data_4nfc_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 4nfc _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' ' ' MET . . . . . 0.612 ' O ' ' N ' ' A' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.202 -1.395 0 CA-C-O 118.745 -0.645 . . . . 92.84 110.554 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.344 0.8 OUTLIER -58.84 30.19 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 119.511 3.152 . . . . 99.2 119.511 -169.487 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' TYR . . . . . 0.612 ' N ' ' O ' ' A' ' 1' ' ' MET . 69.8 m-85 -90.35 144.82 25.46 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.758 -1.571 . . . . 75.7 106.758 152.427 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.38 -150.48 20.74 Favored Glycine 0 C--N 1.312 -0.799 0 N-CA-C 110.992 -0.843 . . . . 54.72 110.992 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -116.99 131.78 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 109.24 -0.652 . . . . 43.92 109.24 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . 0.954 ' O ' ' O ' ' A' ' 203' ' ' HOH . 93.5 m -105.35 126.15 51.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.879 0.696 . . . . 51.41 112.879 177.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -135.85 145.65 53.71 Favored Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.678 . . . . 52.36 110.662 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -54.33 141.83 70.47 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.391 2.061 . . . . 65.87 110.284 169.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . 0.879 ' NZ ' ' O ' ' A' ' 210' ' ' HOH . 4.4 tppp? -73.75 -30.03 62.56 Favored 'General case' 0 C--O 1.2 -1.52 0 N-CA-C 113.375 0.879 . . . . 76.46 113.375 -178.4 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -141.27 146.47 36.83 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.866 0.691 . . . . 81.17 112.866 -175.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -144.85 153.06 41.2 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.064 0.394 . . . . 56.55 112.064 169.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.6 m -129.25 139.36 51.86 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.063 -0.517 . . . . 81.61 111.762 176.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -147.48 152.95 38.9 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.959 -0.296 . . . . 62.8 111.508 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 138.38 35.48 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.903 -0.319 . . . . 75.35 110.742 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.36 142.48 7.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.945 -1.131 . . . . 92.18 107.945 171.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.99 -12.12 4.16 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 114.153 0.421 . . . . 70.6 114.153 -173.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.69 -169.37 42.5 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 111.273 -0.731 . . . . 66.18 111.273 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.7 m -129.5 145.81 51.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 122.615 0.366 . . . . 69.86 110.523 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -133.05 148.03 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 121.495 0.664 . . . . 58.95 112.721 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -112.87 120.54 41.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.683 -1.229 . . . . 64.29 107.683 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 50.6 mt -95.01 110.85 52.22 Favored Pre-proline 0 C--N 1.328 -0.335 0 N-CA-C 108.683 -0.858 . . . . 42.13 108.683 171.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.18 153.04 21.47 Favored 'Trans proline' 0 C--N 1.332 -0.302 0 C-N-CA 124.076 3.184 . . . . 48.88 111.323 -176.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -151.3 150.58 30.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.513 -0.475 . . . . 47.46 111.475 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . 0.456 ' N ' ' O ' ' A' ' 203' ' ' HOH . 68.0 m -137.99 147.6 44.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 105.968 -1.864 . . . . 59.12 105.968 173.609 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 53.9 p90 -133.28 155.37 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.149 -1.02 . . . . 44.35 112.794 173.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -145.39 144.93 30.95 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.089 -0.708 . . . . 69.26 109.089 176.369 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 21.1 p90 -139.52 145.01 41.88 Favored Pre-proline 0 N--CA 1.446 -0.649 0 N-CA-C 108.002 -1.11 . . . . 60.82 108.002 -175.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -91.45 -11.26 2.43 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 121.893 1.729 . . . . 62.16 112.809 -177.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 1.8 m-90 -82.45 157.3 23.69 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 119.93 -0.708 . . . . 59.75 110.816 -178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -78.61 132.87 37.27 Favored 'General case' 0 N--CA 1.423 -1.804 0 N-CA-C 105.308 -2.108 . . . . 70.91 105.308 167.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 49.7 mt -78.62 154.62 30.11 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 113.088 0.773 . . . . 50.87 113.088 178.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.61 167.72 10.53 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.381 -0.372 . . . . 57.81 110.503 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 19.9 mm -53.54 -56.62 7.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 108.955 -0.757 . . . . 71.89 108.955 174.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -96.19 89.49 0.59 Allowed Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 108.609 -0.886 . . . . 63.84 108.609 174.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -65.11 -22.89 61.2 Favored 'Trans proline' 0 C--N 1.328 -0.522 0 C-N-CA 122.009 1.806 . . . . 54.48 114.013 -173.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 15.68 74.41 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.804 2.15 . . . . 58.76 116.804 -163.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -67.26 127.07 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.018 -0.992 . . . . 42.3 110.228 173.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 -119.13 138.64 52.77 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.754 -0.832 . . . . 66.83 108.754 176.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.4 mt -121.16 133.36 68.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 120.695 -0.402 . . . . 41.81 111.78 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.5 p -137.88 157.98 45.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.119 0.485 . . . . 33.65 110.985 172.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -121.9 131.7 54.17 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.307 -0.86 . . . . 35.2 110.257 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.3 mtp180 -118.47 151.33 38.02 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.755 0.822 . . . . 41.51 109.226 178.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -126.63 165.88 18.37 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.297 0.851 . . . . 66.89 113.297 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.49 -62.34 3.1 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.481 -0.866 . . . . 56.65 111.295 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -154.33 166.2 33.95 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.987 0.422 . . . . 52.37 111.811 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -49.97 -45.67 51.75 Favored 'General case' 0 C--O 1.191 -2.019 0 O-C-N 121.841 -0.537 . . . . 48.01 110.747 -172.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -96.3 29.42 2.86 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.934 0.397 . . . . 51.13 111.098 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -83.57 -176.15 51.23 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 117.441 1.736 . . . . 41.79 117.441 -174.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.74 118.93 7.79 Favored 'General case' 0 C--O 1.194 -1.821 0 C-N-CA 125.728 1.611 . . . . 69.93 113.155 -177.432 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -71.2 135.94 47.79 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.983 -0.687 . . . . 47.9 109.634 175.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -124.48 -5.33 7.68 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.281 -0.567 . . . . 33.97 112.208 -177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -154.99 132.83 11.46 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.328 -0.233 . . . . 40.58 110.887 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.5 t -142.51 138.88 31.24 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.0 -0.545 . . . . 39.87 111.06 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.7 p -83.91 -23.33 31.23 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.783 0.66 . . . . 43.9 112.783 179.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -163.87 105.83 0.92 Allowed Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.032 0.382 . . . . 72.72 112.032 -171.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.51 140.93 59.3 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 125.552 -0.603 . . . . 57.45 111.249 -1.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -56.6 118.48 5.32 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 123.285 2.657 . . . . 45.68 111.742 -178.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.7 p -152.38 144.24 23.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.207 0.527 . . . . 45.76 112.028 174.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.73 133.67 42.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 115.322 -0.854 . . . . 41.9 110.178 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -66.7 138.75 57.64 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.624 0.726 . . . . 50.32 112.752 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . 0.891 ' O ' ' O ' ' A' ' 214' ' ' HOH . 29.0 tttm -25.47 -53.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.099 1.359 . . . . 66.78 112.932 169.17 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -67.38 -15.64 63.8 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 114.361 1.245 . . . . 59.91 114.361 -170.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -113.7 -0.68 14.2 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 115.218 1.562 . . . . 48.2 115.218 -174.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.4 t -53.06 132.09 15.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 119.75 -0.78 . . . . 43.52 111.839 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 70.2 7.46 6.23 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.655 -0.702 . . . . 43.04 112.057 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 31.9 mtm105 -121.6 0.59 9.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.038 1.125 . . . . 55.09 114.038 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.3 mt -124.64 140.59 52.79 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.587 0.232 . . . . 43.46 111.323 -172.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -144.39 124.8 13.88 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.807 -0.633 . . . . 50.26 110.146 169.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.4 tp -99.62 109.63 22.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.59 -0.522 . . . . 38.2 109.59 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -85.07 98.66 10.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.738 -0.838 . . . . 54.54 108.738 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -174.21 133.18 0.4 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.615 -0.72 . . . . 50.94 110.305 -177.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.7 136.8 54.93 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.252 -1.018 . . . . 78.68 108.252 172.394 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -46.72 145.13 2.03 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 107.879 -1.156 . . . . 84.93 107.879 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 101.43 -32.41 7.52 Favored Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.83 -0.508 . . . . 60.14 111.83 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -86.94 163.85 16.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.297 -0.631 . . . . 87.22 109.297 174.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -131.18 30.89 4.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.724 0.773 . . . . 60.84 110.666 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.31 154.52 33.51 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 107.305 -1.369 . . . . 56.26 107.305 -172.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.27 -163.11 36.79 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.693 -0.765 . . . . 43.22 114.077 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -155.63 157.48 36.79 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.784 -0.766 . . . . 55.2 112.213 173.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 23.0 tp -108.94 117.74 34.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.904 -1.044 . . . . 38.65 108.789 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 68.3 ttt-85 -94.91 115.58 27.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.927 -0.579 . . . . 75.14 111.376 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.7 mt -106.19 126.27 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.169 -1.049 . . . . 52.61 108.169 172.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 82.7 p -126.48 171.73 10.8 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.086 -0.245 . . . . 55.05 111.248 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . 0.992 ' OD1' ' O ' ' A' ' 213' ' ' HOH . 21.0 m120 57.58 43.92 21.77 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 123.501 0.501 . . . . 69.38 109.966 -174.543 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.72 129.42 41.08 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 114.057 1.132 . . . . 59.42 114.057 -171.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . 0.444 ' CB ' ' OE1' ' A' ' 88' ' ' GLU . 12.0 mtp180 -95.8 -178.29 4.32 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.815 -1.084 . . . . 70.64 108.251 172.325 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.25 -38.84 30.15 Favored 'General case' 0 C--O 1.196 -1.724 0 N-CA-C 109.198 -0.667 . . . . 86.33 109.198 177.831 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . 0.444 ' OE1' ' CB ' ' A' ' 86' ' ' ARG . 1.4 pm0 -64.93 -14.37 59.73 Favored 'General case' 0 C--O 1.206 -1.233 0 C-N-CA 119.576 -0.849 . . . . 79.79 112.179 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -66.05 -12.0 52.25 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 114.035 1.124 . . . . 53.03 114.035 175.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.9 tt0 -75.78 119.79 20.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.948 -0.39 . . . . 60.12 109.948 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 t 177.61 -175.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 49.71 110.428 -166.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.2 t -109.81 133.89 53.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.036 -0.727 . . . . 49.14 109.036 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -118.04 127.94 54.29 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.814 0.696 . . . . 48.79 111.473 -172.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -118.66 133.78 55.6 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 123.422 0.451 . . . . 39.43 111.971 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.3 t -98.85 126.11 44.42 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.598 -0.728 . . . . 37.6 110.921 174.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.63 133.37 54.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.971 0.891 . . . . 50.41 110.981 177.316 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.2 t -119.25 127.49 75.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 107.36 -1.348 . . . . 35.01 107.36 -175.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -116.12 137.29 52.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.568 -0.901 . . . . 