . 1.41 ' CA ' ' N ' ' C' ' 100' ' ' LEU 0.697 0.0 OUTLIER -86.97 -56.13 3.52 Favored 'General case' 3 N--CA 1.823 18.183 3 CA-C-O 89.612 -14.518 . . . . 15.1 94.069 -178.99 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' LEU . . . . . 1.554 ' CA ' ' CB ' ' C' ' 101' ' ' LEU 0.774 0.0 OUTLIER -50.43 -44.16 55.24 Favored 'General case' 2 C--O 1.519 15.241 3 O-C-N 145.231 14.082 . . . . 15.34 125.571 -179.433 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' SER . . . . . 1.349 ' C ' ' N ' ' C' ' 103' ' ' HIS 0.733 1.2 m -18.35 -88.76 0.0 OUTLIER 'General case' 3 C--N 1.122 -9.31 3 C-N-CA 150.161 11.384 . . . . 14.35 97.126 158.74 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HIS . . . . . 1.657 ' CB ' ' CG ' ' C' ' 103' ' ' HIS 0.262 1.5 t-80 -51.67 -32.42 29.64 Favored 'General case' 2 C--N 1.784 19.459 2 C-N-CA 97.113 -9.835 . . . . 14.05 126.861 169.304 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' SER . . . . . 1.475 ' C ' ' CA ' ' C' ' 104' ' ' SER 0.634 0.6 OUTLIER -57.78 -55.79 30.3 Favored 'General case' 3 CA--C 1.766 9.277 5 C-N-CA 147.283 10.233 . . . . 14.55 99.906 -157.097 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' LEU . . . . . 1.501 ' CG ' ' CD1' ' C' ' 105' ' ' LEU 0.469 4.6 tp -83.62 -38.02 22.13 Favored 'General case' 3 C--O 1.398 8.914 4 CA-C-O 97.814 -10.612 . . . . 15.21 99.673 -173.956 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' LEU . . . . . 0.454 HD23 HD21 ' D' ' 111' ' ' LEU . 0.6 OUTLIER -73.25 -21.7 60.57 Favored 'General case' 1 N--CA 1.211 -12.388 2 CA-C-N 131.937 6.699 . . . . 15.05 119.855 175.697 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' VAL . . . . . 0.827 HG12 ' O ' ' C' ' 103' ' ' HIS 0.645 0.2 OUTLIER -89.8 -57.46 4.24 Favored 'Isoleucine or valine' 2 N--CA 1.201 -12.913 5 C-N-CA 166.423 17.889 . . . . 15.99 86.724 173.751 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' THR . . . . . 1.565 ' CG2' ' CB ' ' C' ' 108' ' ' THR 1.101 19.8 m -76.36 -68.21 0.61 Allowed 'General case' 4 CA--C 1.847 12.383 5 CA-C-N 165.266 21.848 . . . . 13.92 86.866 -159.355 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' LEU . . . . . 0.641 ' O ' HD22 ' C' ' 113' ' ' LEU 0.418 1.3 mm? -36.97 -75.01 0.03 OUTLIER 'General case' 2 C--N 1.063 -11.87 3 C-N-CA 149.091 10.956 . . . . 15.09 109.248 -176.354 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' ALA . . . . . 1.212 ' C ' ' CA ' ' C' ' 110' ' ' ALA 0.856 . . 156.84 -72.32 0.0 OUTLIER 'General case' 2 CA--C 2.079 21.314 5 C-N-CA 176.978 22.111 . . . . 16.87 80.796 -25.29 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' SER . . . . . 1.414 ' C ' ' CA ' ' C' ' 111' ' ' SER . 46.7 t -53.07 -36.33 60.52 Favored 'General case' 4 C--N 0.967 -16.049 2 O-C-N 142.286 12.241 . . . . 15.37 117.202 -176.692 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' HIS . . . . . 0.508 ' N ' ' CA ' ' C' ' 111' ' ' SER 0.394 24.3 m80 -95.61 -46.79 6.49 Favored 'General case' 3 C--O 1.555 17.165 5 CA-C-O 81.396 -18.43 . . . . 14.64 97.385 -173.855 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' LEU . . . . . 1.534 ' CD2' ' CG ' ' C' ' 113' ' ' LEU 0.519 0.1 OUTLIER -126.27 80.6 68.52 Favored Pre-proline 1 C--O 1.37 7.425 4 O-C-N 144.523 13.639 . . . . 14.99 102.536 -166.745 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' PRO . . . . . 1.538 ' N ' ' CA ' ' C' ' 114' ' ' PRO 0.67 71.9 Cg_endo -96.99 16.79 0.66 Allowed 'Trans proline' 4 C--N 1.651 16.461 3 C-N-CA 102.645 -11.103 . . . . 12.85 112.432 -172.346 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' THR . . . . . 1.534 ' CB ' ' CG2' ' C' ' 115' ' ' THR 0.76 0.7 OUTLIER -103.09 -8.51 20.47 Favored 'General case' 4 C--O 1.663 22.867 4 O-C-N 134.993 7.683 . . . . 12.8 91.608 -176.89 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' ASN . . . . . 1.531 ' C ' ' CA ' ' C' ' 116' ' ' ASN 0.466 1.3 t30 -106.55 -61.93 1.46 Allowed 'General case' 3 C--N 1.08 -11.114 3 C-N-CA 159.966 15.307 . . . . 15.35 112.952 -157.139 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' PHE . . . . . 1.607 ' CD2' ' CE2' ' C' ' 117' ' ' PHE 1.029 0.1 OUTLIER -82.38 58.32 4.05 Favored 'General case' 2 C--N 0.99 -15.049 3 CA-C-O 92.953 -12.927 . . . . 16.87 104.515 -178.158 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' THR . . . . . 1.455 ' OG1' ' CB ' ' C' ' 118' ' ' THR 0.561 74.6 p -23.19 141.61 0.04 OUTLIER Pre-proline 3 C--N 0.896 -19.112 3 C-N-CA 162.136 16.174 . . . . 15.72 109.878 143.202 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' PRO . . . . . 1.362 ' C ' ' CA ' ' C' ' 119' ' ' PRO 0.607 77.8 Cg_exo -59.19 -35.06 98.34 Favored 'Trans proline' 3 CA--C 1.933 20.438 1 C-N-CA 112.373 -4.618 . . . . 14.73 113.417 177.927 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' ALA . . . . . . . . . . . . 0.566 . . -81.66 -23.58 36.82 Favored 'General case' 1 N--CA 1.09 -18.465 2 C-N-CA 145.636 9.574 . . . . 12.62 105.562 177.176 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' VAL . . . . . 1.379 ' C ' ' N ' ' C' ' 122' ' ' HIS . 85.3 t -90.95 -53.25 9.18 Favored 'Isoleucine or valine' 2 C--N 1.46 5.409 5 O-C-N 89.644 -20.66 . . . . 12.47 90.002 170.681 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' HIS . . . . . 1.379 ' N ' ' C ' ' C' ' 121' ' ' VAL 0.261 4.3 p80 -53.47 -32.88 52.06 Favored 'General case' 2 C--N 1.739 17.519 2 CA-C-N 134.973 8.079 . . . . 13.25 113.074 -167.937 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' ALA . . . . . 0.493 ' HB3' HD22 ' C' ' 124' ' ' ASN 0.609 . . -47.49 -71.01 0.08 Allowed 'General case' 2 C--O 1.105 -6.507 3 O-C-N 98.706 -14.996 . . . . 