59.88 108.568 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.2 pp -149.11 155.37 40.61 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 121.991 -0.443 . . . . 45.22 111.831 -178.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -92.14 126.13 37.1 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 124.171 0.92 . . . . 53.68 110.25 174.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 27.3 p -98.6 163.05 12.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.645 -0.707 . . . . 43.73 110.187 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ARG . . . . . . . . . . . . . 40.5 ttt85 -63.54 -46.49 85.75 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.357 -0.537 . . . . 72.09 112.035 -178.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.31 -8.02 8.7 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.908 1.448 . . . . 75.49 114.908 -169.983 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.9 m -114.15 16.15 18.12 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 113.573 0.953 . . . . 57.18 113.573 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 60.77 -158.73 28.27 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 110.198 -1.161 . . . . 45.83 110.198 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.75 129.25 37.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.658 -0.497 . . . . 74.78 109.658 -173.488 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 204' ' ' HOH . 21.5 mm100 -124.62 156.6 37.2 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.549 0.53 . . . . 40.44 110.993 -178.836 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.37 139.19 46.66 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.595 0.961 . . . . 53.32 113.595 -179.052 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.5 mt -124.3 136.88 54.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.137 -1.06 . . . . 40.84 108.137 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -147.48 142.91 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.352 -0.539 . . . . 40.22 111.307 178.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.0 t -57.66 139.48 53.61 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 106.214 -1.773 . . . . 45.52 106.214 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -73.66 -54.68 14.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.312 0.577 . . . . 45.96 111.785 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.2 mtpt -103.24 -12.22 17.45 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 119.313 -0.955 . . . . 64.63 112.857 -172.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 70.63 -163.09 53.49 Favored Glycine 0 N--CA 1.447 -0.59 0 CA-C-O 121.591 0.551 . . . . 44.13 113.924 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.0 m -119.79 116.55 26.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.549 -0.538 . . . . 48.93 109.549 -179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 20.4 tptp -78.55 126.84 31.31 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.573 -0.529 . . . . 66.85 109.573 177.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 51.5 tp -115.02 119.42 36.4 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.506 -0.478 . . . . 50.67 110.951 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 18.8 p -105.04 128.08 53.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.971 -0.752 . . . . 66.62 108.971 175.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 22.6 mm -99.86 127.78 52.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.201 0.524 . . . . 61.29 111.711 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 102.37 111.982 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.0 mmt . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 121.121 0.486 . . . . 132.23 109.956 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 45.72 58.87 3.99 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.462 2.305 . . . . 101.86 112.978 -172.053 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -91.62 154.22 19.19 Favored 'General case' 0 N--CA 1.401 -2.899 0 N-CA-C 105.395 -2.076 . . . . 73.58 105.395 159.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.4 -144.82 15.36 Favored Glycine 0 C--N 1.304 -1.218 0 C-N-CA 119.447 -1.358 . . . . 52.01 111.539 178.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 93.5 t -120.0 132.06 70.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.629 0.252 . . . . 43.9 110.773 -173.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 43.0 m -110.38 124.33 51.51 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.024 0.75 . . . . 55.03 113.024 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -135.49 142.86 42.79 Favored Pre-proline 0 C--O 1.237 0.415 0 C-N-CA 124.6 1.16 . . . . 51.76 109.049 176.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -48.53 148.34 8.22 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.196 2.597 . . . . 58.09 110.943 168.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -35.92 61.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.696 0.628 . . . . 70.91 112.696 -179.676 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -138.94 150.75 46.26 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.543 0.571 . . . . 77.74 112.543 -172.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 86.0 mt -150.05 156.09 41.04 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.625 -0.261 . . . . 56.31 110.991 170.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -131.65 147.13 52.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.204 -0.453 . . . . 73.48 110.827 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -158.48 150.27 21.3 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.974 0.416 . . . . 64.19 111.914 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.24 141.63 36.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.116 -0.493 . . . . 74.76 110.894 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -50.71 145.74 6.55 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.252 -0.979 . . . . 84.46 108.368 171.365 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.2 1.47 13.95 Favored Glycine 0 CA--C 1.521 0.427 0 O-C-N 123.314 0.384 . . . . 76.83 113.026 -174.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -91.69 -170.16 41.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.923 -0.656 . . . . 62.65 111.762 177.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.67 138.72 52.3 Favored 'General case' 0 C--O 1.196 -1.721 0 C-N-CA 124.939 1.296 . . . . 68.21 113.208 177.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.0 p -127.66 149.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 N-CA-C 112.562 0.579 . . . . 54.97 112.562 173.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -114.67 116.26 28.43 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.665 -1.235 . . . . 67.94 107.665 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 28.3 mt -90.25 110.69 42.33 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 107.854 -1.165 . . . . 41.15 107.854 171.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -80.08 154.81 22.53 Favored 'Trans proline' 0 C--N 1.334 -0.221 0 C-N-CA 123.652 2.901 . . . . 47.49 110.789 -177.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -154.2 143.3 21.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.477 -0.489 . . . . 48.31 111.987 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 50.5 m -133.76 147.24 51.27 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 106.268 -1.753 . . . . 57.07 106.268 174.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -132.82 155.9 48.13 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 119.378 -0.929 . . . . 45.83 112.291 174.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -143.93 145.02 31.97 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.052 0.845 . . . . 71.56 109.501 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -145.04 142.82 18.94 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.773 -0.649 . . . . 58.8 109.306 -175.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -91.7 -9.24 2.83 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 120.489 0.793 . . . . 62.55 112.875 -176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -84.41 155.05 22.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.06 -1.056 . . . . 61.15 110.038 179.946 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 56.7 tt0 -76.33 132.69 39.93 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 106.936 -1.505 . . . . 75.61 106.936 166.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 53.5 mt -76.13 160.01 30.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.757 0.651 . . . . 56.68 112.757 -179.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.87 173.72 7.02 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.124 -0.325 . . . . 54.78 110.124 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 23.8 mm -56.06 -58.88 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 108.558 -0.904 . . . . 68.43 108.558 173.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.48 90.86 1.09 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 108.203 -1.036 . . . . 61.55 108.203 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.05 -18.46 45.94 Favored 'Trans proline' 0 C--N 1.329 -0.477 0 C-N-CA 121.986 1.791 . . . . 55.32 112.681 -171.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 18.02 77.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 116.871 2.174 . . . . 60.64 116.871 -166.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 40.1 t -68.58 126.74 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 CA-C-N 114.563 -1.199 . . . . 40.8 111.098 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -122.58 133.94 54.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.697 -0.853 . . . . 77.03 108.697 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 4.7 mt -117.48 135.83 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.428 -0.509 . . . . 38.34 109.955 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 68.5 p -139.92 156.92 46.44 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.618 -0.433 . . . . 33.25 110.267 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -122.5 137.68 54.8 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.79 -0.641 . . . . 33.63 110.394 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 6.7 mtp180 -122.7 146.4 47.52 Favored 'General case' 0 C--O 1.186 -2.256 0 C-N-CA 125.725 1.61 . . . . 44.11 109.636 -179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -121.92 163.89 18.51 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.15 0.796 . . . . 64.55 113.15 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.67 -76.6 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.053 -1.219 . . . . 63.67 110.053 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -143.74 170.44 15.86 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.028 0.442 . . . . 57.6 111.643 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -49.65 -48.33 49.41 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.814 -0.63 . . . . 48.37 110.915 -172.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -96.1 26.57 4.12 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.166 0.508 . . . . 56.53 111.238 -176.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLY . . . . . . . . . . . . . . . -79.66 -174.21 46.13 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 117.344 1.698 . . . . 47.77 117.344 -174.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -63.8 124.43 21.47 Favored 'General case' 0 C--O 1.2 -1.516 0 CA-C-N 113.672 -1.264 . . . . 65.03 111.799 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -73.95 136.0 43.25 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.677 -0.86 . . . . 45.24 108.677 174.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -122.66 -7.17 8.57 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 119.932 -0.707 . . . . 36.0 112.285 -178.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -154.23 133.15 12.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.511 0.196 . . . . 40.69 110.593 178.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 29.1 t -144.17 141.8 30.16 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.887 -0.597 . . . . 44.33 110.722 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 56.0 p -85.48 -24.02 27.54 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.455 0.539 . . . . 42.35 112.455 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ARG . . . . . 0.819 ' NH1' ' O ' ' B' ' 217' ' ' HOH . 0.0 OUTLIER -163.27 106.65 0.99 Allowed Pre-proline 0 N--CA 1.431 -1.397 0 CA-C-N 116.343 -0.389 . . . . 84.06 110.667 -172.278 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -69.08 139.58 53.44 Favored 'Cis proline' 0 C--N 1.316 -1.16 0 N-CA-C 109.186 -1.121 . . . . 53.15 109.186 1.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.43 118.75 5.53 Favored 'Trans proline' 0 C--O 1.221 -0.349 0 C-N-CA 122.378 2.052 . . . . 46.6 111.087 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 95.3 p -154.63 147.14 24.07 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 118.141 0.428 . . . . 43.63 111.961 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ILE . . . . . . . . . . . . . 11.4 tt -143.25 135.61 24.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.922 -0.581 . . . . 40.47 109.707 -178.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -69.67 140.33 53.59 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.162 0.801 . . . . 50.75 113.162 -176.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -22.24 -59.17 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.68 -1.145 . . . . 72.94 112.926 167.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -66.76 -10.26 45.34 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.452 1.278 . . . . 62.55 114.452 -169.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -116.61 -4.37 11.71 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.364 1.616 . . . . 46.27 115.364 -175.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 92.1 t -49.25 131.41 7.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 C-N-CA 119.524 -0.87 . . . . 46.32 111.478 178.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 71.06 6.99 6.05 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.219 -0.9 . . . . 43.33 112.803 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -121.1 -1.41 9.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.559 0.948 . . . . 55.96 113.559 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 11.8 mt -121.06 140.81 51.44 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 111.916 0.339 . . . . 42.67 111.916 -174.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -144.85 124.89 13.56 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.728 -0.669 . . . . 49.38 109.732 168.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 42.7 tp -96.71 113.91 25.51 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.273 -0.64 . . . . 39.55 109.273 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -85.19 99.42 11.08 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.634 -0.826 . . . . 53.8 108.924 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -173.98 130.34 0.4 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.761 -0.654 . . . . 50.09 110.515 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.1 140.57 49.34 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.255 -1.017 . . . . 72.02 108.255 168.807 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 57.7 tt0 -51.1 147.15 5.56 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.495 -0.928 . . . . 79.57 108.495 177.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . 101.54 -29.33 12.73 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.788 -0.925 . . . . 58.28 110.788 -173.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -89.42 163.59 15.22 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.493 -0.416 . . . . 87.01 110.193 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -132.16 33.8 3.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.505 0.669 . . . . 53.43 111.446 178.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 1.2 t -159.38 149.93 19.37 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.113 -1.81 . . . . 54.52 106.113 -168.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 171.8 -162.96 35.38 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.714 -0.755 . . . . 39.75 114.375 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -156.05 155.8 33.29 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.615 0.721 . . . . 52.16 112.639 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 16.5 tp -106.81 114.04 27.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.939 -1.028 . . . . 39.09 108.703 172.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -90.99 118.84 30.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.152 -0.619 . . . . 67.07 111.209 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.65 131.43 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 108.023 -1.103 . . . . 49.59 108.023 170.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 83.5 p -127.09 175.5 8.07 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.518 0.562 . . . . 53.01 112.518 -179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 45.73 52.72 9.33 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.272 0.558 . . . . 69.15 110.257 -169.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 57.9 mt -56.36 131.64 48.8 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.207 0.817 . . . . 56.0 113.207 -172.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ARG . . . . . 1.103 ' CD ' ' O ' ' B' ' 218' ' ' HOH . 11.5 mtp180 -102.25 176.35 5.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.887 -1.051 . . . . 72.49 108.883 174.415 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 tptt -79.1 -32.05 44.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 120.439 -0.504 . . . . 77.61 109.954 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -66.18 -14.67 62.25 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.056 -0.52 . . . . 74.0 111.356 177.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -73.28 -8.24 54.98 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.574 0.583 . . . . 55.95 112.574 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -75.36 118.0 17.78 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.771 -0.826 . . . . 60.81 108.771 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 7.6 t 176.93 -176.74 0.14 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.117 0.484 . . . . 50.79 110.437 -166.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.1 t -108.08 136.42 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.516 -0.92 . . . . 50.38 108.516 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -119.51 129.1 54.53 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 124.11 0.964 . . . . 46.77 111.566 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -119.56 130.99 55.42 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.297 0.48 . . . . 41.46 112.297 -177.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 49.1 t -94.88 125.39 39.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.958 -0.564 . . . . 37.39 110.787 174.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . 0.282 0.0 OUTLIER -120.27 138.65 53.56 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-O 123.449 1.595 . . . . 49.82 115.167 171.507 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 35.9 t -123.15 124.67 70.61 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 CA-C-N 114.046 -1.434 . . . . 34.04 107.179 -173.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -113.13 140.96 47.45 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.221 -1.029 . . . . 55.5 108.221 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 2.0 pp -152.64 155.6 37.64 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 122.188 -0.32 . . . . 43.17 111.758 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -92.29 126.86 37.55 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 124.179 0.924 . . . . 52.87 110.627 176.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 62.3 p -98.02 160.02 14.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.905 -0.589 . . . . 42.37 109.849 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ARG . . . . . . . . . . . . . 29.9 ttt85 -60.68 -46.47 90.24 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.793 0.664 . . . . 70.46 112.793 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.23 -4.16 6.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.905 1.446 . . . . 75.99 114.905 -171.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 67.0 m -115.48 20.75 14.55 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.73 1.011 . . . . 54.19 113.73 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.22 -159.82 14.12 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.91 -0.662 . . . . 47.13 111.862 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.15 130.88 40.64 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.044 -0.724 . . . . 77.84 109.044 -175.282 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' GLN . . . . . 0.825 ' NE2' ' O ' ' B' ' 202' ' ' HOH . 17.0 mm100 -125.93 157.73 36.98 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.423 -0.584 . . . . 42.55 109.423 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -132.48 135.71 46.21 Favored 'General case' 0 C--O 1.198 -1.652 0 N-CA-C 113.545 0.942 . . . . 53.03 113.545 -177.536 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.1 mt -120.78 139.49 53.04 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.727 -0.472 . . . . 38.58 109.727 177.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -150.69 142.61 23.89 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.603 -0.439 . . . . 38.27 111.686 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 28.2 t -56.17 140.13 45.31 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 106.508 -1.664 . . . . 45.8 106.508 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' ILE . . . . . . . . . . . . . 28.7 mm -74.83 -51.23 22.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 120.148 -0.621 . . . . 46.32 111.327 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -106.1 -12.37 15.79 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 119.548 -0.861 . . . . 71.67 112.666 -175.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . 65.07 -155.25 49.12 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 115.673 1.029 . . . . 43.19 115.673 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' THR . . . . . . . . . . . . . 54.1 m -125.82 109.37 12.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.948 -0.626 . . . . 49.2 110.637 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -73.99 127.66 33.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.849 -0.796 . . . . 67.63 108.849 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 56.0 tp -115.65 124.14 50.15 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 120.782 0.325 . . . . 52.27 110.778 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 31.0 p -109.8 121.86 46.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.305 -0.558 . . . . 67.15 109.495 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ILE . . . . . . . . . . . . . 8.6 mm -95.45 129.88 44.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.253 0.549 . . . . 66.27 112.012 -179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.749 -0.659 . . . . 117.86 111.638 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.954 ' O ' ' O ' ' A' ' 6' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.538 ' O ' ' NE2' ' A' ' 107' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . 0.879 ' O ' ' NZ ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . 0.992 ' O ' ' OD1' ' A' ' 84' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . 0.891 ' O ' ' O ' ' A' ' 61' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . 0.825 ' O ' ' NE2' ' B' ' 107' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' HOH . . . . . 0.951 ' O ' ' NH1' ' B' ' 86' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' HOH . . . . . 0.819 ' O ' ' NH1' ' B' ' 55' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 218' ' ' HOH . . . . . 1.103 ' O ' ' CD ' ' B' ' 86' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . 0.612 ' O ' ' N ' ' A' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.202 -1.395 0 CA-C-O 118.745 -0.645 . . . . 92.840000000000003 110.554 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 2' ' ' LEU 0.344 0.8 OUTLIER -58.84 30.19 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 119.511 3.152 . . . . 99.200000000000003 119.511 -169.487 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 3' ' ' TYR . . . . . 0.612 ' N ' ' O ' ' A' ' 1' ' ' MET . 69.8 m-85 -90.35 144.82 25.46 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.758 -1.571 . . . . 75.700000000000003 106.758 152.427 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.38 -150.48 20.74 Favored Glycine 0 C--N 1.312 -0.799 0 N-CA-C 110.992 -0.843 . . . . 54.719999999999999 110.992 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -116.99 131.78 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 109.24 -0.652 . . . . 43.920000000000002 109.24 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . 0.954 ' O ' ' O ' ' A' ' 203' ' ' HOH . 93.5 m -105.35 126.15 51.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.879 0.696 . . . . 51.409999999999997 112.879 177.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -135.85 145.65 53.71 Favored Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.678 . . . . 52.359999999999999 110.662 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -54.33 141.83 70.47 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.391 2.061 . . . . 65.870000000000005 110.284 169.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . 0.879 ' NZ ' ' O ' ' A' ' 210' ' ' HOH . 4.4 tppp? -73.75 -30.03 62.56 Favored 'General case' 0 C--O 1.2 -1.52 0 N-CA-C 113.375 0.879 . . . . 76.459999999999994 113.375 -178.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HIS . . . . . 0.485 ' O ' HD23 ' A' ' 11' ' ' LEU . 60.3 m80 -141.27 146.47 36.83 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.866 0.691 . . . . 81.170000000000002 112.866 -175.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 10' ' ' HIS . 67.9 mt -144.85 153.06 41.2 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.064 0.394 . . . . 56.549999999999997 112.064 169.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.6 m -129.25 139.36 51.86 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.063 -0.517 . . . . 81.609999999999999 111.762 176.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -147.48 152.95 38.9 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.959 -0.296 . . . . 62.799999999999997 111.508 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 138.38 35.48 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.903 -0.319 . . . . 75.349999999999994 110.742 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' MET . . . . . 0.557 ' HE3' ' N ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -49.36 142.48 7.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.945 -1.131 . . . . 92.180000000000007 107.945 171.55 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.99 -12.12 4.16 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 114.153 0.421 . . . . 70.599999999999994 114.153 -173.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.69 -169.37 42.5 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 111.273 -0.731 . . . . 66.180000000000007 111.273 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.7 m -129.5 145.81 51.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 122.615 0.366 . . . . 69.859999999999999 110.523 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -133.05 148.03 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 121.495 0.664 . . . . 58.950000000000003 112.721 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -112.87 120.54 41.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.683 -1.229 . . . . 64.290000000000006 107.683 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 50.6 mt -95.01 110.85 52.22 Favored Pre-proline 0 C--N 1.328 -0.335 0 N-CA-C 108.683 -0.858 . . . . 42.130000000000003 108.683 171.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.18 153.04 21.47 Favored 'Trans proline' 0 C--N 1.332 -0.302 0 C-N-CA 124.076 3.184 . . . . 48.880000000000003 111.323 -176.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -151.3 150.58 30.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.513 -0.475 . . . . 47.460000000000001 111.475 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.0 m -137.99 147.6 44.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 105.968 -1.864 . . . . 59.119999999999997 105.968 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 76' ' ' GLU . 53.9 p90 -133.28 155.37 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.149 -1.02 . . . . 44.350000000000001 112.794 173.392 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . 0.401 ' HB3' ' O ' ' A' ' 216' ' ' HOH . 0.3 OUTLIER -145.39 144.93 30.95 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.089 -0.708 . . . . 69.260000000000005 109.089 176.369 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . 0.493 ' HB2' ' CE3' ' A' ' 29' ' ' TRP . 21.1 p90 -139.52 145.01 41.88 Favored Pre-proline 0 N--CA 1.446 -0.649 0 N-CA-C 108.002 -1.11 . . . . 60.82 108.002 -175.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PRO . . . . . 0.484 ' HG3' ' CG ' ' A' ' 3' ' ' TYR . 6.0 Cg_endo -91.45 -11.26 2.43 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 121.893 1.729 . . . . 62.159999999999997 112.809 -177.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CE3' ' HB2' ' A' ' 27' ' ' TYR . 1.8 m-90 -82.45 157.3 23.69 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 119.93 -0.708 . . . . 59.75 110.816 -178.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -78.61 132.87 37.27 Favored 'General case' 0 N--CA 1.423 -1.804 0 N-CA-C 105.308 -2.108 . . . . 70.909999999999997 105.308 167.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . 0.468 HD22 HD13 ' A' ' 99' ' ' LEU . 49.7 mt -78.62 154.62 30.11 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 113.088 0.773 . . . . 50.869999999999997 113.088 178.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.61 167.72 10.53 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.381 -0.372 . . . . 57.810000000000002 110.503 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . 0.607 ' O ' ' HD3' ' A' ' 35' ' ' PRO . 19.9 mm -53.54 -56.62 7.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 108.955 -0.757 . . . . 71.890000000000001 108.955 174.489 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -96.19 89.49 0.59 Allowed Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 108.609 -0.886 . . . . 63.840000000000003 108.609 174.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PRO . . . . . 0.607 ' HD3' ' O ' ' A' ' 33' ' ' ILE . 6.6 Cg_exo -65.11 -22.89 61.2 Favored 'Trans proline' 0 C--N 1.328 -0.522 0 C-N-CA 122.009 1.806 . . . . 54.479999999999997 114.013 -173.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASN . . . . . 0.507 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 28.8 p-10 15.68 74.41 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.804 2.15 . . . . 58.759999999999998 116.804 -163.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -67.26 127.07 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.018 -0.992 . . . . 42.299999999999997 110.228 173.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . 0.632 ' HG2' ' HD2' ' A' ' 55' ' ' ARG . 82.2 mtt180 -119.13 138.64 52.77 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.754 -0.832 . . . . 66.829999999999998 108.754 176.524 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.4 mt -121.16 133.36 68.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 120.695 -0.402 . . . . 41.810000000000002 111.78 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.5 p -137.88 157.98 45.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.119 0.485 . . . . 33.649999999999999 110.985 172.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -121.9 131.7 54.17 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.307 -0.86 . . . . 35.200000000000003 110.257 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . 0.643 ' HG2' ' O ' ' A' ' 48' ' ' GLY . 7.3 mtp180 -118.47 151.33 38.02 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.755 0.822 . . . . 41.509999999999998 109.226 178.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -126.63 165.88 18.37 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.297 0.851 . . . . 