12.91 111.961 -170.977 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' ASN . . . . . 1.331 ' CG ' ' ND2' ' C' ' 124' ' ' ASN 0.564 0.0 OUTLIER -47.7 -78.57 0.02 OUTLIER 'General case' 1 C--O 1.332 5.41 2 O-C-N 135.105 7.753 . . . . 12.24 102.591 175.955 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' LEU . . . . . . . . . . . . 0.528 91.0 mt -26.25 -56.69 0.07 Allowed 'General case' 3 C--O 1.359 6.839 4 CA-C-O 99.303 -9.903 . . . . 13.23 107.106 165.646 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' ASN . . . . . 1.504 ' C ' ' CA ' ' C' ' 126' ' ' ASN . 51.0 t-20 -50.32 -55.37 15.81 Favored 'General case' 3 CA--C 1.755 8.851 3 CA-C-N 141.358 10.981 . . . . 13.65 114.715 165.777 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' LYS . . . . . . . . . . . . 0.373 0.8 OUTLIER -41.33 -48.5 3.66 Favored 'General case' 1 C--N 1.124 -9.223 4 CA-C-O 147.319 12.961 . . . . 13.98 116.072 173.983 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' PHE . . . . . 1.594 ' CZ ' ' CE1' ' C' ' 128' ' ' PHE 0.754 4.7 t80 -64.53 -73.38 0.12 Allowed 'General case' 4 C--O 1.477 13.029 4 O-C-N 95.866 -16.771 . . . . 13.37 89.709 -172.081 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' LEU . . . . . 1.495 ' CG ' ' CB ' ' C' ' 129' ' ' LEU 0.475 0.1 OUTLIER -84.82 -63.83 1.26 Allowed 'General case' 3 C--N 1.072 -11.496 4 CA-C-O 100.531 -9.319 . . . . 13.08 93.601 -169.698 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 130' ' ' ALA . . . . . 1.344 ' CA ' ' N ' ' C' ' 130' ' ' ALA 0.447 . . -36.31 -27.19 0.01 OUTLIER 'General case' 4 N--CA 1.905 22.317 3 CA-C-N 152.045 15.839 . . . . 12.75 107.999 168.916 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' ASN . . . . . 1.514 ' CB ' ' CA ' ' C' ' 131' ' ' ASN 0.473 0.3 OUTLIER -95.47 -36.98 11.11 Favored 'General case' 2 N--CA 1.167 -14.58 3 CA-C-N 147.245 13.657 . . . . 14.05 114.532 -173.168 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' ASP . . . . . 0.658 ' O ' HD23 ' C' ' 136' ' ' LEU 0.613 0.8 OUTLIER -64.08 -36.48 84.15 Favored 'General case' 2 C--O 1.436 10.917 5 O-C-N 107.365 -9.585 . . . . 14.99 99.803 176.386 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' SER . . . . . 1.556 ' CA ' ' CB ' ' C' ' 133' ' ' SER 0.592 59.9 m -74.53 -85.33 0.04 OUTLIER 'General case' 3 N--CA 1.113 -17.278 4 C-N-CA 159.203 15.001 . . . . 13.47 94.393 -160.3 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 134' ' ' THR . . . . . 1.524 ' N ' ' CA ' ' C' ' 134' ' ' THR 0.951 21.7 m -46.98 -58.2 4.21 Favored 'General case' 4 N--CA 1.705 12.297 2 O-C-N 142.529 12.393 . . . . 11.67 104.609 176.428 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 135' ' ' VAL . . . . . 1.487 ' CB ' ' CG2' ' C' ' 135' ' ' VAL 0.382 1.3 m -78.67 -37.47 20.74 Favored 'Isoleucine or valine' 2 C--O 1.65 22.168 4 O-C-N 100.294 -14.004 . . . . 11.95 95.174 -154.921 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 136' ' ' LEU . . . . . 1.605 ' CA ' ' CB ' ' C' ' 136' ' ' LEU 0.331 1.6 mm? -64.5 -22.13 66.88 Favored 'General case' 3 C--O 1.377 7.791 3 O-C-N 100.692 -13.755 . . . . 11.91 102.375 -178.267 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 137' ' ' THR . . . . . 1.524 ' CA ' ' N ' ' C' ' 137' ' ' THR . 1.9 m -103.77 -69.77 0.79 Allowed 'General case' 3 C--O 1.709 25.289 3 CA-C-O 101.932 -8.651 . . . . 11.54 93.292 -176.912 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' C' C ' 138' ' ' SER . . . . . 1.577 ' CA ' ' CB ' ' C' ' 138' ' ' SER 0.415 27.8 m 36.91 -64.6 0.0 OUTLIER 'General case' 3 C--N 1.143 -8.374 4 CA-C-N 166.558 22.436 . . . . 12.62 145.677 173.506 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' C' C ' 139' ' ' LYS . . . . . 1.458 ' CG ' ' CB ' ' C' ' 139' ' ' LYS . 0.1 OUTLIER -31.91 -36.83 0.02 OUTLIER 'General case' 2 N--CA 1.328 -6.553 2 CA-C-O 160.59 19.281 . . . . 13.54 109.338 169.691 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' C' C ' 140' ' ' TYR . . . . . 1.666 ' CG ' ' CB ' ' C' ' 140' ' ' TYR 0.402 0.1 OUTLIER -138.23 138.44 38.51 Favored 'General case' 2 N--CA 1.067 -19.614 5 O-C-N 90.577 -20.077 . . . . 14.62 135.072 141.207 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' C' C ' 141' ' ' ARG . . . . . 1.536 ' NE ' ' CD ' ' C' ' 141' ' ' ARG 0.606 1.4 mpt_? . . . . . 2 C--O 1.839 32.112 4 CA-C-N 96.218 -9.537 . . . . 15.41 104.389 172.901 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' MET . . . . . 1.449 ' CA ' ' N ' ' D' ' 1' ' ' MET 0.599 0.0 OUTLIER . . . . . 2 N--CA 1.798 16.971 2 CA-C-O 159.598 18.809 . . . . 14.31 76.283 . . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' LEU . . . . . 1.618 ' CB ' ' CG ' ' D' ' 2' ' ' LEU 1.143 0.0 OUTLIER 171.29 -33.34 0.0 OUTLIER 'General case' 2 C--N 1.572 10.251 4 CA-C-O 66.637 -25.458 . . . . 13.31 67.344 -166.635 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' THR . . . . . 1.43 ' CA ' ' N ' ' D' ' 3' ' ' THR 0.707 0.2 OUTLIER 63.19 103.88 0.03 OUTLIER 'General case' 3 N--CA 1.811 17.618 3 CA-C-N 166.701 22.5 . . . . 13.17 94.013 -168.128 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' ALA . . . . . 1.25 ' C ' ' CA ' ' D' ' 4' ' ' ALA 0.356 . . -94.45 133.77 37.68 Favored 'General case' 3 N--CA 1.944 24.242 4 C-N-CA 62.292 -23.763 . . . . 11.98 117.062 167.945 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' GLU . . . . . 1.248 ' CD ' ' CG ' ' D' ' 5' ' ' GLU 0.306 28.1 mp0 -118.75 138.78 52.43 Favored 'General case' 3 N--CA 0.596 -43.16 2 C-N-CA 171.604 19.962 . . . . 13.4 104.323 -25.501 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' GLU . . . . . 