66.890000000000001 113.297 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.49 -62.34 3.1 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.481 -0.866 . . . . 56.649999999999999 111.295 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -154.33 166.2 33.95 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.987 0.422 . . . . 52.369999999999997 111.811 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -49.97 -45.67 51.75 Favored 'General case' 0 C--O 1.191 -2.019 0 O-C-N 121.841 -0.537 . . . . 48.009999999999998 110.747 -172.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -96.3 29.42 2.86 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.934 0.397 . . . . 51.130000000000003 111.098 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . 0.643 ' O ' ' HG2' ' A' ' 42' ' ' ARG . . . -83.57 -176.15 51.23 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 117.441 1.736 . . . . 41.789999999999999 117.441 -174.885 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . 0.587 ' NE2' ' O ' ' A' ' 221' ' ' HOH . 0.0 OUTLIER -61.74 118.93 7.79 Favored 'General case' 0 C--O 1.194 -1.821 0 C-N-CA 125.728 1.611 . . . . 69.930000000000007 113.155 -177.432 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . 0.544 ' HA ' ' HG3' ' A' ' 42' ' ' ARG . 33.9 t -71.2 135.94 47.79 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.983 -0.687 . . . . 47.899999999999999 109.634 175.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -124.48 -5.33 7.68 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.281 -0.567 . . . . 33.969999999999999 112.208 -177.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -154.99 132.83 11.46 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.328 -0.233 . . . . 40.579999999999998 110.887 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.5 t -142.51 138.88 31.24 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.0 -0.545 . . . . 39.869999999999997 111.06 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.7 p -83.91 -23.33 31.23 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.783 0.66 . . . . 43.899999999999999 112.783 179.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ARG . . . . . 0.632 ' HD2' ' HG2' ' A' ' 38' ' ' ARG . 7.7 ttm180 -163.87 105.83 0.92 Allowed Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.032 0.382 . . . . 72.719999999999999 112.032 -171.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 57.8 Cg_endo -68.51 140.93 59.3 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 125.552 -0.603 . . . . 57.450000000000003 111.249 -1.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 56' ' ' PRO . 46.7 Cg_exo -56.6 118.48 5.32 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 123.285 2.657 . . . . 45.68 111.742 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.7 p -152.38 144.24 23.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.207 0.527 . . . . 45.759999999999998 112.028 174.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.73 133.67 42.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 115.322 -0.854 . . . . 41.899999999999999 110.178 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -66.7 138.75 57.64 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.624 0.726 . . . . 50.32 112.752 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . 0.891 ' O ' ' O ' ' A' ' 214' ' ' HOH . 29.0 tttm -25.47 -53.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.099 1.359 . . . . 66.780000000000001 112.932 169.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -67.38 -15.64 63.8 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 114.361 1.245 . . . . 59.909999999999997 114.361 -170.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . 0.532 ' HB3' ' HG ' ' A' ' 67' ' ' LEU . 94.8 m-85 -113.7 -0.68 14.2 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 115.218 1.562 . . . . 48.200000000000003 115.218 -174.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.4 t -53.06 132.09 15.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 119.75 -0.78 . . . . 43.520000000000003 111.839 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 70.2 7.46 6.23 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.655 -0.702 . . . . 43.039999999999999 112.057 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 31.9 mtm105 -121.6 0.59 9.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.038 1.125 . . . . 55.090000000000003 114.038 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . 0.532 ' HG ' ' HB3' ' A' ' 63' ' ' TYR . 9.3 mt -124.64 140.59 52.79 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.587 0.232 . . . . 43.460000000000001 111.323 -172.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -144.39 124.8 13.88 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.807 -0.633 . . . . 50.259999999999998 110.146 169.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.4 tp -99.62 109.63 22.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.59 -0.522 . . . . 38.200000000000003 109.59 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -85.07 98.66 10.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.738 -0.838 . . . . 54.539999999999999 108.738 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -174.21 133.18 0.4 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.615 -0.72 . . . . 50.939999999999998 110.305 -177.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.7 136.8 54.93 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.252 -1.018 . . . . 78.680000000000007 108.252 172.394 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -46.72 145.13 2.03 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 107.879 -1.156 . . . . 84.930000000000007 107.879 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 101.43 -32.41 7.52 Favored Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.83 -0.508 . . . . 60.140000000000001 111.83 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -86.94 163.85 16.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.297 -0.631 . . . . 87.219999999999999 109.297 174.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . 0.444 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 8.0 mt-10 -131.18 30.89 4.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.724 0.773 . . . . 60.840000000000003 110.666 178.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.31 154.52 33.51 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 107.305 -1.369 . . . . 56.259999999999998 107.305 -172.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.27 -163.11 36.79 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.693 -0.765 . . . . 43.219999999999999 114.077 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -155.63 157.48 36.79 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.784 -0.766 . . . . 55.200000000000003 112.213 173.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . 0.421 HD11 HD22 ' A' ' 67' ' ' LEU . 23.0 tp -108.94 117.74 34.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.904 -1.044 . . . . 38.649999999999999 108.789 173.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 68.3 ttt-85 -94.91 115.58 27.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.927 -0.579 . . . . 75.140000000000001 111.376 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.7 mt -106.19 126.27 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.169 -1.049 . . . . 52.609999999999999 108.169 172.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 82.7 p -126.48 171.73 10.8 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.086 -0.245 . . . . 55.049999999999997 111.248 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . 1.128 ' ND2' ' O ' ' A' ' 213' ' ' HOH . 86.7 m-20 57.58 43.92 21.77 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 123.501 0.501 . . . . 69.379999999999995 109.966 -174.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.72 129.42 41.08 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 114.057 1.132 . . . . 59.420000000000002 114.057 -171.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . 0.916 ' HB3' ' OE1' ' A' ' 88' ' ' GLU . 12.0 mtp180 -95.8 -178.29 4.32 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.815 -1.084 . . . . 70.640000000000001 108.251 172.325 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . 0.625 ' HG3' ' N ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -80.25 -38.84 30.15 Favored 'General case' 0 C--O 1.196 -1.724 0 N-CA-C 109.198 -0.667 . . . . 86.329999999999998 109.198 177.831 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . 0.916 ' OE1' ' HB3' ' A' ' 86' ' ' ARG . 1.4 pm0 -64.93 -14.37 59.73 Favored 'General case' 0 C--O 1.206 -1.233 0 C-N-CA 119.576 -0.849 . . . . 79.790000000000006 112.179 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -66.05 -12.0 52.25 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 114.035 1.124 . . . . 53.030000000000001 114.035 175.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 117' ' ' LEU . 33.4 tt0 -75.78 119.79 20.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.948 -0.39 . . . . 60.119999999999997 109.948 -179.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 t 177.61 -175.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 49.710000000000001 110.428 -166.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.2 t -109.81 133.89 53.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.036 -0.727 . . . . 49.140000000000001 109.036 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -118.04 127.94 54.29 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.814 0.696 . . . . 48.789999999999999 111.473 -172.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -118.66 133.78 55.6 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 123.422 0.451 . . . . 39.43 111.971 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.3 t -98.85 126.11 44.42 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.598 -0.728 . . . . 37.600000000000001 110.921 174.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.63 133.37 54.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.971 0.891 . . . . 50.409999999999997 110.981 177.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.2 t -119.25 127.49 75.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 107.36 -1.348 . . . . 35.009999999999998 107.36 -175.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -116.12 137.29 52.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.568 -0.901 . . . . 59.880000000000003 108.568 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . 0.468 HD13 HD22 ' A' ' 31' ' ' LEU . 1.2 pp -149.11 155.37 40.61 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 121.991 -0.443 . . . . 45.219999999999999 111.831 -178.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -92.14 126.13 37.1 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 124.171 0.92 . . . . 53.68 110.25 174.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 27.3 p -98.6 163.05 12.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.645 -0.707 . . . . 43.729999999999997 110.187 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ARG . . . . . 0.533 ' HE ' ' NH2' ' A' ' 103' ' ' ARG . 40.5 ttt85 -63.54 -46.49 85.75 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.357 -0.537 . . . . 72.090000000000003 112.035 -178.619 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . 0.533 ' NH2' ' HE ' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -122.31 -8.02 8.7 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.908 1.448 . . . . 75.489999999999995 114.908 -169.983 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.9 m -114.15 16.15 18.12 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 113.573 0.953 . . . . 57.18 113.573 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 60.77 -158.73 28.27 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 110.198 -1.161 . . . . 45.829999999999998 110.198 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.75 129.25 37.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.658 -0.497 . . . . 74.780000000000001 109.658 -173.488 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 204' ' ' HOH . 21.5 mm100 -124.62 156.6 37.2 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.549 0.53 . . . . 40.439999999999998 110.993 -178.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.37 139.19 46.66 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.595 0.961 . . . . 53.32 113.595 -179.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.5 mt -124.3 136.88 54.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.137 -1.06 . . . . 40.840000000000003 108.137 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -147.48 142.91 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.352 -0.539 . . . . 40.219999999999999 111.307 178.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.0 t -57.66 139.48 53.61 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 106.214 -1.773 . . . . 45.520000000000003 106.214 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -73.66 -54.68 14.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.312 0.577 . . . . 45.960000000000001 111.785 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.2 mtpt -103.24 -12.22 17.45 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 119.313 -0.955 . . . . 64.629999999999995 112.857 -172.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 70.63 -163.09 53.49 Favored Glycine 0 N--CA 1.447 -0.59 0 CA-C-O 121.591 0.551 . . . . 44.130000000000003 113.924 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.0 m -119.79 116.55 26.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.549 -0.538 . . . . 48.93 109.549 -179.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 20.4 tptp -78.55 126.84 31.31 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.573 -0.529 . . . . 66.849999999999994 109.573 177.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' A' ' 90' ' ' GLN . 51.5 tp -115.02 119.42 36.4 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.506 -0.478 . . . . 50.670000000000002 110.951 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 18.8 p -105.04 128.08 53.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.971 -0.752 . . . . 66.620000000000005 108.971 175.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 22.6 mm -99.86 127.78 52.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.201 0.524 . . . . 61.289999999999999 111.711 -179.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 102.37 111.982 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.0 mmt . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 121.121 0.486 . . . . 132.22999999999999 109.956 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' B' ' 2' ' ' LEU . 0.3 OUTLIER 45.72 58.87 3.99 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.462 2.305 . . . . 101.86 112.978 -172.053 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 3' ' ' TYR . . . . . 0.613 ' CD1' ' HG3' ' B' ' 28' ' ' PRO . 65.9 m-85 -91.62 154.22 19.19 Favored 'General case' 0 N--CA 1.401 -2.899 0 N-CA-C 105.395 -2.076 . . . . 73.579999999999998 105.395 159.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.4 -144.82 15.36 Favored Glycine 0 C--N 1.304 -1.218 0 C-N-CA 119.447 -1.358 . . . . 52.009999999999998 111.539 178.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 93.5 t -120.0 132.06 70.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.629 0.252 . . . . 43.899999999999999 110.773 -173.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 43.0 m -110.38 124.33 51.51 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.024 0.75 . . . . 55.030000000000001 113.024 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -135.49 142.86 42.79 Favored Pre-proline 0 C--O 1.237 0.415 0 C-N-CA 124.6 1.16 . . . . 51.759999999999998 109.049 176.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -48.53 148.34 8.22 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.196 2.597 . . . . 58.090000000000003 110.943 168.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -35.92 61.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.696 0.628 . . . . 70.909999999999997 112.696 -179.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HIS . . . . . 0.555 ' O ' HD23 ' B' ' 11' ' ' LEU . 92.5 m-70 -138.94 150.75 46.26 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.543 0.571 . . . . 77.739999999999995 112.543 -172.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . 0.555 HD23 ' O ' ' B' ' 10' ' ' HIS . 86.0 mt -150.05 156.09 41.04 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.625 -0.261 . . . . 56.310000000000002 110.991 170.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -131.65 147.13 52.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.204 -0.453 . . . . 73.480000000000004 110.827 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -158.48 150.27 21.3 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.974 0.416 . . . . 64.189999999999998 111.914 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.24 141.63 36.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.116 -0.493 . . . . 74.760000000000005 110.894 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' MET . . . . . 0.564 ' HE2' ' HA ' ' B' ' 86' ' ' ARG . 0.2 OUTLIER -50.71 145.74 6.55 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.252 -0.979 . . . . 84.459999999999994 108.368 171.365 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.2 1.47 13.95 Favored Glycine 0 CA--C 1.521 0.427 0 O-C-N 123.314 0.384 . . . . 76.829999999999998 113.026 -174.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -91.69 -170.16 41.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.923 -0.656 . . . . 62.649999999999999 111.762 177.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.67 138.72 52.3 Favored 'General case' 0 C--O 1.196 -1.721 0 C-N-CA 124.939 1.296 . . . . 68.209999999999994 113.208 177.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.0 p -127.66 149.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 N-CA-C 112.562 0.579 . . . . 54.969999999999999 112.562 173.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -114.67 116.26 28.43 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.665 -1.235 . . . . 67.939999999999998 107.665 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 28.3 mt -90.25 110.69 42.33 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 107.854 -1.165 . . . . 41.149999999999999 107.854 171.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -80.08 154.81 22.53 Favored 'Trans proline' 0 C--N 1.334 -0.221 0 C-N-CA 123.652 2.901 . . . . 47.490000000000002 110.789 -177.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -154.2 143.3 21.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.477 -0.489 . . . . 48.310000000000002 111.987 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 50.5 m -133.76 147.24 51.27 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 106.268 -1.753 . . . . 57.07 106.268 174.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' B' ' 76' ' ' GLU . 46.8 p90 -132.82 155.9 48.13 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 119.378 -0.929 . . . . 45.829999999999998 112.291 174.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -143.93 145.02 31.97 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.052 0.845 . . . . 71.560000000000002 109.501 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' TYR . . . . . 0.497 ' HB2' ' CE3' ' B' ' 29' ' ' TRP . 25.8 p90 -145.04 142.82 18.94 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.773 -0.649 . . . . 58.799999999999997 109.306 -175.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PRO . . . . . 0.613 ' HG3' ' CD1' ' B' ' 3' ' ' TYR . 9.4 Cg_endo -91.7 -9.24 2.83 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 120.489 0.793 . . . . 62.549999999999997 112.875 -176.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' TRP . . . . . 0.497 ' CE3' ' HB2' ' B' ' 27' ' ' TYR . 0.8 OUTLIER -84.41 155.05 22.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.06 -1.056 . . . . 61.149999999999999 110.038 179.946 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 56.7 tt0 -76.33 132.69 39.93 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 106.936 -1.505 . . . . 75.609999999999999 106.936 166.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 53.5 mt -76.13 160.01 30.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.757 0.651 . . . . 56.68 112.757 -179.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.87 173.72 7.02 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.124 -0.325 . . . . 54.780000000000001 110.124 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 23.8 mm -56.06 -58.88 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 108.558 -0.904 . . . . 68.430000000000007 108.558 173.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.48 90.86 1.09 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 108.203 -1.036 . . . . 61.549999999999997 108.203 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.05 -18.46 45.94 Favored 'Trans proline' 0 C--N 1.329 -0.477 0 C-N-CA 121.986 1.791 . . . . 55.32 112.681 -171.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 18.02 77.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 116.871 2.174 . . . . 60.640000000000001 116.871 -166.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 40.1 t -68.58 126.74 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 CA-C-N 114.563 -1.199 . . . . 40.799999999999997 111.098 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -122.58 133.94 54.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.697 -0.853 . . . . 77.030000000000001 108.697 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 4.7 mt -117.48 135.83 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.428 -0.509 . . . . 38.340000000000003 109.955 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 68.5 p -139.92 156.92 46.44 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.618 -0.433 . . . . 33.25 110.267 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -122.5 137.68 54.8 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.79 -0.641 . . . . 33.630000000000003 110.394 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' B' ' 48' ' ' GLY . 6.7 mtp180 -122.7 146.4 47.52 Favored 'General case' 0 C--O 1.186 -2.256 0 C-N-CA 125.725 1.61 . . . . 44.109999999999999 109.636 -179.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -121.92 163.89 18.51 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.15 0.796 . . . . 64.549999999999997 113.15 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.67 -76.6 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.053 -1.219 . . . . 63.670000000000002 110.053 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -143.74 170.44 15.86 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.028 0.442 . . . . 57.600000000000001 111.643 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -49.65 -48.33 49.41 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.814 -0.63 . . . . 48.369999999999997 110.915 -172.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -96.1 26.57 4.12 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.166 0.508 . . . . 56.530000000000001 111.238 -176.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLY . . . . . 0.528 ' O ' ' HG2' ' B' ' 42' ' ' ARG . . . -79.66 -174.21 46.13 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 117.344 1.698 . . . . 47.770000000000003 117.344 -174.837 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -63.8 124.43 21.47 Favored 'General case' 0 C--O 1.2 -1.516 0 CA-C-N 113.672 -1.264 . . . . 65.030000000000001 111.799 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . 0.472 ' HA ' ' HG3' ' B' ' 42' ' ' ARG . 32.4 t -73.95 136.0 43.25 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.677 -0.86 . . . . 45.240000000000002 108.677 174.137 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -122.66 -7.17 8.57 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 119.932 -0.707 . . . . 36.0 112.285 -178.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -154.23 133.15 12.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.511 0.196 . . . . 40.689999999999998 110.593 178.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 29.1 t -144.17 141.8 30.16 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.887 -0.597 . . . . 44.329999999999998 110.722 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 56.0 p -85.48 -24.02 27.54 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.455 0.539 . . . . 42.350000000000001 112.455 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ARG . . . . . 0.819 ' NH1' ' O ' ' B' ' 217' ' ' HOH . 0.0 OUTLIER -163.27 106.65 0.99 Allowed Pre-proline 0 N--CA 1.431 -1.397 0 CA-C-N 116.343 -0.389 . . . . 84.060000000000002 110.667 -172.278 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -69.08 139.58 53.44 Favored 'Cis proline' 0 C--N 1.316 -1.16 0 N-CA-C 109.186 -1.121 . . . . 53.149999999999999 109.186 1.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.43 118.75 5.53 Favored 'Trans proline' 0 C--O 1.221 -0.349 0 C-N-CA 122.378 2.052 . . . . 46.600000000000001 111.087 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 95.3 p -154.63 147.14 24.07 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 118.141 0.428 . . . . 43.630000000000003 111.961 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ILE . . . . . . . . . . . . . 11.4 tt -143.25 135.61 24.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.922 -0.581 . . . . 40.469999999999999 109.707 -178.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -69.67 140.33 53.59 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.162 0.801 . . . . 50.75 113.162 -176.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -22.24 -59.17 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.68 -1.145 . . . . 72.939999999999998 112.926 167.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -66.76 -10.26 45.34 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.452 1.278 . . . . 62.549999999999997 114.452 -169.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' TYR . . . . . 0.531 ' HB3' ' HG ' ' B' ' 67' ' ' LEU . 96.3 m-85 -116.61 -4.37 11.71 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.364 1.616 . . . . 46.270000000000003 115.364 -175.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 92.1 t -49.25 131.41 7.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 C-N-CA 119.524 -0.87 . . . . 46.32 111.478 178.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 71.06 6.99 6.05 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.219 -0.9 . . . . 43.329999999999998 112.803 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -121.1 -1.41 9.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.559 0.948 . . . . 55.960000000000001 113.559 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' B' ' 63' ' ' TYR . 11.8 mt -121.06 140.81 51.44 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 111.916 0.339 . . . . 42.670000000000002 111.916 -174.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -144.85 124.89 13.56 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.728 -0.669 . . . . 49.380000000000003 109.732 168.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 42.7 tp -96.71 113.91 25.51 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.273 -0.64 . . . . 39.549999999999997 109.273 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -85.19 99.42 11.08 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.634 -0.826 . . . . 53.799999999999997 108.924 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -173.98 130.34 0.4 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.761 -0.654 . . . . 50.090000000000003 110.515 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.1 140.57 49.34 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.255 -1.017 . . . . 72.019999999999996 108.255 168.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 57.7 tt0 -51.1 147.15 5.56 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.495 -0.928 . . . . 79.569999999999993 108.495 177.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . 101.54 -29.33 12.73 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.788 -0.925 . . . . 58.280000000000001 110.788 -173.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -89.42 163.59 15.22 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.493 -0.416 . . . . 87.010000000000005 110.193 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLU . . . . . 0.429 ' HA ' ' CE2' ' B' ' 25' ' ' PHE . 9.3 mt-10 -132.16 33.8 3.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.505 0.669 . . . . 53.43 111.446 178.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 1.2 t -159.38 149.93 19.37 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.113 -1.81 . . . . 54.520000000000003 106.113 -168.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 171.8 -162.96 35.38 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.714 -0.755 . . . . 39.75 114.375 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -156.05 155.8 33.29 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.615 0.721 . . . . 52.159999999999997 112.639 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . 0.417 HD11 HD22 ' B' ' 67' ' ' LEU . 16.5 tp -106.81 114.04 27.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.939 -1.028 . . . . 39.090000000000003 108.703 172.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -90.99 118.84 30.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.152 -0.619 . . . . 67.069999999999993 111.209 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.65 131.43 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 108.023 -1.103 . . . . 49.590000000000003 108.023 170.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 83.5 p -127.09 175.5 8.07 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.518 0.562 . . . . 53.009999999999998 112.518 -179.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 45.73 52.72 9.33 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.272 0.558 . . . . 69.150000000000006 110.257 -169.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . 0.501 ' HB3' HD12 ' B' ' 119' ' ' ILE . 57.9 mt -56.36 131.64 48.8 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.207 0.817 . . . . 56.0 113.207 -172.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ARG . . . . . 1.103 ' CD ' ' O ' ' B' ' 218' ' ' HOH . 11.5 mtp180 -102.25 176.35 5.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.887 -1.051 . . . . 72.489999999999995 108.883 174.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 tptt -79.1 -32.05 44.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 120.439 -0.504 . . . . 77.609999999999999 109.954 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' GLU . . . . . 0.754 ' HG3' HH21 ' B' ' 86' ' ' ARG . 1.8 pm0 -66.18 -14.67 62.25 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.056 -0.52 . . . . 74.0 111.356 177.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -73.28 -8.24 54.98 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.574 0.583 . . . . 55.950000000000003 112.574 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -75.36 118.0 17.78 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.771 -0.826 . . . . 60.810000000000002 108.771 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 7.6 t 176.93 -176.74 0.14 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.117 0.484 . . . . 50.789999999999999 110.437 -166.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.1 t -108.08 136.42 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.516 -0.92 . . . . 50.380000000000003 108.516 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -119.51 129.1 54.53 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 124.11 0.964 . . . . 46.770000000000003 111.566 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -119.56 130.99 55.42 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.297 0.48 . . . . 41.460000000000001 112.297 -177.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 49.1 t -94.88 125.39 39.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.958 -0.564 . . . . 37.390000000000001 110.787 174.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . 0.282 0.0 OUTLIER -120.27 138.65 53.56 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-O 123.449 1.595 . . . . 49.82 115.167 171.507 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 35.9 t -123.15 124.67 70.61 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 CA-C-N 114.046 -1.434 . . . . 34.039999999999999 107.179 -173.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -113.13 140.96 47.45 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.221 -1.029 . . . . 55.5 108.221 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 2.0 pp -152.64 155.6 37.64 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 122.188 -0.32 . . . . 43.170000000000002 111.758 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -92.29 126.86 37.55 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 124.179 0.924 . . . . 52.869999999999997 110.627 176.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 62.3 p -98.02 160.02 14.