1.585 ' CB ' ' CA ' ' D' ' 6' ' ' GLU 0.375 1.8 pt-20 99.93 86.03 0.0 OUTLIER 'General case' 1 C--O 1.631 21.177 3 C-N-CA 170.876 19.671 . . . . 15.22 111.875 -108.461 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' LYS . . . . . 1.269 ' O ' ' CA ' ' D' ' 8' ' ' ALA 1.334 0.0 OUTLIER 135.95 105.34 0.0 OUTLIER 'General case' 4 C--O 0.695 -28.082 3 O-C-N 164.7 26.25 . . . . 18.76 109.139 -156.921 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ALA . . . . . 1.269 ' CA ' ' O ' ' D' ' 7' ' ' LYS . . . -176.18 55.66 0.01 OUTLIER 'General case' 4 C--O 2.08 44.775 3 O-C-N 47.19 -47.194 . . . . 16.9 110.543 15.913 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' ALA . . . . . 1.026 ' HB3' ' HB3' ' D' ' 5' ' ' GLU 0.74 . . -27.17 -81.06 0.01 OUTLIER 'General case' 1 C--N 1.466 5.64 2 CA-C-O 85.575 -16.441 . . . . 15.85 109.997 52.384 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' VAL . . . . . 1.49 ' C ' ' CA ' ' D' ' 10' ' ' VAL 0.726 0.1 OUTLIER -43.72 -24.04 0.17 Allowed 'Isoleucine or valine' 3 C--O 1.046 -9.634 4 CA-C-N 160.482 19.674 . . . . 14.65 137.115 168.888 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' THR . . . . . 1.494 ' C ' ' CA ' ' D' ' 11' ' ' THR 1.562 0.6 OUTLIER -96.11 61.51 2.1 Favored 'General case' 4 N--CA 1.827 18.4 3 CA-C-N 102.523 -6.671 . . . . 13.94 98.949 164.226 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' GLY . . . . . 1.556 ' N ' ' CA ' ' D' ' 12' ' ' GLY . . . 54.34 -86.38 0.01 OUTLIER Glycine 2 N--CA 1.682 15.053 3 O-C-N 64.523 -36.36 . . . . 14.44 97.904 -2.666 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' PHE . . . . . 0.663 ' O ' ' O ' ' D' ' 14' ' ' TRP 0.748 36.8 t80 -52.61 -56.47 15.13 Favored 'General case' 1 N--CA 1.618 7.953 3 CA-C-N 103.182 -6.509 . . . . 15.14 105.848 172.763 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' TRP . . . . . 1.659 ' CE3' ' CZ3' ' D' ' 14' ' ' TRP 1.032 0.0 OUTLIER -6.0 -137.1 0.0 OUTLIER 'General case' 4 N--CA 1.083 -18.801 4 CA-C-N 140.396 10.544 . . . . 15.08 106.217 170.829 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' GLY . . . . . 0.842 ' N ' ' CA ' ' D' ' 14' ' ' TRP . . . -61.61 117.61 12.09 Favored Glycine 3 C--N 0.985 -18.932 3 O-C-N 143.498 12.998 . . . . 14.7 91.084 -174.249 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' LYS . . . . . 1.53 ' CD ' ' CB ' ' D' ' 16' ' ' LYS 0.533 2.3 mtpt 97.29 87.85 0.01 OUTLIER 'General case' 4 C--O 1.454 11.816 4 C-N-CA 159.533 15.133 . . . . 15.74 110.54 -165.247 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' VAL . . . . . 1.531 ' C ' ' CA ' ' D' ' 17' ' ' VAL 0.74 2.3 m -176.02 155.11 0.31 Allowed 'Isoleucine or valine' 3 N--CA 1.199 -12.993 3 C-N-CA 158.054 14.541 . . . . 14.02 100.029 -170.162 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ASP . . . . . 1.542 ' CA ' ' CB ' ' D' ' 18' ' ' ASP 0.583 6.1 t0 -122.83 142.75 50.42 Favored 'General case' 2 C--O 0.756 -24.917 4 CA-C-O 166.984 22.326 . . . . 13.41 130.775 167.612 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' VAL . . . . . 1.296 ' CB ' ' CG2' ' D' ' 19' ' ' VAL 0.784 1.5 t -78.39 -163.62 0.06 OUTLIER 'Isoleucine or valine' 3 C--N 1.507 7.454 2 O-C-N 76.241 -29.037 . . . . 13.3 117.853 176.55 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' ASP . . . . . 1.41 ' C ' ' N ' ' D' ' 21' ' ' VAL 0.804 0.4 OUTLIER 33.02 -64.75 0.0 OUTLIER 'General case' 2 C--N 1.14 -8.513 5 C-N-CA 171.302 19.841 . . . . 13.1 82.922 -156.695 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' VAL . . . . . 1.41 ' N ' ' C ' ' D' ' 20' ' ' ASP 0.281 0.4 OUTLIER -62.01 -41.96 93.05 Favored 'Isoleucine or valine' 3 N--CA 1.077 -19.101 2 CA-C-O 94.17 -12.348 . . . . 12.3 115.747 -167.02 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' VAL . . . . . 1.651 ' CB ' ' CG1' ' D' ' 22' ' ' VAL 0.873 2.4 t -49.26 -64.84 0.26 Allowed 'Isoleucine or valine' 1 N--CA 1.324 -6.751 2 CA-C-O 146.606 12.622 . . . . 12.78 120.516 167.601 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' GLY . . . . . 0.691 ' N ' HD12 ' D' ' 67' ' ' LEU . . . -45.19 -42.44 8.75 Favored Glycine 3 CA--C 1.309 -12.816 3 O-C-N 89.949 -20.469 . . . . 13.04 111.351 176.642 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' ALA . . . . . . . . . . . . . . . -82.1 -31.09 30.89 Favored 'General case' 1 CA--C 1.289 -9.062 1 CA-C-O 104.124 -7.608 . . . . 12.97 105.222 -172.301 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' GLN . . . . . 1.29 ' CG ' ' CD ' ' D' ' 25' ' ' GLN 0.72 1.0 OUTLIER -36.93 -65.75 0.27 Allowed 'General case' 2 C--O 0.908 -16.909 2 C-N-CA 159.83 15.252 . . . . 12.72 112.673 150.488 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ALA . . . . . 1.398 ' C ' ' CA ' ' D' ' 26' ' ' ALA 0.426 . . -70.48 -64.05 0.97 Allowed 'General case' 2 CA--C 1.897 14.317 3 CA-C-O 99.885 -9.626 . . . . 11.41 97.167 -177.522 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' LEU . . . . . 1.517 ' CD1' ' CG ' ' D' ' 27' ' ' LEU . 0.2 OUTLIER -61.51 -16.47 47.73 Favored 'General case' 1 N--CA 1.333 -6.276 1 O-C-N 140.231 10.957 . . . . 11.92 120.833 -174.759 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' GLY . . . . . 0.918 ' C ' ' HE3' ' D' ' 54' ' ' MET . . . -93.83 -26.73 14.04 Favored Glycine 2 C--O 1.466 14.656 1 CA-C-O 104.574 -8.903 . . . . 14.0 111.567 178.888 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' ARG . . . . . 0.489 ' HG3' HG11 ' D' ' 112' ' ' VAL 0.412 1.5 mmt180 -75.02 -40.22 60.68 Favored 'General case' 2 C--N 0.953 -16.663 3 C-N-CA 148.218 10.607 . . . . 14.08 111.516 176.555 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' LEU . . . . . 1.337 ' C ' ' CA ' ' D' ' 30' ' ' LEU 0.909 62.1 tp -71.29 -50.35 33.48 Favored 'General case' 2 CA--C 1.941 15.998 4 C-N-CA 140.607 7.563 . . . . 14.99 109.165 177.71 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' LEU . . . . . 1.562 ' CB ' ' CA ' ' D' ' 31' ' ' LEU 0.36 0.1 OUTLIER -65.91 -60.66 2.64 Favored 'General case' 3 CA--C 1.809 10.934 3 CA-C-O 96.147 -11.406 . . . . 14.99 96.019 175.279 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' VAL . . . . . 0.653 HG11 ' HA ' ' D' ' 50' ' ' ALA . 1.5 m -73.19 -37.93 53.49 Favored 'Isoleucine or valine' 4 C--O 1.038 -10.052 2 CA-C-O 89.727 -14.463 . . . . 13.02 100.598 -179.586 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' VAL . . . . . 0.612 HG22 ' O ' ' D' ' 33' ' ' VAL 0.575 0.4 OUTLIER -72.15 -48.81 47.4 Favored 'Isoleucine or valine' 4 C--N 1.115 -9.593 1 CA-C-N 145.608 12.913 . . . . 12.84 117.836 -168.973 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' TYR . . . . . 1.514 ' CA ' ' N ' ' D' ' 34' ' ' TYR 0.807 4.4 m-85 -106.95 85.99 2.18 Favored Pre-proline 2 N--CA 1.726 13.329 2 CA-C-O 100.252 -9.451 . . . . 14.86 87.427 -172.5 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' PRO . . . . . 1.387 ' N ' ' CD ' ' D' ' 35' ' ' PRO 0.61 37.6 Cg_endo -48.7 -31.94 20.45 Favored 'Trans proline' 3 C--O 0.976 -12.596 2 CA-C-O 87.639 -13.567 . . . . 14.73 109.445 176.069 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' TRP . . . . . 1.488 ' C ' ' CA ' ' D' ' 36' ' ' TRP . 1.2 p90 -63.1 -27.33 69.32 Favored 'General case' 4 N--CA 1.797 16.91 3 O-C-N 147.89 15.744 . . . . 15.58 86.717 -168.149 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' THR . . . . . 0.768 ' HB ' ' O ' ' D' ' 34' ' ' TYR 0.817 0.3 OUTLIER -39.39 -51.37 2.1 Favored 'General case' 3 C--O 1.534 16.041 2 CA-C-O 140.523 9.725 . . . . 15.52 125.669 -178.408 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' GLN . . . . . 1.501 ' CD ' ' CG ' ' D' ' 38' ' ' GLN . 32.3 tt0 -46.57 -35.92 6.32 Favored 'General case' 1 C--O 0.988 -12.704 3 O-C-N 102.809 -12.432 . . . . 15.27 125.936 176.835 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' ARG . . . . . 1.5 ' CD ' ' NE ' ' D' ' 39' ' ' ARG 0.305 1.5 ttp180 -49.51 -25.81 2.96 Favored 'General case' 2 C--N 1.579 10.577 4 O-C-N 148.756 16.285 . . . . 13.41 123.138 174.346 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' PHE . . . . . 1.546 ' CZ ' ' CE2' ' D' ' 40' ' ' PHE 0.536 1.0 OUTLIER -84.49 -53.23 5.57 Favored 'General case' 2 C--N 0.983 -15.331 3 CA-C-N 98.907 -8.315 . . . . 14.73 120.546 178.895 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' PHE . . . . . 1.632 ' CE2' ' CD2' ' D' ' 41' ' ' PHE 0.931 0.0 OUTLIER -73.22 75.9 1.3 Allowed 'General case' 4 CA--C 1.289 -9.096 2 O-C-N 136.216 8.448 . . . . 13.96 99.93 178.145 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' GLN . . . . . 1.445 ' CG ' ' CA ' ' D' ' 42' ' ' GLN 0.334 3.2 mt-30 -108.94 -7.16 15.46 Favored 'General case' 4 C--N 1.832 21.558 3 O-C-N 93.579 -18.201 . . . . 13.48 127.257 178.469 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' HIS . . . . . 1.562 ' CA ' ' CB ' ' D' ' 43' ' ' HIS 0.464 0.0 OUTLIER -2.1 -67.76 0.0 OUTLIER 'General case' 2 C--N 0.937 -17.329 1 C-N-CA 162.97 16.508 . . . . 15.38 105.713 135.916 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' PHE . . . . . 1.498 ' CB ' ' CA ' ' D' ' 44' ' ' PHE 0.641 18.2 m-30 -48.99 -80.46 0.01 OUTLIER 'General case' 4 N--CA 1.012 -22.337 3 C-N-CA 150.264 11.426 . . . . 17.25 135.595 173.606 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' GLY . . . . . 0.812 ' C ' ' CA ' ' D' ' 46' ' ' ASN . . . 147.23 -120.34 1.24 Allowed Glycine 2 C--O 0.961 -16.966 3 CA-C-N 142.559 11.527 . . . . 15.58 121.378 172.189 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' ASN . . . . . 1.499 ' CA ' ' N ' ' D' ' 46' ' ' ASN 0.731 5.6 t-20 -50.23 90.37 0.0 OUTLIER 'General case' 1 N--CA 1.685 11.296 4 CA-C-O 103.951 -7.69 . . . . 13.92 119.657 176.217 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' LEU . . . . . 1.584 ' CB ' ' CA ' ' D' ' 47' ' ' LEU 0.495 0.0 OUTLIER -127.94 28.61 5.54 Favored 'General case' 3 C--N 1.0 -14.595 3 CA-C-O 138.361 8.696 . . . . 13.24 105.737 -179.516 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' SER . . . . . 1.254 ' CB ' ' OG ' ' D' ' 48' ' ' SER 0.817 0.0 OUTLIER -73.55 34.44 0.08 Allowed 'General case' 2 C--O 1.521 15.391 2 CA-C-N 96.594 -9.366 . . . . 12.24 119.413 -177.069 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' SER . . . . . 0.814 ' O ' ' CG1' ' D' ' 53' ' ' VAL . 9.4 p 136.25 129.47 0.0 OUTLIER 'General case' 1 N--CA 1.661 10.121 1 N-CA-C 96.511 -5.366 . . . . 13.26 96.511 -165.492 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' ALA . . . . . 1.37 ' CA ' ' C ' ' D' ' 50' ' ' ALA 0.342 . . -46.5 -39.27 10.53 Favored 'General case' 3 CA--C 1.908 14.735 3 CA-C-O 90.169 -14.253 . . . . 11.73 92.617 -177.872 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' GLY . . . . . 1.262 ' C ' ' N ' ' D' ' 52' ' ' ALA . . . 150.27 -92.7 0.14 Allowed Glycine 1 C--N 1.075 -13.934 4 CA-C-O 155.404 19.335 . . . . 12.65 77.386 -5.491 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' ALA . . . . . 1.509 ' CA ' ' CB ' ' D' ' 52' ' ' ALA 0.683 . . -123.74 39.64 3.91 Favored 'General case' 4 C--N 1.875 23.418 3 O-C-N 87.781 -20.835 . . . . 12.89 115.223 -167.624 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' VAL . . . . . 1.404 ' CB ' ' CG2' ' D' ' 53' ' ' VAL 0.62 0.8 OUTLIER -98.1 -40.1 9.17 Favored 'Isoleucine or valine' 3 N--CA 0.951 -25.392 2 C-N-CA 156.586 13.954 . . . . 