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.905 -0.589 . . . . 42.369999999999997 109.849 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ARG . . . . . 0.41 ' HE ' ' NH2' ' B' ' 103' ' ' ARG . 29.9 ttt85 -60.68 -46.47 90.24 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.793 0.664 . . . . 70.459999999999994 112.793 179.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . 0.41 ' NH2' ' HE ' ' B' ' 102' ' ' ARG . 0.0 OUTLIER -126.23 -4.16 6.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.905 1.446 . . . . 75.989999999999995 114.905 -171.426 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 67.0 m -115.48 20.75 14.55 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.73 1.011 . . . . 54.189999999999998 113.73 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.22 -159.82 14.12 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.91 -0.662 . . . . 47.130000000000003 111.862 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.15 130.88 40.64 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.044 -0.724 . . . . 77.840000000000003 109.044 -175.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' GLN . . . . . 0.676 ' OE1' ' O ' ' B' ' 202' ' ' HOH . 84.7 mm-40 -125.93 157.73 36.98 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.423 -0.584 . . . . 42.549999999999997 109.423 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.48 135.71 46.21 Favored 'General case' 0 C--O 1.198 -1.652 0 N-CA-C 113.545 0.942 . . . . 53.030000000000001 113.545 -177.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.1 mt -120.78 139.49 53.04 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.727 -0.472 . . . . 38.579999999999998 109.727 177.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -150.69 142.61 23.89 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.603 -0.439 . . . . 38.270000000000003 111.686 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 28.2 t -56.17 140.13 45.31 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 106.508 -1.664 . . . . 45.799999999999997 106.508 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' ILE . . . . . . . . . . . . . 28.7 mm -74.83 -51.23 22.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 120.148 -0.621 . . . . 46.32 111.327 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -106.1 -12.37 15.79 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 119.548 -0.861 . . . . 71.670000000000002 112.666 -175.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . 65.07 -155.25 49.12 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 115.673 1.029 . . . . 43.189999999999998 115.673 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' THR . . . . . . . . . . . . . 54.1 m -125.82 109.37 12.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.948 -0.626 . . . . 49.200000000000003 110.637 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -73.99 127.66 33.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.849 -0.796 . . . . 67.629999999999995 108.849 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 56.0 tp -115.65 124.14 50.15 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 120.782 0.325 . . . . 52.270000000000003 110.778 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 31.0 p -109.8 121.86 46.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.305 -0.558 . . . . 67.150000000000006 109.495 175.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ILE . . . . . 0.501 HD12 ' HB3' ' B' ' 85' ' ' LEU . 8.6 mm -95.45 129.88 44.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.253 0.549 . . . . 66.269999999999996 112.012 -179.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.749 -0.659 . . . . 117.86 111.638 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.954 ' O ' ' O ' ' A' ' 6' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . 0.538 ' O ' ' NE2' ' A' ' 107' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . 0.879 ' O ' ' NZ ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . 1.128 ' O ' ' ND2' ' A' ' 84' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . 0.891 ' O ' ' O ' ' A' ' 61' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . 0.401 ' O ' ' HB3' ' A' ' 26' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . 0.587 ' O ' ' NE2' ' A' ' 49' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . 0.434 ' O ' ' HD2' ' B' ' 42' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . 0.676 ' O ' ' OE1' ' B' ' 107' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 216' ' ' HOH . . . . . 0.871 ' O ' ' HD2' ' B' ' 86' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 217' ' ' HOH . . . . . 0.819 ' O ' ' NH1' ' B' ' 55' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 218' ' ' HOH . . . . . 1.103 ' O ' ' CD ' ' B' ' 86' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . 0.612 ' O ' ' N ' ' A' ' 3' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.202 -1.395 0 CA-C-O 118.745 -0.645 . . . . 92.84 110.554 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 2' ' ' LEU 0.344 0.8 OUTLIER -58.84 30.19 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 119.511 3.152 . . . . 99.2 119.511 -169.487 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.612 ' N ' ' O ' ' A' ' 1' ' ' MET . 69.8 m-85 -90.35 144.82 25.46 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 106.758 -1.571 . . . . 75.7 106.758 152.427 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.38 -150.48 20.74 Favored Glycine 0 C--N 1.312 -0.799 0 N-CA-C 110.992 -0.843 . . . . 54.72 110.992 -178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -116.99 131.78 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 N-CA-C 109.24 -0.652 . . . . 43.92 109.24 -179.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . 0.954 ' O ' ' O ' ' A' ' 203' ' ' HOH . 93.5 m -105.35 126.15 51.78 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.879 0.696 . . . . 51.41 112.879 177.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -135.85 145.65 53.71 Favored Pre-proline 0 C--O 1.235 0.32 0 CA-C-N 115.707 -0.678 . . . . 52.36 110.662 176.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 99.9 Cg_exo -54.33 141.83 70.47 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.391 2.061 . . . . 65.87 110.284 169.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.879 ' NZ ' ' O ' ' A' ' 210' ' ' HOH . 4.4 tppp? -73.75 -30.03 62.56 Favored 'General case' 0 C--O 1.2 -1.52 0 N-CA-C 113.375 0.879 . . . . 76.46 113.375 -178.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.485 ' O ' HD23 ' A' ' 11' ' ' LEU . 86.2 m-70 -141.27 146.47 36.83 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.866 0.691 . . . . 81.17 112.866 -175.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 10' ' ' HIS . 67.9 mt -144.85 153.06 41.2 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 112.064 0.394 . . . . 56.55 112.064 169.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 30.6 m -129.25 139.36 51.86 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.063 -0.517 . . . . 81.61 111.762 176.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -147.48 152.95 38.9 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.959 -0.296 . . . . 62.8 111.508 178.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 138.38 35.48 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.903 -0.319 . . . . 75.35 110.742 -179.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' MET . . . . . 0.557 ' HE3' ' N ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -49.36 142.48 7.55 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 107.945 -1.131 . . . . 92.18 107.945 171.55 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.99 -12.12 4.16 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 114.153 0.421 . . . . 70.6 114.153 -173.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -81.69 -169.37 42.5 Favored Glycine 0 N--CA 1.451 -0.335 0 N-CA-C 111.273 -0.731 . . . . 66.18 111.273 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.7 m -129.5 145.81 51.4 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 122.615 0.366 . . . . 69.86 110.523 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -133.05 148.03 31.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 121.495 0.664 . . . . 58.95 112.721 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -112.87 120.54 41.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.683 -1.229 . . . . 64.29 107.683 175.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 50.6 mt -95.01 110.85 52.22 Favored Pre-proline 0 C--N 1.328 -0.335 0 N-CA-C 108.683 -0.858 . . . . 42.13 108.683 171.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -80.18 153.04 21.47 Favored 'Trans proline' 0 C--N 1.332 -0.302 0 C-N-CA 124.076 3.184 . . . . 48.88 111.323 -176.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -151.3 150.58 30.7 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.513 -0.475 . . . . 47.46 111.475 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 68.0 m -137.99 147.6 44.38 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 105.968 -1.864 . . . . 59.12 105.968 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 76' ' ' GLU . 53.9 p90 -133.28 155.37 49.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 119.149 -1.02 . . . . 44.35 112.794 173.392 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.401 ' HB3' ' O ' ' A' ' 216' ' ' HOH . 0.3 OUTLIER -145.39 144.93 30.95 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.089 -0.708 . . . . 69.26 109.089 176.369 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.493 ' HB2' ' CE3' ' A' ' 29' ' ' TRP . 21.1 p90 -139.52 145.01 41.88 Favored Pre-proline 0 N--CA 1.446 -0.649 0 N-CA-C 108.002 -1.11 . . . . 60.82 108.002 -175.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.484 ' HG3' ' CG ' ' A' ' 3' ' ' TYR . 6.0 Cg_endo -91.45 -11.26 2.43 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 121.893 1.729 . . . . 62.16 112.809 -177.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CE3' ' HB2' ' A' ' 27' ' ' TYR . 1.8 m-90 -82.45 157.3 23.69 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 119.93 -0.708 . . . . 59.75 110.816 -178.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -78.61 132.87 37.27 Favored 'General case' 0 N--CA 1.423 -1.804 0 N-CA-C 105.308 -2.108 . . . . 70.91 105.308 167.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.468 HD22 HD13 ' A' ' 99' ' ' LEU . 49.7 mt -78.62 154.62 30.11 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 113.088 0.773 . . . . 50.87 113.088 178.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.61 167.72 10.53 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.381 -0.372 . . . . 57.81 110.503 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.607 ' O ' ' HD3' ' A' ' 35' ' ' PRO . 19.9 mm -53.54 -56.62 7.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 N-CA-C 108.955 -0.757 . . . . 71.89 108.955 174.489 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 96.5 t -96.19 89.49 0.59 Allowed Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 108.609 -0.886 . . . . 63.84 108.609 174.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.607 ' HD3' ' O ' ' A' ' 33' ' ' ILE . 6.6 Cg_exo -65.11 -22.89 61.2 Favored 'Trans proline' 0 C--N 1.328 -0.522 0 C-N-CA 122.009 1.806 . . . . 54.48 114.013 -173.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.507 ' HB2' ' NH1' ' A' ' 55' ' ' ARG . 28.8 p-10 15.68 74.41 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 116.804 2.15 . . . . 58.76 116.804 -163.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 92.4 t -67.26 127.07 28.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.821 0 CA-C-N 115.018 -0.992 . . . . 42.3 110.228 173.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.632 ' HG2' ' HD2' ' A' ' 55' ' ' ARG . 82.2 mtt180 -119.13 138.64 52.77 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.754 -0.832 . . . . 66.83 108.754 176.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 2.4 mt -121.16 133.36 68.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 C-N-CA 120.695 -0.402 . . . . 41.81 111.78 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 87.5 p -137.88 157.98 45.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.119 0.485 . . . . 33.65 110.985 172.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -121.9 131.7 54.17 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.307 -0.86 . . . . 35.2 110.257 -178.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.643 ' HG2' ' O ' ' A' ' 48' ' ' GLY . 7.3 mtp180 -118.47 151.33 38.02 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 123.755 0.822 . . . . 41.51 109.226 178.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -126.63 165.88 18.37 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 113.297 0.851 . . . . 66.89 113.297 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 90.49 -62.34 3.1 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.481 -0.866 . . . . 56.65 111.295 175.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -154.33 166.2 33.95 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 120.987 0.422 . . . . 52.37 111.811 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -49.97 -45.67 51.75 Favored 'General case' 0 C--O 1.191 -2.019 0 O-C-N 121.841 -0.537 . . . . 48.01 110.747 -172.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 77.6 m80 -96.3 29.42 2.86 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.934 0.397 . . . . 51.13 111.098 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.643 ' O ' ' HG2' ' A' ' 42' ' ' ARG . . . -83.57 -176.15 51.23 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 117.441 1.736 . . . . 41.79 117.441 -174.885 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -61.74 118.93 7.79 Favored 'General case' 0 C--O 1.194 -1.821 0 C-N-CA 125.728 1.611 . . . . 69.93 113.155 -177.432 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . 0.544 ' HA ' ' HG3' ' A' ' 42' ' ' ARG . 33.9 t -71.2 135.94 47.79 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.983 -0.687 . . . . 47.9 109.634 175.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -124.48 -5.33 7.68 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.281 -0.567 . . . . 33.97 112.208 -177.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -154.99 132.83 11.46 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 122.328 -0.233 . . . . 40.58 110.887 176.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 37.5 t -142.51 138.88 31.24 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 116.0 -0.545 . . . . 39.87 111.06 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 45.7 p -83.91 -23.33 31.23 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 112.783 0.66 . . . . 43.9 112.783 179.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.632 ' HD2' ' HG2' ' A' ' 38' ' ' ARG . 7.7 ttm180 -163.87 105.83 0.92 Allowed Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 112.032 0.382 . . . . 72.72 112.032 -171.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.426 ' HA ' ' HD3' ' A' ' 57' ' ' PRO . 57.8 Cg_endo -68.51 140.93 59.3 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 125.552 -0.603 . . . . 57.45 111.249 -1.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 56' ' ' PRO . 46.7 Cg_exo -56.6 118.48 5.32 Favored 'Trans proline' 0 N--CA 1.463 -0.293 0 C-N-CA 123.285 2.657 . . . . 45.68 111.742 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 56.7 p -152.38 144.24 23.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.207 0.527 . . . . 45.76 112.028 174.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 15.6 tt -138.73 133.67 42.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.599 0 CA-C-N 115.322 -0.854 . . . . 41.9 110.178 178.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 55.2 t-80 -66.7 138.75 57.64 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.624 0.726 . . . . 50.32 112.752 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.891 ' O ' ' O ' ' A' ' 214' ' ' HOH . 29.0 tttm -25.47 -53.28 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 125.099 1.359 . . . . 66.78 112.932 169.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -67.38 -15.64 63.8 Favored 'General case' 0 C--O 1.24 0.567 0 N-CA-C 114.361 1.245 . . . . 59.91 114.361 -170.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.532 ' HB3' ' HG ' ' A' ' 67' ' ' LEU . 94.8 m-85 -113.7 -0.68 14.2 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 115.218 1.562 . . . . 48.2 115.218 -174.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 92.4 t -53.06 132.09 15.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 119.75 -0.78 . . . . 43.52 111.839 180.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 70.2 7.46 6.23 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.655 -0.702 . . . . 43.04 112.057 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 31.9 mtm105 -121.6 0.59 9.93 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.038 1.125 . . . . 55.09 114.038 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.532 ' HG ' ' HB3' ' A' ' 63' ' ' TYR . 9.3 mt -124.64 140.59 52.79 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.587 0.232 . . . . 43.46 111.323 -172.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.6 t80 -144.39 124.8 13.88 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.807 -0.633 . . . . 50.26 110.146 169.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 28.4 tp -99.62 109.63 22.11 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.59 -0.522 . . . . 38.2 109.59 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -85.07 98.66 10.55 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.738 -0.838 . . . . 54.54 108.738 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 87.2 t90 -174.21 133.18 0.4 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.615 -0.72 . . . . 50.94 110.305 -177.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.7 136.8 54.93 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.252 -1.018 . . . . 78.68 108.252 172.394 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 57.5 tt0 -46.72 145.13 2.03 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 107.879 -1.156 . . . . 84.93 107.879 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 101.43 -32.41 7.52 Favored Glycine 0 CA--C 1.521 0.408 0 N-CA-C 111.83 -0.508 . . . . 60.14 111.83 -173.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -86.94 163.85 16.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.297 -0.631 . . . . 87.22 109.297 174.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.444 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 8.0 mt-10 -131.18 30.89 4.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.724 0.773 . . . . 60.84 110.666 178.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.31 154.52 33.51 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 107.305 -1.369 . . . . 56.26 107.305 -172.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 169.27 -163.11 36.79 Favored Glycine 0 CA--C 1.52 0.404 0 C-N-CA 120.693 -0.765 . . . . 43.22 114.077 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -155.63 157.48 36.79 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 119.784 -0.766 . . . . 55.2 112.213 173.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.421 HD11 HD22 ' A' ' 67' ' ' LEU . 23.0 tp -108.94 117.74 34.98 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 114.904 -1.044 . . . . 38.65 108.789 173.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 68.3 ttt-85 -94.91 115.58 27.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.927 -0.579 . . . . 75.14 111.376 178.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.7 mt -106.19 126.27 61.78 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.169 -1.049 . . . . 52.61 108.169 172.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 82.7 p -126.48 171.73 10.8 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 121.086 -0.245 . . . . 55.05 111.248 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.992 ' OD1' ' O ' ' A' ' 213' ' ' HOH . 21.0 m120 57.58 43.92 21.77 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 123.501 0.501 . . . . 69.38 109.966 -174.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.72 129.42 41.08 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 114.057 1.132 . . . . 59.42 114.057 -171.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.916 ' HB3' ' OE1' ' A' ' 88' ' ' GLU . 12.0 mtp180 -95.8 -178.29 4.32 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.815 -1.084 . . . . 70.64 108.251 172.325 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.625 ' HG3' ' N ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -80.25 -38.84 30.15 Favored 'General case' 0 C--O 1.196 -1.724 0 N-CA-C 109.198 -0.667 . . . . 86.33 109.198 177.831 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.916 ' OE1' ' HB3' ' A' ' 86' ' ' ARG . 1.4 pm0 -64.93 -14.37 59.73 Favored 'General case' 0 C--O 1.206 -1.233 0 C-N-CA 119.576 -0.849 . . . . 79.79 112.179 179.847 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -66.05 -12.0 52.25 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 114.035 1.124 . . . . 53.03 114.035 175.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.803 HE21 ' H ' ' A' ' 119' ' ' ILE . 19.9 tt0 -75.78 119.79 20.26 Favored 'General case' 0 CA--C 1.517 -0.303 0 N-CA-C 109.948 -0.39 . . . . 60.12 109.948 -179.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 7.3 t 177.61 -175.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 49.71 110.428 -166.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 6.2 t -109.81 133.89 53.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.036 -0.727 . . . . 49.14 109.036 175.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -118.04 127.94 54.29 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.814 0.696 . . . . 48.79 111.473 -172.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -118.66 133.78 55.6 Favored 'General case' 0 C--O 1.238 0.479 0 O-C-N 123.422 0.451 . . . . 39.43 111.971 -177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 52.3 t -98.85 126.11 44.42 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.598 -0.728 . . . . 37.6 110.921 174.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.427 HH12 HE21 ' B' ' 108' ' ' GLN . 0.0 OUTLIER -121.63 133.37 54.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.971 0.891 . . . . 50.41 110.981 177.316 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 39.2 t -119.25 127.49 75.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 107.36 -1.348 . . . . 35.01 107.36 -175.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -116.12 137.29 52.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.568 -0.901 . . . . 59.88 108.568 179.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.468 HD13 HD22 ' A' ' 31' ' ' LEU . 1.2 pp -149.11 155.37 40.61 Favored 'General case' 0 CA--C 1.509 -0.61 0 O-C-N 121.991 -0.443 . . . . 45.22 111.831 -178.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 49.4 m-20 -92.14 126.13 37.1 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 124.171 0.92 . . . . 53.68 110.25 174.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 27.3 p -98.6 163.05 12.82 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.645 -0.707 . . . . 43.73 110.187 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ARG . . . . . 0.533 ' HE ' ' NH2' ' A' ' 103' ' ' ARG . 40.5 ttt85 -63.54 -46.49 85.75 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.357 -0.537 . . . . 72.09 112.035 -178.619 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.533 ' NH2' ' HE ' ' A' ' 102' ' ' ARG . 0.0 OUTLIER -122.31 -8.02 8.7 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 114.908 1.448 . . . . 75.49 114.908 -169.983 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 50.9 m -114.15 16.15 18.12 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 113.573 0.953 . . . . 57.18 113.573 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 60.77 -158.73 28.27 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 110.198 -1.161 . . . . 45.83 110.198 -179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.75 129.25 37.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.658 -0.497 . . . . 74.78 109.658 -173.488 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 204' ' ' HOH . 21.5 mm100 -124.62 156.6 37.2 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 123.549 0.53 . . . . 40.44 110.993 -178.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.37 139.19 46.66 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.595 0.961 . . . . 53.32 113.595 -179.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.5 mt -124.3 136.88 54.45 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.137 -1.06 . . . . 40.84 108.137 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -147.48 142.91 27.45 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.352 -0.539 . . . . 40.22 111.307 178.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.0 t -57.66 139.48 53.61 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 106.214 -1.773 . . . . 45.52 106.214 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -73.66 -54.68 14.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.312 0.577 . . . . 45.96 111.785 178.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 18.2 mtpt -103.24 -12.22 17.45 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 119.313 -0.955 . . . . 64.63 112.857 -172.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 70.63 -163.09 53.49 Favored Glycine 0 N--CA 1.447 -0.59 0 CA-C-O 121.591 0.551 . . . . 44.13 113.924 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 18.0 m -119.79 116.55 26.12 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.549 -0.538 . . . . 48.93 109.549 -179.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 20.4 tptp -78.55 126.84 31.31 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.573 -0.529 . . . . 66.85 109.573 177.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' A' ' 90' ' ' GLN . 51.5 tp -115.02 119.42 36.4 Favored 'General case' 0 CA--C 1.511 -0.539 0 C-N-CA 120.506 -0.478 . . . . 50.67 110.951 -179.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 18.8 p -105.04 128.08 53.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.971 -0.752 . . . . 66.62 108.971 175.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.803 ' H ' HE21 ' A' ' 90' ' ' GLN . 22.6 mm -99.86 127.78 52.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.201 0.524 . . . . 61.29 111.711 -179.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.55 -0.75 . . . . 102.37 111.982 176.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.0 mmt . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 121.121 0.486 . . . . 132.23 109.956 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' B' ' 2' ' ' LEU . 0.3 OUTLIER 45.72 58.87 3.99 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 127.462 2.305 . . . . 101.86 112.978 -172.053 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' TYR . . . . . 0.613 ' CD1' ' HG3' ' B' ' 28' ' ' PRO . 65.9 m-85 -91.62 154.22 19.19 Favored 'General case' 0 N--CA 1.401 -2.899 0 N-CA-C 105.395 -2.076 . . . . 73.58 105.395 159.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.4 -144.82 15.36 Favored Glycine 0 C--N 1.304 -1.218 0 C-N-CA 119.447 -1.358 . . . . 52.01 111.539 178.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 93.5 t -120.0 132.06 70.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.629 0.252 . . . . 43.9 110.773 -173.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 43.0 m -110.38 124.33 51.51 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 113.024 0.75 . . . . 55.03 113.024 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -135.49 142.86 42.79 Favored Pre-proline 0 C--O 1.237 0.415 0 C-N-CA 124.6 1.16 . . . . 51.76 109.049 176.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -48.53 148.34 8.22 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.196 2.597 . . . . 58.09 110.943 168.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -35.92 61.36 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.696 0.628 . . . . 70.91 112.696 -179.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HIS . . . . . 0.555 ' O ' HD23 ' B' ' 11' ' ' LEU . 92.5 m-70 -138.94 150.75 46.26 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.543 0.571 . . . . 77.74 112.543 -172.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.555 HD23 ' O ' ' B' ' 10' ' ' HIS . 86.0 mt -150.05 156.09 41.04 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.625 -0.261 . . . . 56.31 110.991 170.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -131.65 147.13 52.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.204 -0.453 . . . . 73.48 110.827 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -158.48 150.27 21.3 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.974 0.416 . . . . 64.19 111.914 179.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.24 141.63 36.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.116 -0.493 . . . . 74.76 110.894 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' MET . . . . . 0.564 ' HE2' ' HA ' ' B' ' 86' ' ' ARG . 0.2 OUTLIER -50.71 145.74 6.55 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.252 -0.979 . . . . 84.46 108.368 171.365 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 67.2 1.47 13.95 Favored Glycine 0 CA--C 1.521 0.427 0 O-C-N 123.314 0.384 . . . . 76.83 113.026 -174.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -91.69 -170.16 41.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.923 -0.656 . . . . 62.65 111.762 177.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -128.67 138.72 52.3 Favored 'General case' 0 C--O 1.196 -1.721 0 C-N-CA 124.939 1.296 . . . . 68.21 113.208 177.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.0 p -127.66 149.17 32.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 N-CA-C 112.562 0.579 . . . . 54.97 112.562 173.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -114.67 116.26 28.43 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.665 -1.235 . . . . 67.94 107.665 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 28.3 mt -90.25 110.69 42.33 Favored Pre-proline 0 C--N 1.329 -0.321 0 N-CA-C 107.854 -1.165 . . . . 41.15 107.854 171.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -80.08 154.81 22.53 Favored 'Trans proline' 0 C--N 1.334 -0.221 0 C-N-CA 123.652 2.901 . . . . 47.49 110.789 -177.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -154.2 143.3 21.21 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.477 -0.489 . . . . 48.31 111.987 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 50.5 m -133.76 147.24 51.27 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 106.268 -1.753 . . . . 57.07 106.268 174.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . 0.429 ' CE2' ' HA ' ' B' ' 76' ' ' GLU . 46.8 p90 -132.82 155.9 48.13 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 119.378 -0.929 . . . . 45.83 112.291 174.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -143.93 145.02 31.97 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 124.052 0.845 . . . . 71.56 109.501 -179.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' TYR . . . . . 0.497 ' HB2' ' CE3' ' B' ' 29' ' ' TRP . 25.8 p90 -145.04 142.82 18.94 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.773 -0.649 . . . . 58.8 109.306 -175.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.613 ' HG3' ' CD1' ' B' ' 3' ' ' TYR . 9.4 Cg_endo -91.7 -9.24 2.83 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 120.489 0.793 . . . . 62.55 112.875 -176.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' TRP . . . . . 0.497 ' CE3' ' HB2' ' B' ' 27' ' ' TYR . 0.8 OUTLIER -84.41 155.05 22.44 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 119.06 -1.056 . . . . 61.15 110.038 179.946 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 56.7 tt0 -76.33 132.69 39.93 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 106.936 -1.505 . . . . 75.61 106.936 166.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 53.5 mt -76.13 160.01 30.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.757 0.651 . . . . 56.68 112.757 -179.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.87 173.72 7.02 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.124 -0.325 . . . . 54.78 110.124 179.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ILE . . . . . . . . . . . . . 23.8 mm -56.06 -58.88 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 108.558 -0.904 . . . . 68.43 108.558 173.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 60.0 t -98.48 90.86 1.09 Allowed Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 108.203 -1.036 . . . . 61.55 108.203 173.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -68.05 -18.46 45.94 Favored 'Trans proline' 0 C--N 1.329 -0.477 0 C-N-CA 121.986 1.791 . . . . 55.32 112.681 -171.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 30.9 p-10 18.02 77.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 116.871 2.174 . . . . 