12.16 79.243 -177.315 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' MET . . . . . 1.375 ' CG ' ' SD ' ' D' ' 54' ' ' MET 0.328 24.6 mmt -80.82 -48.62 12.18 Favored 'General case' 3 C--O 1.734 26.597 3 O-C-N 110.568 -7.582 . . . . 14.02 102.197 175.183 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' ASN . . . . . 1.261 ' CG ' ' OD1' ' D' ' 55' ' ' ASN 0.904 0.8 OUTLIER -58.48 -60.78 3.26 Favored 'General case' 3 N--CA 0.938 -26.059 2 CA-C-N 139.133 9.97 . . . . 15.52 113.407 -178.595 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' ASN . . . . . 1.328 ' C ' ' O ' ' D' ' 56' ' ' ASN 1.047 0.1 OUTLIER 19.4 67.3 0.24 Allowed Pre-proline 3 C--O 1.656 22.495 4 C-N-CA 161.201 15.8 . . . . 13.03 112.323 -175.892 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' PRO . . . . . 1.424 ' CB ' ' CA ' ' D' ' 57' ' ' PRO 0.605 7.6 Cg_endo -44.28 -50.29 7.96 Favored 'Trans proline' 4 N--CA 1.16 -18.107 2 CA-C-N 142.711 9.147 . . . . 14.62 111.715 -168.954 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' LYS . . . . . 1.381 ' CE ' ' NZ ' ' D' ' 58' ' ' LYS 0.533 0.0 OUTLIER -24.84 -78.08 0.01 OUTLIER 'General case' 1 C--N 1.174 -7.065 4 C-N-CA 151.924 12.09 . . . . 15.02 98.351 173.317 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' VAL . . . . . 1.604 ' CB ' ' CG2' ' D' ' 59' ' ' VAL 0.622 57.8 t -49.39 -88.6 0.0 OUTLIER 'Isoleucine or valine' 4 CA--C 1.837 11.999 3 CA-C-O 94.483 -12.199 . . . . 14.67 93.554 -176.399 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' LYS . . . . . 1.618 ' CD ' ' CE ' ' D' ' 60' ' ' LYS . 1.3 mttp -15.98 -72.99 0.01 OUTLIER 'General case' 3 C--O 1.46 12.172 1 O-C-N 147.322 15.389 . . . . 14.48 112.86 174.674 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' ALA . . . . . 1.527 ' CA ' ' CB ' ' D' ' 61' ' ' ALA 0.311 . . -22.32 -77.49 0.01 OUTLIER 'General case' 2 N--CA 1.18 -13.946 4 CA-C-O 159.514 18.769 . . . . 13.74 119.81 163.059 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' HIS . . . . . 1.55 ' ND1' ' CG ' ' D' ' 62' ' ' HIS 0.276 3.0 t60 -43.38 -22.61 0.04 OUTLIER 'General case' 2 C--O 1.085 -7.567 2 O-C-N 92.81 -18.681 . . . . 13.41 121.61 168.493 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' GLY . . . . . 0.651 ' O ' ' HB ' ' D' ' 66' ' ' VAL . . . -78.49 -50.53 6.07 Favored Glycine 4 C--O 1.563 20.688 5 N-CA-C 92.98 -8.048 . . . . 15.65 92.98 -175.073 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' LYS . . . . . 1.566 ' CG ' ' CD ' ' D' ' 64' ' ' LYS . 0.9 OUTLIER -37.86 -82.61 0.01 OUTLIER 'General case' 4 C--O 0.834 -20.766 2 C-N-CA 140.243 7.417 . . . . 16.11 109.913 177.359 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' ARG . . . . . 1.548 ' C ' ' CA ' ' D' ' 65' ' ' ARG 0.433 0.1 OUTLIER -63.48 -9.62 13.74 Favored 'General case' 3 N--CA 1.27 -9.454 1 CA-C-O 94.603 -12.142 . . . . 17.81 115.078 -178.679 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' VAL . . . . . 1.04 ' N ' ' CA ' ' D' ' 65' ' ' ARG . 1.8 t -85.54 -58.61 3.34 Favored 'Isoleucine or valine' 3 C--N 0.931 -17.611 2 O-C-N 156.589 21.181 . . . . 14.28 108.566 170.484 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' LEU . . . . . 1.485 ' CA ' ' CB ' ' D' ' 67' ' ' LEU 0.683 10.9 mt -62.95 -41.97 99.68 Favored 'General case' 4 CA--C 1.857 12.773 3 CA-C-O 88.837 -14.887 . . . . 13.9 103.07 171.643 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' ASP . . . . . 1.511 ' CB ' ' CG ' ' D' ' 68' ' ' ASP 0.659 0.7 OUTLIER -55.9 -43.61 77.42 Favored 'General case' 3 N--CA 0.922 -26.852 3 O-C-N 136.595 8.684 . . . . 14.74 106.135 175.835 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' ALA . . . . . 1.521 ' C ' ' CA ' ' D' ' 69' ' ' ALA 0.45 . . -61.07 -55.54 31.37 Favored 'General case' 3 C--N 1.021 -13.695 3 O-C-N 96.452 -16.405 . . . . 15.7 116.612 -162.22 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' PHE . . . . . 1.318 ' HA ' ' O ' ' D' ' 70' ' ' PHE 0.284 86.0 t80 -91.55 -47.31 7.48 Favored 'General case' 3 C--O 1.976 39.308 4 CA-C-O 70.167 -23.777 . . . . 17.22 119.19 175.155 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' THR . . . . . 1.45 ' CB ' ' CG2' ' D' ' 71' ' ' THR 0.506 1.2 m 83.53 50.88 0.01 OUTLIER 'General case' 3 C--N 1.0 -14.624 5 CA-C-O 153.439 15.876 . . . . 17.96 135.723 9.981 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' GLN . . . . . 1.207 HE21 ' N ' ' D' ' 73' ' ' GLY 0.308 0.0 OUTLIER 133.9 -102.37 0.0 OUTLIER 'General case' 3 C--N 1.175 -6.994 3 CA-C-O 79.82 -19.181 . . . . 14.44 109.659 -115.848 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' GLY . . . . . 1.53 ' CA ' ' C ' ' D' ' 73' ' ' GLY . . . 2.49 -62.21 0.0 OUTLIER Glycine 3 N--CA 1.102 -23.582 4 C-N-CA 158.708 17.337 . . . . 12.94 94.876 178.272 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' LEU . . . . . 0.988 ' O ' HD11 ' D' ' 77' ' ' LEU 0.666 1.5 mm? -57.66 -41.63 81.91 Favored 'General case' 4 N--CA 1.031 -21.409 4 C-N-CA 164.338 17.055 . . . . 13.05 84.493 -148.138 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' LYS . . . . . 1.585 ' CG ' ' CD ' ' D' ' 75' ' ' LYS 0.727 0.0 OUTLIER -37.38 -112.94 0.0 OUTLIER 'General case' 4 C--O 1.896 35.106 3 C-N-CA 143.531 8.732 . . . . 14.78 99.145 167.571 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' HIS . . . . . 1.583 ' CB ' ' CG ' ' D' ' 76' ' ' HIS 0.615 21.7 p80 -94.39 112.98 24.78 Favored 'General case' 3 N--CA 1.72 13.05 1 CA-C-N 134.553 7.888 . . . . 16.98 111.121 -176.709 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' LEU . . . . . 