60.64 116.871 -166.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 40.1 t -68.58 126.74 29.11 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.016 0 CA-C-N 114.563 -1.199 . . . . 40.8 111.098 172.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ARG . . . . . . . . . . . . . 38.2 mtt180 -122.58 133.94 54.54 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.697 -0.853 . . . . 77.03 108.697 177.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 4.7 mt -117.48 135.83 56.6 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.428 -0.509 . . . . 38.34 109.955 179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 68.5 p -139.92 156.92 46.44 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.618 -0.433 . . . . 33.25 110.267 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -122.5 137.68 54.8 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.79 -0.641 . . . . 33.63 110.394 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.528 ' HG2' ' O ' ' B' ' 48' ' ' GLY . 6.7 mtp180 -122.7 146.4 47.52 Favored 'General case' 0 C--O 1.186 -2.256 0 C-N-CA 125.725 1.61 . . . . 44.11 109.636 -179.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -121.92 163.89 18.51 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 113.15 0.796 . . . . 64.55 113.15 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.67 -76.6 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 110.053 -1.219 . . . . 63.67 110.053 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' HIS . . . . . . . . . . . . . 6.1 p80 -143.74 170.44 15.86 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 121.028 0.442 . . . . 57.6 111.643 -178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -49.65 -48.33 49.41 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 115.814 -0.63 . . . . 48.37 110.915 -172.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -96.1 26.57 4.12 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.166 0.508 . . . . 56.53 111.238 -176.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLY . . . . . 0.528 ' O ' ' HG2' ' B' ' 42' ' ' ARG . . . -79.66 -174.21 46.13 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 117.344 1.698 . . . . 47.77 117.344 -174.837 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -63.8 124.43 21.47 Favored 'General case' 0 C--O 1.2 -1.516 0 CA-C-N 113.672 -1.264 . . . . 65.03 111.799 -178.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . 0.472 ' HA ' ' HG3' ' B' ' 42' ' ' ARG . 32.4 t -73.95 136.0 43.25 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.677 -0.86 . . . . 45.24 108.677 174.137 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -122.66 -7.17 8.57 Favored 'General case' 0 C--O 1.213 -0.848 0 C-N-CA 119.932 -0.707 . . . . 36.0 112.285 -178.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -154.23 133.15 12.36 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.511 0.196 . . . . 40.69 110.593 178.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 29.1 t -144.17 141.8 30.16 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-N 115.887 -0.597 . . . . 44.33 110.722 -177.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 56.0 p -85.48 -24.02 27.54 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.455 0.539 . . . . 42.35 112.455 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.819 ' NH1' ' O ' ' B' ' 217' ' ' HOH . 0.0 OUTLIER -163.27 106.65 0.99 Allowed Pre-proline 0 N--CA 1.431 -1.397 0 CA-C-N 116.343 -0.389 . . . . 84.06 110.667 -172.278 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -69.08 139.58 53.44 Favored 'Cis proline' 0 C--N 1.316 -1.16 0 N-CA-C 109.186 -1.121 . . . . 53.15 109.186 1.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -55.43 118.75 5.53 Favored 'Trans proline' 0 C--O 1.221 -0.349 0 C-N-CA 122.378 2.052 . . . . 46.6 111.087 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' SER . . . . . . . . . . . . . 95.3 p -154.63 147.14 24.07 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 118.141 0.428 . . . . 43.63 111.961 175.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ILE . . . . . . . . . . . . . 11.4 tt -143.25 135.61 24.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.922 -0.581 . . . . 40.47 109.707 -178.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' HIS . . . . . . . . . . . . . 59.8 t-80 -69.67 140.33 53.59 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.162 0.801 . . . . 50.75 113.162 -176.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.1 tttm -22.24 -59.17 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.68 -1.145 . . . . 72.94 112.926 167.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -66.76 -10.26 45.34 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 114.452 1.278 . . . . 62.55 114.452 -169.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' TYR . . . . . 0.531 ' HB3' ' HG ' ' B' ' 67' ' ' LEU . 96.3 m-85 -116.61 -4.37 11.71 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 115.364 1.616 . . . . 46.27 115.364 -175.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 92.1 t -49.25 131.41 7.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 C-N-CA 119.524 -0.87 . . . . 46.32 111.478 178.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 71.06 6.99 6.05 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.219 -0.9 . . . . 43.33 112.803 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 38.0 mtm105 -121.1 -1.41 9.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 113.559 0.948 . . . . 55.96 113.559 -179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.531 ' HG ' ' HB3' ' B' ' 63' ' ' TYR . 11.8 mt -121.06 140.81 51.44 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 111.916 0.339 . . . . 42.67 111.916 -174.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -144.85 124.89 13.56 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.728 -0.669 . . . . 49.38 109.732 168.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 42.7 tp -96.71 113.91 25.51 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.273 -0.64 . . . . 39.55 109.273 175.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -85.19 99.42 11.08 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.634 -0.826 . . . . 53.8 108.924 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -173.98 130.34 0.4 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.761 -0.654 . . . . 50.09 110.515 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.1 140.57 49.34 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.255 -1.017 . . . . 72.02 108.255 168.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 57.7 tt0 -51.1 147.15 5.56 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.495 -0.928 . . . . 79.57 108.495 177.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . 101.54 -29.33 12.73 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.788 -0.925 . . . . 58.28 110.788 -173.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -89.42 163.59 15.22 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.493 -0.416 . . . . 87.01 110.193 174.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLU . . . . . 0.429 ' HA ' ' CE2' ' B' ' 25' ' ' PHE . 9.3 mt-10 -132.16 33.8 3.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.505 0.669 . . . . 53.43 111.446 178.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 1.2 t -159.38 149.93 19.37 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 106.113 -1.81 . . . . 54.52 106.113 -168.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 171.8 -162.96 35.38 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.714 -0.755 . . . . 39.75 114.375 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -156.05 155.8 33.29 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.615 0.721 . . . . 52.16 112.639 172.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.417 HD11 HD22 ' B' ' 67' ' ' LEU . 16.5 tp -106.81 114.04 27.89 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 114.939 -1.028 . . . . 39.09 108.703 172.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -90.99 118.84 30.69 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.152 -0.619 . . . . 67.07 111.209 175.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ILE . . . . . . . . . . . . . 22.2 mt -102.65 131.43 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 N-CA-C 108.023 -1.103 . . . . 49.59 108.023 170.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' SER . . . . . . . . . . . . . 83.5 p -127.09 175.5 8.07 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.518 0.562 . . . . 53.01 112.518 -179.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 45.73 52.72 9.33 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 121.272 0.558 . . . . 69.15 110.257 -169.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.501 ' HB3' HD12 ' B' ' 119' ' ' ILE . 57.9 mt -56.36 131.64 48.8 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 113.207 0.817 . . . . 56.0 113.207 -172.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ARG . . . . . 1.103 ' CD ' ' O ' ' B' ' 218' ' ' HOH . 11.5 mtp180 -102.25 176.35 5.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.887 -1.051 . . . . 72.49 108.883 174.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' LYS . . . . . . . . . . . . . 29.0 tptt -79.1 -32.05 44.5 Favored 'General case' 0 CA--C 1.515 -0.375 0 C-N-CA 120.439 -0.504 . . . . 77.61 109.954 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' GLU . . . . . 0.754 ' HG3' HH21 ' B' ' 86' ' ' ARG . 1.8 pm0 -66.18 -14.67 62.25 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 116.056 -0.52 . . . . 74.0 111.356 177.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -73.28 -8.24 54.98 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.574 0.583 . . . . 55.95 112.574 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLN . . . . . 0.569 HE21 ' H ' ' B' ' 119' ' ' ILE . 9.7 tt0 -75.36 118.0 17.78 Favored 'General case' 0 CA--C 1.511 -0.53 0 N-CA-C 108.771 -0.826 . . . . 60.81 108.771 178.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 7.6 t 176.93 -176.74 0.14 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.117 0.484 . . . . 50.79 110.437 -166.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 3.1 t -108.08 136.42 43.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 108.516 -0.92 . . . . 50.38 108.516 174.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -119.51 129.1 54.53 Favored 'General case' 0 CA--C 1.515 -0.39 0 C-N-CA 124.11 0.964 . . . . 46.77 111.566 -174.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -119.56 130.99 55.42 Favored 'General case' 0 C--O 1.237 0.43 0 N-CA-C 112.297 0.48 . . . . 41.46 112.297 -177.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 49.1 t -94.88 125.39 39.51 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.958 -0.564 . . . . 37.39 110.787 174.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . 0.282 0.0 OUTLIER -120.27 138.65 53.56 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-O 123.449 1.595 . . . . 49.82 115.167 171.507 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 35.9 t -123.15 124.67 70.61 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 CA-C-N 114.046 -1.434 . . . . 34.04 107.179 -173.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -113.13 140.96 47.45 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.221 -1.029 . . . . 55.5 108.221 178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' LEU . . . . . . . . . . . . . 2.0 pp -152.64 155.6 37.64 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 122.188 -0.32 . . . . 43.17 111.758 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -92.29 126.86 37.55 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 124.179 0.924 . . . . 52.87 110.627 176.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 62.3 p -98.02 160.02 14.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.905 -0.589 . . . . 42.37 109.849 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ARG . . . . . 0.41 ' HE ' ' NH2' ' B' ' 103' ' ' ARG . 29.9 ttt85 -60.68 -46.47 90.24 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.793 0.664 . . . . 70.46 112.793 179.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.41 ' NH2' ' HE ' ' B' ' 102' ' ' ARG . 0.0 OUTLIER -126.23 -4.16 6.8 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.905 1.446 . . . . 75.99 114.905 -171.426 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 67.0 m -115.48 20.75 14.55 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.73 1.011 . . . . 54.19 113.73 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . 58.22 -159.82 14.12 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.91 -0.662 . . . . 47.13 111.862 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.15 130.88 40.64 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.044 -0.724 . . . . 77.84 109.044 -175.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' GLN . . . . . 0.825 ' NE2' ' O ' ' B' ' 202' ' ' HOH . 17.0 mm100 -125.93 157.73 36.98 Favored 'General case' 0 CA--C 1.514 -0.429 0 N-CA-C 109.423 -0.584 . . . . 42.55 109.423 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' GLN . . . . . 0.427 HE21 HH12 ' A' ' 96' ' ' ARG . 0.7 OUTLIER -132.48 135.71 46.21 Favored 'General case' 0 C--O 1.198 -1.652 0 N-CA-C 113.545 0.942 . . . . 53.03 113.545 -177.536 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' LEU . . . . . . . . . . . . . 3.1 mt -120.78 139.49 53.04 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.727 -0.472 . . . . 38.58 109.727 177.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 -150.69 142.61 23.89 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 120.603 -0.439 . . . . 38.27 111.686 179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' SER . . . . . . . . . . . . . 28.2 t -56.17 140.13 45.31 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 106.508 -1.664 . . . . 45.8 106.508 177.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' ILE . . . . . . . . . . . . . 28.7 mm -74.83 -51.23 22.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 C-N-CA 120.148 -0.621 . . . . 46.32 111.327 178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LYS . . . . . . . . . . . . . 13.9 mtpt -106.1 -12.37 15.79 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 119.548 -0.861 . . . . 71.67 112.666 -175.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . 65.07 -155.25 49.12 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 115.673 1.029 . . . . 43.19 115.673 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' THR . . . . . . . . . . . . . 54.1 m -125.82 109.37 12.45 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.948 -0.626 . . . . 49.2 110.637 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 20.1 tptp -73.99 127.66 33.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.849 -0.796 . . . . 67.63 108.849 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 56.0 tp -115.65 124.14 50.15 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 120.782 0.325 . . . . 52.27 110.778 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' THR . . . . . 0.415 ' HA ' HE21 ' B' ' 90' ' ' GLN . 31.0 p -109.8 121.86 46.19 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.305 -0.558 . . . . 67.15 109.495 175.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ILE . . . . . 0.569 ' H ' HE21 ' B' ' 90' ' ' GLN . 8.6 mm -95.45 129.88 44.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.253 0.549 . . . . 66.27 112.012 -179.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-N 115.749 -0.659 . . . . 117.86 111.638 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.954 ' O ' ' O ' ' A' ' 6' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . 0.538 ' O ' ' NE2' ' A' ' 107' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . 0.879 ' O ' ' NZ ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . 0.992 ' O ' ' OD1' ' A' ' 84' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . 0.891 ' O ' ' O ' ' A' ' 61' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . 0.401 ' O ' ' HB3' ' A' ' 26' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . 0.434 ' O ' ' HD2' ' B' ' 42' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . 0.825 ' O ' ' NE2' ' B' ' 107' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' HOH . . . . . 0.871 ' O ' ' HD2' ' B' ' 86' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' HOH . . . . . 0.819 ' O ' ' NH1' ' B' ' 55' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 218' ' ' HOH . . . . . 1.103 ' O ' ' CD ' ' B' ' 86' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_