1.436 ' CB ' ' CG ' ' D' ' 77' ' ' LEU 0.452 4.1 mp -76.17 -36.53 58.66 Favored 'General case' 3 N--CA 1.303 -7.809 4 CA-C-O 146.345 12.498 . . . . 14.54 111.413 178.484 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' ASP . . . . . 1.469 ' CB ' ' CG ' ' D' ' 78' ' ' ASP 0.833 0.0 OUTLIER 143.21 -64.12 0.0 OUTLIER 'General case' 2 CA--C 1.851 12.521 4 O-C-N 71.222 -32.174 . . . . 15.31 89.547 25.857 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' ASP . . . . . 1.408 ' CB ' ' CA ' ' D' ' 79' ' ' ASP 0.704 3.1 t0 -140.57 59.27 1.55 Allowed 'General case' 1 N--CA 1.216 -12.154 2 CA-C-N 93.916 -10.583 . . . . 14.14 118.357 -176.325 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.03 -46.39 16.58 Favored 'General case' 1 C--O 1.05 -9.442 3 CA-C-O 103.804 -7.76 . . . . 16.69 119.224 177.654 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' LYS . . . . . 1.611 ' CB ' ' CA ' ' D' ' 81' ' ' LYS 0.905 0.1 OUTLIER -46.3 -20.36 0.11 Allowed 'General case' 4 C--O 1.039 -10.009 4 O-C-N 152.809 18.818 . . . . 16.98 128.64 178.097 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' GLY . . . . . 0.522 ' H ' ' HD3' ' D' ' 81' ' ' LYS . . . -55.53 -93.04 0.01 OUTLIER Glycine 1 C--N 1.48 8.535 4 CA-C-O 159.365 21.536 . . . . 16.24 95.289 -173.227 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' ALA . . . . . 1.365 ' CA ' ' C ' ' D' ' 83' ' ' ALA 0.476 . . -35.79 -62.2 0.43 Allowed 'General case' 2 CA--C 1.9 14.422 4 O-C-N 99.913 -13.698 . . . . 15.35 99.049 -163.19 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' PHE . . . . . 1.604 ' CD1' ' CG ' ' D' ' 84' ' ' PHE 1.403 0.4 OUTLIER -122.02 37.64 4.32 Favored 'General case' 1 C--N 1.453 5.067 5 CA-C-O 147.724 13.154 . . . . 14.38 125.003 173.148 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' ALA . . . . . 1.152 ' CA ' ' N ' ' D' ' 85' ' ' ALA 0.435 . . -60.9 -36.22 78.69 Favored 'General case' 2 N--CA 2.078 30.97 3 CA-C-N 89.462 -12.608 . . . . 14.22 108.021 177.855 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' GLN . . . . . 1.59 ' CB ' ' CA ' ' D' ' 86' ' ' GLN 0.638 5.6 pt20 -31.38 -42.55 0.05 OUTLIER 'General case' 3 C--O 0.987 -12.763 3 C-N-CA 143.674 8.79 . . . . 16.9 115.32 155.542 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' LEU . . . . . 1.448 ' CB ' ' CA ' ' D' ' 87' ' ' LEU 0.535 0.0 OUTLIER -116.13 -17.94 10.72 Favored 'General case' 2 N--CA 1.055 -20.188 1 O-C-N 145.237 14.086 . . . . 13.54 106.792 -173.384 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' SER . . . . . 1.489 ' CA ' ' CB ' ' D' ' 88' ' ' SER 0.447 2.3 t -82.26 57.17 3.49 Favored 'General case' 1 CA--C 1.268 -9.897 2 O-C-N 110.944 -7.347 . . . . 13.39 99.033 162.254 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' GLY . . . . . . . . . . . . . . . -123.43 -65.84 0.21 Allowed Glycine 4 C--N 1.047 -15.488 4 O-C-N 97.55 -15.718 . . . . 13.67 85.81 170.821 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' LEU . . . . . 1.543 ' CB ' ' CG ' ' D' ' 90' ' ' LEU . 0.0 OUTLIER -82.23 -38.29 24.73 Favored 'General case' 4 C--O 0.87 -18.89 4 C-N-CA 158.587 14.755 . . . . 12.73 113.305 -141.791 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' HIS . . . . . 0.682 ' HA ' ' HG ' ' D' ' 95' ' ' LEU . 22.9 m80 -87.43 -51.0 6.18 Favored 'General case' 2 C--N 1.581 10.631 3 CA-C-O 82.103 -18.094 . . . . 13.1 97.016 -178.021 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' CYS . . . . . 1.41 ' C ' ' CA ' ' D' ' 92' ' ' CYS 0.271 40.6 t -61.61 -82.01 0.02 OUTLIER 'General case' 3 CA--C 1.881 13.699 2 O-C-N 162.017 24.573 . . . . 12.09 107.806 174.634 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' ASN . . . . . 1.518 ' CB ' ' CG ' ' D' ' 93' ' ' ASN 0.64 2.0 m120 -57.77 -45.53 85.84 Favored 'General case' 3 N--CA 1.227 -11.593 2 CA-C-O 94.427 -12.225 . . . . 13.18 113.191 -172.93 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' LYS . . . . . 1.456 ' CD ' ' CE ' ' D' ' 94' ' ' LYS 0.756 0.0 OUTLIER -87.58 -70.05 0.65 Allowed 'General case' 2 N--CA 1.263 -9.795 5 O-C-N 157.505 21.753 . . . . 14.61 133.514 175.746 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' LEU . . . . . 1.313 ' CB ' ' CG ' ' D' ' 95' ' ' LEU 0.718 0.0 OUTLIER -88.7 -6.09 57.69 Favored 'General case' 3 C--N 0.921 -18.025 3 C-N-CA 102.467 -7.693 . . . . 14.95 119.135 168.217 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' HIS . . . . . 1.444 ' C ' ' CA ' ' D' ' 96' ' ' HIS . 0.9 OUTLIER 79.52 90.3 0.05 Allowed 'General case' 4 N--CA 1.801 17.102 5 O-C-N 99.745 -14.347 . . . . 16.47 96.443 168.253 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' VAL . . . . . 0.83 ' CG2' HD12 ' D' ' 95' ' ' LEU 0.785 20.6 t -106.09 116.26 49.48 Favored 'Isoleucine or valine' 3 C--O 1.06 -8.917 2 CA-C-O 90.578 -14.058 . . . . 16.08 114.195 -170.095 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' ASN . . . . . 0.414 ' O ' ' N ' ' D' ' 100' ' ' GLN . 1.5 m120 -37.69 114.18 0.71 Allowed Pre-proline 3 C--N 1.102 -10.155 3 CA-C-N 143.315 11.871 . . . . 17.9 130.947 174.215 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' PRO . . . . . 1.434 ' CG ' ' CB ' ' D' ' 99' ' ' PRO . 71.6 Cg_exo -24.03 -41.14 0.03 OUTLIER 'Trans proline' 2 CA--C 1.316 -10.392 2 CA-C-O 151.09 12.871 . . . . 15.06 120.87 -178.49 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' GLN . . . . . 1.519 ' CB ' ' CG ' ' D' ' 100' ' ' GLN 0.784 0.9 OUTLIER -65.37 -58.03 6.9 Favored 'General case' 3 N--CA 1.564 5.229 3 O-C-N 91.249 -19.657 . . . . 13.87 90.816 -146.806 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' ASN . . . . . 1.529 ' CA ' ' N ' ' D' ' 101' ' ' ASN 1.091 0.1 OUTLIER -51.46 -26.31 7.95 Favored 'General case' 3 N--CA 1.678 10.965 4 O-C-N 138.726 10.016 . . . . 14.56 131.74 178.896 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' PHE . . . . . 1.347 ' CA ' ' N ' ' D' ' 102' ' ' PHE 0.797 12.2 m-30 -70.24 -57.74 4.55 Favored 'General case' 2 N--CA 1.899 22.018 4 CA-C-O 88.824 -14.893 . . . . 15.22 83.92 -175.351 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' ARG . . . . . 1.561 ' CG ' ' CD ' ' D' ' 103' ' ' ARG 1.638 0.1 OUTLIER -80.2 -10.4 59.76 Favored 'General case' 2 C--N 1.092 -10.625 4 CA-C-O 157.969 18.033 . . . . 14.68 131.413 -166.592 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' LEU . . . . . 1.467 ' CB ' ' CG ' ' D' ' 104' ' ' LEU 0.264 0.6 OUTLIER -73.63 -54.77 7.36 Favored 'General case' 1 N--CA 1.317 -7.108 3 O-C-N 100.971 -13.58 . . . . 14.91 103.291 -179.888 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' LEU . . . . . 1.552 ' CG ' ' CD1' ' D' ' 105' ' ' LEU 0.301 6.0 tt -89.2 -21.26 23.36 Favored 'General case' 3 C--O 1.489 13.686 5 O-C-N 98.207 -15.308 . . . . 14.63 91.116 -179.445 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' GLY . . . . . 0.496 ' HA3' ' CG1' ' D' ' 133' ' ' VAL . . . -73.45 -42.82 39.83 Favored Glycine 2 N--CA 1.336 -7.995 3 CA-C-N 152.099 15.863 . . . . 14.63 115.517 174.49 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' ASN . . . . . 1.525 ' N ' ' CA ' ' D' ' 107' ' ' ASN 0.747 1.0 OUTLIER -65.75 -48.35 72.15 Favored 'General case' 3 N--CA 1.694 11.771 4 CA-C-O 98.171 -10.442 . . . . 14.09 90.817 -173.973 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' VAL . . . . . 1.467 ' O ' ' CA ' ' D' ' 108' ' ' VAL 0.75 2.3 t -45.95 -35.0 2.0 Favored 'Isoleucine or valine' 4 C--O 0.729 -26.337 2 CA-C-N 130.571 6.078 . . . . 13.74 118.324 162.719 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' LEU . . . . . 1.499 ' CD2' ' CG ' ' D' ' 109' ' ' LEU 0.848 0.2 OUTLIER -72.9 -75.5 0.14 Allowed 'General case' 3 N--CA 0.966 -24.645 4 CA-C-O 95.668 -11.634 . . . . 14.26 101.013 -177.881 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' ALA . . . . . 1.537 ' CA ' ' N ' ' D' ' 110' ' ' ALA 0.97 . . -18.36 -52.22 0.01 OUTLIER 'General case' 4 CA--C 2.017 18.928 4 O-C-N 146.555 14.909 . . . . 15.54 90.839 170.159 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' LEU . . . . . 1.267 ' C ' ' CA ' ' D' ' 112' ' ' VAL 0.272 0.0 OUTLIER -88.05 -52.5 5.22 Favored 'General case' 4 N--CA 1.21 -12.449 3 CA-C-O 88.826 -14.892 . . . . 16.18 108.08 -162.586 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' VAL . . . . . 1.525 ' CB ' ' CG1' ' D' ' 112' ' ' VAL 0.687 1.1 m -78.45 -20.55 13.25 Favored 'Isoleucine or valine' 3 C--N 0.844 -21.385 4 O-C-N 143.039 12.712 . . . . 15.41 105.419 -177.267 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' VAL . . . . . 0.425 ' CG2' HD13 ' D' ' 109' ' ' LEU 0.779 0.0 OUTLIER -84.75 -63.92 1.14 Allowed 'Isoleucine or valine' 2 CA--C 1.332 -7.434 3 O-C-N 141.776 11.923 . . . . 14.39 84.823 -178.164 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' ALA . . . . . 0.677 ' N ' ' O ' ' D' ' 110' ' ' ALA . . . -70.09 14.1 0.13 Allowed 'General case' 2 N--CA 1.627 8.423 1 CA-C-O 101.057 -9.068 . . . . 13.13 112.135 -175.857 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' ARG . . . . . 1.461 ' CB ' ' CA ' ' D' ' 115' ' ' ARG 0.867 0.0 OUTLIER -97.68 -55.0 2.94 Favored 'General case' 3 C--N 1.033 -13.186 4 CA-C-O 144.991 11.853 . . . . 14.8 118.64 161.052 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' ASN . . . . . 1.391 ' C ' ' N ' ' D' ' 117' ' ' PHE 1.511 0.0 OUTLIER -12.29 -67.6 0.01 OUTLIER 'General case' 2 C--N 1.611 11.938 3 O-C-N 88.478 -21.389 . . . . 12.17 111.999 151.198 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' PHE . . . . . 1.391 ' N ' ' C ' ' D' ' 116' ' ' ASN 0.665 2.0 m-85 -113.48 5.21 16.59 Favored 'General case' 3 C--N 1.715 16.468 2 CA-C-O 97.187 -10.911 . . . . 12.97 108.116 179.111 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' GLY . . . . . . . . . . . . . . . 82.77 -147.36 25.06 Favored Glycine 3 CA--C 1.194 -19.978 4 CA-C-N 145.67 12.941 . . . . 12.36 114.445 144.73 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' GLY . . . . . 1.525 ' CA ' ' N ' ' D' ' 119' ' ' GLY . . . -73.8 -41.95 40.26 Favored Glycine 2 N--CA 1.72 17.606 4 O-C-N 96.922 -15.458 . . . . 11.6 94.997 -166.096 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' GLN . . . . . 1.608 ' CB ' ' CG ' ' D' ' 120' ' ' GLN 0.305 13.2 mt-30 -41.44 -35.32 0.66 Allowed 'General case' 2 C--O 0.955 -14.396 4 O-C-N 96.833 -15.51 . . . . 12.6 98.705 177.536 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' PHE . . . . . 1.564 ' CA ' ' CB ' ' D' ' 121' ' ' PHE 0.707 0.1 OUTLIER -79.44 50.34 1.1 Allowed 'General case' 1 C--O 1.044 -9.756 2 N-CA-C 138.628 10.233 . . . . 15.11 138.628 176.914 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' THR . . . . . 0.63 ' H ' HG12 ' D' ' 125' ' ' VAL 0.672 1.3 p -41.26 172.35 0.03 OUTLIER Pre-proline 3 CA--C 1.24 -10.962 2 N-CA-C 130.622 7.267 . . . . 13.44 130.622 -166.429 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' PRO . . . . . 1.642 ' CG ' ' CD ' ' D' ' 123' ' ' PRO 1.042 18.4 Cg_exo -58.28 -42.93 51.29 Favored 'Trans proline' 3 CA--C 1.891 18.342 0 CA-C-O 128.977 3.657 . . . . 12.96 116.245 170.786 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' ASN . . . . . 1.456 ' CG ' ' CB ' ' D' ' 124' ' ' ASN 0.666 0.2 OUTLIER -52.52 -97.84 0.0 OUTLIER 'General case' 4 CA--C 1.827 11.61 4 CA-C-O 98.106 -10.473 . . . . 14.55 97.263 159.553 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' VAL . . . . . 0.63 HG12 ' H ' ' D' ' 122' ' ' THR 0.987 0.4 OUTLIER -40.35 -49.01 0.62 Allowed 'Isoleucine or valine' 4 C--O 1.626 20.914 1 O-C-N 134.796 7.56 . . . . 14.36 102.062 -176.074 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' GLN . . . . . 1.123 ' OE1' ' CD ' ' D' ' 126' ' ' GLN . 0.0 OUTLIER -71.62 -51.3 23.92 Favored 'General case' 4 N--CA 1.565 5.325 3 O-C-N 104.057 -11.652 . . . . 15.38 112.173 -173.57 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' ALA . . . . . 1.527 ' CB ' ' CA ' ' D' ' 127' ' ' ALA 0.891 . . -76.09 -70.84 0.42 Allowed 'General case' 2 C--O 1.387 8.337 4 CA-C-O 77.446 -20.312 . . . . 15.57 90.312 -170.734 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' LEU . . . . . 1.476 ' CA ' ' N ' ' D' ' 128' ' ' LEU 1.142 0.1 OUTLIER -26.65 -74.59 0.02 OUTLIER 'General case' 3 N--CA 1.725 13.275 3 CA-C-N 155.776 17.534 . . . . 16.69 96.908 -170.374 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' PHE . . . . . 1.491 ' CA ' ' N ' ' D' ' 129' ' ' PHE . 59.7 m-85 -46.58 -32.82 3.67 Favored 'General case' 3 N--CA 1.759 14.977 5 O-C-N 160.523 23.639 . . . . 15.02 128.259 -171.191 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' GLN . . . . . 1.362 ' CG ' ' CA ' ' D' ' 130' ' ' GLN 0.846 0.3 OUTLIER -55.76 -35.89 66.71 Favored 'General case' 3 CA--C 1.727 7.772 4 O-C-N 101.767 -13.083 . . . . 14.14 95.954 178.238 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' LYS . . . . . 1.538 ' CB ' ' CG ' ' D' ' 131' ' ' LYS 1.061 0.0 OUTLIER -94.8 -7.33 40.68 Favored 'General case' 2 C--O 1.027 -10.608 2 O-C-N 105.863 -10.523 . . . . 12.73 111.538 178.45 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' VAL . . . . . 1.483 ' CA ' ' N ' ' D' ' 132' ' ' VAL 0.593 1.1 m -69.61 -31.16 47.79 Favored 'Isoleucine or valine' 3 N--CA 1.723 13.183 2 C-N-CA 90.627 -12.429 . . . . 13.85 110.629 -179.126 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' VAL . . . . . 0.496 ' CG1' ' HA3' ' D' ' 106' ' ' GLY 0.643 0.8 OUTLIER -46.29 -44.9 6.04 Favored 'Isoleucine or valine' 1 C--N 1.139 -8.567 4 O-C-N 137.303 9.127 . . . . 14.37 122.478 -177.667 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 134' ' ' ALA . . . . . . . . . . . . 0.282 . . -73.75 -98.58 0.01 OUTLIER 'General case' 3 CA--C 1.686 6.177 3 C-N-CA 149.37 11.068 . . . . 14.0 83.547 -172.106 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' D' D ' 135' ' ' GLY . . . . . . . . . . . . . . . -54.33 -36.21 57.16 Favored Glycine 3 CA--C 1.182 -20.779 5 CA-C-O 91.644 -16.086 . . . . 13.58 102.823 -170.481 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' D' D ' 136' ' ' VAL . . . . . 0.712 HG13 ' CE1' ' D' ' 84' ' ' PHE 0.688 21.6 t -79.07 -35.75 17.79 Favored 'Isoleucine or valine' 3 C--O 1.569 17.89 3 CA-C-N 144.129 13.965 . . . . 12.61 101.332 -175.41 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 137' ' ' ALA . . . . . 0.968 ' HB1' HD13 ' D' ' 140' ' ' LEU 0.554 . . -132.81 65.01 1.6 Allowed 'General case' 3 C--O 1.012 -11.435 5 C-N-CA 91.594 -12.042 . . . . 12.4 82.606 -168.543 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 138' ' ' ASN . . . . . 1.423 ' CA ' ' N ' ' D' ' 138' ' ' ASN 0.777 0.8 OUTLIER -120.68 -58.75 1.81 Allowed 'General case' 4 N--CA 1.817 17.923 3 C-N-CA 167.187 18.195 . . . . 12.11 108.251 145.911 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 139' ' ' ALA . . . . . 0.49 ' O ' ' N ' ' D' ' 142' ' ' HIS 0.805 . . -19.43 -60.25 0.02 OUTLIER 'General case' 1 C--N 1.209 -5.531 4 CA-C-N 154.756 17.071 . . . . 10.84 108.446 144.931 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 140' ' ' LEU . . . . . 1.514 ' CG ' ' CD1' ' D' ' 140' ' ' LEU 0.982 0.6 OUTLIER -43.33 -55.68 3.93 Favored 'General case' 2 C--O 1.001 -11.977 3 CA-C-O 100.018 -9.563 . . . . 11.45 102.615 178.749 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 141' ' ' ALA . . . . . 1.443 ' C ' ' N ' ' D' ' 142' ' ' HIS . . . -72.44 -11.84 60.85 Favored 'General case' 4 CA--C 1.857 12.787 2 CA-C-N 132.398 6.908 . . . . 11.21 101.129 -170.132 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' D' D ' 142' ' ' HIS . . . . . 1.49 ' CB ' ' CA ' ' D' ' 142' ' ' HIS 0.999 0.2 OUTLIER -102.3 98.76 8.84 Favored 'General case' 4 C--O 0.905 -17.06 4 C-N-CA 97.473 -9.691 . . . . 12.09 94.222 -172.775 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 143' ' ' LYS . . . . . 1.469 ' CE ' ' CD ' ' D' ' 143' ' ' LYS 0.526 0.0 OUTLIER 174.39 -65.93 0.01 OUTLIER 'General case' 2 C--O 1.626 20.912 5 O-C-N 151.128 17.767 . . . . 14.22 141.109 110.872 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' D' D ' 144' ' ' TYR . . . . . 1.556 ' CZ ' ' CE1' ' D' ' 144' ' ' TYR 1.288 10.8 t80 -7.44 -84.29 0.0 OUTLIER 'General case' 2 C--O 1.532 15.957 3 O-C-N 78.559 -27.588 . . . . 14.55 118.416 -161.434 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' D' D ' 145' ' ' HIS . . . . . 1.457 ' C ' ' CA ' ' D' ' 145' ' ' HIS 1.342 0.0 OUTLIER . . . . . 4 C--O 1.747 27.253 5 O-C-N 145.609 14.318 . . . . 16.63 146.623 -169.036 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HEM . . . . . 1.672 ' CMA' ' C3A' ' A' ' 142' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' HEM . . . . . 1.612 ' C3D' ' CAD' ' B' ' 146' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 142' ' ' HEM . . . . . 1.646 ' CAB' ' C3B' ' C' ' 142' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 146' ' ' HEM . . . . . 1.615 ' CBA' ' CAA' ' D' ' 146' ' ' HEM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_